A0A3Q0KL37_SCHMA Loading...

5HT-1 receptor; Putative biogenic amine (5HT) receptor

AlphaFold DB , UniProt , Accession A0A3Q0KL37, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 515 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	37.8	Very low	45.6	Very low	216 Å²	216	167.1 Å²	167.1	100%	1.064	77%	0.766	S	S	*	*				0	29.3	0	-100.5	173.4	67.7	0	0	113.4	Y3	M1-Y3 PolarHBondContact O-N 3.1Å
2	W	36.4	Very low	45.7	Very low	259 Å²	259	164.5 Å²	164.5	98%	0.981	75%	0.752	S	S	*	*			trans	-87.4	100.8	-177.5	-82.9	47.1	0	0	0	111.1
3	Y	42.5	Very low	46.3	Very low	224 Å²	224	161.2 Å²	161.2	88%	0.878	74%	0.735	S	S	*	*			trans	177	91.4	140.4	-143	-105.1	0	0	0	108.7	M1	M1-Y3 PolarHBondContact O-N 3.1Å
4	I	40.9	Very low	46.9	Very low	138 Å²	138	154.9 Å²	154.9	71%	0.708	71%	0.71	S	S	*	*			trans	-132	133.9	167	-62.9	-179.8	0	0	0	107.2
5	P	40.4	Very low	47.2	Very low	106 Å²	106	149.1 Å²	149.1	69%	0.688	69%	0.686	S	S	*	*			trans	-63.3	138.8	-171.5	-19.2	31.1	0	0	0	113.3	K7	P5-K7 PolarHBondContact O-N 3.48Å
6	T	52.2	Low	47.7	Very low	123 Å²	123	149.1 Å²	149.1	76%	0.755	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-57.4	-12.3	-164.4	49.4	0	0	0	0	117.4	H8	T6-H8 VanDerWaalsContact C-N 3.34Å; T6-H8 PolarHBondContact O-N 3.01Å
7	K	49.3	Very low	48.2	Very low	195 Å²	195	149.2 Å²	149.2	85%	0.848	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-82.7	-0.6	-171.3	-127.5	178.6	-175.9	176.9	0	116.1	P5	P5-K7 PolarHBondContact O-N 3.48Å
8	H	51.5	Low	48.5	Very low	113 Å²	113	148.5 Å²	148.5	52%	0.523	67%	0.671	S	S	.	*	G	3₁₀ helix	trans	-131.5	12.6	179.8	-69.7	-64.5	0	0	0	114.5	T6 H10	T6-H8 VanDerWaalsContact C-N 3.34Å; T6-H8 PolarHBondContact O-N 3.01Å; H8-H10 PolarHBondContact O-N 3.44Å
9	E	50.7	Low	48.4	Very low	99 Å²	99	144.1 Å²	144.1	46%	0.463	65%	0.653	S	S	.	*	H	α-helix	trans	-63.8	-37.2	-174.5	-125.3	-170.7	149.9	0	0	113.4	W11 K13	E9-W11 PolarHBondContact O-N 2.91Å; E9-K13 VanDerWaalsContact CD-NZ 3.25Å; E9-K13 HydrophobicContact CG-CD 4.49Å; E9-K13 WeakPolarHBondContact O-CB 3.36Å; E9-K13 VanDerWaalsContact O-CG 3.32Å; E9-K13 WeakPolarHBondContact O-CG 3.48Å; E9-K13 PolarHBondContact O-N 2.9Å; E9-K13 WeakPolarHBondContact OE1-CE 3.46Å; E9-K13 IonicContact OE1-NZ 3.48Å; E9-K13 PolarHBondContact OE1-NZ 3.48Å; E9-K13 IonicContact OE2-NZ 3.27Å
10	H	50.7	Low	48.8	Very low	164 Å²	164	142.7 Å²	142.7	76%	0.759	65%	0.646	S	S	*	*	H	α-helix	trans	-64.1	-44.3	-172.4	-104.1	-84.9	0	0	0	113.8	H8 L14	H8-H10 PolarHBondContact O-N 3.44Å; H10-L14 WeakPolarHBondContact O-CB 3.35Å; H10-L14 PolarHBondContact O-N 3.06Å
11	W	49	Very low	49.2	Very low	201 Å²	201	139.7 Å²	139.7	76%	0.761	64%	0.635	S	S	*	*	H	α-helix	trans	-80.1	-31.5	-175.8	-73.9	99.6	0	0	0	113.6	E9 L14 L15	E9-W11 PolarHBondContact O-N 2.91Å; W11-L14 HydrophobicContact CE3-CD2 3.84Å; W11-L14 HydrophobicContact CH2-CD2 4.45Å; W11-L14 HydrophobicContact CZ3-CD2 3.64Å; W11-L14 PolarHBondContact O-N 3.44Å; W11-L15 VanDerWaalsContact O-CB 3.26Å; W11-L15 WeakPolarHBondContact O-CB 3.38Å; W11-L15 PolarHBondContact O-N 3.21Å
12	F	47.4	Very low	49.9	Very low	136 Å²	136	132.2 Å²	132.2	60%	0.596	60%	0.604	S	S	*	*	H	α-helix	trans	-69.7	-40	172	-87	-81.8	0	0	0	111.1	L14 L15 F16	F12-L14 VanDerWaalsContact C-N 3.34Å; F12-L15 PolarHBondContact O-N 3.39Å; F12-F16 VanDerWaalsContact O-CB 3.22Å; F12-F16 WeakPolarHBondContact O-CB 3.36Å; F12-F16 PolarHBondContact O-N 3.08Å
13	K	53.4	Low	50.3	Low	122 Å²	122	123.6 Å²	123.6	53%	0.53	58%	0.582	S	S	.	*	H	α-helix	trans	-61.4	-43.8	170.1	-75.3	178.8	-178.5	172.1	0	110.8	E9 F16 Y17	E9-K13 VanDerWaalsContact CD-NZ 3.25Å; E9-K13 HydrophobicContact CG-CD 4.49Å; E9-K13 WeakPolarHBondContact O-CB 3.36Å; E9-K13 VanDerWaalsContact O-CG 3.32Å; E9-K13 WeakPolarHBondContact O-CG 3.48Å; E9-K13 PolarHBondContact O-N 2.9Å; E9-K13 WeakPolarHBondContact OE1-CE 3.46Å; E9-K13 IonicContact OE1-NZ 3.48Å; E9-K13 PolarHBondContact OE1-NZ 3.48Å; E9-K13 IonicContact OE2-NZ 3.27Å; K13-F16 PolarHBondContact O-N 2.93Å; K13-Y17 WeakPolarHBondContact O-CB 3.44Å; K13-Y17 PolarHBondContact O-N 3.44Å
14	L	55	Low	50.9	Low	73 Å²	73	115.2 Å²	115.2	38%	0.382	55%	0.552	S	S	.	*	H	α-helix	trans	-63.1	-46.7	177.5	-150.5	82	0	0	0	111.6	H10 W11 F12 F16 Y17 Y18	H10-L14 WeakPolarHBondContact O-CB 3.35Å; H10-L14 PolarHBondContact O-N 3.06Å; W11-L14 HydrophobicContact CE3-CD2 3.84Å; W11-L14 HydrophobicContact CH2-CD2 4.45Å; W11-L14 HydrophobicContact CZ3-CD2 3.64Å; W11-L14 PolarHBondContact O-N 3.44Å; F12-L14 VanDerWaalsContact C-N 3.34Å; L14-F16 PolarHBondContact O-N 3.14Å; L14-Y17 CarbonylContact O-C 3.56Å; L14-Y17 PolarHBondContact O-N 3.01Å; L14-Y18 HydrophobicContact CD2-CD2 4.39Å; L14-Y18 HydrophobicContact CD2-CE2 4.06Å; L14-Y18 HydrophobicContact CG-CD2 4.02Å; L14-Y18 HydrophobicContact CG-CE2 4.02Å; L14-Y18 WeakPolarHBondContact O-CB 3.39Å; L14-Y18 VanDerWaalsContact O-CD2 3.27Å; L14-Y18 WeakPolarHBondContact O-CD2 3.45Å; L14-Y18 PolarHBondContact O-N 3.04Å
15	L	50.7	Low	51.5	Low	68 Å²	68	109.8 Å²	109.8	36%	0.356	53%	0.531	S	S	.	.	H	α-helix	trans	-63.4	-40.7	177.5	-175.3	71	0	0	0	111.5	W11 F12 Y18 L19 L400	W11-L15 VanDerWaalsContact O-CB 3.26Å; W11-L15 WeakPolarHBondContact O-CB 3.38Å; W11-L15 PolarHBondContact O-N 3.21Å; F12-L15 PolarHBondContact O-N 3.39Å; L15-Y18 PolarHBondContact O-N 3.46Å; L15-L19 HydrophobicContact CG-CD1 4.18Å; L15-L19 WeakPolarHBondContact O-CB 3.46Å; L15-L19 WeakPolarHBondContact O-CD1 3.35Å; L15-L19 VanDerWaalsContact O-CG 3.23Å; L15-L19 WeakPolarHBondContact O-CG 3.42Å; L15-L19 PolarHBondContact O-N 2.93Å; L15-L400 HydrophobicContact CD1-CD1 3.7Å
16	F	54.9	Low	52	Low	148 Å²	148	106.9 Å²	106.9	65%	0.649	51%	0.509	S	S	*	.	H	α-helix	trans	-70.9	-35.4	176.3	-153.8	-87.4	0	0	0	111.7	F12 K13 L14 L19 F20	F12-F16 VanDerWaalsContact O-CB 3.22Å; F12-F16 WeakPolarHBondContact O-CB 3.36Å; F12-F16 PolarHBondContact O-N 3.08Å; K13-F16 PolarHBondContact O-N 2.93Å; L14-F16 PolarHBondContact O-N 3.14Å; F16-L19 PolarHBondContact O-N 3.11Å; F16-F20 WeakPolarHBondContact O-CB 3.49Å; F16-F20 PolarHBondContact O-N 3.42Å
17	Y	56.3	Low	51.8	Low	151 Å²	151	105.6 Å²	105.6	59%	0.592	50%	0.497	S	S	*	.	H	α-helix	trans	-67.4	-39.6	173.4	-165.9	-105.6	0	0	0	110.7	K13 L14 F20 I21	K13-Y17 WeakPolarHBondContact O-CB 3.44Å; K13-Y17 PolarHBondContact O-N 3.44Å; L14-Y17 CarbonylContact O-C 3.56Å; L14-Y17 PolarHBondContact O-N 3.01Å; Y17-F20 PolarHBondContact O-N 2.78Å; Y17-I21 HydrophobicContact CD1-CD1 3.4Å; Y17-I21 VanDerWaalsContact CD1-CD1 3.4Å; Y17-I21 HydrophobicContact CD1-CG1 4.35Å; Y17-I21 HydrophobicContact CE1-CD1 3.27Å; Y17-I21 HydrophobicContact CE1-CG1 4.3Å; Y17-I21 HydrophobicContact CG-CD1 4.25Å; Y17-I21 VanDerWaalsContact O-CB 3.31Å; Y17-I21 WeakPolarHBondContact O-CB 3.28Å; Y17-I21 WeakPolarHBondContact O-CG1 3.39Å; Y17-I21 PolarHBondContact O-N 3.08Å
18	Y	55	Low	51.8	Low	137 Å²	137	101 Å²	101	54%	0.537	48%	0.481	S	S	.	.	H	α-helix	trans	-65.5	-43.7	169.8	-93.2	-78.1	0	0	0	111.7	L14 L15 F20 I21 S22	L14-Y18 HydrophobicContact CD2-CD2 4.39Å; L14-Y18 HydrophobicContact CD2-CE2 4.06Å; L14-Y18 HydrophobicContact CG-CD2 4.02Å; L14-Y18 HydrophobicContact CG-CE2 4.02Å; L14-Y18 WeakPolarHBondContact O-CB 3.39Å; L14-Y18 VanDerWaalsContact O-CD2 3.27Å; L14-Y18 WeakPolarHBondContact O-CD2 3.45Å; L14-Y18 PolarHBondContact O-N 3.04Å; L15-Y18 PolarHBondContact O-N 3.46Å; Y18-F20 VanDerWaalsContact C-N 3.31Å; Y18-F20 PolarHBondContact O-N 3.48Å; Y18-I21 CarbonylContact O-C 3.54Å; Y18-I21 PolarHBondContact O-N 3.05Å; Y18-S22 WeakPolarHBondContact O-CB 3.33Å; Y18-S22 PolarHBondContact O-N 3.47Å; Y18-S22 PolarHBondContact O-OG 2.91Å; Y18-S22 VanDerWaalsContact O-OG 3.06Å
19	L	46.6	Very low	51.7	Low	64 Å²	64	99.8 Å²	99.8	34%	0.335	48%	0.477	S	S	.	.	H	α-helix	trans	-61.6	-40.7	174.6	-79	161.9	0	0	0	111.4	L15 F16 S22 C23 L400	L15-L19 HydrophobicContact CG-CD1 4.18Å; L15-L19 WeakPolarHBondContact O-CB 3.46Å; L15-L19 WeakPolarHBondContact O-CD1 3.35Å; L15-L19 VanDerWaalsContact O-CG 3.23Å; L15-L19 WeakPolarHBondContact O-CG 3.42Å; L15-L19 PolarHBondContact O-N 2.93Å; F16-L19 PolarHBondContact O-N 3.11Å; L19-S22 PolarHBondContact O-N 3.17Å; L19-C23 VanDerWaalsContact O-CB 3.27Å; L19-C23 WeakPolarHBondContact O-CB 3.44Å; L19-C23 PolarHBondContact O-N 3.24Å; L19-L400 HydrophobicContact CD2-CD1 4.34Å; L19-L400 HydrophobicContact CD2-CD2 3.32Å; L19-L400 HydrophobicContact CD2-CG 3.87Å; L19-L400 HydrophobicContact CG-CD2 3.99Å
20	F	55.7	Low	51.4	Low	117 Å²	117	97.7 Å²	97.7	51%	0.513	47%	0.471	S	S	.	.	H	α-helix	trans	-68.8	-39.5	175.2	-173.3	-97.6	0	0	0	111	F16 Y17 Y18 N24	F16-F20 WeakPolarHBondContact O-CB 3.49Å; F16-F20 PolarHBondContact O-N 3.42Å; Y17-F20 PolarHBondContact O-N 2.78Å; Y18-F20 VanDerWaalsContact C-N 3.31Å; Y18-F20 PolarHBondContact O-N 3.48Å; F20-N24 VanDerWaalsContact CD1-ND2 3.3Å; F20-N24 WeakPolarHBondContact CD1-ND2 3.44Å; F20-N24 WeakPolarHBondContact CD2-ND2 3.45Å; F20-N24 WeakPolarHBondContact CE1-ND2 3.35Å; F20-N24 WeakPolarHBondContact CE2-ND2 3.4Å; F20-N24 VanDerWaalsContact CG-ND2 3.32Å; F20-N24 WeakPolarHBondContact CG-ND2 3.29Å; F20-N24 WeakPolarHBondContact CZ-ND2 3.43Å; F20-N24 WeakPolarHBondContact O-CA 3.32Å; F20-N24 WeakPolarHBondContact O-CB 3.39Å; F20-N24 PolarHBondContact O-N 2.96Å; F20-N24 PolarHBondContact O-ND2 2.97Å
21	I	56.8	Low	51.2	Low	79 Å²	79	95.3 Å²	95.3	41%	0.405	46%	0.464	S	S	.	.	H	α-helix	trans	-70.2	-35.5	173.9	-73	167.2	0	0	0	111.6	Y17 Y18 G25	Y17-I21 HydrophobicContact CD1-CD1 3.4Å; Y17-I21 VanDerWaalsContact CD1-CD1 3.4Å; Y17-I21 HydrophobicContact CD1-CG1 4.35Å; Y17-I21 HydrophobicContact CE1-CD1 3.27Å; Y17-I21 HydrophobicContact CE1-CG1 4.3Å; Y17-I21 HydrophobicContact CG-CD1 4.25Å; Y17-I21 VanDerWaalsContact O-CB 3.31Å; Y17-I21 WeakPolarHBondContact O-CB 3.28Å; Y17-I21 WeakPolarHBondContact O-CG1 3.39Å; Y17-I21 PolarHBondContact O-N 3.08Å; Y18-I21 CarbonylContact O-C 3.54Å; Y18-I21 PolarHBondContact O-N 3.05Å; I21-G25 WeakPolarHBondContact O-CA 3.23Å; I21-G25 PolarHBondContact O-N 3.41Å
22	S	52.8	Low	51.2	Low	59 Å²	59	90 Å²	90	41%	0.413	46%	0.458	S	S	.	.	H	α-helix	trans	-73.8	-41.3	176.8	-65.3	0	0	0	0	110.8	Y18 L19 L26	Y18-S22 WeakPolarHBondContact O-CB 3.33Å; Y18-S22 PolarHBondContact O-N 3.47Å; Y18-S22 PolarHBondContact O-OG 2.91Å; Y18-S22 VanDerWaalsContact O-OG 3.06Å; L19-S22 PolarHBondContact O-N 3.17Å; S22-L26 WeakPolarHBondContact O-CB 3.39Å; S22-L26 PolarHBondContact O-N 2.88Å
23	C	45.7	Very low	51	Low	78 Å²	78	85.1 Å²	85.1	53%	0.527	44%	0.438	S	S	.	.	H	α-helix	trans	-69.9	-45.3	173.5	-86.4	0	0	0	0	112.4	L19 L26 L27	L19-C23 VanDerWaalsContact O-CB 3.27Å; L19-C23 WeakPolarHBondContact O-CB 3.44Å; L19-C23 PolarHBondContact O-N 3.24Å; C23-L26 PolarHBondContact O-N 3.25Å; C23-L27 VanDerWaalsContact O-CB 3.26Å; C23-L27 WeakPolarHBondContact O-CB 3.31Å; C23-L27 PolarHBondContact O-N 2.91Å
24	N	54.9	Low	50.6	Low	48 Å²	48	83 Å²	83	26%	0.257	43%	0.432	S	S	.	.	H	α-helix	trans	-71.9	-32.4	174.5	-76.6	-87.3	0	0	0	111.2	F20 L26 L27 I28	F20-N24 VanDerWaalsContact CD1-ND2 3.3Å; F20-N24 WeakPolarHBondContact CD1-ND2 3.44Å; F20-N24 WeakPolarHBondContact CD2-ND2 3.45Å; F20-N24 WeakPolarHBondContact CE1-ND2 3.35Å; F20-N24 WeakPolarHBondContact CE2-ND2 3.4Å; F20-N24 VanDerWaalsContact CG-ND2 3.32Å; F20-N24 WeakPolarHBondContact CG-ND2 3.29Å; F20-N24 WeakPolarHBondContact CZ-ND2 3.43Å; F20-N24 WeakPolarHBondContact O-CA 3.32Å; F20-N24 WeakPolarHBondContact O-CB 3.39Å; F20-N24 PolarHBondContact O-N 2.96Å; F20-N24 PolarHBondContact O-ND2 2.97Å; N24-L26 VanDerWaalsContact C-N 3.32Å; N24-L27 CarbonylContact O-C 3.54Å; N24-L27 PolarHBondContact O-N 3.21Å; N24-I28 HydrophobicContact CB-CD1 4.33Å; N24-I28 WeakPolarHBondContact O-CA 3.5Å; N24-I28 WeakPolarHBondContact O-CB 3.35Å; N24-I28 VanDerWaalsContact O-CD1 3.31Å; N24-I28 WeakPolarHBondContact O-CD1 3.48Å; N24-I28 WeakPolarHBondContact O-CG1 3.28Å; N24-I28 PolarHBondContact O-N 3.2Å
25	G	53.4	Low	50.2	Low	25 Å²	25	83.8 Å²	83.8	26%	0.258	44%	0.436	S	S	.	.	H	α-helix	trans	-64	-41.1	172.8	0	0	0	0	0	110.2	I21 I29	I21-G25 WeakPolarHBondContact O-CA 3.23Å; I21-G25 PolarHBondContact O-N 3.41Å; G25-I29 VanDerWaalsContact O-CB 3.3Å; G25-I29 WeakPolarHBondContact O-CB 3.45Å; G25-I29 WeakPolarHBondContact O-CD1 3.44Å; G25-I29 WeakPolarHBondContact O-CG1 3.43Å; G25-I29 PolarHBondContact O-N 3.35Å
26	L	50.1	Low	50.2	Low	44 Å²	44	84 Å²	84	23%	0.23	44%	0.443	C	S	.	.	H	α-helix	trans	-68.4	-41.5	171.2	-163.9	77.9	0	0	0	111.9	S22 C23 N24 I28 I29 V30	S22-L26 WeakPolarHBondContact O-CB 3.39Å; S22-L26 PolarHBondContact O-N 2.88Å; C23-L26 PolarHBondContact O-N 3.25Å; N24-L26 VanDerWaalsContact C-N 3.32Å; L26-I28 VanDerWaalsContact C-N 3.33Å; L26-I29 PolarHBondContact O-N 2.89Å; L26-V30 VanDerWaalsContact O-CB 3.28Å; L26-V30 WeakPolarHBondContact O-CB 3.18Å; L26-V30 WeakPolarHBondContact O-CG2 3.3Å; L26-V30 PolarHBondContact O-N 2.8Å
27	L	47.5	Very low	49.8	Very low	97 Å²	97	83.8 Å²	83.8	51%	0.508	44%	0.439	S	S	.	.	H	α-helix	trans	-68.7	-33.3	177.3	-153.4	94.6	0	0	0	111.6	C23 N24 N31	C23-L27 VanDerWaalsContact O-CB 3.26Å; C23-L27 WeakPolarHBondContact O-CB 3.31Å; C23-L27 PolarHBondContact O-N 2.91Å; N24-L27 CarbonylContact O-C 3.54Å; N24-L27 PolarHBondContact O-N 3.21Å; L27-N31 WeakPolarHBondContact O-CA 3.29Å; L27-N31 WeakPolarHBondContact O-CB 3.49Å; L27-N31 PolarHBondContact O-N 3.36Å
28	I	50.6	Low	49.1	Very low	98 Å²	98	82.7 Å²	82.7	50%	0.503	43%	0.434	S	S	.	.	H	α-helix	trans	-73.9	-41.4	173.3	-71.5	162.6	0	0	0	108.1	N24 L26 V30 N31 S32	N24-I28 HydrophobicContact CB-CD1 4.33Å; N24-I28 WeakPolarHBondContact O-CA 3.5Å; N24-I28 WeakPolarHBondContact O-CB 3.35Å; N24-I28 VanDerWaalsContact O-CD1 3.31Å; N24-I28 WeakPolarHBondContact O-CD1 3.48Å; N24-I28 WeakPolarHBondContact O-CG1 3.28Å; N24-I28 PolarHBondContact O-N 3.2Å; L26-I28 VanDerWaalsContact C-N 3.33Å; I28-V30 VanDerWaalsContact C-N 3.34Å; I28-N31 PolarHBondContact O-N 3.34Å; I28-S32 WeakPolarHBondContact CG2-OG 3.32Å; I28-S32 VanDerWaalsContact O-CA 3.31Å; I28-S32 WeakPolarHBondContact O-CA 3.45Å; I28-S32 WeakPolarHBondContact O-CB 3.45Å; I28-S32 PolarHBondContact O-N 3.2Å; I28-S32 PolarHBondContact O-OG 2.91Å
29	I	49.3	Very low	48.6	Very low	87 Å²	87	79.7 Å²	79.7	45%	0.446	43%	0.426	S	S	.	.	H	α-helix	trans	-61.8	-45.5	172	-72.1	162.7	0	0	0	109.4	G25 L26 S32 L33	G25-I29 VanDerWaalsContact O-CB 3.3Å; G25-I29 WeakPolarHBondContact O-CB 3.45Å; G25-I29 WeakPolarHBondContact O-CD1 3.44Å; G25-I29 WeakPolarHBondContact O-CG1 3.43Å; G25-I29 PolarHBondContact O-N 3.35Å; L26-I29 PolarHBondContact O-N 2.89Å; I29-S32 PolarHBondContact O-N 3.32Å; I29-L33 HydrophobicContact CG2-CD1 3.99Å; I29-L33 HydrophobicContact CG2-CG 4.47Å; I29-L33 WeakPolarHBondContact O-CB 3.5Å; I29-L33 WeakPolarHBondContact O-CD1 3.23Å; I29-L33 WeakPolarHBondContact O-CG 3.29Å; I29-L33 PolarHBondContact O-N 3.26Å
30	V	44.6	Very low	48.6	Very low	55 Å²	55	81.1 Å²	81.1	33%	0.333	43%	0.433	S	S	.	.	H	α-helix	trans	-68	-34.4	177.9	171.5	0	0	0	0	112.8	L26 I28	L26-V30 VanDerWaalsContact O-CB 3.28Å; L26-V30 WeakPolarHBondContact O-CB 3.18Å; L26-V30 WeakPolarHBondContact O-CG2 3.3Å; L26-V30 PolarHBondContact O-N 2.8Å; I28-V30 VanDerWaalsContact C-N 3.34Å
31	N	46.1	Very low	48.2	Very low	115 Å²	115	79.4 Å²	79.4	62%	0.615	43%	0.427	S	S	*	.	H	α-helix	trans	-84.2	-26.8	175.7	-76.7	-4.4	0	0	0	113.1	L27 I28	L27-N31 WeakPolarHBondContact O-CA 3.29Å; L27-N31 WeakPolarHBondContact O-CB 3.49Å; L27-N31 PolarHBondContact O-N 3.36Å; I28-N31 PolarHBondContact O-N 3.34Å
32	S	48.9	Very low	47.7	Very low	90 Å²	90	77.9 Å²	77.9	63%	0.629	42%	0.419	S	S	*	.	H	α-helix	trans	-85	-21.4	175.2	-53.3	0	0	0	0	111.2	I28 I29 D34	I28-S32 WeakPolarHBondContact CG2-OG 3.32Å; I28-S32 VanDerWaalsContact O-CA 3.31Å; I28-S32 WeakPolarHBondContact O-CA 3.45Å; I28-S32 WeakPolarHBondContact O-CB 3.45Å; I28-S32 PolarHBondContact O-N 3.2Å; I28-S32 PolarHBondContact O-OG 2.91Å; I29-S32 PolarHBondContact O-N 3.32Å; S32-D34 PolarHBondContact O-N 3.43Å
33	L	43.7	Very low	47.4	Very low	33 Å²	33	79.3 Å²	79.3	17%	0.173	43%	0.425	C	S	.	.	S	Bend	trans	-65.6	79.4	149.8	-70.6	164.6	0	0	0	105.1	I29 I35	I29-L33 HydrophobicContact CG2-CD1 3.99Å; I29-L33 HydrophobicContact CG2-CG 4.47Å; I29-L33 WeakPolarHBondContact O-CB 3.5Å; I29-L33 WeakPolarHBondContact O-CD1 3.23Å; I29-L33 WeakPolarHBondContact O-CG 3.29Å; I29-L33 PolarHBondContact O-N 3.26Å; L33-I35 WeakPolarHBondContact O-CG1 3.42Å; L33-I35 PolarHBondContact O-N 2.82Å
34	D	44.8	Very low	47.3	Very low	76 Å²	76	82.2 Å²	82.2	41%	0.406	43%	0.429	S	S	.	.			trans	-63.4	82.6	172.1	-169	-14.5	0	0	0	107.2	S32 S36 Y37 W38	S32-D34 PolarHBondContact O-N 3.43Å; D34-S36 PolarHBondContact O-N 3.04Å; D34-S36 VanDerWaalsContact O-N 3.15Å; D34-S36 WeakPolarHBondContact OD1-CB 2.98Å; D34-S36 PolarHBondContact OD1-N 3.25Å; D34-S36 PolarHBondContact OD1-OG 2.98Å; D34-Y37 PolarHBondContact O-N 3.34Å; D34-Y37 PolarHBondContact OD1-N 3.04Å; D34-W38 PolarHBondContact O-N 3.45Å
35	I	46.9	Very low	46.6	Very low	90 Å²	90	83.4 Å²	83.4	46%	0.462	43%	0.434	S	S	.	.	H	α-helix	trans	-55.8	-32.1	-177.3	-69.5	160.5	0	0	0	108.8	L33 I39	L33-I35 WeakPolarHBondContact O-CG1 3.42Å; L33-I35 PolarHBondContact O-N 2.82Å; I35-I39 HydrophobicContact CG2-CD1 3.75Å; I35-I39 HydrophobicContact CG2-CG1 4.36Å; I35-I39 WeakPolarHBondContact O-CB 3.4Å; I35-I39 WeakPolarHBondContact O-CD1 3.46Å; I35-I39 WeakPolarHBondContact O-CG1 3.28Å; I35-I39 PolarHBondContact O-N 3.21Å
36	S	48.8	Very low	46.2	Very low	72 Å²	72	86.9 Å²	86.9	50%	0.503	45%	0.45	S	S	.	.	H	α-helix	trans	-62.1	-41.3	172.3	17	0	0	0	0	113.8	D34 I39 I40	D34-S36 PolarHBondContact O-N 3.04Å; D34-S36 VanDerWaalsContact O-N 3.15Å; D34-S36 WeakPolarHBondContact OD1-CB 2.98Å; D34-S36 PolarHBondContact OD1-N 3.25Å; D34-S36 PolarHBondContact OD1-OG 2.98Å; S36-I39 PolarHBondContact O-N 3.28Å; S36-I40 WeakPolarHBondContact O-CD1 3.32Å; S36-I40 VanDerWaalsContact O-CG1 3.31Å; S36-I40 WeakPolarHBondContact O-CG1 3.45Å; S36-I40 PolarHBondContact O-N 3.16Å
37	Y	47.7	Very low	45.9	Very low	144 Å²	144	90.7 Å²	90.7	57%	0.565	47%	0.47	S	S	*	.	H	α-helix	trans	-68.6	-39	179.9	-161.5	-90.3	0	0	0	111.8	D34 I40 E41	D34-Y37 PolarHBondContact O-N 3.34Å; D34-Y37 PolarHBondContact OD1-N 3.04Å; Y37-I40 PolarHBondContact O-N 3.24Å; Y37-E41 HydrophobicContact CE1-CG 4.37Å; Y37-E41 PolarHBondContact O-N 2.92Å
38	W	41.6	Very low	45.8	Very low	129 Å²	129	89.1 Å²	89.1	49%	0.489	47%	0.467	S	S	.	.	H	α-helix	trans	-69.6	-35.3	175.4	-79.2	98.5	0	0	0	113.2	D34 I40 E41 D42	D34-W38 PolarHBondContact O-N 3.45Å; W38-I40 PolarHBondContact O-N 3.49Å; W38-E41 PolarHBondContact O-N 3.41Å; W38-D42 PolarHBondContact O-N 3.45Å
39	I	44.3	Very low	45.6	Very low	74 Å²	74	91.5 Å²	91.5	38%	0.379	48%	0.476	S	S	.	.	H	α-helix	trans	-59.9	-36.9	172.1	-71.8	164	0	0	0	111.2	I35 S36 T43 Y420	I35-I39 HydrophobicContact CG2-CD1 3.75Å; I35-I39 HydrophobicContact CG2-CG1 4.36Å; I35-I39 WeakPolarHBondContact O-CB 3.4Å; I35-I39 WeakPolarHBondContact O-CD1 3.46Å; I35-I39 WeakPolarHBondContact O-CG1 3.28Å; I35-I39 PolarHBondContact O-N 3.21Å; S36-I39 PolarHBondContact O-N 3.28Å; I39-T43 PolarHBondContact O-N 3.42Å; I39-T43 PolarHBondContact O-OG1 2.96Å; I39-Y420 HydrophobicContact CG1-CE1 4.17Å
40	I	46.9	Very low	45.4	Very low	94 Å²	94	94.5 Å²	94.5	48%	0.482	49%	0.492	S	S	.	.	H	α-helix	trans	-74.9	-34.8	-178.9	-65.4	164.9	0	0	0	111.6	S36 Y37 W38 K44	S36-I40 WeakPolarHBondContact O-CD1 3.32Å; S36-I40 VanDerWaalsContact O-CG1 3.31Å; S36-I40 WeakPolarHBondContact O-CG1 3.45Å; S36-I40 PolarHBondContact O-N 3.16Å; Y37-I40 PolarHBondContact O-N 3.24Å; W38-I40 PolarHBondContact O-N 3.49Å; I40-K44 PolarHBondContact O-N 3.31Å
41	E	46.2	Very low	45.4	Very low	81 Å²	81	98.6 Å²	98.6	38%	0.379	51%	0.512	S	S	.	.	H	α-helix	trans	-72.1	-39	176.7	-80.7	-140.3	160.4	0	0	113.7	Y37 W38 T43 K44 M45	Y37-E41 HydrophobicContact CE1-CG 4.37Å; Y37-E41 PolarHBondContact O-N 2.92Å; W38-E41 PolarHBondContact O-N 3.41Å; E41-T43 VanDerWaalsContact C-N 3.25Å; E41-T43 PolarHBondContact O-N 3.36Å; E41-K44 CarbonylContact O-C 3.59Å; E41-K44 WeakPolarHBondContact O-CB 3.3Å; E41-K44 PolarHBondContact O-N 2.71Å; E41-M45 PolarHBondContact O-N 2.85Å
42	D	47.6	Very low	45.1	Very low	47 Å²	47	98 Å²	98	25%	0.251	51%	0.509	S	S	.	.	H	α-helix	trans	-64.9	-33	177.8	-105.1	-7.3	0	0	0	111.8	W38 K44 M45 T46	W38-D42 PolarHBondContact O-N 3.45Å; D42-K44 VanDerWaalsContact C-N 3.32Å; D42-K44 PolarHBondContact O-N 3.28Å; D42-M45 PolarHBondContact O-N 3.45Å; D42-M45 WeakPolarHBondContact OD1-CE 3.34Å; D42-T46 PolarHBondContact O-N 2.82Å; D42-T46 PolarHBondContact O-OG1 3.19Å
43	T	45.6	Very low	44.9	Very low	88 Å²	88	98.8 Å²	98.8	54%	0.54	51%	0.514	S	S	.	.	H	α-helix	trans	-65.6	-35.8	173.2	-46.2	0	0	0	0	111.3	I39 E41 I47	I39-T43 PolarHBondContact O-N 3.42Å; I39-T43 PolarHBondContact O-OG1 2.96Å; E41-T43 VanDerWaalsContact C-N 3.25Å; E41-T43 PolarHBondContact O-N 3.36Å; T43-I47 WeakPolarHBondContact O-CG1 3.38Å
44	K	44.2	Very low	44.9	Very low	139 Å²	139	101.5 Å²	101.5	60%	0.604	54%	0.536	S	S	*	.	H	α-helix	trans	-76.2	-38	176.4	-71.1	177.9	-177.6	176.3	0	112.7	I40 E41 D42 I47 S48	I40-K44 PolarHBondContact O-N 3.31Å; E41-K44 CarbonylContact O-C 3.59Å; E41-K44 WeakPolarHBondContact O-CB 3.3Å; E41-K44 PolarHBondContact O-N 2.71Å; D42-K44 VanDerWaalsContact C-N 3.32Å; D42-K44 PolarHBondContact O-N 3.28Å; K44-I47 PolarHBondContact O-N 2.86Å; K44-S48 PolarHBondContact O-N 2.97Å; K44-S48 VanDerWaalsContact O-N 3.14Å
45	M	40.4	Very low	44.7	Very low	74 Å²	74	103.1 Å²	103.1	37%	0.365	54%	0.544	S	S	.	.	H	α-helix	trans	-65	-39.7	176.8	-89.8	-167.3	-74.9	0	0	112.1	E41 D42 I47 S48 Q49	E41-M45 PolarHBondContact O-N 2.85Å; D42-M45 PolarHBondContact O-N 3.45Å; D42-M45 WeakPolarHBondContact OD1-CE 3.34Å; M45-I47 VanDerWaalsContact C-N 3.26Å; M45-I47 PolarHBondContact O-N 3.25Å; M45-S48 PolarHBondContact O-N 2.99Å; M45-S48 VanDerWaalsContact O-N 3.11Å; M45-S48 PolarHBondContact O-OG 3.16Å; M45-Q49 PolarHBondContact O-N 2.86Å
46	T	44.9	Very low	44.3	Very low	97 Å²	97	107.4 Å²	107.4	60%	0.595	56%	0.559	S	S	*	*	H	α-helix	trans	-60.3	-36.2	175.8	-51.5	0	0	0	0	111.8	D42	D42-T46 PolarHBondContact O-N 2.82Å; D42-T46 PolarHBondContact O-OG1 3.19Å
