A0A077ZD76_TRITR Loading...

Calcium homeostasis endoplasmic reticulum protein

AlphaFold DB , UniProt , Accession A0A077ZD76, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 420 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	49.3	Very low	60.2	Low	220 Å²	220	111.5 Å²	111.5	100%	1.084	63%	0.632	S	S	*	*				0	-8.5	0	-75.2	-179.7	130.6	0	0	114.6	N3	M1-N3 PolarHBondContact O-N 2.7Å
2	S	55.2	Low	62	Low	93 Å²	93	108.1 Å²	108.1	65%	0.65	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-33.1	-178.3	44	0	0	0	0	115.5	Q4 A5	S2-Q4 VanDerWaalsContact C-N 3.3Å; S2-Q4 PolarHBondContact O-N 3.35Å; S2-A5 PolarHBondContact O-N 3.05Å
3	N	50.5	Low	63.5	Low	143 Å²	143	102.8 Å²	102.8	77%	0.765	59%	0.589	S	S	*	*	H	α-helix	trans	-67.3	-23.6	-169.8	-64.7	2.4	0	0	0	114.6	M1	M1-N3 PolarHBondContact O-N 2.7Å
4	Q	49	Very low	64.6	Low	156 Å²	156	101.5 Å²	101.5	73%	0.729	58%	0.579	S	S	*	*	H	α-helix	trans	-70.2	-30.5	175.4	-89	178.7	-26.2	0	0	113	S2 F6	S2-Q4 VanDerWaalsContact C-N 3.3Å; S2-Q4 PolarHBondContact O-N 3.35Å; Q4-F6 VanDerWaalsContact C-N 3.33Å; Q4-F6 PolarHBondContact O-N 3.05Å
5	A	54.8	Low	66	Low	69 Å²	69	102.9 Å²	102.9	57%	0.57	58%	0.576	S	S	*	*	H	α-helix	trans	-69.5	-31.3	179.9	0	0	0	0	0	112.7	S2 S9	S2-A5 PolarHBondContact O-N 3.05Å; A5-S9 PolarHBondContact O-N 2.83Å
6	F	54.5	Low	67.2	Low	167 Å²	167	106.5 Å²	106.5	73%	0.732	58%	0.577	S	S	*	*	H	α-helix	trans	-72.7	-36.4	-176.6	-142.8	-88.8	0	0	0	112.7	Q4 S10	Q4-F6 VanDerWaalsContact C-N 3.33Å; Q4-F6 PolarHBondContact O-N 3.05Å; F6-S10 PolarHBondContact O-N 3.34Å; F6-S10 PolarHBondContact O-OG 3.42Å
7	G	57.7	Low	68.2	Low	37 Å²	37	109 Å²	109	38%	0.381	58%	0.582	S	S	.	*	H	α-helix	trans	-65.1	-42.4	175.5	0	0	0	0	0	113	S9 S10 I11	G7-S9 PolarHBondContact O-N 3.05Å; G7-S10 PolarHBondContact O-N 3.44Å; G7-I11 WeakPolarHBondContact O-CG1 3.46Å; G7-I11 PolarHBondContact O-N 3.19Å; G7-I11 VanDerWaalsContact O-N 3.12Å
8	L	61.4	Low	68.9	Low	106 Å²	106	107.1 Å²	107.1	56%	0.555	57%	0.574	S	S	*	*	H	α-helix	trans	-60.7	-45.5	178.9	-70	168.9	0	0	0	112.1	S10 I11 D12	L8-S10 VanDerWaalsContact C-N 3.27Å; L8-S10 PolarHBondContact O-N 3.19Å; L8-I11 PolarHBondContact O-N 3.44Å; L8-D12 PolarHBondContact O-N 3.04Å
9	S	76.2	Confident	69.8	Low	79 Å²	79	107 Å²	107	55%	0.552	57%	0.57	S	S	*	*	H	α-helix	trans	-57.3	-39.5	177.6	-173.7	0	0	0	0	113	A5 G7 A13	A5-S9 PolarHBondContact O-N 2.83Å; G7-S9 PolarHBondContact O-N 3.05Å; S9-A13 WeakPolarHBondContact O-CB 3.45Å; S9-A13 PolarHBondContact O-N 3.47Å
10	S	76.2	Confident	70.5	Confident	70 Å²	70	108.6 Å²	108.6	49%	0.49	57%	0.574	S	S	.	*	H	α-helix	trans	-70.7	-39.1	179.4	-58.8	0	0	0	0	112.1	F6 G7 L8 A13 L14	F6-S10 PolarHBondContact O-N 3.34Å; F6-S10 PolarHBondContact O-OG 3.42Å; G7-S10 PolarHBondContact O-N 3.44Å; L8-S10 VanDerWaalsContact C-N 3.27Å; L8-S10 PolarHBondContact O-N 3.19Å; S10-A13 PolarHBondContact O-N 2.97Å; S10-L14 PolarHBondContact O-N 3.39Å
11	I	76.9	Confident	70.8	Confident	87 Å²	87	105.8 Å²	105.8	45%	0.446	56%	0.563	S	S	.	*	H	α-helix	trans	-63.8	-43.8	175	-69.1	166.1	0	0	0	110.7	G7 L8 A13 L14 K15	G7-I11 WeakPolarHBondContact O-CG1 3.46Å; G7-I11 PolarHBondContact O-N 3.19Å; G7-I11 VanDerWaalsContact O-N 3.12Å; L8-I11 PolarHBondContact O-N 3.44Å; I11-A13 VanDerWaalsContact C-N 3.34Å; I11-A13 PolarHBondContact O-N 3.35Å; I11-L14 PolarHBondContact O-N 3.11Å; I11-K15 HydrophobicContact CG2-CD 4.3Å; I11-K15 WeakPolarHBondContact O-CG 3.5Å; I11-K15 PolarHBondContact O-N 3.12Å
12	D	82.5	Confident	72.1	Confident	70 Å²	70	101.2 Å²	101.2	37%	0.374	54%	0.539	S	S	.	.	H	α-helix	trans	-75.7	-21.4	-179.5	-65.1	-26.8	0	0	0	113.2	L8 K15 R16	L8-D12 PolarHBondContact O-N 3.04Å; D12-K15 IonicContact OD1-NZ 3.69Å; D12-K15 PolarHBondContact OD1-NZ 2.9Å; D12-R16 WeakPolarHBondContact O-CG 3.33Å; D12-R16 PolarHBondContact O-N 3.46Å; D12-R16 PolarHBondContact O-NE 3.49Å
13	A	80.8	Confident	73.6	Confident	40 Å²	40	101.8 Å²	101.8	33%	0.331	53%	0.532	S	S	.	.	H	α-helix	trans	-70.9	-41.8	165.2	0	0	0	0	0	111.8	S9 S10 I11 R16 K17	S9-A13 WeakPolarHBondContact O-CB 3.45Å; S9-A13 PolarHBondContact O-N 3.47Å; S10-A13 PolarHBondContact O-N 2.97Å; I11-A13 VanDerWaalsContact C-N 3.34Å; I11-A13 PolarHBondContact O-N 3.35Å; A13-R16 PolarHBondContact O-N 3.38Å; A13-K17 PolarHBondContact O-N 3.11Å
14	L	79	Confident	75	Confident	84 Å²	84	99.1 Å²	99.1	44%	0.44	52%	0.517	S	S	.	.	H	α-helix	trans	-67.1	-45.2	178.4	-170.1	68.3	0	0	0	111.9	S10 I11 R16 K17 V18 F130	S10-L14 PolarHBondContact O-N 3.39Å; I11-L14 PolarHBondContact O-N 3.11Å; L14-R16 VanDerWaalsContact C-N 3.3Å; L14-R16 PolarHBondContact O-N 3.5Å; L14-K17 PolarHBondContact O-N 3.45Å; L14-K17 VanDerWaalsContact O-N 3.14Å; L14-V18 PolarHBondContact O-N 3Å; L14-F130 HydrophobicContact CD1-CE2 4.13Å; L14-F130 HydrophobicContact CD2-CE2 4.37Å; L14-F130 HydrophobicContact CD2-CZ 4.13Å
15	K	85.7	Confident	76	Confident	123 Å²	123	95.3 Å²	95.3	54%	0.535	50%	0.501	S	S	.	.	H	α-helix	trans	-54.7	-43.6	175.1	-74.5	173.3	-173.3	159.6	0	112.5	I11 D12 V18 Q19	I11-K15 HydrophobicContact CG2-CD 4.3Å; I11-K15 WeakPolarHBondContact O-CG 3.5Å; I11-K15 PolarHBondContact O-N 3.12Å; D12-K15 IonicContact OD1-NZ 3.69Å; D12-K15 PolarHBondContact OD1-NZ 2.9Å; K15-V18 PolarHBondContact O-N 3.15Å; K15-Q19 PolarHBondContact O-N 3.37Å
16	R	85.2	Confident	77.1	Confident	160 Å²	160	98 Å²	98	60%	0.604	50%	0.5	S	S	*	.	H	α-helix	trans	-62.4	-42.1	177.5	-80.1	180	-72.7	157.6	-5.4	112.4	D12 A13 L14 V18 Q19 E20	D12-R16 WeakPolarHBondContact O-CG 3.33Å; D12-R16 PolarHBondContact O-N 3.46Å; D12-R16 PolarHBondContact O-NE 3.49Å; A13-R16 PolarHBondContact O-N 3.38Å; L14-R16 VanDerWaalsContact C-N 3.3Å; L14-R16 PolarHBondContact O-N 3.5Å; R16-V18 VanDerWaalsContact C-N 3.35Å; R16-V18 PolarHBondContact O-N 3.02Å; R16-Q19 PolarHBondContact O-N 3.35Å; R16-E20 WeakPolarHBondContact O-CB 3.48Å; R16-E20 PolarHBondContact O-N 3.12Å
17	K	84.1	Confident	78.3	Confident	149 Å²	149	92.5 Å²	92.5	65%	0.648	49%	0.486	S	S	*	.	H	α-helix	trans	-63.5	-38.6	175	-72.1	-174.1	173.6	-171.4	0	112.7	A13 L14 S21	A13-K17 PolarHBondContact O-N 3.11Å; L14-K17 PolarHBondContact O-N 3.45Å; L14-K17 VanDerWaalsContact O-N 3.14Å; K17-S21 PolarHBondContact O-N 3.31Å; K17-S21 VanDerWaalsContact O-N 3.1Å
18	V	80.9	Confident	78.9	Confident	74 Å²	74	92.9 Å²	92.9	45%	0.448	48%	0.478	S	S	.	.	H	α-helix	trans	-63	-51	174.5	174.3	0	0	0	0	110.2	L14 K15 R16 E20 S21 E22	L14-V18 PolarHBondContact O-N 3Å; K15-V18 PolarHBondContact O-N 3.15Å; R16-V18 VanDerWaalsContact C-N 3.35Å; R16-V18 PolarHBondContact O-N 3.02Å; V18-E20 PolarHBondContact O-N 3.43Å; V18-S21 WeakPolarHBondContact O-CB 3.46Å; V18-S21 PolarHBondContact O-N 2.96Å; V18-S21 VanDerWaalsContact O-N 3.08Å; V18-S21 PolarHBondContact O-OG 3.23Å; V18-E22 PolarHBondContact O-N 3.02Å
19	Q	86.6	Confident	79.1	Confident	106 Å²	106	94.2 Å²	94.2	50%	0.495	48%	0.476	S	S	.	.	H	α-helix	trans	-58.8	-44.4	178.6	-173.9	-176.3	-22.3	0	0	112.5	K15 R16 S21 E22 E23	K15-Q19 PolarHBondContact O-N 3.37Å; R16-Q19 PolarHBondContact O-N 3.35Å; Q19-S21 VanDerWaalsContact C-N 3.27Å; Q19-S21 PolarHBondContact O-N 2.89Å; Q19-E22 PolarHBondContact O-N 3.01Å; Q19-E23 PolarHBondContact NE2-OE1 2.95Å; Q19-E23 WeakPolarHBondContact O-CG 3.33Å; Q19-E23 PolarHBondContact O-N 3.41Å
20	E	83	Confident	79	Confident	139 Å²	139	93.7 Å²	93.7	65%	0.65	47%	0.466	S	S	*	.	H	α-helix	trans	-59.5	-37.9	175.9	-175.6	176.6	-167.3	0	0	111.9	R16 V18 N24	R16-E20 WeakPolarHBondContact O-CB 3.48Å; R16-E20 PolarHBondContact O-N 3.12Å; V18-E20 PolarHBondContact O-N 3.43Å; E20-N24 WeakPolarHBondContact O-CB 3.39Å; E20-N24 PolarHBondContact O-N 3.42Å; E20-N24 VanDerWaalsContact O-N 3.07Å
21	S	76.4	Confident	79	Confident	50 Å²	50	94.1 Å²	94.1	35%	0.35	47%	0.466	S	S	.	.	H	α-helix	trans	-69	-37.3	175.7	78.5	0	0	0	0	113.2	K17 V18 Q19 L25	K17-S21 PolarHBondContact O-N 3.31Å; K17-S21 VanDerWaalsContact O-N 3.1Å; V18-S21 WeakPolarHBondContact O-CB 3.46Å; V18-S21 PolarHBondContact O-N 2.96Å; V18-S21 VanDerWaalsContact O-N 3.08Å; V18-S21 PolarHBondContact O-OG 3.23Å; Q19-S21 VanDerWaalsContact C-N 3.27Å; Q19-S21 PolarHBondContact O-N 2.89Å; S21-L25 WeakPolarHBondContact O-CB 3.33Å; S21-L25 WeakPolarHBondContact O-CG 3.39Å; S21-L25 PolarHBondContact O-N 3.43Å
22	E	78.5	Confident	78.5	Confident	123 Å²	123	92.5 Å²	92.5	58%	0.575	46%	0.458	S	S	*	.	H	α-helix	trans	-67.1	-43	175.5	-69.7	-175.2	159.4	0	0	111.9	V18 Q19 L25 K26	V18-E22 PolarHBondContact O-N 3.02Å; Q19-E22 PolarHBondContact O-N 3.01Å; E22-L25 PolarHBondContact O-N 2.97Å; E22-K26 WeakPolarHBondContact O-CB 3.48Å; E22-K26 PolarHBondContact O-N 3.47Å
23	E	84.9	Confident	77.7	Confident	106 Å²	106	93.7 Å²	93.7	50%	0.495	46%	0.463	S	S	.	.	H	α-helix	trans	-64.1	-40.8	177	-72	179.3	-162.7	0	0	111.5	Q19 K26 A27	Q19-E23 PolarHBondContact NE2-OE1 2.95Å; Q19-E23 WeakPolarHBondContact O-CG 3.33Å; Q19-E23 PolarHBondContact O-N 3.41Å; E23-K26 PolarHBondContact O-N 3.42Å; E23-A27 PolarHBondContact O-N 3.34Å
24	N	80	Confident	77.3	Confident	87 Å²	87	97 Å²	97	47%	0.465	47%	0.471	S	S	.	.	H	α-helix	trans	-64.8	-46	174.6	-169.2	1.7	0	0	0	111.9	E20 K26 A27 Q28	E20-N24 WeakPolarHBondContact O-CB 3.39Å; E20-N24 PolarHBondContact O-N 3.42Å; E20-N24 VanDerWaalsContact O-N 3.07Å; N24-K26 VanDerWaalsContact C-N 3.3Å; N24-K26 PolarHBondContact O-N 3.21Å; N24-A27 PolarHBondContact O-N 2.96Å; N24-Q28 VanDerWaalsContact O-CG 3.27Å; N24-Q28 WeakPolarHBondContact O-CG 3.48Å; N24-Q28 PolarHBondContact O-N 3.42Å; N24-Q28 PolarHBondContact OD1-NE2 2.94Å
25	L	71.4	Confident	76.6	Confident	75 Å²	75	98.9 Å²	98.9	39%	0.393	48%	0.477	S	S	.	.	H	α-helix	trans	-57.9	-41.6	174.3	-82.2	170.1	0	0	0	112.2	S21 E22 Q28 R29 Y123	S21-L25 WeakPolarHBondContact O-CB 3.33Å; S21-L25 WeakPolarHBondContact O-CG 3.39Å; S21-L25 PolarHBondContact O-N 3.43Å; E22-L25 PolarHBondContact O-N 2.97Å; L25-Q28 PolarHBondContact O-N 2.94Å; L25-R29 WeakPolarHBondContact O-CB 3.28Å; L25-R29 PolarHBondContact O-N 3.42Å; L25-Y123 HydrophobicContact CD2-CD2 4.48Å; L25-Y123 HydrophobicContact CD2-CE2 3.64Å
26	K	77.2	Confident	75.3	Confident	125 Å²	125	94.8 Å²	94.8	54%	0.543	46%	0.463	S	S	.	.	H	α-helix	trans	-64.6	-46.2	177.5	-171.8	179.8	177.4	-176.2	0	111.9	E22 E23 N24 Q28 R29 D30	E22-K26 WeakPolarHBondContact O-CB 3.48Å; E22-K26 PolarHBondContact O-N 3.47Å; E23-K26 PolarHBondContact O-N 3.42Å; N24-K26 VanDerWaalsContact C-N 3.3Å; N24-K26 PolarHBondContact O-N 3.21Å; K26-Q28 VanDerWaalsContact C-N 3.34Å; K26-Q28 PolarHBondContact O-N 2.79Å; K26-R29 WeakPolarHBondContact O-CB 3.4Å; K26-R29 PolarHBondContact O-N 3Å; K26-D30 VanDerWaalsContact O-CG 3.24Å; K26-D30 PolarHBondContact O-N 2.97Å
27	A	79.8	Confident	74.4	Confident	53 Å²	53	92.4 Å²	92.4	44%	0.438	46%	0.457	S	S	.	.	H	α-helix	trans	-62.6	-39.4	176.3	0	0	0	0	0	112.4	E23 N24 D30 T31	E23-A27 PolarHBondContact O-N 3.34Å; N24-A27 PolarHBondContact O-N 2.96Å; A27-D30 PolarHBondContact O-N 3.09Å; A27-T31 WeakPolarHBondContact O-CB 3.39Å; A27-T31 PolarHBondContact O-N 2.97Å; A27-T31 PolarHBondContact O-OG1 2.97Å
28	Q	69.7	Low	73.6	Confident	44 Å²	44	89.4 Å²	89.4	21%	0.206	45%	0.445	C	S	.	.	H	α-helix	trans	-65.5	-43.9	175.6	-70.2	173.8	24	0	0	112.2	N24 L25 K26 D30 T31 I32	N24-Q28 VanDerWaalsContact O-CG 3.27Å; N24-Q28 WeakPolarHBondContact O-CG 3.48Å; N24-Q28 PolarHBondContact O-N 3.42Å; N24-Q28 PolarHBondContact OD1-NE2 2.94Å; L25-Q28 PolarHBondContact O-N 2.94Å; K26-Q28 VanDerWaalsContact C-N 3.34Å; K26-Q28 PolarHBondContact O-N 2.79Å; Q28-D30 VanDerWaalsContact C-N 3.35Å; Q28-D30 PolarHBondContact O-N 3.17Å; Q28-T31 PolarHBondContact O-N 3.45Å; Q28-I32 WeakPolarHBondContact O-CG1 3.44Å; Q28-I32 PolarHBondContact O-N 2.89Å
29	R	65.5	Low	72.6	Confident	135 Å²	135	86.9 Å²	86.9	51%	0.509	43%	0.432	S	S	.	.	H	α-helix	trans	-56.6	-49.2	173.6	178	-157.2	68.9	-176.1	0.2	111	L25 K26 T31 I32 M33	L25-R29 WeakPolarHBondContact O-CB 3.28Å; L25-R29 PolarHBondContact O-N 3.42Å; K26-R29 WeakPolarHBondContact O-CB 3.4Å; K26-R29 PolarHBondContact O-N 3Å; R29-T31 VanDerWaalsContact C-N 3.31Å; R29-T31 PolarHBondContact O-N 3.19Å; R29-I32 PolarHBondContact O-N 3.46Å; R29-M33 WeakPolarHBondContact O-CG 3.43Å; R29-M33 PolarHBondContact O-N 3.03Å
30	D	75.7	Confident	71	Confident	67 Å²	67	84.7 Å²	84.7	36%	0.358	42%	0.423	S	S	.	.	H	α-helix	trans	-65.1	-37.8	-177.1	-65.5	-13.8	0	0	0	111.1	K26 A27 Q28 M33 E34	K26-D30 VanDerWaalsContact O-CG 3.24Å; K26-D30 PolarHBondContact O-N 2.97Å; A27-D30 PolarHBondContact O-N 3.09Å; Q28-D30 VanDerWaalsContact C-N 3.35Å; Q28-D30 PolarHBondContact O-N 3.17Å; D30-M33 PolarHBondContact O-N 3.27Å; D30-E34 PolarHBondContact O-N 2.98Å
31	T	76.4	Confident	70	Confident	80 Å²	80	84.7 Å²	84.7	49%	0.491	42%	0.417	S	S	.	.	H	α-helix	trans	-60	-45.2	171.7	-54.2	0	0	0	0	112.5	A27 Q28 R29 E34 Q35	A27-T31 WeakPolarHBondContact O-CB 3.39Å; A27-T31 PolarHBondContact O-N 2.97Å; A27-T31 PolarHBondContact O-OG1 2.97Å; Q28-T31 PolarHBondContact O-N 3.45Å; R29-T31 VanDerWaalsContact C-N 3.31Å; R29-T31 PolarHBondContact O-N 3.19Å; T31-E34 PolarHBondContact O-N 3.47Å; T31-Q35 WeakPolarHBondContact O-CG 3.32Å; T31-Q35 PolarHBondContact O-N 2.76Å; T31-Q35 VanDerWaalsContact O-N 3.11Å
32	I	65.3	Low	69.3	Low	53 Å²	53	85.5 Å²	85.5	27%	0.272	42%	0.421	S	S	.	.	H	α-helix	trans	-64.7	-40.9	177.5	-68.1	164.7	0	0	0	110.6	Q28 R29 E34 Q35 V36 I112	Q28-I32 WeakPolarHBondContact O-CG1 3.44Å; Q28-I32 PolarHBondContact O-N 2.89Å; R29-I32 PolarHBondContact O-N 3.46Å; I32-E34 PolarHBondContact O-N 2.87Å; I32-Q35 PolarHBondContact O-N 3.34Å; I32-V36 HydrophobicContact CG2-CG2 4.44Å; I32-V36 WeakPolarHBondContact O-CG2 3.42Å; I32-V36 PolarHBondContact O-N 2.97Å; I32-I112 HydrophobicContact CG2-CG2 4.32Å
33	M	66.2	Low	68.1	Low	95 Å²	95	79.7 Å²	79.7	47%	0.468	39%	0.393	S	S	.	.	H	α-helix	trans	-63.2	-39.2	178.3	-72	-59.6	-59.3	0	0	112.7	R29 D30 V36 K37	R29-M33 WeakPolarHBondContact O-CG 3.43Å; R29-M33 PolarHBondContact O-N 3.03Å; D30-M33 PolarHBondContact O-N 3.27Å; M33-V36 PolarHBondContact O-N 3.39Å; M33-K37 WeakPolarHBondContact O-CG 3.39Å; M33-K37 PolarHBondContact O-N 3.32Å
34	E	71.4	Confident	66.7	Low	109 Å²	109	78.3 Å²	78.3	51%	0.509	39%	0.387	S	S	.	.	H	α-helix	trans	-68.8	-38.3	174	-66.4	-50	127.4	0	0	112.4	D30 T31 I32 V36 K37 E38	D30-E34 PolarHBondContact O-N 2.98Å; T31-E34 PolarHBondContact O-N 3.47Å; I32-E34 PolarHBondContact O-N 2.87Å; E34-V36 VanDerWaalsContact C-N 3.33Å; E34-V36 PolarHBondContact O-N 3.29Å; E34-K37 PolarHBondContact O-N 3.31Å; E34-K37 IonicContact OE1-NZ 3.59Å; E34-K37 PolarHBondContact OE1-NZ 3.02Å; E34-K37 IonicContact OE2-NZ 3.88Å; E34-E38 WeakPolarHBondContact O-CB 3.45Å; E34-E38 PolarHBondContact O-N 3.45Å
35	Q	65.2	Low	65.7	Low	123 Å²	123	76.6 Å²	76.6	58%	0.575	38%	0.378	S	S	*	.	H	α-helix	trans	-61.5	-40.4	173.3	-72.6	178	-5.7	0	0	112.2	T31 I32 E38 A39	T31-Q35 WeakPolarHBondContact O-CG 3.32Å; T31-Q35 PolarHBondContact O-N 2.76Å; T31-Q35 VanDerWaalsContact O-N 3.11Å; I32-Q35 PolarHBondContact O-N 3.34Å; Q35-E38 PolarHBondContact O-N 3.39Å; Q35-A39 WeakPolarHBondContact O-CB 3.49Å; Q35-A39 PolarHBondContact O-N 3.07Å
36	V	58.8	Low	65.2	Low	38 Å²	38	76.4 Å²	76.4	23%	0.23	38%	0.375	C	S	.	.	H	α-helix	trans	-65.5	-44.6	175.5	169.8	0	0	0	0	111.4	I32 M33 E34 E38 A39 I40 I112	I32-V36 HydrophobicContact CG2-CG2 4.44Å; I32-V36 WeakPolarHBondContact O-CG2 3.42Å; I32-V36 PolarHBondContact O-N 2.97Å; M33-V36 PolarHBondContact O-N 3.39Å; E34-V36 VanDerWaalsContact C-N 3.33Å; E34-V36 PolarHBondContact O-N 3.29Å; V36-E38 VanDerWaalsContact C-N 3.35Å; V36-E38 PolarHBondContact O-N 2.96Å; V36-A39 PolarHBondContact O-N 2.93Å; V36-I40 HydrophobicContact CG1-CD1 3.81Å; V36-I40 HydrophobicContact CG1-CG1 4.5Å; V36-I40 VanDerWaalsContact O-CG1 3.27Å; V36-I40 WeakPolarHBondContact O-CG1 3.41Å; V36-I40 PolarHBondContact O-N 2.85Å; V36-I112 HydrophobicContact CG2-CD1 3.9Å
37	K	66.3	Low	64.1	Low	109 Å²	109	70.9 Å²	70.9	47%	0.474	35%	0.352	S	S	.	.	H	α-helix	trans	-59.7	-43.9	175.6	-73.8	169.3	-176.3	173.7	0	112.3	M33 E34 I40 R41	M33-K37 WeakPolarHBondContact O-CG 3.39Å; M33-K37 PolarHBondContact O-N 3.32Å; E34-K37 PolarHBondContact O-N 3.31Å; E34-K37 IonicContact OE1-NZ 3.59Å; E34-K37 PolarHBondContact OE1-NZ 3.02Å; E34-K37 IonicContact OE2-NZ 3.88Å; K37-I40 PolarHBondContact O-N 2.91Å; K37-R41 WeakPolarHBondContact O-CB 3.46Å; K37-R41 PolarHBondContact O-N 3.39Å
38	E	67.3	Low	63	Low	86 Å²	86	71.5 Å²	71.5	40%	0.402	35%	0.347	S	S	.	.	H	α-helix	trans	-67.2	-42.8	-179.9	-178	58.7	-172	0	0	111.4	E34 Q35 V36 I40 R41 T42	E34-E38 WeakPolarHBondContact O-CB 3.45Å; E34-E38 PolarHBondContact O-N 3.45Å; Q35-E38 PolarHBondContact O-N 3.39Å; V36-E38 VanDerWaalsContact C-N 3.35Å; V36-E38 PolarHBondContact O-N 2.96Å; E38-I40 PolarHBondContact O-N 2.96Å; E38-R41 WeakPolarHBondContact O-CB 3.26Å; E38-R41 PolarHBondContact O-N 3.24Å; E38-R41 IonicContact OE1-CZ 3.85Å; E38-R41 IonicContact OE1-NE 2.88Å; E38-R41 IonicContact OE1-NH2 3.17Å; E38-R41 PolarHBondContact OE1-NH2 3.43Å; E38-R41 IonicContact OE2-CZ 2.79Å; E38-R41 IonicContact OE2-NE 3.61Å; E38-R41 PolarHBondContact OE2-NE 3.38Å; E38-R41 IonicContact OE2-NH2 2.63Å; E38-R41 PolarHBondContact OE2-NH2 3.37Å; E38-T42 PolarHBondContact O-N 3.45Å; E38-T42 PolarHBondContact O-OG1 3.13Å
39	A	58.9	Low	62.7	Low	22 Å²	22	72.4 Å²	72.4	18%	0.182	35%	0.353	C	S	.	.	H	α-helix	trans	-59.2	-47.2	173.9	0	0	0	0	0	111.6	Q35 V36 R41 T42 G43 F105	Q35-A39 WeakPolarHBondContact O-CB 3.49Å; Q35-A39 PolarHBondContact O-N 3.07Å; V36-A39 PolarHBondContact O-N 2.93Å; A39-R41 VanDerWaalsContact C-N 3.32Å; A39-R41 PolarHBondContact O-N 3.45Å; A39-T42 PolarHBondContact O-N 3.44Å; A39-T42 VanDerWaalsContact O-N 3.14Å; A39-G43 PolarHBondContact O-N 2.99Å; A39-F105 VanDerWaalsContact C-CZ 3.47Å; A39-F105 HydrophobicContact CB-CE1 3.69Å; A39-F105 HydrophobicContact CB-CZ 4.21Å; A39-F105 WeakPolarHBondContact O-CZ 3.26Å
40	I	53.3	Low	62.4	Low	60 Å²	60	73.4 Å²	73.4	31%	0.308	36%	0.357	S	S	.	.	H	α-helix	trans	-54.3	-49.2	174.6	-69.7	165.5	0	0	0	110.3	V36 K37 E38 T42 G43 E44 F105	V36-I40 HydrophobicContact CG1-CD1 3.81Å; V36-I40 HydrophobicContact CG1-CG1 4.5Å; V36-I40 VanDerWaalsContact O-CG1 3.27Å; V36-I40 WeakPolarHBondContact O-CG1 3.41Å; V36-I40 PolarHBondContact O-N 2.85Å; K37-I40 PolarHBondContact O-N 2.91Å; E38-I40 PolarHBondContact O-N 2.96Å; I40-T42 VanDerWaalsContact C-N 3.34Å; I40-T42 PolarHBondContact O-N 3.26Å; I40-G43 PolarHBondContact O-N 3.41Å; I40-E44 HydrophobicContact CG2-CG 4.31Å; I40-E44 WeakPolarHBondContact O-CB 3.5Å; I40-E44 VanDerWaalsContact O-CG 3.31Å; I40-E44 WeakPolarHBondContact O-CG 3.45Å; I40-E44 PolarHBondContact O-N 3.21Å; I40-F105 HydrophobicContact CB-CZ 4.41Å; I40-F105 HydrophobicContact CG1-CE1 4.02Å; I40-F105 HydrophobicContact CG1-CZ 4.01Å
41	R	61.5	Low	61.5	Low	138 Å²	138	70.9 Å²	70.9	52%	0.521	34%	0.343	S	S	.	.	H	α-helix	trans	-60.8	-39.3	178.2	-169.1	178	75.2	117.6	2.9	112.4	K37 E38 A39 N45	K37-R41 WeakPolarHBondContact O-CB 3.46Å; K37-R41 PolarHBondContact O-N 3.39Å; E38-R41 WeakPolarHBondContact O-CB 3.26Å; E38-R41 PolarHBondContact O-N 3.24Å; E38-R41 IonicContact OE1-CZ 3.85Å; E38-R41 IonicContact OE1-NE 2.88Å; E38-R41 IonicContact OE1-NH2 3.17Å; E38-R41 PolarHBondContact OE1-NH2 3.43Å; E38-R41 IonicContact OE2-CZ 2.79Å; E38-R41 IonicContact OE2-NE 3.61Å; E38-R41 PolarHBondContact OE2-NE 3.38Å; E38-R41 IonicContact OE2-NH2 2.63Å; E38-R41 PolarHBondContact OE2-NH2 3.37Å; A39-R41 VanDerWaalsContact C-N 3.32Å; A39-R41 PolarHBondContact O-N 3.45Å; R41-N45 PolarHBondContact O-N 3.24Å; R41-N45 PolarHBondContact O-ND2 3.41Å
42	T	62.7	Low	60.9	Low	68 Å²	68	67.4 Å²	67.4	42%	0.417	32%	0.322	S	S	.	.	H	α-helix	trans	-66	-51.5	176.4	-55.5	0	0	0	0	111.1	E38 A39 I40 E44 N45 E46	E38-T42 PolarHBondContact O-N 3.45Å; E38-T42 PolarHBondContact O-OG1 3.13Å; A39-T42 PolarHBondContact O-N 3.44Å; A39-T42 VanDerWaalsContact O-N 3.14Å; I40-T42 VanDerWaalsContact C-N 3.34Å; I40-T42 PolarHBondContact O-N 3.26Å; T42-E44 VanDerWaalsContact C-N 3.34Å; T42-E44 PolarHBondContact O-N 3.41Å; T42-N45 PolarHBondContact O-N 3.37Å; T42-E46 PolarHBondContact O-N 2.91Å
43	G	53	Low	60.8	Low	0 Å²	0	68.9 Å²	68.9	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-63.1	-35.9	178.6	0	0	0	0	0	113.1	A39 I40 E46 V47	A39-G43 PolarHBondContact O-N 2.99Å; I40-G43 PolarHBondContact O-N 3.41Å; G43-E46 PolarHBondContact O-N 3Å; G43-V47 WeakPolarHBondContact O-CB 3.38Å; G43-V47 WeakPolarHBondContact O-CG2 3.32Å; G43-V47 PolarHBondContact O-N 2.85Å
44	E	55.1	Low	60.7	Low	77 Å²	77	70.1 Å²	70.1	36%	0.36	34%	0.338	S	S	.	.	H	α-helix	trans	-58	-51.3	171.3	-82.3	178.5	167.4	0	0	111.6	I40 T42 E46 V47 I48 F97	I40-E44 HydrophobicContact CG2-CG 4.31Å; I40-E44 WeakPolarHBondContact O-CB 3.5Å; I40-E44 VanDerWaalsContact O-CG 3.31Å; I40-E44 WeakPolarHBondContact O-CG 3.45Å; I40-E44 PolarHBondContact O-N 3.21Å; T42-E44 VanDerWaalsContact C-N 3.34Å; T42-E44 PolarHBondContact O-N 3.41Å; E44-E46 PolarHBondContact O-N 3.28Å; E44-V47 PolarHBondContact O-N 2.94Å; E44-I48 WeakPolarHBondContact O-CB 3.46Å; E44-I48 WeakPolarHBondContact O-CD1 3.46Å; E44-I48 WeakPolarHBondContact O-CG1 3.5Å; E44-I48 PolarHBondContact O-N 3.47Å; E44-F97 HydrophobicContact CG-CE2 4.03Å
45	N	59.9	Low	60.2	Low	51 Å²	51	65.4 Å²	65.4	27%	0.273	32%	0.317	S	S	.	.	H	α-helix	trans	-63.4	-40.1	179.4	-80.1	-70.1	0	0	0	112	R41 T42 I48 N49	R41-N45 PolarHBondContact O-N 3.24Å; R41-N45 PolarHBondContact O-ND2 3.41Å; T42-N45 PolarHBondContact O-N 3.37Å; N45-I48 PolarHBondContact O-N 3.12Å; N45-N49 WeakPolarHBondContact O-CB 3.35Å; N45-N49 PolarHBondContact O-N 3.04Å; N45-N49 PolarHBondContact O-ND2 3.48Å
46	E	59.7	Low	60.1	Low	71 Å²	71	60.2 Å²	60.2	33%	0.332	30%	0.295	S	S	.	.	H	α-helix	trans	-68.1	-42	179.1	-173.9	162.2	158.2	0	0	112.3	T42 G43 E44 N49 R50	T42-E46 PolarHBondContact O-N 2.91Å; G43-E46 PolarHBondContact O-N 3Å; E44-E46 PolarHBondContact O-N 3.28Å; E46-N49 PolarHBondContact O-N 2.88Å; E46-R50 HydrophobicContact CG-CG 4.34Å; E46-R50 WeakPolarHBondContact O-CB 3.39Å; E46-R50 WeakPolarHBondContact O-CG 3.34Å; E46-R50 PolarHBondContact O-N 3.47Å; E46-R50 IonicContact OE1-CZ 2.99Å; E46-R50 IonicContact OE1-NE 2.65Å; E46-R50 PolarHBondContact OE1-NE 2.93Å; E46-R50 IonicContact OE1-NH2 3.13Å; E46-R50 PolarHBondContact OE1-NH2 3.24Å
47	V	54	Low	60.5	Low	10 Å²	10	63.9 Å²	63.9	6%	0.061	31%	0.313	C	S	.	.	H	α-helix	trans	-61.1	-45.5	173.8	170.9	0	0	0	0	111.2	G43 E44 N49 R50 M51 L96 S100	G43-V47 WeakPolarHBondContact O-CB 3.38Å; G43-V47 WeakPolarHBondContact O-CG2 3.32Å; G43-V47 PolarHBondContact O-N 2.85Å; E44-V47 PolarHBondContact O-N 2.94Å; V47-N49 VanDerWaalsContact C-N 3.32Å; V47-N49 PolarHBondContact O-N 3.28Å; V47-R50 PolarHBondContact O-N 3.17Å; V47-M51 WeakPolarHBondContact O-CB 3.49Å; V47-M51 PolarHBondContact O-N 3.39Å; V47-L96 HydrophobicContact CG1-CB 4.31Å; V47-S100 VanDerWaalsContact CG2-CB 3.42Å; V47-S100 WeakPolarHBondContact CG2-OG 3.32Å
48	I	58	Low	60.6	Low	66 Å²	66	64.7 Å²	64.7	34%	0.338	32%	0.322	S	S	.	.	H	α-helix	trans	-59.2	-44.5	176.1	-70.8	164.8	0	0	0	110.4	E44 N45 S52 L303	E44-I48 WeakPolarHBondContact O-CB 3.46Å; E44-I48 WeakPolarHBondContact O-CD1 3.46Å; E44-I48 WeakPolarHBondContact O-CG1 3.5Å; E44-I48 PolarHBondContact O-N 3.47Å; N45-I48 PolarHBondContact O-N 3.12Å; I48-S52 WeakPolarHBondContact O-CB 3.49Å; I48-S52 PolarHBondContact O-N 2.8Å; I48-L303 HydrophobicContact CG2-CD1 3.95Å