47	I	44.4	Very low	43.8	Very low	125 Å²	125	108.3 Å²	108.3	64%	0.641	57%	0.565	S	S	*	*	H	α-helix	trans	-69.7	-39.4	175.2	-64.3	169	0	0	0	111.2	T43 K44 M45 Q49 L50	T43-I47 WeakPolarHBondContact O-CG1 3.38Å; K44-I47 PolarHBondContact O-N 2.86Å; M45-I47 VanDerWaalsContact C-N 3.26Å; M45-I47 PolarHBondContact O-N 3.25Å; I47-Q49 PolarHBondContact O-N 3.36Å; I47-L50 PolarHBondContact O-N 3.49Å
48	S	45.2	Very low	43.2	Very low	64 Å²	64	107.4 Å²	107.4	45%	0.448	58%	0.575	S	S	.	*	H	α-helix	trans	-71.6	-26.2	-179.6	74	0	0	0	0	114.7	K44 M45 L50 D51	K44-S48 PolarHBondContact O-N 2.97Å; K44-S48 VanDerWaalsContact O-N 3.14Å; M45-S48 PolarHBondContact O-N 2.99Å; M45-S48 VanDerWaalsContact O-N 3.11Å; M45-S48 PolarHBondContact O-OG 3.16Å; S48-L50 VanDerWaalsContact C-N 3.3Å; S48-L50 PolarHBondContact O-N 3.03Å; S48-D51 PolarHBondContact O-N 3.32Å
49	Q	46.3	Very low	42.9	Very low	147 Å²	147	109 Å²	109	69%	0.687	59%	0.592	S	S	*	*	H	α-helix	trans	-75.3	-18.6	179.2	-73.2	-165.3	2.2	0	0	113.2	M45 I47 D51	M45-Q49 PolarHBondContact O-N 2.86Å; I47-Q49 PolarHBondContact O-N 3.36Å; Q49-D51 PolarHBondContact O-N 2.97Å
50	L	44	Very low	42.6	Very low	151 Å²	151	109.8 Å²	109.8	79%	0.791	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-27.2	172.4	-126.4	83.2	0	0	0	111.9	I47 S48	I47-L50 PolarHBondContact O-N 3.49Å; S48-L50 VanDerWaalsContact C-N 3.3Å; S48-L50 PolarHBondContact O-N 3.03Å
51	D	45.1	Very low	41.9	Very low	140 Å²	140	113.3 Å²	113.3	75%	0.749	62%	0.621	S	S	*	*	S	Bend	trans	-95	-10.6	-169.6	-125.2	4	0	0	0	114.8	S48 Q49	S48-D51 PolarHBondContact O-N 3.32Å; Q49-D51 PolarHBondContact O-N 2.97Å
52	N	40.4	Very low	41.4	Very low	102 Å²	102	117.4 Å²	117.4	55%	0.545	65%	0.645	S	S	.	*			trans	-114.9	16.2	-172.2	-94.6	-26.5	0	0	0	115.3	S54 I55	N52-S54 PolarHBondContact O-N 3.47Å; N52-S54 VanDerWaalsContact O-N 3.13Å; N52-I55 PolarHBondContact O-N 2.93Å
53	S	44.9	Very low	40.9	Very low	107 Å²	107	124.7 Å²	124.7	75%	0.748	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	-11.8	175.3	59.5	0	0	0	0	113.9
54	S	42.4	Very low	40.7	Very low	90 Å²	90	124.7 Å²	124.7	63%	0.629	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-13.9	-178.3	56.5	0	0	0	0	115.8	N52	N52-S54 PolarHBondContact O-N 3.47Å; N52-S54 VanDerWaalsContact O-N 3.13Å
55	I	40.9	Very low	40.9	Very low	110 Å²	110	126 Å²	126	56%	0.564	69%	0.692	S	S	*	*	S	Bend	trans	-100.3	-10.5	-173.7	-61.3	177.7	0	0	0	113.4	N52 S57	N52-I55 PolarHBondContact O-N 2.93Å; I55-S57 PolarHBondContact O-N 3.45Å
56	K	37.6	Very low	41.3	Very low	181 Å²	181	126.7 Å²	126.7	79%	0.787	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-7	-175.3	-85	-178.5	178.4	175.6	0	116.4
57	S	38.8	Very low	42.1	Very low	91 Å²	91	126 Å²	126	64%	0.636	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-26.8	-179.2	55.2	0	0	0	0	114.4	I55 S60	I55-S57 PolarHBondContact O-N 3.45Å; S57-S60 PolarHBondContact O-OG 3.36Å
58	T	35.2	Very low	43.6	Very low	124 Å²	124	127.7 Å²	127.7	76%	0.761	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	-13.7	-166.1	-42.5	0	0	0	0	114.8
59	L	35	Very low	45.4	Very low	164 Å²	164	126.4 Å²	126.4	86%	0.859	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	9.1	-179.9	-80.2	158.8	0	0	0	114.4
60	S	38.4	Very low	46.9	Very low	90 Å²	90	126.5 Å²	126.5	63%	0.629	70%	0.699	S	S	*	*	S	Bend	trans	-93.2	-1.6	-172.1	69.8	0	0	0	0	116.4	S57	S57-S60 PolarHBondContact O-OG 3.36Å
61	M	33.2	Very low	48.3	Very low	168 Å²	168	122.3 Å²	122.3	83%	0.828	68%	0.682	S	S	*	*	S	Bend	trans	-128.2	77.7	179.8	-65.2	-154.8	-176.7	0	0	112.1
62	N	34	Very low	49.4	Very low	167 Å²	167	119.9 Å²	119.9	89%	0.893	67%	0.666	S	S	*	*			trans	-179.4	14	149.7	-97.1	-8.8	0	0	0	115.9	S64	N62-S64 PolarHBondContact O-N 3.08Å; N62-S64 VanDerWaalsContact O-N 3.17Å
63	K	37.7	Very low	50.5	Low	199 Å²	199	122.8 Å²	122.8	87%	0.865	68%	0.682	S	S	*	*			trans	-78.9	100.2	163.2	-100	179.4	177	176.6	0	108.7	N65	K63-N65 PolarHBondContact O-N 3.41Å
64	S	42.6	Very low	51.8	Low	88 Å²	88	122.4 Å²	122.4	62%	0.615	67%	0.672	S	S	*	*			trans	-44.5	129.8	154.7	47.4	0	0	0	0	108.7	N62 T66	N62-S64 PolarHBondContact O-N 3.08Å; N62-S64 VanDerWaalsContact O-N 3.17Å; S64-T66 PolarHBondContact O-N 2.75Å
65	N	47.7	Very low	53.7	Low	166 Å²	166	121 Å²	121	89%	0.888	66%	0.661	S	S	*	*	S	Bend	trans	-64.3	22	-177.4	-82.8	-19.8	0	0	0	114.9	K63 S67	K63-N65 PolarHBondContact O-N 3.41Å; N65-S67 VanDerWaalsContact C-N 3.29Å; N65-S67 PolarHBondContact O-N 3.24Å; N65-S67 VanDerWaalsContact O-N 3.15Å
66	T	48.9	Very low	55.9	Low	89 Å²	89	122 Å²	122	55%	0.546	67%	0.672	S	S	.	*			trans	-83.8	78.2	166	51.5	0	0	0	0	108	S64 E68	S64-T66 PolarHBondContact O-N 2.75Å; T66-E68 PolarHBondContact O-N 3.1Å
67	S	62.2	Low	58.3	Low	82 Å²	82	119.5 Å²	119.5	57%	0.573	67%	0.667	S	S	*	*			trans	-62.4	91.3	158.4	-53.8	0	0	0	0	106.6	N65 K224	N65-S67 VanDerWaalsContact C-N 3.29Å; N65-S67 PolarHBondContact O-N 3.24Å; N65-S67 VanDerWaalsContact O-N 3.15Å; S67-K224 PolarHBondContact O-NZ 3.39Å
68	E	76	Confident	60.6	Low	161 Å²	161	119.7 Å²	119.7	75%	0.752	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-69.1	131.7	167.9	-72.9	-177.6	169.4	0	0	107.8	T66 I70	T66-E68 PolarHBondContact O-N 3.1Å; E68-I70 PolarHBondContact O-N 2.92Å
69	C	81.8	Confident	63.1	Low	38 Å²	38	114.8 Å²	114.8	26%	0.257	63%	0.63	S	S	.	*	P	Polyproline II helix	trans	-72.7	119.1	176.4	-56.1	0	0	0	0	108.2	Y144 C225	C69-Y144 HydrophobicContact CB-CD1 4Å; C69-Y144 HydrophobicContact CB-CD2 3.42Å; C69-Y144 VanDerWaalsContact CB-CD2 3.42Å; C69-Y144 HydrophobicContact CB-CE1 4.01Å; C69-Y144 HydrophobicContact CB-CE2 3.45Å; C69-Y144 VanDerWaalsContact CB-CE2 3.45Å; C69-Y144 HydrophobicContact CB-CG 3.72Å; C69-C225 WeakPolarHBondContact CA-SG 3.49Å; C69-C225 HydrophobicContact CB-CB 3.75Å; C69-C225 WeakPolarHBondContact CB-SG 3.24Å; C69-C225 WeakPolarHBondContact SG-CB 3.34Å; C69-C225 CovalentContact SG-SG 2.03Å; C69-C225 PolarHBondContact SG-SG 3.43Å
70	I	78.4	Confident	65.8	Low	149 Å²	149	108.1 Å²	108.1	76%	0.764	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-90.2	121.9	176.6	-57.4	174.6	0	0	0	107.3	E68	E68-I70 PolarHBondContact O-N 2.92Å
71	S	73.3	Confident	68.3	Low	63 Å²	63	107.9 Å²	107.9	44%	0.441	59%	0.591	S	S	.	*	P	Polyproline II helix	trans	-64.4	139.4	170.2	55.7	0	0	0	0	110.3	N73 Q142	S71-N73 PolarHBondContact O-N 2.87Å; S71-Q142 WeakPolarHBondContact CB-O 3.15Å
72	E	68.6	Low	70.9	Confident	88 Å²	88	103.6 Å²	103.6	41%	0.411	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-59	138.4	169.8	-71.2	178	160.2	0	0	110.1	D74 R432	E72-D74 PolarHBondContact O-N 3.27Å; E72-R432 IonicContact OE1-NH1 2.77Å; E72-R432 IonicContact OE2-CZ 2.68Å; E72-R432 IonicContact OE2-NH1 2.72Å; E72-R432 PolarHBondContact OE2-NH1 3.38Å
73	N	63.8	Low	73.7	Confident	163 Å²	163	99 Å²	99	87%	0.872	54%	0.543	S	S	*	.			trans	-75.8	55.7	-175.6	-87.4	-12.2	0	0	0	112.6	S71	S71-N73 PolarHBondContact O-N 2.87Å
74	D	70.7	Confident	76.4	Confident	100 Å²	100	94.2 Å²	94.2	54%	0.535	53%	0.526	S	S	.	.			trans	-81.8	149.4	171.2	-78.4	-17.4	0	0	0	111.2	E72 V76 T79	E72-D74 PolarHBondContact O-N 3.27Å; D74-V76 PolarHBondContact O-N 2.85Å; D74-T79 VanDerWaalsContact CB-OG1 3.26Å; D74-T79 WeakPolarHBondContact CB-OG1 3.24Å
75	S	83.7	Confident	78.8	Confident	59 Å²	59	94.8 Å²	94.8	41%	0.413	52%	0.522	S	S	.	.			trans	-63.9	128.8	175.6	72.4	0	0	0	0	110.1	L77 I78 T79	S75-L77 PolarHBondContact O-N 3.12Å; S75-I78 PolarHBondContact O-N 2.82Å; S75-I78 VanDerWaalsContact OG-CB 3.26Å; S75-I78 WeakPolarHBondContact OG-CB 3.11Å; S75-I78 WeakPolarHBondContact OG-CD1 3.46Å; S75-I78 WeakPolarHBondContact OG-CG1 3.26Å; S75-I78 PolarHBondContact OG-N 3.16Å; S75-T79 PolarHBondContact O-N 3.46Å; S75-T79 VanDerWaalsContact O-N 3.07Å; S75-T79 PolarHBondContact O-OG1 3.46Å
76	V	85.8	Confident	81	Confident	131 Å²	131	87.5 Å²	87.5	79%	0.794	48%	0.484	S	S	*	.	H	α-helix	trans	-48.6	-38.4	-178.3	178.4	0	0	0	0	112.6	D74 G80	D74-V76 PolarHBondContact O-N 2.85Å; V76-G80 PolarHBondContact O-N 3.5Å
77	L	89	Confident	83.2	Confident	130 Å²	130	86.9 Å²	86.9	68%	0.681	48%	0.477	S	S	*	.	H	α-helix	trans	-65.5	-47.8	178.4	-179.2	63.2	0	0	0	112.5	S75 G80 I81	S75-L77 PolarHBondContact O-N 3.12Å; L77-G80 PolarHBondContact O-N 3.48Å; L77-I81 HydrophobicContact CD1-CD1 4.16Å; L77-I81 HydrophobicContact CG-CD1 4.06Å; L77-I81 VanDerWaalsContact O-CG1 3.29Å; L77-I81 WeakPolarHBondContact O-CG1 3.46Å; L77-I81 PolarHBondContact O-N 2.93Å
78	I	87.5	Confident	84.8	Confident	95 Å²	95	87.7 Å²	87.7	49%	0.487	47%	0.473	S	S	.	.	H	α-helix	trans	-65	-47	-179.6	-67.2	174.3	0	0	0	109.9	S75 G80 I81 I82	S75-I78 PolarHBondContact O-N 2.82Å; S75-I78 VanDerWaalsContact OG-CB 3.26Å; S75-I78 WeakPolarHBondContact OG-CB 3.11Å; S75-I78 WeakPolarHBondContact OG-CD1 3.46Å; S75-I78 WeakPolarHBondContact OG-CG1 3.26Å; S75-I78 PolarHBondContact OG-N 3.16Å; I78-G80 VanDerWaalsContact C-N 3.3Å; I78-G80 PolarHBondContact O-N 3.42Å; I78-I81 PolarHBondContact O-N 3.45Å; I78-I81 VanDerWaalsContact O-N 3.15Å; I78-I82 HydrophobicContact CG2-CD1 3.8Å; I78-I82 HydrophobicContact CG2-CG1 4.4Å; I78-I82 WeakPolarHBondContact O-CG1 3.33Å; I78-I82 PolarHBondContact O-N 2.95Å
79	T	86.8	Confident	85.6	Confident	21 Å²	21	81.8 Å²	81.8	13%	0.129	45%	0.448	C	S	.	.	H	α-helix	trans	-60	-41.6	177.6	-48	0	0	0	0	111.2	D74 S75 I82 F83 Y141	D74-T79 VanDerWaalsContact CB-OG1 3.26Å; D74-T79 WeakPolarHBondContact CB-OG1 3.24Å; S75-T79 PolarHBondContact O-N 3.46Å; S75-T79 VanDerWaalsContact O-N 3.07Å; S75-T79 PolarHBondContact O-OG1 3.46Å; T79-I82 PolarHBondContact O-N 3.15Å; T79-F83 WeakPolarHBondContact O-CB 3.48Å; T79-F83 PolarHBondContact O-N 2.71Å; T79-Y141 HydrophobicContact CG2-CD2 3.84Å; T79-Y141 HydrophobicContact CG2-CE2 4.28Å; T79-Y141 WeakPolarHBondContact CG2-O 3.38Å
80	G	90.9	Very high	86.4	Confident	23 Å²	23	80.4 Å²	80.4	24%	0.237	44%	0.44	C	S	.	.	H	α-helix	trans	-61.7	-41.6	174.4	0	0	0	0	0	113.5	V76 L77 I78 F83 I84	V76-G80 PolarHBondContact O-N 3.5Å; L77-G80 PolarHBondContact O-N 3.48Å; I78-G80 VanDerWaalsContact C-N 3.3Å; I78-G80 PolarHBondContact O-N 3.42Å; G80-F83 PolarHBondContact O-N 2.87Å; G80-I84 WeakPolarHBondContact O-CG1 3.32Å; G80-I84 PolarHBondContact O-N 3.44Å; G80-I84 VanDerWaalsContact O-N 3.08Å
81	I	91.1	Very high	87.3	Confident	85 Å²	85	78.6 Å²	78.6	44%	0.436	43%	0.43	S	S	.	.	H	α-helix	trans	-65.2	-47	176	-69.1	165.2	0	0	0	110.8	L77 I78 F83 I84 L85	L77-I81 HydrophobicContact CD1-CD1 4.16Å; L77-I81 HydrophobicContact CG-CD1 4.06Å; L77-I81 VanDerWaalsContact O-CG1 3.29Å; L77-I81 WeakPolarHBondContact O-CG1 3.46Å; L77-I81 PolarHBondContact O-N 2.93Å; I78-I81 PolarHBondContact O-N 3.45Å; I78-I81 VanDerWaalsContact O-N 3.15Å; I81-F83 VanDerWaalsContact C-N 3.29Å; I81-F83 PolarHBondContact O-N 3.01Å; I81-I84 PolarHBondContact O-N 3.13Å; I81-L85 HydrophobicContact CG2-CD1 3.82Å; I81-L85 HydrophobicContact CG2-CG 4.28Å; I81-L85 WeakPolarHBondContact O-CB 3.32Å; I81-L85 WeakPolarHBondContact O-CG 3.33Å; I81-L85 PolarHBondContact O-N 3.4Å
82	I	88.9	Confident	88.4	Confident	79 Å²	79	77.4 Å²	77.4	41%	0.405	43%	0.425	S	S	.	.	H	α-helix	trans	-59.1	-43.6	178.3	-68.7	170.5	0	0	0	110.3	I78 T79 L85 S86	I78-I82 HydrophobicContact CG2-CD1 3.8Å; I78-I82 HydrophobicContact CG2-CG1 4.4Å; I78-I82 WeakPolarHBondContact O-CG1 3.33Å; I78-I82 PolarHBondContact O-N 2.95Å; T79-I82 PolarHBondContact O-N 3.15Å; I82-L85 PolarHBondContact O-N 3.33Å; I82-S86 WeakPolarHBondContact O-CB 3.31Å; I82-S86 PolarHBondContact O-N 2.72Å; I82-S86 PolarHBondContact O-OG 2.99Å
83	F	92.6	Very high	89.8	Confident	69 Å²	69	73.2 Å²	73.2	30%	0.303	41%	0.405	S	S	.	.	H	α-helix	trans	-59	-50	176.6	175.8	-99.8	0	0	0	112.3	T79 G80 I81 L85 S86 L87 I137 Y141	T79-F83 WeakPolarHBondContact O-CB 3.48Å; T79-F83 PolarHBondContact O-N 2.71Å; G80-F83 PolarHBondContact O-N 2.87Å; I81-F83 VanDerWaalsContact C-N 3.29Å; I81-F83 PolarHBondContact O-N 3.01Å; F83-L85 PolarHBondContact O-N 3.38Å; F83-S86 PolarHBondContact O-N 2.83Å; F83-L87 WeakPolarHBondContact O-CB 3.4Å; F83-L87 PolarHBondContact O-N 2.83Å; F83-I137 HydrophobicContact CD2-CG2 3.42Å; F83-I137 VanDerWaalsContact CD2-CG2 3.42Å; F83-I137 HydrophobicContact CE2-CG2 3.44Å; F83-I137 VanDerWaalsContact CE2-CG2 3.44Å; F83-Y141 HydrophobicContact CB-CD2 3.77Å; F83-Y141 HydrophobicContact CB-CE2 4.43Å; F83-Y141 AromaticContact CD2-CD2 3.9Å; F83-Y141 HydrophobicContact CD2-CD2 3.9Å; F83-Y141 AromaticContact CD2-CG 3.9Å; F83-Y141 HydrophobicContact CD2-CG 3.9Å; F83-Y141 HydrophobicContact CE2-CG 4.45Å; F83-Y141 AromaticContact CG-CD2 3.9Å; F83-Y141 HydrophobicContact CG-CD2 3.9Å; F83-Y141 HydrophobicContact CG-CE2 4.47Å; F83-Y141 HydrophobicContact CG-CG 4.37Å
84	I	94.8	Very high	91.4	Very high	99 Å²	99	66.3 Å²	66.3	51%	0.508	37%	0.37	S	S	.	.	H	α-helix	trans	-62	-45.6	179.4	-67.6	168.3	0	0	0	111	G80 I81 S86 L87 I88	G80-I84 WeakPolarHBondContact O-CG1 3.32Å; G80-I84 PolarHBondContact O-N 3.44Å; G80-I84 VanDerWaalsContact O-N 3.08Å; I81-I84 PolarHBondContact O-N 3.13Å; I84-S86 PolarHBondContact O-N 3.11Å; I84-L87 PolarHBondContact O-N 2.9Å; I84-I88 HydrophobicContact CG2-CD1 3.97Å; I84-I88 WeakPolarHBondContact O-CG1 3.2Å; I84-I88 PolarHBondContact O-N 2.9Å
85	L	92.7	Very high	92.7	Very high	100 Å²	100	63.5 Å²	63.5	52%	0.524	37%	0.365	S	S	.	.	H	α-helix	trans	-62.8	-43.3	178.6	-70.5	176	0	0	0	111.8	I81 I82 F83 L87 I88 V89	I81-L85 HydrophobicContact CG2-CD1 3.82Å; I81-L85 HydrophobicContact CG2-CG 4.28Å; I81-L85 WeakPolarHBondContact O-CB 3.32Å; I81-L85 WeakPolarHBondContact O-CG 3.33Å; I81-L85 PolarHBondContact O-N 3.4Å; I82-L85 PolarHBondContact O-N 3.33Å; F83-L85 PolarHBondContact O-N 3.38Å; L85-L87 VanDerWaalsContact C-N 3.33Å; L85-L87 PolarHBondContact O-N 3.21Å; L85-I88 PolarHBondContact O-N 2.82Å; L85-V89 WeakPolarHBondContact O-CG2 3.43Å; L85-V89 PolarHBondContact O-N 2.93Å
86	S	93.3	Very high	93.4	Very high	13 Å²	13	61.4 Å²	61.4	9%	0.091	35%	0.353	C	S	.	.	H	α-helix	trans	-64.2	-38.7	178.1	-58.5	0	0	0	0	111.7	I82 F83 I84 V89 A90 W436	I82-S86 WeakPolarHBondContact O-CB 3.31Å; I82-S86 PolarHBondContact O-N 2.72Å; I82-S86 PolarHBondContact O-OG 2.99Å; F83-S86 PolarHBondContact O-N 2.83Å; I84-S86 PolarHBondContact O-N 3.11Å; S86-V89 PolarHBondContact O-N 3.48Å; S86-A90 WeakPolarHBondContact O-CB 3.35Å; S86-A90 PolarHBondContact O-N 3.07Å; S86-W436 VanDerWaalsContact CB-CH2 3.5Å
87	L	96	Very high	94	Very high	76 Å²	76	55.1 Å²	55.1	40%	0.398	32%	0.315	S	S	.	.	H	α-helix	trans	-65	-42.5	174.4	-174.7	64.1	0	0	0	112.1	F83 I84 L85 V89 A90 I91	F83-L87 WeakPolarHBondContact O-CB 3.4Å; F83-L87 PolarHBondContact O-N 2.83Å; I84-L87 PolarHBondContact O-N 2.9Å; L85-L87 VanDerWaalsContact C-N 3.33Å; L85-L87 PolarHBondContact O-N 3.21Å; L87-V89 VanDerWaalsContact C-N 3.35Å; L87-V89 PolarHBondContact O-N 2.94Å; L87-A90 PolarHBondContact O-N 3.46Å; L87-I91 HydrophobicContact CD1-CD1 4.36Å; L87-I91 HydrophobicContact CG-CD1 4.08Å; L87-I91 WeakPolarHBondContact O-CG1 3.49Å; L87-I91 PolarHBondContact O-N 3.35Å
88	I	95.5	Very high	94.4	Very high	99 Å²	99	54 Å²	54	51%	0.508	30%	0.304	S	S	.	.	H	α-helix	trans	-60.7	-45.5	174.9	-69.7	166.2	0	0	0	110.5	I84 L85 A90 I91 A92	I84-I88 HydrophobicContact CG2-CD1 3.97Å; I84-I88 WeakPolarHBondContact O-CG1 3.2Å; I84-I88 PolarHBondContact O-N 2.9Å; L85-I88 PolarHBondContact O-N 2.82Å; I88-A90 VanDerWaalsContact C-N 3.35Å; I88-A90 PolarHBondContact O-N 3.45Å; I88-I91 PolarHBondContact O-N 2.8Å; I88-A92 VanDerWaalsContact O-CB 3.24Å; I88-A92 WeakPolarHBondContact O-CB 3.22Å; I88-A92 PolarHBondContact O-N 2.86Å
89	V	93.3	Very high	94.9	Very high	37 Å²	37	50.4 Å²	50.4	22%	0.224	29%	0.286	C	S	.	.	H	α-helix	trans	-61.7	-42.8	177.3	171.4	0	0	0	0	110.8	L85 S86 L87 A92 T93 F443	L85-V89 WeakPolarHBondContact O-CG2 3.43Å; L85-V89 PolarHBondContact O-N 2.93Å; S86-V89 PolarHBondContact O-N 3.48Å; L87-V89 VanDerWaalsContact C-N 3.35Å; L87-V89 PolarHBondContact O-N 2.94Å; V89-A92 PolarHBondContact O-N 3.13Å; V89-T93 VanDerWaalsContact O-CB 3.32Å; V89-T93 WeakPolarHBondContact O-CB 3.35Å; V89-T93 PolarHBondContact O-N 3.27Å; V89-T93 PolarHBondContact O-OG1 3.15Å; V89-F443 HydrophobicContact CG1-CB 4.38Å; V89-F443 HydrophobicContact CG1-CG 4.42Å
90	A	97.1	Very high	95.4	Very high	9 Å²	9	49.4 Å²	49.4	7%	0.074	28%	0.28	C	S	.	.	H	α-helix	trans	-62.4	-47.4	177.9	0	0	0	0	0	112.5	S86 L87 I88 A92 T93 A94 L133 I137	S86-A90 WeakPolarHBondContact O-CB 3.35Å; S86-A90 PolarHBondContact O-N 3.07Å; L87-A90 PolarHBondContact O-N 3.46Å; I88-A90 VanDerWaalsContact C-N 3.35Å; I88-A90 PolarHBondContact O-N 3.45Å; A90-A92 VanDerWaalsContact C-N 3.35Å; A90-A92 PolarHBondContact O-N 2.81Å; A90-T93 PolarHBondContact O-N 2.78Å; A90-A94 PolarHBondContact O-N 2.87Å; A90-L133 HydrophobicContact CB-CB 4Å; A90-L133 HydrophobicContact CB-CD1 3.71Å; A90-I137 HydrophobicContact CB-CD1 3.84Å
91	I	97.5	Very high	95.8	Very high	111 Å²	111	49.6 Å²	49.6	57%	0.569	28%	0.276	S	S	*	.	H	α-helix	trans	-62	-43.7	176.9	-67	168.4	0	0	0	110.8	L87 I88 T93 A94 G95	L87-I91 HydrophobicContact CD1-CD1 4.36Å; L87-I91 HydrophobicContact CG-CD1 4.08Å; L87-I91 WeakPolarHBondContact O-CG1 3.49Å; L87-I91 PolarHBondContact O-N 3.35Å; I88-I91 PolarHBondContact O-N 2.8Å; I91-T93 VanDerWaalsContact C-N 3.34Å; I91-T93 PolarHBondContact O-N 2.82Å; I91-A94 PolarHBondContact O-N 3.36Å; I91-G95 PolarHBondContact O-N 3.26Å
92	A	96.5	Very high	96.1	Very high	39 Å²	39	47.6 Å²	47.6	32%	0.322	27%	0.266	S	S	.	.	H	α-helix	trans	-67.4	-35.2	179.5	0	0	0	0	0	112.1	I88 V89 A90 G96 F443	I88-A92 VanDerWaalsContact O-CB 3.24Å; I88-A92 WeakPolarHBondContact O-CB 3.22Å; I88-A92 PolarHBondContact O-N 2.86Å; V89-A92 PolarHBondContact O-N 3.13Å; A90-A92 VanDerWaalsContact C-N 3.35Å; A90-A92 PolarHBondContact O-N 2.81Å; A92-G96 WeakPolarHBondContact O-CA 3.3Å; A92-G96 PolarHBondContact O-N 2.98Å; A92-F443 HydrophobicContact CB-CD2 4.03Å; A92-F443 HydrophobicContact CB-CE2 3.52Å; A92-F443 HydrophobicContact CB-CZ 4.41Å
93	T	97.6	Very high	96.4	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64.8	-49	173.9	-56.9	0	0	0	0	111	V89 A90 I91 N97 A129 F443	V89-T93 VanDerWaalsContact O-CB 3.32Å; V89-T93 WeakPolarHBondContact O-CB 3.35Å; V89-T93 PolarHBondContact O-N 3.27Å; V89-T93 PolarHBondContact O-OG1 3.15Å; A90-T93 PolarHBondContact O-N 2.78Å; I91-T93 VanDerWaalsContact C-N 3.34Å; I91-T93 PolarHBondContact O-N 2.82Å; T93-N97 WeakPolarHBondContact O-CB 3.33Å; T93-N97 PolarHBondContact O-N 2.94Å; T93-N97 PolarHBondContact O-ND2 3.49Å; T93-A129 HydrophobicContact CG2-CB 3.91Å; T93-F443 VanDerWaalsContact OG1-CB 3.31Å; T93-F443 WeakPolarHBondContact OG1-CB 3.32Å
94	A	98.5	Very high	96.6	Very high	17 Å²	17	41.3 Å²	41.3	14%	0.14	24%	0.237	C	C	.	.	H	α-helix	trans	-60.8	-52.7	176.9	0	0	0	0	0	111.1	A90 I91 G96 N97 F98 F126 A129	A90-A94 PolarHBondContact O-N 2.87Å; I91-A94 PolarHBondContact O-N 3.36Å; A94-G96 PolarHBondContact O-N 3.44Å; A94-N97 PolarHBondContact O-N 2.93Å; A94-F98 WeakPolarHBondContact O-CB 3.18Å; A94-F98 PolarHBondContact O-N 3.48Å; A94-F126 HydrophobicContact CB-CD2 4.33Å; A94-F126 HydrophobicContact CB-CE2 4.38Å; A94-F126 WeakPolarHBondContact O-CD2 3.5Å; A94-A129 HydrophobicContact CB-CB 3.75Å
95	G	97.6	Very high	96.7	Very high	41 Å²	41	41.5 Å²	41.5	42%	0.423	24%	0.237	S	C	.	.	H	α-helix	trans	-63.3	-41.9	-178.6	0	0	0	0	0	113.2	I91 L99	I91-G95 PolarHBondContact O-N 3.26Å; G95-L99 VanDerWaalsContact O-CB 3.32Å; G95-L99 WeakPolarHBondContact O-CB 3.26Å; G95-L99 PolarHBondContact O-N 2.91Å
96	G	97.8	Very high	96.8	Very high	15 Å²	15	39.6 Å²	39.6	16%	0.155	23%	0.227	C	C	.	.	H	α-helix	trans	-65.2	-45.9	178.9	0	0	0	0	0	112.7	A92 A94 L99 V100	A92-G96 WeakPolarHBondContact O-CA 3.3Å; A92-G96 PolarHBondContact O-N 2.98Å; A94-G96 PolarHBondContact O-N 3.44Å; G96-L99 WeakPolarHBondContact O-CB 3.41Å; G96-L99 PolarHBondContact O-N 3.41Å; G96-V100 WeakPolarHBondContact O-CG2 3.31Å; G96-V100 PolarHBondContact O-N 2.9Å; G96-V100 VanDerWaalsContact O-N 3.13Å
97	N	98.4	Very high	97	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-73	-36.4	179	-75.6	-66.8	0	0	0	112.1	T93 A94 L99 V100 I101 A122 D125 F126 S442 P446	T93-N97 WeakPolarHBondContact O-CB 3.33Å; T93-N97 PolarHBondContact O-N 2.94Å; T93-N97 PolarHBondContact O-ND2 3.49Å; A94-N97 PolarHBondContact O-N 2.93Å; N97-L99 VanDerWaalsContact C-N 3.27Å; N97-L99 PolarHBondContact O-N 3.4Å; N97-V100 WeakPolarHBondContact O-CB 3.32Å; N97-V100 PolarHBondContact O-N 3.38Å; N97-V100 VanDerWaalsContact O-N 3.12Å; N97-I101 WeakPolarHBondContact O-CG1 3.48Å; N97-I101 PolarHBondContact O-N 2.68Å; N97-A122 HydrophobicContact CB-CB 4.29Å; N97-A122 WeakPolarHBondContact CB-O 3.39Å; N97-D125 HydrophobicContact CB-CB 4.39Å; N97-D125 WeakPolarHBondContact ND2-CB 3.29Å; N97-F126 HydrophobicContact CB-CB 4.04Å; N97-S442 PolarHBondContact ND2-O 3.11Å; N97-P446 HydrophobicContact CB-CG 4.38Å; N97-P446 WeakPolarHBondContact OD1-CG 3.22Å
98	F	98.3	Very high	96.9	Very high	105 Å²	105	42.9 Å²	42.9	46%	0.461	24%	0.237	S	C	.	.	H	α-helix	trans	-58.4	-40.6	170.3	-175.4	-108.1	0	0	0	111.8	A94 V100 I101 L102 F126	A94-F98 WeakPolarHBondContact O-CB 3.18Å; A94-F98 PolarHBondContact O-N 3.48Å; F98-V100 VanDerWaalsContact C-N 3.35Å; F98-V100 PolarHBondContact O-N 3.43Å; F98-I101 PolarHBondContact O-N 2.96Å; F98-L102 HydrophobicContact CE1-CD1 4.35Å; F98-L102 HydrophobicContact CZ-CD1 4.14Å; F98-L102 WeakPolarHBondContact O-CB 3.4Å; F98-L102 PolarHBondContact O-N 3.08Å; F98-F126 HydrophobicContact CB-CD2 4.04Å; F98-F126 HydrophobicContact CB-CE2 3.97Å; F98-F126 HydrophobicContact CD2-CE2 4.19Å; F98-F126 HydrophobicContact CD2-CZ 4.29Å; F98-F126 HydrophobicContact CG-CE2 4.42Å
99	L	97.6	Very high	96.7	Very high	20 Å²	20	43.9 Å²	43.9	11%	0.105	24%	0.238	C	C	.	.	H	α-helix	trans	-62.3	-39.2	174.7	-179.7	64.3	0	0	0	112.5	G95 G96 N97 A103 F460 I463 L464	G95-L99 VanDerWaalsContact O-CB 3.32Å; G95-L99 WeakPolarHBondContact O-CB 3.26Å; G95-L99 PolarHBondContact O-N 2.91Å; G96-L99 WeakPolarHBondContact O-CB 3.41Å; G96-L99 PolarHBondContact O-N 3.41Å; N97-L99 VanDerWaalsContact C-N 3.27Å; N97-L99 PolarHBondContact O-N 3.4Å; L99-A103 VanDerWaalsContact O-CB 3.29Å; L99-A103 WeakPolarHBondContact O-CB 3.12Å; L99-A103 PolarHBondContact O-N 3.03Å; L99-F460 HydrophobicContact CD1-CD1 4.12Å; L99-F460 HydrophobicContact CD2-CB 3.96Å; L99-F460 HydrophobicContact CD2-CD1 3.82Å; L99-F460 HydrophobicContact CD2-CD2 3.92Å; L99-F460 HydrophobicContact CD2-CE1 4.22Å; L99-F460 HydrophobicContact CD2-CE2 4.34Å; L99-F460 HydrophobicContact CD2-CG 3.64Å; L99-F460 HydrophobicContact CD2-CZ 4.48Å; L99-F460 HydrophobicContact CG-CD1 3.58Å; L99-F460 HydrophobicContact CG-CE1 3.79Å; L99-F460 HydrophobicContact CG-CG 3.98Å; L99-F460 HydrophobicContact CG-CZ 4.37Å; L99-I463 HydrophobicContact CD1-CB 3.62Å; L99-I463 HydrophobicContact CD1-CD1 3.99Å; L99-I463 HydrophobicContact CD1-CG1 4.42Å; L99-I463 HydrophobicContact CD1-CG2 3.32Å; L99-L464 HydrophobicContact CD1-CG 4.44Å; L99-L464 HydrophobicContact CD2-CD1 4.13Å; L99-L464 HydrophobicContact CD2-CD2 4.27Å; L99-L464 HydrophobicContact CD2-CG 4.11Å
100	V	97.7	Very high	96.8	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.5	-49.8	173.6	177.2	0	0	0	0	110.4	G96 N97 F98 L102 A103 V104 I118 A122 P446 Y449 F456 F460	G96-V100 WeakPolarHBondContact O-CG2 3.31Å; G96-V100 PolarHBondContact O-N 2.9Å; G96-V100 VanDerWaalsContact O-N 3.13Å; N97-V100 WeakPolarHBondContact O-CB 3.32Å; N97-V100 PolarHBondContact O-N 3.38Å; N97-V100 VanDerWaalsContact O-N 3.12Å; F98-V100 VanDerWaalsContact C-N 3.35Å; F98-V100 PolarHBondContact O-N 3.43Å; V100-L102 VanDerWaalsContact C-N 3.35Å; V100-L102 PolarHBondContact O-N 2.96Å; V100-A103 PolarHBondContact O-N 2.82Å; V100-V104 WeakPolarHBondContact O-CG2 3.32Å; V100-V104 PolarHBondContact O-N 3.4Å; V100-I118 HydrophobicContact CG1-CG2 3.86Å; V100-A122 HydrophobicContact CB-CB 3.77Å; V100-A122 HydrophobicContact CG1-CB 3.62Å; V100-P446 HydrophobicContact CG2-CB 4.3Å; V100-P446 HydrophobicContact CG2-CG 4.26Å; V100-Y449 HydrophobicContact CG1-CD2 4.44Å; V100-Y449 HydrophobicContact CG1-CE2 4.47Å; V100-Y449 HydrophobicContact CG2-CD2 3.78Å; V100-Y449 HydrophobicContact CG2-CE2 4.32Å; V100-F456 HydrophobicContact CG1-CE1 4.11Å; V100-F460 HydrophobicContact CG2-CE1 4.37Å; V100-F460 HydrophobicContact CG2-CZ 3.73Å
101	I	98.3	Very high	96.7	Very high	28 Å²	28	47 Å²	47	14%	0.144	25%	0.248	C	C	.	.	H	α-helix	trans	-56.9	-50.2	178	-64.8	165.8	0	0	0	110	N97 F98 A103 V104 I105 A122 F123 F126	N97-I101 WeakPolarHBondContact O-CG1 3.48Å; N97-I101 PolarHBondContact O-N 2.68Å; F98-I101 PolarHBondContact O-N 2.96Å; I101-A103 VanDerWaalsContact C-N 3.32Å; I101-A103 PolarHBondContact O-N 3.31Å; I101-V104 PolarHBondContact O-N 2.95Å; I101-I105 HydrophobicContact CG2-CD1 3.7Å; I101-I105 WeakPolarHBondContact O-CG1 3.18Å; I101-I105 PolarHBondContact O-N 3.39Å; I101-A122 HydrophobicContact CD1-CB 4.48Å; I101-A122 HydrophobicContact CG1-CB 3.83Å; I101-F123 HydrophobicContact CD1-CB 4.38Å; I101-F123 HydrophobicContact CD1-CD2 4.5Å; I101-F126 HydrophobicContact CD1-CB 4.14Å; I101-F126 HydrophobicContact CD1-CG 4.4Å
102	L	97.4	Very high	96.5	Very high	43 Å²	43	43.7 Å²	43.7	23%	0.225	23%	0.234	C	C	.	.	H	α-helix	trans	-62	-39.5	-179.6	-152.9	84.4	0	0	0	111.9	F98 V100 I105 L106 I463	F98-L102 HydrophobicContact CE1-CD1 4.35Å; F98-L102 HydrophobicContact CZ-CD1 4.14Å; F98-L102 WeakPolarHBondContact O-CB 3.4Å; F98-L102 PolarHBondContact O-N 3.08Å; V100-L102 VanDerWaalsContact C-N 3.35Å; V100-L102 PolarHBondContact O-N 2.96Å; L102-I105 PolarHBondContact O-N 3.4Å; L102-L106 HydrophobicContact CD1-CD1 4.37Å; L102-L106 HydrophobicContact CD2-CD1 3.6Å; L102-L106 HydrophobicContact CG-CD1 3.57Å; L102-L106 HydrophobicContact CG-CG 4.04Å; L102-L106 VanDerWaalsContact O-CB 3.29Å; L102-L106 WeakPolarHBondContact O-CB 3.43Å; L102-L106 VanDerWaalsContact O-CG 3.26Å; L102-L106 WeakPolarHBondContact O-CG 3.1Å; L102-L106 PolarHBondContact O-N 3.37Å; L102-I463 HydrophobicContact CB-CD1 4.39Å; L102-I463 HydrophobicContact CD2-CB 4.5Å; L102-I463 HydrophobicContact CD2-CD1 4.19Å; L102-I463 HydrophobicContact CD2-CG1 4.24Å; L102-I463 HydrophobicContact CD2-CG2 3.46Å; L102-I463 VanDerWaalsContact CD2-CG2 3.46Å
103	A	97	Very high	96.4	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.1	-43.7	176.7	0	0	0	0	0	112.1	L99 V100 I101 I105 V107 L110 F456 P459 F460 I463	L99-A103 VanDerWaalsContact O-CB 3.29Å; L99-A103 WeakPolarHBondContact O-CB 3.12Å; L99-A103 PolarHBondContact O-N 3.03Å; V100-A103 PolarHBondContact O-N 2.82Å; I101-A103 VanDerWaalsContact C-N 3.32Å; I101-A103 PolarHBondContact O-N 3.31Å; A103-I105 VanDerWaalsContact C-N 3.34Å; A103-V107 WeakPolarHBondContact O-CB 3.23Å; A103-V107 PolarHBondContact O-N 3.37Å; A103-L110 HydrophobicContact CB-CD1 3.94Å; A103-F456 HydrophobicContact CB-CD1 4.12Å; A103-F456 HydrophobicContact CB-CE1 4.26Å; A103-P459 HydrophobicContact CB-CB 4.07Å; A103-F460 HydrophobicContact CB-CD1 4.05Å; A103-F460 HydrophobicContact CB-CE1 3.81Å; A103-I463 HydrophobicContact CB-CD1 3.94Å
104	V	96.6	Very high	96.1	Very high	16 Å²	16	43.1 Å²	43.1	10%	0.097	23%	0.227	C	C	.	.	H	α-helix	trans	-64.3	-39.5	176.7	174.6	0	0	0	0	111.1	V100 I101 Q111 N115 F456	V100-V104 WeakPolarHBondContact O-CG2 3.32Å; V100-V104 PolarHBondContact O-N 3.4Å; I101-V104 PolarHBondContact O-N 2.95Å; V104-Q111 WeakPolarHBondContact O-CG 3.4Å; V104-N115 HydrophobicContact CG2-CB 4.47Å; V104-F456 HydrophobicContact CG2-CE1 4Å; V104-F456 HydrophobicContact CG2-CZ 4.08Å
105	I	96.2	Very high	96	Very high	103 Å²	103	42.9 Å²	42.9	53%	0.528	22%	0.223	S	C	.	.	H	α-helix	trans	-73.1	-45.2	-179.8	-67	171	0	0	0	112	I101 L102 A103 Q111	I101-I105 HydrophobicContact CG2-CD1 3.7Å; I101-I105 WeakPolarHBondContact O-CG1 3.18Å; I101-I105 PolarHBondContact O-N 3.39Å; L102-I105 PolarHBondContact O-N 3.4Å; A103-I105 VanDerWaalsContact C-N 3.34Å; I105-Q111 PolarHBondContact O-NE2 3.32Å
106	L	95.8	Very high	95.9	Very high	59 Å²	59	43.8 Å²	43.8	31%	0.309	22%	0.217	S	C	.	.	H	α-helix	trans	-83.4	-25.6	-169.9	-66	-179	0	0	0	114.2	L102 I463 C468 N472	L102-L106 HydrophobicContact CD1-CD1 4.37Å; L102-L106 HydrophobicContact CD2-CD1 3.6Å; L102-L106 HydrophobicContact CG-CD1 3.57Å; L102-L106 HydrophobicContact CG-CG 4.04Å; L102-L106 VanDerWaalsContact O-CB 3.29Å; L102-L106 WeakPolarHBondContact O-CB 3.43Å; L102-L106 VanDerWaalsContact O-CG 3.26Å; L102-L106 WeakPolarHBondContact O-CG 3.1Å; L102-L106 PolarHBondContact O-N 3.37Å; L106-I463 HydrophobicContact CD1-CG1 4.46Å; L106-C468 HydrophobicContact CD1-CB 4.43Å; L106-N472 PolarHBondContact O-ND2 3Å
107	V	95.6	Very high	95.9	Very high	2 Å²	2	43 Å²	43	1%	0.012	21%	0.21	C	C	.	.			trans	-104.9	109	-170.9	179.9	0	0	0	0	111	A103 K109 L110 Q111 P459 I471 L475	A103-V107 WeakPolarHBondContact O-CB 3.23Å; A103-V107 PolarHBondContact O-N 3.37Å; V107-K109 HydrophobicContact CG1-CB 4.17Å; V107-K109 PolarHBondContact O-N 2.9Å; V107-K109 VanDerWaalsContact O-N 3.13Å; V107-L110 HydrophobicContact CB-CB 4.12Å; V107-L110 HydrophobicContact CB-CD1 4.13Å; V107-L110 HydrophobicContact CB-CG 4.09Å; V107-L110 HydrophobicContact CG1-CB 4.24Å; V107-L110 HydrophobicContact CG1-CD1 4.35Å; V107-L110 HydrophobicContact CG1-CG 3.93Å; V107-L110 CarbonylContact O-C 3.59Å; V107-L110 WeakPolarHBondContact O-CA 3.22Å; V107-L110 WeakPolarHBondContact O-CB 3.4Å; V107-L110 PolarHBondContact O-N 2.76Å; V107-Q111 PolarHBondContact O-N 2.99Å; V107-Q111 VanDerWaalsContact O-N 3.15Å; V107-P459 HydrophobicContact CB-CG 4.49Å; V107-P459 HydrophobicContact CG1-CG 4.25Å; V107-P459 HydrophobicContact CG2-CB 3.91Å; V107-P459 HydrophobicContact CG2-CG 3.93Å; V107-I471 HydrophobicContact CG2-CD1 3.81Å; V107-I471 HydrophobicContact CG2-CG1 4.23Å; V107-L475 HydrophobicContact CB-CD1 4.36Å; V107-L475 HydrophobicContact CG1-CD1 3.55Å; V107-L475 HydrophobicContact CG2-CD1 3.83Å
108	K	94.2	Very high	95.8	Very high	156 Å²	156	43.9 Å²	43.9	68%	0.678	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-35.6	-179.7	-67.9	-171.1	177.2	-170.3	0	113.3	L110 Q111 N472	K108-L110 VanDerWaalsContact C-N 3.28Å; K108-L110 PolarHBondContact O-N 3.07Å; K108-Q111 PolarHBondContact O-N 3Å; K108-N472 PolarHBondContact N-OD1 3.19Å
109	K	92.5	Very high	95.8	Very high	121 Å²	121	39.6 Å²	39.6	53%	0.526	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-31	175.9	-174.9	178.8	174.8	-167.9	0	112.4	V107 T112 E455	V107-K109 HydrophobicContact CG1-CB 4.17Å; V107-K109 PolarHBondContact O-N 2.9Å; V107-K109 VanDerWaalsContact O-N 3.13Å; K109-T112 WeakPolarHBondContact O-CG2 3.39Å; K109-E455 WeakPolarHBondContact CE-OE1 3.45Å; K109-E455 IonicContact NZ-OE1 2.73Å; K109-E455 PolarHBondContact NZ-OE1 3.4Å; K109-E455 VanDerWaalsContact NZ-OE1 3.16Å
110	L	94	Very high	95.9	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.01	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-13.3	177.4	-68.4	-176.6	0	0	0	113.1	A103 V107 K108 T112 N115 E455 F456 P459	A103-L110 HydrophobicContact CB-CD1 3.94Å; V107-L110 HydrophobicContact CB-CB 4.12Å; V107-L110 HydrophobicContact CB-CD1 4.13Å; V107-L110 HydrophobicContact CB-CG 4.09Å; V107-L110 HydrophobicContact CG1-CB 4.24Å; V107-L110 HydrophobicContact CG1-CD1 4.35Å; V107-L110 HydrophobicContact CG1-CG 3.93Å; V107-L110 CarbonylContact O-C 3.59Å; V107-L110 WeakPolarHBondContact O-CA 3.22Å; V107-L110 WeakPolarHBondContact O-CB 3.4Å; V107-L110 PolarHBondContact O-N 2.76Å; K108-L110 VanDerWaalsContact C-N 3.28Å; K108-L110 PolarHBondContact O-N 3.07Å; L110-T112 PolarHBondContact O-N 3.38Å; L110-N115 WeakPolarHBondContact O-CB 3.27Å; L110-N115 PolarHBondContact O-ND2 3.02Å; L110-E455 HydrophobicContact CD2-CB 3.77Å; L110-F456 HydrophobicContact CD1-CD1 3.95Å; L110-F456 HydrophobicContact CD1-CE1 3.94Å; L110-F456 HydrophobicContact CD1-CG 4.45Å; L110-F456 HydrophobicContact CD1-CZ 4.42Å; L110-F456 HydrophobicContact CD2-CD2 4.47Å; L110-F456 HydrophobicContact CD2-CE2 4.35Å; L110-F456 HydrophobicContact CD2-CZ 4.5Å; L110-P459 HydrophobicContact CD1-CB 4.14Å; L110-P459 HydrophobicContact CD1-CG 3.79Å; L110-P459 HydrophobicContact CG-CG 4.48Å
111	Q	95.4	Very high	95.9	Very high	108 Å²	108	39.3 Å²	39.3	51%	0.505	20%	0.199	S	C	.	.			trans	-73.2	49.4	175.4	-67	175.6	-18.1	0	0	112.2	V104 I105 V107 K108	V104-Q111 WeakPolarHBondContact O-CG 3.4Å; I105-Q111 PolarHBondContact O-NE2 3.32Å; V107-Q111 PolarHBondContact O-N 2.99Å; V107-Q111 VanDerWaalsContact O-N 3.15Å; K108-Q111 PolarHBondContact O-N 3Å
112	T	93.5	Very high	95.9	Very high	43 Å²	43	38 Å²	38	26%	0.264	19%	0.193	S	C	.	.			trans	-93.5	151.8	174.2	71.9	0	0	0	0	109.9	K109 L110 S114 N115 I116	K109-T112 WeakPolarHBondContact O-CG2 3.39Å; L110-T112 PolarHBondContact O-N 3.38Å; T112-S114 VanDerWaalsContact C-N 3.26Å; T112-S114 PolarHBondContact O-N 3.35Å; T112-S114 VanDerWaalsContact O-N 3.16Å; T112-N115 PolarHBondContact O-N 2.95Å; T112-N115 VanDerWaalsContact OG1-CG 3.31Å; T112-N115 PolarHBondContact OG1-ND2 3.4Å; T112-I116 PolarHBondContact O-N 3.47Å
113	P	93.8	Very high	95.9	Very high	22 Å²	22	40.4 Å²	40.4	14%	0.143	20%	0.201	C	C	.	.	H	α-helix	trans	-50.9	-43.5	-179.5	-29.6	35.4	0	0	0	113.6	N115 I116 R191 P193 M196	P113-N115 VanDerWaalsContact C-N 3.3Å; P113-N115 PolarHBondContact O-N 2.91Å; P113-I116 VanDerWaalsContact O-CB 3.23Å; P113-I116 WeakPolarHBondContact O-CB 3.4Å; P113-I116 WeakPolarHBondContact O-CG1 3.09Å; P113-I116 PolarHBondContact O-N 3.28Å; P113-I116 VanDerWaalsContact O-N 3.08Å; P113-R191 HydrophobicContact CB-CG 3.82Å; P113-R191 HydrophobicContact CG-CG 4.3Å; P113-P193 HydrophobicContact CG-CG 4.44Å; P113-M196 HydrophobicContact CB-CG 3.65Å; P113-M196 HydrophobicContact CB-SD 4.25Å; P113-M196 WeakPolarHBondContact O-CG 3.37Å
114	S	92.9	Very high	96	Very high	5 Å²	5	40.4 Å²	40.4	4%	0.035	20%	0.201	C	C	.	.	H	α-helix	trans	-67	-30.5	-178.9	-56.6	0	0	0	0	113.9	T112 I116 L117 D176 R177 R191	T112-S114 VanDerWaalsContact C-N 3.26Å; T112-S114 PolarHBondContact O-N 3.35Å; T112-S114 VanDerWaalsContact O-N 3.16Å; S114-I116 PolarHBondContact O-N 3.46Å; S114-L117 WeakPolarHBondContact O-CB 3.26Å; S114-L117 PolarHBondContact O-N 2.92Å; S114-D176 VanDerWaalsContact CB-OD2 3.32Å; S114-D176 WeakPolarHBondContact CB-OD2 3.3Å; S114-D176 PolarHBondContact OG-OD1 3.47Å; S114-D176 PolarHBondContact OG-OD2 3.34Å; S114-R177 PolarHBondContact OG-NH2 3.38Å; S114-R191 PolarHBondContact OG-NH1 3.16Å
115	N	94.8	Very high	96.1	Very high	12 Å²	12	39.7 Å²	39.7	6%	0.064	20%	0.197	C	C	.	.	H	α-helix	trans	-76.3	-13.9	176.6	-67.8	-7.2	0	0	0	112.2	V104 L110 T112 P113 L117 I118 G119	V104-N115 HydrophobicContact CG2-CB 4.47Å; L110-N115 WeakPolarHBondContact O-CB 3.27Å; L110-N115 PolarHBondContact O-ND2 3.02Å; T112-N115 PolarHBondContact O-N 2.95Å; T112-N115 VanDerWaalsContact OG1-CG 3.31Å; T112-N115 PolarHBondContact OG1-ND2 3.4Å; P113-N115 VanDerWaalsContact C-N 3.3Å; P113-N115 PolarHBondContact O-N 2.91Å; N115-L117 VanDerWaalsContact C-N 3.29Å; N115-I118 PolarHBondContact O-N 3.46Å; N115-G119 PolarHBondContact O-N 3.31Å
116	I	97.3	Very high	96.2	Very high	59 Å²	59	36.6 Å²	36.6	30%	0.303	18%	0.18	S	C	.	.	H	α-helix	trans	-64.1	-39.2	168.9	-55	176.7	0	0	0	109.7	T112 P113 S114 G119 S120 P193 M196 I200	T112-I116 PolarHBondContact O-N 3.47Å; P113-I116 VanDerWaalsContact O-CB 3.23Å; P113-I116 WeakPolarHBondContact O-CB 3.4Å; P113-I116 WeakPolarHBondContact O-CG1 3.09Å; P113-I116 PolarHBondContact O-N 3.28Å; P113-I116 VanDerWaalsContact O-N 3.08Å; S114-I116 PolarHBondContact O-N 3.46Å; I116-G119 WeakPolarHBondContact O-CA 3.34Å; I116-G119 PolarHBondContact O-N 2.73Å; I116-S120 PolarHBondContact O-N 3.33Å; I116-P193 HydrophobicContact CD1-CB 3.71Å; I116-P193 HydrophobicContact CD1-CG 4.29Å; I116-M196 HydrophobicContact CB-CB 4.4Å; I116-I200 HydrophobicContact CG2-CD1 3.76Å
117	L	97.5	Very high	96.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-63.3	-42.3	174.3	-58.4	178.3	0	0	0	111.6	S114 N115 G119 S120 L121 A172 I173 D176 M196 M199 I200	S114-L117 WeakPolarHBondContact O-CB 3.26Å; S114-L117 PolarHBondContact O-N 2.92Å; N115-L117 VanDerWaalsContact C-N 3.29Å; L117-G119 VanDerWaalsContact C-N 3.27Å; L117-G119 PolarHBondContact O-N 3.45Å; L117-S120 PolarHBondContact O-N 2.64Å; L117-L121 PolarHBondContact O-N 2.94Å; L117-A172 HydrophobicContact CD2-CB 4.48Å; L117-I173 HydrophobicContact CB-CD1 4.39Å; L117-I173 HydrophobicContact CB-CG1 3.63Å; L117-I173 HydrophobicContact CD1-CG1 4.26Å; L117-D176 HydrophobicContact CD1-CB 3.84Å; L117-M196 HydrophobicContact CD1-SD 3.86Å; L117-M196 HydrophobicContact CD2-CB 4.16Å; L117-M196 HydrophobicContact CD2-SD 4.38Å; L117-M196 HydrophobicContact CG-CB 4.46Å; L117-M196 HydrophobicContact CG-SD 3.96Å; L117-M199 HydrophobicContact CD1-CE 4.21Å; L117-M199 HydrophobicContact CD2-CB 4.2Å; L117-I200 HydrophobicContact CD2-CD1 4.07Å; L117-I200 HydrophobicContact CD2-CG1 3.74Å
118	I	96.4	Very high	96.5	Very high	18 Å²	18	36.5 Å²	36.5	9%	0.092	18%	0.177	C	C	.	.	H	α-helix	trans	-61.3	-39.2	174	-60.9	176.8	0	0	0	110.6	V100 N115 L121 A122 I173 Y449 F456	V100-I118 HydrophobicContact CG1-CG2 3.86Å; N115-I118 PolarHBondContact O-N 3.46Å; I118-L121 PolarHBondContact O-N 3.3Å; I118-A122 WeakPolarHBondContact O-CB 3.47Å; I118-A122 PolarHBondContact O-N 2.89Å; I118-I173 HydrophobicContact CG1-CD1 4.13Å; I118-Y449 HydrophobicContact CD1-CE1 4.44Å; I118-Y449 HydrophobicContact CG2-CE1 4.15Å; I118-Y449 HydrophobicContact CG2-CE2 4Å; I118-F456 HydrophobicContact CD1-CE2 4.24Å; I118-F456 HydrophobicContact CD1-CZ 4.43Å; I118-F456 HydrophobicContact CG2-CZ 4.06Å
119	G	97.8	Very high	96.7	Very high	15 Å²	15	29.4 Å²	29.4	16%	0.155	15%	0.147	C	C	.	.	H	α-helix	trans	-61.2	-43.5	173.7	0	0	0	0	0	112.9	N115 I116 L117 A122 F123	N115-G119 PolarHBondContact O-N 3.31Å; I116-G119 WeakPolarHBondContact O-CA 3.34Å; I116-G119 PolarHBondContact O-N 2.73Å; L117-G119 VanDerWaalsContact C-N 3.27Å; L117-G119 PolarHBondContact O-N 3.45Å; G119-A122 PolarHBondContact O-N 2.94Å; G119-F123 WeakPolarHBondContact O-CB 3.11Å; G119-F123 PolarHBondContact O-N 3.32Å
120	S	98.4	Very high	97	Very high	12 Å²	12	27.5 Å²	27.5	8%	0.084	14%	0.143	C	C	.	.	H	α-helix	trans	-64.1	-41	175.2	-179.2	0	0	0	0	112.5	I116 L117 F123 S124 N169 W204	I116-S120 PolarHBondContact O-N 3.33Å; L117-S120 PolarHBondContact O-N 2.64Å; S120-F123 WeakPolarHBondContact O-CB 3.33Å; S120-F123 PolarHBondContact O-N 3.04Å; S120-S124 PolarHBondContact O-N 3.34Å; S120-S124 PolarHBondContact O-OG 3.27Å; S120-N169 PolarHBondContact OG-ND2 3.03Å; S120-N169 PolarHBondContact OG-OD1 3.07Å; S120-W204 PolarHBondContact OG-NE1 2.74Å
121	L	98	Very high	97.1	Very high	1 Å²	1	30 Å²	30	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-60.2	-48.4	174.4	175.9	61.9	0	0	0	111.7	L117 I118 F123 S124 D125 S166 N169 L170 I173 Y449	L117-L121 PolarHBondContact O-N 2.94Å; I118-L121 PolarHBondContact O-N 3.3Å; L121-F123 VanDerWaalsContact C-N 3.25Å; L121-F123 PolarHBondContact O-N 3.44Å; L121-S124 PolarHBondContact O-N 3.43Å; L121-S124 PolarHBondContact O-OG 3.32Å; L121-D125 PolarHBondContact O-N 2.88Å; L121-S166 WeakPolarHBondContact CD1-O 3.48Å; L121-S166 WeakPolarHBondContact CD1-OG 3.14Å; L121-N169 HydrophobicContact CB-CB 4.09Å; L121-N169 HydrophobicContact CD1-CB 4.3Å; L121-L170 HydrophobicContact CD1-CD2 4.42Å; L121-L170 HydrophobicContact CD1-CG 4Å; L121-L170 HydrophobicContact CD2-CD2 3.54Å; L121-L170 HydrophobicContact CD2-CG 4.04Å; L121-I173 HydrophobicContact CB-CD1 4.42Å; L121-I173 HydrophobicContact CD2-CD1 3.84Å; L121-Y449 WeakPolarHBondContact CD2-OH 3.39Å
122	A	98.4	Very high	97.3	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.008	13%	0.131	C	C	.	.	H	α-helix	trans	-63.9	-33	176.3	0	0	0	0	0	112	N97 V100 I101 I118 G119 D125 F126	N97-A122 HydrophobicContact CB-CB 4.29Å; N97-A122 WeakPolarHBondContact CB-O 3.39Å; V100-A122 HydrophobicContact CB-CB 3.77Å; V100-A122 HydrophobicContact CG1-CB 3.62Å; I101-A122 HydrophobicContact CD1-CB 4.48Å; I101-A122 HydrophobicContact CG1-CB 3.83Å; I118-A122 WeakPolarHBondContact O-CB 3.47Å; I118-A122 PolarHBondContact O-N 2.89Å; G119-A122 PolarHBondContact O-N 2.94Å; A122-D125 PolarHBondContact O-N 2.92Å; A122-F126 WeakPolarHBondContact O-CB 3.4Å; A122-F126 PolarHBondContact O-N 3.17Å
123	F	98.6	Very high	97.5	Very high	94 Å²	94	22.8 Å²	22.8	41%	0.412	12%	0.119	S	C	.	.	H	α-helix	trans	-64.4	-46.3	174.7	-172.7	-88	0	0	0	111.8	I101 G119 S120 L121 F126 F127 W204	I101-F123 HydrophobicContact CD1-CB 4.38Å; I101-F123 HydrophobicContact CD1-CD2 4.5Å; G119-F123 WeakPolarHBondContact O-CB 3.11Å; G119-F123 PolarHBondContact O-N 3.32Å; S120-F123 WeakPolarHBondContact O-CB 3.33Å; S120-F123 PolarHBondContact O-N 3.04Å; L121-F123 VanDerWaalsContact C-N 3.25Å; L121-F123 PolarHBondContact O-N 3.44Å; F123-F126 PolarHBondContact O-N 3.11Å; F123-F127 AromaticContact CD1-CD2 3.98Å; F123-F127 HydrophobicContact CD1-CD2 3.98Å; F123-F127 HydrophobicContact CD1-CE2 4.28Å; F123-F127 HydrophobicContact CD2-CD2 4.39Å; F123-F127 HydrophobicContact CD2-CE2 4.08Å; F123-F127 AromaticContact CE1-CD2 3.69Å; F123-F127 HydrophobicContact CE1-CD2 3.69Å; F123-F127 AromaticContact CE1-CE2 3.71Å; F123-F127 HydrophobicContact CE1-CE2 3.71Å; F123-F127 HydrophobicContact CE2-CD2 4.14Å; F123-F127 AromaticContact CE2-CE2 3.49Å; F123-F127 HydrophobicContact CE2-CE2 3.49Å; F123-F127 VanDerWaalsContact CE2-CE2 3.49Å; F123-F127 HydrophobicContact CE2-CZ 4.49Å; F123-F127 HydrophobicContact CG-CD2 4.34Å; F123-F127 HydrophobicContact CG-CE2 4.46Å; F123-F127 AromaticContact CZ-CD2 3.78Å; F123-F127 HydrophobicContact CZ-CD2 3.78Å; F123-F127 AromaticContact CZ-CE2 3.27Å; F123-F127 HydrophobicContact CZ-CE2 3.27Å; F123-F127 HydrophobicContact CZ-CZ 4.2Å; F123-F127 WeakPolarHBondContact O-CD2 3.32Å; F123-F127 PolarHBondContact O-N 3.19Å; F123-W204 AromaticContact CD1-CH2 3.74Å; F123-W204 HydrophobicContact CD1-CH2 3.74Å; F123-W204 AromaticContact CD1-CZ2 3.67Å; F123-W204 HydrophobicContact CD1-CZ2 3.67Å; F123-W204 AromaticContact CE1-CH2 3.99Å; F123-W204 HydrophobicContact CE1-CH2 3.99Å; F123-W204 HydrophobicContact CE1-CZ2 4.24Å
124	S	98.5	Very high	97.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-60.1	-47.2	174.4	44.6	0	0	0	0	111.8	S120 L121 F126 F127 V128 S166	S120-S124 PolarHBondContact O-N 3.34Å; S120-S124 PolarHBondContact O-OG 3.27Å; L121-S124 PolarHBondContact O-N 3.43Å; L121-S124 PolarHBondContact O-OG 3.32Å; S124-F126 PolarHBondContact O-N 2.83Å; S124-F127 PolarHBondContact O-N 3.05Å; S124-V128 WeakPolarHBondContact O-CG2 3.19Å; S124-V128 PolarHBondContact O-N 3.39Å; S124-S166 WeakPolarHBondContact OG-CA 3.43Å
125	D	98.4	Very high	97.8	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-68.3	-32.7	-177.8	-69.2	-24.4	0	0	0	113.1	N97 L121 A122 V128 A129 S166 S442 N445	N97-D125 HydrophobicContact CB-CB 4.39Å; N97-D125 WeakPolarHBondContact ND2-CB 3.29Å; L121-D125 PolarHBondContact O-N 2.88Å; A122-D125 PolarHBondContact O-N 2.92Å; D125-V128 PolarHBondContact O-N 3.49Å; D125-A129 PolarHBondContact O-N 3.11Å; D125-S166 WeakPolarHBondContact OD1-CB 3.31Å; D125-S166 PolarHBondContact OD1-OG 3.44Å; D125-S442 WeakPolarHBondContact OD1-CB 3.32Å; D125-S442 PolarHBondContact OD1-OG 3.41Å; D125-N445 PolarHBondContact OD2-ND2 3.01Å
126	F	98.6	Very high	97.9	Very high	39 Å²	39	25.3 Å²	25.3	17%	0.171	13%	0.132	C	C	.	.	H	α-helix	trans	-62.1	-44.2	172.2	173.3	-110.4	0	0	0	111.3	A94 N97 F98 I101 A122 F123 S124 A129 L130	A94-F126 HydrophobicContact CB-CD2 4.33Å; A94-F126 HydrophobicContact CB-CE2 4.38Å; A94-F126 WeakPolarHBondContact O-CD2 3.5Å; N97-F126 HydrophobicContact CB-CB 4.04Å; F98-F126 HydrophobicContact CB-CD2 4.04Å; F98-F126 HydrophobicContact CB-CE2 3.97Å; F98-F126 HydrophobicContact CD2-CE2 4.19Å; F98-F126 HydrophobicContact CD2-CZ 4.29Å; F98-F126 HydrophobicContact CG-CE2 4.42Å; I101-F126 HydrophobicContact CD1-CB 4.14Å; I101-F126 HydrophobicContact CD1-CG 4.4Å; A122-F126 WeakPolarHBondContact O-CB 3.4Å; A122-F126 PolarHBondContact O-N 3.17Å; F123-F126 PolarHBondContact O-N 3.11Å; S124-F126 PolarHBondContact O-N 2.83Å; F126-A129 WeakPolarHBondContact O-CB 3.43Å; F126-A129 PolarHBondContact O-N 3.43Å; F126-L130 HydrophobicContact CD1-CD1 4.1Å; F126-L130 HydrophobicContact CE1-CD1 3.43Å; F126-L130 VanDerWaalsContact CE1-CD1 3.43Å; F126-L130 HydrophobicContact CE1-CG 4.43Å; F126-L130 HydrophobicContact CE2-CD1 4.03Å; F126-L130 HydrophobicContact CE2-CG 4.38Å; F126-L130 HydrophobicContact CZ-CD1 3.4Å; F126-L130 VanDerWaalsContact CZ-CD1 3.4Å; F126-L130 HydrophobicContact CZ-CG 4.22Å; F126-L130 PolarHBondContact O-N 3.26Å