49	N	61.7	Low	60.5	Low	62 Å²	62	61.2 Å²	61.2	33%	0.332	31%	0.306	S	S	.	.	H	α-helix	trans	-67.1	-44.6	-179.8	-75.8	-25.8	0	0	0	113.2	N45 E46 V47 S52 V53	N45-N49 WeakPolarHBondContact O-CB 3.35Å; N45-N49 PolarHBondContact O-N 3.04Å; N45-N49 PolarHBondContact O-ND2 3.48Å; E46-N49 PolarHBondContact O-N 2.88Å; V47-N49 VanDerWaalsContact C-N 3.32Å; V47-N49 PolarHBondContact O-N 3.28Å; N49-S52 VanDerWaalsContact O-CB 3.31Å; N49-S52 WeakPolarHBondContact O-CB 3.37Å; N49-S52 PolarHBondContact O-N 2.9Å; N49-V53 PolarHBondContact O-N 3.23Å
50	R	60.9	Low	60.8	Low	156 Å²	156	61.7 Å²	61.7	59%	0.589	31%	0.308	S	S	*	.	H	α-helix	trans	-64.2	-47.8	176.6	-71.3	173.3	178.3	-103.5	7.5	111.3	E46 V47 S52 V53 E54	E46-R50 HydrophobicContact CG-CG 4.34Å; E46-R50 WeakPolarHBondContact O-CB 3.39Å; E46-R50 WeakPolarHBondContact O-CG 3.34Å; E46-R50 PolarHBondContact O-N 3.47Å; E46-R50 IonicContact OE1-CZ 2.99Å; E46-R50 IonicContact OE1-NE 2.65Å; E46-R50 PolarHBondContact OE1-NE 2.93Å; E46-R50 IonicContact OE1-NH2 3.13Å; E46-R50 PolarHBondContact OE1-NH2 3.24Å; V47-R50 PolarHBondContact O-N 3.17Å; R50-S52 VanDerWaalsContact C-N 3.29Å; R50-S52 PolarHBondContact O-N 3.23Å; R50-V53 PolarHBondContact O-N 2.88Å; R50-E54 PolarHBondContact O-N 3.23Å
51	M	56.6	Low	61.5	Low	14 Å²	14	62.4 Å²	62.4	7%	0.069	32%	0.316	C	S	.	.	H	α-helix	trans	-61.2	-38.2	176.3	-176.8	-170.6	64.9	0	0	111.6	V47 V53 E54 C55 L93 L96	V47-M51 WeakPolarHBondContact O-CB 3.49Å; V47-M51 PolarHBondContact O-N 3.39Å; M51-V53 VanDerWaalsContact C-N 3.3Å; M51-V53 PolarHBondContact O-N 3.09Å; M51-E54 PolarHBondContact O-N 3.4Å; M51-C55 VanDerWaalsContact CG-SG 3.6Å; M51-C55 WeakPolarHBondContact O-CB 3.33Å; M51-C55 PolarHBondContact O-N 3.38Å; M51-C55 PolarHBondContact O-SG 2.9Å; M51-C55 VanDerWaalsContact O-SG 3.42Å; M51-L93 HydrophobicContact CE-CD2 3.42Å; M51-L93 VanDerWaalsContact CE-CD2 3.42Å; M51-L93 HydrophobicContact CE-CG 3.82Å; M51-L93 HydrophobicContact SD-CD2 3.81Å; M51-L93 HydrophobicContact SD-CG 3.79Å; M51-L96 HydrophobicContact CB-CD1 3.97Å; M51-L96 HydrophobicContact CG-CD1 3.67Å; M51-L96 HydrophobicContact SD-CD1 4.14Å
52	S	62.9	Low	61.7	Low	7 Å²	7	60.5 Å²	60.5	5%	0.049	31%	0.312	C	S	.	.	H	α-helix	trans	-52.3	-48.1	175.2	137.1	0	0	0	0	111.4	I48 N49 R50 A56 W307	I48-S52 WeakPolarHBondContact O-CB 3.49Å; I48-S52 PolarHBondContact O-N 2.8Å; N49-S52 VanDerWaalsContact O-CB 3.31Å; N49-S52 WeakPolarHBondContact O-CB 3.37Å; N49-S52 PolarHBondContact O-N 2.9Å; R50-S52 VanDerWaalsContact C-N 3.29Å; R50-S52 PolarHBondContact O-N 3.23Å; S52-A56 WeakPolarHBondContact O-CB 3.35Å; S52-A56 PolarHBondContact O-N 2.85Å; S52-W307 VanDerWaalsContact C-NE1 3.27Å; S52-W307 VanDerWaalsContact CB-NE1 3.33Å; S52-W307 PolarHBondContact O-NE1 3.5Å; S52-W307 PolarHBondContact OG-NE1 3.37Å
53	V	64.3	Low	61.8	Low	85 Å²	85	57.6 Å²	57.6	52%	0.515	29%	0.294	S	S	.	.	H	α-helix	trans	-68.6	-48.3	-179.1	179.3	0	0	0	0	111.8	N49 R50 M51 A56 N57	N49-V53 PolarHBondContact O-N 3.23Å; R50-V53 PolarHBondContact O-N 2.88Å; M51-V53 VanDerWaalsContact C-N 3.3Å; M51-V53 PolarHBondContact O-N 3.09Å; V53-A56 PolarHBondContact O-N 3.42Å; V53-N57 VanDerWaalsContact O-CG 3.27Å; V53-N57 PolarHBondContact O-N 2.84Å; V53-N57 VanDerWaalsContact O-N 3.17Å; V53-N57 PolarHBondContact O-ND2 3.33Å
54	E	63.8	Low	62.4	Low	121 Å²	121	63.6 Å²	63.6	57%	0.565	32%	0.316	S	S	*	.	H	α-helix	trans	-64.9	-46.4	-178.6	-68	-169.7	171.8	0	0	112.5	R50 M51 A56 N57 I58	R50-E54 PolarHBondContact O-N 3.23Å; M51-E54 PolarHBondContact O-N 3.4Å; E54-A56 PolarHBondContact O-N 3.06Å; E54-N57 PolarHBondContact O-N 2.91Å; E54-I58 WeakPolarHBondContact O-CG1 3.36Å; E54-I58 PolarHBondContact O-N 3.02Å; E54-I58 VanDerWaalsContact O-N 3.16Å
55	C	60.9	Low	63	Low	10 Å²	10	62.5 Å²	62.5	7%	0.068	32%	0.317	C	S	.	.	H	α-helix	trans	-64.3	-40.7	178.3	-72.8	0	0	0	0	112	M51 N57 I58 L59 W307	M51-C55 VanDerWaalsContact CG-SG 3.6Å; M51-C55 WeakPolarHBondContact O-CB 3.33Å; M51-C55 PolarHBondContact O-N 3.38Å; M51-C55 PolarHBondContact O-SG 2.9Å; M51-C55 VanDerWaalsContact O-SG 3.42Å; C55-N57 VanDerWaalsContact C-N 3.33Å; C55-N57 PolarHBondContact O-N 3.14Å; C55-I58 PolarHBondContact O-N 3.21Å; C55-L59 WeakPolarHBondContact O-CB 3.43Å; C55-L59 PolarHBondContact O-N 3.33Å; C55-W307 HydrophobicContact CB-CZ2 4.1Å
56	A	63.2	Low	63.1	Low	13 Å²	13	61.3 Å²	61.3	11%	0.107	31%	0.312	C	S	.	.	H	α-helix	trans	-60.9	-43.2	176.9	0	0	0	0	0	111.7	S52 V53 E54 I58 S60	S52-A56 WeakPolarHBondContact O-CB 3.35Å; S52-A56 PolarHBondContact O-N 2.85Å; V53-A56 PolarHBondContact O-N 3.42Å; E54-A56 PolarHBondContact O-N 3.06Å; A56-I58 PolarHBondContact O-N 3.01Å; A56-S60 WeakPolarHBondContact O-CB 3.45Å; A56-S60 PolarHBondContact O-N 3.27Å; A56-S60 VanDerWaalsContact O-N 3.11Å
57	N	66.8	Low	63.2	Low	116 Å²	116	58.6 Å²	58.6	62%	0.62	30%	0.299	S	S	*	.	H	α-helix	trans	-67.2	-34.8	-178.7	-71.3	-21	0	0	0	113.4	V53 E54 C55 P61	V53-N57 VanDerWaalsContact O-CG 3.27Å; V53-N57 PolarHBondContact O-N 2.84Å; V53-N57 VanDerWaalsContact O-N 3.17Å; V53-N57 PolarHBondContact O-ND2 3.33Å; E54-N57 PolarHBondContact O-N 2.91Å; C55-N57 VanDerWaalsContact C-N 3.33Å; C55-N57 PolarHBondContact O-N 3.14Å; N57-P61 WeakPolarHBondContact O-CD 3.32Å; N57-P61 VanDerWaalsContact O-CG 3.23Å; N57-P61 WeakPolarHBondContact O-CG 3.41Å
58	I	67.5	Low	63.5	Low	126 Å²	126	63.8 Å²	63.8	65%	0.646	33%	0.325	S	S	*	.	H	α-helix	trans	-85.5	-46.4	179.9	-62.7	168.9	0	0	0	111.3	E54 C55 A56 P61	E54-I58 WeakPolarHBondContact O-CG1 3.36Å; E54-I58 PolarHBondContact O-N 3.02Å; E54-I58 VanDerWaalsContact O-N 3.16Å; C55-I58 PolarHBondContact O-N 3.21Å; A56-I58 PolarHBondContact O-N 3.01Å; I58-P61 WeakPolarHBondContact O-CD 3.29Å; I58-P61 WeakPolarHBondContact O-CG 3.41Å
59	L	65.9	Low	63.6	Low	13 Å²	13	69 Å²	69	7%	0.068	35%	0.345	C	S	.	.	H	α-helix	trans	-82.9	-33	-168	-166.8	64.1	0	0	0	112.9	C55 F62 L63 V85 L88 F310	C55-L59 WeakPolarHBondContact O-CB 3.43Å; C55-L59 PolarHBondContact O-N 3.33Å; L59-F62 HydrophobicContact CD1-CD1 4.27Å; L59-F62 PolarHBondContact O-N 3.49Å; L59-L63 HydrophobicContact CD1-CD1 4.11Å; L59-L63 HydrophobicContact CD1-CD2 4.41Å; L59-L63 HydrophobicContact CD1-CG 3.94Å; L59-L63 HydrophobicContact CD2-CD1 4.06Å; L59-L63 HydrophobicContact CG-CD1 3.68Å; L59-L63 HydrophobicContact CG-CG 3.92Å; L59-L63 WeakPolarHBondContact O-CB 3.31Å; L59-L63 WeakPolarHBondContact O-CG 3.44Å; L59-L63 PolarHBondContact O-N 3.18Å; L59-V85 HydrophobicContact CD1-CG2 4.33Å; L59-V85 HydrophobicContact CD2-CG1 4.01Å; L59-L88 HydrophobicContact CD1-CD2 4.43Å; L59-F310 HydrophobicContact CD2-CE1 4.49Å; L59-F310 HydrophobicContact CD2-CZ 4Å; L59-F310 HydrophobicContact CG-CZ 4.32Å
60	S	64.4	Low	63.6	Low	32 Å²	32	68.6 Å²	68.6	22%	0.224	34%	0.343	C	S	.	.	H	α-helix	trans	-58.1	-53	176.7	-178	0	0	0	0	113.3	A56 R64	A56-S60 WeakPolarHBondContact O-CB 3.45Å; A56-S60 PolarHBondContact O-N 3.27Å; A56-S60 VanDerWaalsContact O-N 3.11Å; S60-R64 VanDerWaalsContact O-CB 3.31Å; S60-R64 WeakPolarHBondContact O-CB 3.39Å; S60-R64 WeakPolarHBondContact O-CG 3.22Å; S60-R64 PolarHBondContact O-N 3.49Å; S60-R64 PolarHBondContact OG-NE 3.43Å
61	P	68.4	Low	63.6	Low	74 Å²	74	71.3 Å²	71.3	48%	0.481	36%	0.36	S	S	.	.	H	α-helix	trans	-66.7	-37.1	177.7	25.8	-33.9	0	0	0	112.4	N57 I58 S65	N57-P61 WeakPolarHBondContact O-CD 3.32Å; N57-P61 VanDerWaalsContact O-CG 3.23Å; N57-P61 WeakPolarHBondContact O-CG 3.41Å; I58-P61 WeakPolarHBondContact O-CD 3.29Å; I58-P61 WeakPolarHBondContact O-CG 3.41Å; P61-S65 WeakPolarHBondContact O-CB 3.31Å; P61-S65 PolarHBondContact O-N 3.42Å; P61-S65 PolarHBondContact O-OG 3.01Å
62	F	66.3	Low	63.6	Low	98 Å²	98	79.5 Å²	79.5	43%	0.43	39%	0.39	S	S	.	.	H	α-helix	trans	-60.6	-56	175.8	178.8	-102.7	0	0	0	111.4	L59 R64 S65 V66 L81	L59-F62 HydrophobicContact CD1-CD1 4.27Å; L59-F62 PolarHBondContact O-N 3.49Å; F62-R64 VanDerWaalsContact C-N 3.34Å; F62-R64 PolarHBondContact O-N 3.28Å; F62-S65 PolarHBondContact O-N 3.27Å; F62-S65 VanDerWaalsContact O-N 3.09Å; F62-S65 PolarHBondContact O-OG 3.03Å; F62-V66 HydrophobicContact CD1-CG2 4.5Å; F62-V66 HydrophobicContact CD2-CG2 4.3Å; F62-V66 HydrophobicContact CE1-CG2 4.15Å; F62-V66 HydrophobicContact CE2-CG2 3.94Å; F62-V66 HydrophobicContact CZ-CG2 3.86Å; F62-V66 WeakPolarHBondContact O-CG2 3.18Å; F62-V66 PolarHBondContact O-N 2.97Å; F62-L81 HydrophobicContact CE1-CD1 4.22Å
63	L	65.6	Low	63.5	Low	8 Å²	8	82.1 Å²	82.1	4%	0.042	40%	0.403	C	S	.	.	H	α-helix	trans	-63.4	-37.5	180	-68.5	-179.1	0	0	0	112.9	L59 S65 V66 L67 L81 V85 F310 L314	L59-L63 HydrophobicContact CD1-CD1 4.11Å; L59-L63 HydrophobicContact CD1-CD2 4.41Å; L59-L63 HydrophobicContact CD1-CG 3.94Å; L59-L63 HydrophobicContact CD2-CD1 4.06Å; L59-L63 HydrophobicContact CG-CD1 3.68Å; L59-L63 HydrophobicContact CG-CG 3.92Å; L59-L63 WeakPolarHBondContact O-CB 3.31Å; L59-L63 WeakPolarHBondContact O-CG 3.44Å; L59-L63 PolarHBondContact O-N 3.18Å; L63-S65 VanDerWaalsContact C-N 3.34Å; L63-S65 PolarHBondContact O-N 2.89Å; L63-V66 PolarHBondContact O-N 3.42Å; L63-L67 HydrophobicContact CB-CD1 4.3Å; L63-L67 VanDerWaalsContact O-CB 3.24Å; L63-L67 WeakPolarHBondContact O-CB 3.46Å; L63-L67 WeakPolarHBondContact O-CG 3.41Å; L63-L67 PolarHBondContact O-N 3.42Å; L63-L81 HydrophobicContact CD2-CD1 3.94Å; L63-L81 HydrophobicContact CD2-CD2 3.86Å; L63-L81 HydrophobicContact CD2-CG 3.95Å; L63-V85 HydrophobicContact CD1-CG2 4.2Å; L63-V85 HydrophobicContact CD2-CG2 3.75Å; L63-V85 HydrophobicContact CG-CG2 4.49Å; L63-F310 HydrophobicContact CD1-CE2 4.33Å; L63-F310 HydrophobicContact CD1-CZ 3.93Å; L63-L314 HydrophobicContact CD1-CD1 3.68Å
64	R	65.6	Low	63.6	Low	126 Å²	126	81.4 Å²	81.4	48%	0.475	40%	0.399	S	S	.	.	H	α-helix	trans	-60.4	-43.7	172.1	-75.7	171.9	-176.9	-95.2	2.4	111.5	S60 F62 I68	S60-R64 VanDerWaalsContact O-CB 3.31Å; S60-R64 WeakPolarHBondContact O-CB 3.39Å; S60-R64 WeakPolarHBondContact O-CG 3.22Å; S60-R64 PolarHBondContact O-N 3.49Å; S60-R64 PolarHBondContact OG-NE 3.43Å; F62-R64 VanDerWaalsContact C-N 3.34Å; F62-R64 PolarHBondContact O-N 3.28Å; R64-I68 HydrophobicContact CB-CD1 4.17Å; R64-I68 HydrophobicContact CG-CD1 4.42Å; R64-I68 WeakPolarHBondContact O-CB 3.28Å; R64-I68 WeakPolarHBondContact O-CD1 3.38Å; R64-I68 WeakPolarHBondContact O-CG1 3.34Å; R64-I68 PolarHBondContact O-N 3.16Å
65	S	66.2	Low	63.5	Low	54 Å²	54	78.1 Å²	78.1	38%	0.378	39%	0.393	S	S	.	.	H	α-helix	trans	-63.7	-44.1	178	73.1	0	0	0	0	112.3	P61 F62 L63 K69	P61-S65 WeakPolarHBondContact O-CB 3.31Å; P61-S65 PolarHBondContact O-N 3.42Å; P61-S65 PolarHBondContact O-OG 3.01Å; F62-S65 PolarHBondContact O-N 3.27Å; F62-S65 VanDerWaalsContact O-N 3.09Å; F62-S65 PolarHBondContact O-OG 3.03Å; L63-S65 VanDerWaalsContact C-N 3.34Å; L63-S65 PolarHBondContact O-N 2.89Å; S65-K69 VanDerWaalsContact O-CB 3.3Å; S65-K69 WeakPolarHBondContact O-CB 3.41Å; S65-K69 PolarHBondContact O-N 3.46Å
66	V	63.4	Low	63.7	Low	26 Å²	26	81.7 Å²	81.7	16%	0.158	41%	0.414	C	S	.	.	H	α-helix	trans	-74.2	-45.8	-176.3	173.9	0	0	0	0	112.5	F62 L63 F77 L81	F62-V66 HydrophobicContact CD1-CG2 4.5Å; F62-V66 HydrophobicContact CD2-CG2 4.3Å; F62-V66 HydrophobicContact CE1-CG2 4.15Å; F62-V66 HydrophobicContact CE2-CG2 3.94Å; F62-V66 HydrophobicContact CZ-CG2 3.86Å; F62-V66 WeakPolarHBondContact O-CG2 3.18Å; F62-V66 PolarHBondContact O-N 2.97Å; L63-V66 PolarHBondContact O-N 3.42Å; V66-F77 HydrophobicContact CG1-CE1 3.51Å; V66-F77 HydrophobicContact CG1-CZ 3.54Å; V66-L81 HydrophobicContact CG1-CD1 4.24Å; V66-L81 HydrophobicContact CG1-CD2 3.77Å
67	L	60.4	Low	63.8	Low	14 Å²	14	84 Å²	84	7%	0.073	42%	0.422	C	S	.	.	H	α-helix	trans	-76	-27.4	-176.9	-70.7	167	0	0	0	113.8	L63 N73 L81 L317	L63-L67 HydrophobicContact CB-CD1 4.3Å; L63-L67 VanDerWaalsContact O-CB 3.24Å; L63-L67 WeakPolarHBondContact O-CB 3.46Å; L63-L67 WeakPolarHBondContact O-CG 3.41Å; L63-L67 PolarHBondContact O-N 3.42Å; L67-N73 PolarHBondContact O-ND2 2.88Å; L67-L81 HydrophobicContact CD2-CD2 3.81Å; L67-L81 HydrophobicContact CG-CD2 3.95Å; L67-L317 HydrophobicContact CD1-CB 4.39Å; L67-L317 HydrophobicContact CD1-CD1 4.14Å
68	I	61.9	Low	63.5	Low	118 Å²	118	81 Å²	81	61%	0.605	40%	0.404	S	S	*	.	H	α-helix	trans	-95.2	-35	-175.7	-56.6	172.8	0	0	0	112	R64	R64-I68 HydrophobicContact CB-CD1 4.17Å; R64-I68 HydrophobicContact CG-CD1 4.42Å; R64-I68 WeakPolarHBondContact O-CB 3.28Å; R64-I68 WeakPolarHBondContact O-CD1 3.38Å; R64-I68 WeakPolarHBondContact O-CG1 3.34Å; R64-I68 PolarHBondContact O-N 3.16Å
69	K	59.2	Low	63.3	Low	175 Å²	175	76.4 Å²	76.4	76%	0.761	38%	0.38	S	S	*	.	H	α-helix	trans	-101.6	-22	-170.4	-59.1	-172.7	175	-175.4	0	115.5	S65 K71	S65-K69 VanDerWaalsContact O-CB 3.3Å; S65-K69 WeakPolarHBondContact O-CB 3.41Å; S65-K69 PolarHBondContact O-N 3.46Å; K69-K71 PolarHBondContact O-N 2.98Å
70	D	61.4	Low	63.2	Low	54 Å²	54	81.3 Å²	81.3	29%	0.289	40%	0.402	S	S	.	.			trans	-80.7	121.5	-176.3	-156.7	-24.5	0	0	0	111.6	R72 N73	D70-R72 PolarHBondContact O-N 2.84Å; D70-R72 WeakPolarHBondContact OD1-CB 3.36Å; D70-R72 WeakPolarHBondContact OD1-CG 3.46Å; D70-R72 PolarHBondContact OD1-N 2.84Å; D70-R72 IonicContact OD1-NE 3.32Å; D70-R72 IonicContact OD2-NE 3.74Å; D70-N73 WeakPolarHBondContact O-CB 3.4Å; D70-N73 PolarHBondContact O-N 3.36Å
71	K	60.9	Low	63.3	Low	214 Å²	214	80.3 Å²	80.3	93%	0.93	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-14.8	172.5	-66.6	-174.6	177.4	-176.5	0	112.4	K69 N73	K69-K71 PolarHBondContact O-N 2.98Å; K71-N73 PolarHBondContact O-N 2.9Å
72	R	57.7	Low	63.1	Low	186 Å²	186	78.9 Å²	78.9	70%	0.702	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	25.5	176.5	-57.8	179.1	-117.7	-159.6	-7.2	113.6	D70 T74 F77	D70-R72 PolarHBondContact O-N 2.84Å; D70-R72 WeakPolarHBondContact OD1-CB 3.36Å; D70-R72 WeakPolarHBondContact OD1-CG 3.46Å; D70-R72 PolarHBondContact OD1-N 2.84Å; D70-R72 IonicContact OD1-NE 3.32Å; D70-R72 IonicContact OD2-NE 3.74Å; R72-T74 PolarHBondContact O-N 2.89Å; R72-F77 WeakPolarHBondContact O-CB 3.21Å
73	N	60.2	Low	63.1	Low	62 Å²	62	78.4 Å²	78.4	33%	0.332	38%	0.379	S	S	.	.			trans	-71.7	54.6	-178.9	-163.4	4.1	0	0	0	113.3	L67 D70 K71 K78	L67-N73 PolarHBondContact O-ND2 2.88Å; D70-N73 WeakPolarHBondContact O-CB 3.4Å; D70-N73 PolarHBondContact O-N 3.36Å; K71-N73 PolarHBondContact O-N 2.9Å; N73-K78 WeakPolarHBondContact OD1-CE 3.39Å; N73-K78 VanDerWaalsContact OD1-CG 3.29Å; N73-K78 WeakPolarHBondContact OD1-CG 3.49Å
74	T	66.6	Low	63.3	Low	69 Å²	69	82.9 Å²	82.9	42%	0.423	40%	0.402	S	S	.	.			trans	-73.9	156.8	174.8	63.1	0	0	0	0	110.5	R72 T76 F77 K78	R72-T74 PolarHBondContact O-N 2.89Å; T74-T76 PolarHBondContact O-N 3.33Å; T74-T76 PolarHBondContact OG1-OG1 3.3Å; T74-F77 PolarHBondContact O-N 3.01Å; T74-F77 WeakPolarHBondContact OG1-CB 3.32Å; T74-F77 PolarHBondContact OG1-N 3.46Å; T74-K78 PolarHBondContact O-N 3.45Å
75	A	61.6	Low	63.3	Low	53 Å²	53	77.4 Å²	77.4	44%	0.438	38%	0.382	S	S	.	.	H	α-helix	trans	-56	-37.8	173	0	0	0	0	0	112	K78 L79 L326	A75-K78 PolarHBondContact O-N 2.82Å; A75-L79 PolarHBondContact O-N 2.82Å; A75-L326 HydrophobicContact CB-CD1 4.45Å
76	T	64.6	Low	63.4	Low	85 Å²	85	76 Å²	76	52%	0.521	37%	0.371	S	S	.	.	H	α-helix	trans	-61.9	-42.7	174	50.8	0	0	0	0	112.4	T74 L79 H80	T74-T76 PolarHBondContact O-N 3.33Å; T74-T76 PolarHBondContact OG1-OG1 3.3Å; T76-L79 PolarHBondContact O-N 2.89Å; T76-H80 PolarHBondContact O-N 3.35Å; T76-H80 PolarHBondContact O-ND1 3.18Å
77	F	65.4	Low	63.7	Low	62 Å²	62	78.2 Å²	78.2	27%	0.272	38%	0.382	S	S	.	.	H	α-helix	trans	-66.6	-42.4	177.2	-178.2	-109.1	0	0	0	112.1	V66 R72 T74 L79 H80 L81	V66-F77 HydrophobicContact CG1-CE1 3.51Å; V66-F77 HydrophobicContact CG1-CZ 3.54Å; R72-F77 WeakPolarHBondContact O-CB 3.21Å; T74-F77 PolarHBondContact O-N 3.01Å; T74-F77 WeakPolarHBondContact OG1-CB 3.32Å; T74-F77 PolarHBondContact OG1-N 3.46Å; F77-L79 VanDerWaalsContact C-N 3.29Å; F77-L79 PolarHBondContact O-N 3.07Å; F77-H80 PolarHBondContact O-N 3.34Å; F77-L81 WeakPolarHBondContact O-CB 3.38Å; F77-L81 PolarHBondContact O-N 3.02Å
78	K	61.7	Low	63.9	Low	52 Å²	52	81.6 Å²	81.6	23%	0.226	40%	0.399	C	S	.	.	H	α-helix	trans	-56.8	-42.3	173.5	-67.5	-174.2	-178.7	-170.4	0	112	N73 T74 A75 L81 L82 L318	N73-K78 WeakPolarHBondContact OD1-CE 3.39Å; N73-K78 VanDerWaalsContact OD1-CG 3.29Å; N73-K78 WeakPolarHBondContact OD1-CG 3.49Å; T74-K78 PolarHBondContact O-N 3.45Å; A75-K78 PolarHBondContact O-N 2.82Å; K78-L81 PolarHBondContact O-N 2.67Å; K78-L82 PolarHBondContact O-N 2.93Å; K78-L318 HydrophobicContact CB-CD2 4.49Å
79	L	61.2	Low	64	Low	29 Å²	29	77.8 Å²	77.8	15%	0.152	38%	0.38	C	S	.	.	H	α-helix	trans	-65.7	-46.5	177.7	-173.5	71.1	0	0	0	112.1	A75 T76 F77 L81 L82 Y83 L326	A75-L79 PolarHBondContact O-N 2.82Å; T76-L79 PolarHBondContact O-N 2.89Å; F77-L79 VanDerWaalsContact C-N 3.29Å; F77-L79 PolarHBondContact O-N 3.07Å; L79-L81 VanDerWaalsContact C-N 3.31Å; L79-L81 PolarHBondContact O-N 3.39Å; L79-L82 WeakPolarHBondContact O-CB 3.42Å; L79-L82 PolarHBondContact O-N 3.37Å; L79-Y83 HydrophobicContact CD1-CD2 4.49Å; L79-Y83 HydrophobicContact CD1-CE2 3.85Å; L79-Y83 HydrophobicContact CD2-CE2 3.85Å; L79-Y83 HydrophobicContact CG-CD2 4.02Å; L79-Y83 HydrophobicContact CG-CE2 3.54Å; L79-Y83 WeakPolarHBondContact O-CD2 3.24Å; L79-Y83 PolarHBondContact O-N 2.96Å; L79-L326 HydrophobicContact CB-CD2 4.44Å; L79-L326 HydrophobicContact CD1-CD2 4.01Å; L79-L326 HydrophobicContact CD2-CD2 4.22Å; L79-L326 HydrophobicContact CG-CD2 4.44Å
80	H	65.8	Low	64.2	Low	116 Å²	116	75 Å²	75	54%	0.537	37%	0.369	S	S	.	.	H	α-helix	trans	-62.1	-39.2	176.1	-74.7	78.9	0	0	0	112	T76 F77 L82 Y83 L84	T76-H80 PolarHBondContact O-N 3.35Å; T76-H80 PolarHBondContact O-ND1 3.18Å; F77-H80 PolarHBondContact O-N 3.34Å; H80-L82 VanDerWaalsContact C-N 3.35Å; H80-Y83 PolarHBondContact O-N 3.08Å; H80-L84 WeakPolarHBondContact O-CB 3.37Å; H80-L84 PolarHBondContact O-N 3.1Å
81	L	64.8	Low	64.3	Low	12 Å²	12	78.5 Å²	78.5	6%	0.063	38%	0.382	C	S	.	.	H	α-helix	trans	-64.4	-39.6	175	-174	64.2	0	0	0	111.5	F62 L63 V66 L67 F77 K78 L79 L84 V85	F62-L81 HydrophobicContact CE1-CD1 4.22Å; L63-L81 HydrophobicContact CD2-CD1 3.94Å; L63-L81 HydrophobicContact CD2-CD2 3.86Å; L63-L81 HydrophobicContact CD2-CG 3.95Å; V66-L81 HydrophobicContact CG1-CD1 4.24Å; V66-L81 HydrophobicContact CG1-CD2 3.77Å; L67-L81 HydrophobicContact CD2-CD2 3.81Å; L67-L81 HydrophobicContact CG-CD2 3.95Å; F77-L81 WeakPolarHBondContact O-CB 3.38Å; F77-L81 PolarHBondContact O-N 3.02Å; K78-L81 PolarHBondContact O-N 2.67Å; L79-L81 VanDerWaalsContact C-N 3.31Å; L79-L81 PolarHBondContact O-N 3.39Å; L81-L84 PolarHBondContact O-N 3.46Å; L81-V85 WeakPolarHBondContact O-CB 3.4Å; L81-V85 VanDerWaalsContact O-CG2 3.23Å; L81-V85 WeakPolarHBondContact O-CG2 3.5Å; L81-V85 PolarHBondContact O-N 2.99Å
82	L	63.8	Low	64.2	Low	43 Å²	43	71.2 Å²	71.2	23%	0.225	35%	0.353	C	S	.	.	H	α-helix	trans	-63.7	-46.4	174.8	177.7	59.7	0	0	0	112	K78 L79 H80 L84 V85 N86 L318 W323	K78-L82 PolarHBondContact O-N 2.93Å; L79-L82 WeakPolarHBondContact O-CB 3.42Å; L79-L82 PolarHBondContact O-N 3.37Å; H80-L82 VanDerWaalsContact C-N 3.35Å; L82-L84 VanDerWaalsContact C-N 3.32Å; L82-L84 PolarHBondContact O-N 2.94Å; L82-V85 PolarHBondContact O-N 3.01Å; L82-N86 VanDerWaalsContact O-CB 3.28Å; L82-N86 WeakPolarHBondContact O-CB 3.45Å; L82-N86 PolarHBondContact O-N 3.09Å; L82-L318 HydrophobicContact CD1-CD1 3.83Å; L82-L318 HydrophobicContact CD2-CD1 4.46Å; L82-W323 HydrophobicContact CD2-CH2 3.41Å; L82-W323 VanDerWaalsContact CD2-CH2 3.41Å; L82-W323 HydrophobicContact CD2-CZ2 3.52Å
83	Y	67	Low	64.4	Low	89 Å²	89	66.1 Å²	66.1	35%	0.349	34%	0.339	S	S	.	.	H	α-helix	trans	-61	-41.2	175	-70.4	-51.9	0	0	0	111.7	L79 H80 V85 N86 D87 N281	L79-Y83 HydrophobicContact CD1-CD2 4.49Å; L79-Y83 HydrophobicContact CD1-CE2 3.85Å; L79-Y83 HydrophobicContact CD2-CE2 3.85Å; L79-Y83 HydrophobicContact CG-CD2 4.02Å; L79-Y83 HydrophobicContact CG-CE2 3.54Å; L79-Y83 WeakPolarHBondContact O-CD2 3.24Å; L79-Y83 PolarHBondContact O-N 2.96Å; H80-Y83 PolarHBondContact O-N 3.08Å; Y83-V85 PolarHBondContact O-N 3.5Å; Y83-N86 WeakPolarHBondContact O-CB 3.36Å; Y83-N86 PolarHBondContact O-N 3.28Å; Y83-D87 WeakPolarHBondContact O-CB 3.3Å; Y83-D87 PolarHBondContact O-N 3.41Å; Y83-N281 WeakPolarHBondContact CE1-ND2 3.47Å
84	L	69.9	Low	64.3	Low	102 Å²	102	65.8 Å²	65.8	53%	0.534	34%	0.341	S	S	.	.	H	α-helix	trans	-62.4	-43.1	175.7	-177.7	66.3	0	0	0	112.5	H80 L81 L82 L88	H80-L84 WeakPolarHBondContact O-CB 3.37Å; H80-L84 PolarHBondContact O-N 3.1Å; L81-L84 PolarHBondContact O-N 3.46Å; L82-L84 VanDerWaalsContact C-N 3.32Å; L82-L84 PolarHBondContact O-N 2.94Å; L84-L88 VanDerWaalsContact O-CB 3.24Å; L84-L88 WeakPolarHBondContact O-CB 3.43Å; L84-L88 PolarHBondContact O-N 3.22Å
85	V	66.3	Low	63.9	Low	10 Å²	10	64 Å²	64	6%	0.061	33%	0.331	C	S	.	.	H	α-helix	trans	-64.8	-43.6	175.9	167.9	0	0	0	0	110.9	L59 L63 L81 L82 Y83 L88 L89	L59-V85 HydrophobicContact CD1-CG2 4.33Å; L59-V85 HydrophobicContact CD2-CG1 4.01Å; L63-V85 HydrophobicContact CD1-CG2 4.2Å; L63-V85 HydrophobicContact CD2-CG2 3.75Å; L63-V85 HydrophobicContact CG-CG2 4.49Å; L81-V85 WeakPolarHBondContact O-CB 3.4Å; L81-V85 VanDerWaalsContact O-CG2 3.23Å; L81-V85 WeakPolarHBondContact O-CG2 3.5Å; L81-V85 PolarHBondContact O-N 2.99Å; L82-V85 PolarHBondContact O-N 3.01Å; Y83-V85 PolarHBondContact O-N 3.5Å; V85-L88 PolarHBondContact O-N 3.47Å; V85-L89 HydrophobicContact CG1-CD1 3.73Å; V85-L89 HydrophobicContact CG1-CG 4.36Å; V85-L89 VanDerWaalsContact O-CB 3.32Å; V85-L89 WeakPolarHBondContact O-CB 3.45Å; V85-L89 VanDerWaalsContact O-CG 3.27Å; V85-L89 WeakPolarHBondContact O-CG 3.22Å; V85-L89 PolarHBondContact O-N 3.45Å
86	N	68.7	Low	63.6	Low	25 Å²	25	63.9 Å²	63.9	13%	0.134	32%	0.323	C	S	.	.	H	α-helix	trans	-59.2	-49.7	175.7	175.2	82.8	0	0	0	111.6	L82 Y83 L88 L89 H90 T283	L82-N86 VanDerWaalsContact O-CB 3.28Å; L82-N86 WeakPolarHBondContact O-CB 3.45Å; L82-N86 PolarHBondContact O-N 3.09Å; Y83-N86 WeakPolarHBondContact O-CB 3.36Å; Y83-N86 PolarHBondContact O-N 3.28Å; N86-L88 VanDerWaalsContact C-N 3.35Å; N86-L88 PolarHBondContact O-N 3.31Å; N86-L89 PolarHBondContact O-N 3.23Å; N86-H90 WeakPolarHBondContact O-CB 3.36Å; N86-H90 PolarHBondContact O-N 3.48Å; N86-T283 VanDerWaalsContact OD1-CB 3.28Å; N86-T283 WeakPolarHBondContact OD1-CB 3.25Å; N86-T283 WeakPolarHBondContact OD1-CG2 3.22Å; N86-T283 PolarHBondContact OD1-OG1 3.23Å
87	D	68.7	Low	63.1	Low	73 Å²	73	64.2 Å²	64.2	39%	0.39	32%	0.317	S	S	.	.	H	α-helix	trans	-63.9	-39.4	178.4	-86.7	26	0	0	0	112.4	Y83 K91	Y83-D87 WeakPolarHBondContact O-CB 3.3Å; Y83-D87 PolarHBondContact O-N 3.41Å; D87-K91 VanDerWaalsContact O-CB 3.3Å; D87-K91 WeakPolarHBondContact O-CB 3.36Å; D87-K91 WeakPolarHBondContact O-CD 3.45Å; D87-K91 VanDerWaalsContact O-CG 3.23Å; D87-K91 WeakPolarHBondContact O-CG 3.49Å; D87-K91 PolarHBondContact O-N 2.87Å
88	L	64.5	Low	62.6	Low	84 Å²	84	66.2 Å²	66.2	44%	0.44	33%	0.33	S	S	.	.	H	α-helix	trans	-66.5	-46.4	176.6	-173.6	68.4	0	0	0	110.7	L59 L84 V85 N86 K91 L92	L59-L88 HydrophobicContact CD1-CD2 4.43Å; L84-L88 VanDerWaalsContact O-CB 3.24Å; L84-L88 WeakPolarHBondContact O-CB 3.43Å; L84-L88 PolarHBondContact O-N 3.22Å; V85-L88 PolarHBondContact O-N 3.47Å; N86-L88 VanDerWaalsContact C-N 3.35Å; N86-L88 PolarHBondContact O-N 3.31Å; L88-K91 PolarHBondContact O-N 3.03Å; L88-L92 HydrophobicContact CD1-CD1 4.32Å; L88-L92 HydrophobicContact CG-CD1 3.9Å; L88-L92 VanDerWaalsContact O-CB 3.31Å; L88-L92 WeakPolarHBondContact O-CB 3.35Å; L88-L92 WeakPolarHBondContact O-CG 3.49Å; L88-L92 PolarHBondContact O-N 3.18Å
89	L	64.3	Low	62.3	Low	39 Å²	39	67.4 Å²	67.4	20%	0.204	34%	0.339	C	S	.	.	H	α-helix	trans	-60	-45	174.6	-76.7	167.5	0	0	0	111.3	V85 N86 L92 L93 W307	V85-L89 HydrophobicContact CG1-CD1 3.73Å; V85-L89 HydrophobicContact CG1-CG 4.36Å; V85-L89 VanDerWaalsContact O-CB 3.32Å; V85-L89 WeakPolarHBondContact O-CB 3.45Å; V85-L89 VanDerWaalsContact O-CG 3.27Å; V85-L89 WeakPolarHBondContact O-CG 3.22Å; V85-L89 PolarHBondContact O-N 3.45Å; N86-L89 PolarHBondContact O-N 3.23Å; L89-L92 PolarHBondContact O-N 2.89Å; L89-L93 VanDerWaalsContact O-CB 3.24Å; L89-L93 WeakPolarHBondContact O-CB 3.42Å; L89-L93 WeakPolarHBondContact O-CG 3.19Å; L89-L93 PolarHBondContact O-N 2.89Å; L89-W307 HydrophobicContact CD2-CH2 4.23Å
90	H	63.3	Low	62	Low	116 Å²	116	67.9 Å²	67.9	54%	0.537	35%	0.345	S	S	.	.	H	α-helix	trans	-63.1	-45.3	177.3	-172.7	-79.8	0	0	0	111.9	N86 L92 L93 C94	N86-H90 WeakPolarHBondContact O-CB 3.36Å; N86-H90 PolarHBondContact O-N 3.48Å; H90-L92 PolarHBondContact O-N 3.46Å; H90-L93 PolarHBondContact O-N 3.36Å; H90-C94 PolarHBondContact CE1-SG 2.9Å; H90-C94 WeakPolarHBondContact O-CB 3.27Å; H90-C94 PolarHBondContact O-N 2.74Å; H90-C94 PolarHBondContact O-SG 3.37Å; H90-C94 VanDerWaalsContact O-SG 3.34Å
91	K	63.1	Low	61.4	Low	127 Å²	127	63.4 Å²	63.4	55%	0.552	32%	0.324	S	S	*	.	H	α-helix	trans	-65	-38.1	176.9	-74.8	166.4	-176.5	161.1	0	112.3	D87 L88 S95	D87-K91 VanDerWaalsContact O-CB 3.3Å; D87-K91 WeakPolarHBondContact O-CB 3.36Å; D87-K91 WeakPolarHBondContact O-CD 3.45Å; D87-K91 VanDerWaalsContact O-CG 3.23Å; D87-K91 WeakPolarHBondContact O-CG 3.49Å; D87-K91 PolarHBondContact O-N 2.87Å; L88-K91 PolarHBondContact O-N 3.03Å; K91-S95 WeakPolarHBondContact O-CB 3.4Å; K91-S95 PolarHBondContact O-N 3.34Å
92	L	59.8	Low	60.6	Low	62 Å²	62	69.2 Å²	69.2	33%	0.325	35%	0.352	S	S	.	.	H	α-helix	trans	-68.1	-49.2	174.9	-73	168.5	0	0	0	111.1	L88 L89 H90 S95 L96	L88-L92 HydrophobicContact CD1-CD1 4.32Å; L88-L92 HydrophobicContact CG-CD1 3.9Å; L88-L92 VanDerWaalsContact O-CB 3.31Å; L88-L92 WeakPolarHBondContact O-CB 3.35Å; L88-L92 WeakPolarHBondContact O-CG 3.49Å; L88-L92 PolarHBondContact O-N 3.18Å; L89-L92 PolarHBondContact O-N 2.89Å; H90-L92 PolarHBondContact O-N 3.46Å; L92-S95 PolarHBondContact O-N 2.95Å; L92-L96 WeakPolarHBondContact O-CB 3.44Å; L92-L96 VanDerWaalsContact O-CG 3.26Å; L92-L96 WeakPolarHBondContact O-CG 3.5Å; L92-L96 PolarHBondContact O-N 3.37Å
93	L	61.1	Low	60.5	Low	79 Å²	79	74.9 Å²	74.9	41%	0.414	38%	0.375	S	S	.	.	H	α-helix	trans	-52.1	-58.5	173.6	-86	162.3	0	0	0	111.1	M51 L89 H90 S95 L96 F97	M51-L93 HydrophobicContact CE-CD2 3.42Å; M51-L93 VanDerWaalsContact CE-CD2 3.42Å; M51-L93 HydrophobicContact CE-CG 3.82Å; M51-L93 HydrophobicContact SD-CD2 3.81Å; M51-L93 HydrophobicContact SD-CG 3.79Å; L89-L93 VanDerWaalsContact O-CB 3.24Å; L89-L93 WeakPolarHBondContact O-CB 3.42Å; L89-L93 WeakPolarHBondContact O-CG 3.19Å; L89-L93 PolarHBondContact O-N 2.89Å; H90-L93 PolarHBondContact O-N 3.36Å; L93-S95 PolarHBondContact O-N 3.03Å; L93-L96 PolarHBondContact O-N 3.5Å; L93-F97 WeakPolarHBondContact O-CB 3.35Å; L93-F97 PolarHBondContact O-N 3.46Å
94	C	58.5	Low	60.2	Low	55 Å²	55	73.5 Å²	73.5	37%	0.372	37%	0.372	S	S	.	.	H	α-helix	trans	-60.9	-44.6	-179.5	-67	0	0	0	0	112.4	H90 I98	H90-C94 PolarHBondContact CE1-SG 2.9Å; H90-C94 WeakPolarHBondContact O-CB 3.27Å; H90-C94 PolarHBondContact O-N 2.74Å; H90-C94 PolarHBondContact O-SG 3.37Å; H90-C94 VanDerWaalsContact O-SG 3.34Å; C94-I98 WeakPolarHBondContact O-CD1 3.36Å; C94-I98 VanDerWaalsContact O-CG1 3.29Å; C94-I98 WeakPolarHBondContact O-CG1 3.21Å; C94-I98 PolarHBondContact O-N 3.43Å; C94-I98 VanDerWaalsContact O-N 3.12Å
95	S	57.6	Low	59.6	Low	30 Å²	30	69.7 Å²	69.7	21%	0.21	35%	0.351	C	S	.	.	H	α-helix	trans	-73.7	-26.9	-177.6	-171	0	0	0	0	113.5	K91 L92 L93 N99 R403	K91-S95 WeakPolarHBondContact O-CB 3.4Å; K91-S95 PolarHBondContact O-N 3.34Å; L92-S95 PolarHBondContact O-N 2.95Å; L93-S95 PolarHBondContact O-N 3.03Å; S95-N99 VanDerWaalsContact O-CB 3.28Å; S95-N99 WeakPolarHBondContact O-CB 3.15Å; S95-N99 PolarHBondContact O-N 2.96Å; S95-N99 PolarHBondContact O-ND2 3.07Å; S95-N99 PolarHBondContact OG-ND2 2.98Å; S95-R403 PolarHBondContact OG-NH1 2.96Å; S95-R403 PolarHBondContact OG-NH2 3.32Å
96	L	56.3	Low	59.3	Low	52 Å²	52	75.2 Å²	75.2	27%	0.272	38%	0.376	S	S	.	.	H	α-helix	trans	-84.7	-38.5	176.2	-69.8	171.5	0	0	0	111.3	V47 M51 L92 L93 I98 N99 S100	V47-L96 HydrophobicContact CG1-CB 4.31Å; M51-L96 HydrophobicContact CB-CD1 3.97Å; M51-L96 HydrophobicContact CG-CD1 3.67Å; M51-L96 HydrophobicContact SD-CD1 4.14Å; L92-L96 WeakPolarHBondContact O-CB 3.44Å; L92-L96 VanDerWaalsContact O-CG 3.26Å; L92-L96 WeakPolarHBondContact O-CG 3.5Å; L92-L96 PolarHBondContact O-N 3.37Å; L93-L96 PolarHBondContact O-N 3.5Å; L96-I98 PolarHBondContact O-N 2.94Å; L96-N99 PolarHBondContact O-N 3.3Å; L96-S100 WeakPolarHBondContact O-CB 3.38Å; L96-S100 PolarHBondContact O-N 2.93Å
97	F	54.1	Low	59.6	Low	91 Å²	91	77.7 Å²	77.7	40%	0.399	39%	0.394	S	S	.	.	H	α-helix	trans	-54	-54.5	171.4	-175.2	-97.8	0	0	0	110.3	E44 L93 N99 Q101	E44-F97 HydrophobicContact CG-CE2 4.03Å; L93-F97 WeakPolarHBondContact O-CB 3.35Å; L93-F97 PolarHBondContact O-N 3.46Å; F97-N99 PolarHBondContact O-N 3.37Å; F97-Q101 HydrophobicContact CD2-CG 4.08Å; F97-Q101 HydrophobicContact CE2-CG 4.13Å; F97-Q101 HydrophobicContact CG-CG 4.3Å; F97-Q101 HydrophobicContact CZ-CG 4.38Å; F97-Q101 WeakPolarHBondContact O-CB 3.38Å; F97-Q101 WeakPolarHBondContact O-CG 3.28Å; F97-Q101 PolarHBondContact O-N 2.86Å; F97-Q101 VanDerWaalsContact O-N 3.08Å
98	I	55.2	Low	59.6	Low	105 Å²	105	77.4 Å²	77.4	54%	0.538	39%	0.392	S	S	.	.	H	α-helix	trans	-61.1	-48.3	178.3	-64.4	166.8	0	0	0	111.8	C94 L96 M102	C94-I98 WeakPolarHBondContact O-CD1 3.36Å; C94-I98 VanDerWaalsContact O-CG1 3.29Å; C94-I98 WeakPolarHBondContact O-CG1 3.21Å; C94-I98 PolarHBondContact O-N 3.43Å; C94-I98 VanDerWaalsContact O-N 3.12Å; L96-I98 PolarHBondContact O-N 2.94Å; I98-M102 WeakPolarHBondContact O-CB 3.49Å; I98-M102 WeakPolarHBondContact O-CG 3.29Å; I98-M102 PolarHBondContact O-N 3.39Å
99	N	55.3	Low	59.3	Low	76 Å²	76	78 Å²	78	41%	0.406	40%	0.395	S	S	.	.	H	α-helix	trans	-73.4	-31.8	-173.3	-76.1	-32.1	0	0	0	114.4	S95 L96 F97 R403	S95-N99 VanDerWaalsContact O-CB 3.28Å; S95-N99 WeakPolarHBondContact O-CB 3.15Å; S95-N99 PolarHBondContact O-N 2.96Å; S95-N99 PolarHBondContact O-ND2 3.07Å; S95-N99 PolarHBondContact OG-ND2 2.98Å; L96-N99 PolarHBondContact O-N 3.3Å; F97-N99 PolarHBondContact O-N 3.37Å; N99-R403 PolarHBondContact ND2-NH2 3.38Å
100	S	54.7	Low	59.7	Low	39 Å²	39	79.6 Å²	79.6	27%	0.273	41%	0.409	S	S	.	.	H	α-helix	trans	-86.4	-44.2	-177.3	-160.2	0	0	0	0	111.2	V47 L96 M102 K103 E104	V47-S100 VanDerWaalsContact CG2-CB 3.42Å; V47-S100 WeakPolarHBondContact CG2-OG 3.32Å; L96-S100 WeakPolarHBondContact O-CB 3.38Å; L96-S100 PolarHBondContact O-N 2.93Å; S100-M102 VanDerWaalsContact C-N 3.33Å; S100-M102 PolarHBondContact O-N 2.97Å; S100-K103 PolarHBondContact O-N 2.85Å; S100-E104 PolarHBondContact O-N 3.19Å; S100-E104 VanDerWaalsContact O-N 3.12Å
101	Q	52.3	Low	60.2	Low	22 Å²	22	80.9 Å²	80.9	10%	0.103	41%	0.413	C	S	.	.	H	α-helix	trans	-57.1	-48.8	176.3	-63.2	-89.6	-52.4	0	0	109.5	F97 K103 E104 F105	F97-Q101 HydrophobicContact CD2-CG 4.08Å; F97-Q101 HydrophobicContact CE2-CG 4.13Å; F97-Q101 HydrophobicContact CG-CG 4.3Å; F97-Q101 HydrophobicContact CZ-CG 4.38Å; F97-Q101 WeakPolarHBondContact O-CB 3.38Å; F97-Q101 WeakPolarHBondContact O-CG 3.28Å; F97-Q101 PolarHBondContact O-N 2.86Å; F97-Q101 VanDerWaalsContact O-N 3.08Å; Q101-K103 VanDerWaalsContact C-N 3.26Å; Q101-K103 PolarHBondContact O-N 3.12Å; Q101-K103 VanDerWaalsContact O-N 3.12Å; Q101-E104 PolarHBondContact O-N 3.2Å; Q101-F105 HydrophobicContact CB-CD2 3.96Å; Q101-F105 HydrophobicContact CB-CE2 4.32Å; Q101-F105 HydrophobicContact CG-CE2 4.5Å; Q101-F105 WeakPolarHBondContact O-CB 3.26Å; Q101-F105 WeakPolarHBondContact O-CD2 3.47Å; Q101-F105 PolarHBondContact O-N 3.4Å
102	M	49	Very low	60.4	Low	135 Å²	135	77.2 Å²	77.2	67%	0.665	40%	0.399	S	S	*	.	H	α-helix	trans	-55.9	-36.6	-179.6	-73	-60.6	-59.4	0	0	114	I98 S100 E106	I98-M102 WeakPolarHBondContact O-CB 3.49Å; I98-M102 WeakPolarHBondContact O-CG 3.29Å; I98-M102 PolarHBondContact O-N 3.39Å; S100-M102 VanDerWaalsContact C-N 3.33Å; S100-M102 PolarHBondContact O-N 2.97Å; M102-E106 VanDerWaalsContact O-CB 3.22Å; M102-E106 WeakPolarHBondContact O-CB 3.2Å; M102-E106 PolarHBondContact O-N 2.99Å
103	K	61.1	Low	60.7	Low	161 Å²	161	80.2 Å²	80.2	70%	0.7	41%	0.41	S	S	*	.	H	α-helix	trans	-80	-31.3	-179.4	-71.7	-171.5	173.8	-165.7	0	114.4	S100 Q101 P107	S100-K103 PolarHBondContact O-N 2.85Å; Q101-K103 VanDerWaalsContact C-N 3.26Å; Q101-K103 PolarHBondContact O-N 3.12Å; Q101-K103 VanDerWaalsContact O-N 3.12Å; K103-P107 WeakPolarHBondContact O-CD 3.21Å
104	E	60	Low	61.4	Low	61 Å²	61	81.8 Å²	81.8	29%	0.285	42%	0.415	S	S	.	.	H	α-helix	trans	-86.6	-35.7	-177.6	-163.7	176.3	169.7	0	0	111.3	S100 Q101 P107	S100-E104 PolarHBondContact O-N 3.19Å; S100-E104 VanDerWaalsContact O-N 3.12Å; Q101-E104 PolarHBondContact O-N 3.2Å; E104-P107 WeakPolarHBondContact O-CD 3.4Å; E104-P107 WeakPolarHBondContact O-CG 3.4Å
105	F	57.4	Low	62	Low	22 Å²	22	83.6 Å²	83.6	10%	0.096	42%	0.418	C	S	.	.	H	α-helix	trans	-78.3	-24.5	174.7	-73.9	-77.9	0	0	0	113.7	A39 I40 Q101 I108 L109	A39-F105 VanDerWaalsContact C-CZ 3.47Å; A39-F105 HydrophobicContact CB-CE1 3.69Å; A39-F105 HydrophobicContact CB-CZ 4.21Å; A39-F105 WeakPolarHBondContact O-CZ 3.26Å; I40-F105 HydrophobicContact CB-CZ 4.41Å; I40-F105 HydrophobicContact CG1-CE1 4.02Å; I40-F105 HydrophobicContact CG1-CZ 4.01Å; Q101-F105 HydrophobicContact CB-CD2 3.96Å; Q101-F105 HydrophobicContact CB-CE2 4.32Å; Q101-F105 HydrophobicContact CG-CE2 4.5Å; Q101-F105 WeakPolarHBondContact O-CB 3.26Å; Q101-F105 WeakPolarHBondContact O-CD2 3.47Å; Q101-F105 PolarHBondContact O-N 3.4Å; F105-I108 PolarHBondContact O-N 3.48Å; F105-L109 HydrophobicContact CB-CD1 3.88Å; F105-L109 HydrophobicContact CB-CG 4.17Å; F105-L109 VanDerWaalsContact O-CB 3.22Å; F105-L109 WeakPolarHBondContact O-CB 3.32Å; F105-L109 VanDerWaalsContact O-CG 3.25Å; F105-L109 WeakPolarHBondContact O-CG 3.42Å; F105-L109 PolarHBondContact O-N 2.97Å
106	E	61.1	Low	62.4	Low	125 Å²	125	88.3 Å²	88.3	58%	0.584	44%	0.435	S	S	*	.	H	α-helix	trans	-49.2	-57.6	176.9	176.4	169.3	-145.9	0	0	113.3	M102 I108 L109 S110	M102-E106 VanDerWaalsContact O-CB 3.22Å; M102-E106 WeakPolarHBondContact O-CB 3.2Å; M102-E106 PolarHBondContact O-N 2.99Å; E106-I108 VanDerWaalsContact C-N 3.34Å; E106-I108 PolarHBondContact O-N 2.79Å; E106-L109 PolarHBondContact O-N 3.48Å; E106-S110 WeakPolarHBondContact O-CB 3.46Å; E106-S110 PolarHBondContact O-N 3.3Å; E106-S110 PolarHBondContact O-OG 3.31Å
107	P	74.2	Confident	63.1	Low	78 Å²	78	90.1 Å²	90.1	51%	0.506	44%	0.442	S	S	.	.	H	α-helix	trans	-66	-32.6	178.7	26.1	-35.4	0	0	0	113.6	K103 E104 K111	K103-P107 WeakPolarHBondContact O-CD 3.21Å; E104-P107 WeakPolarHBondContact O-CD 3.4Å; E104-P107 WeakPolarHBondContact O-CG 3.4Å; P107-K111 WeakPolarHBondContact O-CB 3.49Å; P107-K111 PolarHBondContact O-N 2.96Å; P107-K111 VanDerWaalsContact O-N 3.07Å
108	I	69.6	Low	64.4	Low	67 Å²	67	89.2 Å²	89.2	34%	0.344	44%	0.44	S	S	.	.	H	α-helix	trans	-70.3	-48.2	179.7	-62.1	173.6	0	0	0	110.2	F105 E106 K111 I112	F105-I108 PolarHBondContact O-N 3.48Å; E106-I108 VanDerWaalsContact C-N 3.34Å; E106-I108 PolarHBondContact O-N 2.79Å; I108-K111 PolarHBondContact O-N 2.9Å; I108-I112 HydrophobicContact CG2-CD1 3.83Å; I108-I112 VanDerWaalsContact O-CG1 3.3Å; I108-I112 WeakPolarHBondContact O-CG1 2.98Å; I108-I112 PolarHBondContact O-N 2.84Å
109	L	56.9	Low	65.1	Low	97 Å²	97	88.5 Å²	88.5	51%	0.508	43%	0.431	S	S	.	.	H	α-helix	trans	-64	-42	176.6	-71	171.8	0	0	0	111.1	F105 E106 K111 I112 F113	F105-L109 HydrophobicContact CB-CD1 3.88Å; F105-L109 HydrophobicContact CB-CG 4.17Å; F105-L109 VanDerWaalsContact O-CB 3.22Å; F105-L109 WeakPolarHBondContact O-CB 3.32Å; F105-L109 VanDerWaalsContact O-CG 3.25Å; F105-L109 WeakPolarHBondContact O-CG 3.42Å; F105-L109 PolarHBondContact O-N 2.97Å; E106-L109 PolarHBondContact O-N 3.48Å; L109-K111 VanDerWaalsContact C-N 3.34Å; L109-K111 PolarHBondContact O-N 3.48Å; L109-I112 PolarHBondContact O-N 3.47Å; L109-F113 WeakPolarHBondContact O-CB 3.22Å; L109-F113 PolarHBondContact O-N 3.36Å
110	S	72.6	Confident	65.8	Low	72 Å²	72	91.5 Å²	91.5	50%	0.503	44%	0.438	S	S	.	.	H	α-helix	trans	-57.3	-47.1	173.3	-66	0	0	0	0	111.5	E106 F113 E114	E106-S110 WeakPolarHBondContact O-CB 3.46Å; E106-S110 PolarHBondContact O-N 3.3Å; E106-S110 PolarHBondContact O-OG 3.31Å; S110-F113 PolarHBondContact O-N 2.87Å; S110-E114 WeakPolarHBondContact O-CB 3.31Å; S110-E114 PolarHBondContact O-N 3.12Å
111	K	75.1	Confident	67.1	Low	142 Å²	142	97.7 Å²	97.7	62%	0.617	46%	0.455	S	S	*	.	H	α-helix	trans	-66	-40.4	178.3	-172.8	175.6	-177.8	177.8	0	112.8	P107 I108 L109 Q115	P107-K111 WeakPolarHBondContact O-CB 3.49Å; P107-K111 PolarHBondContact O-N 2.96Å; P107-K111 VanDerWaalsContact O-N 3.07Å; I108-K111 PolarHBondContact O-N 2.9Å; L109-K111 VanDerWaalsContact C-N 3.34Å; L109-K111 PolarHBondContact O-N 3.48Å; K111-Q115 WeakPolarHBondContact O-CB 3.33Å; K111-Q115 VanDerWaalsContact O-CG 3.22Å; K111-Q115 WeakPolarHBondContact O-CG 3.26Å; K111-Q115 PolarHBondContact O-N 3.49Å
112	I	65.9	Low	68.4	Low	51 Å²	51	101.8 Å²	101.8	26%	0.262	47%	0.474	S	S	.	.	H	α-helix	trans	-64.3	-42.8	175.3	-70.5	169	0	0	0	110.4	I32 V36 I108 L109 Q115 F116	I32-I112 HydrophobicContact CG2-CG2 4.32Å; V36-I112 HydrophobicContact CG2-CD1 3.9Å; I108-I112 HydrophobicContact CG2-CD1 3.83Å; I108-I112 VanDerWaalsContact O-CG1 3.3Å; I108-I112 WeakPolarHBondContact O-CG1 2.98Å; I108-I112 PolarHBondContact O-N 2.84Å; L109-I112 PolarHBondContact O-N 3.47Å; I112-Q115 PolarHBondContact O-N 2.94Å; I112-F116 WeakPolarHBondContact O-CB 3.36Å; I112-F116 PolarHBondContact O-N 3.45Å
113	F	66.2	Low	69.6	Low	124 Å²	124	99.3 Å²	99.3	54%	0.544	46%	0.458	S	S	.	.	H	α-helix	trans	-67.4	-41.1	179.6	-168.6	-100.8	0	0	0	112.1	L109 S110 F116 Q117	L109-F113 WeakPolarHBondContact O-CB 3.22Å; L109-F113 PolarHBondContact O-N 3.36Å; S110-F113 PolarHBondContact O-N 2.87Å; F113-F116 PolarHBondContact O-N 3.32Å; F113-Q117 HydrophobicContact CD1-CG 4.27Å; F113-Q117 HydrophobicContact CE1-CG 4.05Å; F113-Q117 HydrophobicContact CZ-CG 4.45Å; F113-Q117 WeakPolarHBondContact O-CG 3.27Å; F113-Q117 PolarHBondContact O-N 3.3Å
114	E	76.7	Confident	70.4	Confident	112 Å²	112	95.8 Å²	95.8	52%	0.523	44%	0.444	S	S	.	.	H	α-helix	trans	-60.7	-49.3	172.8	-177	-177	-157	0	0	111.4	S110 F116 Q117 I118	S110-E114 WeakPolarHBondContact O-CB 3.31Å; S110-E114 PolarHBondContact O-N 3.12Å; E114-F116 VanDerWaalsContact C-N 3.3Å; E114-F116 PolarHBondContact O-N 3.08Å; E114-Q117 PolarHBondContact O-N 3.46Å; E114-I118 HydrophobicContact CG-CD1 3.97Å; E114-I118 VanDerWaalsContact O-CG1 3.31Å; E114-I118 WeakPolarHBondContact O-CG1 3.43Å; E114-I118 PolarHBondContact O-N 3.01Å
115	Q	70.4	Confident	71.6	Confident	93 Å²	93	95.5 Å²	95.5	44%	0.435	45%	0.449	S	S	.	.	H	α-helix	trans	-59.1	-40.7	175.5	-73.4	-70.3	-47.5	0	0	112.2	K111 I112 R119	K111-Q115 WeakPolarHBondContact O-CB 3.33Å; K111-Q115 VanDerWaalsContact O-CG 3.22Å; K111-Q115 WeakPolarHBondContact O-CG 3.26Å; K111-Q115 PolarHBondContact O-N 3.49Å; I112-Q115 PolarHBondContact O-N 2.94Å; Q115-R119 PolarHBondContact O-N 3.19Å; Q115-R119 VanDerWaalsContact O-N 3.09Å
116	F	66.7	Low	72.7	Confident	130 Å²	130	100 Å²	100	57%	0.57	47%	0.47	S	S	*	.	H	α-helix	trans	-65.1	-45.2	176	-174.4	-95.3	0	0	0	111.8	I112 F113 E114 I118 R119 Y120	I112-F116 WeakPolarHBondContact O-CB 3.36Å; I112-F116 PolarHBondContact O-N 3.45Å; F113-F116 PolarHBondContact O-N 3.32Å; E114-F116 VanDerWaalsContact C-N 3.3Å; E114-F116 PolarHBondContact O-N 3.08Å; F116-I118 PolarHBondContact O-N 3.3Å; F116-R119 PolarHBondContact O-N 3.43Å; F116-Y120 VanDerWaalsContact O-CB 3.31Å; F116-Y120 WeakPolarHBondContact O-CB 3.41Å; F116-Y120 PolarHBondContact O-N 3.26Å
117	Q	71.2	Confident	73.7	Confident	89 Å²	89	99.8 Å²	99.8	42%	0.416	47%	0.469	S	S	.	.	H	α-helix	trans	-63	-40.3	175.9	-77.8	-161.3	-16.7	0	0	112.9	F113 E114 Y120 R121	F113-Q117 HydrophobicContact CD1-CG 4.27Å; F113-Q117 HydrophobicContact CE1-CG 4.05Å; F113-Q117 HydrophobicContact CZ-CG 4.45Å; F113-Q117 WeakPolarHBondContact O-CG 3.27Å; F113-Q117 PolarHBondContact O-N 3.3Å; E114-Q117 PolarHBondContact O-N 3.46Å; Q117-Y120 PolarHBondContact O-N 3.11Å; Q117-R121 PolarHBondContact O-N 3.07Å
118	I	80.6	Confident	74.3	Confident	72 Å²	72	100.4 Å²	100.4	37%	0.369	47%	0.467	S	S	.	.	H	α-helix	trans	-61.6	-49.7	176.7	-70	165.7	0	0	0	110.1	E114 F116 R121 Q122	E114-I118 HydrophobicContact CG-CD1 3.97Å; E114-I118 VanDerWaalsContact O-CG1 3.31Å; E114-I118 WeakPolarHBondContact O-CG1 3.43Å; E114-I118 PolarHBondContact O-N 3.01Å; F116-I118 PolarHBondContact O-N 3.3Å; I118-R121 PolarHBondContact O-N 2.93Å; I118-Q122 WeakPolarHBondContact O-CG 3.39Å; I118-Q122 PolarHBondContact O-N 3.46Å
119	R	69.2	Low	75.1	Confident	90 Å²	90	102.5 Å²	102.5	34%	0.34	48%	0.476	S	S	.	.	H	α-helix	trans	-63.8	-41.8	176.9	-72	-169.9	-171.3	167.2	6.6	112.3	Q115 F116 R121 Q122 Y123	Q115-R119 PolarHBondContact O-N 3.19Å; Q115-R119 VanDerWaalsContact O-N 3.09Å; F116-R119 PolarHBondContact O-N 3.43Å; R119-R121 VanDerWaalsContact C-N 3.33Å; R119-R121 PolarHBondContact O-N 2.99Å; R119-Q122 WeakPolarHBondContact O-CB 3.17Å; R119-Q122 PolarHBondContact O-N 2.91Å; R119-Q122 VanDerWaalsContact O-N 3.13Å; R119-Y123 HydrophobicContact CB-CD2 4.49Å; R119-Y123 HydrophobicContact CB-CE2 4.46Å; R119-Y123 WeakPolarHBondContact O-CD2 3.49Å; R119-Y123 PolarHBondContact O-N 3.45Å
120	Y	71.6	Confident	76.5	Confident	140 Å²	140	102.2 Å²	102.2	55%	0.549	47%	0.471	S	S	.	.	H	α-helix	trans	-56.4	-47.5	177.1	-178.9	-93.4	0	0	0	111.1	F116 Q117 Q122 Y123 E124	F116-Y120 VanDerWaalsContact O-CB 3.31Å; F116-Y120 WeakPolarHBondContact O-CB 3.41Å; F116-Y120 PolarHBondContact O-N 3.26Å; Q117-Y120 PolarHBondContact O-N 3.11Å; Y120-Q122 VanDerWaalsContact C-N 3.33Å; Y120-Q122 PolarHBondContact O-N 3.49Å; Y120-Y123 PolarHBondContact O-N 3.43Å; Y120-E124 WeakPolarHBondContact O-CB 3.44Å; Y120-E124 PolarHBondContact O-N 2.99Å
121	R	80.6	Confident	77	Confident	168 Å²	168	100.9 Å²	100.9	63%	0.634	46%	0.46	S	S	*	.	H	α-helix	trans	-65.9	-31.4	176.4	-73.1	-154.8	-88.7	-154.8	-4.2	113.8	Q117 I118 R119 S125	Q117-R121 PolarHBondContact O-N 3.07Å; I118-R121 PolarHBondContact O-N 2.93Å; R119-R121 VanDerWaalsContact C-N 3.33Å; R119-R121 PolarHBondContact O-N 2.99Å; R121-S125 WeakPolarHBondContact O-CB 3.48Å; R121-S125 PolarHBondContact O-N 3.43Å
122	Q	81.2	Confident	77.8	Confident	109 Å²	109	101 Å²	101	51%	0.509	46%	0.456	S	S	.	.	H	α-helix	trans	-65.4	-46.2	171.7	-71.7	170.6	-16.1	0	0	111.7	I118 R119 Y120 S125 Q126	I118-Q122 WeakPolarHBondContact O-CG 3.39Å; I118-Q122 PolarHBondContact O-N 3.46Å; R119-Q122 WeakPolarHBondContact O-CB 3.17Å; R119-Q122 PolarHBondContact O-N 2.91Å; R119-Q122 VanDerWaalsContact O-N 3.13Å; Y120-Q122 VanDerWaalsContact C-N 3.33Å; Y120-Q122 PolarHBondContact O-N 3.49Å; Q122-S125 PolarHBondContact O-N 3.43Å; Q122-Q126 WeakPolarHBondContact O-CG 3.11Å; Q122-Q126 PolarHBondContact O-N 3.45Å
123	Y	72.6	Confident	78.8	Confident	82 Å²	82	104.6 Å²	104.6	32%	0.322	47%	0.467	S	S	.	.	H	α-helix	trans	-65.6	-39.9	175.9	-77	-65.8	0	0	0	112.6	L25 R119 Y120 Q126 H127	L25-Y123 HydrophobicContact CD2-CD2 4.48Å; L25-Y123 HydrophobicContact CD2-CE2 3.64Å; R119-Y123 HydrophobicContact CB-CD2 4.49Å; R119-Y123 HydrophobicContact CB-CE2 4.46Å; R119-Y123 WeakPolarHBondContact O-CD2 3.49Å; R119-Y123 PolarHBondContact O-N 3.45Å; Y120-Y123 PolarHBondContact O-N 3.43Å; Y123-Q126 PolarHBondContact O-N 2.92Å; Y123-H127 WeakPolarHBondContact O-CB 3.3Å; Y123-H127 PolarHBondContact O-N 3.3Å
124	E	78.3	Confident	79.7	Confident	87 Å²	87	100.9 Å²	100.9	41%	0.407	46%	0.455	S	S	.	.	H	α-helix	trans	-59.5	-46.6	174.1	-177.2	177.2	-147.4	0	0	111.3	Y120 H127 L128	Y120-E124 WeakPolarHBondContact O-CB 3.44Å; Y120-E124 PolarHBondContact O-N 2.99Å; E124-H127 PolarHBondContact O-N 2.95Å; E124-L128 HydrophobicContact CG-CD1 4.21Å; E124-L128 WeakPolarHBondContact O-CB 3.46Å; E124-L128 WeakPolarHBondContact O-CG 3.37Å; E124-L128 PolarHBondContact O-N 2.88Å
125	S	85.1	Confident	80.4	Confident	56 Å²	56	100.5 Å²	100.5	39%	0.392	45%	0.453	S	S	.	.	H	α-helix	trans	-61.2	-45.7	175.9	-166.7	0	0	0	0	112.3	R121 Q122 H127 L128 E129	R121-S125 WeakPolarHBondContact O-CB 3.48Å; R121-S125 PolarHBondContact O-N 3.43Å; Q122-S125 PolarHBondContact O-N 3.43Å; S125-H127 VanDerWaalsContact C-N 3.32Å; S125-H127 PolarHBondContact O-N 2.65Å; S125-L128 PolarHBondContact O-N 2.79Å; S125-E129 WeakPolarHBondContact O-CG 3.17Å; S125-E129 PolarHBondContact O-N 2.96Å
126	Q	81.7	Confident	81.4	Confident	116 Å²	116	102.2 Å²	102.2	54%	0.542	46%	0.461	S	S	.	.	H	α-helix	trans	-62.3	-39.4	176.6	-72.3	173.9	8.7	0	0	111.9	Q122 Y123 E129 F130	Q122-Q126 WeakPolarHBondContact O-CG 3.11Å; Q122-Q126 PolarHBondContact O-N 3.45Å; Y123-Q126 PolarHBondContact O-N 2.92Å; Q126-E129 PolarHBondContact O-N 3.35Å; Q126-F130 WeakPolarHBondContact O-CB 3.36Å; Q126-F130 PolarHBondContact O-N 3.4Å
127	H	81.5	Confident	82.5	Confident	120 Å²	120	99.4 Å²	99.4	56%	0.556	45%	0.45	S	S	*	.	H	α-helix	trans	-66	-43.8	176.3	-171.9	69.5	0	0	0	111.6	Y123 E124 S125 E129 F130 V131	Y123-H127 WeakPolarHBondContact O-CB 3.3Å; Y123-H127 PolarHBondContact O-N 3.3Å; E124-H127 PolarHBondContact O-N 2.95Å; S125-H127 VanDerWaalsContact C-N 3.32Å; S125-H127 PolarHBondContact O-N 2.65Å; H127-E129 VanDerWaalsContact C-N 3.33Å; H127-E129 PolarHBondContact O-N 3.14Å; H127-F130 PolarHBondContact O-N 3.47Å; H127-V131 WeakPolarHBondContact O-CG2 3.21Å; H127-V131 PolarHBondContact O-N 3.21Å
128	L	87.1	Confident	83.3	Confident	91 Å²	91	99.4 Å²	99.4	48%	0.476	45%	0.451	S	S	.	.	H	α-helix	trans	-65.6	-31.7	176.3	-72.1	170.1	0	0	0	113.4	E124 S125 R132	E124-L128 HydrophobicContact CG-CD1 4.21Å; E124-L128 WeakPolarHBondContact O-CB 3.46Å; E124-L128 WeakPolarHBondContact O-CG 3.37Å; E124-L128 PolarHBondContact O-N 2.88Å; S125-L128 PolarHBondContact O-N 2.79Å; L128-R132 WeakPolarHBondContact O-CB 3.31Å; L128-R132 WeakPolarHBondContact O-CG 3.42Å; L128-R132 PolarHBondContact O-N 3.38Å; L128-R132 PolarHBondContact O-NE 2.84Å
129	E	87	Confident	83.8	Confident	111 Å²	111	102.2 Å²	102.2	52%	0.519	46%	0.463	S	S	.	.	H	α-helix	trans	-70.5	-43.2	171	-75.4	176.8	-179.6	0	0	111.8	S125 Q126 H127 R132 Y133	S125-E129 WeakPolarHBondContact O-CG 3.17Å; S125-E129 PolarHBondContact O-N 2.96Å; Q126-E129 PolarHBondContact O-N 3.35Å; H127-E129 VanDerWaalsContact C-N 3.33Å; H127-E129 PolarHBondContact O-N 3.14Å; E129-R132 PolarHBondContact O-N 3.39Å; E129-Y133 WeakPolarHBondContact O-CB 3.42Å; E129-Y133 PolarHBondContact O-N 3Å