127	F	98.6	Very high	97.8	Very high	58 Å²	58	23 Å²	23	25%	0.254	12%	0.12	S	C	.	.	H	α-helix	trans	-75.3	-26	177.9	-83.5	-77.2	0	0	0	113.3	F123 S124 A129 L130 L131 L162	F123-F127 AromaticContact CD1-CD2 3.98Å; F123-F127 HydrophobicContact CD1-CD2 3.98Å; F123-F127 HydrophobicContact CD1-CE2 4.28Å; F123-F127 HydrophobicContact CD2-CD2 4.39Å; F123-F127 HydrophobicContact CD2-CE2 4.08Å; F123-F127 AromaticContact CE1-CD2 3.69Å; F123-F127 HydrophobicContact CE1-CD2 3.69Å; F123-F127 AromaticContact CE1-CE2 3.71Å; F123-F127 HydrophobicContact CE1-CE2 3.71Å; F123-F127 HydrophobicContact CE2-CD2 4.14Å; F123-F127 AromaticContact CE2-CE2 3.49Å; F123-F127 HydrophobicContact CE2-CE2 3.49Å; F123-F127 VanDerWaalsContact CE2-CE2 3.49Å; F123-F127 HydrophobicContact CE2-CZ 4.49Å; F123-F127 HydrophobicContact CG-CD2 4.34Å; F123-F127 HydrophobicContact CG-CE2 4.46Å; F123-F127 AromaticContact CZ-CD2 3.78Å; F123-F127 HydrophobicContact CZ-CD2 3.78Å; F123-F127 AromaticContact CZ-CE2 3.27Å; F123-F127 HydrophobicContact CZ-CE2 3.27Å; F123-F127 HydrophobicContact CZ-CZ 4.2Å; F123-F127 WeakPolarHBondContact O-CD2 3.32Å; F123-F127 PolarHBondContact O-N 3.19Å; S124-F127 PolarHBondContact O-N 3.05Å; F127-A129 PolarHBondContact O-N 3.22Å; F127-L130 HydrophobicContact CD1-CD1 4.4Å; F127-L130 HydrophobicContact CE1-CD1 4.34Å; F127-L130 PolarHBondContact O-N 3.04Å; F127-L131 HydrophobicContact CB-CD1 4.45Å; F127-L131 HydrophobicContact CD1-CD1 3.73Å; F127-L131 HydrophobicContact CD1-CG 4.01Å; F127-L131 WeakPolarHBondContact O-CB 3.41Å; F127-L131 PolarHBondContact O-N 3.37Å; F127-L162 HydrophobicContact CB-CD1 3.91Å; F127-L162 HydrophobicContact CB-CD2 3.74Å; F127-L162 HydrophobicContact CB-CG 4.5Å
128	V	98.5	Very high	97.6	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-55.6	-47.3	166.3	171.2	0	0	0	0	109.1	S124 D125 L130 V132 L133 L162 Y439	S124-V128 WeakPolarHBondContact O-CG2 3.19Å; S124-V128 PolarHBondContact O-N 3.39Å; D125-V128 PolarHBondContact O-N 3.49Å; V128-L130 VanDerWaalsContact C-N 3.29Å; V128-L130 PolarHBondContact O-N 2.76Å; V128-V132 HydrophobicContact CG1-CB 4.25Å; V128-V132 WeakPolarHBondContact O-CA 3.43Å; V128-V132 VanDerWaalsContact O-CB 3.3Å; V128-V132 WeakPolarHBondContact O-CB 3.26Å; V128-V132 PolarHBondContact O-N 3.48Å; V128-L133 HydrophobicContact CG1-CD2 4.38Å; V128-L133 HydrophobicContact CG1-CG 4.26Å; V128-L133 PolarHBondContact O-N 2.91Å; V128-L162 HydrophobicContact CG2-CB 3.58Å; V128-L162 HydrophobicContact CG2-CD1 4.45Å; V128-Y439 HydrophobicContact CG1-CD1 4.12Å; V128-Y439 HydrophobicContact CG1-CE1 4.48Å
129	A	98.4	Very high	97.4	Very high	7 Å²	7	26.3 Å²	26.3	6%	0.058	14%	0.138	C	C	.	.	H	α-helix	trans	-65.8	-28.6	-179.9	0	0	0	0	0	114.4	T93 A94 D125 F126 F127 L133 P134	T93-A129 HydrophobicContact CG2-CB 3.91Å; A94-A129 HydrophobicContact CB-CB 3.75Å; D125-A129 PolarHBondContact O-N 3.11Å; F126-A129 WeakPolarHBondContact O-CB 3.43Å; F126-A129 PolarHBondContact O-N 3.43Å; F127-A129 PolarHBondContact O-N 3.22Å; A129-L133 HydrophobicContact CB-CD1 4.11Å; A129-P134 WeakPolarHBondContact O-CD 3.36Å
130	L	98.1	Very high	97.1	Very high	82 Å²	82	26.9 Å²	26.9	43%	0.429	14%	0.14	S	C	.	.	H	α-helix	trans	-90.3	-35.9	-179.5	-69.1	-176.6	0	0	0	114.3	F126 F127 V128 P134	F126-L130 HydrophobicContact CD1-CD1 4.1Å; F126-L130 HydrophobicContact CE1-CD1 3.43Å; F126-L130 VanDerWaalsContact CE1-CD1 3.43Å; F126-L130 HydrophobicContact CE1-CG 4.43Å; F126-L130 HydrophobicContact CE2-CD1 4.03Å; F126-L130 HydrophobicContact CE2-CG 4.38Å; F126-L130 HydrophobicContact CZ-CD1 3.4Å; F126-L130 VanDerWaalsContact CZ-CD1 3.4Å; F126-L130 HydrophobicContact CZ-CG 4.22Å; F126-L130 PolarHBondContact O-N 3.26Å; F127-L130 HydrophobicContact CD1-CD1 4.4Å; F127-L130 HydrophobicContact CE1-CD1 4.34Å; F127-L130 PolarHBondContact O-N 3.04Å; V128-L130 VanDerWaalsContact C-N 3.29Å; V128-L130 PolarHBondContact O-N 2.76Å; L130-P134 WeakPolarHBondContact O-CG 3.29Å
131	L	98	Very high	96.7	Very high	53 Å²	53	32.2 Å²	32.2	28%	0.277	16%	0.16	S	C	.	.	H	α-helix	trans	-110.5	-18.7	-169.1	-59.1	-178.6	0	0	0	113.7	F127 F135 F158 L162	F127-L131 HydrophobicContact CB-CD1 4.45Å; F127-L131 HydrophobicContact CD1-CD1 3.73Å; F127-L131 HydrophobicContact CD1-CG 4.01Å; F127-L131 WeakPolarHBondContact O-CB 3.41Å; F127-L131 PolarHBondContact O-N 3.37Å; L131-F135 VanDerWaalsContact O-CD2 3.23Å; L131-F135 WeakPolarHBondContact O-CD2 3.36Å; L131-F135 WeakPolarHBondContact O-CE2 3.45Å; L131-F158 HydrophobicContact CB-CB 4.49Å; L131-F158 HydrophobicContact CB-CG 4.43Å; L131-F158 HydrophobicContact CD1-CD1 3.98Å; L131-F158 HydrophobicContact CD1-CD2 4.42Å; L131-F158 HydrophobicContact CD1-CE1 4Å; L131-F158 HydrophobicContact CD1-CE2 4.42Å; L131-F158 HydrophobicContact CD1-CG 4.22Å; L131-F158 HydrophobicContact CD1-CZ 4.23Å; L131-L162 HydrophobicContact CB-CD1 4.47Å
132	V	98.4	Very high	96.3	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.4	-51.3	-174.4	-178.6	0	0	0	0	110.7	V128 F135 T136 Y155 F158 D159 L162 Y439	V128-V132 HydrophobicContact CG1-CB 4.25Å; V128-V132 WeakPolarHBondContact O-CA 3.43Å; V128-V132 VanDerWaalsContact O-CB 3.3Å; V128-V132 WeakPolarHBondContact O-CB 3.26Å; V128-V132 PolarHBondContact O-N 3.48Å; V132-F135 PolarHBondContact O-N 3.38Å; V132-T136 PolarHBondContact O-N 2.84Å; V132-T136 PolarHBondContact O-OG1 3.44Å; V132-Y155 HydrophobicContact CB-CE2 4.49Å; V132-Y155 HydrophobicContact CG1-CD2 4.31Å; V132-Y155 HydrophobicContact CG1-CE2 3.65Å; V132-Y155 WeakPolarHBondContact O-CE2 3.18Å; V132-F158 HydrophobicContact CG2-CB 4.22Å; V132-D159 HydrophobicContact CG1-CB 3.78Å; V132-D159 HydrophobicContact CG2-CB 4.11Å; V132-L162 HydrophobicContact CG2-CD1 4.05Å; V132-Y439 HydrophobicContact CG1-CE1 3.81Å; V132-Y439 WeakPolarHBondContact CG1-OH 3.32Å
133	L	97.7	Very high	95.8	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-61.1	-38.4	-175.8	-62.9	-172.7	0	0	0	114.6	A90 V128 A129 F135 T136 I137 W436 Y439	A90-L133 HydrophobicContact CB-CB 4Å; A90-L133 HydrophobicContact CB-CD1 3.71Å; V128-L133 HydrophobicContact CG1-CD2 4.38Å; V128-L133 HydrophobicContact CG1-CG 4.26Å; V128-L133 PolarHBondContact O-N 2.91Å; A129-L133 HydrophobicContact CB-CD1 4.11Å; L133-F135 VanDerWaalsContact C-N 3.32Å; L133-F135 PolarHBondContact O-N 3.28Å; L133-T136 PolarHBondContact O-N 3.49Å; L133-I137 HydrophobicContact CB-CD1 4.48Å; L133-I137 WeakPolarHBondContact O-CB 3.5Å; L133-I137 WeakPolarHBondContact O-CD1 3.04Å; L133-I137 WeakPolarHBondContact O-CG1 3.36Å; L133-I137 PolarHBondContact O-N 2.9Å; L133-W436 HydrophobicContact CD2-CH2 4.41Å; L133-W436 HydrophobicContact CD2-CZ3 4.28Å; L133-Y439 HydrophobicContact CD2-CD1 4.06Å; L133-Y439 HydrophobicContact CD2-CD2 3.65Å; L133-Y439 HydrophobicContact CD2-CE2 4.16Å; L133-Y439 HydrophobicContact CD2-CG 3.61Å
134	P	97.1	Very high	95.4	Very high	53 Å²	53	34 Å²	34	34%	0.344	17%	0.169	S	C	.	.	H	α-helix	trans	-59.6	-41.8	178.4	-26.5	37.1	0	0	0	112.9	A129 L130 I137 I138	A129-P134 WeakPolarHBondContact O-CD 3.36Å; L130-P134 WeakPolarHBondContact O-CG 3.29Å; P134-I137 PolarHBondContact O-N 2.87Å; P134-I138 WeakPolarHBondContact O-CD1 3.18Å; P134-I138 VanDerWaalsContact O-CG1 3.26Å; P134-I138 WeakPolarHBondContact O-CG1 3.49Å; P134-I138 PolarHBondContact O-N 3.2Å; P134-I138 VanDerWaalsContact O-N 3.11Å
135	F	97	Very high	95.2	Very high	36 Å²	36	34.1 Å²	34.1	16%	0.158	17%	0.17	C	C	.	.	H	α-helix	trans	-69.5	-42.2	177	-65.2	-81.8	0	0	0	111.6	L131 V132 L133 I137 I138 D139 W145 F147 L151 M154 Y155	L131-F135 VanDerWaalsContact O-CD2 3.23Å; L131-F135 WeakPolarHBondContact O-CD2 3.36Å; L131-F135 WeakPolarHBondContact O-CE2 3.45Å; V132-F135 PolarHBondContact O-N 3.38Å; L133-F135 VanDerWaalsContact C-N 3.32Å; L133-F135 PolarHBondContact O-N 3.28Å; F135-I137 VanDerWaalsContact C-N 3.29Å; F135-I137 PolarHBondContact O-N 3.35Å; F135-I138 PolarHBondContact O-N 2.98Å; F135-D139 WeakPolarHBondContact O-CB 3.3Å; F135-D139 PolarHBondContact O-N 2.74Å; F135-W145 HydrophobicContact CB-CH2 3.94Å; F135-W145 HydrophobicContact CB-CZ3 3.96Å; F135-W145 AromaticContact CD1-CH2 3.9Å; F135-W145 HydrophobicContact CD1-CH2 3.9Å; F135-W145 HydrophobicContact CG-CH2 4.22Å; F135-F147 HydrophobicContact CD1-CD2 4.03Å; F135-F147 AromaticContact CD1-CE2 3.69Å; F135-F147 HydrophobicContact CD1-CE2 3.69Å; F135-F147 AromaticContact CD1-CZ 3.99Å; F135-F147 HydrophobicContact CD1-CZ 3.99Å; F135-F147 HydrophobicContact CE1-CE1 4.5Å; F135-F147 HydrophobicContact CE1-CE2 4.34Å; F135-F147 HydrophobicContact CE1-CZ 4.29Å; F135-L151 HydrophobicContact CE1-CD2 4.29Å; F135-L151 HydrophobicContact CZ-CD2 4.38Å; F135-M154 HydrophobicContact CE2-CE 3.97Å; F135-M154 HydrophobicContact CZ-CE 3.71Å; F135-Y155 HydrophobicContact CB-CD2 3.61Å; F135-Y155 HydrophobicContact CB-CE2 4.02Å; F135-Y155 HydrophobicContact CB-CG 4.23Å; F135-Y155 HydrophobicContact CD2-CD2 4.37Å; F135-Y155 HydrophobicContact CG-CD2 4.23Å
136	T	95.7	Very high	95	Very high	3 Å²	3	36.5 Å²	36.5	2%	0.018	19%	0.186	C	C	.	.	H	α-helix	trans	-58.6	-42.4	175.4	-51.2	0	0	0	0	111.4	V132 L133 A140 Y155 W436 Y439	V132-T136 PolarHBondContact O-N 2.84Å; V132-T136 PolarHBondContact O-OG1 3.44Å; L133-T136 PolarHBondContact O-N 3.49Å; T136-A140 VanDerWaalsContact O-CB 3.27Å; T136-A140 WeakPolarHBondContact O-CB 3.4Å; T136-A140 PolarHBondContact O-N 3.27Å; T136-Y155 PolarHBondContact OG1-OH 3.4Å; T136-W436 HydrophobicContact CG2-CH2 4.41Å; T136-W436 HydrophobicContact CG2-CZ2 3.6Å; T136-Y439 HydrophobicContact CG2-CD2 4.23Å; T136-Y439 HydrophobicContact CG2-CE2 3.56Å
137	I	95.5	Very high	94.9	Very high	9 Å²	9	37.2 Å²	37.2	5%	0.046	19%	0.189	C	C	.	.	H	α-helix	trans	-66.4	-43.1	179.8	-70.3	166.1	0	0	0	110.9	F83 A90 L133 P134 F135 A140 Y141 W436	F83-I137 HydrophobicContact CD2-CG2 3.42Å; F83-I137 VanDerWaalsContact CD2-CG2 3.42Å; F83-I137 HydrophobicContact CE2-CG2 3.44Å; F83-I137 VanDerWaalsContact CE2-CG2 3.44Å; A90-I137 HydrophobicContact CB-CD1 3.84Å; L133-I137 HydrophobicContact CB-CD1 4.48Å; L133-I137 WeakPolarHBondContact O-CB 3.5Å; L133-I137 WeakPolarHBondContact O-CD1 3.04Å; L133-I137 WeakPolarHBondContact O-CG1 3.36Å; L133-I137 PolarHBondContact O-N 2.9Å; P134-I137 PolarHBondContact O-N 2.87Å; F135-I137 VanDerWaalsContact C-N 3.29Å; F135-I137 PolarHBondContact O-N 3.35Å; I137-A140 PolarHBondContact O-N 2.74Å; I137-Y141 VanDerWaalsContact O-CB 3.28Å; I137-Y141 WeakPolarHBondContact O-CB 3.1Å; I137-Y141 PolarHBondContact O-N 2.79Å; I137-W436 HydrophobicContact CD1-CH2 4.25Å; I137-W436 HydrophobicContact CG1-CH2 3.56Å; I137-W436 HydrophobicContact CG1-CZ2 3.82Å
138	I	94.2	Very high	94.7	Very high	59 Å²	59	39.2 Å²	39.2	30%	0.303	20%	0.202	S	C	.	.	H	α-helix	trans	-66.7	-45.2	179.8	-68.2	165.9	0	0	0	110.7	P134 F135 A140 Y141 Q142 P146 F147	P134-I138 WeakPolarHBondContact O-CD1 3.18Å; P134-I138 VanDerWaalsContact O-CG1 3.26Å; P134-I138 WeakPolarHBondContact O-CG1 3.49Å; P134-I138 PolarHBondContact O-N 3.2Å; P134-I138 VanDerWaalsContact O-N 3.11Å; F135-I138 PolarHBondContact O-N 2.98Å; I138-A140 PolarHBondContact O-N 3.47Å; I138-Y141 PolarHBondContact O-N 2.75Å; I138-Q142 HydrophobicContact CG2-CG 4.43Å; I138-Q142 WeakPolarHBondContact O-CB 3.27Å; I138-Q142 WeakPolarHBondContact O-CG 3.26Å; I138-Q142 PolarHBondContact O-N 3.4Å; I138-P146 HydrophobicContact CG2-CG 3.95Å; I138-F147 HydrophobicContact CB-CE2 4.31Å; I138-F147 HydrophobicContact CB-CZ 4.31Å; I138-F147 HydrophobicContact CD1-CZ 3.9Å; I138-F147 HydrophobicContact CG2-CE2 3.89Å; I138-F147 HydrophobicContact CG2-CZ 3.81Å
139	D	92.2	Very high	94.6	Very high	30 Å²	30	43.1 Å²	43.1	16%	0.16	22%	0.22	C	C	.	.	H	α-helix	trans	-58.2	-47.6	175.1	-180	70.3	0	0	0	111.5	F135 Y141 Q142 G143 Y144 W145 R432	F135-D139 WeakPolarHBondContact O-CB 3.3Å; F135-D139 PolarHBondContact O-N 2.74Å; D139-Y141 VanDerWaalsContact C-N 3.33Å; D139-Y141 PolarHBondContact O-N 2.88Å; D139-Q142 PolarHBondContact O-N 3.39Å; D139-G143 WeakPolarHBondContact O-CA 3.49Å; D139-G143 PolarHBondContact O-N 3.15Å; D139-Y144 PolarHBondContact O-N 3.12Å; D139-W145 HydrophobicContact CB-CE3 4.12Å; D139-W145 WeakPolarHBondContact OD1-CA 3.46Å; D139-W145 PolarHBondContact OD1-N 3.03Å; D139-W145 VanDerWaalsContact OD1-N 3.13Å; D139-R432 IonicContact OD2-NE 3.76Å
140	A	89.9	Confident	94.5	Very high	26 Å²	26	45 Å²	45	22%	0.215	24%	0.241	C	C	.	.	H	α-helix	trans	-64.6	-35.1	177.9	0	0	0	0	0	113.2	T136 I137 I138	T136-A140 VanDerWaalsContact O-CB 3.27Å; T136-A140 WeakPolarHBondContact O-CB 3.4Å; T136-A140 PolarHBondContact O-N 3.27Å; I137-A140 PolarHBondContact O-N 2.74Å; I138-A140 PolarHBondContact O-N 3.47Å
141	Y	90.7	Very high	94.5	Very high	124 Å²	124	43.8 Å²	43.8	49%	0.486	23%	0.234	S	C	.	.	H	α-helix	trans	-74.5	-40.1	179.4	175.7	-104.6	0	0	0	112.8	T79 F83 I137 I138 D139	T79-Y141 HydrophobicContact CG2-CD2 3.84Å; T79-Y141 HydrophobicContact CG2-CE2 4.28Å; T79-Y141 WeakPolarHBondContact CG2-O 3.38Å; F83-Y141 HydrophobicContact CB-CD2 3.77Å; F83-Y141 HydrophobicContact CB-CE2 4.43Å; F83-Y141 AromaticContact CD2-CD2 3.9Å; F83-Y141 HydrophobicContact CD2-CD2 3.9Å; F83-Y141 AromaticContact CD2-CG 3.9Å; F83-Y141 HydrophobicContact CD2-CG 3.9Å; F83-Y141 HydrophobicContact CE2-CG 4.45Å; F83-Y141 AromaticContact CG-CD2 3.9Å; F83-Y141 HydrophobicContact CG-CD2 3.9Å; F83-Y141 HydrophobicContact CG-CE2 4.47Å; F83-Y141 HydrophobicContact CG-CG 4.37Å; I137-Y141 VanDerWaalsContact O-CB 3.28Å; I137-Y141 WeakPolarHBondContact O-CB 3.1Å; I137-Y141 PolarHBondContact O-N 2.79Å; I138-Y141 PolarHBondContact O-N 2.75Å; D139-Y141 VanDerWaalsContact C-N 3.33Å; D139-Y141 PolarHBondContact O-N 2.88Å
142	Q	89.5	Confident	94.5	Very high	61 Å²	61	41.5 Å²	41.5	29%	0.285	22%	0.223	S	C	.	.	H	α-helix	trans	-80.4	-22.2	179	-67.5	-170.7	-9.2	0	0	112.8	S71 I138 D139 Y144 P146	S71-Q142 WeakPolarHBondContact CB-O 3.15Å; I138-Q142 HydrophobicContact CG2-CG 4.43Å; I138-Q142 WeakPolarHBondContact O-CB 3.27Å; I138-Q142 WeakPolarHBondContact O-CG 3.26Å; I138-Q142 PolarHBondContact O-N 3.4Å; D139-Q142 PolarHBondContact O-N 3.39Å; Q142-Y144 HydrophobicContact CB-CD1 4.17Å; Q142-Y144 HydrophobicContact CB-CE1 4.05Å; Q142-Y144 VanDerWaalsContact O-CD1 3.27Å; Q142-Y144 WeakPolarHBondContact O-CD1 3.34Å; Q142-Y144 PolarHBondContact O-N 2.92Å; Q142-P146 VanDerWaalsContact OE1-CD 3.28Å
143	G	88	Confident	94.4	Very high	10 Å²	10	43.3 Å²	43.3	10%	0.103	23%	0.232	C	C	.	.	S	Bend	trans	80	-2.1	-174.2	0	0	0	0	0	113.6	D139 R432	D139-G143 WeakPolarHBondContact O-CA 3.49Å; D139-G143 PolarHBondContact O-N 3.15Å; G143-R432 PolarHBondContact O-NH2 3Å
144	Y	90.6	Very high	94.3	Very high	62 Å²	62	46.5 Å²	46.5	24%	0.243	25%	0.248	C	C	.	.	S	Bend	trans	-149.2	164.4	177.8	66.7	-93.1	0	0	0	110.5	C69 D139 Q142 P146 C225	C69-Y144 HydrophobicContact CB-CD1 4Å; C69-Y144 HydrophobicContact CB-CD2 3.42Å; C69-Y144 VanDerWaalsContact CB-CD2 3.42Å; C69-Y144 HydrophobicContact CB-CE1 4.01Å; C69-Y144 HydrophobicContact CB-CE2 3.45Å; C69-Y144 VanDerWaalsContact CB-CE2 3.45Å; C69-Y144 HydrophobicContact CB-CG 3.72Å; D139-Y144 PolarHBondContact O-N 3.12Å; Q142-Y144 HydrophobicContact CB-CD1 4.17Å; Q142-Y144 HydrophobicContact CB-CE1 4.05Å; Q142-Y144 VanDerWaalsContact O-CD1 3.27Å; Q142-Y144 WeakPolarHBondContact O-CD1 3.34Å; Q142-Y144 PolarHBondContact O-N 2.92Å; Y144-P146 HydrophobicContact CE2-CB 4.02Å; Y144-P146 WeakPolarHBondContact O-CD 3.23Å; Y144-C225 HydrophobicContact CD2-CB 4.34Å
145	W	94.2	Very high	94.4	Very high	3 Å²	3	44.6 Å²	44.6	1%	0.011	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-84.8	108.4	177.8	-179.6	-99.6	0	0	0	111.2	F135 D139 F147 L151 C152 Y155 C225 C227	F135-W145 HydrophobicContact CB-CH2 3.94Å; F135-W145 HydrophobicContact CB-CZ3 3.96Å; F135-W145 AromaticContact CD1-CH2 3.9Å; F135-W145 HydrophobicContact CD1-CH2 3.9Å; F135-W145 HydrophobicContact CG-CH2 4.22Å; D139-W145 HydrophobicContact CB-CE3 4.12Å; D139-W145 WeakPolarHBondContact OD1-CA 3.46Å; D139-W145 PolarHBondContact OD1-N 3.03Å; D139-W145 VanDerWaalsContact OD1-N 3.13Å; W145-F147 VanDerWaalsContact C-N 3.32Å; W145-F147 HydrophobicContact CD2-CB 4.49Å; W145-F147 AromaticContact CD2-CD2 3.94Å; W145-F147 HydrophobicContact CD2-CD2 3.94Å; W145-F147 AromaticContact CE2-CD2 3.68Å; W145-F147 HydrophobicContact CE3-CD2 4.09Å; W145-F147 AromaticContact CH2-CD2 3.75Å; W145-F147 HydrophobicContact CH2-CD2 3.75Å; W145-F147 HydrophobicContact CH2-CE2 4.38Å; W145-F147 HydrophobicContact CZ2-CB 3.74Å; W145-F147 AromaticContact CZ2-CD2 3.57Å; W145-F147 HydrophobicContact CZ2-CD2 3.57Å; W145-F147 HydrophobicContact CZ2-CG 4.05Å; W145-F147 HydrophobicContact CZ3-CD2 4.01Å; W145-F147 HydrophobicContact CZ3-CE2 4.42Å; W145-F147 PolarHBondContact NE1-O 3.5Å; W145-F147 PolarHBondContact O-N 2.92Å; W145-L151 HydrophobicContact CZ2-CB 4.27Å; W145-C152 VanDerWaalsContact CZ2-CA 3.48Å; W145-C152 HydrophobicContact CZ2-CB 3.97Å; W145-Y155 AromaticContact CH2-CD1 3.87Å; W145-Y155 HydrophobicContact CH2-CD1 3.87Å; W145-Y155 HydrophobicContact CH2-CD2 4.5Å; W145-Y155 AromaticContact CH2-CG 3.77Å; W145-Y155 HydrophobicContact CH2-CG 3.77Å; W145-Y155 AromaticContact CZ3-CD1 3.94Å; W145-Y155 HydrophobicContact CZ3-CD1 3.94Å; W145-Y155 HydrophobicContact CZ3-CE1 4.32Å; W145-Y155 HydrophobicContact CZ3-CG 4.13Å; W145-C225 PolarHBondContact N-O 3.44Å; W145-C225 WeakPolarHBondContact O-CA 3.14Å; W145-C227 HydrophobicContact CB-CB 3.94Å; W145-C227 HydrophobicContact CD2-CB 3.31Å; W145-C227 HydrophobicContact CE3-CB 3.66Å; W145-C227 HydrophobicContact CG-CB 3.43Å; W145-C227 VanDerWaalsContact CG-CB 3.43Å; W145-C227 HydrophobicContact CZ2-CB 4.4Å; W145-C227 HydrophobicContact CZ3-CB 4.33Å
146	P	93.9	Very high	94.4	Very high	51 Å²	51	43.6 Å²	43.6	33%	0.331	23%	0.23	S	C	.	.			trans	-81.1	-11.6	-176.4	31.5	-36.1	0	0	0	114.5	I138 Q142 Y144	I138-P146 HydrophobicContact CG2-CG 3.95Å; Q142-P146 VanDerWaalsContact OE1-CD 3.28Å; Y144-P146 HydrophobicContact CE2-CB 4.02Å; Y144-P146 WeakPolarHBondContact O-CD 3.23Å
147	F	96.2	Very high	94.5	Very high	54 Å²	54	44.4 Å²	44.4	24%	0.237	24%	0.236	C	C	.	.	S	Bend	trans	-89.5	168.2	-170.4	-48.8	-78.3	0	0	0	111.4	F135 I138 W145 L151	F135-F147 HydrophobicContact CD1-CD2 4.03Å; F135-F147 AromaticContact CD1-CE2 3.69Å; F135-F147 HydrophobicContact CD1-CE2 3.69Å; F135-F147 AromaticContact CD1-CZ 3.99Å; F135-F147 HydrophobicContact CD1-CZ 3.99Å; F135-F147 HydrophobicContact CE1-CE1 4.5Å; F135-F147 HydrophobicContact CE1-CE2 4.34Å; F135-F147 HydrophobicContact CE1-CZ 4.29Å; I138-F147 HydrophobicContact CB-CE2 4.31Å; I138-F147 HydrophobicContact CB-CZ 4.31Å; I138-F147 HydrophobicContact CD1-CZ 3.9Å; I138-F147 HydrophobicContact CG2-CE2 3.89Å; I138-F147 HydrophobicContact CG2-CZ 3.81Å; W145-F147 VanDerWaalsContact C-N 3.32Å; W145-F147 HydrophobicContact CD2-CB 4.49Å; W145-F147 AromaticContact CD2-CD2 3.94Å; W145-F147 HydrophobicContact CD2-CD2 3.94Å; W145-F147 AromaticContact CE2-CD2 3.68Å; W145-F147 HydrophobicContact CE3-CD2 4.09Å; W145-F147 AromaticContact CH2-CD2 3.75Å; W145-F147 HydrophobicContact CH2-CD2 3.75Å; W145-F147 HydrophobicContact CH2-CE2 4.38Å; W145-F147 HydrophobicContact CZ2-CB 3.74Å; W145-F147 AromaticContact CZ2-CD2 3.57Å; W145-F147 HydrophobicContact CZ2-CD2 3.57Å; W145-F147 HydrophobicContact CZ2-CG 4.05Å; W145-F147 HydrophobicContact CZ3-CD2 4.01Å; W145-F147 HydrophobicContact CZ3-CE2 4.42Å; W145-F147 PolarHBondContact NE1-O 3.5Å; W145-F147 PolarHBondContact O-N 2.92Å; F147-L151 HydrophobicContact CB-CB 3.77Å; F147-L151 HydrophobicContact CB-CD1 3.77Å; F147-L151 HydrophobicContact CB-CG 4.42Å; F147-L151 HydrophobicContact CD1-CD1 3.72Å; F147-L151 HydrophobicContact CG-CB 4.45Å; F147-L151 HydrophobicContact CG-CD1 4.02Å
148	N	95.9	Very high	94.6	Very high	99 Å²	99	47.3 Å²	47.3	53%	0.529	25%	0.248	S	C	.	.			trans	-77	176.8	176.3	65.4	11.6	0	0	0	112	G150 L151 C152	N148-G150 PolarHBondContact O-N 2.98Å; N148-G150 PolarHBondContact OD1-N 3.48Å; N148-L151 PolarHBondContact O-N 3.31Å; N148-L151 WeakPolarHBondContact OD1-CB 3.37Å; N148-L151 PolarHBondContact OD1-N 3.39Å; N148-C152 PolarHBondContact O-N 3.28Å; N148-C152 VanDerWaalsContact O-N 3.16Å
149	E	96	Very high	94.8	Very high	83 Å²	83	44.8 Å²	44.8	39%	0.388	24%	0.236	S	C	.	.	H	α-helix	trans	-57	-46.1	177.5	-178.4	170	-163.5	0	0	112.6	L151 C152 D153 K219 F222	E149-L151 VanDerWaalsContact C-N 3.31Å; E149-L151 PolarHBondContact O-N 3.01Å; E149-C152 WeakPolarHBondContact O-CA 3.42Å; E149-C152 WeakPolarHBondContact O-CB 3.46Å; E149-C152 PolarHBondContact O-N 3Å; E149-D153 PolarHBondContact O-N 3.49Å; E149-K219 IonicContact OE1-NZ 2.64Å; E149-K219 PolarHBondContact OE1-NZ 2.86Å; E149-F222 HydrophobicContact CB-CB 4.02Å; E149-F222 HydrophobicContact CB-CD1 3.69Å; E149-F222 HydrophobicContact CB-CD2 3.97Å; E149-F222 HydrophobicContact CB-CE1 4.11Å; E149-F222 HydrophobicContact CB-CE2 4.37Å; E149-F222 HydrophobicContact CB-CG 3.6Å; E149-F222 HydrophobicContact CB-CZ 4.43Å; E149-F222 VanDerWaalsContact CD-CB 3.49Å; E149-F222 HydrophobicContact CG-CB 3.64Å; E149-F222 HydrophobicContact CG-CD1 4.3Å; E149-F222 HydrophobicContact CG-CD2 4.14Å; E149-F222 HydrophobicContact CG-CG 3.77Å
150	G	96.1	Very high	95.1	Very high	47 Å²	47	44.4 Å²	44.4	49%	0.485	23%	0.234	S	C	.	.	H	α-helix	trans	-60.8	-38.5	-177.4	0	0	0	0	0	113.4	N148 M154	N148-G150 PolarHBondContact O-N 2.98Å; N148-G150 PolarHBondContact OD1-N 3.48Å; G150-M154 WeakPolarHBondContact O-CB 3.42Å; G150-M154 PolarHBondContact O-N 3.47Å