130	F	84.8	Confident	84.8	Confident	92 Å²	92	101.7 Å²	101.7	40%	0.404	47%	0.467	S	S	.	.	H	α-helix	trans	-61.6	-45.2	175.5	178.4	-98.2	0	0	0	112.1	L14 Q126 H127 Y133 T134	L14-F130 HydrophobicContact CD1-CE2 4.13Å; L14-F130 HydrophobicContact CD2-CE2 4.37Å; L14-F130 HydrophobicContact CD2-CZ 4.13Å; Q126-F130 WeakPolarHBondContact O-CB 3.36Å; Q126-F130 PolarHBondContact O-N 3.4Å; H127-F130 PolarHBondContact O-N 3.47Å; F130-Y133 PolarHBondContact O-N 3.5Å; F130-T134 HydrophobicContact CD1-CG2 4.37Å; F130-T134 HydrophobicContact CE1-CG2 3.86Å; F130-T134 HydrophobicContact CE2-CG2 4.07Å; F130-T134 HydrophobicContact CZ-CG2 3.69Å; F130-T134 WeakPolarHBondContact O-CG2 3.28Å; F130-T134 PolarHBondContact O-N 3.42Å; F130-T134 PolarHBondContact O-OG1 2.86Å
131	V	84.4	Confident	85.6	Confident	44 Å²	44	100.3 Å²	100.3	27%	0.267	47%	0.468	S	S	.	.	H	α-helix	trans	-58	-54.3	175.6	169.8	0	0	0	0	110.4	H127 Y133 T134 E135	H127-V131 WeakPolarHBondContact O-CG2 3.21Å; H127-V131 PolarHBondContact O-N 3.21Å; V131-Y133 VanDerWaalsContact C-N 3.29Å; V131-Y133 PolarHBondContact O-N 2.95Å; V131-T134 WeakPolarHBondContact CA-OG1 3.22Å; V131-T134 PolarHBondContact O-N 3.3Å; V131-T134 PolarHBondContact O-OG1 2.82Å; V131-E135 HydrophobicContact CG1-CG 4.33Å; V131-E135 WeakPolarHBondContact O-CG 3.45Å; V131-E135 PolarHBondContact O-N 3.46Å
132	R	90.1	Very high	86.1	Confident	144 Å²	144	98.7 Å²	98.7	54%	0.543	47%	0.465	S	S	.	.	H	α-helix	trans	-55.2	-42.1	177.2	-81.1	179.2	-78.5	161.2	-6	112.9	L128 E129 E135 Q136	L128-R132 WeakPolarHBondContact O-CB 3.31Å; L128-R132 WeakPolarHBondContact O-CG 3.42Å; L128-R132 PolarHBondContact O-N 3.38Å; L128-R132 PolarHBondContact O-NE 2.84Å; E129-R132 PolarHBondContact O-N 3.39Å; R132-E135 PolarHBondContact O-N 2.93Å; R132-Q136 WeakPolarHBondContact O-CB 3.37Å; R132-Q136 PolarHBondContact O-N 2.63Å
133	Y	88.8	Confident	86.5	Confident	126 Å²	126	96.1 Å²	96.1	49%	0.494	46%	0.46	S	S	.	.	H	α-helix	trans	-63.3	-43.6	175.3	172.3	-100.4	0	0	0	112.2	E129 F130 V131 Q136 Q137	E129-Y133 WeakPolarHBondContact O-CB 3.42Å; E129-Y133 PolarHBondContact O-N 3Å; F130-Y133 PolarHBondContact O-N 3.5Å; V131-Y133 VanDerWaalsContact C-N 3.29Å; V131-Y133 PolarHBondContact O-N 2.95Å; Y133-Q136 PolarHBondContact O-N 2.98Å; Y133-Q137 HydrophobicContact CD2-CG 4.47Å; Y133-Q137 HydrophobicContact CE1-CG 4.12Å; Y133-Q137 HydrophobicContact CE2-CG 4.03Å; Y133-Q137 VanDerWaalsContact O-CG 3.32Å; Y133-Q137 WeakPolarHBondContact O-CG 3.36Å; Y133-Q137 PolarHBondContact O-N 2.84Å; Y133-Q137 PolarHBondContact OH-NE2 3.46Å
134	T	84.2	Confident	87.3	Confident	46 Å²	46	96.2 Å²	96.2	28%	0.282	47%	0.466	S	S	.	.	H	α-helix	trans	-67.1	-37.5	177	52.8	0	0	0	0	113	F130 V131 Q137 I138	F130-T134 HydrophobicContact CD1-CG2 4.37Å; F130-T134 HydrophobicContact CE1-CG2 3.86Å; F130-T134 HydrophobicContact CE2-CG2 4.07Å; F130-T134 HydrophobicContact CZ-CG2 3.69Å; F130-T134 WeakPolarHBondContact O-CG2 3.28Å; F130-T134 PolarHBondContact O-N 3.42Å; F130-T134 PolarHBondContact O-OG1 2.86Å; V131-T134 WeakPolarHBondContact CA-OG1 3.22Å; V131-T134 PolarHBondContact O-N 3.3Å; V131-T134 PolarHBondContact O-OG1 2.82Å; T134-Q137 PolarHBondContact O-N 3.27Å; T134-I138 WeakPolarHBondContact O-CD1 3.48Å; T134-I138 VanDerWaalsContact O-CG1 3.26Å; T134-I138 WeakPolarHBondContact O-CG1 3.24Å; T134-I138 PolarHBondContact O-N 2.96Å
135	E	90.8	Very high	87.7	Confident	104 Å²	104	96.6 Å²	96.6	49%	0.486	47%	0.47	S	S	.	.	H	α-helix	trans	-62.5	-48.6	174.2	-70.5	173.5	148.3	0	0	111	V131 R132 Q137 I138 E139	V131-E135 HydrophobicContact CG1-CG 4.33Å; V131-E135 WeakPolarHBondContact O-CG 3.45Å; V131-E135 PolarHBondContact O-N 3.46Å; R132-E135 PolarHBondContact O-N 2.93Å; E135-Q137 VanDerWaalsContact C-N 3.31Å; E135-Q137 PolarHBondContact O-N 3.17Å; E135-I138 WeakPolarHBondContact O-CB 3.47Å; E135-I138 PolarHBondContact O-N 3.32Å; E135-I138 VanDerWaalsContact O-N 3.07Å; E135-E139 PolarHBondContact O-N 2.96Å
136	Q	92.7	Very high	88	Confident	129 Å²	129	97.6 Å²	97.6	60%	0.603	47%	0.474	S	S	*	.	H	α-helix	trans	-58.6	-40.2	176.4	-171.7	-178.2	19.2	0	0	112.4	R132 Y133 E139 N140	R132-Q136 WeakPolarHBondContact O-CB 3.37Å; R132-Q136 PolarHBondContact O-N 2.63Å; Y133-Q136 PolarHBondContact O-N 2.98Å; Q136-E139 PolarHBondContact O-N 3.04Å; Q136-N140 WeakPolarHBondContact O-CB 3.46Å; Q136-N140 PolarHBondContact O-N 3.12Å
137	Q	88.3	Confident	88.2	Confident	71 Å²	71	96.2 Å²	96.2	33%	0.332	47%	0.47	S	S	.	.	H	α-helix	trans	-67.8	-37.6	175.5	-70.3	-72.6	23.5	0	0	112.2	Y133 T134 E135 N140 I141	Y133-Q137 HydrophobicContact CD2-CG 4.47Å; Y133-Q137 HydrophobicContact CE1-CG 4.12Å; Y133-Q137 HydrophobicContact CE2-CG 4.03Å; Y133-Q137 VanDerWaalsContact O-CG 3.32Å; Y133-Q137 WeakPolarHBondContact O-CG 3.36Å; Y133-Q137 PolarHBondContact O-N 2.84Å; Y133-Q137 PolarHBondContact OH-NE2 3.46Å; T134-Q137 PolarHBondContact O-N 3.27Å; E135-Q137 VanDerWaalsContact C-N 3.31Å; E135-Q137 PolarHBondContact O-N 3.17Å; Q137-N140 PolarHBondContact O-N 3.01Å; Q137-I141 WeakPolarHBondContact O-CB 3.23Å; Q137-I141 WeakPolarHBondContact O-CD1 3.33Å; Q137-I141 VanDerWaalsContact O-CG1 3.26Å; Q137-I141 WeakPolarHBondContact O-CG1 3.3Å; Q137-I141 PolarHBondContact O-N 3.44Å
138	I	88.4	Confident	88.5	Confident	89 Å²	89	95.1 Å²	95.1	46%	0.456	47%	0.471	S	S	.	.	H	α-helix	trans	-64.3	-41.7	174	-71.2	163.1	0	0	0	110.8	T134 E135 I141 K142	T134-I138 WeakPolarHBondContact O-CD1 3.48Å; T134-I138 VanDerWaalsContact O-CG1 3.26Å; T134-I138 WeakPolarHBondContact O-CG1 3.24Å; T134-I138 PolarHBondContact O-N 2.96Å; E135-I138 WeakPolarHBondContact O-CB 3.47Å; E135-I138 PolarHBondContact O-N 3.32Å; E135-I138 VanDerWaalsContact O-N 3.07Å; I138-I141 PolarHBondContact O-N 2.93Å; I138-K142 HydrophobicContact CG2-CD 4.08Å; I138-K142 WeakPolarHBondContact O-CB 3.23Å; I138-K142 VanDerWaalsContact O-CG 3.28Å; I138-K142 WeakPolarHBondContact O-CG 3.38Å; I138-K142 PolarHBondContact O-N 3.47Å
139	E	91	Very high	88.5	Confident	132 Å²	132	96.2 Å²	96.2	62%	0.617	47%	0.474	S	S	*	.	H	α-helix	trans	-64.2	-44.5	175.9	-71.6	-173.9	160.3	0	0	112.5	E135 Q136 I141 K142 S143	E135-E139 PolarHBondContact O-N 2.96Å; Q136-E139 PolarHBondContact O-N 3.04Å; E139-I141 VanDerWaalsContact C-N 3.34Å; E139-I141 PolarHBondContact O-N 3.35Å; E139-K142 WeakPolarHBondContact O-CB 3.46Å; E139-K142 PolarHBondContact O-N 3.42Å; E139-S143 PolarHBondContact O-N 3Å; E139-S143 PolarHBondContact O-OG 3.48Å
140	N	90.5	Very high	88.4	Confident	79 Å²	79	96.7 Å²	96.7	42%	0.422	48%	0.476	S	S	.	.	H	α-helix	trans	-61	-41.4	175.2	-171.4	9.7	0	0	0	111.7	Q136 Q137 S143 N144	Q136-N140 WeakPolarHBondContact O-CB 3.46Å; Q136-N140 PolarHBondContact O-N 3.12Å; Q137-N140 PolarHBondContact O-N 3.01Å; N140-S143 PolarHBondContact O-OG 3.25Å; N140-N144 WeakPolarHBondContact O-CB 3.47Å; N140-N144 VanDerWaalsContact O-CG 3.27Å; N140-N144 PolarHBondContact O-N 3.23Å; N140-N144 VanDerWaalsContact O-N 3.12Å; N140-N144 PolarHBondContact O-ND2 3.39Å; N140-N144 PolarHBondContact OD1-ND2 2.92Å
141	I	88.7	Confident	88.3	Confident	111 Å²	111	95.6 Å²	95.6	57%	0.569	48%	0.48	S	S	*	.	H	α-helix	trans	-65.4	-40.4	174.7	-68.9	165.5	0	0	0	111.1	Q137 I138 E139 L145	Q137-I141 WeakPolarHBondContact O-CB 3.23Å; Q137-I141 WeakPolarHBondContact O-CD1 3.33Å; Q137-I141 VanDerWaalsContact O-CG1 3.26Å; Q137-I141 WeakPolarHBondContact O-CG1 3.3Å; Q137-I141 PolarHBondContact O-N 3.44Å; I138-I141 PolarHBondContact O-N 2.93Å; E139-I141 VanDerWaalsContact C-N 3.34Å; E139-I141 PolarHBondContact O-N 3.35Å; I141-L145 WeakPolarHBondContact O-CB 3.17Å; I141-L145 PolarHBondContact O-N 3.47Å
142	K	90.8	Very high	88.4	Confident	133 Å²	133	97.9 Å²	97.9	58%	0.578	49%	0.491	S	S	*	.	H	α-helix	trans	-63.3	-46.1	176.6	-75.8	169.4	178.6	174.5	0	112.4	I138 E139 L145 V146	I138-K142 HydrophobicContact CG2-CD 4.08Å; I138-K142 WeakPolarHBondContact O-CB 3.23Å; I138-K142 VanDerWaalsContact O-CG 3.28Å; I138-K142 WeakPolarHBondContact O-CG 3.38Å; I138-K142 PolarHBondContact O-N 3.47Å; E139-K142 WeakPolarHBondContact O-CB 3.46Å; E139-K142 PolarHBondContact O-N 3.42Å; K142-L145 PolarHBondContact O-N 2.86Å; K142-V146 WeakPolarHBondContact O-CG2 3.07Å; K142-V146 PolarHBondContact O-N 3.36Å
143	S	89.3	Confident	87.9	Confident	55 Å²	55	96.7 Å²	96.7	39%	0.385	49%	0.494	S	S	.	.	H	α-helix	trans	-64.6	-41.5	179.4	61.5	0	0	0	0	111.8	E139 N140 L145 V146 N147	E139-S143 PolarHBondContact O-N 3Å; E139-S143 PolarHBondContact O-OG 3.48Å; N140-S143 PolarHBondContact O-OG 3.25Å; S143-L145 VanDerWaalsContact C-N 3.33Å; S143-L145 PolarHBondContact O-N 3.47Å; S143-V146 PolarHBondContact O-N 3.36Å; S143-N147 PolarHBondContact O-N 2.96Å; S143-N147 PolarHBondContact O-ND2 2.98Å
144	N	89.7	Confident	87.5	Confident	84 Å²	84	95.8 Å²	95.8	45%	0.449	50%	0.497	S	S	.	.	H	α-helix	trans	-62.3	-38.4	173.8	-71.2	-44.9	0	0	0	112.4	N140 N147 V148	N140-N144 WeakPolarHBondContact O-CB 3.47Å; N140-N144 VanDerWaalsContact O-CG 3.27Å; N140-N144 PolarHBondContact O-N 3.23Å; N140-N144 VanDerWaalsContact O-N 3.12Å; N140-N144 PolarHBondContact O-ND2 3.39Å; N140-N144 PolarHBondContact OD1-ND2 2.92Å; N144-N147 PolarHBondContact O-N 2.88Å; N144-V148 WeakPolarHBondContact O-CG2 3.2Å; N144-V148 PolarHBondContact O-N 3.44Å
145	L	87.2	Confident	87.1	Confident	95 Å²	95	99.7 Å²	99.7	50%	0.497	51%	0.512	S	S	.	.	H	α-helix	trans	-65.9	-41.4	176.4	-170.4	149	0	0	0	112	I141 K142 S143 V148 Q149	I141-L145 WeakPolarHBondContact O-CB 3.17Å; I141-L145 PolarHBondContact O-N 3.47Å; K142-L145 PolarHBondContact O-N 2.86Å; S143-L145 VanDerWaalsContact C-N 3.33Å; S143-L145 PolarHBondContact O-N 3.47Å; L145-V148 PolarHBondContact O-N 3.26Å; L145-Q149 HydrophobicContact CD2-CG 4.21Å; L145-Q149 WeakPolarHBondContact O-CG 3.2Å; L145-Q149 PolarHBondContact O-N 2.95Å
146	V	90	Very high	86.5	Confident	78 Å²	78	99.1 Å²	99.1	47%	0.473	51%	0.512	S	S	.	.	H	α-helix	trans	-63	-45.1	174.1	172.1	0	0	0	0	111.2	K142 S143 V148 Q149 Q150	K142-V146 WeakPolarHBondContact O-CG2 3.07Å; K142-V146 PolarHBondContact O-N 3.36Å; S143-V146 PolarHBondContact O-N 3.36Å; V146-V148 VanDerWaalsContact C-N 3.34Å; V146-V148 PolarHBondContact O-N 3.47Å; V146-Q149 PolarHBondContact O-N 2.94Å; V146-Q150 PolarHBondContact O-N 3.19Å
147	N	87.2	Confident	85.1	Confident	87 Å²	87	95.9 Å²	95.9	47%	0.465	50%	0.503	S	S	.	.	H	α-helix	trans	-58.7	-44.9	177.2	-69	-20.1	0	0	0	111.6	S143 N144 Q150 S151	S143-N147 PolarHBondContact O-N 2.96Å; S143-N147 PolarHBondContact O-ND2 2.98Å; N144-N147 PolarHBondContact O-N 2.88Å; N147-Q150 PolarHBondContact O-N 3.44Å; N147-S151 PolarHBondContact O-N 3.47Å; N147-S151 PolarHBondContact O-OG 2.71Å; N147-S151 VanDerWaalsContact O-OG 3.04Å
148	V	87.7	Confident	83.8	Confident	96 Å²	96	99.2 Å²	99.2	58%	0.582	52%	0.519	S	S	*	.	H	α-helix	trans	-63.8	-42.9	176.3	170.2	0	0	0	0	111.7	N144 L145 V146 Q150 S151 L152	N144-V148 WeakPolarHBondContact O-CG2 3.2Å; N144-V148 PolarHBondContact O-N 3.44Å; L145-V148 PolarHBondContact O-N 3.26Å; V146-V148 VanDerWaalsContact C-N 3.34Å; V146-V148 PolarHBondContact O-N 3.47Å; V148-Q150 VanDerWaalsContact C-N 3.34Å; V148-Q150 PolarHBondContact O-N 3.4Å; V148-S151 PolarHBondContact O-N 3.4Å; V148-L152 WeakPolarHBondContact O-CB 3.15Å; V148-L152 PolarHBondContact O-N 2.73Å
149	Q	86.5	Confident	82.3	Confident	115 Å²	115	102.9 Å²	102.9	54%	0.537	53%	0.532	S	S	.	.	H	α-helix	trans	-61.5	-41.4	175.6	-77.1	-179.9	-29.4	0	0	112.2	L145 V146 L152 L153	L145-Q149 HydrophobicContact CD2-CG 4.21Å; L145-Q149 WeakPolarHBondContact O-CG 3.2Å; L145-Q149 PolarHBondContact O-N 2.95Å; V146-Q149 PolarHBondContact O-N 2.94Å; Q149-L152 PolarHBondContact O-N 2.75Å; Q149-L153 PolarHBondContact O-N 3.18Å
150	Q	85.4	Confident	80.6	Confident	120 Å²	120	101.6 Å²	101.6	56%	0.561	53%	0.533	S	S	*	.	H	α-helix	trans	-70.4	-39.7	179.7	-165.9	167.3	22.3	0	0	112.2	V146 N147 V148 L152 L153 L154	V146-Q150 PolarHBondContact O-N 3.19Å; N147-Q150 PolarHBondContact O-N 3.44Å; V148-Q150 VanDerWaalsContact C-N 3.34Å; V148-Q150 PolarHBondContact O-N 3.4Å; Q150-L152 VanDerWaalsContact C-N 3.3Å; Q150-L152 PolarHBondContact O-N 2.94Å; Q150-L153 PolarHBondContact O-N 3.5Å; Q150-L154 WeakPolarHBondContact O-CG 3.27Å; Q150-L154 PolarHBondContact O-N 3.34Å; Q150-L154 VanDerWaalsContact O-N 3.11Å
151	S	83.1	Confident	78.7	Confident	69 Å²	69	105.6 Å²	105.6	48%	0.483	55%	0.551	S	S	.	*	H	α-helix	trans	-60.1	-40.2	171.1	-59	0	0	0	0	112.3	N147 V148 L154 Q155	N147-S151 PolarHBondContact O-N 3.47Å; N147-S151 PolarHBondContact O-OG 2.71Å; N147-S151 VanDerWaalsContact O-OG 3.04Å; V148-S151 PolarHBondContact O-N 3.4Å; S151-L154 PolarHBondContact O-N 2.89Å; S151-Q155 WeakPolarHBondContact O-CG 3.31Å; S151-Q155 PolarHBondContact O-N 2.88Å; S151-Q155 VanDerWaalsContact O-N 3.12Å
152	L	85	Confident	76.9	Confident	93 Å²	93	106.7 Å²	106.7	49%	0.487	56%	0.558	S	S	.	*	H	α-helix	trans	-72.1	-33.9	-179.5	-163.8	140.8	0	0	0	112.3	V148 Q149 Q150 Q155 I156	V148-L152 WeakPolarHBondContact O-CB 3.15Å; V148-L152 PolarHBondContact O-N 2.73Å; Q149-L152 PolarHBondContact O-N 2.75Å; Q150-L152 VanDerWaalsContact C-N 3.3Å; Q150-L152 PolarHBondContact O-N 2.94Å; L152-Q155 PolarHBondContact O-N 3.46Å; L152-I156 HydrophobicContact CD2-CD1 3.67Å; L152-I156 WeakPolarHBondContact O-CG1 3.24Å; L152-I156 PolarHBondContact O-N 2.8Å; L152-I156 VanDerWaalsContact O-N 3.11Å
153	L	81.2	Confident	74.7	Confident	119 Å²	119	105.6 Å²	105.6	62%	0.623	56%	0.563	S	S	*	*	H	α-helix	trans	-63.9	-41.6	170.3	-80.2	168.4	0	0	0	112.6	Q149 Q150 I156 S157	Q149-L153 PolarHBondContact O-N 3.18Å; Q150-L153 PolarHBondContact O-N 3.5Å; L153-I156 PolarHBondContact O-N 3.39Å; L153-S157 PolarHBondContact O-N 2.86Å
154	L	78.9	Confident	72.8	Confident	106 Å²	106	111.1 Å²	111.1	56%	0.555	59%	0.586	S	S	*	*	H	α-helix	trans	-62	-46.5	176.1	-71.5	169.5	0	0	0	111.2	Q150 S151 I156 S157 E158	Q150-L154 WeakPolarHBondContact O-CG 3.27Å; Q150-L154 PolarHBondContact O-N 3.34Å; Q150-L154 VanDerWaalsContact O-N 3.11Å; S151-L154 PolarHBondContact O-N 2.89Å; L154-I156 VanDerWaalsContact C-N 3.32Å; L154-I156 PolarHBondContact O-N 3.38Å; L154-S157 PolarHBondContact O-N 3.26Å; L154-S157 PolarHBondContact O-OG 3.23Å; L154-E158 PolarHBondContact O-N 3.41Å
155	Q	77.5	Confident	71.2	Confident	128 Å²	128	112.1 Å²	112.1	60%	0.598	60%	0.597	S	S	*	*	H	α-helix	trans	-58.8	-39.2	176.1	-73.2	179.5	-22.6	0	0	113.1	S151 L152 S157 E158 F159	S151-Q155 WeakPolarHBondContact O-CG 3.31Å; S151-Q155 PolarHBondContact O-N 2.88Å; S151-Q155 VanDerWaalsContact O-N 3.12Å; L152-Q155 PolarHBondContact O-N 3.46Å; Q155-S157 VanDerWaalsContact C-N 3.34Å; Q155-E158 PolarHBondContact O-N 3.02Å; Q155-F159 PolarHBondContact O-N 3.49Å; Q155-F159 VanDerWaalsContact O-N 3.15Å
156	I	76.7	Confident	69.4	Low	93 Å²	93	113.4 Å²	113.4	48%	0.477	61%	0.611	S	S	.	*	H	α-helix	trans	-67	-35.8	175.1	-68.1	168	0	0	0	111.4	L152 L153 L154 F159 T160	L152-I156 HydrophobicContact CD2-CD1 3.67Å; L152-I156 WeakPolarHBondContact O-CG1 3.24Å; L152-I156 PolarHBondContact O-N 2.8Å; L152-I156 VanDerWaalsContact O-N 3.11Å; L153-I156 PolarHBondContact O-N 3.39Å; L154-I156 VanDerWaalsContact C-N 3.32Å; L154-I156 PolarHBondContact O-N 3.38Å; I156-F159 PolarHBondContact O-N 2.9Å; I156-T160 WeakPolarHBondContact O-CG2 3.32Å; I156-T160 PolarHBondContact O-N 3.45Å; I156-T160 PolarHBondContact O-OG1 3.32Å
157	S	64.1	Low	67	Low	61 Å²	61	114.2 Å²	114.2	43%	0.427	63%	0.626	S	S	.	*	H	α-helix	trans	-68.2	-37.7	177.3	76.2	0	0	0	0	113	L153 L154 Q155 T160	L153-S157 PolarHBondContact O-N 2.86Å; L154-S157 PolarHBondContact O-N 3.26Å; L154-S157 PolarHBondContact O-OG 3.23Å; Q155-S157 VanDerWaalsContact C-N 3.34Å; S157-T160 PolarHBondContact O-N 3.21Å; S157-T160 PolarHBondContact O-OG1 3.39Å
158	E	60.3	Low	65.3	Low	141 Å²	141	116.4 Å²	116.4	66%	0.659	64%	0.643	S	S	*	*	H	α-helix	trans	-67.5	-37.4	174.7	-69.3	-177.6	153.4	0	0	111.7	L154 Q155 T160	L154-E158 PolarHBondContact O-N 3.41Å; Q155-E158 PolarHBondContact O-N 3.02Å; E158-T160 VanDerWaalsContact C-N 3.32Å; E158-T160 PolarHBondContact O-N 3.17Å
159	F	57.9	Low	63.1	Low	165 Å²	165	118.1 Å²	118.1	72%	0.724	65%	0.649	S	S	*	*	H	α-helix	trans	-72.2	-21.9	179.3	-135.4	-85.9	0	0	0	113.8	Q155 I156	Q155-F159 PolarHBondContact O-N 3.49Å; Q155-F159 VanDerWaalsContact O-N 3.15Å; I156-F159 PolarHBondContact O-N 2.9Å
160	T	54.6	Low	60.8	Low	106 Å²	106	119.7 Å²	119.7	65%	0.65	66%	0.66	S	S	*	*	H	α-helix	trans	-93.4	-9.3	-175.9	43.5	0	0	0	0	114.8	I156 S157 E158	I156-T160 WeakPolarHBondContact O-CG2 3.32Å; I156-T160 PolarHBondContact O-N 3.45Å; I156-T160 PolarHBondContact O-OG1 3.32Å; S157-T160 PolarHBondContact O-N 3.21Å; S157-T160 PolarHBondContact O-OG1 3.39Å; E158-T160 VanDerWaalsContact C-N 3.32Å; E158-T160 PolarHBondContact O-N 3.17Å
161	M	51.6	Low	58.5	Low	162 Å²	162	120.1 Å²	120.1	80%	0.798	67%	0.671	S	S	*	*	S	Bend	trans	-99.2	-7.4	175.1	-79.1	-71.5	166.2	0	0	114.4
162	N	49.8	Very low	56.6	Low	134 Å²	134	122 Å²	122	72%	0.717	68%	0.684	S	S	*	*	S	Bend	trans	-136.7	76.5	-177	-74	-55.2	0	0	0	112.6
163	T	45.6	Very low	54.2	Low	111 Å²	111	122.9 Å²	122.9	68%	0.681	70%	0.698	S	S	*	*			trans	-175.9	106.7	144.4	16.3	0	0	0	0	111.8	P165	T163-P165 WeakPolarHBondContact O-CD 3.41Å
164	I	48.9	Very low	52.5	Low	170 Å²	170	122.8 Å²	122.8	87%	0.872	70%	0.703	S	S	*	*			trans	-92.9	111.8	155	-63.4	168.9	0	0	0	105.8
165	P	55.2	Low	50.6	Low	105 Å²	105	124.5 Å²	124.5	68%	0.682	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-93.8	129.4	-175.8	33.6	-30.8	0	0	0	111.8	T163	T163-P165 WeakPolarHBondContact O-CD 3.41Å
166	P	49.5	Very low	49	Very low	122 Å²	122	127.7 Å²	127.7	79%	0.792	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-76.7	140.4	154.8	32.3	-29.9	0	0	0	109.3
167	A	41.3	Very low	47.2	Very low	95 Å²	95	130 Å²	130	79%	0.785	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-68.1	154.2	174.5	0	0	0	0	0	112
168	V	50.6	Low	46.1	Very low	134 Å²	134	134 Å²	134	81%	0.812	75%	0.75	S	S	*	*				-179.3	124.2	126.1	150.4	0	0	0	0	111.4
169	N	40.7	Very low	45.2	Very low	131 Å²	131	133.8 Å²	133.8	70%	0.701	75%	0.753	S	S	*	*			trans	20.7	120.9	154.1	-59.5	-18.8	0	0	0	123.4
170	L	38.9	Very low	44.7	Very low	149 Å²	149	131 Å²	131	78%	0.78	75%	0.752	S	S	*	*				27	117.8	116	-66.6	127.8	0	0	0	118.6
171	T	37.7	Very low	43.9	Very low	129 Å²	129	136.4 Å²	136.4	79%	0.791	76%	0.76	S	S	*	*				170.1	165.2	100.5	37	0	0	0	0	112.7
172	S	42	Very low	43.7	Very low	109 Å²	109	137.2 Å²	137.2	76%	0.762	77%	0.766	S	S	*	*			trans	74.3	103.5	163.1	66.9	0	0	0	0	119.7
173	S	36.2	Very low	43.6	Very low	111 Å²	111	137.8 Å²	137.8	78%	0.776	77%	0.77	S	S	*	*			trans	-41.3	146	151	50.6	0	0	0	0	116.1
174	T	45.2	Very low	43.5	Very low	117 Å²	117	138.5 Å²	138.5	72%	0.718	78%	0.776	S	S	*	*			trans	-151.4	160.4	134	-8.5	0	0	0	0	111.6
175	N	37.7	Very low	43.2	Very low	141 Å²	141	140.8 Å²	140.8	75%	0.754	77%	0.774	S	S	*	*			trans	-123.3	125.2	-157.4	178.4	21.1	0	0	0	109.6
176	Y	44.4	Very low	42.5	Very low	196 Å²	196	143 Å²	143	77%	0.769	78%	0.779	S	S	*	*			trans	-135.6	139.9	177.9	-53.1	-66.1	0	0	0	112.9
177	N	39.7	Very low	42.2	Very low	141 Å²	141	144.7 Å²	144.7	75%	0.754	78%	0.779	S	S	*	*			trans	-76.1	141.7	-164.7	-82.6	-65	0	0	0	115.8
178	L	39.2	Very low	42.3	Very low	146 Å²	146	148.6 Å²	148.6	76%	0.764	79%	0.786	S	S	*	*				20	124.2	123.6	-71.5	153.3	0	0	0	119.4
179	D	42.1	Very low	41.5	Very low	135 Å²	135	151.3 Å²	151.3	72%	0.722	78%	0.782	S	S	*	*			trans	-142.8	114.5	135	-169.6	0.7	0	0	0	110.5
180	P	47.1	Very low	41.4	Very low	108 Å²	108	153.6 Å²	153.6	70%	0.701	79%	0.786	S	S	*	*			trans	-107.5	87.2	179.2	36.6	-27.3	0	0	0	112.3
181	R	38.3	Very low	41.5	Very low	219 Å²	219	153.1 Å²	153.1	83%	0.826	78%	0.78	S	S	*	*			trans	-137.5	73.6	178.2	-77.3	-172.3	153.9	-170	-4	114.9
182	L	47.7	Very low	41.7	Very low	178 Å²	178	157.1 Å²	157.1	93%	0.932	79%	0.787	S	S	*	*			trans	-134.6	135	161.5	-77.7	174.2	0	0	0	111.9
183	N	47.7	Very low	41.4	Very low	147 Å²	147	156.6 Å²	156.6	79%	0.786	79%	0.789	S	S	*	*			trans	-75.2	130.1	-166.3	-103.8	-43.1	0	0	0	114.1	R185	N183-R185 PolarHBondContact O-N 3.37Å
184	P	42.5	Very low	41.7	Very low	125 Å²	125	154.9 Å²	154.9	81%	0.812	79%	0.788	S	S	*	*			trans	-90	68.6	165.4	35.8	-32.6	0	0	0	111
185	R	42.8	Very low	41.7	Very low	219 Å²	219	155.5 Å²	155.5	83%	0.826	80%	0.795	S	S	*	*			trans	-143	63.5	175.9	-81.3	-168.5	171.7	174.9	-1.3	112.6	N183	N183-R185 PolarHBondContact O-N 3.37Å
186	D	41.6	Very low	41.6	Very low	150 Å²	150	156.5 Å²	156.5	80%	0.802	81%	0.805	S	S	*	*			trans	-160.4	40.5	167	-110.6	-28.3	0	0	0	114.7
187	M	43.2	Very low	41.3	Very low	159 Å²	159	150 Å²	150	78%	0.783	80%	0.798	S	S	*	*			trans	-107.7	19.4	-179.7	-77.5	-74.6	120.6	0	0	114.5
188	N	42.1	Very low	41.3	Very low	176 Å²	176	149 Å²	149	94%	0.941	80%	0.803	S	S	*	*			trans	-107	43	176.3	-89.4	-6.2	0	0	0	112.6
189	R	34.5	Very low	41.4	Very low	192 Å²	192	150 Å²	150	73%	0.725	81%	0.805	S	S	*	*			trans	-149.6	53.2	177.7	-151.7	178.8	-175.1	166.4	3	116.1	Q191	R189-Q191 VanDerWaalsContact C-N 3.31Å; R189-Q191 HydrophobicContact CG-CG 4.21Å; R189-Q191 PolarHBondContact O-N 2.99Å
190	F	38.7	Very low	41.8	Very low	179 Å²	179	148.9 Å²	148.9	79%	0.785	81%	0.805	S	S	*	*			trans	-87.5	77.6	154.7	-78.1	-76	0	0	0	109.8	F192	F190-F192 PolarHBondContact O-N 3.39Å
191	Q	40.3	Very low	41.7	Very low	138 Å²	138	148.8 Å²	148.8	65%	0.645	81%	0.805	S	S	*	*			trans	-71.3	115.5	162.6	-70.3	-179.5	-69.1	0	0	107.6	R189 A193	R189-Q191 VanDerWaalsContact C-N 3.31Å; R189-Q191 HydrophobicContact CG-CG 4.21Å; R189-Q191 PolarHBondContact O-N 2.99Å; Q191-A193 PolarHBondContact O-N 2.97Å; Q191-A193 VanDerWaalsContact O-N 3.09Å
192	F	43	Very low	41.5	Very low	214 Å²	214	142 Å²	142	94%	0.939	80%	0.795	S	S	*	*			trans	-64.3	108.7	169.4	-82.3	-92.9	0	0	0	108.9	F190	F190-F192 PolarHBondContact O-N 3.39Å
193	A	35.4	Very low	41.1	Very low	98 Å²	98	144.8 Å²	144.8	81%	0.81	79%	0.794	S	S	*	*			trans	-119.6	114	173.5	0	0	0	0	0	109.2	Q191	Q191-A193 PolarHBondContact O-N 2.97Å; Q191-A193 VanDerWaalsContact O-N 3.09Å
194	G	42.8	Very low	40.5	Very low	74 Å²	74	144.6 Å²	144.6	76%	0.763	79%	0.792	S	S	*	*			trans	136.8	143.7	173.4	0	0	0	0	0	113.8
195	P	44.4	Very low	40.1	Very low	131 Å²	131	146 Å²	146	85%	0.851	79%	0.788	S	S	*	*			cis	-112.5	161.5	-37.9	36.5	-26.5	0	0	0	111.6	G197	P195-G197 PolarHBondContact O-N 3.41Å
196	V	37.3	Very low	39.5	Very low	161 Å²	161	145.3 Å²	145.3	98%	0.976	79%	0.786	S	S	*	*			trans	-72.1	121.4	179.2	-175.6	0	0	0	0	110.1
197	G	37	Very low	39.3	Very low	60 Å²	60	147.6 Å²	147.6	62%	0.619	79%	0.789	S	S	*	*			trans	-171.2	106.7	178.3	0	0	0	0	0	115.2	P195	P195-G197 PolarHBondContact O-N 3.41Å
198	S	40.8	Very low	39	Very low	121 Å²	121	146.4 Å²	146.4	85%	0.846	79%	0.79	S	S	*	*			trans	48.3	97	161.9	56.7	0	0	0	0	119.5
199	M	40.8	Very low	38.7	Very low	165 Å²	165	146 Å²	146	81%	0.813	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-71.7	140	153.9	-85.9	173.9	63.4	0	0	111.6
200	P	50.4	Low	38.6	Very low	113 Å²	113	140.2 Å²	140.2	73%	0.734	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-75.7	158.6	147.1	-7.1	25.6	0	0	0	110.6
201	P	44.1	Very low	38.6	Very low	106 Å²	106	140.6 Å²	140.6	69%	0.688	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-78.1	147.5	-158	30.5	-36.5	0	0	0	114.7	W203	P201-W203 PolarHBondContact O-N 3.07Å
202	A	35.5	Very low	38.6	Very low	75 Å²	75	142 Å²	142	62%	0.62	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-66	122.1	165.8	0	0	0	0	0	110.5
203	W	38.6	Very low	38.4	Very low	238 Å²	238	138.3 Å²	138.3	90%	0.902	78%	0.778	S	S	*	*			trans	-99.9	93.9	163.4	-84.7	29.9	0	0	0	108.7	P201	P201-W203 PolarHBondContact O-N 3.07Å
204	N	35.6	Very low	38.6	Very low	142 Å²	142	141.7 Å²	141.7	76%	0.759	78%	0.783	S	S	*	*			trans	-72.7	157.9	166	-74.7	-15.1	0	0	0	110.3
205	E	33.1	Very low	38.7	Very low	154 Å²	154	146.9 Å²	146.9	72%	0.72	79%	0.789	S	S	*	*	S	Bend	trans	76.2	126	165.4	-69	-168.5	-145.9	0	0	119.8
206	R	30.8	Very low	38.9	Very low	206 Å²	206	145.7 Å²	145.7	78%	0.777	78%	0.781	S	S	*	*			trans	74.8	65.7	156.3	-57.4	166.3	-155.5	-146.5	3.9	118.8
207	F	37.5	Very low	39.2	Very low	198 Å²	198	143.6 Å²	143.6	87%	0.868	77%	0.771	S	S	*	*			trans	-132.9	99.5	130.3	-100.5	-81	0	0	0	110.6	M209	F207-M209 PolarHBondContact O-N 2.98Å; F207-M209 VanDerWaalsContact O-N 3.16Å
208	V	36.4	Very low	39.6	Very low	133 Å²	133	146.4 Å²	146.4	81%	0.806	78%	0.778	S	S	*	*			trans	-78.5	94.4	170.1	-179.9	0	0	0	0	107.5	P210	V208-P210 WeakPolarHBondContact O-CD 3.38Å
209	M	35.3	Very low	39.9	Very low	168 Å²	168	150.1 Å²	150.1	83%	0.828	78%	0.78	S	S	*	*			trans	-87.5	110.2	160.3	-82.2	-71	-173.1	0	0	107.7	F207	F207-M209 PolarHBondContact O-N 2.98Å; F207-M209 VanDerWaalsContact O-N 3.16Å
210	P	32.9	Very low	39.8	Very low	70 Å²	70	149.9 Å²	149.9	46%	0.455	78%	0.78	S	S	.	*			trans	-84.4	152.9	-179.5	34.5	-34	0	0	0	111.5	V208	V208-P210 WeakPolarHBondContact O-CD 3.38Å
211	F	38	Very low	39.9	Very low	188 Å²	188	150.8 Å²	150.8	83%	0.825	78%	0.784	S	S	*	*	S	Bend	trans	75.2	145.2	169.9	-26.8	-63.5	0	0	0	116.7
212	I	40.9	Very low	40.1	Very low	166 Å²	166	151.7 Å²	151.7	85%	0.851	79%	0.787	S	S	*	*			trans	75.8	61.1	177.1	-38.4	168.2	0	0	0	115.6
213	V	38.5	Very low	40.3	Very low	138 Å²	138	153.7 Å²	153.7	84%	0.836	79%	0.794	S	S	*	*			trans	-136.8	149.4	147	-97.7	0	0	0	0	108
214	N	40.1	Very low	40.5	Very low	168 Å²	168	152 Å²	152	90%	0.898	79%	0.793	S	S	*	*			trans	75.4	55.7	-173.2	-57.3	-14.7	0	0	0	117.1
215	M	44.9	Very low	40.5	Very low	184 Å²	184	150.2 Å²	150.2	91%	0.906	80%	0.798	S	S	*	*			trans	-113.3	122.5	154.3	-147.4	170.2	-173.3	0	0	109.1
216	P	47.5	Very low	40.7	Very low	105 Å²	105	146 Å²	146	68%	0.682	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-68.4	157.6	179	29	-34.6	0	0	0	111
217	P	43.7	Very low	41	Very low	118 Å²	118	143.6 Å²	143.6	77%	0.766	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-56.2	135	-177.3	-24.4	33.5	0	0	0	112	K219	P217-K219 PolarHBondContact O-N 3.36Å
218	P	46.2	Very low	41.1	Very low	118 Å²	118	139.3 Å²	139.3	77%	0.766	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-57.7	129.3	172.3	-23	33.4	0	0	0	110.3	L220	P218-L220 PolarHBondContact O-N 3.26Å
219	K	47.5	Very low	41.1	Very low	200 Å²	200	138.3 Å²	138.3	87%	0.87	78%	0.784	S	S	*	*			trans	-62.9	107.6	172.9	-70.5	-179.7	178.5	178.3	0	108.6	P217 V221	P217-K219 PolarHBondContact O-N 3.36Å; K219-V221 PolarHBondContact O-N 2.97Å
220	L	38.6	Very low	41.1	Very low	159 Å²	159	137.4 Å²	137.4	83%	0.832	79%	0.788	S	S	*	*			trans	-62.8	99.6	176.7	-72.9	169.7	0	0	0	109.9	P218 V222	P218-L220 PolarHBondContact O-N 3.26Å; L220-V222 PolarHBondContact O-N 3.21Å
221	V	52.2	Low	41.2	Very low	132 Å²	132	138.8 Å²	138.8	80%	0.8	80%	0.799	S	S	*	*			trans	-71.2	111.8	165.9	178.3	0	0	0	0	107.2	K219 P223	K219-V221 PolarHBondContact O-N 2.97Å; V221-P223 VanDerWaalsContact O-CD 3.28Å; V221-P223 WeakPolarHBondContact O-CD 3.39Å
222	V	48.3	Very low	40.9	Very low	125 Å²	125	133.8 Å²	133.8	76%	0.758	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-57.6	119.2	178.7	179	0	0	0	0	109.6	L220 K224	L220-V222 PolarHBondContact O-N 3.21Å; V222-K224 PolarHBondContact O-N 3.16Å
223	P	40.3	Very low	40.8	Very low	118 Å²	118	135.4 Å²	135.4	77%	0.766	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-66	119.5	174	-19.6	33.2	0	0	0	109.6	V221 A225	V221-P223 VanDerWaalsContact O-CD 3.28Å; V221-P223 WeakPolarHBondContact O-CD 3.39Å; P223-A225 PolarHBondContact O-N 3.43Å
224	K	42.8	Very low	40.8	Very low	202 Å²	202	135.7 Å²	135.7	88%	0.878	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-59.8	121.4	177.1	-173.9	172.9	-178.4	176.1	0	109.5	V222 G226	V222-K224 PolarHBondContact O-N 3.16Å; K224-G226 PolarHBondContact O-N 3.48Å; K224-G226 VanDerWaalsContact O-N 3.16Å
225	A	35.7	Very low	41.1	Very low	104 Å²	104	131.3 Å²	131.3	86%	0.86	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-58	119.3	178.5	0	0	0	0	0	110.4	P223	P223-A225 PolarHBondContact O-N 3.43Å
226	G	36.9	Very low	41.4	Very low	65 Å²	65	126.6 Å²	126.6	67%	0.67	75%	0.754	S	S	*	*			trans	-174.7	79.2	-173.9	0	0	0	0	0	109.8	K224 P228	K224-G226 PolarHBondContact O-N 3.48Å; K224-G226 VanDerWaalsContact O-N 3.16Å; G226-P228 VanDerWaalsContact O-CD 3.26Å; G226-P228 WeakPolarHBondContact O-CD 3.49Å
227	L	37.1	Very low	41.7	Very low	156 Å²	156	126 Å²	126	82%	0.817	75%	0.752	S	S	*	*			trans	-67.8	116.8	179.1	-148.6	83.7	0	0	0	109.4	T229	L227-T229 PolarHBondContact O-N 3.45Å
228	P	38.6	Very low	42.2	Very low	109 Å²	109	124.4 Å²	124.4	71%	0.708	74%	0.737	S	S	*	*			trans	-80.4	96.5	164.5	31.1	-26	0	0	0	107.3	G226 T230	G226-P228 VanDerWaalsContact O-CD 3.26Å; G226-P228 WeakPolarHBondContact O-CD 3.49Å; P228-T230 PolarHBondContact O-N 3.33Å; P228-T230 VanDerWaalsContact O-N 3.09Å
229	T	38.1	Very low	42.6	Very low	112 Å²	112	126.7 Å²	126.7	69%	0.687	74%	0.735	S	S	*	*			trans	-54.8	116.4	165.1	37.5	0	0	0	0	108.3	L227 S231	L227-T229 PolarHBondContact O-N 3.45Å; T229-S231 PolarHBondContact O-N 3.17Å
230	T	35.5	Very low	42.8	Very low	148 Å²	148	119.2 Å²	119.2	91%	0.908	71%	0.706	S	S	*	*			trans	-74.7	74.6	-176.7	-35.6	0	0	0	0	109.8	P228	P228-T230 PolarHBondContact O-N 3.33Å; P228-T230 VanDerWaalsContact O-N 3.09Å
231	S	33.9	Very low	44	Very low	100 Å²	100	124.2 Å²	124.2	70%	0.699	71%	0.714	S	S	*	*			trans	-71.5	130.5	173	56.5	0	0	0	0	110	T229	T229-S231 PolarHBondContact O-N 3.17Å
232	A	33	Very low	44.6	Very low	82 Å²	82	120.6 Å²	120.6	68%	0.678	69%	0.694	S	S	*	*			trans	11.4	131	159.1	0	0	0	0	0	119.1	Q234	A232-Q234 PolarHBondContact O-N 2.84Å
233	F	38.7	Very low	45	Very low	201 Å²	201	119.9 Å²	119.9	88%	0.882	68%	0.684	S	S	*	*			trans	-11.6	99	151.9	-83.6	-97.8	0	0	0	113.7	S235	F233-S235 PolarHBondContact O-N 3.48Å
234	Q	38.6	Very low	45.7	Very low	143 Å²	143	119.3 Å²	119.3	67%	0.668	67%	0.667	S	S	*	*			trans	-66.4	105.9	175.4	-79.5	-168.2	-9.1	0	0	109.4	A232 S236 S237	A232-Q234 PolarHBondContact O-N 2.84Å; Q234-S236 PolarHBondContact O-N 3.5Å; Q234-S237 WeakPolarHBondContact O-CB 3.41Å; Q234-S237 PolarHBondContact O-N 3.06Å; Q234-S237 PolarHBondContact O-OG 2.88Å
235	S	46	Very low	46.6	Very low	77 Å²	77	116.5 Å²	116.5	54%	0.538	65%	0.652	S	S	.	*	G	3₁₀ helix	trans	-62.9	-12.3	-177.5	51.4	0	0	0	0	114.2	F233 S237	F233-S235 PolarHBondContact O-N 3.48Å; S235-S237 VanDerWaalsContact C-N 3.32Å
236	S	51.1	Low	48.1	Very low	85 Å²	85	116.5 Å²	116.5	59%	0.594	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-67.5	-25.9	169	49.2	0	0	0	0	113.8	Q234 L238	Q234-S236 PolarHBondContact O-N 3.5Å; S236-L238 VanDerWaalsContact C-N 3.26Å; S236-L238 PolarHBondContact O-N 3.39Å
237	S	52.7	Low	49.4	Very low	93 Å²	93	114.7 Å²	114.7	65%	0.65	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-73.2	-15.6	178.5	64.7	0	0	0	0	114.1	Q234 S235 K239	Q234-S237 WeakPolarHBondContact O-CB 3.41Å; Q234-S237 PolarHBondContact O-N 3.06Å; Q234-S237 PolarHBondContact O-OG 2.88Å; S235-S237 VanDerWaalsContact C-N 3.32Å; S237-K239 VanDerWaalsContact C-N 3.33Å
238	L	54.8	Low	50.6	Low	84 Å²	84	110.2 Å²	110.2	44%	0.44	59%	0.593	S	S	.	*	G	3₁₀ helix	trans	-88	3.2	179.8	-70.2	166	0	0	0	113.4	S236	S236-L238 VanDerWaalsContact C-N 3.26Å; S236-L238 PolarHBondContact O-N 3.39Å
239	K	55.5	Low	51.8	Low	166 Å²	166	106.5 Å²	106.5	72%	0.722	57%	0.571	S	S	*	*	S	Bend	trans	-80.4	119.2	176.3	-168	173	-176.7	177.8	0	109.4	S237	S237-K239 VanDerWaalsContact C-N 3.33Å
240	P	51.3	Low	52.9	Low	43 Å²	43	102.8 Å²	102.8	28%	0.279	56%	0.555	S	S	.	*			trans	-61.4	142.2	179.6	24.4	-32.6	0	0	0	111.1	V273	P240-V273 HydrophobicContact CB-CG2 4.23Å; P240-V273 HydrophobicContact CG-CG2 4.38Å
241	R	64.2	Low	54.2	Low	263 Å²	263	97.8 Å²	97.8	99%	0.992	53%	0.525	S	S	*	.	S	Bend	trans	-80	-25.4	177.8	-73.8	-176.3	175.3	177.7	-1.7	113.2
242	C	63.8	Low	55.7	Low	57 Å²	57	96.5 Å²	96.5	39%	0.385	51%	0.508	S	S	.	.	S	Bend	trans	-96	158.4	174.7	61.6	0	0	0	0	110.8	D246 L247	C242-D246 HydrophobicContact CB-CB 4.36Å; C242-L247 VanDerWaalsContact SG-CD2 3.59Å
243	M	57.7	Low	57.3	Low	109 Å²	109	93.8 Å²	93.8	54%	0.537	48%	0.483	S	S	.	.			trans	-71.2	156.4	173.2	-66.8	-79.6	-170	0	0	110.2	Y245 D246	M243-Y245 HydrophobicContact CB-CD1 4Å; M243-Y245 HydrophobicContact CB-CD2 4.03Å; M243-Y245 HydrophobicContact CB-CE1 3.57Å; M243-Y245 HydrophobicContact CB-CE2 3.59Å; M243-Y245 HydrophobicContact CB-CG 4.23Å; M243-Y245 HydrophobicContact CG-CE1 3.99Å; M243-Y245 HydrophobicContact CG-CE2 4.13Å; M243-Y245 WeakPolarHBondContact CG-OH 3.26Å; M243-Y245 PolarHBondContact O-N 3.36Å; M243-Y245 HydrophobicContact SD-CE1 4.34Å; M243-D246 PolarHBondContact O-N 3.36Å; M243-D246 VanDerWaalsContact O-N 3.13Å
244	Y	53.9	Low	58.5	Low	107 Å²	107	86.3 Å²	86.3	42%	0.42	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-62.7	-31.6	-175.5	74.5	-91.2	0	0	0	112.7	D246 L247 P268	Y244-D246 VanDerWaalsContact C-N 3.28Å; Y244-D246 PolarHBondContact O-N 2.78Å; Y244-L247 WeakPolarHBondContact O-CB 3.41Å; Y244-L247 PolarHBondContact O-N 3.42Å; Y244-P268 HydrophobicContact CD1-CB 4.21Å; Y244-P268 HydrophobicContact CE1-CB 4.25Å
245	Y	61.2	Low	59.8	Low	142 Å²	142	81.2 Å²	81.2	56%	0.557	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-74.8	-13	179.6	51.3	-108.3	0	0	0	114	M243 L247	M243-Y245 HydrophobicContact CB-CD1 4Å; M243-Y245 HydrophobicContact CB-CD2 4.03Å; M243-Y245 HydrophobicContact CB-CE1 3.57Å; M243-Y245 HydrophobicContact CB-CE2 3.59Å; M243-Y245 HydrophobicContact CB-CG 4.23Å; M243-Y245 HydrophobicContact CG-CE1 3.99Å; M243-Y245 HydrophobicContact CG-CE2 4.13Å; M243-Y245 WeakPolarHBondContact CG-OH 3.26Å; M243-Y245 PolarHBondContact O-N 3.36Å; M243-Y245 HydrophobicContact SD-CE1 4.34Å; Y245-L247 VanDerWaalsContact C-N 3.34Å
246	D	67.6	Low	60.9	Low	105 Å²	105	80 Å²	80	56%	0.561	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-90	-0.6	173.8	-60.8	-40.5	0	0	0	112.3	C242 M243 Y244	C242-D246 HydrophobicContact CB-CB 4.36Å; M243-D246 PolarHBondContact O-N 3.36Å; M243-D246 VanDerWaalsContact O-N 3.13Å; Y244-D246 VanDerWaalsContact C-N 3.28Å; Y244-D246 PolarHBondContact O-N 2.78Å
247	L	63.5	Low	61.8	Low	27 Å²	27	79.7 Å²	79.7	14%	0.141	42%	0.418	C	S	.	.	S	Bend	trans	-81.2	137.6	179.4	-68.1	170.8	0	0	0	111.1	C242 Y244 Y245 V251 M252 M255	C242-L247 VanDerWaalsContact SG-CD2 3.59Å; Y244-L247 WeakPolarHBondContact O-CB 3.41Å; Y244-L247 PolarHBondContact O-N 3.42Å; Y245-L247 VanDerWaalsContact C-N 3.34Å; L247-V251 HydrophobicContact CB-CB 4.42Å; L247-V251 HydrophobicContact CD1-CG1 4.34Å; L247-V251 HydrophobicContact CD2-CG1 4.25Å; L247-M252 HydrophobicContact CB-CG 3.83Å; L247-M255 HydrophobicContact CD1-CE 3.61Å; L247-M255 HydrophobicContact CD1-SD 4.19Å
248	P	64.1	Low	62.8	Low	62 Å²	62	78.2 Å²	78.2	40%	0.403	40%	0.402	S	S	.	.			trans	-54.1	143.7	169.7	-24.3	33.6	0	0	0	111.2	G250 V251 M252	P248-G250 PolarHBondContact O-N 2.86Å; P248-G250 VanDerWaalsContact O-N 3.12Å; P248-V251 HydrophobicContact CB-CG2 4.49Å; P248-V251 WeakPolarHBondContact O-CA 3.38Å; P248-V251 WeakPolarHBondContact O-CB 3.37Å; P248-V251 PolarHBondContact O-N 3.4Å; P248-M252 PolarHBondContact O-N 2.84Å
249	A	63	Low	63.4	Low	31 Å²	31	78.5 Å²	78.5	26%	0.256	40%	0.401	S	S	.	.	H	α-helix	trans	-62.1	-30.7	-170.6	0	0	0	0	0	112.7	V251 M252 V253 E324 M328	A249-V251 PolarHBondContact O-N 2.85Å; A249-M252 PolarHBondContact O-N 3.21Å; A249-V253 WeakPolarHBondContact O-CB 2.99Å; A249-V253 WeakPolarHBondContact O-CG2 3.43Å; A249-V253 PolarHBondContact O-N 3.38Å; A249-E324 WeakPolarHBondContact CB-OE1 3.38Å; A249-M328 HydrophobicContact CB-CE 3.56Å
250	G	61.4	Low	64.2	Low	34 Å²	34	71.7 Å²	71.7	35%	0.351	38%	0.376	S	S	.	.	H	α-helix	trans	-60.6	-24.6	171.7	0	0	0	0	0	114.9	P248	P248-G250 PolarHBondContact O-N 2.86Å; P248-G250 VanDerWaalsContact O-N 3.12Å
251	V	63.2	Low	64.8	Low	43 Å²	43	76.7 Å²	76.7	26%	0.261	40%	0.396	S	S	.	.	H	α-helix	trans	-83.6	-47.6	172	-176.2	0	0	0	0	110.3	L247 P248 A249 V253 S254 M255	L247-V251 HydrophobicContact CB-CB 4.42Å; L247-V251 HydrophobicContact CD1-CG1 4.34Å; L247-V251 HydrophobicContact CD2-CG1 4.25Å; P248-V251 HydrophobicContact CB-CG2 4.49Å; P248-V251 WeakPolarHBondContact O-CA 3.38Å; P248-V251 WeakPolarHBondContact O-CB 3.37Å; P248-V251 PolarHBondContact O-N 3.4Å; A249-V251 PolarHBondContact O-N 2.85Å; V251-V253 PolarHBondContact O-N 2.93Å; V251-S254 PolarHBondContact O-N 3.34Å; V251-S254 PolarHBondContact O-OG 3.2Å; V251-M255 HydrophobicContact CG1-CE 4.46Å
252	M	64.3	Low	65.2	Low	72 Å²	72	72.2 Å²	72.2	36%	0.355	39%	0.386	S	S	.	.	H	α-helix	trans	-56.6	-38.7	178.4	-62.5	-156.5	-51.8	0	0	112.6	L247 P248 A249 S254 M255	L247-M252 HydrophobicContact CB-CG 3.83Å; P248-M252 PolarHBondContact O-N 2.84Å; A249-M252 PolarHBondContact O-N 3.21Å; M252-S254 VanDerWaalsContact C-N 3.25Å; M252-S254 PolarHBondContact O-N 3.5Å; M252-M255 WeakPolarHBondContact O-CA 3.23Å; M252-M255 VanDerWaalsContact O-CB 3.24Å; M252-M255 WeakPolarHBondContact O-CB 3.44Å; M252-M255 PolarHBondContact O-N 3.37Å
253	V	66.9	Low	65.5	Low	26 Å²	26	79.2 Å²	79.2	16%	0.158	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-62.1	-31.4	-177.5	154.1	0	0	0	0	113.1	A249 V251 M255 V256 M328 Y331	A249-V253 WeakPolarHBondContact O-CB 2.99Å; A249-V253 WeakPolarHBondContact O-CG2 3.43Å; A249-V253 PolarHBondContact O-N 3.38Å; V251-V253 PolarHBondContact O-N 2.93Å; V253-M255 PolarHBondContact O-N 3.48Å; V253-V256 PolarHBondContact O-N 2.87Å; V253-M328 HydrophobicContact CB-CE 4.21Å; V253-M328 HydrophobicContact CG2-CE 3.47Å; V253-M328 VanDerWaalsContact CG2-CE 3.47Å; V253-M328 HydrophobicContact CG2-SD 3.75Å; V253-Y331 HydrophobicContact CG1-CD1 3.45Å; V253-Y331 VanDerWaalsContact CG1-CD1 3.45Å; V253-Y331 HydrophobicContact CG1-CD2 3.22Å; V253-Y331 HydrophobicContact CG1-CE1 3.86Å; V253-Y331 HydrophobicContact CG1-CE2 3.63Å; V253-Y331 HydrophobicContact CG1-CG 3.1Å; V253-Y331 VanDerWaalsContact O-CE2 3.28Å; V253-Y331 WeakPolarHBondContact O-CE2 3.28Å
254	S	63.5	Low	66.1	Low	43 Å²	43	81.2 Å²	81.2	30%	0.301	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-70.6	-11.3	173.6	70.5	0	0	0	0	114.3	V251 M252	V251-S254 PolarHBondContact O-N 3.34Å; V251-S254 PolarHBondContact O-OG 3.2Å; M252-S254 VanDerWaalsContact C-N 3.25Å; M252-S254 PolarHBondContact O-N 3.5Å
255	M	66.3	Low	66.9	Low	36 Å²	36	81.1 Å²	81.1	18%	0.177	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-90.3	-13.9	175.6	-54.8	171.6	164.8	0	0	112.6	L247 V251 M252 V253 V271 V273	L247-M255 HydrophobicContact CD1-CE 3.61Å; L247-M255 HydrophobicContact CD1-SD 4.19Å; V251-M255 HydrophobicContact CG1-CE 4.46Å; M252-M255 WeakPolarHBondContact O-CA 3.23Å; M252-M255 VanDerWaalsContact O-CB 3.24Å; M252-M255 WeakPolarHBondContact O-CB 3.44Å; M252-M255 PolarHBondContact O-N 3.37Å; V253-M255 PolarHBondContact O-N 3.48Å; M255-V271 HydrophobicContact CE-CG1 3.68Å; M255-V271 HydrophobicContact SD-CG1 3.61Å; M255-V273 HydrophobicContact CE-CB 4.33Å; M255-V273 HydrophobicContact CE-CG1 4.49Å; M255-V273 HydrophobicContact CE-CG2 3.95Å
256	V	69.9	Low	67.2	Low	51 Å²	51	78.4 Å²	78.4	31%	0.309	42%	0.421	S	S	.	.	S	Bend	trans	-85	122.4	177.3	-178.6	0	0	0	0	109.2	V253 L258 Y331	V253-V256 PolarHBondContact O-N 2.87Å; V256-L258 PolarHBondContact O-N 3.31Å; V256-Y331 WeakPolarHBondContact CB-OH 3.32Å; V256-Y331 WeakPolarHBondContact CG1-OH 3.43Å
257	P	69.4	Low	67.5	Low	80 Å²	80	77.5 Å²	77.5	52%	0.519	42%	0.415	S	S	.	.			trans	-56.3	131.1	177.2	-23.7	33.1	0	0	0	111.5	E259 A260	P257-E259 PolarHBondContact O-N 3.16Å; P257-A260 HydrophobicContact CB-CB 4.2Å; P257-A260 WeakPolarHBondContact O-CB 3.43Å; P257-A260 PolarHBondContact O-N 3.09Å
258	L	74	Confident	67.5	Low	61 Å²	61	79.8 Å²	79.8	32%	0.319	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-20.5	178.4	-65.1	173.4	0	0	0	112.9	V256 Y331 A334 K335 A338	V256-L258 PolarHBondContact O-N 3.31Å; L258-Y331 HydrophobicContact CD2-CD2 3.82Å; L258-Y331 HydrophobicContact CD2-CE2 3.52Å; L258-A334 HydrophobicContact CD2-CB 4.31Å; L258-K335 HydrophobicContact CD2-CB 4.29Å; L258-A338 HydrophobicContact CB-CB 3.64Å; L258-A338 HydrophobicContact CD1-CB 4.39Å
259	E	67.7	Low	67.4	Low	91 Å²	91	84.7 Å²	84.7	43%	0.425	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-5.2	-179	-57.6	-174	-176.1	0	0	113.5	P257 Q261 K342 R345	P257-E259 PolarHBondContact O-N 3.16Å; E259-Q261 PolarHBondContact O-N 3.49Å; E259-K342 HydrophobicContact CB-CD 4.29Å; E259-R345 IonicContact OE1-NH1 2.71Å
260	A	70.5	Confident	67.5	Low	23 Å²	23	86.3 Å²	86.3	19%	0.19	46%	0.463	C	S	.	.			trans	-76.8	116.4	-179.8	0	0	0	0	0	111.3	P257 K335	P257-A260 HydrophobicContact CB-CB 4.2Å; P257-A260 WeakPolarHBondContact O-CB 3.43Å; P257-A260 PolarHBondContact O-N 3.09Å; A260-K335 VanDerWaalsContact O-CE 3.25Å; A260-K335 WeakPolarHBondContact O-CE 3.31Å; A260-K335 PolarHBondContact O-NZ 3.02Å
261	Q	65.3	Low	67.4	Low	148 Å²	148	85.6 Å²	85.6	69%	0.692	45%	0.451	S	S	*	.			trans	-93.5	-31.5	175.8	-70.9	179.7	-19.3	0	0	112.5	E259	E259-Q261 PolarHBondContact O-N 3.49Å
262	E	72.7	Confident	67.1	Low	169 Å²	169	91.4 Å²	91.4	79%	0.79	47%	0.469	S	S	*	.	S	Bend	trans	-107.8	166.1	179.4	-63.8	-176.8	180	0	0	111.4	E264	E262-E264 PolarHBondContact O-N 3.22Å
263	Y	70	Confident	66.6	Low	204 Å²	204	90.6 Å²	90.6	80%	0.8	47%	0.468	S	S	*	.			trans	-81.5	109.9	177.1	173.4	-94.6	0	0	0	110.4	P265	Y263-P265 HydrophobicContact CE1-CG 4.07Å
264	E	69.3	Low	65.5	Low	150 Å²	150	91.7 Å²	91.7	70%	0.701	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-100.6	129.5	166.8	-68.5	-173.7	160.4	0	0	109.8	E262 I266	E262-E264 PolarHBondContact O-N 3.22Å; E264-I266 PolarHBondContact O-N 3.38Å
265	P	71.2	Confident	64.5	Low	105 Å²	105	95.4 Å²	95.4	68%	0.682	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-60.2	118.7	174	-21.9	32.5	0	0	0	111.1	Y263 D267	Y263-P265 HydrophobicContact CE1-CG 4.07Å; P265-D267 PolarHBondContact O-N 3.45Å
266	I	68.1	Low	63.1	Low	86 Å²	86	99 Å²	99	44%	0.441	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-71.4	119	179	-55.5	177.2	0	0	0	109	E264 P268 V271	E264-I266 PolarHBondContact O-N 3.38Å; I266-P268 WeakPolarHBondContact O-CD 3.28Å; I266-V271 HydrophobicContact CG2-CG2 3.41Å; I266-V271 VanDerWaalsContact CG2-CG2 3.41Å
267	D	72.6	Confident	61.6	Low	85 Å²	85	103.9 Å²	103.9	46%	0.455	54%	0.535	S	S	.	.			trans	-62.5	115.3	173.7	168.1	15.5	0	0	0	110	P265 H269 A270 V271	P265-D267 PolarHBondContact O-N 3.45Å; D267-H269 PolarHBondContact O-N 3.44Å; D267-H269 VanDerWaalsContact O-N 3.07Å; D267-H269 WeakPolarHBondContact OD1-CB 3.29Å; D267-H269 IonicContact OD1-CD2 3.99Å; D267-H269 PolarHBondContact OD1-N 3.18Å; D267-A270 HydrophobicContact CB-CB 3.85Å; D267-A270 PolarHBondContact O-N 3.09Å; D267-A270 WeakPolarHBondContact OD2-CB 3.44Å; D267-A270 PolarHBondContact OD2-N 2.78Å; D267-V271 WeakPolarHBondContact O-CG2 3.33Å; D267-V271 PolarHBondContact O-N 3.12Å; D267-V271 VanDerWaalsContact O-N 3.17Å
268	P	63.6	Low	59.7	Low	76 Å²	76	108.1 Å²	108.1	49%	0.494	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.8	-15.7	-177	28.1	-36.5	0	0	0	113.7	Y244 I266	Y244-P268 HydrophobicContact CD1-CB 4.21Å; Y244-P268 HydrophobicContact CE1-CB 4.25Å; I266-P268 WeakPolarHBondContact O-CD 3.28Å
269	H	63.6	Low	57.7	Low	164 Å²	164	111.1 Å²	111.1	76%	0.759	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-22.3	173.4	-63	-50.4	0	0	0	113.4	D267	D267-H269 PolarHBondContact O-N 3.44Å; D267-H269 VanDerWaalsContact O-N 3.07Å; D267-H269 WeakPolarHBondContact OD1-CB 3.29Å; D267-H269 IonicContact OD1-CD2 3.99Å; D267-H269 PolarHBondContact OD1-N 3.18Å
270	A	63.1	Low	56.3	Low	65 Å²	65	111.4 Å²	111.4	54%	0.537	58%	0.576	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.4	-17.8	171.8	0	0	0	0	0	113.2	D267 R272	D267-A270 HydrophobicContact CB-CB 3.85Å; D267-A270 PolarHBondContact O-N 3.09Å; D267-A270 WeakPolarHBondContact OD2-CB 3.44Å; D267-A270 PolarHBondContact OD2-N 2.78Å; A270-R272 PolarHBondContact O-N 2.93Å
271	V	60.5	Low	55	Low	19 Å²	19	113.5 Å²	113.5	12%	0.115	58%	0.584	C	S	.	*			trans	-60.6	94.8	175.8	-178.2	0	0	0	0	111.1	M255 I266 D267	M255-V271 HydrophobicContact CE-CG1 3.68Å; M255-V271 HydrophobicContact SD-CG1 3.61Å; I266-V271 HydrophobicContact CG2-CG2 3.41Å; I266-V271 VanDerWaalsContact CG2-CG2 3.41Å; D267-V271 WeakPolarHBondContact O-CG2 3.33Å; D267-V271 PolarHBondContact O-N 3.12Å; D267-V271 VanDerWaalsContact O-N 3.17Å
272	R	56.6	Low	53.9	Low	165 Å²	165	112.1 Å²	112.1	62%	0.623	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-99.2	131.5	159	-61.4	-172.2	-178.2	-147.1	-0.4	107	A270 P274	A270-R272 PolarHBondContact O-N 2.93Å; R272-P274 WeakPolarHBondContact O-CD 3.4Å; R272-P274 VanDerWaalsContact O-N 3.13Å
273	V	52.9	Low	52.9	Low	56 Å²	56	107 Å²	107	34%	0.339	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-57.2	121.8	166.6	-170.9	0	0	0	0	106	P240 M255 V275	P240-V273 HydrophobicContact CB-CG2 4.23Å; P240-V273 HydrophobicContact CG-CG2 4.38Å; M255-V273 HydrophobicContact CE-CB 4.33Å; M255-V273 HydrophobicContact CE-CG1 4.49Å; M255-V273 HydrophobicContact CE-CG2 3.95Å; V273-V275 PolarHBondContact O-N 3.4Å
274	P	45.1	Very low	51.9	Low	48 Å²	48	101.9 Å²	101.9	31%	0.312	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-56	141.2	177.5	22.8	-32.4	0	0	0	107.9	R272 M276	R272-P274 WeakPolarHBondContact O-CD 3.4Å; R272-P274 VanDerWaalsContact O-N 3.13Å; P274-M276 PolarHBondContact O-N 3.11Å
275	V	42.9	Very low	50.9	Low	122 Å²	122	99.9 Å²	99.9	74%	0.739	55%	0.545	S	S	*	.			trans	-63.3	93	164.4	179.7	0	0	0	0	104.6	V273 M277	V273-V275 PolarHBondContact O-N 3.4Å; V275-M277 PolarHBondContact O-N 3.38Å
276	M	36.5	Very low	50	Low	112 Å²	112	100.2 Å²	100.2	55%	0.552	54%	0.536	S	S	*	.			trans	-53.8	132.9	-164.4	-97	-163.1	150.9	0	0	108.8	P274 L278	P274-M276 PolarHBondContact O-N 3.11Å; M276-L278 PolarHBondContact O-N 3.25Å
277	M	37.4	Very low	49.3	Very low	152 Å²	152	98.2 Å²	98.2	75%	0.749	53%	0.528	S	S	*	.			trans	-44.7	118.1	-179.8	-101.8	-170.5	-88.2	0	0	109.1	V275 L279	V275-M277 PolarHBondContact O-N 3.38Å; M277-L279 HydrophobicContact CB-CB 4.45Å; M277-L279 HydrophobicContact CB-CD1 4.09Å; M277-L279 HydrophobicContact CG-CD1 4.27Å; M277-L279 PolarHBondContact O-N 3.06Å; M277-L279 HydrophobicContact SD-CD1 3.7Å
278	L	30.6	Very low	48.2	Very low	169 Å²	169	96.8 Å²	96.8	89%	0.885	52%	0.519	S	S	*	.			trans	-68.6	70.5	176.4	-74.1	161.3	0	0	0	108.9	M276	M276-L278 PolarHBondContact O-N 3.25Å
279	L	31.7	Very low	47.6	Very low	124 Å²	124	96.9 Å²	96.9	65%	0.649	52%	0.515	S	S	*	.			trans	-126.2	119.2	-174.3	-101.6	155	0	0	0	109	M277	M277-L279 HydrophobicContact CB-CB 4.45Å; M277-L279 HydrophobicContact CB-CD1 4.09Å; M277-L279 HydrophobicContact CG-CD1 4.27Å; M277-L279 PolarHBondContact O-N 3.06Å; M277-L279 HydrophobicContact SD-CD1 3.7Å