151	L	97.1	Very high	95.5	Very high	56 Å²	56	44.8 Å²	44.8	29%	0.293	23%	0.233	S	C	.	.	H	α-helix	trans	-71.6	-32.3	173.9	-75.4	173.2	0	0	0	112.3	F135 W145 F147 N148 E149 M154 Y155	F135-L151 HydrophobicContact CE1-CD2 4.29Å; F135-L151 HydrophobicContact CZ-CD2 4.38Å; W145-L151 HydrophobicContact CZ2-CB 4.27Å; F147-L151 HydrophobicContact CB-CB 3.77Å; F147-L151 HydrophobicContact CB-CD1 3.77Å; F147-L151 HydrophobicContact CB-CG 4.42Å; F147-L151 HydrophobicContact CD1-CD1 3.72Å; F147-L151 HydrophobicContact CG-CB 4.45Å; F147-L151 HydrophobicContact CG-CD1 4.02Å; N148-L151 PolarHBondContact O-N 3.31Å; N148-L151 WeakPolarHBondContact OD1-CB 3.37Å; N148-L151 PolarHBondContact OD1-N 3.39Å; E149-L151 VanDerWaalsContact C-N 3.31Å; E149-L151 PolarHBondContact O-N 3.01Å; L151-M154 HydrophobicContact CD2-CE 3.63Å; L151-M154 HydrophobicContact CD2-SD 4.43Å; L151-Y155 WeakPolarHBondContact O-CB 2.99Å; L151-Y155 PolarHBondContact O-N 2.88Å
152	C	97.7	Very high	95.9	Very high	5 Å²	5	39.2 Å²	39.2	3%	0.034	21%	0.211	C	C	.	.	H	α-helix	trans	-65.1	-48	174.1	177.6	0	0	0	0	111.2	W145 N148 E149 M154 Y155 I156 F222 C227	W145-C152 VanDerWaalsContact CZ2-CA 3.48Å; W145-C152 HydrophobicContact CZ2-CB 3.97Å; N148-C152 PolarHBondContact O-N 3.28Å; N148-C152 VanDerWaalsContact O-N 3.16Å; E149-C152 WeakPolarHBondContact O-CA 3.42Å; E149-C152 WeakPolarHBondContact O-CB 3.46Å; E149-C152 PolarHBondContact O-N 3Å; C152-M154 VanDerWaalsContact C-N 3.33Å; C152-M154 PolarHBondContact O-N 3.36Å; C152-Y155 PolarHBondContact O-N 3.5Å; C152-I156 PolarHBondContact O-N 2.96Å; C152-F222 HydrophobicContact CB-CD2 4.29Å; C152-F222 HydrophobicContact CB-CE2 3.97Å; C152-C227 WeakPolarHBondContact CA-SG 3.49Å; C152-C227 HydrophobicContact CB-CB 3.89Å; C152-C227 WeakPolarHBondContact CB-SG 3.43Å; C152-C227 WeakPolarHBondContact SG-CA 3.49Å; C152-C227 WeakPolarHBondContact SG-CB 3.08Å; C152-C227 CovalentContact SG-SG 2.04Å; C152-C227 PolarHBondContact SG-SG 3.38Å
153	D	97	Very high	96.3	Very high	37 Å²	37	36.5 Å²	36.5	20%	0.198	20%	0.199	C	C	.	.	H	α-helix	trans	-61.2	-43.2	178.4	-70.3	-11.4	0	0	0	111.3	E149 S157 K219	E149-D153 PolarHBondContact O-N 3.49Å; D153-S157 WeakPolarHBondContact O-CB 3.49Å; D153-S157 PolarHBondContact O-N 2.88Å; D153-S157 PolarHBondContact O-OG 2.68Å; D153-K219 IonicContact OD1-NZ 3.16Å; D153-K219 PolarHBondContact OD1-NZ 3.13Å; D153-K219 IonicContact OD2-NZ 3.34Å; D153-K219 PolarHBondContact OD2-NZ 3.1Å
154	M	96.4	Very high	96.7	Very high	69 Å²	69	36.2 Å²	36.2	34%	0.34	20%	0.195	S	C	.	.	H	α-helix	trans	-61.1	-48.4	174.6	-176.3	-169.8	75.5	0	0	111.5	F135 G150 L151 C152 S157 F158	F135-M154 HydrophobicContact CE2-CE 3.97Å; F135-M154 HydrophobicContact CZ-CE 3.71Å; G150-M154 WeakPolarHBondContact O-CB 3.42Å; G150-M154 PolarHBondContact O-N 3.47Å; L151-M154 HydrophobicContact CD2-CE 3.63Å; L151-M154 HydrophobicContact CD2-SD 4.43Å; C152-M154 VanDerWaalsContact C-N 3.33Å; C152-M154 PolarHBondContact O-N 3.36Å; M154-S157 PolarHBondContact O-N 2.96Å; M154-F158 HydrophobicContact CG-CD2 3.59Å; M154-F158 HydrophobicContact CG-CE2 3.45Å; M154-F158 VanDerWaalsContact CG-CE2 3.45Å; M154-F158 VanDerWaalsContact O-CD2 3.26Å; M154-F158 WeakPolarHBondContact O-CD2 3.31Å; M154-F158 PolarHBondContact O-N 2.94Å; M154-F158 HydrophobicContact SD-CD2 4.47Å; M154-F158 HydrophobicContact SD-CE2 4.04Å
155	Y	98	Very high	97.1	Very high	12 Å²	12	33.3 Å²	33.3	5%	0.047	18%	0.184	C	C	.	.	H	α-helix	trans	-59.6	-53.3	179.8	161.4	-105.8	0	0	0	111.8	V132 F135 T136 W145 L151 C152 S157 F158 D159 Q435 Y439	V132-Y155 HydrophobicContact CB-CE2 4.49Å; V132-Y155 HydrophobicContact CG1-CD2 4.31Å; V132-Y155 HydrophobicContact CG1-CE2 3.65Å; V132-Y155 WeakPolarHBondContact O-CE2 3.18Å; F135-Y155 HydrophobicContact CB-CD2 3.61Å; F135-Y155 HydrophobicContact CB-CE2 4.02Å; F135-Y155 HydrophobicContact CB-CG 4.23Å; F135-Y155 HydrophobicContact CD2-CD2 4.37Å; F135-Y155 HydrophobicContact CG-CD2 4.23Å; T136-Y155 PolarHBondContact OG1-OH 3.4Å; W145-Y155 AromaticContact CH2-CD1 3.87Å; W145-Y155 HydrophobicContact CH2-CD1 3.87Å; W145-Y155 HydrophobicContact CH2-CD2 4.5Å; W145-Y155 AromaticContact CH2-CG 3.77Å; W145-Y155 HydrophobicContact CH2-CG 3.77Å; W145-Y155 AromaticContact CZ3-CD1 3.94Å; W145-Y155 HydrophobicContact CZ3-CD1 3.94Å; W145-Y155 HydrophobicContact CZ3-CE1 4.32Å; W145-Y155 HydrophobicContact CZ3-CG 4.13Å; L151-Y155 WeakPolarHBondContact O-CB 2.99Å; L151-Y155 PolarHBondContact O-N 2.88Å; C152-Y155 PolarHBondContact O-N 3.5Å; Y155-S157 VanDerWaalsContact C-N 3.3Å; Y155-S157 PolarHBondContact O-N 3.49Å; Y155-F158 PolarHBondContact O-N 3.41Å; Y155-D159 WeakPolarHBondContact O-CB 3.36Å; Y155-D159 PolarHBondContact O-N 3.23Å; Y155-Q435 PolarHBondContact OH-NE2 2.94Å; Y155-Q435 VanDerWaalsContact OH-NE2 3.12Å; Y155-Y439 PolarHBondContact OH-OH 3.47Å
156	I	97.5	Very high	97.3	Very high	15 Å²	15	33.2 Å²	33.2	8%	0.077	18%	0.183	C	C	.	.	H	α-helix	trans	-61.7	-41	179.5	-69.4	175.4	0	0	0	110.5	C152 D159 V160 E228 Y229	C152-I156 PolarHBondContact O-N 2.96Å; I156-D159 PolarHBondContact O-N 3.47Å; I156-V160 HydrophobicContact CG2-CG2 4.26Å; I156-V160 WeakPolarHBondContact O-CB 3.34Å; I156-V160 VanDerWaalsContact O-CG2 3.32Å; I156-V160 WeakPolarHBondContact O-CG2 3.35Å; I156-V160 PolarHBondContact O-N 3.4Å; I156-E228 WeakPolarHBondContact CD1-O 3.48Å; I156-Y229 HydrophobicContact CG2-CD1 3.92Å; I156-Y229 HydrophobicContact CG2-CE1 4.27Å
157	S	97.8	Very high	97.4	Very high	21 Å²	21	30.8 Å²	30.8	15%	0.147	17%	0.168	C	C	.	.	H	α-helix	trans	-62.8	-47.7	177.9	-61	0	0	0	0	111.4	D153 M154 Y155 D159 L161 S211 N215	D153-S157 WeakPolarHBondContact O-CB 3.49Å; D153-S157 PolarHBondContact O-N 2.88Å; D153-S157 PolarHBondContact O-OG 2.68Å; M154-S157 PolarHBondContact O-N 2.96Å; Y155-S157 VanDerWaalsContact C-N 3.3Å; Y155-S157 PolarHBondContact O-N 3.49Å; S157-D159 VanDerWaalsContact C-N 3.35Å; S157-D159 PolarHBondContact O-N 2.88Å; S157-L161 WeakPolarHBondContact O-CB 3.44Å; S157-L161 PolarHBondContact O-N 3.07Å; S157-S211 WeakPolarHBondContact CA-OG 3.41Å; S157-S211 PolarHBondContact O-OG 3.31Å; S157-N215 PolarHBondContact OG-ND2 3.32Å
158	F	98.4	Very high	97.5	Very high	69 Å²	69	29.7 Å²	29.7	30%	0.303	16%	0.164	S	C	.	.	H	α-helix	trans	-65.4	-39.2	177.5	-81.2	-55.6	0	0	0	112.7	L131 V132 M154 Y155 L161 L162	L131-F158 HydrophobicContact CB-CB 4.49Å; L131-F158 HydrophobicContact CB-CG 4.43Å; L131-F158 HydrophobicContact CD1-CD1 3.98Å; L131-F158 HydrophobicContact CD1-CD2 4.42Å; L131-F158 HydrophobicContact CD1-CE1 4Å; L131-F158 HydrophobicContact CD1-CE2 4.42Å; L131-F158 HydrophobicContact CD1-CG 4.22Å; L131-F158 HydrophobicContact CD1-CZ 4.23Å; V132-F158 HydrophobicContact CG2-CB 4.22Å; M154-F158 HydrophobicContact CG-CD2 3.59Å; M154-F158 HydrophobicContact CG-CE2 3.45Å; M154-F158 VanDerWaalsContact CG-CE2 3.45Å; M154-F158 VanDerWaalsContact O-CD2 3.26Å; M154-F158 WeakPolarHBondContact O-CD2 3.31Å; M154-F158 PolarHBondContact O-N 2.94Å; M154-F158 HydrophobicContact SD-CD2 4.47Å; M154-F158 HydrophobicContact SD-CE2 4.04Å; Y155-F158 PolarHBondContact O-N 3.41Å; F158-L161 HydrophobicContact CD1-CD2 4.32Å; F158-L162 HydrophobicContact CB-CD1 4.18Å; F158-L162 HydrophobicContact CD1-CD1 4.42Å; F158-L162 WeakPolarHBondContact O-CB 3.45Å; F158-L162 WeakPolarHBondContact O-CD1 3.22Å; F158-L162 WeakPolarHBondContact O-CG 3.31Å; F158-L162 PolarHBondContact O-N 3.37Å
159	D	98.2	Very high	97.5	Very high	7 Å²	7	25 Å²	25	4%	0.037	14%	0.139	C	C	.	.	H	α-helix	trans	-59.9	-56.7	176.6	178.4	30	0	0	0	111.3	V132 Y155 I156 S157 L161 L162 C163 Y229 Y439	V132-D159 HydrophobicContact CG1-CB 3.78Å; V132-D159 HydrophobicContact CG2-CB 4.11Å; Y155-D159 WeakPolarHBondContact O-CB 3.36Å; Y155-D159 PolarHBondContact O-N 3.23Å; I156-D159 PolarHBondContact O-N 3.47Å; S157-D159 VanDerWaalsContact C-N 3.35Å; S157-D159 PolarHBondContact O-N 2.88Å; D159-L161 VanDerWaalsContact C-N 3.32Å; D159-L161 PolarHBondContact O-N 3.46Å; D159-L162 PolarHBondContact O-N 3.24Å; D159-C163 WeakPolarHBondContact O-CB 3.48Å; D159-C163 PolarHBondContact O-N 2.92Å; D159-C163 PolarHBondContact O-SG 3.39Å; D159-C163 VanDerWaalsContact O-SG 3.41Å; D159-C163 PolarHBondContact OD1-SG 3.26Å; D159-Y229 WeakPolarHBondContact OD2-CE1 3.47Å; D159-Y229 VanDerWaalsContact OD2-CZ 3.28Å; D159-Y229 PolarHBondContact OD2-OH 3.26Å; D159-Y439 WeakPolarHBondContact OD1-CE1 3.31Å
160	V	98	Very high	97.5	Very high	21 Å²	21	21.3 Å²	21.3	13%	0.127	12%	0.122	C	C	.	.	H	α-helix	trans	-60	-44	179.4	177.8	0	0	0	0	110.6	I156 T164 I210 Y229	I156-V160 HydrophobicContact CG2-CG2 4.26Å; I156-V160 WeakPolarHBondContact O-CB 3.34Å; I156-V160 VanDerWaalsContact O-CG2 3.32Å; I156-V160 WeakPolarHBondContact O-CG2 3.35Å; I156-V160 PolarHBondContact O-N 3.4Å; V160-T164 WeakPolarHBondContact O-CB 3.28Å; V160-T164 PolarHBondContact O-N 2.82Å; V160-T164 PolarHBondContact O-OG1 2.79Å; V160-I210 HydrophobicContact CG1-CG2 4.09Å; V160-Y229 HydrophobicContact CG2-CD1 4.39Å; V160-Y229 HydrophobicContact CG2-CE1 4.28Å
161	L	98.6	Very high	97.5	Very high	35 Å²	35	19.7 Å²	19.7	18%	0.183	10%	0.103	C	C	.	.	H	α-helix	trans	-59.1	-54	178.6	174.1	66	0	0	0	112.3	S157 F158 D159 A165 S207 A208	S157-L161 WeakPolarHBondContact O-CB 3.44Å; S157-L161 PolarHBondContact O-N 3.07Å; F158-L161 HydrophobicContact CD1-CD2 4.32Å; D159-L161 VanDerWaalsContact C-N 3.32Å; D159-L161 PolarHBondContact O-N 3.46Å; L161-A165 VanDerWaalsContact O-CB 3.23Å; L161-A165 WeakPolarHBondContact O-CB 3.3Å; L161-A165 PolarHBondContact O-N 2.75Å; L161-S207 WeakPolarHBondContact O-CB 3.48Å; L161-A208 HydrophobicContact CD1-CB 4.04Å
162	L	98.6	Very high	97.6	Very high	6 Å²	6	17.4 Å²	17.4	3%	0.031	9%	0.093	C	C	.	.	H	α-helix	trans	-75.2	-41.1	-170.8	-66.8	165.3	0	0	0	111.5	F127 V128 L131 V132 F158 D159 A165 S166 W204	F127-L162 HydrophobicContact CB-CD1 3.91Å; F127-L162 HydrophobicContact CB-CD2 3.74Å; F127-L162 HydrophobicContact CB-CG 4.5Å; V128-L162 HydrophobicContact CG2-CB 3.58Å; V128-L162 HydrophobicContact CG2-CD1 4.45Å; L131-L162 HydrophobicContact CB-CD1 4.47Å; V132-L162 HydrophobicContact CG2-CD1 4.05Å; F158-L162 HydrophobicContact CB-CD1 4.18Å; F158-L162 HydrophobicContact CD1-CD1 4.42Å; F158-L162 WeakPolarHBondContact O-CB 3.45Å; F158-L162 WeakPolarHBondContact O-CD1 3.22Å; F158-L162 WeakPolarHBondContact O-CG 3.31Å; F158-L162 PolarHBondContact O-N 3.37Å; D159-L162 PolarHBondContact O-N 3.24Å; L162-A165 PolarHBondContact O-N 2.84Å; L162-S166 WeakPolarHBondContact O-CB 3.23Å; L162-S166 PolarHBondContact O-N 3.45Å; L162-W204 HydrophobicContact CD2-CH2 4.05Å; L162-W204 HydrophobicContact CD2-CZ3 4.18Å
163	C	97.5	Very high	97.4	Very high	5 Å²	5	17.8 Å²	17.8	3%	0.034	9%	0.094	C	C	.	.	H	α-helix	trans	-64.6	-44.6	174.4	-68.1	0	0	0	0	110.5	D159 A165 S166 I167 W402	D159-C163 WeakPolarHBondContact O-CB 3.48Å; D159-C163 PolarHBondContact O-N 2.92Å; D159-C163 PolarHBondContact O-SG 3.39Å; D159-C163 VanDerWaalsContact O-SG 3.41Å; D159-C163 PolarHBondContact OD1-SG 3.26Å; C163-A165 PolarHBondContact O-N 3.13Å; C163-S166 WeakPolarHBondContact O-CB 3.31Å; C163-S166 PolarHBondContact O-N 3.03Å; C163-I167 VanDerWaalsContact O-CG1 3.31Å; C163-I167 WeakPolarHBondContact O-CG1 3.32Å; C163-I167 PolarHBondContact O-N 3.49Å; C163-W402 HydrophobicContact CB-CH2 3.71Å; C163-W402 HydrophobicContact CB-CZ2 3.86Å; C163-W402 VanDerWaalsContact SG-CH2 3.54Å
164	T	97.8	Very high	97.3	Very high	4 Å²	4	16.1 Å²	16.1	3%	0.025	9%	0.085	C	C	.	.	H	α-helix	trans	-63.1	-41.3	175.2	-56.6	0	0	0	0	111.6	V160 S166 I167 L168 S207 I210 A243	V160-T164 WeakPolarHBondContact O-CB 3.28Å; V160-T164 PolarHBondContact O-N 2.82Å; V160-T164 PolarHBondContact O-OG1 2.79Å; T164-S166 VanDerWaalsContact C-N 3.29Å; T164-S166 PolarHBondContact O-N 3.16Å; T164-I167 PolarHBondContact O-N 2.77Å; T164-L168 HydrophobicContact CG2-CD1 3.94Å; T164-L168 HydrophobicContact CG2-CG 4.14Å; T164-L168 WeakPolarHBondContact O-CB 3.41Å; T164-L168 WeakPolarHBondContact O-CG 3Å; T164-L168 PolarHBondContact O-N 2.78Å; T164-S207 WeakPolarHBondContact CG2-OG 3.22Å; T164-I210 HydrophobicContact CG2-CD1 3.74Å; T164-A243 HydrophobicContact CG2-CB 3.75Å
165	A	98.6	Very high	97.2	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-61.9	-38.9	176.5	0	0	0	0	0	111.6	L161 L162 C163 N169 W204 S207	L161-A165 VanDerWaalsContact O-CB 3.23Å; L161-A165 WeakPolarHBondContact O-CB 3.3Å; L161-A165 PolarHBondContact O-N 2.75Å; L162-A165 PolarHBondContact O-N 2.84Å; C163-A165 PolarHBondContact O-N 3.13Å; A165-N169 VanDerWaalsContact O-CB 3.26Å; A165-N169 WeakPolarHBondContact O-CB 3.4Å; A165-N169 PolarHBondContact O-N 3.37Å; A165-N169 PolarHBondContact O-ND2 3.1Å; A165-W204 HydrophobicContact CB-CD2 4.22Å; A165-W204 HydrophobicContact CB-CE3 4.25Å; A165-W204 HydrophobicContact CB-CH2 4.4Å; A165-W204 HydrophobicContact CB-CZ2 4.36Å; A165-W204 HydrophobicContact CB-CZ3 4.35Å; A165-S207 WeakPolarHBondContact CA-OG 3.23Å; A165-S207 PolarHBondContact N-OG 2.89Å
166	S	97.3	Very high	97.1	Very high	1 Å²	1	15.2 Å²	15.2	1%	0.007	8%	0.082	C	C	.	.	H	α-helix	trans	-59.8	-48.8	173.7	-172.1	0	0	0	0	111	L121 S124 D125 L162 C163 T164 N169 L170	L121-S166 WeakPolarHBondContact CD1-O 3.48Å; L121-S166 WeakPolarHBondContact CD1-OG 3.14Å; S124-S166 WeakPolarHBondContact OG-CA 3.43Å; D125-S166 WeakPolarHBondContact OD1-CB 3.31Å; D125-S166 PolarHBondContact OD1-OG 3.44Å; L162-S166 WeakPolarHBondContact O-CB 3.23Å; L162-S166 PolarHBondContact O-N 3.45Å; C163-S166 WeakPolarHBondContact O-CB 3.31Å; C163-S166 PolarHBondContact O-N 3.03Å; T164-S166 VanDerWaalsContact C-N 3.29Å; T164-S166 PolarHBondContact O-N 3.16Å; S166-N169 PolarHBondContact O-N 3.44Å; S166-L170 WeakPolarHBondContact O-CG 3.43Å; S166-L170 PolarHBondContact O-N 3.46Å
167	I	96.1	Very high	96.8	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-64.1	-45.6	179.5	-59.5	173.5	0	0	0	112.1	C163 T164 N169 L170 C171 A243 F244 P247 F398 W402 F406	C163-I167 VanDerWaalsContact O-CG1 3.31Å; C163-I167 WeakPolarHBondContact O-CG1 3.32Å; C163-I167 PolarHBondContact O-N 3.49Å; T164-I167 PolarHBondContact O-N 2.77Å; I167-N169 VanDerWaalsContact C-N 3.34Å; I167-N169 PolarHBondContact O-N 3.36Å; I167-L170 WeakPolarHBondContact O-CB 3.32Å; I167-L170 PolarHBondContact O-N 3.44Å; I167-C171 PolarHBondContact O-N 3.38Å; I167-A243 VanDerWaalsContact CG2-O 3.29Å; I167-A243 WeakPolarHBondContact CG2-O 3.29Å; I167-F244 HydrophobicContact CD1-CD2 4.43Å; I167-P247 HydrophobicContact CG2-CB 3.78Å; I167-P247 HydrophobicContact CG2-CG 4.27Å; I167-F398 HydrophobicContact CB-CE2 4.15Å; I167-F398 HydrophobicContact CD1-CE2 3.8Å; I167-F398 HydrophobicContact CG1-CD2 4.16Å; I167-F398 HydrophobicContact CG1-CE2 3.53Å; I167-F398 HydrophobicContact CG1-CZ 4.43Å; I167-F398 HydrophobicContact CG2-CE2 3.66Å; I167-F398 HydrophobicContact CG2-CZ 3.74Å; I167-W402 HydrophobicContact CD1-CD2 4.49Å; I167-W402 HydrophobicContact CD1-CG 4.49Å; I167-F406 HydrophobicContact CD1-CE2 4.02Å; I167-F406 HydrophobicContact CD1-CZ 4.2Å
168	L	98	Very high	96.6	Very high	32 Å²	32	18 Å²	18	17%	0.168	9%	0.088	C	C	.	.	H	α-helix	trans	-68.1	-33.5	179	-67.3	-177.1	0	0	0	112	T164 C171 A172 A203 P247	T164-L168 HydrophobicContact CG2-CD1 3.94Å; T164-L168 HydrophobicContact CG2-CG 4.14Å; T164-L168 WeakPolarHBondContact O-CB 3.41Å; T164-L168 WeakPolarHBondContact O-CG 3Å; T164-L168 PolarHBondContact O-N 2.78Å; L168-C171 WeakPolarHBondContact O-CB 3.08Å; L168-C171 PolarHBondContact O-N 2.97Å; L168-A172 WeakPolarHBondContact O-CB 3.47Å; L168-A172 PolarHBondContact O-N 3.24Å; L168-A203 HydrophobicContact CB-CB 3.67Å; L168-A203 WeakPolarHBondContact CD1-O 3.45Å; L168-P247 HydrophobicContact CD2-CB 4.28Å; L168-P247 HydrophobicContact CD2-CG 3.48Å; L168-P247 VanDerWaalsContact CD2-CG 3.48Å
169	N	97.8	Very high	96.4	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-66.6	-37.6	171.2	-80.6	-57.7	0	0	0	112.1	S120 L121 A165 S166 I167 C171 A172 I173	S120-N169 PolarHBondContact OG-ND2 3.03Å; S120-N169 PolarHBondContact OG-OD1 3.07Å; L121-N169 HydrophobicContact CB-CB 4.09Å; L121-N169 HydrophobicContact CD1-CB 4.3Å; A165-N169 VanDerWaalsContact O-CB 3.26Å; A165-N169 WeakPolarHBondContact O-CB 3.4Å; A165-N169 PolarHBondContact O-N 3.37Å; A165-N169 PolarHBondContact O-ND2 3.1Å; S166-N169 PolarHBondContact O-N 3.44Å; I167-N169 VanDerWaalsContact C-N 3.34Å; I167-N169 PolarHBondContact O-N 3.36Å; N169-C171 VanDerWaalsContact C-N 3.33Å; N169-C171 PolarHBondContact O-N 3.18Å; N169-A172 WeakPolarHBondContact O-CB 3.28Å; N169-A172 PolarHBondContact O-N 2.71Å; N169-I173 VanDerWaalsContact O-CG1 3.27Å; N169-I173 WeakPolarHBondContact O-CG1 3.28Å; N169-I173 PolarHBondContact O-N 3.24Å
170	L	95.4	Very high	96.1	Very high	6 Å²	6	17.9 Å²	17.9	3%	0.031	9%	0.092	C	C	.	.	H	α-helix	trans	-62	-40.1	171.4	-75.5	172.2	0	0	0	112.3	L121 S166 I167 I173 S174 M251 I394 F398	L121-L170 HydrophobicContact CD1-CD2 4.42Å; L121-L170 HydrophobicContact CD1-CG 4Å; L121-L170 HydrophobicContact CD2-CD2 3.54Å; L121-L170 HydrophobicContact CD2-CG 4.04Å; S166-L170 WeakPolarHBondContact O-CG 3.43Å; S166-L170 PolarHBondContact O-N 3.46Å; I167-L170 WeakPolarHBondContact O-CB 3.32Å; I167-L170 PolarHBondContact O-N 3.44Å; L170-I173 PolarHBondContact O-N 2.76Å; L170-S174 PolarHBondContact O-N 3.06Å; L170-S174 PolarHBondContact O-OG 2.72Å; L170-M251 HydrophobicContact CB-SD 3.97Å; L170-I394 HydrophobicContact CD2-CG2 3.36Å; L170-F398 HydrophobicContact CD1-CB 3.95Å; L170-F398 HydrophobicContact CD1-CD2 4.06Å; L170-F398 HydrophobicContact CD1-CG 4.09Å
171	C	96.7	Very high	95.5	Very high	13 Å²	13	18.9 Å²	18.9	9%	0.088	10%	0.096	C	C	.	.	H	α-helix	trans	-63.3	-45.6	173.4	-173.5	0	0	0	0	111.4	I167 L168 N169 I173 S174 I175 P247 V250 M251	I167-C171 PolarHBondContact O-N 3.38Å; L168-C171 WeakPolarHBondContact O-CB 3.08Å; L168-C171 PolarHBondContact O-N 2.97Å; N169-C171 VanDerWaalsContact C-N 3.33Å; N169-C171 PolarHBondContact O-N 3.18Å; C171-I173 PolarHBondContact O-N 2.91Å; C171-S174 WeakPolarHBondContact O-CA 3.34Å; C171-S174 VanDerWaalsContact O-CB 3.31Å; C171-S174 WeakPolarHBondContact O-CB 3.31Å; C171-S174 PolarHBondContact O-N 2.6Å; C171-S174 VanDerWaalsContact O-N 3.07Å; C171-I175 WeakPolarHBondContact O-CG1 3.35Å; C171-I175 PolarHBondContact O-N 3.11Å; C171-P247 HydrophobicContact CB-CB 4.27Å; C171-V250 VanDerWaalsContact SG-CG1 3.6Å; C171-M251 HydrophobicContact CB-CG 4.15Å; C171-M251 HydrophobicContact CB-SD 4.35Å
172	A	97.3	Very high	95.1	Very high	8 Å²	8	19.2 Å²	19.2	7%	0.066	10%	0.1	C	C	.	.	H	α-helix	trans	-59.2	-43.9	175.6	0	0	0	0	0	112.3	L117 L168 N169 S174 I175 D176 M199	L117-A172 HydrophobicContact CD2-CB 4.48Å; L168-A172 WeakPolarHBondContact O-CB 3.47Å; L168-A172 PolarHBondContact O-N 3.24Å; N169-A172 WeakPolarHBondContact O-CB 3.28Å; N169-A172 PolarHBondContact O-N 2.71Å; A172-S174 VanDerWaalsContact C-N 3.32Å; A172-S174 PolarHBondContact O-N 3.48Å; A172-I175 PolarHBondContact O-N 2.85Å; A172-D176 PolarHBondContact O-N 3.3Å; A172-M199 HydrophobicContact CB-CB 4.44Å; A172-M199 HydrophobicContact CB-CE 3.77Å; A172-M199 WeakPolarHBondContact O-CE 3.45Å
173	I	94.6	Very high	94.7	Very high	13 Å²	13	24.2 Å²	24.2	7%	0.067	12%	0.121	C	C	.	.	H	α-helix	trans	-57.8	-47.2	172.5	-69.8	163.9	0	0	0	109.6	L117 I118 L121 N169 L170 C171 I175 D176 R177 L391	L117-I173 HydrophobicContact CB-CD1 4.39Å; L117-I173 HydrophobicContact CB-CG1 3.63Å; L117-I173 HydrophobicContact CD1-CG1 4.26Å; I118-I173 HydrophobicContact CG1-CD1 4.13Å; L121-I173 HydrophobicContact CB-CD1 4.42Å; L121-I173 HydrophobicContact CD2-CD1 3.84Å; N169-I173 VanDerWaalsContact O-CG1 3.27Å; N169-I173 WeakPolarHBondContact O-CG1 3.28Å; N169-I173 PolarHBondContact O-N 3.24Å; L170-I173 PolarHBondContact O-N 2.76Å; C171-I173 PolarHBondContact O-N 2.91Å; I173-I175 VanDerWaalsContact C-N 3.33Å; I173-I175 PolarHBondContact O-N 3.02Å; I173-D176 PolarHBondContact O-N 2.91Å; I173-R177 HydrophobicContact CG2-CG 4.07Å; I173-R177 WeakPolarHBondContact O-CB 3.31Å; I173-R177 WeakPolarHBondContact O-CG 3.21Å; I173-R177 PolarHBondContact O-N 3.09Å; I173-L391 HydrophobicContact CG2-CD2 4.04Å
174	S	94.3	Very high	94.2	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.014	14%	0.139	C	C	.	.	H	α-helix	trans	-59	-41.9	179.6	-56.9	0	0	0	0	112.7	L170 C171 A172 Y178 M395	L170-S174 PolarHBondContact O-N 3.06Å; L170-S174 PolarHBondContact O-OG 2.72Å; C171-S174 WeakPolarHBondContact O-CA 3.34Å; C171-S174 VanDerWaalsContact O-CB 3.31Å; C171-S174 WeakPolarHBondContact O-CB 3.31Å; C171-S174 PolarHBondContact O-N 2.6Å; C171-S174 VanDerWaalsContact O-N 3.07Å; A172-S174 VanDerWaalsContact C-N 3.32Å; A172-S174 PolarHBondContact O-N 3.48Å; S174-Y178 WeakPolarHBondContact O-CB 3.1Å; S174-Y178 PolarHBondContact O-N 3.33Å; S174-M395 WeakPolarHBondContact OG-CE 3.45Å
175	I	95.5	Very high	93.7	Very high	61 Å²	61	34 Å²	34	31%	0.313	18%	0.175	S	C	.	.	H	α-helix	trans	-63.2	-51.6	175.3	-67.7	165.2	0	0	0	110.9	C171 A172 I173 R177 Y178 L179 M199 L254	C171-I175 WeakPolarHBondContact O-CG1 3.35Å; C171-I175 PolarHBondContact O-N 3.11Å; A172-I175 PolarHBondContact O-N 2.85Å; I173-I175 VanDerWaalsContact C-N 3.33Å; I173-I175 PolarHBondContact O-N 3.02Å; I175-R177 VanDerWaalsContact C-N 3.31Å; I175-R177 PolarHBondContact O-N 3.09Å; I175-Y178 PolarHBondContact O-N 3.13Å; I175-L179 HydrophobicContact CG2-CD1 3.84Å; I175-L179 HydrophobicContact CG2-CG 4.42Å; I175-L179 WeakPolarHBondContact O-CG 3.3Å; I175-L179 PolarHBondContact O-N 3.38Å; I175-M199 HydrophobicContact CB-CE 4.26Å; I175-M199 HydrophobicContact CG2-CE 4.26Å; I175-L254 HydrophobicContact CB-CD1 4.33Å; I175-L254 HydrophobicContact CG1-CD1 3.51Å
176	D	94.9	Very high	93.3	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-57.5	-45.2	178.3	168.1	79.8	0	0	0	111	S114 L117 A172 I173 Y178 L179 V180 Y187 R191 M199	S114-D176 VanDerWaalsContact CB-OD2 3.32Å; S114-D176 WeakPolarHBondContact CB-OD2 3.3Å; S114-D176 PolarHBondContact OG-OD1 3.47Å; S114-D176 PolarHBondContact OG-OD2 3.34Å; L117-D176 HydrophobicContact CD1-CB 3.84Å; A172-D176 PolarHBondContact O-N 3.3Å; I173-D176 PolarHBondContact O-N 2.91Å; D176-Y178 PolarHBondContact O-N 3.41Å; D176-L179 PolarHBondContact O-N 3.43Å; D176-V180 WeakPolarHBondContact O-CB 3.27Å; D176-V180 VanDerWaalsContact O-CG2 3.26Å; D176-V180 WeakPolarHBondContact O-CG2 3.27Å; D176-V180 PolarHBondContact O-N 3.49Å; D176-Y187 PolarHBondContact OD1-OH 2.83Å; D176-R191 VanDerWaalsContact OD1-CD 3.3Å; D176-R191 WeakPolarHBondContact OD1-CD 3.05Å; D176-M199 HydrophobicContact CB-CE 4.42Å