280	V	38.2	Very low	47.1	Very low	98 Å²	98	92.9 Å²	92.9	59%	0.594	50%	0.498	S	S	*	.	S	Bend	trans	56.7	95.8	175	-95.8	0	0	0	0	117.4
281	N	43.5	Very low	46.3	Very low	66 Å²	66	96.1 Å²	96.1	35%	0.353	50%	0.5	S	S	.	.			trans	86.5	106.4	155.4	-49.3	-30.2	0	0	0	116.9	Y83 T283 F284	Y83-N281 WeakPolarHBondContact CE1-ND2 3.47Å; N281-T283 PolarHBondContact O-N 2.7Å; N281-F284 PolarHBondContact O-N 2.98Å
282	C	40.9	Very low	45.7	Very low	120 Å²	120	103 Å²	103	81%	0.811	53%	0.525	S	S	*	.	H	α-helix	trans	-51.6	-25.1	171.5	-65.8	0	0	0	0	113.8	F286	C282-F286 WeakPolarHBondContact O-CB 3.21Å; C282-F286 PolarHBondContact O-N 3.01Å
283	T	51.9	Low	45.1	Very low	61 Å²	61	98.6 Å²	98.6	37%	0.374	51%	0.514	S	S	.	.	H	α-helix	trans	-65.6	-31.1	175.3	26.3	0	0	0	0	114.2	N86 N281 F286 V287	N86-T283 VanDerWaalsContact OD1-CB 3.28Å; N86-T283 WeakPolarHBondContact OD1-CB 3.25Å; N86-T283 WeakPolarHBondContact OD1-CG2 3.22Å; N86-T283 PolarHBondContact OD1-OG1 3.23Å; N281-T283 PolarHBondContact O-N 2.7Å; T283-F286 PolarHBondContact O-N 2.85Å; T283-V287 WeakPolarHBondContact O-CB 3.34Å; T283-V287 VanDerWaalsContact O-CG2 3.29Å; T283-V287 WeakPolarHBondContact O-CG2 3.32Å; T283-V287 PolarHBondContact O-N 3.38Å
284	F	49.6	Very low	44.5	Very low	97 Å²	97	105.6 Å²	105.6	43%	0.425	54%	0.54	S	S	.	.	H	α-helix	trans	-68.8	-45.9	175.9	-178.3	-105.3	0	0	0	110.9	N281 F286 V287 M288 W323	N281-F284 PolarHBondContact O-N 2.98Å; F284-F286 VanDerWaalsContact C-N 3.3Å; F284-F286 PolarHBondContact O-N 2.89Å; F284-V287 PolarHBondContact O-N 3.09Å; F284-M288 HydrophobicContact CD1-CG 4.38Å; F284-M288 HydrophobicContact CE1-CG 3.94Å; F284-M288 HydrophobicContact CE2-CE 3.95Å; F284-M288 HydrophobicContact CE2-CG 4.17Å; F284-M288 HydrophobicContact CZ-CE 3.95Å; F284-M288 HydrophobicContact CZ-CG 3.83Å; F284-M288 HydrophobicContact CZ-SD 4.41Å; F284-M288 WeakPolarHBondContact O-CB 3.3Å; F284-M288 WeakPolarHBondContact O-CG 3.46Å; F284-M288 PolarHBondContact O-N 3.42Å; F284-W323 HydrophobicContact CD2-CH2 4.41Å; F284-W323 AromaticContact CD2-CZ3 3.99Å; F284-W323 HydrophobicContact CD2-CZ3 3.99Å; F284-W323 HydrophobicContact CE2-CE3 4.06Å; F284-W323 HydrophobicContact CE2-CH2 4.19Å; F284-W323 AromaticContact CE2-CZ3 3.44Å; F284-W323 HydrophobicContact CE2-CZ3 3.44Å; F284-W323 VanDerWaalsContact CE2-CZ3 3.44Å; F284-W323 HydrophobicContact CZ-CZ3 4.33Å
285	L	49.3	Very low	44.3	Very low	107 Å²	107	112.4 Å²	112.4	56%	0.56	57%	0.568	S	S	*	*	H	α-helix	trans	-62.4	-38.8	172.9	-163	75.3	0	0	0	111.1	M288 L289	L285-M288 PolarHBondContact O-N 3.46Å; L285-L289 HydrophobicContact CD2-CD1 4.25Å; L285-L289 HydrophobicContact CG-CD1 3.97Å; L285-L289 HydrophobicContact CG-CG 4.29Å; L285-L289 WeakPolarHBondContact O-CB 3.32Å; L285-L289 WeakPolarHBondContact O-CD1 3.47Å; L285-L289 WeakPolarHBondContact O-CG 2.99Å; L285-L289 PolarHBondContact O-N 3.42Å
286	F	52.3	Low	44.2	Very low	112 Å²	112	112.1 Å²	112.1	49%	0.491	56%	0.561	S	S	.	*	H	α-helix	trans	-62.6	-44.6	176.2	-162.1	-93.4	0	0	0	112.4	C282 T283 F284 L289 M290 F300	C282-F286 WeakPolarHBondContact O-CB 3.21Å; C282-F286 PolarHBondContact O-N 3.01Å; T283-F286 PolarHBondContact O-N 2.85Å; F284-F286 VanDerWaalsContact C-N 3.3Å; F284-F286 PolarHBondContact O-N 2.89Å; F286-L289 PolarHBondContact O-N 2.93Å; F286-M290 HydrophobicContact CD1-CG 4.29Å; F286-M290 HydrophobicContact CE1-CG 4.29Å; F286-M290 HydrophobicContact CE1-SD 4.22Å; F286-M290 VanDerWaalsContact O-CG 3.24Å; F286-M290 WeakPolarHBondContact O-CG 3.32Å; F286-M290 PolarHBondContact O-N 2.84Å; F286-F300 HydrophobicContact CZ-CE2 4.41Å
287	V	53.1	Low	44	Very low	45 Å²	45	109 Å²	109	27%	0.273	56%	0.558	S	S	.	*	H	α-helix	trans	-67.2	-40.9	176.7	170.1	0	0	0	0	111.5	T283 F284 M290 F291	T283-V287 WeakPolarHBondContact O-CB 3.34Å; T283-V287 VanDerWaalsContact O-CG2 3.29Å; T283-V287 WeakPolarHBondContact O-CG2 3.32Å; T283-V287 PolarHBondContact O-N 3.38Å; F284-V287 PolarHBondContact O-N 3.09Å; V287-M290 PolarHBondContact O-N 3.29Å; V287-F291 PolarHBondContact O-N 3.45Å
288	M	48.8	Very low	44.3	Very low	54 Å²	54	107.5 Å²	107.5	27%	0.266	56%	0.557	S	S	.	*	H	α-helix	trans	-66.1	-40.6	174.2	-76.9	-70.6	142.5	0	0	112.3	F284 L285 M290 F291 Y292 F319	F284-M288 HydrophobicContact CD1-CG 4.38Å; F284-M288 HydrophobicContact CE1-CG 3.94Å; F284-M288 HydrophobicContact CE2-CE 3.95Å; F284-M288 HydrophobicContact CE2-CG 4.17Å; F284-M288 HydrophobicContact CZ-CE 3.95Å; F284-M288 HydrophobicContact CZ-CG 3.83Å; F284-M288 HydrophobicContact CZ-SD 4.41Å; F284-M288 WeakPolarHBondContact O-CB 3.3Å; F284-M288 WeakPolarHBondContact O-CG 3.46Å; F284-M288 PolarHBondContact O-N 3.42Å; L285-M288 PolarHBondContact O-N 3.46Å; M288-M290 VanDerWaalsContact C-N 3.33Å; M288-M290 PolarHBondContact O-N 2.88Å; M288-F291 PolarHBondContact O-N 3.37Å; M288-F291 VanDerWaalsContact O-N 3.13Å; M288-Y292 PolarHBondContact O-N 2.98Å; M288-Y292 HydrophobicContact SD-CD2 4.17Å; M288-Y292 HydrophobicContact SD-CE2 3.88Å; M288-F319 HydrophobicContact CE-CE1 3.99Å
289	L	51.4	Low	45.1	Very low	79 Å²	79	109.4 Å²	109.4	41%	0.414	55%	0.552	S	S	.	*	H	α-helix	trans	-63.8	-37.1	174.2	-75	168.1	0	0	0	111.6	L285 F286 F291 N293	L285-L289 HydrophobicContact CD2-CD1 4.25Å; L285-L289 HydrophobicContact CG-CD1 3.97Å; L285-L289 HydrophobicContact CG-CG 4.29Å; L285-L289 WeakPolarHBondContact O-CB 3.32Å; L285-L289 WeakPolarHBondContact O-CD1 3.47Å; L285-L289 WeakPolarHBondContact O-CG 2.99Å; L285-L289 PolarHBondContact O-N 3.42Å; F286-L289 PolarHBondContact O-N 2.93Å; L289-F291 VanDerWaalsContact C-N 3.32Å; L289-N293 VanDerWaalsContact CD2-ND2 3.3Å; L289-N293 WeakPolarHBondContact CD2-ND2 3.21Å; L289-N293 VanDerWaalsContact O-CB 3.3Å; L289-N293 WeakPolarHBondContact O-CB 3.31Å; L289-N293 PolarHBondContact O-N 3.42Å; L289-N293 PolarHBondContact O-ND2 3.18Å; L289-N293 VanDerWaalsContact O-ND2 3.08Å
290	M	52.3	Low	45.8	Very low	79 Å²	79	108.3 Å²	108.3	39%	0.389	54%	0.543	S	S	.	.	H	α-helix	trans	-66.4	-31.4	172.1	-68.4	-133.5	-56.4	0	0	113.1	F286 V287 M288 L311	F286-M290 HydrophobicContact CD1-CG 4.29Å; F286-M290 HydrophobicContact CE1-CG 4.29Å; F286-M290 HydrophobicContact CE1-SD 4.22Å; F286-M290 VanDerWaalsContact O-CG 3.24Å; F286-M290 WeakPolarHBondContact O-CG 3.32Å; F286-M290 PolarHBondContact O-N 2.84Å; V287-M290 PolarHBondContact O-N 3.29Å; M288-M290 VanDerWaalsContact C-N 3.33Å; M288-M290 PolarHBondContact O-N 2.88Å; M290-L311 HydrophobicContact CE-CD2 3.66Å
291	F	46.4	Very low	46.4	Very low	133 Å²	133	112.5 Å²	112.5	58%	0.583	55%	0.553	S	S	*	*	H	α-helix	trans	-83.2	-38.2	-178.3	-132.3	-95.6	0	0	0	113	V287 M288 L289 I315	V287-F291 PolarHBondContact O-N 3.45Å; M288-F291 PolarHBondContact O-N 3.37Å; M288-F291 VanDerWaalsContact O-N 3.13Å; L289-F291 VanDerWaalsContact C-N 3.32Å; F291-I315 HydrophobicContact CD2-CD1 4.14Å; F291-I315 HydrophobicContact CE2-CD1 3.84Å; F291-I315 HydrophobicContact CE2-CG2 3.97Å; F291-I315 HydrophobicContact CZ-CG2 4.27Å
292	Y	47.8	Very low	46.7	Very low	163 Å²	163	113.1 Å²	113.1	64%	0.639	56%	0.559	S	S	*	*	H	α-helix	trans	-93.5	-20.4	-177.2	-79.4	-83	0	0	0	114.7	M288	M288-Y292 PolarHBondContact O-N 2.98Å; M288-Y292 HydrophobicContact SD-CD2 4.17Å; M288-Y292 HydrophobicContact SD-CE2 3.88Å
293	N	44.7	Very low	47.4	Very low	73 Å²	73	108.9 Å²	108.9	39%	0.39	53%	0.528	S	S	.	.			trans	-105.9	65.5	174.7	-56.3	-83.1	0	0	0	111.5	L289 E295 I296	L289-N293 VanDerWaalsContact CD2-ND2 3.3Å; L289-N293 WeakPolarHBondContact CD2-ND2 3.21Å; L289-N293 VanDerWaalsContact O-CB 3.3Å; L289-N293 WeakPolarHBondContact O-CB 3.31Å; L289-N293 PolarHBondContact O-N 3.42Å; L289-N293 PolarHBondContact O-ND2 3.18Å; L289-N293 VanDerWaalsContact O-ND2 3.08Å; N293-E295 PolarHBondContact O-N 2.96Å; N293-I296 HydrophobicContact CB-CD1 3.72Å; N293-I296 HydrophobicContact CB-CG1 3.8Å; N293-I296 PolarHBondContact O-N 2.62Å; N293-I296 VanDerWaalsContact O-N 3.13Å
294	F	40.4	Very low	47.8	Very low	204 Å²	204	108 Å²	108	90%	0.895	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	8.4	176	-169.8	-108.6	0	0	0	114.5
295	E	40.3	Very low	48.5	Very low	191 Å²	191	108.7 Å²	108.7	89%	0.893	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.8	9.1	173.6	-90.6	-172.9	148.1	0	0	114.6	N293 G297	N293-E295 PolarHBondContact O-N 2.96Å; E295-G297 PolarHBondContact O-N 2.89Å
296	I	41.2	Very low	49.1	Very low	116 Å²	116	107.4 Å²	107.4	60%	0.595	54%	0.539	S	S	*	.			trans	-73	82	172.9	-59.6	177.3	0	0	0	110.3	N293	N293-I296 HydrophobicContact CB-CD1 3.72Å; N293-I296 HydrophobicContact CB-CG1 3.8Å; N293-I296 PolarHBondContact O-N 2.62Å; N293-I296 VanDerWaalsContact O-N 3.13Å
297	G	32.3	Very low	49.6	Very low	47 Å²	47	103.3 Å²	103.3	49%	0.485	52%	0.52	S	S	.	.			trans	-63.4	162.5	177.3	0	0	0	0	0	113.8	E295 R299	E295-G297 PolarHBondContact O-N 2.89Å; G297-R299 VanDerWaalsContact C-N 3.34Å; G297-R299 PolarHBondContact O-N 3.39Å
298	T	43.5	Very low	50.1	Low	119 Å²	119	106.3 Å²	106.3	73%	0.73	53%	0.533	S	S	*	.	S	Bend	trans	71.8	-39.1	166.5	73.5	0	0	0	0	118.8
299	R	46.6	Very low	50.9	Low	210 Å²	210	105.8 Å²	105.8	79%	0.792	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-18.8	-167.5	-70.6	-166.1	178.2	-153.9	0	117.4	G297	G297-R299 VanDerWaalsContact C-N 3.34Å; G297-R299 PolarHBondContact O-N 3.39Å
300	F	46.8	Very low	51.5	Low	101 Å²	101	103.1 Å²	103.1	44%	0.443	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.9	10.2	-174.6	-97.8	-89.5	0	0	0	115.2	F286 T302 L303	F286-F300 HydrophobicContact CZ-CE2 4.41Å; F300-T302 PolarHBondContact O-N 2.9Å; F300-L303 HydrophobicContact CD1-CB 4.26Å; F300-L303 HydrophobicContact CD1-CD1 3.78Å; F300-L303 HydrophobicContact CD1-CD2 3.86Å; F300-L303 HydrophobicContact CD1-CG 4.17Å; F300-L303 HydrophobicContact CE1-CD1 3.7Å; F300-L303 HydrophobicContact CE1-CD2 3.84Å; F300-L303 HydrophobicContact CE1-CG 4.33Å; F300-L303 PolarHBondContact O-N 3.44Å
301	K	50.5	Low	51.9	Low	185 Å²	185	101.4 Å²	101.4	80%	0.804	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-10.1	-178.8	-72.6	-170.1	173.6	-174.2	0	114.8
302	T	51.7	Low	52.6	Low	80 Å²	80	97.8 Å²	97.8	49%	0.491	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-10.4	-179.6	45.3	0	0	0	0	114.1	F300 S304	F300-T302 PolarHBondContact O-N 2.9Å; T302-S304 PolarHBondContact O-N 2.98Å
303	L	54.7	Low	53.3	Low	31 Å²	31	93.1 Å²	93.1	16%	0.162	50%	0.499	C	S	.	.	S	Bend	trans	-67.1	129.1	177.3	-123.9	72.8	0	0	0	110.1	I48 F300 W307	I48-L303 HydrophobicContact CG2-CD1 3.95Å; F300-L303 HydrophobicContact CD1-CB 4.26Å; F300-L303 HydrophobicContact CD1-CD1 3.78Å; F300-L303 HydrophobicContact CD1-CD2 3.86Å; F300-L303 HydrophobicContact CD1-CG 4.17Å; F300-L303 HydrophobicContact CE1-CD1 3.7Å; F300-L303 HydrophobicContact CE1-CD2 3.84Å; F300-L303 HydrophobicContact CE1-CG 4.33Å; F300-L303 PolarHBondContact O-N 3.44Å; L303-W307 HydrophobicContact CD2-CB 3.91Å; L303-W307 HydrophobicContact CD2-CE3 4.48Å; L303-W307 HydrophobicContact CG-CB 4.15Å
304	S	59.8	Low	54.1	Low	42 Å²	42	90.9 Å²	90.9	29%	0.294	49%	0.488	S	S	.	.			trans	-62	148.8	-175.9	84.4	0	0	0	0	111.2	T302 S306 W307 I308	T302-S304 PolarHBondContact O-N 2.98Å; S304-S306 PolarHBondContact O-N 2.99Å; S304-W307 PolarHBondContact O-N 2.73Å; S304-I308 PolarHBondContact O-N 2.98Å
305	P	64.9	Low	55	Low	112 Å²	112	82.6 Å²	82.6	73%	0.727	45%	0.452	S	S	*	.	H	α-helix	trans	-54.7	-26.8	176.3	-28.1	35.7	0	0	0	113.5	W307 I308 G309	P305-W307 VanDerWaalsContact C-N 3.34Å; P305-I308 PolarHBondContact O-N 2.83Å; P305-G309 PolarHBondContact O-N 2.75Å
306	S	61.7	Low	56	Low	79 Å²	79	81 Å²	81	55%	0.552	44%	0.442	S	S	*	.	H	α-helix	trans	-64.6	-35.3	174.3	-169.9	0	0	0	0	112.7	S304 F310	S304-S306 PolarHBondContact O-N 2.99Å; S306-F310 VanDerWaalsContact O-CB 3.32Å; S306-F310 WeakPolarHBondContact O-CB 3.48Å; S306-F310 PolarHBondContact O-N 2.95Å
307	W	62.3	Low	56.8	Low	27 Å²	27	78.5 Å²	78.5	10%	0.102	43%	0.43	C	S	.	.	H	α-helix	trans	-75.1	-37.7	175.5	-100.5	76.8	0	0	0	113.4	S52 C55 L89 L303 S304 P305 G309 F310 L311	S52-W307 VanDerWaalsContact C-NE1 3.27Å; S52-W307 VanDerWaalsContact CB-NE1 3.33Å; S52-W307 PolarHBondContact O-NE1 3.5Å; S52-W307 PolarHBondContact OG-NE1 3.37Å; C55-W307 HydrophobicContact CB-CZ2 4.1Å; L89-W307 HydrophobicContact CD2-CH2 4.23Å; L303-W307 HydrophobicContact CD2-CB 3.91Å; L303-W307 HydrophobicContact CD2-CE3 4.48Å; L303-W307 HydrophobicContact CG-CB 4.15Å; S304-W307 PolarHBondContact O-N 2.73Å; P305-W307 VanDerWaalsContact C-N 3.34Å; W307-G309 VanDerWaalsContact C-N 3.3Å; W307-F310 HydrophobicContact CE3-CD1 4.45Å; W307-F310 HydrophobicContact CZ3-CD1 4.41Å; W307-F310 PolarHBondContact O-N 3.13Å; W307-L311 HydrophobicContact CE3-CD1 3.65Å; W307-L311 HydrophobicContact CZ3-CD1 3.76Å; W307-L311 WeakPolarHBondContact O-CB 3.5Å; W307-L311 PolarHBondContact O-N 3.01Å
308	I	63.3	Low	57.7	Low	107 Å²	107	76.9 Å²	76.9	55%	0.549	41%	0.41	S	S	.	.	H	α-helix	trans	-61.3	-44.9	172.3	-58.2	174.5	0	0	0	109.1	S304 P305 A312	S304-I308 PolarHBondContact O-N 2.98Å; P305-I308 PolarHBondContact O-N 2.83Å; I308-A312 WeakPolarHBondContact O-CB 3.3Å; I308-A312 PolarHBondContact O-N 2.77Å
309	G	66.2	Low	58.3	Low	43 Å²	43	73.8 Å²	73.8	44%	0.443	39%	0.386	S	S	.	.	H	α-helix	trans	-62.7	-40.1	173.3	0	0	0	0	0	113.8	P305 W307 L313	P305-G309 PolarHBondContact O-N 2.75Å; W307-G309 VanDerWaalsContact C-N 3.3Å; G309-L313 VanDerWaalsContact O-CB 3.25Å; G309-L313 WeakPolarHBondContact O-CB 3.18Å; G309-L313 PolarHBondContact O-N 3.3Å
310	F	63.6	Low	58.7	Low	24 Å²	24	67.4 Å²	67.4	11%	0.105	37%	0.374	C	S	.	.	H	α-helix	trans	-67.1	-46.4	176.4	176.9	-101.2	0	0	0	112	L59 L63 S306 W307 L313 L314	L59-F310 HydrophobicContact CD2-CE1 4.49Å; L59-F310 HydrophobicContact CD2-CZ 4Å; L59-F310 HydrophobicContact CG-CZ 4.32Å; L63-F310 HydrophobicContact CD1-CE2 4.33Å; L63-F310 HydrophobicContact CD1-CZ 3.93Å; S306-F310 VanDerWaalsContact O-CB 3.32Å; S306-F310 WeakPolarHBondContact O-CB 3.48Å; S306-F310 PolarHBondContact O-N 2.95Å; W307-F310 HydrophobicContact CE3-CD1 4.45Å; W307-F310 HydrophobicContact CZ3-CD1 4.41Å; W307-F310 PolarHBondContact O-N 3.13Å; F310-L313 PolarHBondContact O-N 3.07Å; F310-L314 HydrophobicContact CE1-CD2 4.37Å; F310-L314 HydrophobicContact CZ-CD1 4.49Å; F310-L314 WeakPolarHBondContact O-CB 3.19Å; F310-L314 PolarHBondContact O-N 3.3Å
311	L	61	Low	58.9	Low	42 Å²	42	70.2 Å²	70.2	22%	0.22	39%	0.389	C	S	.	.	H	α-helix	trans	-62.3	-44.7	174.8	-116.4	84	0	0	0	111	M290 W307 L313 L314 I315	M290-L311 HydrophobicContact CE-CD2 3.66Å; W307-L311 HydrophobicContact CE3-CD1 3.65Å; W307-L311 HydrophobicContact CZ3-CD1 3.76Å; W307-L311 WeakPolarHBondContact O-CB 3.5Å; W307-L311 PolarHBondContact O-N 3.01Å; L311-L313 VanDerWaalsContact C-N 3.34Å; L311-L313 PolarHBondContact O-N 3.48Å; L311-L314 PolarHBondContact O-N 3.22Å; L311-I315 HydrophobicContact CD2-CD1 4.45Å; L311-I315 VanDerWaalsContact O-CB 3.27Å; L311-I315 WeakPolarHBondContact O-CB 3.2Å; L311-I315 WeakPolarHBondContact O-CG1 3.42Å; L311-I315 PolarHBondContact O-N 3.14Å
312	A	61.2	Low	59.1	Low	58 Å²	58	62.6 Å²	62.6	48%	0.479	36%	0.363	S	S	.	.	H	α-helix	trans	-62.6	-39.8	177.6	0	0	0	0	0	112.1	I308 K316	I308-A312 WeakPolarHBondContact O-CB 3.3Å; I308-A312 PolarHBondContact O-N 2.77Å; A312-K316 WeakPolarHBondContact O-CB 3.24Å; A312-K316 PolarHBondContact O-N 3.34Å
313	L	63	Low	59.4	Low	64 Å²	64	62 Å²	62	34%	0.335	35%	0.352	S	S	.	.	H	α-helix	trans	-67.4	-44.3	174.4	-170.6	81.8	0	0	0	111.6	G309 F310 L311 K316 L317	G309-L313 VanDerWaalsContact O-CB 3.25Å; G309-L313 WeakPolarHBondContact O-CB 3.18Å; G309-L313 PolarHBondContact O-N 3.3Å; F310-L313 PolarHBondContact O-N 3.07Å; L311-L313 VanDerWaalsContact C-N 3.34Å; L311-L313 PolarHBondContact O-N 3.48Å; L313-K316 PolarHBondContact O-N 3.02Å; L313-L317 HydrophobicContact CD2-CD1 4.18Å; L313-L317 HydrophobicContact CG-CD1 3.88Å; L313-L317 HydrophobicContact CG-CG 4.44Å; L313-L317 WeakPolarHBondContact O-CB 3.21Å; L313-L317 VanDerWaalsContact O-CG 3.28Å; L313-L317 WeakPolarHBondContact O-CG 3.26Å; L313-L317 PolarHBondContact O-N 3.02Å
314	L	60.6	Low	59.5	Low	27 Å²	27	65.9 Å²	65.9	14%	0.141	37%	0.369	C	S	.	.	H	α-helix	trans	-62.8	-46.3	178.8	-171.6	75.9	0	0	0	110.6	L63 F310 L311 L317 L318	L63-L314 HydrophobicContact CD1-CD1 3.68Å; F310-L314 HydrophobicContact CE1-CD2 4.37Å; F310-L314 HydrophobicContact CZ-CD1 4.49Å; F310-L314 WeakPolarHBondContact O-CB 3.19Å; F310-L314 PolarHBondContact O-N 3.3Å; L311-L314 PolarHBondContact O-N 3.22Å; L314-L317 PolarHBondContact O-N 2.97Å; L314-L318 HydrophobicContact CD1-CD1 4.14Å; L314-L318 HydrophobicContact CD2-CD1 4.39Å; L314-L318 HydrophobicContact CG-CD1 3.81Å; L314-L318 HydrophobicContact CG-CG 4.47Å; L314-L318 VanDerWaalsContact O-CB 3.28Å; L314-L318 WeakPolarHBondContact O-CB 3.24Å; L314-L318 VanDerWaalsContact O-CG 3.26Å; L314-L318 WeakPolarHBondContact O-CG 3.41Å; L314-L318 PolarHBondContact O-N 3.26Å
315	I	60	Low	59.6	Low	30 Å²	30	71.5 Å²	71.5	15%	0.154	39%	0.388	C	S	.	.	H	α-helix	trans	-62.6	-46.9	174.8	-68.5	167.9	0	0	0	109.3	F291 L311 L317 L318 F319	F291-I315 HydrophobicContact CD2-CD1 4.14Å; F291-I315 HydrophobicContact CE2-CD1 3.84Å; F291-I315 HydrophobicContact CE2-CG2 3.97Å; F291-I315 HydrophobicContact CZ-CG2 4.27Å; L311-I315 HydrophobicContact CD2-CD1 4.45Å; L311-I315 VanDerWaalsContact O-CB 3.27Å; L311-I315 WeakPolarHBondContact O-CB 3.2Å; L311-I315 WeakPolarHBondContact O-CG1 3.42Å; L311-I315 PolarHBondContact O-N 3.14Å; I315-L317 PolarHBondContact O-N 2.82Å; I315-L318 PolarHBondContact O-N 2.93Å; I315-F319 HydrophobicContact CB-CD2 4.23Å; I315-F319 HydrophobicContact CG1-CD2 4.49Å; I315-F319 HydrophobicContact CG1-CE2 4.34Å; I315-F319 HydrophobicContact CG2-CB 4.41Å; I315-F319 HydrophobicContact CG2-CD2 3.86Å; I315-F319 HydrophobicContact CG2-CE2 4.39Å; I315-F319 HydrophobicContact CG2-CG 4.25Å; I315-F319 WeakPolarHBondContact O-CA 3.27Å; I315-F319 WeakPolarHBondContact O-CB 3.38Å; I315-F319 VanDerWaalsContact O-CD2 3.26Å; I315-F319 WeakPolarHBondContact O-CD2 3.33Å; I315-F319 PolarHBondContact O-N 3.41Å
316	K	62.1	Low	59.3	Low	156 Å²	156	67.5 Å²	67.5	68%	0.678	36%	0.361	S	S	*	.	H	α-helix	trans	-60.7	-41.9	177.2	-167.2	169.2	-176	174.2	0	112.6	A312 L313 S320	A312-K316 WeakPolarHBondContact O-CB 3.24Å; A312-K316 PolarHBondContact O-N 3.34Å; L313-K316 PolarHBondContact O-N 3.02Å; K316-S320 WeakPolarHBondContact O-CB 3.39Å; K316-S320 PolarHBondContact O-N 3.45Å; K316-S320 VanDerWaalsContact O-N 3.12Å
317	L	56.8	Low	59.4	Low	64 Å²	64	65.3 Å²	65.3	34%	0.335	35%	0.35	S	S	.	.	H	α-helix	trans	-72.7	-35	-179.6	-74.5	169.7	0	0	0	114	L67 L313 L314 I315	L67-L317 HydrophobicContact CD1-CB 4.39Å; L67-L317 HydrophobicContact CD1-CD1 4.14Å; L313-L317 HydrophobicContact CD2-CD1 4.18Å; L313-L317 HydrophobicContact CG-CD1 3.88Å; L313-L317 HydrophobicContact CG-CG 4.44Å; L313-L317 WeakPolarHBondContact O-CB 3.21Å; L313-L317 VanDerWaalsContact O-CG 3.28Å; L313-L317 WeakPolarHBondContact O-CG 3.26Å; L313-L317 PolarHBondContact O-N 3.02Å; L314-L317 PolarHBondContact O-N 2.97Å; I315-L317 PolarHBondContact O-N 2.82Å
318	L	51.7	Low	59.5	Low	13 Å²	13	65.9 Å²	65.9	7%	0.068	35%	0.354	C	S	.	.	H	α-helix	trans	-81.5	-39.5	177.9	-68.8	173.7	0	0	0	111.7	K78 L82 L314 I315 W323	K78-L318 HydrophobicContact CB-CD2 4.49Å; L82-L318 HydrophobicContact CD1-CD1 3.83Å; L82-L318 HydrophobicContact CD2-CD1 4.46Å; L314-L318 HydrophobicContact CD1-CD1 4.14Å; L314-L318 HydrophobicContact CD2-CD1 4.39Å; L314-L318 HydrophobicContact CG-CD1 3.81Å; L314-L318 HydrophobicContact CG-CG 4.47Å; L314-L318 VanDerWaalsContact O-CB 3.28Å; L314-L318 WeakPolarHBondContact O-CB 3.24Å; L314-L318 VanDerWaalsContact O-CG 3.26Å; L314-L318 WeakPolarHBondContact O-CG 3.41Å; L314-L318 PolarHBondContact O-N 3.26Å; I315-L318 PolarHBondContact O-N 2.93Å; L318-W323 PolarHBondContact O-NE1 2.88Å
319	F	56.2	Low	59.7	Low	54 Å²	54	68 Å²	68	24%	0.237	36%	0.357	C	S	.	.	H	α-helix	trans	-100	-9	-168.3	-64.2	-106.8	0	0	0	115.4	M288 I315 E321 W323	M288-F319 HydrophobicContact CE-CE1 3.99Å; I315-F319 HydrophobicContact CB-CD2 4.23Å; I315-F319 HydrophobicContact CG1-CD2 4.49Å; I315-F319 HydrophobicContact CG1-CE2 4.34Å; I315-F319 HydrophobicContact CG2-CB 4.41Å; I315-F319 HydrophobicContact CG2-CD2 3.86Å; I315-F319 HydrophobicContact CG2-CE2 4.39Å; I315-F319 HydrophobicContact CG2-CG 4.25Å; I315-F319 WeakPolarHBondContact O-CA 3.27Å; I315-F319 WeakPolarHBondContact O-CB 3.38Å; I315-F319 VanDerWaalsContact O-CD2 3.26Å; I315-F319 WeakPolarHBondContact O-CD2 3.33Å; I315-F319 PolarHBondContact O-N 3.41Å; F319-E321 VanDerWaalsContact C-N 3.3Å; F319-E321 PolarHBondContact O-N 3.33Å; F319-E321 VanDerWaalsContact O-N 3.09Å; F319-W323 HydrophobicContact CD1-CB 4.18Å; F319-W323 AromaticContact CD1-CD1 3.57Å; F319-W323 AromaticContact CD1-CD2 3.55Å; F319-W323 HydrophobicContact CD1-CD2 3.55Å; F319-W323 AromaticContact CD1-CE2 3.6Å; F319-W323 HydrophobicContact CD1-CE3 4.3Å; F319-W323 AromaticContact CD1-CG 3.48Å; F319-W323 HydrophobicContact CD1-CG 3.48Å; F319-W323 VanDerWaalsContact CD1-CG 3.48Å; F319-W323 HydrophobicContact CD1-CZ2 4.31Å; F319-W323 AromaticContact CD1-NE1 3.59Å; F319-W323 HydrophobicContact CD2-CZ2 4.33Å; F319-W323 AromaticContact CD2-NE1 3.83Å; F319-W323 AromaticContact CE1-CD2 3.36Å; F319-W323 HydrophobicContact CE1-CD2 3.36Å; F319-W323 AromaticContact CE1-CE2 3.39Å; F319-W323 AromaticContact CE1-CE3 3.7Å; F319-W323 HydrophobicContact CE1-CE3 3.7Å; F319-W323 AromaticContact CE1-CG 3.83Å; F319-W323 HydrophobicContact CE1-CG 3.83Å; F319-W323 HydrophobicContact CE1-CH2 4.01Å; F319-W323 AromaticContact CE1-CZ2 3.71Å; F319-W323 HydrophobicContact CE1-CZ2 3.71Å; F319-W323 HydrophobicContact CE1-CZ3 4.03Å; F319-W323 AromaticContact CE1-NE1 3.89Å; F319-W323 AromaticContact CE2-CE2 3.9Å; F319-W323 HydrophobicContact CE2-CH2 4.45Å; F319-W323 AromaticContact CE2-CZ2 3.75Å; F319-W323 HydrophobicContact CE2-CZ2 3.75Å; F319-W323 AromaticContact CG-CD1 3.74Å; F319-W323 HydrophobicContact CG-CD2 4.31Å; F319-W323 AromaticContact CG-CE2 3.94Å; F319-W323 HydrophobicContact CG-CG 4.13Å; F319-W323 AromaticContact CG-NE1 3.57Å; F319-W323 AromaticContact CZ-CD2 4Å; F319-W323 HydrophobicContact CZ-CD2 4Å; F319-W323 AromaticContact CZ-CE2 3.56Å; F319-W323 HydrophobicContact CZ-CE3 4.28Å; F319-W323 AromaticContact CZ-CH2 3.72Å; F319-W323 HydrophobicContact CZ-CH2 3.72Å; F319-W323 AromaticContact CZ-CZ2 3.4Å; F319-W323 HydrophobicContact CZ-CZ2 3.4Å; F319-W323 HydrophobicContact CZ-CZ3 4.18Å
320	S	55	Low	59.9	Low	77 Å²	77	70.9 Å²	70.9	54%	0.538	36%	0.359	S	S	.	.	S	Bend	trans	-55.8	-33.8	-171.3	61.1	0	0	0	0	116.1	K316	K316-S320 WeakPolarHBondContact O-CB 3.39Å; K316-S320 PolarHBondContact O-N 3.45Å; K316-S320 VanDerWaalsContact O-N 3.12Å
321	E	50.5	Low	60.2	Low	159 Å²	159	71.2 Å²	71.2	74%	0.743	36%	0.359	S	S	*	.	S	Bend	trans	-147.4	10.1	-168.7	-63.8	-173.9	144.6	0	0	115.9	F319	F319-E321 VanDerWaalsContact C-N 3.3Å; F319-E321 PolarHBondContact O-N 3.33Å; F319-E321 VanDerWaalsContact O-N 3.09Å