177	R	92.1	Very high	93.1	Very high	48 Å²	48	39.6 Å²	39.6	18%	0.181	21%	0.207	C	C	.	.	H	α-helix	trans	-61.6	-45.4	178	-65.5	-64	83.5	179.9	-4.2	112.4	S114 I173 I175 L179 V180 I181 R191 I258 L391	S114-R177 PolarHBondContact OG-NH2 3.38Å; I173-R177 HydrophobicContact CG2-CG 4.07Å; I173-R177 WeakPolarHBondContact O-CB 3.31Å; I173-R177 WeakPolarHBondContact O-CG 3.21Å; I173-R177 PolarHBondContact O-N 3.09Å; I175-R177 VanDerWaalsContact C-N 3.31Å; I175-R177 PolarHBondContact O-N 3.09Å; R177-L179 VanDerWaalsContact C-N 3.35Å; R177-L179 PolarHBondContact O-N 3.04Å; R177-V180 PolarHBondContact O-N 3.33Å; R177-I181 WeakPolarHBondContact O-CG1 3.44Å; R177-I181 PolarHBondContact O-N 2.93Å; R177-I181 VanDerWaalsContact O-N 3.11Å; R177-R191 VanDerWaalsContact NH2-NH1 3.15Å; R177-I258 HydrophobicContact CB-CD1 4.35Å; R177-L391 HydrophobicContact CB-CD1 3.81Å; R177-L391 HydrophobicContact CG-CD1 3.49Å; R177-L391 VanDerWaalsContact CG-CD1 3.49Å; R177-L391 HydrophobicContact CG-CD2 3.84Å; R177-L391 HydrophobicContact CG-CG 4.31Å
178	Y	93	Very high	92.7	Very high	45 Å²	45	41.2 Å²	41.2	18%	0.176	22%	0.22	C	C	.	.	H	α-helix	trans	-59.5	-46.1	176.3	174.2	-102.1	0	0	0	111.5	S174 I175 D176 I181 T182 L254 R257 I258	S174-Y178 WeakPolarHBondContact O-CB 3.1Å; S174-Y178 PolarHBondContact O-N 3.33Å; I175-Y178 PolarHBondContact O-N 3.13Å; D176-Y178 PolarHBondContact O-N 3.41Å; Y178-I181 PolarHBondContact O-N 3.26Å; Y178-T182 HydrophobicContact CD1-CG2 4.42Å; Y178-T182 HydrophobicContact CD2-CG2 3.8Å; Y178-T182 HydrophobicContact CE1-CG2 4.12Å; Y178-T182 HydrophobicContact CE2-CG2 3.45Å; Y178-T182 VanDerWaalsContact CE2-CG2 3.45Å; Y178-T182 HydrophobicContact CG-CG2 4.28Å; Y178-T182 WeakPolarHBondContact O-CB 3.44Å; Y178-T182 WeakPolarHBondContact O-CG2 3.31Å; Y178-T182 PolarHBondContact O-N 3.24Å; Y178-T182 PolarHBondContact O-OG1 2.87Å; Y178-L254 HydrophobicContact CD1-CD2 3.76Å; Y178-L254 HydrophobicContact CD2-CD2 4.18Å; Y178-L254 HydrophobicContact CE1-CD2 4.25Å; Y178-L254 HydrophobicContact CG-CD2 3.71Å; Y178-R257 HydrophobicContact CD2-CB 4.2Å; Y178-R257 HydrophobicContact CE2-CB 3.6Å; Y178-R257 HydrophobicContact CE2-CG 4.38Å; Y178-I258 HydrophobicContact CD2-CG1 3.96Å
179	L	94.1	Very high	92.3	Very high	42 Å²	42	43.7 Å²	43.7	22%	0.22	24%	0.24	C	C	.	.	H	α-helix	trans	-67.4	-38.8	-179.1	-67.5	174.2	0	0	0	112.6	I175 D176 R177 I181 T182 K183 Y187	I175-L179 HydrophobicContact CG2-CD1 3.84Å; I175-L179 HydrophobicContact CG2-CG 4.42Å; I175-L179 WeakPolarHBondContact O-CG 3.3Å; I175-L179 PolarHBondContact O-N 3.38Å; D176-L179 PolarHBondContact O-N 3.43Å; R177-L179 VanDerWaalsContact C-N 3.35Å; R177-L179 PolarHBondContact O-N 3.04Å; L179-I181 PolarHBondContact O-N 3.38Å; L179-T182 PolarHBondContact O-OG1 2.94Å; L179-K183 WeakPolarHBondContact O-CB 3.34Å; L179-K183 PolarHBondContact O-N 3.36Å; L179-Y187 HydrophobicContact CB-CD1 3.55Å; L179-Y187 HydrophobicContact CB-CD2 3.91Å; L179-Y187 HydrophobicContact CB-CE1 3.57Å; L179-Y187 HydrophobicContact CB-CE2 3.92Å; L179-Y187 HydrophobicContact CB-CG 3.72Å; L179-Y187 HydrophobicContact CD1-CD2 4.05Å; L179-Y187 HydrophobicContact CD1-CE1 4.44Å; L179-Y187 HydrophobicContact CD1-CE2 3.52Å; L179-Y187 HydrophobicContact CG-CD2 4.49Å; L179-Y187 HydrophobicContact CG-CE2 4.33Å
180	V	91.1	Very high	91.9	Very high	32 Å²	32	51.6 Å²	51.6	19%	0.194	27%	0.27	C	S	.	.	H	α-helix	trans	-62.2	-43.1	175.4	169.4	0	0	0	0	111.7	D176 R177 Y187	D176-V180 WeakPolarHBondContact O-CB 3.27Å; D176-V180 VanDerWaalsContact O-CG2 3.26Å; D176-V180 WeakPolarHBondContact O-CG2 3.27Å; D176-V180 PolarHBondContact O-N 3.49Å; R177-V180 PolarHBondContact O-N 3.33Å; V180-Y187 HydrophobicContact CG2-CD1 3.89Å; V180-Y187 HydrophobicContact CG2-CE1 3.78Å
181	I	87.2	Confident	91.7	Very high	42 Å²	42	54.3 Å²	54.3	22%	0.215	28%	0.279	C	S	.	.	H	α-helix	trans	-73.1	-42.2	-177.9	-67.2	170.8	0	0	0	111	R177 Y178 L179 I258 M265 I388	R177-I181 WeakPolarHBondContact O-CG1 3.44Å; R177-I181 PolarHBondContact O-N 2.93Å; R177-I181 VanDerWaalsContact O-N 3.11Å; Y178-I181 PolarHBondContact O-N 3.26Å; L179-I181 PolarHBondContact O-N 3.38Å; I181-I258 HydrophobicContact CD1-CG1 4.38Å; I181-I258 HydrophobicContact CD1-CG2 3.75Å; I181-M265 HydrophobicContact CG2-CE 4.4Å; I181-I388 HydrophobicContact CD1-CD1 4.5Å; I181-I388 HydrophobicContact CD1-CG1 4.28Å
182	T	89.2	Confident	91.6	Very high	43 Å²	43	56 Å²	56	26%	0.264	29%	0.289	S	S	.	.	H	α-helix	trans	-79.2	-27.9	-175.8	55.7	0	0	0	0	113.6	Y178 L179 L261	Y178-T182 HydrophobicContact CD1-CG2 4.42Å; Y178-T182 HydrophobicContact CD2-CG2 3.8Å; Y178-T182 HydrophobicContact CE1-CG2 4.12Å; Y178-T182 HydrophobicContact CE2-CG2 3.45Å; Y178-T182 VanDerWaalsContact CE2-CG2 3.45Å; Y178-T182 HydrophobicContact CG-CG2 4.28Å; Y178-T182 WeakPolarHBondContact O-CB 3.44Å; Y178-T182 WeakPolarHBondContact O-CG2 3.31Å; Y178-T182 PolarHBondContact O-N 3.24Å; Y178-T182 PolarHBondContact O-OG1 2.87Å; L179-T182 PolarHBondContact O-OG1 2.94Å; T182-L261 HydrophobicContact CG2-CD1 3.35Å
183	K	90.1	Very high	91.5	Very high	111 Å²	111	58.8 Å²	58.8	48%	0.483	31%	0.307	S	S	.	.			trans	-131.5	61.9	-172.8	-66.3	-176.6	-177	-177.6	0	111.8	L179 L185 T186 Y187 A188	L179-K183 WeakPolarHBondContact O-CB 3.34Å; L179-K183 PolarHBondContact O-N 3.36Å; K183-L185 PolarHBondContact O-N 3.07Å; K183-T186 WeakPolarHBondContact CB-OG1 3.46Å; K183-T186 PolarHBondContact O-N 3.46Å; K183-Y187 WeakPolarHBondContact O-CB 2.95Å; K183-Y187 PolarHBondContact O-N 3.44Å; K183-A188 PolarHBondContact O-N 3.31Å
184	P	86.2	Confident	91.6	Very high	61 Å²	61	64.7 Å²	64.7	40%	0.396	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-34	-171.2	25.2	-35.2	0	0	0	114.2	A188	P184-A188 WeakPolarHBondContact O-CB 3.39Å
185	L	88.1	Confident	91.6	Very high	152 Å²	152	70.5 Å²	70.5	80%	0.796	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-23.6	-177.6	-62.2	179.5	0	0	0	113.7	K183 S189	K183-L185 PolarHBondContact O-N 3.07Å; L185-S189 WeakPolarHBondContact O-CB 3.5Å; L185-S189 PolarHBondContact O-OG 2.97Å
186	T	91.3	Very high	91.7	Very high	87 Å²	87	67.6 Å²	67.6	53%	0.534	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-42.3	-173.8	50.7	0	0	0	0	113.1	K183 R190	K183-T186 WeakPolarHBondContact CB-OG1 3.46Å; K183-T186 PolarHBondContact O-N 3.46Å; T186-R190 WeakPolarHBondContact O-CD 3.31Å; T186-R190 WeakPolarHBondContact O-CG 3.41Å
187	Y	92.9	Very high	91.9	Very high	33 Å²	33	70.1 Å²	70.1	13%	0.129	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-49.6	177	-178.3	-96.5	0	0	0	111.3	D176 L179 V180 K183 S189 R190 R191	D176-Y187 PolarHBondContact OD1-OH 2.83Å; L179-Y187 HydrophobicContact CB-CD1 3.55Å; L179-Y187 HydrophobicContact CB-CD2 3.91Å; L179-Y187 HydrophobicContact CB-CE1 3.57Å; L179-Y187 HydrophobicContact CB-CE2 3.92Å; L179-Y187 HydrophobicContact CB-CG 3.72Å; L179-Y187 HydrophobicContact CD1-CD2 4.05Å; L179-Y187 HydrophobicContact CD1-CE1 4.44Å; L179-Y187 HydrophobicContact CD1-CE2 3.52Å; L179-Y187 HydrophobicContact CG-CD2 4.49Å; L179-Y187 HydrophobicContact CG-CE2 4.33Å; V180-Y187 HydrophobicContact CG2-CD1 3.89Å; V180-Y187 HydrophobicContact CG2-CE1 3.78Å; K183-Y187 WeakPolarHBondContact O-CB 2.95Å; K183-Y187 PolarHBondContact O-N 3.44Å; Y187-S189 VanDerWaalsContact C-N 3.28Å; Y187-S189 PolarHBondContact O-N 3.27Å; Y187-R190 CarbonylContact O-C 3.47Å; Y187-R190 PolarHBondContact O-N 2.74Å; Y187-R191 HydrophobicContact CE1-CG 4.45Å; Y187-R191 PolarHBondContact O-N 2.97Å
188	A	87.8	Confident	92.2	Very high	33 Å²	33	70.4 Å²	70.4	27%	0.273	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-64.9	-33.2	-173.3	0	0	0	0	0	112.7	K183 P184 R190	K183-A188 PolarHBondContact O-N 3.31Å; P184-A188 WeakPolarHBondContact O-CB 3.39Å; A188-R190 VanDerWaalsContact C-N 3.33Å
189	S	88.1	Confident	92.4	Very high	84 Å²	84	70.2 Å²	70.2	59%	0.587	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-70.3	-25.9	174.6	61	0	0	0	0	113.7	L185 Y187	L185-S189 WeakPolarHBondContact O-CB 3.5Å; L185-S189 PolarHBondContact O-OG 2.97Å; Y187-S189 VanDerWaalsContact C-N 3.28Å; Y187-S189 PolarHBondContact O-N 3.27Å
190	R	91	Very high	92.6	Very high	167 Å²	167	69.6 Å²	69.6	63%	0.63	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-105	8.2	-178.4	-61.5	-176.7	-179.5	-168.6	-0.4	113.1	T186 Y187 A188 T192 R195	T186-R190 WeakPolarHBondContact O-CD 3.31Å; T186-R190 WeakPolarHBondContact O-CG 3.41Å; Y187-R190 CarbonylContact O-C 3.47Å; Y187-R190 PolarHBondContact O-N 2.74Å; A188-R190 VanDerWaalsContact C-N 3.33Å; R190-T192 PolarHBondContact O-N 3.32Å; R190-R195 PolarHBondContact O-NH1 3.11Å; R190-R195 VanDerWaalsContact O-NH1 3.09Å
191	R	90.9	Very high	93	Very high	62 Å²	62	70.2 Å²	70.2	23%	0.234	38%	0.381	C	S	.	.			trans	-74.9	119	179.9	-174.7	-175.1	58.4	-162.9	-6.1	108.9	P113 S114 D176 R177 Y187 M196	P113-R191 HydrophobicContact CB-CG 3.82Å; P113-R191 HydrophobicContact CG-CG 4.3Å; S114-R191 PolarHBondContact OG-NH1 3.16Å; D176-R191 VanDerWaalsContact OD1-CD 3.3Å; D176-R191 WeakPolarHBondContact OD1-CD 3.05Å; R177-R191 VanDerWaalsContact NH2-NH1 3.15Å; Y187-R191 HydrophobicContact CE1-CG 4.45Å; Y187-R191 PolarHBondContact O-N 2.97Å; R191-M196 HydrophobicContact CG-CE 4.27Å
192	T	94.6	Very high	93.5	Very high	49 Å²	49	73 Å²	73	30%	0.301	40%	0.4	S	S	.	.			trans	-124.6	155.2	-177.6	67.4	0	0	0	0	111.9	R190 Q194 R195 M196	R190-T192 PolarHBondContact O-N 3.32Å; T192-Q194 VanDerWaalsContact C-N 3.25Å; T192-Q194 PolarHBondContact O-N 2.82Å; T192-Q194 PolarHBondContact OG1-OE1 3.31Å; T192-R195 PolarHBondContact O-N 2.87Å; T192-M196 PolarHBondContact O-N 3.05Å
193	P	95	Very high	94	Very high	66 Å²	66	71.3 Å²	71.3	43%	0.429	39%	0.39	S	S	.	.	H	α-helix	trans	-55.3	-36.8	174.5	-27.8	36.8	0	0	0	114	P113 I116 R195 M196 A197	P113-P193 HydrophobicContact CG-CG 4.44Å; I116-P193 HydrophobicContact CD1-CB 3.71Å; I116-P193 HydrophobicContact CD1-CG 4.29Å; P193-R195 VanDerWaalsContact C-N 3.31Å; P193-R195 PolarHBondContact O-N 3.45Å; P193-M196 WeakPolarHBondContact O-CB 3.37Å; P193-M196 PolarHBondContact O-N 3.49Å; P193-M196 VanDerWaalsContact O-N 3.13Å; P193-A197 PolarHBondContact O-N 3.45Å
194	Q	96.1	Very high	94.4	Very high	138 Å²	138	68.9 Å²	68.9	65%	0.645	38%	0.378	S	S	*	.	H	α-helix	trans	-63.5	-36.9	-178.8	-63.3	81.2	-0.5	0	0	112.1	T192 M196 A197 A198	T192-Q194 VanDerWaalsContact C-N 3.25Å; T192-Q194 PolarHBondContact O-N 2.82Å; T192-Q194 PolarHBondContact OG1-OE1 3.31Å; Q194-M196 VanDerWaalsContact C-N 3.34Å; Q194-A197 WeakPolarHBondContact O-CB 3.11Å; Q194-A197 PolarHBondContact O-N 3.36Å; Q194-A198 PolarHBondContact O-N 2.99Å
195	R	95.7	Very high	95	Very high	123 Å²	123	71 Å²	71	46%	0.464	39%	0.385	S	S	.	.	H	α-helix	trans	-68.9	-35.4	175.5	-69	176.7	177.3	-170.9	-4	111.9	R190 T192 P193 A198 M199	R190-R195 PolarHBondContact O-NH1 3.11Å; R190-R195 VanDerWaalsContact O-NH1 3.09Å; T192-R195 PolarHBondContact O-N 2.87Å; P193-R195 VanDerWaalsContact C-N 3.31Å; P193-R195 PolarHBondContact O-N 3.45Å; R195-A198 PolarHBondContact O-N 3.36Å; R195-M199 WeakPolarHBondContact O-CG 3.37Å; R195-M199 PolarHBondContact O-N 2.96Å; R195-M199 VanDerWaalsContact O-N 3.1Å
196	M	97.2	Very high	95.5	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-67.6	-40.8	174.4	-53.1	-70.8	94.8	0	0	110.5	P113 I116 L117 R191 T192 P193 Q194 A198 M199 I200	P113-M196 HydrophobicContact CB-CG 3.65Å; P113-M196 HydrophobicContact CB-SD 4.25Å; P113-M196 WeakPolarHBondContact O-CG 3.37Å; I116-M196 HydrophobicContact CB-CB 4.4Å; L117-M196 HydrophobicContact CD1-SD 3.86Å; L117-M196 HydrophobicContact CD2-CB 4.16Å; L117-M196 HydrophobicContact CD2-SD 4.38Å; L117-M196 HydrophobicContact CG-CB 4.46Å; L117-M196 HydrophobicContact CG-SD 3.96Å; R191-M196 HydrophobicContact CG-CE 4.27Å; T192-M196 PolarHBondContact O-N 3.05Å; P193-M196 WeakPolarHBondContact O-CB 3.37Å; P193-M196 PolarHBondContact O-N 3.49Å; P193-M196 VanDerWaalsContact O-N 3.13Å; Q194-M196 VanDerWaalsContact C-N 3.34Å; M196-A198 VanDerWaalsContact C-N 3.31Å; M196-A198 PolarHBondContact O-N 3.4Å; M196-M199 HydrophobicContact CE-SD 3.58Å; M196-M199 VanDerWaalsContact CE-SD 3.58Å; M196-M199 PolarHBondContact O-N 3Å; M196-I200 WeakPolarHBondContact O-CG1 3.09Å; M196-I200 PolarHBondContact O-N 3.47Å
197	A	97.7	Very high	95.8	Very high	54 Å²	54	60.6 Å²	60.6	45%	0.446	33%	0.332	S	S	.	.	H	α-helix	trans	-60.2	-38.8	173.4	0	0	0	0	0	112.2	P193 Q194 I200 A201	P193-A197 PolarHBondContact O-N 3.45Å; Q194-A197 WeakPolarHBondContact O-CB 3.11Å; Q194-A197 PolarHBondContact O-N 3.36Å; A197-I200 PolarHBondContact O-N 3.28Å; A197-A201 WeakPolarHBondContact O-CB 3.02Å; A197-A201 PolarHBondContact O-N 3.38Å
198	A	98.1	Very high	96.1	Very high	55 Å²	55	60.5 Å²	60.5	46%	0.455	34%	0.338	S	S	.	.	H	α-helix	trans	-64.8	-40.6	173.9	0	0	0	0	0	112.8	Q194 R195 M196 A201 T202	Q194-A198 PolarHBondContact O-N 2.99Å; R195-A198 PolarHBondContact O-N 3.36Å; M196-A198 VanDerWaalsContact C-N 3.31Å; M196-A198 PolarHBondContact O-N 3.4Å; A198-A201 PolarHBondContact O-N 2.82Å; A198-T202 WeakPolarHBondContact O-CB 3.25Å; A198-T202 PolarHBondContact O-N 3.32Å; A198-T202 PolarHBondContact O-OG1 2.73Å
199	M	98	Very high	96.6	Very high	41 Å²	41	63.9 Å²	63.9	20%	0.202	35%	0.351	C	S	.	.	H	α-helix	trans	-63.2	-43.2	174.3	-68.6	173.2	67.5	0	0	111.5	L117 A172 I175 D176 R195 M196 T202 A203	L117-M199 HydrophobicContact CD1-CE 4.21Å; L117-M199 HydrophobicContact CD2-CB 4.2Å; A172-M199 HydrophobicContact CB-CB 4.44Å; A172-M199 HydrophobicContact CB-CE 3.77Å; A172-M199 WeakPolarHBondContact O-CE 3.45Å; I175-M199 HydrophobicContact CB-CE 4.26Å; I175-M199 HydrophobicContact CG2-CE 4.26Å; D176-M199 HydrophobicContact CB-CE 4.42Å; R195-M199 WeakPolarHBondContact O-CG 3.37Å; R195-M199 PolarHBondContact O-N 2.96Å; R195-M199 VanDerWaalsContact O-N 3.1Å; M196-M199 HydrophobicContact CE-SD 3.58Å; M196-M199 VanDerWaalsContact CE-SD 3.58Å; M196-M199 PolarHBondContact O-N 3Å; M199-T202 PolarHBondContact O-N 3.46Å; M199-A203 PolarHBondContact O-N 2.63Å
200	I	98.7	Very high	97	Very high	29 Å²	29	60.2 Å²	60.2	15%	0.149	33%	0.325	C	S	.	.	H	α-helix	trans	-61.3	-52.4	175	-71.3	165.4	0	0	0	110.1	I116 L117 M196 A197 T202 A203 W204	I116-I200 HydrophobicContact CG2-CD1 3.76Å; L117-I200 HydrophobicContact CD2-CD1 4.07Å; L117-I200 HydrophobicContact CD2-CG1 3.74Å; M196-I200 WeakPolarHBondContact O-CG1 3.09Å; M196-I200 PolarHBondContact O-N 3.47Å; A197-I200 PolarHBondContact O-N 3.28Å; I200-T202 PolarHBondContact O-N 2.65Å; I200-A203 WeakPolarHBondContact O-CA 3.12Å; I200-A203 WeakPolarHBondContact O-CB 3.43Å; I200-A203 PolarHBondContact O-N 3.3Å; I200-W204 VanDerWaalsContact CG2-CD1 3.43Å; I200-W204 VanDerWaalsContact O-CD1 3.22Å; I200-W204 PolarHBondContact O-N 3.46Å
201	A	98.6	Very high	97.4	Very high	45 Å²	45	52.6 Å²	52.6	37%	0.372	30%	0.297	S	S	.	.	H	α-helix	trans	-55.4	-41.8	178.9	0	0	0	0	0	111.7	A197 A198 W204 I205	A197-A201 WeakPolarHBondContact O-CB 3.02Å; A197-A201 PolarHBondContact O-N 3.38Å; A198-A201 PolarHBondContact O-N 2.82Å; A201-W204 PolarHBondContact O-N 3.13Å; A201-I205 VanDerWaalsContact O-CB 3.3Å; A201-I205 WeakPolarHBondContact O-CB 3.38Å; A201-I205 WeakPolarHBondContact O-CD1 3.3Å; A201-I205 WeakPolarHBondContact O-CG1 3.13Å; A201-I205 PolarHBondContact O-N 3.31Å
202	T	98.5	Very high	97.6	Very high	101 Å²	101	53.2 Å²	53.2	62%	0.62	30%	0.304	S	S	*	.	H	α-helix	trans	-61.7	-45.1	175.6	-53.9	0	0	0	0	111.7	A198 M199 I200 G206	A198-T202 WeakPolarHBondContact O-CB 3.25Å; A198-T202 PolarHBondContact O-N 3.32Å; A198-T202 PolarHBondContact O-OG1 2.73Å; M199-T202 PolarHBondContact O-N 3.46Å; I200-T202 PolarHBondContact O-N 2.65Å; T202-G206 PolarHBondContact O-N 3.41Å
203	A	98.5	Very high	97.7	Very high	6 Å²	6	52 Å²	52	5%	0.05	30%	0.298	C	S	.	.	H	α-helix	trans	-61.5	-49.3	177.2	0	0	0	0	0	111.6	L168 M199 I200 G206 S207	L168-A203 HydrophobicContact CB-CB 3.67Å; L168-A203 WeakPolarHBondContact CD1-O 3.45Å; M199-A203 PolarHBondContact O-N 2.63Å; I200-A203 WeakPolarHBondContact O-CA 3.12Å; I200-A203 WeakPolarHBondContact O-CB 3.43Å; I200-A203 PolarHBondContact O-N 3.3Å; A203-G206 PolarHBondContact O-N 3.35Å; A203-S207 PolarHBondContact O-N 3.34Å; A203-S207 PolarHBondContact O-OG 2.88Å
204	W	98.8	Very high	97.8	Very high	60 Å²	60	49.2 Å²	49.2	23%	0.227	28%	0.279	C	S	.	.	H	α-helix	trans	-67.5	-41.3	-178.6	-77.3	89.1	0	0	0	113.3	S120 F123 L162 A165 I200 A201 S207 A208	S120-W204 PolarHBondContact OG-NE1 2.74Å; F123-W204 AromaticContact CD1-CH2 3.74Å; F123-W204 HydrophobicContact CD1-CH2 3.74Å; F123-W204 AromaticContact CD1-CZ2 3.67Å; F123-W204 HydrophobicContact CD1-CZ2 3.67Å; F123-W204 AromaticContact CE1-CH2 3.99Å; F123-W204 HydrophobicContact CE1-CH2 3.99Å; F123-W204 HydrophobicContact CE1-CZ2 4.24Å; L162-W204 HydrophobicContact CD2-CH2 4.05Å; L162-W204 HydrophobicContact CD2-CZ3 4.18Å; A165-W204 HydrophobicContact CB-CD2 4.22Å; A165-W204 HydrophobicContact CB-CE3 4.25Å; A165-W204 HydrophobicContact CB-CH2 4.4Å; A165-W204 HydrophobicContact CB-CZ2 4.36Å; A165-W204 HydrophobicContact CB-CZ3 4.35Å; I200-W204 VanDerWaalsContact CG2-CD1 3.43Å; I200-W204 VanDerWaalsContact O-CD1 3.22Å; I200-W204 PolarHBondContact O-N 3.46Å; A201-W204 PolarHBondContact O-N 3.13Å; W204-S207 PolarHBondContact O-N 3.35Å; W204-A208 WeakPolarHBondContact O-CB 3.34Å; W204-A208 PolarHBondContact O-N 2.75Å
205	I	98.6	Very high	97.7	Very high	105 Å²	105	45.8 Å²	45.8	54%	0.538	27%	0.265	S	S	.	.	H	α-helix	trans	-64.1	-45.6	175.2	-67.9	166.3	0	0	0	109.9	A201 S207 A208 L209	A201-I205 VanDerWaalsContact O-CB 3.3Å; A201-I205 WeakPolarHBondContact O-CB 3.38Å; A201-I205 WeakPolarHBondContact O-CD1 3.3Å; A201-I205 WeakPolarHBondContact O-CG1 3.13Å; A201-I205 PolarHBondContact O-N 3.31Å; I205-S207 VanDerWaalsContact C-N 3.35Å; I205-S207 PolarHBondContact O-N 3.41Å; I205-A208 PolarHBondContact O-N 2.86Å; I205-L209 HydrophobicContact CG2-CD1 4.04Å; I205-L209 HydrophobicContact CG2-CG 4.38Å; I205-L209 WeakPolarHBondContact O-CG 3.25Å; I205-L209 PolarHBondContact O-N 3.37Å
206	G	98.4	Very high	97.7	Very high	21 Å²	21	47.9 Å²	47.9	22%	0.216	28%	0.278	C	S	.	.	H	α-helix	trans	-57.5	-46	175.8	0	0	0	0	0	112.4	T202 A203 A208 L209 I210	T202-G206 PolarHBondContact O-N 3.41Å; A203-G206 PolarHBondContact O-N 3.35Å; G206-A208 PolarHBondContact O-N 2.93Å; G206-L209 PolarHBondContact O-N 2.91Å; G206-I210 WeakPolarHBondContact O-CD1 3.41Å; G206-I210 WeakPolarHBondContact O-CG1 3.45Å; G206-I210 PolarHBondContact O-N 3.05Å; G206-I210 VanDerWaalsContact O-N 3.09Å
207	S	98.8	Very high	97.5	Very high	0 Å²	0	51 Å²	51	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-60.9	-41.9	175.8	-58.3	0	0	0	0	113.1	L161 T164 A165 A203 W204 I205 I210 S211	L161-S207 WeakPolarHBondContact O-CB 3.48Å; T164-S207 WeakPolarHBondContact CG2-OG 3.22Å; A165-S207 WeakPolarHBondContact CA-OG 3.23Å; A165-S207 PolarHBondContact N-OG 2.89Å; A203-S207 PolarHBondContact O-N 3.34Å; A203-S207 PolarHBondContact O-OG 2.88Å; W204-S207 PolarHBondContact O-N 3.35Å; I205-S207 VanDerWaalsContact C-N 3.35Å; I205-S207 PolarHBondContact O-N 3.41Å; S207-I210 PolarHBondContact O-N 3.14Å; S207-S211 WeakPolarHBondContact O-CB 3.43Å; S207-S211 PolarHBondContact O-N 3.49Å
208	A	98.4	Very high	97.3	Very high	32 Å²	32	53.2 Å²	53.2	26%	0.264	31%	0.307	S	S	.	.	H	α-helix	trans	-64.1	-43.9	176.9	0	0	0	0	0	111.6	L161 W204 I205 G206 I210 S211 I212	L161-A208 HydrophobicContact CD1-CB 4.04Å; W204-A208 WeakPolarHBondContact O-CB 3.34Å; W204-A208 PolarHBondContact O-N 2.75Å; I205-A208 PolarHBondContact O-N 2.86Å; G206-A208 PolarHBondContact O-N 2.93Å; A208-I210 PolarHBondContact O-N 3.44Å; A208-S211 PolarHBondContact O-N 2.91Å; A208-S211 VanDerWaalsContact O-N 3.15Å; A208-I212 HydrophobicContact CB-CD1 4.38Å; A208-I212 WeakPolarHBondContact O-CB 3.45Å; A208-I212 VanDerWaalsContact O-CD1 3.31Å; A208-I212 WeakPolarHBondContact O-CD1 3.27Å; A208-I212 WeakPolarHBondContact O-CG1 3.4Å; A208-I212 PolarHBondContact O-N 3.45Å; A208-I212 VanDerWaalsContact O-N 3.1Å
209	L	98.2	Very high	97.1	Very high	104 Å²	104	53.2 Å²	53.2	55%	0.545	30%	0.297	S	S	.	.	H	α-helix	trans	-62.5	-28	176.4	-69.6	174	0	0	0	113.1	I205 G206 P213 Y238	I205-L209 HydrophobicContact CG2-CD1 4.04Å; I205-L209 HydrophobicContact CG2-CG 4.38Å; I205-L209 WeakPolarHBondContact O-CG 3.25Å; I205-L209 PolarHBondContact O-N 3.37Å; G206-L209 PolarHBondContact O-N 2.91Å; L209-P213 WeakPolarHBondContact O-CD 3.29Å; L209-Y238 PolarHBondContact O-OH 3.14Å
210	I	98	Very high	96.8	Very high	6 Å²	6	54.9 Å²	54.9	3%	0.031	31%	0.306	C	S	.	.	H	α-helix	trans	-79.5	-39.3	173.7	-66.8	157	0	0	0	111.5	V160 T164 G206 S207 A208 P213 Y235 Y238 A239 F242 A243	V160-I210 HydrophobicContact CG1-CG2 4.09Å; T164-I210 HydrophobicContact CG2-CD1 3.74Å; G206-I210 WeakPolarHBondContact O-CD1 3.41Å; G206-I210 WeakPolarHBondContact O-CG1 3.45Å; G206-I210 PolarHBondContact O-N 3.05Å; G206-I210 VanDerWaalsContact O-N 3.09Å; S207-I210 PolarHBondContact O-N 3.14Å; A208-I210 PolarHBondContact O-N 3.44Å; I210-P213 WeakPolarHBondContact O-CD 3.08Å; I210-Y235 WeakPolarHBondContact O-CE2 3.5Å; I210-Y235 PolarHBondContact O-OH 3.34Å; I210-Y238 HydrophobicContact CG1-CE1 4.36Å; I210-A239 HydrophobicContact CG2-CB 3.74Å; I210-F242 HydrophobicContact CD1-CB 3.74Å; I210-F242 HydrophobicContact CG1-CB 4.18Å; I210-A243 HydrophobicContact CD1-CB 4.16Å; I210-A243 HydrophobicContact CG2-CB 4.32Å
211	S	98	Very high	96.6	Very high	7 Å²	7	59.2 Å²	59.2	5%	0.049	34%	0.336	C	S	.	.	H	α-helix	trans	-74.7	-27	-174.3	172.6	0	0	0	0	114.8	S157 S207 A208 P214	S157-S211 WeakPolarHBondContact CA-OG 3.41Å; S157-S211 PolarHBondContact O-OG 3.31Å; S207-S211 WeakPolarHBondContact O-CB 3.43Å; S207-S211 PolarHBondContact O-N 3.49Å; A208-S211 PolarHBondContact O-N 2.91Å; A208-S211 VanDerWaalsContact O-N 3.15Å; S211-P214 WeakPolarHBondContact O-CD 3.49Å