322	G	55.7	Low	60.9	Low	26 Å²	26	75.5 Å²	75.5	27%	0.268	37%	0.373	S	S	.	.	S	Bend	trans	-129.6	-28.5	-161.4	0	0	0	0	0	119.1	K325 L326	G322-K325 PolarHBondContact O-N 3.19Å; G322-L326 WeakPolarHBondContact O-CB 3.49Å; G322-L326 PolarHBondContact O-N 2.82Å
323	W	56.4	Low	61.6	Low	67 Å²	67	74.9 Å²	74.9	25%	0.254	36%	0.364	S	S	.	.	H	α-helix	trans	-76.7	-39.2	-162.6	-78.6	64.8	0	0	0	114.3	L82 F284 L318 F319 K325 L326 G327	L82-W323 HydrophobicContact CD2-CH2 3.41Å; L82-W323 VanDerWaalsContact CD2-CH2 3.41Å; L82-W323 HydrophobicContact CD2-CZ2 3.52Å; F284-W323 HydrophobicContact CD2-CH2 4.41Å; F284-W323 AromaticContact CD2-CZ3 3.99Å; F284-W323 HydrophobicContact CD2-CZ3 3.99Å; F284-W323 HydrophobicContact CE2-CE3 4.06Å; F284-W323 HydrophobicContact CE2-CH2 4.19Å; F284-W323 AromaticContact CE2-CZ3 3.44Å; F284-W323 HydrophobicContact CE2-CZ3 3.44Å; F284-W323 VanDerWaalsContact CE2-CZ3 3.44Å; F284-W323 HydrophobicContact CZ-CZ3 4.33Å; L318-W323 PolarHBondContact O-NE1 2.88Å; F319-W323 HydrophobicContact CD1-CB 4.18Å; F319-W323 AromaticContact CD1-CD1 3.57Å; F319-W323 AromaticContact CD1-CD2 3.55Å; F319-W323 HydrophobicContact CD1-CD2 3.55Å; F319-W323 AromaticContact CD1-CE2 3.6Å; F319-W323 HydrophobicContact CD1-CE3 4.3Å; F319-W323 AromaticContact CD1-CG 3.48Å; F319-W323 HydrophobicContact CD1-CG 3.48Å; F319-W323 VanDerWaalsContact CD1-CG 3.48Å; F319-W323 HydrophobicContact CD1-CZ2 4.31Å; F319-W323 AromaticContact CD1-NE1 3.59Å; F319-W323 HydrophobicContact CD2-CZ2 4.33Å; F319-W323 AromaticContact CD2-NE1 3.83Å; F319-W323 AromaticContact CE1-CD2 3.36Å; F319-W323 HydrophobicContact CE1-CD2 3.36Å; F319-W323 AromaticContact CE1-CE2 3.39Å; F319-W323 AromaticContact CE1-CE3 3.7Å; F319-W323 HydrophobicContact CE1-CE3 3.7Å; F319-W323 AromaticContact CE1-CG 3.83Å; F319-W323 HydrophobicContact CE1-CG 3.83Å; F319-W323 HydrophobicContact CE1-CH2 4.01Å; F319-W323 AromaticContact CE1-CZ2 3.71Å; F319-W323 HydrophobicContact CE1-CZ2 3.71Å; F319-W323 HydrophobicContact CE1-CZ3 4.03Å; F319-W323 AromaticContact CE1-NE1 3.89Å; F319-W323 AromaticContact CE2-CE2 3.9Å; F319-W323 HydrophobicContact CE2-CH2 4.45Å; F319-W323 AromaticContact CE2-CZ2 3.75Å; F319-W323 HydrophobicContact CE2-CZ2 3.75Å; F319-W323 AromaticContact CG-CD1 3.74Å; F319-W323 HydrophobicContact CG-CD2 4.31Å; F319-W323 AromaticContact CG-CE2 3.94Å; F319-W323 HydrophobicContact CG-CG 4.13Å; F319-W323 AromaticContact CG-NE1 3.57Å; F319-W323 AromaticContact CZ-CD2 4Å; F319-W323 HydrophobicContact CZ-CD2 4Å; F319-W323 AromaticContact CZ-CE2 3.56Å; F319-W323 HydrophobicContact CZ-CE3 4.28Å; F319-W323 AromaticContact CZ-CH2 3.72Å; F319-W323 HydrophobicContact CZ-CH2 3.72Å; F319-W323 AromaticContact CZ-CZ2 3.4Å; F319-W323 HydrophobicContact CZ-CZ2 3.4Å; F319-W323 HydrophobicContact CZ-CZ3 4.18Å; W323-K325 VanDerWaalsContact C-N 3.34Å; W323-L326 PolarHBondContact O-N 2.86Å; W323-G327 PolarHBondContact O-N 3.4Å
324	E	57.2	Low	62.2	Low	112 Å²	112	73.7 Å²	73.7	52%	0.523	36%	0.363	S	S	.	.	H	α-helix	trans	-61.9	-44.9	173	-171.9	165.9	-135	0	0	110.4	A249 L326 G327 M328	A249-E324 WeakPolarHBondContact CB-OE1 3.38Å; E324-L326 VanDerWaalsContact C-N 3.29Å; E324-L326 PolarHBondContact O-N 3.49Å; E324-G327 PolarHBondContact O-N 3.45Å; E324-M328 HydrophobicContact CG-CE 4.41Å; E324-M328 VanDerWaalsContact O-CB 3.29Å; E324-M328 WeakPolarHBondContact O-CB 3.48Å; E324-M328 WeakPolarHBondContact O-CG 3.21Å; E324-M328 PolarHBondContact O-N 2.81Å
325	K	61.5	Low	63.1	Low	160 Å²	160	74.5 Å²	74.5	70%	0.696	37%	0.365	S	S	*	.	H	α-helix	trans	-59.4	-36.9	173.7	-67.4	177.7	-179.8	168.5	0	112.9	G322 W323 Y329	G322-K325 PolarHBondContact O-N 3.19Å; W323-K325 VanDerWaalsContact C-N 3.34Å; K325-Y329 WeakPolarHBondContact O-CB 3.3Å; K325-Y329 PolarHBondContact O-N 3.35Å
326	L	60.3	Low	64	Low	29 Å²	29	78.2 Å²	78.2	15%	0.152	39%	0.385	C	S	.	.	H	α-helix	trans	-76	-43.3	-179.4	-164	69.6	0	0	0	112.1	A75 L79 G322 W323 E324 M328 Y329 E330	A75-L326 HydrophobicContact CB-CD1 4.45Å; L79-L326 HydrophobicContact CB-CD2 4.44Å; L79-L326 HydrophobicContact CD1-CD2 4.01Å; L79-L326 HydrophobicContact CD2-CD2 4.22Å; L79-L326 HydrophobicContact CG-CD2 4.44Å; G322-L326 WeakPolarHBondContact O-CB 3.49Å; G322-L326 PolarHBondContact O-N 2.82Å; W323-L326 PolarHBondContact O-N 2.86Å; E324-L326 VanDerWaalsContact C-N 3.29Å; E324-L326 PolarHBondContact O-N 3.49Å; L326-M328 VanDerWaalsContact C-N 3.33Å; L326-M328 PolarHBondContact O-N 3.19Å; L326-Y329 WeakPolarHBondContact O-CB 3.45Å; L326-Y329 PolarHBondContact O-N 2.86Å; L326-Y329 VanDerWaalsContact O-N 3.17Å; L326-E330 PolarHBondContact O-N 3.3Å
327	G	62.4	Low	65	Low	32 Å²	32	77.6 Å²	77.6	33%	0.33	38%	0.383	S	S	.	.	H	α-helix	trans	-63.6	-38.2	173.3	0	0	0	0	0	112.3	W323 E324 Y331	W323-G327 PolarHBondContact O-N 3.4Å; E324-G327 PolarHBondContact O-N 3.45Å; G327-Y331 VanDerWaalsContact O-CB 3.31Å; G327-Y331 WeakPolarHBondContact O-CB 3.42Å; G327-Y331 PolarHBondContact O-N 2.78Å
328	M	65	Low	66	Low	39 Å²	39	75.4 Å²	75.4	19%	0.192	37%	0.374	C	S	.	.	H	α-helix	trans	-60.7	-47.6	169.4	-68.6	-76.5	157.9	0	0	111.1	A249 V253 E324 L326 Y331 Y332	A249-M328 HydrophobicContact CB-CE 3.56Å; V253-M328 HydrophobicContact CB-CE 4.21Å; V253-M328 HydrophobicContact CG2-CE 3.47Å; V253-M328 VanDerWaalsContact CG2-CE 3.47Å; V253-M328 HydrophobicContact CG2-SD 3.75Å; E324-M328 HydrophobicContact CG-CE 4.41Å; E324-M328 VanDerWaalsContact O-CB 3.29Å; E324-M328 WeakPolarHBondContact O-CB 3.48Å; E324-M328 WeakPolarHBondContact O-CG 3.21Å; E324-M328 PolarHBondContact O-N 2.81Å; L326-M328 VanDerWaalsContact C-N 3.33Å; L326-M328 PolarHBondContact O-N 3.19Å; M328-Y331 WeakPolarHBondContact O-CB 3.13Å; M328-Y331 PolarHBondContact O-N 3.29Å; M328-Y332 HydrophobicContact CB-CD2 4.46Å; M328-Y332 HydrophobicContact CB-CE2 4.4Å; M328-Y332 WeakPolarHBondContact O-CD2 3.5Å; M328-Y332 PolarHBondContact O-N 3.37Å
329	Y	68.2	Low	67.4	Low	153 Å²	153	76.8 Å²	76.8	60%	0.6	38%	0.383	S	S	*	.	H	α-helix	trans	-60.9	-46	178.7	179.5	-99.4	0	0	0	112.5	K325 L326 Y331 Y332 V333	K325-Y329 WeakPolarHBondContact O-CB 3.3Å; K325-Y329 PolarHBondContact O-N 3.35Å; L326-Y329 WeakPolarHBondContact O-CB 3.45Å; L326-Y329 PolarHBondContact O-N 2.86Å; L326-Y329 VanDerWaalsContact O-N 3.17Å; Y329-Y331 VanDerWaalsContact C-N 3.33Å; Y329-Y331 PolarHBondContact O-N 2.77Å; Y329-Y332 PolarHBondContact O-N 2.89Å; Y329-V333 HydrophobicContact CD1-CG2 4.35Å; Y329-V333 HydrophobicContact CE1-CG2 3.93Å; Y329-V333 HydrophobicContact CE2-CG2 4.17Å; Y329-V333 WeakPolarHBondContact O-CB 3.39Å; Y329-V333 WeakPolarHBondContact O-CG2 3.25Å; Y329-V333 PolarHBondContact O-N 3.13Å
330	E	69.3	Low	68.7	Low	103 Å²	103	76.5 Å²	76.5	48%	0.481	39%	0.391	S	S	.	.	H	α-helix	trans	-63.3	-39.1	175.8	-71.9	-177	172.8	0	0	112	L326 V333 A334	L326-E330 PolarHBondContact O-N 3.3Å; E330-V333 PolarHBondContact O-N 3Å; E330-A334 WeakPolarHBondContact O-CB 3.3Å; E330-A334 PolarHBondContact O-N 3.4Å
331	Y	70.8	Confident	70	Confident	30 Å²	30	74.5 Å²	74.5	12%	0.118	38%	0.379	C	S	.	.	H	α-helix	trans	-62.5	-47.6	172.6	172.1	-97.5	0	0	0	112.5	V253 V256 L258 G327 M328 Y329 V333 A334 K335	V253-Y331 HydrophobicContact CG1-CD1 3.45Å; V253-Y331 VanDerWaalsContact CG1-CD1 3.45Å; V253-Y331 HydrophobicContact CG1-CD2 3.22Å; V253-Y331 HydrophobicContact CG1-CE1 3.86Å; V253-Y331 HydrophobicContact CG1-CE2 3.63Å; V253-Y331 HydrophobicContact CG1-CG 3.1Å; V253-Y331 VanDerWaalsContact O-CE2 3.28Å; V253-Y331 WeakPolarHBondContact O-CE2 3.28Å; V256-Y331 WeakPolarHBondContact CB-OH 3.32Å; V256-Y331 WeakPolarHBondContact CG1-OH 3.43Å; L258-Y331 HydrophobicContact CD2-CD2 3.82Å; L258-Y331 HydrophobicContact CD2-CE2 3.52Å; G327-Y331 VanDerWaalsContact O-CB 3.31Å; G327-Y331 WeakPolarHBondContact O-CB 3.42Å; G327-Y331 PolarHBondContact O-N 2.78Å; M328-Y331 WeakPolarHBondContact O-CB 3.13Å; M328-Y331 PolarHBondContact O-N 3.29Å; Y329-Y331 VanDerWaalsContact C-N 3.33Å; Y329-Y331 PolarHBondContact O-N 2.77Å; Y331-V333 PolarHBondContact O-N 3.33Å; Y331-A334 CarbonylContact O-C 3.58Å; Y331-A334 WeakPolarHBondContact O-CB 3.45Å; Y331-A334 PolarHBondContact O-N 2.93Å; Y331-A334 VanDerWaalsContact O-N 3.13Å; Y331-K335 HydrophobicContact CE1-CD 4.14Å; Y331-K335 WeakPolarHBondContact O-CB 3.4Å; Y331-K335 PolarHBondContact O-N 3.42Å
332	Y	75	Confident	71.5	Confident	132 Å²	132	69.9 Å²	69.9	52%	0.518	36%	0.356	S	S	.	.	H	α-helix	trans	-62	-43.1	177.5	-78.3	-66.8	0	0	0	111.3	M328 Y329 A334 K335 D336	M328-Y332 HydrophobicContact CB-CD2 4.46Å; M328-Y332 HydrophobicContact CB-CE2 4.4Å; M328-Y332 WeakPolarHBondContact O-CD2 3.5Å; M328-Y332 PolarHBondContact O-N 3.37Å; Y329-Y332 PolarHBondContact O-N 2.89Å; Y332-A334 VanDerWaalsContact C-N 3.28Å; Y332-A334 PolarHBondContact O-N 3.47Å; Y332-K335 PolarHBondContact O-N 3.08Å; Y332-K335 VanDerWaalsContact O-N 3.16Å; Y332-D336 VanDerWaalsContact O-CG 3.25Å; Y332-D336 PolarHBondContact O-N 2.9Å
333	V	76.6	Confident	72.8	Confident	45 Å²	45	74.1 Å²	74.1	27%	0.273	37%	0.368	S	S	.	.	H	α-helix	trans	-62.5	-33.8	174.1	170.5	0	0	0	0	112.3	Y329 E330 Y331 K337	Y329-V333 HydrophobicContact CD1-CG2 4.35Å; Y329-V333 HydrophobicContact CE1-CG2 3.93Å; Y329-V333 HydrophobicContact CE2-CG2 4.17Å; Y329-V333 WeakPolarHBondContact O-CB 3.39Å; Y329-V333 WeakPolarHBondContact O-CG2 3.25Å; Y329-V333 PolarHBondContact O-N 3.13Å; E330-V333 PolarHBondContact O-N 3Å; Y331-V333 PolarHBondContact O-N 3.33Å; V333-K337 HydrophobicContact CG1-CD 4.49Å; V333-K337 WeakPolarHBondContact O-CD 3.14Å; V333-K337 VanDerWaalsContact O-CG 3.26Å; V333-K337 WeakPolarHBondContact O-CG 3.39Å; V333-K337 PolarHBondContact O-N 3.35Å
334	A	75.6	Confident	74.1	Confident	39 Å²	39	77.8 Å²	77.8	32%	0.322	39%	0.388	S	S	.	.	H	α-helix	trans	-73.4	-38.6	173.6	0	0	0	0	0	112.3	L258 E330 Y331 Y332 K337 A338	L258-A334 HydrophobicContact CD2-CB 4.31Å; E330-A334 WeakPolarHBondContact O-CB 3.3Å; E330-A334 PolarHBondContact O-N 3.4Å; Y331-A334 CarbonylContact O-C 3.58Å; Y331-A334 WeakPolarHBondContact O-CB 3.45Å; Y331-A334 PolarHBondContact O-N 2.93Å; Y331-A334 VanDerWaalsContact O-N 3.13Å; Y332-A334 VanDerWaalsContact C-N 3.28Å; Y332-A334 PolarHBondContact O-N 3.47Å; A334-K337 PolarHBondContact O-N 3.43Å; A334-A338 WeakPolarHBondContact O-CB 3.48Å; A334-A338 PolarHBondContact O-N 2.77Å
335	K	78.1	Confident	75.2	Confident	44 Å²	44	80.2 Å²	80.2	19%	0.191	39%	0.392	C	S	.	.	H	α-helix	trans	-63.3	-48.9	176	-178.3	166.7	-172.9	167.6	0	111	L258 A260 Y331 Y332 K337 A338 V339	L258-K335 HydrophobicContact CD2-CB 4.29Å; A260-K335 VanDerWaalsContact O-CE 3.25Å; A260-K335 WeakPolarHBondContact O-CE 3.31Å; A260-K335 PolarHBondContact O-NZ 3.02Å; Y331-K335 HydrophobicContact CE1-CD 4.14Å; Y331-K335 WeakPolarHBondContact O-CB 3.4Å; Y331-K335 PolarHBondContact O-N 3.42Å; Y332-K335 PolarHBondContact O-N 3.08Å; Y332-K335 VanDerWaalsContact O-N 3.16Å; K335-K337 VanDerWaalsContact C-N 3.28Å; K335-K337 PolarHBondContact O-N 2.76Å; K335-A338 PolarHBondContact O-N 3.36Å; K335-V339 HydrophobicContact CG-CG2 4.33Å; K335-V339 WeakPolarHBondContact O-CG2 3.38Å; K335-V339 PolarHBondContact O-N 3.04Å
336	D	80.7	Confident	76.1	Confident	108 Å²	108	76.9 Å²	76.9	58%	0.578	38%	0.379	S	S	*	.	H	α-helix	trans	-58.3	-41.1	177.2	-67.5	-15.6	0	0	0	111.5	Y332 A340	Y332-D336 VanDerWaalsContact O-CG 3.25Å; Y332-D336 PolarHBondContact O-N 2.9Å; D336-A340 VanDerWaalsContact O-CB 3.27Å; D336-A340 WeakPolarHBondContact O-CB 3.24Å; D336-A340 PolarHBondContact O-N 2.8Å
337	K	82.1	Confident	77.1	Confident	143 Å²	143	80.4 Å²	80.4	62%	0.622	39%	0.393	S	S	*	.	H	α-helix	trans	-65.6	-40.7	174	-73.5	170.5	-174.9	171.7	0	112.8	V333 A334 K335 A341	V333-K337 HydrophobicContact CG1-CD 4.49Å; V333-K337 WeakPolarHBondContact O-CD 3.14Å; V333-K337 VanDerWaalsContact O-CG 3.26Å; V333-K337 WeakPolarHBondContact O-CG 3.39Å; V333-K337 PolarHBondContact O-N 3.35Å; A334-K337 PolarHBondContact O-N 3.43Å; K335-K337 VanDerWaalsContact C-N 3.28Å; K335-K337 PolarHBondContact O-N 2.76Å; K337-A341 VanDerWaalsContact O-CB 3.29Å; K337-A341 WeakPolarHBondContact O-CB 3.31Å; K337-A341 PolarHBondContact O-N 3.04Å
338	A	78.3	Confident	77.7	Confident	19 Å²	19	79.8 Å²	79.8	16%	0.157	39%	0.387	C	S	.	.	H	α-helix	trans	-67.2	-43.9	178.1	0	0	0	0	0	111.6	L258 A334 K335 A341 K342	L258-A338 HydrophobicContact CB-CB 3.64Å; L258-A338 HydrophobicContact CD1-CB 4.39Å; A334-A338 WeakPolarHBondContact O-CB 3.48Å; A334-A338 PolarHBondContact O-N 2.77Å; K335-A338 PolarHBondContact O-N 3.36Å; A338-A341 PolarHBondContact O-N 2.73Å; A338-K342 WeakPolarHBondContact O-CB 3.25Å; A338-K342 PolarHBondContact O-N 3.43Å
339	V	80.1	Confident	78.1	Confident	42 Å²	42	79.6 Å²	79.6	26%	0.255	39%	0.391	S	S	.	.	H	α-helix	trans	-61.5	-45.7	174.4	172.2	0	0	0	0	110.8	K335 A341 K342 F343	K335-V339 HydrophobicContact CG-CG2 4.33Å; K335-V339 WeakPolarHBondContact O-CG2 3.38Å; K335-V339 PolarHBondContact O-N 3.04Å; V339-A341 PolarHBondContact O-N 3.38Å; V339-K342 PolarHBondContact O-N 3.05Å; V339-F343 PolarHBondContact O-N 2.7Å
340	A	84.1	Confident	78.4	Confident	48 Å²	48	77.5 Å²	77.5	40%	0.397	39%	0.387	S	S	.	.	H	α-helix	trans	-62.1	-40.2	175.3	0	0	0	0	0	112.6	D336 Q344	D336-A340 VanDerWaalsContact O-CB 3.27Å; D336-A340 WeakPolarHBondContact O-CB 3.24Å; D336-A340 PolarHBondContact O-N 2.8Å; A340-Q344 WeakPolarHBondContact O-CG 3.43Å; A340-Q344 PolarHBondContact O-N 3.26Å
341	A	83	Confident	78.5	Confident	35 Å²	35	78.4 Å²	78.4	29%	0.289	39%	0.391	S	S	.	.	H	α-helix	trans	-67.9	-37.3	176.2	0	0	0	0	0	112.5	K337 A338 V339 Q344 R345	K337-A341 VanDerWaalsContact O-CB 3.29Å; K337-A341 WeakPolarHBondContact O-CB 3.31Å; K337-A341 PolarHBondContact O-N 3.04Å; A338-A341 PolarHBondContact O-N 2.73Å; V339-A341 PolarHBondContact O-N 3.38Å; A341-Q344 PolarHBondContact O-N 2.96Å; A341-R345 WeakPolarHBondContact O-CG 3.48Å; A341-R345 PolarHBondContact O-N 3.07Å
342	K	82.1	Confident	78.2	Confident	61 Å²	61	84.9 Å²	84.9	27%	0.265	42%	0.415	S	S	.	.	H	α-helix	trans	-62.6	-49.5	173.7	-177.3	176.3	174.5	-179.3	0	110.9	E259 A338 V339 Q344 R345 E346	E259-K342 HydrophobicContact CB-CD 4.29Å; A338-K342 WeakPolarHBondContact O-CB 3.25Å; A338-K342 PolarHBondContact O-N 3.43Å; V339-K342 PolarHBondContact O-N 3.05Å; K342-Q344 VanDerWaalsContact C-N 3.29Å; K342-Q344 PolarHBondContact O-N 3.01Å; K342-R345 WeakPolarHBondContact O-CA 3.41Å; K342-R345 WeakPolarHBondContact O-CB 3.33Å; K342-R345 PolarHBondContact O-N 3.39Å; K342-E346 WeakPolarHBondContact CE-OE1 3.33Å; K342-E346 WeakPolarHBondContact CG-OE1 3.34Å; K342-E346 WeakPolarHBondContact O-CG 3.25Å; K342-E346 PolarHBondContact O-N 2.8Å
343	F	83	Confident	77.8	Confident	116 Å²	116	83.5 Å²	83.5	51%	0.509	42%	0.417	S	S	.	.	H	α-helix	trans	-59.3	-37	176.5	-173.3	-112.3	0	0	0	113	V339 K347	V339-F343 PolarHBondContact O-N 2.7Å; F343-K347 HydrophobicContact CD1-CD 4.42Å; F343-K347 HydrophobicContact CE1-CD 3.95Å; F343-K347 HydrophobicContact CZ-CD 4.21Å; F343-K347 VanDerWaalsContact CZ-CE 3.43Å; F343-K347 WeakPolarHBondContact O-CB 3.43Å; F343-K347 PolarHBondContact O-N 2.99Å
344	Q	82.2	Confident	77.4	Confident	144 Å²	144	89 Å²	89	67%	0.673	43%	0.433	S	S	*	.	H	α-helix	trans	-68.2	-37.8	172.5	-75.6	-179.2	-3.6	0	0	113.1	A340 A341 K342 G348	A340-Q344 WeakPolarHBondContact O-CG 3.43Å; A340-Q344 PolarHBondContact O-N 3.26Å; A341-Q344 PolarHBondContact O-N 2.96Å; K342-Q344 VanDerWaalsContact C-N 3.29Å; K342-Q344 PolarHBondContact O-N 3.01Å; Q344-G348 PolarHBondContact O-N 2.88Å
345	R	80.4	Confident	76.7	Confident	162 Å²	162	90.4 Å²	90.4	61%	0.611	44%	0.44	S	S	*	.	H	α-helix	trans	-66.6	-39.2	174.4	-71.7	170.3	-174.6	162.9	2.1	111.8	E259 A341 K342 G348 A349	E259-R345 IonicContact OE1-NH1 2.71Å; A341-R345 WeakPolarHBondContact O-CG 3.48Å; A341-R345 PolarHBondContact O-N 3.07Å; K342-R345 WeakPolarHBondContact O-CA 3.41Å; K342-R345 WeakPolarHBondContact O-CB 3.33Å; K342-R345 PolarHBondContact O-N 3.39Å; R345-G348 CarbonylContact O-C 3.56Å; R345-A349 VanDerWaalsContact O-CB 3.25Å; R345-A349 WeakPolarHBondContact O-CB 3.28Å; R345-A349 PolarHBondContact O-N 2.77Å
346	E	81.5	Confident	75.9	Confident	90 Å²	90	92.2 Å²	92.2	42%	0.421	45%	0.454	S	S	.	.	H	α-helix	trans	-66.5	-51.3	177.2	-73.5	165.1	173.4	0	0	110.6	K342 G348 A349 E350	K342-E346 WeakPolarHBondContact CE-OE1 3.33Å; K342-E346 WeakPolarHBondContact CG-OE1 3.34Å; K342-E346 WeakPolarHBondContact O-CG 3.25Å; K342-E346 PolarHBondContact O-N 2.8Å; E346-G348 PolarHBondContact O-N 3.3Å; E346-A349 CarbonylContact O-C 3.6Å; E346-A349 WeakPolarHBondContact O-CA 3.49Å; E346-A349 WeakPolarHBondContact O-CB 3.42Å; E346-A349 PolarHBondContact O-N 3.39Å; E346-E350 PolarHBondContact O-N 3.24Å
347	K	80.1	Confident	75	Confident	103 Å²	103	92.3 Å²	92.3	45%	0.448	46%	0.455	S	S	.	.	H	α-helix	trans	-56.6	-46	171.6	-79.7	-169.2	167.3	-172.8	0	112.9	F343 A349 E350 E351	F343-K347 HydrophobicContact CD1-CD 4.42Å; F343-K347 HydrophobicContact CE1-CD 3.95Å; F343-K347 HydrophobicContact CZ-CD 4.21Å; F343-K347 VanDerWaalsContact CZ-CE 3.43Å; F343-K347 WeakPolarHBondContact O-CB 3.43Å; F343-K347 PolarHBondContact O-N 2.99Å; K347-A349 PolarHBondContact O-N 3.29Å; K347-E350 PolarHBondContact O-N 2.85Å; K347-E351 WeakPolarHBondContact O-CB 3.25Å; K347-E351 WeakPolarHBondContact O-CG 3.28Å; K347-E351 PolarHBondContact O-N 3.02Å
348	G	75.2	Confident	73.9	Confident	20 Å²	20	88 Å²	88	21%	0.206	44%	0.442	C	S	.	.	H	α-helix	trans	-68.7	-17	176.5	0	0	0	0	0	114.1	Q344 R345 E346 R352	Q344-G348 PolarHBondContact O-N 2.88Å; R345-G348 CarbonylContact O-C 3.56Å; E346-G348 PolarHBondContact O-N 3.3Å; G348-R352 WeakPolarHBondContact O-CB 3.34Å; G348-R352 VanDerWaalsContact O-CG 3.31Å; G348-R352 WeakPolarHBondContact O-CG 3.21Å; G348-R352 PolarHBondContact O-N 3.37Å; G348-R352 PolarHBondContact O-NE 2.86Å
349	A	73.2	Confident	72.7	Confident	34 Å²	34	91.5 Å²	91.5	28%	0.281	46%	0.458	S	S	.	.	H	α-helix	trans	-84.9	-40.9	170.1	0	0	0	0	0	110.9	R345 E346 K347 R352 N353	R345-A349 VanDerWaalsContact O-CB 3.25Å; R345-A349 WeakPolarHBondContact O-CB 3.28Å; R345-A349 PolarHBondContact O-N 2.77Å; E346-A349 CarbonylContact O-C 3.6Å; E346-A349 WeakPolarHBondContact O-CA 3.49Å; E346-A349 WeakPolarHBondContact O-CB 3.42Å; E346-A349 PolarHBondContact O-N 3.39Å; K347-A349 PolarHBondContact O-N 3.29Å; A349-R352 PolarHBondContact O-N 2.71Å; A349-N353 VanDerWaalsContact O-CB 3.31Å; A349-N353 WeakPolarHBondContact O-CB 3.26Å; A349-N353 PolarHBondContact O-N 2.79Å; A349-N353 PolarHBondContact O-ND2 2.79Å
350	E	74.8	Confident	71.6	Confident	110 Å²	110	94.5 Å²	94.5	51%	0.514	48%	0.476	S	S	.	.	H	α-helix	trans	-62	-40.8	171	-74	-174.3	-174.2	0	0	112.6	E346 K347 N353 R354	E346-E350 PolarHBondContact O-N 3.24Å; K347-E350 PolarHBondContact O-N 2.85Å; E350-N353 PolarHBondContact O-N 3.43Å; E350-R354 VanDerWaalsContact O-CB 3.31Å; E350-R354 WeakPolarHBondContact O-CB 3.19Å; E350-R354 PolarHBondContact O-N 3.46Å; E350-R354 IonicContact OE2-NH2 2.73Å; E350-R354 PolarHBondContact OE2-NH2 3.46Å
351	E	72.7	Confident	70.2	Confident	122 Å²	122	95 Å²	95	57%	0.57	48%	0.48	S	S	*	.	H	α-helix	trans	-68.9	-38.9	175.8	-76.4	173	-176.4	0	0	111.5	K347 R354 C355	K347-E351 WeakPolarHBondContact O-CB 3.25Å; K347-E351 WeakPolarHBondContact O-CG 3.28Å; K347-E351 PolarHBondContact O-N 3.02Å; E351-R354 CarbonylContact O-C 3.59Å; E351-R354 PolarHBondContact O-N 3.43Å; E351-C355 VanDerWaalsContact O-CB 3.24Å; E351-C355 WeakPolarHBondContact O-CB 2.92Å; E351-C355 PolarHBondContact O-N 3.2Å
352	R	64.2	Low	68.7	Low	166 Å²	166	97.6 Å²	97.6	63%	0.626	49%	0.487	S	S	*	.	H	α-helix	trans	-66.6	-40.9	171.4	-81.9	179.9	-68.1	164.5	2.6	112	G348 A349 R354 C355 V356	G348-R352 WeakPolarHBondContact O-CB 3.34Å; G348-R352 VanDerWaalsContact O-CG 3.31Å; G348-R352 WeakPolarHBondContact O-CG 3.21Å; G348-R352 PolarHBondContact O-N 3.37Å; G348-R352 PolarHBondContact O-NE 2.86Å; A349-R352 PolarHBondContact O-N 2.71Å; R352-R354 VanDerWaalsContact C-N 3.34Å; R352-C355 CarbonylContact O-C 3.37Å; R352-C355 PolarHBondContact O-N 3.03Å; R352-V356 WeakPolarHBondContact O-CB 3.49Å; R352-V356 WeakPolarHBondContact O-CG2 3.34Å; R352-V356 PolarHBondContact O-N 2.83Å
353	N	66.4	Low	67.2	Low	103 Å²	103	104.6 Å²	104.6	55%	0.551	51%	0.513	S	S	*	.	H	α-helix	trans	-66.5	-37.1	174.4	-71.3	-15.3	0	0	0	111.2	A349 E350 N357	A349-N353 VanDerWaalsContact O-CB 3.31Å; A349-N353 WeakPolarHBondContact O-CB 3.26Å; A349-N353 PolarHBondContact O-N 2.79Å; A349-N353 PolarHBondContact O-ND2 2.79Å; E350-N353 PolarHBondContact O-N 3.43Å; N353-N357 VanDerWaalsContact O-CB 3.25Å; N353-N357 WeakPolarHBondContact O-CB 3.29Å; N353-N357 PolarHBondContact O-N 3.32Å; N353-N357 PolarHBondContact O-ND2 2.82Å
354	R	67.6	Low	65.8	Low	159 Å²	159	104.2 Å²	104.2	60%	0.6	53%	0.525	S	S	*	.	H	α-helix	trans	-63.8	-40.1	169.5	-109.1	178.2	-76.7	-156.1	-7.1	112	E350 E351 R352 S358	E350-R354 VanDerWaalsContact O-CB 3.31Å; E350-R354 WeakPolarHBondContact O-CB 3.19Å; E350-R354 PolarHBondContact O-N 3.46Å; E350-R354 IonicContact OE2-NH2 2.73Å; E350-R354 PolarHBondContact OE2-NH2 3.46Å; E351-R354 CarbonylContact O-C 3.59Å; E351-R354 PolarHBondContact O-N 3.43Å; R352-R354 VanDerWaalsContact C-N 3.34Å; R354-S358 WeakPolarHBondContact O-CA 3.42Å; R354-S358 WeakPolarHBondContact O-CB 3.48Å; R354-S358 PolarHBondContact O-N 2.64Å
355	C	61.5	Low	64.1	Low	70 Å²	70	100.5 Å²	100.5	47%	0.473	52%	0.519	S	S	.	.	H	α-helix	trans	-72.4	-34.9	178.6	-174	0	0	0	0	112	E351 R352 L359	E351-C355 VanDerWaalsContact O-CB 3.24Å; E351-C355 WeakPolarHBondContact O-CB 2.92Å; E351-C355 PolarHBondContact O-N 3.2Å; R352-C355 CarbonylContact O-C 3.37Å; R352-C355 PolarHBondContact O-N 3.03Å; C355-L359 VanDerWaalsContact O-CB 3.3Å; C355-L359 WeakPolarHBondContact O-CB 3.31Å; C355-L359 WeakPolarHBondContact O-CD1 3.33Å; C355-L359 WeakPolarHBondContact O-CG 3.43Å; C355-L359 PolarHBondContact O-N 2.89Å
356	V	60.4	Low	62.3	Low	81 Å²	81	100.7 Å²	100.7	49%	0.491	53%	0.526	S	S	.	.	H	α-helix	trans	-68.6	-46.3	171.6	170	0	0	0	0	110.7	R352 S358 L359 V360	R352-V356 WeakPolarHBondContact O-CB 3.49Å; R352-V356 WeakPolarHBondContact O-CG2 3.34Å; R352-V356 PolarHBondContact O-N 2.83Å; V356-S358 VanDerWaalsContact C-N 3.3Å; V356-S358 PolarHBondContact O-N 3.44Å; V356-L359 PolarHBondContact O-N 3.19Å; V356-V360 WeakPolarHBondContact O-CG2 3.36Å; V356-V360 PolarHBondContact O-N 3.42Å
357	N	61.3	Low	60.6	Low	111 Å²	111	101.9 Å²	101.9	59%	0.594	54%	0.544	S	S	*	.	H	α-helix	trans	-66	-34	175	-68.6	-10.4	0	0	0	111.8	N353 A361	N353-N357 VanDerWaalsContact O-CB 3.25Å; N353-N357 WeakPolarHBondContact O-CB 3.29Å; N353-N357 PolarHBondContact O-N 3.32Å; N353-N357 PolarHBondContact O-ND2 2.82Å; N357-A361 WeakPolarHBondContact O-CB 3.44Å; N357-A361 PolarHBondContact O-N 2.86Å
358	S	59.7	Low	59.1	Low	51 Å²	51	102 Å²	102	36%	0.357	56%	0.564	S	S	.	*	H	α-helix	trans	-63.4	-54.8	170.2	-164.2	0	0	0	0	109.2	R354 V356 V360 A361 E362	R354-S358 WeakPolarHBondContact O-CA 3.42Å; R354-S358 WeakPolarHBondContact O-CB 3.48Å; R354-S358 PolarHBondContact O-N 2.64Å; V356-S358 VanDerWaalsContact C-N 3.3Å; V356-S358 PolarHBondContact O-N 3.44Å; S358-V360 PolarHBondContact O-N 3.37Å; S358-V360 VanDerWaalsContact O-N 3.13Å; S358-A361 CarbonylContact O-C 3.44Å; S358-A361 WeakPolarHBondContact O-CA 3.26Å; S358-A361 PolarHBondContact O-N 3.2Å; S358-E362 WeakPolarHBondContact O-CA 3.44Å; S358-E362 WeakPolarHBondContact O-CB 3.37Å; S358-E362 PolarHBondContact O-N 3.39Å; S358-E362 PolarHBondContact OG-OE2 3.36Å