212	I	95.8	Very high	96.4	Very high	75 Å²	75	59.9 Å²	59.9	39%	0.385	33%	0.331	S	S	.	.	S	Bend	trans	-76.3	-40.5	-169.4	-74	166.6	0	0	0	115.5	A208 P214 N215 F216	A208-I212 HydrophobicContact CB-CD1 4.38Å; A208-I212 WeakPolarHBondContact O-CB 3.45Å; A208-I212 VanDerWaalsContact O-CD1 3.31Å; A208-I212 WeakPolarHBondContact O-CD1 3.27Å; A208-I212 WeakPolarHBondContact O-CG1 3.4Å; A208-I212 PolarHBondContact O-N 3.45Å; A208-I212 VanDerWaalsContact O-N 3.1Å; I212-P214 VanDerWaalsContact O-N 3.15Å; I212-N215 WeakPolarHBondContact O-CB 3.48Å; I212-N215 PolarHBondContact O-N 3Å; I212-F216 HydrophobicContact CG2-CD2 3.48Å; I212-F216 VanDerWaalsContact CG2-CD2 3.48Å; I212-F216 HydrophobicContact CG2-CE2 3.4Å
213	P	96.7	Very high	96.1	Very high	25 Å²	25	61.7 Å²	61.7	16%	0.162	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-51	-36.9	-171.2	-30	35.9	0	0	0	117.6	L209 I210 N215 F216 W218 Y235 Y238	L209-P213 WeakPolarHBondContact O-CD 3.29Å; I210-P213 WeakPolarHBondContact O-CD 3.08Å; P213-N215 PolarHBondContact O-N 3.18Å; P213-F216 CarbonylContact O-C 3.44Å; P213-F216 WeakPolarHBondContact O-CA 3.46Å; P213-F216 PolarHBondContact O-N 3.36Å; P213-W218 HydrophobicContact CB-CB 4.44Å; P213-W218 HydrophobicContact CB-CD2 4.06Å; P213-W218 HydrophobicContact CB-CE3 3.95Å; P213-W218 HydrophobicContact CB-CG 4.24Å; P213-W218 PolarHBondContact O-N 2.58Å; P213-Y235 HydrophobicContact CB-CD2 4.29Å; P213-Y235 HydrophobicContact CB-CE2 4.39Å; P213-Y238 HydrophobicContact CG-CE1 4.12Å
214	P	96	Very high	95.8	Very high	7 Å²	7	67.4 Å²	67.4	5%	0.045	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-53.9	-36.2	176.2	-29	38.2	0	0	0	113.2	S211 I212 F216 K219 Y235	S211-P214 WeakPolarHBondContact O-CD 3.49Å; I212-P214 VanDerWaalsContact O-N 3.15Å; P214-F216 PolarHBondContact O-N 2.92Å; P214-K219 HydrophobicContact CB-CB 4.05Å; P214-K219 WeakPolarHBondContact O-CB 3.19Å; P214-K219 WeakPolarHBondContact O-CG 3.34Å; P214-K219 PolarHBondContact O-N 2.64Å; P214-Y235 VanDerWaalsContact CD-CE2 3.5Å; P214-Y235 HydrophobicContact CG-CD1 4.2Å; P214-Y235 HydrophobicContact CG-CD2 4.09Å; P214-Y235 HydrophobicContact CG-CE1 3.65Å; P214-Y235 HydrophobicContact CG-CE2 3.51Å; P214-Y235 HydrophobicContact CG-CG 4.39Å; P214-Y235 WeakPolarHBondContact CG-OH 3.14Å
215	N	95	Very high	95.6	Very high	66 Å²	66	65.9 Å²	65.9	35%	0.353	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-72	-12.2	179	-57.5	-35.5	0	0	0	113.2	S157 I212 P213	S157-N215 PolarHBondContact OG-ND2 3.32Å; I212-N215 WeakPolarHBondContact O-CB 3.48Å; I212-N215 PolarHBondContact O-N 3Å; P213-N215 PolarHBondContact O-N 3.18Å
216	F	94.6	Very high	95.3	Very high	166 Å²	166	62.2 Å²	62.2	73%	0.728	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-117.8	40.9	-178.8	-67.1	-83.6	0	0	0	111.7	I212 P213 P214	I212-F216 HydrophobicContact CG2-CD2 3.48Å; I212-F216 VanDerWaalsContact CG2-CD2 3.48Å; I212-F216 HydrophobicContact CG2-CE2 3.4Å; P213-F216 CarbonylContact O-C 3.44Å; P213-F216 WeakPolarHBondContact O-CA 3.46Å; P213-F216 PolarHBondContact O-N 3.36Å; P214-F216 PolarHBondContact O-N 2.92Å
217	G	93.3	Very high	95.1	Very high	65 Å²	65	62.3 Å²	62.3	67%	0.67	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.6	7.4	168.6	0	0	0	0	0	115.7
218	W	94.8	Very high	94.8	Very high	101 Å²	101	67.4 Å²	67.4	38%	0.383	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-6.9	174.2	-73.4	27	0	0	0	113	P213 S230 N232 Y235 Y238	P213-W218 HydrophobicContact CB-CB 4.44Å; P213-W218 HydrophobicContact CB-CD2 4.06Å; P213-W218 HydrophobicContact CB-CE3 3.95Å; P213-W218 HydrophobicContact CB-CG 4.24Å; P213-W218 PolarHBondContact O-N 2.58Å; W218-S230 VanDerWaalsContact O-CB 3.31Å; W218-S230 WeakPolarHBondContact O-CB 3.16Å; W218-S230 PolarHBondContact O-OG 2.76Å; W218-N232 WeakPolarHBondContact O-CB 3.47Å; W218-Y235 AromaticContact CE3-CD2 3.62Å; W218-Y235 HydrophobicContact CE3-CD2 3.62Å; W218-Y235 AromaticContact CE3-CG 3.93Å; W218-Y235 HydrophobicContact CE3-CG 3.93Å; W218-Y235 VanDerWaalsContact CZ3-CA 3.41Å; W218-Y235 HydrophobicContact CZ3-CD2 4.2Å; W218-Y238 HydrophobicContact CZ3-CD1 4.16Å; W218-Y238 HydrophobicContact CZ3-CG 4.35Å
219	K	93.9	Very high	94.6	Very high	55 Å²	55	67.5 Å²	67.5	24%	0.239	35%	0.354	C	S	.	.	S	Bend	trans	-87	153	173.4	74.9	178	-171.1	159.2	0	112.5	E149 D153 P214	E149-K219 IonicContact OE1-NZ 2.64Å; E149-K219 PolarHBondContact OE1-NZ 2.86Å; D153-K219 IonicContact OD1-NZ 3.16Å; D153-K219 PolarHBondContact OD1-NZ 3.13Å; D153-K219 IonicContact OD2-NZ 3.34Å; D153-K219 PolarHBondContact OD2-NZ 3.1Å; P214-K219 HydrophobicContact CB-CB 4.05Å; P214-K219 WeakPolarHBondContact O-CB 3.19Å; P214-K219 WeakPolarHBondContact O-CG 3.34Å; P214-K219 PolarHBondContact O-N 2.64Å
220	D	91.7	Very high	94.4	Very high	76 Å²	76	62.7 Å²	62.7	41%	0.406	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-70.4	154.9	167.8	-59	-72.5	0	0	0	110.4	F222 K231	D220-F222 PolarHBondContact O-N 3.35Å; D220-K231 WeakPolarHBondContact OD2-CB 3.44Å; D220-K231 PolarHBondContact OD2-N 3.37Å
221	P	94	Very high	94.1	Very high	120 Å²	120	67.3 Å²	67.3	78%	0.779	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-55.9	136.6	176.3	-24.3	34	0	0	0	111.8	Q223	P221-Q223 PolarHBondContact O-N 3.45Å
222	F	94.5	Very high	93.9	Very high	60 Å²	60	70.1 Å²	70.1	26%	0.263	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-61.1	127.7	-179.9	176	-102.5	0	0	0	111.5	E149 C152 D220	E149-F222 HydrophobicContact CB-CB 4.02Å; E149-F222 HydrophobicContact CB-CD1 3.69Å; E149-F222 HydrophobicContact CB-CD2 3.97Å; E149-F222 HydrophobicContact CB-CE1 4.11Å; E149-F222 HydrophobicContact CB-CE2 4.37Å; E149-F222 HydrophobicContact CB-CG 3.6Å; E149-F222 HydrophobicContact CB-CZ 4.43Å; E149-F222 VanDerWaalsContact CD-CB 3.49Å; E149-F222 HydrophobicContact CG-CB 3.64Å; E149-F222 HydrophobicContact CG-CD1 4.3Å; E149-F222 HydrophobicContact CG-CD2 4.14Å; E149-F222 HydrophobicContact CG-CG 3.77Å; C152-F222 HydrophobicContact CB-CD2 4.29Å; C152-F222 HydrophobicContact CB-CE2 3.97Å; D220-F222 PolarHBondContact O-N 3.35Å
223	Q	92.4	Very high	93.9	Very high	138 Å²	138	69.1 Å²	69.1	65%	0.645	36%	0.361	S	S	*	.			trans	-106.4	127.4	174.4	-176.2	171.8	-8.5	0	0	109.6	P221 C225 A226	P221-Q223 PolarHBondContact O-N 3.45Å; Q223-C225 PolarHBondContact O-N 3.13Å; Q223-A226 PolarHBondContact O-N 3.36Å; Q223-A226 VanDerWaalsContact O-N 3.1Å
224	K	92.6	Very high	93.8	Very high	126 Å²	126	69.4 Å²	69.4	55%	0.548	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	138.9	175.5	-166.4	-173.7	177.4	-164.8	0	110	S67 A226	S67-K224 PolarHBondContact O-NZ 3.39Å; K224-A226 VanDerWaalsContact C-N 3.28Å; K224-A226 PolarHBondContact O-N 3.1Å
225	C	93.3	Very high	93.9	Very high	28 Å²	28	69.5 Å²	69.5	19%	0.189	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	75.1	1.1	-177.6	-36.5	0	0	0	0	115.6	C69 Y144 W145 Q223	C69-C225 WeakPolarHBondContact CA-SG 3.49Å; C69-C225 HydrophobicContact CB-CB 3.75Å; C69-C225 WeakPolarHBondContact CB-SG 3.24Å; C69-C225 WeakPolarHBondContact SG-CB 3.34Å; C69-C225 CovalentContact SG-SG 2.03Å; C69-C225 PolarHBondContact SG-SG 3.43Å; Y144-C225 HydrophobicContact CD2-CB 4.34Å; W145-C225 PolarHBondContact N-O 3.44Å; W145-C225 WeakPolarHBondContact O-CA 3.14Å; Q223-C225 PolarHBondContact O-N 3.13Å
226	A	92	Very high	93.9	Very high	29 Å²	29	66.8 Å²	66.8	24%	0.24	35%	0.354	C	S	.	.			trans	-134.5	135.8	178.1	0	0	0	0	0	111.6	Q223 K224 E228	Q223-A226 PolarHBondContact O-N 3.36Å; Q223-A226 VanDerWaalsContact O-N 3.1Å; K224-A226 VanDerWaalsContact C-N 3.28Å; K224-A226 PolarHBondContact O-N 3.1Å; A226-E228 HydrophobicContact CB-CG 4.45Å
227	C	94.7	Very high	94.1	Very high	23 Å²	23	62 Å²	62	16%	0.155	34%	0.338	C	S	.	.			trans	-125.8	98.5	170.8	-176.8	0	0	0	0	108.9	W145 C152	W145-C227 HydrophobicContact CB-CB 3.94Å; W145-C227 HydrophobicContact CD2-CB 3.31Å; W145-C227 HydrophobicContact CE3-CB 3.66Å; W145-C227 HydrophobicContact CG-CB 3.43Å; W145-C227 VanDerWaalsContact CG-CB 3.43Å; W145-C227 HydrophobicContact CZ2-CB 4.4Å; W145-C227 HydrophobicContact CZ3-CB 4.33Å; C152-C227 WeakPolarHBondContact CA-SG 3.49Å; C152-C227 HydrophobicContact CB-CB 3.89Å; C152-C227 WeakPolarHBondContact CB-SG 3.43Å; C152-C227 WeakPolarHBondContact SG-CA 3.49Å; C152-C227 WeakPolarHBondContact SG-CB 3.08Å; C152-C227 CovalentContact SG-SG 2.04Å; C152-C227 PolarHBondContact SG-SG 3.38Å
228	E	92.6	Very high	94.2	Very high	106 Å²	106	62.3 Å²	62.3	50%	0.495	32%	0.319	S	S	.	.			trans	-114.4	145.8	-172.3	-61.1	-173.9	130.6	0	0	110.9	I156 A226 K231	I156-E228 WeakPolarHBondContact CD1-O 3.48Å; A226-E228 HydrophobicContact CB-CG 4.45Å; E228-K231 VanDerWaalsContact CD-NZ 3.33Å; E228-K231 IonicContact OE1-NZ 2.94Å; E228-K231 PolarHBondContact OE1-NZ 2.85Å; E228-K231 VanDerWaalsContact OE2-CE 3.22Å; E228-K231 WeakPolarHBondContact OE2-CE 3.34Å; E228-K231 IonicContact OE2-NZ 2.86Å; E228-K231 PolarHBondContact OE2-NZ 3.49Å
229	Y	94.1	Very high	94.3	Very high	34 Å²	34	57.9 Å²	57.9	13%	0.133	30%	0.304	C	S	.	.			trans	-62.2	147.4	168.8	-57.4	-84.5	0	0	0	110.3	I156 D159 V160 K231 F405 Q435	I156-Y229 HydrophobicContact CG2-CD1 3.92Å; I156-Y229 HydrophobicContact CG2-CE1 4.27Å; D159-Y229 WeakPolarHBondContact OD2-CE1 3.47Å; D159-Y229 VanDerWaalsContact OD2-CZ 3.28Å; D159-Y229 PolarHBondContact OD2-OH 3.26Å; V160-Y229 HydrophobicContact CG2-CD1 4.39Å; V160-Y229 HydrophobicContact CG2-CE1 4.28Å; Y229-K231 PolarHBondContact O-N 3.39Å; Y229-F405 HydrophobicContact CD2-CZ 4.4Å; Y229-F405 AromaticContact CE2-CZ 3.97Å; Y229-F405 HydrophobicContact CE2-CZ 3.97Å; Y229-Q435 PolarHBondContact OH-NE2 3.31Å
230	S	94.5	Very high	94.5	Very high	3 Å²	3	55.5 Å²	55.5	2%	0.021	29%	0.294	C	S	.	.			trans	-48.1	124.6	173.5	160.6	0	0	0	0	111.6	W218 N232 Y235 Q236	W218-S230 VanDerWaalsContact O-CB 3.31Å; W218-S230 WeakPolarHBondContact O-CB 3.16Å; W218-S230 PolarHBondContact O-OG 2.76Å; S230-N232 VanDerWaalsContact C-N 3.28Å; S230-N232 WeakPolarHBondContact OG-CB 3.31Å; S230-N232 PolarHBondContact OG-N 2.82Å; S230-Y235 VanDerWaalsContact CB-CD1 3.46Å; S230-Y235 WeakPolarHBondContact OG-CD1 3.3Å; S230-Q236 PolarHBondContact O-NE2 3.43Å
231	K	92	Very high	94.7	Very high	104 Å²	104	56.2 Å²	56.2	45%	0.452	29%	0.294	S	S	.	.			trans	-88.2	0	175.7	-61.8	174.8	-174.4	167.7	0	112.3	D220 E228 Y229 V233	D220-K231 WeakPolarHBondContact OD2-CB 3.44Å; D220-K231 PolarHBondContact OD2-N 3.37Å; E228-K231 VanDerWaalsContact CD-NZ 3.33Å; E228-K231 IonicContact OE1-NZ 2.94Å; E228-K231 PolarHBondContact OE1-NZ 2.85Å; E228-K231 VanDerWaalsContact OE2-CE 3.22Å; E228-K231 WeakPolarHBondContact OE2-CE 3.34Å; E228-K231 IonicContact OE2-NZ 2.86Å; E228-K231 PolarHBondContact OE2-NZ 3.49Å; Y229-K231 PolarHBondContact O-N 3.39Å; K231-V233 PolarHBondContact O-N 3.34Å
232	N	94.1	Very high	94.8	Very high	65 Å²	65	54.8 Å²	54.8	35%	0.348	28%	0.276	S	S	.	.			trans	-57.9	121.7	178.9	-177.1	-73.9	0	0	0	110.4	W218 S230 G234 Y235 Q236	W218-N232 WeakPolarHBondContact O-CB 3.47Å; S230-N232 VanDerWaalsContact C-N 3.28Å; S230-N232 WeakPolarHBondContact OG-CB 3.31Å; S230-N232 PolarHBondContact OG-N 2.82Å; N232-G234 VanDerWaalsContact C-N 3.28Å; N232-G234 PolarHBondContact O-N 3.01Å; N232-G234 VanDerWaalsContact OD1-CA 3.3Å; N232-G234 WeakPolarHBondContact OD1-CA 3.04Å; N232-G234 PolarHBondContact OD1-N 2.87Å; N232-Y235 WeakPolarHBondContact O-CB 3.43Å; N232-Y235 PolarHBondContact O-N 3.32Å; N232-Y235 VanDerWaalsContact O-N 3.14Å; N232-Y235 PolarHBondContact OD1-N 3.49Å; N232-Q236 WeakPolarHBondContact O-CG 3.36Å; N232-Q236 PolarHBondContact O-N 2.98Å
233	V	94.7	Very high	94.9	Very high	54 Å²	54	52.1 Å²	52.1	33%	0.327	27%	0.265	S	S	.	.	H	α-helix	trans	-60.9	-36.9	-177.2	67.5	0	0	0	0	112.6	K231 Q236 V237 L414 A417	K231-V233 PolarHBondContact O-N 3.34Å; V233-Q236 PolarHBondContact O-N 2.86Å; V233-V237 HydrophobicContact CG2-CG2 4.23Å; V233-V237 WeakPolarHBondContact O-CB 3.27Å; V233-V237 VanDerWaalsContact O-CG2 3.27Å; V233-V237 WeakPolarHBondContact O-CG2 3.39Å; V233-V237 PolarHBondContact O-N 3.08Å; V233-L414 HydrophobicContact CG2-CD2 4.35Å; V233-A417 HydrophobicContact CB-CB 3.87Å; V233-A417 HydrophobicContact CG1-CB 4Å; V233-A417 HydrophobicContact CG2-CB 3.68Å
234	G	95.5	Very high	95.1	Very high	32 Å²	32	45.5 Å²	45.5	33%	0.33	23%	0.234	S	C	.	.	H	α-helix	trans	-62.2	-45.6	176.1	0	0	0	0	0	111.6	N232 Y238	N232-G234 VanDerWaalsContact C-N 3.28Å; N232-G234 PolarHBondContact O-N 3.01Å; N232-G234 VanDerWaalsContact OD1-CA 3.3Å; N232-G234 WeakPolarHBondContact OD1-CA 3.04Å; N232-G234 PolarHBondContact OD1-N 2.87Å; G234-Y238 VanDerWaalsContact O-CB 3.24Å; G234-Y238 WeakPolarHBondContact O-CB 3.2Å; G234-Y238 PolarHBondContact O-N 3.29Å
235	Y	97	Very high	95.3	Very high	8 Å²	8	41.3 Å²	41.3	3%	0.031	22%	0.215	C	C	.	.	H	α-helix	trans	-61.9	-49.5	173.7	-175.7	-118.5	0	0	0	112.5	I210 P213 P214 W218 S230 N232 V237 Y238 A239	I210-Y235 WeakPolarHBondContact O-CE2 3.5Å; I210-Y235 PolarHBondContact O-OH 3.34Å; P213-Y235 HydrophobicContact CB-CD2 4.29Å; P213-Y235 HydrophobicContact CB-CE2 4.39Å; P214-Y235 VanDerWaalsContact CD-CE2 3.5Å; P214-Y235 HydrophobicContact CG-CD1 4.2Å; P214-Y235 HydrophobicContact CG-CD2 4.09Å; P214-Y235 HydrophobicContact CG-CE1 3.65Å; P214-Y235 HydrophobicContact CG-CE2 3.51Å; P214-Y235 HydrophobicContact CG-CG 4.39Å; P214-Y235 WeakPolarHBondContact CG-OH 3.14Å; W218-Y235 AromaticContact CE3-CD2 3.62Å; W218-Y235 HydrophobicContact CE3-CD2 3.62Å; W218-Y235 AromaticContact CE3-CG 3.93Å; W218-Y235 HydrophobicContact CE3-CG 3.93Å; W218-Y235 VanDerWaalsContact CZ3-CA 3.41Å; W218-Y235 HydrophobicContact CZ3-CD2 4.2Å; S230-Y235 VanDerWaalsContact CB-CD1 3.46Å; S230-Y235 WeakPolarHBondContact OG-CD1 3.3Å; N232-Y235 WeakPolarHBondContact O-CB 3.43Å; N232-Y235 PolarHBondContact O-N 3.32Å; N232-Y235 VanDerWaalsContact O-N 3.14Å; N232-Y235 PolarHBondContact OD1-N 3.49Å; Y235-V237 PolarHBondContact O-N 3.34Å; Y235-Y238 HydrophobicContact CD2-CD1 4.4Å; Y235-Y238 PolarHBondContact O-N 3.32Å; Y235-A239 HydrophobicContact CD2-CB 4.13Å; Y235-A239 HydrophobicContact CE1-CB 4.22Å; Y235-A239 HydrophobicContact CE2-CB 3.77Å; Y235-A239 WeakPolarHBondContact O-CB 3.42Å; Y235-A239 PolarHBondContact O-N 3.21Å
236	Q	96.8	Very high	95.5	Very high	10 Å²	10	43.2 Å²	43.2	5%	0.047	22%	0.223	C	C	.	.	H	α-helix	trans	-62.3	-43.6	-176.7	-73.4	-72.9	-6.1	0	0	111.2	S230 N232 V233 T240 A413	S230-Q236 PolarHBondContact O-NE2 3.43Å; N232-Q236 WeakPolarHBondContact O-CG 3.36Å; N232-Q236 PolarHBondContact O-N 2.98Å; V233-Q236 PolarHBondContact O-N 2.86Å; Q236-T240 VanDerWaalsContact O-CB 3.25Å; Q236-T240 WeakPolarHBondContact O-CB 3.19Å; Q236-T240 WeakPolarHBondContact O-CG2 3.15Å; Q236-T240 PolarHBondContact O-N 2.97Å; Q236-T240 PolarHBondContact O-OG1 3.21Å; Q236-A413 HydrophobicContact CB-CB 3.49Å; Q236-A413 VanDerWaalsContact CB-CB 3.49Å; Q236-A413 HydrophobicContact CG-CB 3.7Å
237	V	96.8	Very high	95.7	Very high	66 Å²	66	42 Å²	42	40%	0.4	21%	0.213	S	C	.	.	H	α-helix	trans	-62.6	-50.2	174.5	172.1	0	0	0	0	111.1	V233 Y235 F241 L410 L414	V233-V237 HydrophobicContact CG2-CG2 4.23Å; V233-V237 WeakPolarHBondContact O-CB 3.27Å; V233-V237 VanDerWaalsContact O-CG2 3.27Å; V233-V237 WeakPolarHBondContact O-CG2 3.39Å; V233-V237 PolarHBondContact O-N 3.08Å; Y235-V237 PolarHBondContact O-N 3.34Å; V237-F241 WeakPolarHBondContact O-CB 3.41Å; V237-F241 PolarHBondContact O-N 3.43Å; V237-F241 VanDerWaalsContact O-N 3.1Å; V237-L410 HydrophobicContact CG2-CD1 3.99Å; V237-L414 HydrophobicContact CG2-CD2 4.44Å
238	Y	97.1	Very high	95.7	Very high	70 Å²	70	41.8 Å²	41.8	28%	0.275	21%	0.209	S	C	.	.	H	α-helix	trans	-59.8	-55.1	179.9	165.7	-105.4	0	0	0	112.4	L209 I210 P213 W218 G234 Y235 F242	L209-Y238 PolarHBondContact O-OH 3.14Å; I210-Y238 HydrophobicContact CG1-CE1 4.36Å; P213-Y238 HydrophobicContact CG-CE1 4.12Å; W218-Y238 HydrophobicContact CZ3-CD1 4.16Å; W218-Y238 HydrophobicContact CZ3-CG 4.35Å; G234-Y238 VanDerWaalsContact O-CB 3.24Å; G234-Y238 WeakPolarHBondContact O-CB 3.2Å; G234-Y238 PolarHBondContact O-N 3.29Å; Y235-Y238 HydrophobicContact CD2-CD1 4.4Å; Y235-Y238 PolarHBondContact O-N 3.32Å; Y238-F242 AromaticContact CD2-CD2 3.68Å; Y238-F242 HydrophobicContact CD2-CD2 3.68Å; Y238-F242 AromaticContact CD2-CE2 3.86Å; Y238-F242 HydrophobicContact CD2-CE2 3.86Å; Y238-F242 AromaticContact CE2-CD2 3.76Å; Y238-F242 HydrophobicContact CE2-CD2 3.76Å; Y238-F242 HydrophobicContact CE2-CE2 4.01Å; Y238-F242 WeakPolarHBondContact O-CD2 3.29Å; Y238-F242 PolarHBondContact O-N 3.27Å; Y238-F242 VanDerWaalsContact O-N 3.16Å
239	A	97.2	Very high	95.9	Very high	8 Å²	8	40.9 Å²	40.9	7%	0.066	21%	0.207	C	C	.	.	H	α-helix	trans	-66.9	-49.8	-174.3	0	0	0	0	0	111.2	I210 Y235 F241 F242 A243	I210-A239 HydrophobicContact CG2-CB 3.74Å; Y235-A239 HydrophobicContact CD2-CB 4.13Å; Y235-A239 HydrophobicContact CE1-CB 4.22Å; Y235-A239 HydrophobicContact CE2-CB 3.77Å; Y235-A239 WeakPolarHBondContact O-CB 3.42Å; Y235-A239 PolarHBondContact O-N 3.21Å; A239-F241 VanDerWaalsContact C-N 3.32Å; A239-F241 PolarHBondContact O-N 3.33Å; A239-F242 PolarHBondContact O-N 3.43Å; A239-A243 WeakPolarHBondContact O-CA 3.47Å; A239-A243 WeakPolarHBondContact O-CB 3.4Å; A239-A243 PolarHBondContact O-N 3.35Å
240	T	96.1	Very high	96	Very high	5 Å²	5	41.5 Å²	41.5	3%	0.031	21%	0.214	C	C	.	.	H	α-helix	trans	-66	-35.9	-178.8	64.9	0	0	0	0	112.1	Q236 F244 Y245 F406	Q236-T240 VanDerWaalsContact O-CB 3.25Å; Q236-T240 WeakPolarHBondContact O-CB 3.19Å; Q236-T240 WeakPolarHBondContact O-CG2 3.15Å; Q236-T240 PolarHBondContact O-N 2.97Å; Q236-T240 PolarHBondContact O-OG1 3.21Å; T240-F244 WeakPolarHBondContact O-CA 3.04Å; T240-F244 WeakPolarHBondContact O-CB 3.45Å; T240-F244 PolarHBondContact O-N 2.97Å; T240-Y245 WeakPolarHBondContact O-CD2 3.38Å; T240-Y245 PolarHBondContact O-N 2.89Å; T240-F406 HydrophobicContact CG2-CD1 3.95Å
241	F	96.9	Very high	96	Very high	91 Å²	91	41.6 Å²	41.6	40%	0.399	22%	0.215	S	C	.	.	I	π-helix	trans	-61.6	-55.1	176.4	179.8	-98.3	0	0	0	111.6	V237 A239 Y245 L246	V237-F241 WeakPolarHBondContact O-CB 3.41Å; V237-F241 PolarHBondContact O-N 3.43Å; V237-F241 VanDerWaalsContact O-N 3.1Å; A239-F241 VanDerWaalsContact C-N 3.32Å; A239-F241 PolarHBondContact O-N 3.33Å; F241-Y245 PolarHBondContact O-N 3.02Å; F241-L246 HydrophobicContact CD1-CB 4.49Å; F241-L246 HydrophobicContact CE1-CB 4.2Å; F241-L246 HydrophobicContact CE1-CD2 4.31Å; F241-L246 HydrophobicContact CZ-CB 4.28Å; F241-L246 VanDerWaalsContact O-CB 3.25Å; F241-L246 WeakPolarHBondContact O-CB 3.41Å; F241-L246 PolarHBondContact O-N 3.32Å
242	F	97.2	Very high	96.1	Very high	91 Å²	91	41.5 Å²	41.5	40%	0.399	22%	0.218	S	C	.	.	I	π-helix	trans	-79.8	-32.2	-175.2	-72.1	-72.5	0	0	0	113.7	I210 Y238 A239 L246 P247	I210-F242 HydrophobicContact CD1-CB 3.74Å; I210-F242 HydrophobicContact CG1-CB 4.18Å; Y238-F242 AromaticContact CD2-CD2 3.68Å; Y238-F242 HydrophobicContact CD2-CD2 3.68Å; Y238-F242 AromaticContact CD2-CE2 3.86Å; Y238-F242 HydrophobicContact CD2-CE2 3.86Å; Y238-F242 AromaticContact CE2-CD2 3.76Å; Y238-F242 HydrophobicContact CE2-CD2 3.76Å; Y238-F242 HydrophobicContact CE2-CE2 4.01Å; Y238-F242 WeakPolarHBondContact O-CD2 3.29Å; Y238-F242 PolarHBondContact O-N 3.27Å; Y238-F242 VanDerWaalsContact O-N 3.16Å; A239-F242 PolarHBondContact O-N 3.43Å; F242-L246 HydrophobicContact CD1-CD2 3.73Å; F242-L246 HydrophobicContact CE1-CD2 4.05Å; F242-P247 VanDerWaalsContact O-CD 3.25Å; F242-P247 WeakPolarHBondContact O-CD 3.17Å; F242-P247 VanDerWaalsContact O-CG 3.3Å; F242-P247 WeakPolarHBondContact O-CG 3.44Å
243	A	96.1	Very high	96.2	Very high	3 Å²	3	42.6 Å²	42.6	3%	0.025	22%	0.223	C	C	.	.	I	π-helix	trans	-78	-31	179.3	0	0	0	0	0	113	T164 I167 I210 A239	T164-A243 HydrophobicContact CG2-CB 3.75Å; I167-A243 VanDerWaalsContact CG2-O 3.29Å; I167-A243 WeakPolarHBondContact CG2-O 3.29Å; I210-A243 HydrophobicContact CD1-CB 4.16Å; I210-A243 HydrophobicContact CG2-CB 4.32Å; A239-A243 WeakPolarHBondContact O-CA 3.47Å; A239-A243 WeakPolarHBondContact O-CB 3.4Å; A239-A243 PolarHBondContact O-N 3.35Å
244	F	95.9	Very high	96.2	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.212	C	C	.	.	I	π-helix	trans	-130.3	-61.7	-169.9	178.9	-102.1	0	0	0	114.2	I167 T240 L246 P247 L248 F398 W402 L403 F406	I167-F244 HydrophobicContact CD1-CD2 4.43Å; T240-F244 WeakPolarHBondContact O-CA 3.04Å; T240-F244 WeakPolarHBondContact O-CB 3.45Å; T240-F244 PolarHBondContact O-N 2.97Å; F244-L246 PolarHBondContact O-N 3.15Å; F244-P247 WeakPolarHBondContact O-CD 3.37Å; F244-L248 HydrophobicContact CE1-CD2 3.77Å; F244-L248 HydrophobicContact CZ-CD2 3.71Å; F244-L248 WeakPolarHBondContact O-CB 3.3Å; F244-L248 PolarHBondContact O-N 3.44Å; F244-F398 HydrophobicContact CD2-CE2 4.04Å; F244-F398 AromaticContact CD2-CZ 3.6Å; F244-F398 HydrophobicContact CD2-CZ 3.6Å; F244-F398 HydrophobicContact CE2-CE1 4.14Å; F244-F398 AromaticContact CE2-CE2 3.96Å; F244-F398 HydrophobicContact CE2-CE2 3.96Å; F244-F398 AromaticContact CE2-CZ 3.43Å; F244-F398 HydrophobicContact CE2-CZ 3.43Å; F244-F398 VanDerWaalsContact CE2-CZ 3.43Å; F244-W402 HydrophobicContact CD2-CB 4.08Å; F244-W402 HydrophobicContact CE2-CB 3.64Å; F244-L403 HydrophobicContact CE1-CB 4.49Å; F244-L403 HydrophobicContact CE1-CD1 3.54Å; F244-L403 VanDerWaalsContact CZ-CA 3.43Å; F244-L403 HydrophobicContact CZ-CB 3.8Å; F244-L403 HydrophobicContact CZ-CD1 3.62Å; F244-L403 HydrophobicContact CZ-CG 4.33Å; F244-F406 HydrophobicContact CB-CB 4.39Å; F244-F406 HydrophobicContact CB-CD1 3.9Å; F244-F406 HydrophobicContact CB-CD2 3.64Å; F244-F406 HydrophobicContact CB-CE1 4.01Å; F244-F406 HydrophobicContact CB-CE2 3.75Å; F244-F406 HydrophobicContact CB-CG 3.71Å; F244-F406 HydrophobicContact CB-CZ 3.94Å; F244-F406 HydrophobicContact CD1-CB 3.54Å; F244-F406 AromaticContact CD1-CD2 3.77Å; F244-F406 HydrophobicContact CD1-CD2 3.77Å; F244-F406 AromaticContact CD1-CG 3.74Å; F244-F406 HydrophobicContact CD1-CG 3.74Å; F244-F406 AromaticContact CD2-CD2 3.19Å; F244-F406 HydrophobicContact CD2-CD2 3.19Å; F244-F406 AromaticContact CD2-CE2 3.46Å; F244-F406 HydrophobicContact CD2-CE2 3.46Å; F244-F406 VanDerWaalsContact CD2-CE2 3.46Å; F244-F406 HydrophobicContact CD2-CG 4Å; F244-F406 HydrophobicContact CD2-CZ 4.44Å; F244-F406 HydrophobicContact CE1-CB 3.91Å; F244-F406 HydrophobicContact CE1-CD2 4.24Å; F244-F406 HydrophobicContact CE1-CG 4.38Å; F244-F406 AromaticContact CE2-CD2 3.73Å; F244-F406 HydrophobicContact CE2-CD2 3.73Å; F244-F406 HydrophobicContact CE2-CE2 4.25Å; F244-F406 HydrophobicContact CG-CB 3.89Å; F244-F406 HydrophobicContact CG-CD1 4.22Å; F244-F406 AromaticContact CG-CD2 3.21Å; F244-F406 HydrophobicContact CG-CD2 3.21Å; F244-F406 AromaticContact CG-CE2 3.7Å; F244-F406 HydrophobicContact CG-CE2 3.7Å; F244-F406 AromaticContact CG-CG 3.52Å; F244-F406 HydrophobicContact CG-CG 3.52Å; F244-F406 HydrophobicContact CG-CZ 4.38Å; F244-F406 HydrophobicContact CZ-CD2 4.23Å