359	L	53.2	Low	57.6	Low	93 Å²	93	106.5 Å²	106.5	49%	0.487	59%	0.59	S	S	.	*	H	α-helix	trans	-54.3	-37.1	178	-83	159.2	0	0	0	113	C355 V356 Y363	C355-L359 VanDerWaalsContact O-CB 3.3Å; C355-L359 WeakPolarHBondContact O-CB 3.31Å; C355-L359 WeakPolarHBondContact O-CD1 3.33Å; C355-L359 WeakPolarHBondContact O-CG 3.43Å; C355-L359 PolarHBondContact O-N 2.89Å; V356-L359 PolarHBondContact O-N 3.19Å; L359-Y363 WeakPolarHBondContact O-CB 3.49Å; L359-Y363 PolarHBondContact O-N 2.89Å
360	V	57.6	Low	56.4	Low	105 Å²	105	111.3 Å²	111.3	64%	0.636	62%	0.616	S	S	*	*	H	α-helix	trans	-67.5	-37.5	172.9	171.4	0	0	0	0	112.2	V356 S358	V356-V360 WeakPolarHBondContact O-CG2 3.36Å; V356-V360 PolarHBondContact O-N 3.42Å; S358-V360 PolarHBondContact O-N 3.37Å; S358-V360 VanDerWaalsContact O-N 3.13Å
361	A	54.8	Low	55.1	Low	59 Å²	59	111.7 Å²	111.7	49%	0.488	63%	0.626	S	S	.	*	H	α-helix	trans	-81.6	-25.4	175.2	0	0	0	0	0	114.3	N357 S358 S364 A365	N357-A361 WeakPolarHBondContact O-CB 3.44Å; N357-A361 PolarHBondContact O-N 2.86Å; S358-A361 CarbonylContact O-C 3.44Å; S358-A361 WeakPolarHBondContact O-CA 3.26Å; S358-A361 PolarHBondContact O-N 3.2Å; A361-S364 CarbonylContact O-C 3.58Å; A361-S364 WeakPolarHBondContact O-CA 3.29Å; A361-S364 VanDerWaalsContact O-CB 3.25Å; A361-S364 WeakPolarHBondContact O-CB 3.27Å; A361-S364 PolarHBondContact O-N 2.78Å; A361-A365 PolarHBondContact O-N 3.06Å; A361-A365 VanDerWaalsContact O-N 3.14Å
362	E	50.4	Low	53.6	Low	90 Å²	90	110.9 Å²	110.9	42%	0.421	63%	0.634	S	S	.	*	H	α-helix	trans	-94.6	-20.2	-169.2	-169.8	169.9	178.5	0	0	111	S358 S364 A365 H366	S358-E362 WeakPolarHBondContact O-CA 3.44Å; S358-E362 WeakPolarHBondContact O-CB 3.37Å; S358-E362 PolarHBondContact O-N 3.39Å; S358-E362 PolarHBondContact OG-OE2 3.36Å; E362-S364 PolarHBondContact O-N 3.13Å; E362-A365 CarbonylContact O-C 3.4Å; E362-A365 PolarHBondContact O-N 2.85Å; E362-H366 PolarHBondContact O-N 3.33Å; E362-H366 PolarHBondContact O-ND1 2.75Å; E362-H366 VanDerWaalsContact O-ND1 3.12Å
363	Y	51.6	Low	52.7	Low	207 Å²	207	111.9 Å²	111.9	81%	0.812	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.6	-19	151.5	-108.5	-81.7	0	0	0	113.2	L359	L359-Y363 WeakPolarHBondContact O-CB 3.49Å; L359-Y363 PolarHBondContact O-N 2.89Å
364	S	52.6	Low	51.4	Low	109 Å²	109	110.9 Å²	110.9	76%	0.762	65%	0.652	S	S	*	*	S	Bend	trans	-104.6	-5.2	172.8	-52.7	0	0	0	0	113.5	A361 E362	A361-S364 CarbonylContact O-C 3.58Å; A361-S364 WeakPolarHBondContact O-CA 3.29Å; A361-S364 VanDerWaalsContact O-CB 3.25Å; A361-S364 WeakPolarHBondContact O-CB 3.27Å; A361-S364 PolarHBondContact O-N 2.78Å; E362-S364 PolarHBondContact O-N 3.13Å
365	A	47.1	Very low	50	Low	66 Å²	66	108.3 Å²	108.3	55%	0.545	66%	0.658	S	S	.	*			trans	-153.3	70.1	-171	0	0	0	0	0	112.9	A361 E362 S367	A361-A365 PolarHBondContact O-N 3.06Å; A361-A365 VanDerWaalsContact O-N 3.14Å; E362-A365 CarbonylContact O-C 3.4Å; E362-A365 PolarHBondContact O-N 2.85Å; A365-S367 PolarHBondContact O-N 3.26Å
366	H	43.4	Very low	48.9	Very low	166 Å²	166	112.4 Å²	112.4	77%	0.769	68%	0.675	S	S	*	*			trans	-69.4	110.1	166.8	-83.8	4.3	0	0	0	111.5	E362	E362-H366 PolarHBondContact O-N 3.33Å; E362-H366 PolarHBondContact O-ND1 2.75Å; E362-H366 VanDerWaalsContact O-ND1 3.12Å
367	S	43.9	Very low	47.9	Very low	115 Å²	115	117.2 Å²	117.2	80%	0.804	69%	0.693	S	S	*	*			trans	-174.4	91.2	147.3	25	0	0	0	0	116	A365	A365-S367 PolarHBondContact O-N 3.26Å
368	A	50.5	Low	46.6	Very low	104 Å²	104	123.6 Å²	123.6	86%	0.86	71%	0.708	S	S	*	*			trans	67.4	150	141.9	0	0	0	0	0	122.6
369	P	43	Very low	45.6	Very low	116 Å²	116	128.5 Å²	128.5	75%	0.753	73%	0.73	S	S	*	*			trans	-121.3	165.3	-171.8	43.2	-31.2	0	0	0	115.8
370	T	48.3	Very low	45.2	Very low	134 Å²	134	132.1 Å²	132.1	82%	0.822	75%	0.749	S	S	*	*			trans	175.3	154.4	158.5	36.5	0	0	0	0	108.9
371	T	45.9	Very low	44.7	Very low	119 Å²	119	129.6 Å²	129.6	73%	0.73	75%	0.745	S	S	*	*			cis	-167.4	163.2	-9	20.6	0	0	0	0	109.3
372	S	42.9	Very low	44.5	Very low	104 Å²	104	134.5 Å²	134.5	73%	0.727	76%	0.755	S	S	*	*			trans	50	123.5	150.3	64.6	0	0	0	0	119.4
373	E	43.9	Very low	44.4	Very low	187 Å²	187	137.3 Å²	137.3	87%	0.874	77%	0.768	S	S	*	*				175.7	168.6	76.8	-97.3	-134.7	114.9	0	0	108.7
374	A	40.7	Very low	44.5	Very low	83 Å²	83	131.9 Å²	131.9	69%	0.686	76%	0.757	S	S	*	*			cis	-158.3	-172.5	-6.2	0	0	0	0	0	110.2
375	S	36.8	Very low	44.4	Very low	105 Å²	105	131.2 Å²	131.2	73%	0.734	75%	0.748	S	S	*	*			trans	-112	149.1	177.8	57.3	0	0	0	0	113.5
376	N	39.1	Very low	45	Very low	156 Å²	156	134.1 Å²	134.1	83%	0.834	75%	0.75	S	S	*	*				-171.4	176	116.8	-132.3	-28.6	0	0	0	115.9
377	E	39.7	Very low	46	Very low	182 Å²	182	130.1 Å²	130.1	85%	0.85	74%	0.738	S	S	*	*			trans	76.5	94.7	164.2	-55.5	-155	151.1	0	0	119.8
378	R	33.6	Very low	46.6	Very low	244 Å²	244	128.7 Å²	128.7	92%	0.921	72%	0.72	S	S	*	*			trans	-154.6	64.9	164	-151.2	179.1	-164.7	-174.6	6.7	114.7
379	L	39.2	Very low	47.3	Very low	154 Å²	154	127.7 Å²	127.7	81%	0.806	70%	0.703	S	S	*	*			trans	-145.7	87.6	-179.3	-100.4	154.8	0	0	0	113
380	N	44.8	Very low	48.4	Very low	169 Å²	169	130.7 Å²	130.7	90%	0.904	70%	0.701	S	S	*	*	S	Bend	trans	-161.9	-0.3	158.2	-113.1	-21.2	0	0	0	117
381	G	47.5	Very low	49.3	Very low	53 Å²	53	129.1 Å²	129.1	55%	0.546	69%	0.686	S	S	.	*	S	Bend	trans	-95.8	-6	-174.3	0	0	0	0	0	117.6
382	K	49	Very low	50.2	Low	162 Å²	162	128.3 Å²	128.3	70%	0.704	68%	0.677	S	S	*	*	H	α-helix	trans	-78.2	-31.8	-164.7	-71.3	-177.5	176.9	177.5	0	115.1
383	H	49.1	Very low	51.3	Low	149 Å²	149	131.4 Å²	131.4	69%	0.69	67%	0.673	S	S	*	*	H	α-helix	trans	-70.7	-36.5	-175	-97.9	-73.5	0	0	0	114	V385 Q386 T387	H383-V385 VanDerWaalsContact C-N 3.34Å; H383-V385 PolarHBondContact O-N 3.04Å; H383-Q386 PolarHBondContact O-N 2.87Å; H383-T387 PolarHBondContact O-N 2.9Å; H383-T387 PolarHBondContact O-OG1 3.49Å; H383-T387 VanDerWaalsContact O-OG1 3.09Å
384	T	52.8	Low	52.4	Low	93 Å²	93	129.9 Å²	129.9	57%	0.571	66%	0.661	S	S	*	*	H	α-helix	trans	-65.8	-38.4	-177.8	-38.8	0	0	0	0	112	T387 I388	T384-T387 PolarHBondContact O-N 3.17Å; T384-I388 HydrophobicContact CG2-CD1 4.31Å; T384-I388 WeakPolarHBondContact O-CG1 3.4Å; T384-I388 PolarHBondContact O-N 2.93Å
385	V	51.3	Low	53.5	Low	94 Å²	94	130.2 Å²	130.2	57%	0.57	65%	0.654	S	S	*	*	H	α-helix	trans	-66.3	-46.5	179.2	-177.5	0	0	0	0	110.8	H383 T387 I388 T389	H383-V385 VanDerWaalsContact C-N 3.34Å; H383-V385 PolarHBondContact O-N 3.04Å; V385-T387 VanDerWaalsContact C-N 3.34Å; V385-T387 PolarHBondContact O-N 2.87Å; V385-I388 PolarHBondContact O-N 3.41Å; V385-T389 PolarHBondContact O-N 3.4Å; V385-T389 PolarHBondContact O-OG1 2.9Å
386	Q	59.5	Low	54.8	Low	128 Å²	128	128.5 Å²	128.5	60%	0.598	64%	0.639	S	S	*	*	H	α-helix	trans	-58	-43.6	177	-78.7	-177.1	-41.8	0	0	112.6	H383 T389 Y390	H383-Q386 PolarHBondContact O-N 2.87Å; Q386-T389 PolarHBondContact O-N 2.98Å; Q386-Y390 PolarHBondContact O-N 3.49Å
387	T	63.8	Low	56.2	Low	82 Å²	82	122.7 Å²	122.7	50%	0.503	61%	0.61	S	S	.	*	H	α-helix	trans	-63	-44	179.6	-54.6	0	0	0	0	112.1	H383 T384 V385 Y390 I391	H383-T387 PolarHBondContact O-N 2.9Å; H383-T387 PolarHBondContact O-OG1 3.49Å; H383-T387 VanDerWaalsContact O-OG1 3.09Å; T384-T387 PolarHBondContact O-N 3.17Å; V385-T387 VanDerWaalsContact C-N 3.34Å; V385-T387 PolarHBondContact O-N 2.87Å; T387-Y390 PolarHBondContact O-N 3.33Å; T387-I391 HydrophobicContact CG2-CD1 4.29Å; T387-I391 WeakPolarHBondContact O-CG1 3.45Å; T387-I391 PolarHBondContact O-N 3.26Å
388	I	57.3	Low	57.2	Low	84 Å²	84	116.6 Å²	116.6	43%	0.431	59%	0.588	S	S	.	*	H	α-helix	trans	-65	-43.6	177.6	-66.7	169.1	0	0	0	110.6	T384 V385 Y390 I391 I392	T384-I388 HydrophobicContact CG2-CD1 4.31Å; T384-I388 WeakPolarHBondContact O-CG1 3.4Å; T384-I388 PolarHBondContact O-N 2.93Å; V385-I388 PolarHBondContact O-N 3.41Å; I388-Y390 VanDerWaalsContact C-N 3.31Å; I388-Y390 PolarHBondContact O-N 2.94Å; I388-I391 PolarHBondContact O-N 2.73Å; I388-I392 HydrophobicContact CG2-CD1 3.86Å; I388-I392 WeakPolarHBondContact O-CG1 3.44Å; I388-I392 PolarHBondContact O-N 3.13Å
389	T	64.5	Low	58.4	Low	83 Å²	83	107.9 Å²	107.9	51%	0.509	57%	0.567	S	S	.	*	H	α-helix	trans	-58.8	-41.8	176.4	-56.2	0	0	0	0	111.9	V385 Q386 I392 Y393	V385-T389 PolarHBondContact O-N 3.4Å; V385-T389 PolarHBondContact O-OG1 2.9Å; Q386-T389 PolarHBondContact O-N 2.98Å; T389-I392 PolarHBondContact O-N 3.37Å; T389-Y393 WeakPolarHBondContact O-CB 3.48Å; T389-Y393 PolarHBondContact O-N 3.47Å
390	Y	67.3	Low	59.7	Low	179 Å²	179	104.7 Å²	104.7	70%	0.702	55%	0.55	S	S	*	*	H	α-helix	trans	-66.5	-40.1	180	-156.1	-91.6	0	0	0	112.6	Q386 T387 I388 Y393 Y394	Q386-Y390 PolarHBondContact O-N 3.49Å; T387-Y390 PolarHBondContact O-N 3.33Å; I388-Y390 VanDerWaalsContact C-N 3.31Å; I388-Y390 PolarHBondContact O-N 2.94Å; Y390-Y393 PolarHBondContact O-N 3.48Å; Y390-Y394 WeakPolarHBondContact O-CB 3.47Å; Y390-Y394 PolarHBondContact O-N 3.16Å
391	I	65.9	Low	60.7	Low	102 Å²	102	102.3 Å²	102.3	52%	0.523	54%	0.536	S	S	.	.	H	α-helix	trans	-63.9	-44.9	175.8	-66.8	167.3	0	0	0	110.8	T387 I388 Y393 Y394 V395	T387-I391 HydrophobicContact CG2-CD1 4.29Å; T387-I391 WeakPolarHBondContact O-CG1 3.45Å; T387-I391 PolarHBondContact O-N 3.26Å; I388-I391 PolarHBondContact O-N 2.73Å; I391-Y393 VanDerWaalsContact C-N 3.35Å; I391-Y393 PolarHBondContact O-N 3.34Å; I391-Y394 PolarHBondContact O-N 2.92Å; I391-V395 WeakPolarHBondContact O-CG2 3.19Å; I391-V395 PolarHBondContact O-N 2.83Å
392	I	65	Low	61.6	Low	102 Å²	102	103.7 Å²	103.7	52%	0.523	54%	0.537	S	S	.	.	H	α-helix	trans	-60.9	-45.8	177	-67.4	168.5	0	0	0	110.4	I388 T389 Y394 V395 V396	I388-I392 HydrophobicContact CG2-CD1 3.86Å; I388-I392 WeakPolarHBondContact O-CG1 3.44Å; I388-I392 PolarHBondContact O-N 3.13Å; T389-I392 PolarHBondContact O-N 3.37Å; I392-Y394 PolarHBondContact O-N 3.41Å; I392-V395 PolarHBondContact O-N 3.06Å; I392-V396 HydrophobicContact CG2-CG2 4.38Å; I392-V396 WeakPolarHBondContact O-CB 3.34Å; I392-V396 VanDerWaalsContact O-CG2 3.3Å; I392-V396 WeakPolarHBondContact O-CG2 3.29Å; I392-V396 PolarHBondContact O-N 2.91Å
393	Y	66.3	Low	62.1	Low	169 Å²	169	101.7 Å²	101.7	66%	0.663	53%	0.525	S	S	*	.	H	α-helix	trans	-59.6	-47	178.1	-164.4	-90	0	0	0	111.4	T389 Y390 I391 V395 V396 S397	T389-Y393 WeakPolarHBondContact O-CB 3.48Å; T389-Y393 PolarHBondContact O-N 3.47Å; Y390-Y393 PolarHBondContact O-N 3.48Å; I391-Y393 VanDerWaalsContact C-N 3.35Å; I391-Y393 PolarHBondContact O-N 3.34Å; Y393-V395 PolarHBondContact O-N 2.76Å; Y393-V396 PolarHBondContact O-N 3.31Å; Y393-S397 WeakPolarHBondContact O-CB 3.02Å; Y393-S397 PolarHBondContact O-N 2.93Å; Y393-S397 PolarHBondContact O-OG 2.98Å
394	Y	67.8	Low	63	Low	155 Å²	155	99.4 Å²	99.4	61%	0.608	52%	0.515	S	S	*	.	H	α-helix	trans	-61.7	-44.9	179	-170.8	-97.1	0	0	0	113	Y390 I391 I392 S397 C398	Y390-Y394 WeakPolarHBondContact O-CB 3.47Å; Y390-Y394 PolarHBondContact O-N 3.16Å; I391-Y394 PolarHBondContact O-N 2.92Å; I392-Y394 PolarHBondContact O-N 3.41Å; Y394-S397 PolarHBondContact O-N 3.45Å; Y394-C398 WeakPolarHBondContact O-CB 3.4Å; Y394-C398 PolarHBondContact O-N 3.29Å; Y394-C398 PolarHBondContact O-SG 2.96Å
395	V	62.9	Low	63.8	Low	89 Å²	89	101.4 Å²	101.4	54%	0.539	52%	0.516	S	S	.	.	H	α-helix	trans	-64.7	-42.9	178.3	172.6	0	0	0	0	111.3	I391 I392 Y393 C398 A399	I391-V395 WeakPolarHBondContact O-CG2 3.19Å; I391-V395 PolarHBondContact O-N 2.83Å; I392-V395 PolarHBondContact O-N 3.06Å; Y393-V395 PolarHBondContact O-N 2.76Å; V395-C398 PolarHBondContact O-N 2.85Å; V395-A399 WeakPolarHBondContact O-CB 3.31Å; V395-A399 PolarHBondContact O-N 2.89Å
396	V	63.5	Low	64.7	Low	69 Å²	69	104.3 Å²	104.3	42%	0.418	52%	0.521	S	S	.	.	H	α-helix	trans	-64.9	-45.2	176.6	171.2	0	0	0	0	111.1	I392 Y393 C398 A399 I400	I392-V396 HydrophobicContact CG2-CG2 4.38Å; I392-V396 WeakPolarHBondContact O-CB 3.34Å; I392-V396 VanDerWaalsContact O-CG2 3.3Å; I392-V396 WeakPolarHBondContact O-CG2 3.29Å; I392-V396 PolarHBondContact O-N 2.91Å; Y393-V396 PolarHBondContact O-N 3.31Å; V396-C398 PolarHBondContact O-N 3.3Å; V396-A399 PolarHBondContact O-N 2.83Å; V396-I400 HydrophobicContact CG1-CD1 3.71Å; V396-I400 HydrophobicContact CG1-CG1 4.43Å; V396-I400 VanDerWaalsContact O-CG1 3.32Å; V396-I400 WeakPolarHBondContact O-CG1 3.34Å; V396-I400 PolarHBondContact O-N 3.32Å
397	S	68.8	Low	64.8	Low	34 Å²	34	102.8 Å²	102.8	24%	0.238	51%	0.514	C	S	.	.	H	α-helix	trans	-60.2	-44.4	175.9	-63.9	0	0	0	0	112.2	Y393 Y394 A399 I400 I401	Y393-S397 WeakPolarHBondContact O-CB 3.02Å; Y393-S397 PolarHBondContact O-N 2.93Å; Y393-S397 PolarHBondContact O-OG 2.98Å; Y394-S397 PolarHBondContact O-N 3.45Å; S397-A399 PolarHBondContact O-N 3.27Å; S397-I400 PolarHBondContact O-N 3.04Å; S397-I401 WeakPolarHBondContact O-CB 3.44Å; S397-I401 VanDerWaalsContact O-CG1 3.26Å; S397-I401 WeakPolarHBondContact O-CG1 3.48Å; S397-I401 PolarHBondContact O-N 2.77Å
398	C	61	Low	64.8	Low	55 Å²	55	107.7 Å²	107.7	37%	0.372	52%	0.523	S	S	.	.	H	α-helix	trans	-61.6	-41.9	176.5	-69.8	0	0	0	0	112.2	Y394 V395 V396 I401 S402	Y394-C398 WeakPolarHBondContact O-CB 3.4Å; Y394-C398 PolarHBondContact O-N 3.29Å; Y394-C398 PolarHBondContact O-SG 2.96Å; V395-C398 PolarHBondContact O-N 2.85Å; V396-C398 PolarHBondContact O-N 3.3Å; C398-I401 PolarHBondContact O-N 3.12Å; C398-S402 WeakPolarHBondContact O-CB 3.08Å; C398-S402 PolarHBondContact O-N 3.41Å
399	A	59.6	Low	65.5	Low	60 Å²	60	108.5 Å²	108.5	50%	0.496	53%	0.525	S	S	.	.	H	α-helix	trans	-64.5	-41.6	176.4	0	0	0	0	0	112.3	V395 V396 S397 R403	V395-A399 WeakPolarHBondContact O-CB 3.31Å; V395-A399 PolarHBondContact O-N 2.89Å; V396-A399 PolarHBondContact O-N 2.83Å; S397-A399 PolarHBondContact O-N 3.27Å; A399-R403 WeakPolarHBondContact O-CB 3.48Å; A399-R403 PolarHBondContact O-N 2.85Å
400	I	64.9	Low	65.1	Low	88 Å²	88	108.4 Å²	108.4	45%	0.451	52%	0.524	S	S	.	.	H	α-helix	trans	-64.9	-46.1	176.5	-69.6	168.3	0	0	0	111.1	V396 S397 S402 R403 H404	V396-I400 HydrophobicContact CG1-CD1 3.71Å; V396-I400 HydrophobicContact CG1-CG1 4.43Å; V396-I400 VanDerWaalsContact O-CG1 3.32Å; V396-I400 WeakPolarHBondContact O-CG1 3.34Å; V396-I400 PolarHBondContact O-N 3.32Å; S397-I400 PolarHBondContact O-N 3.04Å; I400-S402 PolarHBondContact O-N 2.95Å; I400-R403 PolarHBondContact O-N 3.21Å; I400-H404 PolarHBondContact O-N 2.88Å
401	I	66.7	Low	64.3	Low	118 Å²	118	106.3 Å²	106.3	61%	0.605	52%	0.523	S	S	*	.	H	α-helix	trans	-62.1	-44.4	178.4	-68.8	164.6	0	0	0	110.7	S397 C398 H404 K405	S397-I401 WeakPolarHBondContact O-CB 3.44Å; S397-I401 VanDerWaalsContact O-CG1 3.26Å; S397-I401 WeakPolarHBondContact O-CG1 3.48Å; S397-I401 PolarHBondContact O-N 2.77Å; C398-I401 PolarHBondContact O-N 3.12Å; I401-H404 PolarHBondContact O-N 3.09Å; I401-K405 PolarHBondContact O-N 3.26Å
402	S	65.8	Low	64.2	Low	82 Å²	82	108.7 Å²	108.7	57%	0.573	53%	0.529	S	S	*	.	H	α-helix	trans	-64	-40.9	177.7	-163.5	0	0	0	0	112	C398 I400 K405 K406	C398-S402 WeakPolarHBondContact O-CB 3.08Å; C398-S402 PolarHBondContact O-N 3.41Å; I400-S402 PolarHBondContact O-N 2.95Å; S402-K405 PolarHBondContact O-N 2.83Å; S402-K406 PolarHBondContact O-N 3.26Å; S402-K406 VanDerWaalsContact O-N 3.09Å
403	R	60.7	Low	64	Low	120 Å²	120	109.3 Å²	109.3	45%	0.453	53%	0.533	S	S	.	.	H	α-helix	trans	-63.2	-42.9	173.4	-172.6	174	-178.6	140.7	-1.9	112.1	S95 N99 A399 I400 K406 Q407	S95-R403 PolarHBondContact OG-NH1 2.96Å; S95-R403 PolarHBondContact OG-NH2 3.32Å; N99-R403 PolarHBondContact ND2-NH2 3.38Å; A399-R403 WeakPolarHBondContact O-CB 3.48Å; A399-R403 PolarHBondContact O-N 2.85Å; I400-R403 PolarHBondContact O-N 3.21Å; R403-K406 PolarHBondContact O-N 3.23Å; R403-Q407 WeakPolarHBondContact O-CB 3.28Å; R403-Q407 PolarHBondContact O-N 2.84Å
404	H	67.2	Low	62.9	Low	101 Å²	101	108 Å²	108	47%	0.468	53%	0.531	S	S	.	.	H	α-helix	trans	-66.2	-36.8	176	-95.1	-64.4	0	0	0	113	I400 I401 Q407 R408	I400-H404 PolarHBondContact O-N 2.88Å; I401-H404 PolarHBondContact O-N 3.09Å; H404-Q407 PolarHBondContact O-N 3.26Å; H404-R408 WeakPolarHBondContact O-CB 3.48Å; H404-R408 WeakPolarHBondContact O-CG 3.24Å; H404-R408 PolarHBondContact O-N 3.21Å
405	K	69.7	Low	62	Low	135 Å²	135	102.9 Å²	102.9	59%	0.587	52%	0.518	S	S	*	.	H	α-helix	trans	-62	-50.5	174.8	-170.4	177.6	178	-176.2	0	110.7	I401 S402 Q407 R408 E409	I401-K405 PolarHBondContact O-N 3.26Å; S402-K405 PolarHBondContact O-N 2.83Å; K405-Q407 PolarHBondContact O-N 3.12Å; K405-R408 PolarHBondContact O-N 2.9Å; K405-E409 VanDerWaalsContact CE-OE1 3.24Å; K405-E409 WeakPolarHBondContact CE-OE1 3.46Å; K405-E409 WeakPolarHBondContact O-CG 3.36Å; K405-E409 PolarHBondContact O-N 3.27Å
406	K	69.5	Low	61.8	Low	155 Å²	155	104.7 Å²	104.7	67%	0.674	52%	0.519	S	S	*	.	H	α-helix	trans	-62.7	-38.6	177.5	-159	173	-171.5	177.9	0	112.4	S402 R403 E409 T410	S402-K406 PolarHBondContact O-N 3.26Å; S402-K406 VanDerWaalsContact O-N 3.09Å; R403-K406 PolarHBondContact O-N 3.23Å; K406-E409 PolarHBondContact O-N 2.92Å; K406-T410 PolarHBondContact O-N 2.84Å; K406-T410 PolarHBondContact O-OG1 3.17Å
407	Q	61.6	Low	60.9	Low	96 Å²	96	104.4 Å²	104.4	45%	0.449	52%	0.524	S	S	.	.	H	α-helix	trans	-66	-41.1	174.4	-86.8	-169.8	-33.3	0	0	113.2	R403 H404 K405 T410 M411	R403-Q407 WeakPolarHBondContact O-CB 3.28Å; R403-Q407 PolarHBondContact O-N 2.84Å; H404-Q407 PolarHBondContact O-N 3.26Å; K405-Q407 PolarHBondContact O-N 3.12Å; Q407-T410 WeakPolarHBondContact CA-OG1 3.39Å; Q407-T410 PolarHBondContact O-N 3.33Å; Q407-T410 PolarHBondContact O-OG1 3.05Å; Q407-M411 PolarHBondContact O-N 3.06Å
408	R	64.6	Low	59.8	Low	185 Å²	185	108.8 Å²	108.8	70%	0.698	54%	0.544	S	S	*	.	H	α-helix	trans	-62.8	-42.1	175	-76.7	-176	-171.2	-167.8	4.5	111.6	H404 K405 M411 F412	H404-R408 WeakPolarHBondContact O-CB 3.48Å; H404-R408 WeakPolarHBondContact O-CG 3.24Å; H404-R408 PolarHBondContact O-N 3.21Å; K405-R408 PolarHBondContact O-N 2.9Å; R408-M411 PolarHBondContact O-N 3.25Å; R408-F412 VanDerWaalsContact O-CB 3.28Å; R408-F412 WeakPolarHBondContact O-CB 3Å; R408-F412 PolarHBondContact O-N 3.27Å
409	E	71.3	Confident	59.6	Low	101 Å²	101	116.1 Å²	116.1	47%	0.472	56%	0.564	S	S	.	*	H	α-helix	trans	-61	-44.2	174.9	-72.1	165	-171.2	0	0	111.1	K405 K406 F412 L413	K405-E409 VanDerWaalsContact CE-OE1 3.24Å; K405-E409 WeakPolarHBondContact CE-OE1 3.46Å; K405-E409 WeakPolarHBondContact O-CG 3.36Å; K405-E409 PolarHBondContact O-N 3.27Å; K406-E409 PolarHBondContact O-N 2.92Å; E409-F412 PolarHBondContact O-N 2.81Å; E409-L413 WeakPolarHBondContact O-CG 3.35Å; E409-L413 PolarHBondContact O-N 3.29Å
410	T	57	Low	59.3	Low	82 Å²	82	122.5 Å²	122.5	50%	0.503	59%	0.588	S	S	.	*	H	α-helix	trans	-67.6	-38.9	175.1	52.9	0	0	0	0	114	K406 Q407 L413 F414	K406-T410 PolarHBondContact O-N 2.84Å; K406-T410 PolarHBondContact O-OG1 3.17Å; Q407-T410 WeakPolarHBondContact CA-OG1 3.39Å; Q407-T410 PolarHBondContact O-N 3.33Å; Q407-T410 PolarHBondContact O-OG1 3.05Å; T410-L413 PolarHBondContact O-N 3.42Å; T410-F414 WeakPolarHBondContact O-CB 3.25Å; T410-F414 PolarHBondContact O-N 3.13Å
411	M	50.6	Low	59	Low	134 Å²	134	124.2 Å²	124.2	66%	0.66	60%	0.595	S	S	*	*	H	α-helix	trans	-69.4	-33.7	175.2	-92.5	-149.7	-62.4	0	0	112.3	Q407 R408 F414 S415	Q407-M411 PolarHBondContact O-N 3.06Å; R408-M411 PolarHBondContact O-N 3.25Å; M411-F414 PolarHBondContact O-N 3.25Å; M411-S415 VanDerWaalsContact O-CB 3.29Å; M411-S415 WeakPolarHBondContact O-CB 3.36Å; M411-S415 PolarHBondContact O-N 2.96Å
412	F	64.2	Low	58.6	Low	152 Å²	152	124.5 Å²	124.5	67%	0.667	60%	0.595	S	S	*	*	H	α-helix	trans	-67.2	-42.6	175.2	-174.1	-99.5	0	0	0	111	R408 E409 K416	R408-F412 VanDerWaalsContact O-CB 3.28Å; R408-F412 WeakPolarHBondContact O-CB 3Å; R408-F412 PolarHBondContact O-N 3.27Å; E409-F412 PolarHBondContact O-N 2.81Å; F412-K416 VanDerWaalsContact O-CB 3.32Å; F412-K416 WeakPolarHBondContact O-CB 3.49Å; F412-K416 PolarHBondContact O-N 3.07Å
413	L	60.9	Low	58.2	Low	116 Å²	116	126.9 Å²	126.9	61%	0.607	60%	0.596	S	S	*	*	H	α-helix	trans	-63.4	-42.6	172.4	-71.2	170.4	0	0	0	112	E409 T410 K416 A417	E409-L413 WeakPolarHBondContact O-CG 3.35Å; E409-L413 PolarHBondContact O-N 3.29Å; T410-L413 PolarHBondContact O-N 3.42Å; L413-K416 PolarHBondContact O-N 3.3Å; L413-A417 WeakPolarHBondContact O-CB 3.49Å; L413-A417 PolarHBondContact O-N 2.87Å
414	F	43.2	Very low	58.1	Low	140 Å²	140	127.3 Å²	127.3	61%	0.614	60%	0.604	S	S	*	*	H	α-helix	trans	-66.6	-42.2	177.5	-163.7	-106.4	0	0	0	112.4	T410 M411 K416 A417 L418	T410-F414 WeakPolarHBondContact O-CB 3.25Å; T410-F414 PolarHBondContact O-N 3.13Å; M411-F414 PolarHBondContact O-N 3.25Å; F414-K416 VanDerWaalsContact C-N 3.27Å; F414-K416 PolarHBondContact O-N 3.41Å; F414-A417 PolarHBondContact O-N 2.75Å; F414-L418 HydrophobicContact CD1-CD1 3.7Å; F414-L418 HydrophobicContact CD1-CG 4.5Å; F414-L418 HydrophobicContact CE1-CD1 3.48Å; F414-L418 VanDerWaalsContact CE1-CD1 3.48Å; F414-L418 HydrophobicContact CE1-CG 4.32Å; F414-L418 HydrophobicContact CZ-CD1 4.25Å; F414-L418 WeakPolarHBondContact O-CB 3.48Å; F414-L418 PolarHBondContact O-N 3.42Å
415	S	48.3	Very low	57.5	Low	49 Å²	49	128.9 Å²	128.9	34%	0.343	61%	0.613	S	S	.	*	H	α-helix	trans	-67.9	-25.4	173.4	179.7	0	0	0	0	113	M411 R419	M411-S415 VanDerWaalsContact O-CB 3.29Å; M411-S415 WeakPolarHBondContact O-CB 3.36Å; M411-S415 PolarHBondContact O-N 2.96Å; S415-R419 WeakPolarHBondContact O-CG 3.39Å
416	K	58.9	Low	56.7	Low	126 Å²	126	128.5 Å²	128.5	55%	0.548	62%	0.615	S	S	.	*	H	α-helix	trans	-77.4	-36.5	172.5	-167.3	177.1	-177.6	-176.3	0	111	F412 L413 F414 R419 L420	F412-K416 VanDerWaalsContact O-CB 3.32Å; F412-K416 WeakPolarHBondContact O-CB 3.49Å; F412-K416 PolarHBondContact O-N 3.07Å; L413-K416 PolarHBondContact O-N 3.3Å; F414-K416 VanDerWaalsContact C-N 3.27Å; F414-K416 PolarHBondContact O-N 3.41Å; K416-R419 PolarHBondContact O-N 3.42Å; K416-L420 WeakPolarHBondContact O-CG 3.33Å; K416-L420 PolarHBondContact O-N 3.18Å
417	A	45.3	Very low	55.8	Low	64 Å²	64	126.6 Å²	126.6	53%	0.529	61%	0.61	S	S	.	*	H	α-helix	trans	-71.7	-24.4	174.2	0	0	0	0	0	113.8	L413 F414	L413-A417 WeakPolarHBondContact O-CB 3.49Å; L413-A417 PolarHBondContact O-N 2.87Å; F414-A417 PolarHBondContact O-N 2.75Å
418	L	45.9	Very low	55.3	Low	125 Å²	125	129 Å²	129	65%	0.654	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	-3.1	172.6	-81.8	170.3	0	0	0	114.4	F414	F414-L418 HydrophobicContact CD1-CD1 3.7Å; F414-L418 HydrophobicContact CD1-CG 4.5Å; F414-L418 HydrophobicContact CE1-CD1 3.48Å; F414-L418 VanDerWaalsContact CE1-CD1 3.48Å; F414-L418 HydrophobicContact CE1-CG 4.32Å; F414-L418 HydrophobicContact CZ-CD1 4.25Å; F414-L418 WeakPolarHBondContact O-CB 3.48Å; F414-L418 PolarHBondContact O-N 3.42Å
419	R	56.1	Low	54.5	Low	210 Å²	210	124.3 Å²	124.3	79%	0.792	62%	0.617	S	S	*	*			trans	-111.4	-1.3	175.7	-72.4	-176.8	-169.1	-171.5	5.4	113.1	S415 K416	S415-R419 WeakPolarHBondContact O-CG 3.39Å; K416-R419 PolarHBondContact O-N 3.42Å
420	L	52.8	Low	53	Low	193 Å²	193	126.5 Å²	126.5	100%	1.01	63%	0.63	S	S	*	*			trans	-105.6	0	170.7	-69.3	171.7	0	0	0	108.1	K416	K416-L420 WeakPolarHBondContact O-CG 3.33Å; K416-L420 PolarHBondContact O-N 3.18Å

Retrieved 420 of 420 residues in 208.1 ms (Link to these results)

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