245	Y	96.5	Very high	96	Very high	38 Å²	38	42.4 Å²	42.4	15%	0.149	21%	0.208	C	C	.	.	I	π-helix	trans	-66.2	-44.5	-169.6	-68.4	-71.4	0	0	0	113.2	T240 F241 L248 I249 F406 M407 L410	T240-Y245 WeakPolarHBondContact O-CD2 3.38Å; T240-Y245 PolarHBondContact O-N 2.89Å; F241-Y245 PolarHBondContact O-N 3.02Å; Y245-L248 PolarHBondContact O-N 3.02Å; Y245-I249 WeakPolarHBondContact O-CB 3.48Å; Y245-I249 WeakPolarHBondContact O-CD1 3.49Å; Y245-I249 VanDerWaalsContact O-CG1 3.23Å; Y245-I249 WeakPolarHBondContact O-CG1 3.36Å; Y245-I249 PolarHBondContact O-N 3.15Å; Y245-F406 PolarHBondContact OH-O 2.79Å; Y245-M407 HydrophobicContact CE1-SD 3.94Å; Y245-M407 WeakPolarHBondContact OH-CA 3.32Å; Y245-M407 PolarHBondContact OH-SD 3.21Å; Y245-L410 HydrophobicContact CD2-CD2 4.4Å; Y245-L410 HydrophobicContact CE2-CB 4.44Å; Y245-L410 HydrophobicContact CE2-CD2 3.53Å
246	L	96.9	Very high	95.8	Very high	68 Å²	68	44 Å²	44	36%	0.356	23%	0.227	S	C	.	.	H	α-helix	trans	-63.2	-52	176.7	172.9	70.5	0	0	0	111.3	F241 F242 F244 L248 I249 V250	F241-L246 HydrophobicContact CD1-CB 4.49Å; F241-L246 HydrophobicContact CE1-CB 4.2Å; F241-L246 HydrophobicContact CE1-CD2 4.31Å; F241-L246 HydrophobicContact CZ-CB 4.28Å; F241-L246 VanDerWaalsContact O-CB 3.25Å; F241-L246 WeakPolarHBondContact O-CB 3.41Å; F241-L246 PolarHBondContact O-N 3.32Å; F242-L246 HydrophobicContact CD1-CD2 3.73Å; F242-L246 HydrophobicContact CE1-CD2 4.05Å; F244-L246 PolarHBondContact O-N 3.15Å; L246-L248 VanDerWaalsContact C-N 3.31Å; L246-L248 PolarHBondContact O-N 3.39Å; L246-I249 PolarHBondContact O-N 3.44Å; L246-V250 HydrophobicContact CD1-CG2 4.41Å; L246-V250 WeakPolarHBondContact O-CG2 3.34Å; L246-V250 PolarHBondContact O-N 3.19Å
247	P	96.6	Very high	95.6	Very high	4 Å²	4	49.9 Å²	49.9	3%	0.026	25%	0.249	C	C	.	.	H	α-helix	trans	-55.5	-42.6	172.9	-28.8	36.3	0	0	0	113.6	I167 L168 C171 F242 F244 V250 M251	I167-P247 HydrophobicContact CG2-CB 3.78Å; I167-P247 HydrophobicContact CG2-CG 4.27Å; L168-P247 HydrophobicContact CD2-CB 4.28Å; L168-P247 HydrophobicContact CD2-CG 3.48Å; L168-P247 VanDerWaalsContact CD2-CG 3.48Å; C171-P247 HydrophobicContact CB-CB 4.27Å; F242-P247 VanDerWaalsContact O-CD 3.25Å; F242-P247 WeakPolarHBondContact O-CD 3.17Å; F242-P247 VanDerWaalsContact O-CG 3.3Å; F242-P247 WeakPolarHBondContact O-CG 3.44Å; F244-P247 WeakPolarHBondContact O-CD 3.37Å; P247-V250 PolarHBondContact O-N 3.27Å; P247-M251 HydrophobicContact CB-CE 4.42Å; P247-M251 WeakPolarHBondContact O-CB 3.35Å; P247-M251 VanDerWaalsContact O-CG 3.28Å; P247-M251 WeakPolarHBondContact O-CG 3.41Å; P247-M251 PolarHBondContact O-N 3.38Å
248	L	95.4	Very high	95.3	Very high	17 Å²	17	46.8 Å²	46.8	9%	0.089	23%	0.23	C	C	.	.	H	α-helix	trans	-59.9	-50.4	178.1	175.9	68.7	0	0	0	111.5	F244 Y245 L246 V250 M251 I252 F398 C399 L403	F244-L248 HydrophobicContact CE1-CD2 3.77Å; F244-L248 HydrophobicContact CZ-CD2 3.71Å; F244-L248 WeakPolarHBondContact O-CB 3.3Å; F244-L248 PolarHBondContact O-N 3.44Å; Y245-L248 PolarHBondContact O-N 3.02Å; L246-L248 VanDerWaalsContact C-N 3.31Å; L246-L248 PolarHBondContact O-N 3.39Å; L248-V250 VanDerWaalsContact C-N 3.32Å; L248-V250 PolarHBondContact O-N 3.05Å; L248-M251 PolarHBondContact O-N 2.96Å; L248-I252 HydrophobicContact CD1-CD1 3.83Å; L248-I252 HydrophobicContact CD1-CG1 4.2Å; L248-I252 HydrophobicContact CG-CD1 3.83Å; L248-I252 HydrophobicContact CG-CG1 4.49Å; L248-I252 WeakPolarHBondContact O-CB 3.27Å; L248-I252 VanDerWaalsContact O-CG1 3.31Å; L248-I252 WeakPolarHBondContact O-CG1 3.42Å; L248-I252 PolarHBondContact O-N 3.07Å; L248-F398 HydrophobicContact CB-CE1 4.38Å; L248-F398 HydrophobicContact CD1-CD1 4.47Å; L248-F398 HydrophobicContact CD1-CE1 3.72Å; L248-C399 HydrophobicContact CD1-CB 4.41Å; L248-C399 WeakPolarHBondContact CD1-SG 3.34Å; L248-L403 HydrophobicContact CD2-CD1 4.19Å
249	I	96.5	Very high	94.9	Very high	88 Å²	88	48.5 Å²	48.5	45%	0.451	24%	0.239	S	C	.	.	H	α-helix	trans	-59.1	-46	178.6	-70.3	164	0	0	0	110.4	Y245 L246 M251 I252 I253	Y245-I249 WeakPolarHBondContact O-CB 3.48Å; Y245-I249 WeakPolarHBondContact O-CD1 3.49Å; Y245-I249 VanDerWaalsContact O-CG1 3.23Å; Y245-I249 WeakPolarHBondContact O-CG1 3.36Å; Y245-I249 PolarHBondContact O-N 3.15Å; L246-I249 PolarHBondContact O-N 3.44Å; I249-M251 PolarHBondContact O-N 3.38Å; I249-I252 PolarHBondContact O-N 2.75Å; I249-I253 HydrophobicContact CG2-CD1 3.75Å; I249-I253 VanDerWaalsContact O-CG1 3.29Å; I249-I253 WeakPolarHBondContact O-CG1 3.27Å; I249-I253 PolarHBondContact O-N 3.03Å
250	V	96.7	Very high	94.6	Very high	46 Å²	46	54.5 Å²	54.5	28%	0.279	26%	0.264	S	S	.	.	H	α-helix	trans	-59	-49.1	176.9	171.5	0	0	0	0	110.6	C171 L246 P247 L248 I252 I253 L254	C171-V250 VanDerWaalsContact SG-CG1 3.6Å; L246-V250 HydrophobicContact CD1-CG2 4.41Å; L246-V250 WeakPolarHBondContact O-CG2 3.34Å; L246-V250 PolarHBondContact O-N 3.19Å; P247-V250 PolarHBondContact O-N 3.27Å; L248-V250 VanDerWaalsContact C-N 3.32Å; L248-V250 PolarHBondContact O-N 3.05Å; V250-I252 PolarHBondContact O-N 3.23Å; V250-I253 PolarHBondContact O-N 3.18Å; V250-L254 HydrophobicContact CG1-CD1 3.64Å; V250-L254 HydrophobicContact CG1-CG 4.24Å; V250-L254 WeakPolarHBondContact O-CB 3.08Å; V250-L254 WeakPolarHBondContact O-CG 3.42Å; V250-L254 PolarHBondContact O-N 2.92Å
251	M	94.3	Very high	94.2	Very high	6 Å²	6	57 Å²	57	3%	0.03	28%	0.276	C	S	.	.	H	α-helix	trans	-61.4	-44.3	179.4	-73.8	-171	-69.3	0	0	112.6	L170 C171 P247 L248 I249 I253 L254 Y255 F398	L170-M251 HydrophobicContact CB-SD 3.97Å; C171-M251 HydrophobicContact CB-CG 4.15Å; C171-M251 HydrophobicContact CB-SD 4.35Å; P247-M251 HydrophobicContact CB-CE 4.42Å; P247-M251 WeakPolarHBondContact O-CB 3.35Å; P247-M251 VanDerWaalsContact O-CG 3.28Å; P247-M251 WeakPolarHBondContact O-CG 3.41Å; P247-M251 PolarHBondContact O-N 3.38Å; L248-M251 PolarHBondContact O-N 2.96Å; I249-M251 PolarHBondContact O-N 3.38Å; M251-I253 PolarHBondContact O-N 2.82Å; M251-L254 PolarHBondContact O-N 3.3Å; M251-Y255 VanDerWaalsContact O-CB 3.29Å; M251-Y255 WeakPolarHBondContact O-CB 3.43Å; M251-Y255 PolarHBondContact O-N 2.9Å; M251-F398 HydrophobicContact CE-CD1 3.51Å; M251-F398 HydrophobicContact CE-CE1 3.11Å; M251-F398 HydrophobicContact CE-CG 4.36Å; M251-F398 HydrophobicContact CE-CZ 3.69Å
252	I	94.2	Very high	93.6	Very high	101 Å²	101	53.4 Å²	53.4	52%	0.518	26%	0.264	S	S	.	.	H	α-helix	trans	-60.3	-47.5	177.6	-70.7	171.9	0	0	0	110.7	L248 I249 V250 Y255 G256	L248-I252 HydrophobicContact CD1-CD1 3.83Å; L248-I252 HydrophobicContact CD1-CG1 4.2Å; L248-I252 HydrophobicContact CG-CD1 3.83Å; L248-I252 HydrophobicContact CG-CG1 4.49Å; L248-I252 WeakPolarHBondContact O-CB 3.27Å; L248-I252 VanDerWaalsContact O-CG1 3.31Å; L248-I252 WeakPolarHBondContact O-CG1 3.42Å; L248-I252 PolarHBondContact O-N 3.07Å; I249-I252 PolarHBondContact O-N 2.75Å; V250-I252 PolarHBondContact O-N 3.23Å; I252-Y255 PolarHBondContact O-N 2.54Å; I252-G256 PolarHBondContact O-N 3.15Å
253	I	96.1	Very high	93	Very high	88 Å²	88	55.3 Å²	55.3	45%	0.451	27%	0.268	S	S	.	.	H	α-helix	trans	-62	-48.5	179.3	-69	168.6	0	0	0	110.6	I249 V250 M251 Y255 G256 R257	I249-I253 HydrophobicContact CG2-CD1 3.75Å; I249-I253 VanDerWaalsContact O-CG1 3.29Å; I249-I253 WeakPolarHBondContact O-CG1 3.27Å; I249-I253 PolarHBondContact O-N 3.03Å; V250-I253 PolarHBondContact O-N 3.18Å; M251-I253 PolarHBondContact O-N 2.82Å; I253-Y255 PolarHBondContact O-N 3.24Å; I253-G256 PolarHBondContact O-N 2.72Å; I253-R257 WeakPolarHBondContact O-CG 3.01Å; I253-R257 PolarHBondContact O-N 3.26Å
254	L	94.9	Very high	92.5	Very high	20 Å²	20	59.2 Å²	59.2	11%	0.105	29%	0.286	C	S	.	.	H	α-helix	trans	-62.8	-44.4	-178.8	-68	174.7	0	0	0	111.3	I175 Y178 V250 M251 R257 I258	I175-L254 HydrophobicContact CB-CD1 4.33Å; I175-L254 HydrophobicContact CG1-CD1 3.51Å; Y178-L254 HydrophobicContact CD1-CD2 3.76Å; Y178-L254 HydrophobicContact CD2-CD2 4.18Å; Y178-L254 HydrophobicContact CE1-CD2 4.25Å; Y178-L254 HydrophobicContact CG-CD2 3.71Å; V250-L254 HydrophobicContact CG1-CD1 3.64Å; V250-L254 HydrophobicContact CG1-CG 4.24Å; V250-L254 WeakPolarHBondContact O-CB 3.08Å; V250-L254 WeakPolarHBondContact O-CG 3.42Å; V250-L254 PolarHBondContact O-N 2.92Å; M251-L254 PolarHBondContact O-N 3.3Å; L254-R257 PolarHBondContact O-N 2.88Å; L254-I258 VanDerWaalsContact O-CG1 3.3Å; L254-I258 WeakPolarHBondContact O-CG1 3.4Å; L254-I258 PolarHBondContact O-N 3.16Å
255	Y	90.6	Very high	91.7	Very high	62 Å²	62	63.6 Å²	63.6	24%	0.243	31%	0.307	C	S	.	.	H	α-helix	trans	-67.9	-41.1	179	-172.1	-105.2	0	0	0	112.5	M251 I252 I253 R257 I258 F259 I388 G392 M395	M251-Y255 VanDerWaalsContact O-CB 3.29Å; M251-Y255 WeakPolarHBondContact O-CB 3.43Å; M251-Y255 PolarHBondContact O-N 2.9Å; I252-Y255 PolarHBondContact O-N 2.54Å; I253-Y255 PolarHBondContact O-N 3.24Å; Y255-R257 VanDerWaalsContact C-N 3.26Å; Y255-R257 PolarHBondContact O-N 2.74Å; Y255-I258 PolarHBondContact O-N 3.44Å; Y255-I258 VanDerWaalsContact O-N 3.17Å; Y255-F259 WeakPolarHBondContact O-CB 3.41Å; Y255-F259 PolarHBondContact O-N 3.5Å; Y255-I388 HydrophobicContact CE2-CG2 4.11Å; Y255-G392 VanDerWaalsContact CZ-CA 3.45Å; Y255-G392 VanDerWaalsContact OH-CA 3.31Å; Y255-G392 WeakPolarHBondContact OH-CA 3.49Å; Y255-M395 VanDerWaalsContact CB-SD 3.55Å; Y255-M395 HydrophobicContact CD1-SD 4.47Å; Y255-M395 HydrophobicContact CD2-CE 3.98Å; Y255-M395 HydrophobicContact CD2-SD 3.36Å; Y255-M395 WeakPolarHBondContact CD2-SD 3.21Å; Y255-M395 HydrophobicContact CE2-SD 4.19Å; Y255-M395 HydrophobicContact CG-CE 4.49Å; Y255-M395 HydrophobicContact CG-SD 3.53Å; Y255-M395 VanDerWaalsContact CG-SD 3.53Å
256	G	92.4	Very high	90.8	Very high	41 Å²	41	65 Å²	65	42%	0.423	32%	0.323	S	S	.	.	H	α-helix	trans	-56	-42.5	173	0	0	0	0	0	111.9	I252 I253 K260	I252-G256 PolarHBondContact O-N 3.15Å; I253-G256 PolarHBondContact O-N 2.72Å; G256-K260 WeakPolarHBondContact O-CB 3.48Å; G256-K260 PolarHBondContact O-N 2.92Å
257	R	93.8	Very high	89.9	Confident	135 Å²	135	69.5 Å²	69.5	51%	0.509	34%	0.335	S	S	.	.	H	α-helix	trans	-67.8	-43.4	174.7	-67.3	178	178.2	-168.3	1.2	112.6	Y178 I253 L254 Y255 F259 K260 L261	Y178-R257 HydrophobicContact CD2-CB 4.2Å; Y178-R257 HydrophobicContact CE2-CB 3.6Å; Y178-R257 HydrophobicContact CE2-CG 4.38Å; I253-R257 WeakPolarHBondContact O-CG 3.01Å; I253-R257 PolarHBondContact O-N 3.26Å; L254-R257 PolarHBondContact O-N 2.88Å; Y255-R257 VanDerWaalsContact C-N 3.26Å; Y255-R257 PolarHBondContact O-N 2.74Å; R257-F259 VanDerWaalsContact C-N 3.32Å; R257-F259 PolarHBondContact O-N 3.45Å; R257-K260 PolarHBondContact O-N 3.28Å; R257-L261 WeakPolarHBondContact O-CB 3.43Å; R257-L261 VanDerWaalsContact O-CG 3.26Å; R257-L261 WeakPolarHBondContact O-CG 3.5Å; R257-L261 PolarHBondContact O-N 3.42Å
258	I	90.6	Very high	88.9	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-57	-48	175.1	-70.2	169	0	0	0	110.3	R177 Y178 I181 L254 Y255 L261 A262 I388	R177-I258 HydrophobicContact CB-CD1 4.35Å; Y178-I258 HydrophobicContact CD2-CG1 3.96Å; I181-I258 HydrophobicContact CD1-CG1 4.38Å; I181-I258 HydrophobicContact CD1-CG2 3.75Å; L254-I258 VanDerWaalsContact O-CG1 3.3Å; L254-I258 WeakPolarHBondContact O-CG1 3.4Å; L254-I258 PolarHBondContact O-N 3.16Å; Y255-I258 PolarHBondContact O-N 3.44Å; Y255-I258 VanDerWaalsContact O-N 3.17Å; I258-L261 PolarHBondContact O-N 3.09Å; I258-A262 WeakPolarHBondContact O-CB 3.46Å; I258-A262 PolarHBondContact O-N 3.24Å; I258-I388 HydrophobicContact CG2-CD1 3.82Å; I258-I388 HydrophobicContact CG2-CG1 3.72Å; I258-I388 HydrophobicContact CG2-CG2 4.2Å
259	F	88.5	Confident	87.6	Confident	107 Å²	107	74 Å²	74	47%	0.469	38%	0.375	S	S	.	.	H	α-helix	trans	-62.8	-44.5	-178.7	-178.2	-98	0	0	0	111.9	Y255 R257 A262 R263	Y255-F259 WeakPolarHBondContact O-CB 3.41Å; Y255-F259 PolarHBondContact O-N 3.5Å; R257-F259 VanDerWaalsContact C-N 3.32Å; R257-F259 PolarHBondContact O-N 3.45Å; F259-A262 PolarHBondContact O-N 3.29Å; F259-R263 PolarHBondContact O-N 3.44Å; F259-R263 VanDerWaalsContact O-N 3.07Å
260	K	90.5	Very high	86	Confident	134 Å²	134	75.7 Å²	75.7	58%	0.583	38%	0.381	S	S	*	.	H	α-helix	trans	-58.6	-50.2	175.9	-176.5	177.8	174.8	180	0	111.3	G256 R257 A262 R263 E264	G256-K260 WeakPolarHBondContact O-CB 3.48Å; G256-K260 PolarHBondContact O-N 2.92Å; R257-K260 PolarHBondContact O-N 3.28Å; K260-A262 VanDerWaalsContact C-N 3.34Å; K260-A262 PolarHBondContact O-N 3.18Å; K260-R263 PolarHBondContact O-N 3.27Å; K260-E264 WeakPolarHBondContact CE-OE1 3.31Å; K260-E264 WeakPolarHBondContact CG-OE1 3.38Å; K260-E264 WeakPolarHBondContact O-CG 3.36Å; K260-E264 PolarHBondContact O-N 3.24Å
261	L	88.1	Confident	84.4	Confident	57 Å²	57	77.2 Å²	77.2	30%	0.298	39%	0.394	S	S	.	.	H	α-helix	trans	-60.8	-42.1	179.5	-69.8	170.9	0	0	0	112.1	T182 R257 I258 R263 E264 M265	T182-L261 HydrophobicContact CG2-CD1 3.35Å; R257-L261 WeakPolarHBondContact O-CB 3.43Å; R257-L261 VanDerWaalsContact O-CG 3.26Å; R257-L261 WeakPolarHBondContact O-CG 3.5Å; R257-L261 PolarHBondContact O-N 3.42Å; I258-L261 PolarHBondContact O-N 3.09Å; L261-R263 VanDerWaalsContact C-N 3.31Å; L261-R263 PolarHBondContact O-N 3.06Å; L261-E264 PolarHBondContact O-N 2.94Å; L261-M265 WeakPolarHBondContact O-CG 3.37Å; L261-M265 PolarHBondContact O-N 2.93Å
262	A	83.6	Confident	82.8	Confident	16 Å²	16	85 Å²	85	13%	0.132	43%	0.427	C	S	.	.	H	α-helix	trans	-63.3	-37.1	177.7	0	0	0	0	0	113.1	I258 F259 K260 M265 S266 I388	I258-A262 WeakPolarHBondContact O-CB 3.46Å; I258-A262 PolarHBondContact O-N 3.24Å; F259-A262 PolarHBondContact O-N 3.29Å; K260-A262 VanDerWaalsContact C-N 3.34Å; K260-A262 PolarHBondContact O-N 3.18Å; A262-M265 HydrophobicContact CB-CE 4.4Å; A262-S266 PolarHBondContact O-N 3.33Å; A262-S266 VanDerWaalsContact O-N 3.08Å; A262-S266 PolarHBondContact O-OG 3.36Å; A262-I388 HydrophobicContact CB-CD1 3.31Å
263	R	85.1	Confident	81.1	Confident	131 Å²	131	85 Å²	85	49%	0.494	43%	0.427	S	S	.	.	H	α-helix	trans	-70.5	-37	175.3	-170.6	177.8	178.3	-166.7	-2.4	112.2	F259 K260 L261 S266 R267	F259-R263 PolarHBondContact O-N 3.44Å; F259-R263 VanDerWaalsContact O-N 3.07Å; K260-R263 PolarHBondContact O-N 3.27Å; L261-R263 VanDerWaalsContact C-N 3.31Å; L261-R263 PolarHBondContact O-N 3.06Å; R263-S266 PolarHBondContact O-N 3.22Å; R263-S266 PolarHBondContact O-OG 2.88Å; R263-R267 VanDerWaalsContact O-CG 3.29Å; R263-R267 WeakPolarHBondContact O-CG 3.26Å; R263-R267 PolarHBondContact O-N 3.14Å
264	E	84.2	Confident	79.3	Confident	85 Å²	85	85 Å²	85	40%	0.397	43%	0.431	S	S	.	.	H	α-helix	trans	-67.1	-39.8	175.4	-73.1	170.4	-175.7	0	0	111.7	K260 L261 R267 S268	K260-E264 WeakPolarHBondContact CE-OE1 3.31Å; K260-E264 WeakPolarHBondContact CG-OE1 3.38Å; K260-E264 WeakPolarHBondContact O-CG 3.36Å; K260-E264 PolarHBondContact O-N 3.24Å; L261-E264 PolarHBondContact O-N 2.94Å; E264-R267 PolarHBondContact O-N 3.41Å; E264-S268 WeakPolarHBondContact O-CB 3.32Å; E264-S268 PolarHBondContact O-N 3.38Å; E264-S268 PolarHBondContact O-OG 3.47Å
265	M	80.6	Confident	77.5	Confident	91 Å²	91	86.1 Å²	86.1	45%	0.448	44%	0.443	S	S	.	.	H	α-helix	trans	-63.5	-41.7	174.4	-71.7	-171.7	-65.5	0	0	112.2	I181 L261 A262 G269	I181-M265 HydrophobicContact CG2-CE 4.4Å; L261-M265 WeakPolarHBondContact O-CG 3.37Å; L261-M265 PolarHBondContact O-N 2.93Å; A262-M265 HydrophobicContact CB-CE 4.4Å; M265-G269 PolarHBondContact O-N 3.19Å
266	S	76.6	Confident	75.8	Confident	69 Å²	69	85.2 Å²	85.2	48%	0.483	45%	0.453	S	S	.	.	H	α-helix	trans	-67.3	-40.2	177.7	67.5	0	0	0	0	112.4	A262 R263 Q270	A262-S266 PolarHBondContact O-N 3.33Å; A262-S266 VanDerWaalsContact O-N 3.08Å; A262-S266 PolarHBondContact O-OG 3.36Å; R263-S266 PolarHBondContact O-N 3.22Å; R263-S266 PolarHBondContact O-OG 2.88Å; S266-Q270 PolarHBondContact O-N 3.01Å; S266-Q270 VanDerWaalsContact O-N 3.13Å
267	R	78	Confident	74	Confident	162 Å²	162	88.4 Å²	88.4	61%	0.611	46%	0.459	S	S	*	.	H	α-helix	trans	-65.7	-45.9	175.3	-72	176.7	70.9	137	6	112.5	R263 E264 G269 Q270 S271	R263-R267 VanDerWaalsContact O-CG 3.29Å; R263-R267 WeakPolarHBondContact O-CG 3.26Å; R263-R267 PolarHBondContact O-N 3.14Å; E264-R267 PolarHBondContact O-N 3.41Å; R267-G269 VanDerWaalsContact C-N 3.33Å; R267-G269 PolarHBondContact O-N 3.35Å; R267-Q270 PolarHBondContact O-N 2.81Å; R267-S271 PolarHBondContact O-N 3.35Å
268	S	76.9	Confident	71.9	Confident	68 Å²	68	85.4 Å²	85.4	48%	0.476	46%	0.459	S	S	.	.	H	α-helix	trans	-66	-37.4	-179.9	-57.6	0	0	0	0	111.7	E264 Q270 K272	E264-S268 WeakPolarHBondContact O-CB 3.32Å; E264-S268 PolarHBondContact O-N 3.38Å; E264-S268 PolarHBondContact O-OG 3.47Å; S268-Q270 VanDerWaalsContact C-N 3.35Å; S268-K272 WeakPolarHBondContact O-CG 3.41Å; S268-K272 PolarHBondContact O-N 2.98Å; S268-K272 VanDerWaalsContact O-N 3.16Å
269	G	67.8	Low	69.9	Low	46 Å²	46	94.7 Å²	94.7	47%	0.474	49%	0.494	S	S	.	.	H	α-helix	trans	-61.8	-40.8	172.4	0	0	0	0	0	112.7	M265 R267 M273	M265-G269 PolarHBondContact O-N 3.19Å; R267-G269 VanDerWaalsContact C-N 3.33Å; R267-G269 PolarHBondContact O-N 3.35Å; G269-M273 PolarHBondContact O-N 3.47Å
270	Q	62.3	Low	68.1	Low	125 Å²	125	95.8 Å²	95.8	58%	0.584	50%	0.498	S	S	*	.	H	α-helix	trans	-71.4	-43	178	-168.5	162.4	9.2	0	0	112.5	S266 R267 S268 K272 M273 T274	S266-Q270 PolarHBondContact O-N 3.01Å; S266-Q270 VanDerWaalsContact O-N 3.13Å; R267-Q270 PolarHBondContact O-N 2.81Å; S268-Q270 VanDerWaalsContact C-N 3.35Å; Q270-K272 PolarHBondContact O-N 3.23Å; Q270-M273 WeakPolarHBondContact O-CB 3.48Å; Q270-M273 PolarHBondContact O-N 3Å; Q270-M273 VanDerWaalsContact O-N 3.15Å; Q270-T274 PolarHBondContact O-N 2.78Å; Q270-T274 PolarHBondContact O-OG1 2.83Å; Q270-T274 VanDerWaalsContact O-OG1 3.13Å
271	S	62.2	Low	66	Low	78 Å²	78	94 Å²	94	55%	0.545	50%	0.502	S	S	.	.	H	α-helix	trans	-60.6	-41.8	177.9	177.4	0	0	0	0	112.7	R267 M273 T274 A275	R267-S271 PolarHBondContact O-N 3.35Å; S271-M273 VanDerWaalsContact C-N 3.31Å; S271-M273 PolarHBondContact O-N 2.93Å; S271-T274 PolarHBondContact O-N 3.39Å; S271-A275 WeakPolarHBondContact O-CB 3.39Å; S271-A275 PolarHBondContact O-N 3.38Å
272	K	61.4	Low	63.8	Low	168 Å²	168	96.7 Å²	96.7	73%	0.73	52%	0.522	S	S	*	.	H	α-helix	trans	-65.3	-34.4	176	-72.3	-176.3	178.7	-173.9	0	112.3	S268 Q270 G276	S268-K272 WeakPolarHBondContact O-CG 3.41Å; S268-K272 PolarHBondContact O-N 2.98Å; S268-K272 VanDerWaalsContact O-N 3.16Å; Q270-K272 PolarHBondContact O-N 3.23Å; K272-G276 PolarHBondContact O-N 3.41Å
273	M	58.2	Low	61.4	Low	103 Å²	103	103.7 Å²	103.7	51%	0.507	55%	0.551	S	S	.	*	H	α-helix	trans	-69.4	-46.5	176	-171.6	178	70.1	0	0	111.7	G269 Q270 S271 A275 G276 I277	G269-M273 PolarHBondContact O-N 3.47Å; Q270-M273 WeakPolarHBondContact O-CB 3.48Å; Q270-M273 PolarHBondContact O-N 3Å; Q270-M273 VanDerWaalsContact O-N 3.15Å; S271-M273 VanDerWaalsContact C-N 3.31Å; S271-M273 PolarHBondContact O-N 2.93Å; M273-A275 PolarHBondContact O-N 2.91Å; M273-G276 PolarHBondContact O-N 3Å; M273-I277 HydrophobicContact CG-CD1 4.31Å; M273-I277 WeakPolarHBondContact O-CG1 3.5Å; M273-I277 PolarHBondContact O-N 3.36Å; M273-I277 VanDerWaalsContact O-N 3.08Å
274	T	58.1	Low	59.1	Low	86 Å²	86	102.8 Å²	102.8	53%	0.528	56%	0.56	S	S	.	*	H	α-helix	trans	-62.6	-41.3	176.5	-50.9	0	0	0	0	111.7	Q270 S271 I277 S278	Q270-T274 PolarHBondContact O-N 2.78Å; Q270-T274 PolarHBondContact O-OG1 2.83Å; Q270-T274 VanDerWaalsContact O-OG1 3.13Å; S271-T274 PolarHBondContact O-N 3.39Å; T274-I277 PolarHBondContact O-N 2.89Å; T274-S278 WeakPolarHBondContact O-CB 3.21Å; T274-S278 PolarHBondContact O-N 3.1Å
275	A	58.2	Low	56.8	Low	45 Å²	45	103.7 Å²	103.7	37%	0.372	57%	0.573	S	S	.	*	H	α-helix	trans	-66	-38.4	176.4	0	0	0	0	0	112.8	S271 M273 S278 R279	S271-A275 WeakPolarHBondContact O-CB 3.39Å; S271-A275 PolarHBondContact O-N 3.38Å; M273-A275 PolarHBondContact O-N 2.91Å; A275-S278 PolarHBondContact O-N 3.18Å; A275-R279 PolarHBondContact O-N 3.04Å
276	G	53.9	Low	54.5	Low	43 Å²	43	108.6 Å²	108.6	44%	0.443	60%	0.595	S	S	.	*	H	α-helix	trans	-66.5	-35.5	175.9	0	0	0	0	0	113.6	K272 M273	K272-G276 PolarHBondContact O-N 3.41Å; M273-G276 PolarHBondContact O-N 3Å
277	I	55.8	Low	52.3	Low	108 Å²	108	110.7 Å²	110.7	55%	0.554	61%	0.606	S	S	*	*	H	α-helix	trans	-70.8	-46.4	173.9	-65.4	167.4	0	0	0	110.3	M273 T274 R279 K280 S281	M273-I277 HydrophobicContact CG-CD1 4.31Å; M273-I277 WeakPolarHBondContact O-CG1 3.5Å; M273-I277 PolarHBondContact O-N 3.36Å; M273-I277 VanDerWaalsContact O-N 3.08Å; T274-I277 PolarHBondContact O-N 2.89Å; I277-R279 PolarHBondContact O-N 3Å; I277-K280 PolarHBondContact O-N 3.46Å; I277-S281 PolarHBondContact O-N 3.16Å
278	S	48.6	Very low	50.1	Low	72 Å²	72	110 Å²	110	50%	0.503	62%	0.619	S	S	.	*	H	α-helix	trans	-64.1	-38.9	-177.7	-168.7	0	0	0	0	113.4	T274 A275 K280 S281 T282	T274-S278 WeakPolarHBondContact O-CB 3.21Å; T274-S278 PolarHBondContact O-N 3.1Å; A275-S278 PolarHBondContact O-N 3.18Å; S278-K280 VanDerWaalsContact C-N 3.3Å; S278-K280 PolarHBondContact O-N 3.39Å; S278-S281 PolarHBondContact O-N 2.63Å; S278-T282 PolarHBondContact O-OG1 2.91Å
279	R	50.1	Low	47.8	Very low	195 Å²	195	111.2 Å²	111.2	74%	0.736	63%	0.627	S	S	*	*	H	α-helix	trans	-62.5	-35.6	176.4	-83.1	-176	172.8	147.7	-2.2	112.7	A275 I277 S281 T282 E283	A275-R279 PolarHBondContact O-N 3.04Å; I277-R279 PolarHBondContact O-N 3Å; R279-S281 VanDerWaalsContact C-N 3.34Å; R279-S281 PolarHBondContact O-N 2.81Å; R279-T282 PolarHBondContact O-N 3.33Å; R279-E283 PolarHBondContact O-N 3.48Å
280	K	49.1	Very low	45.8	Very low	130 Å²	130	115.6 Å²	115.6	57%	0.565	64%	0.64	S	S	*	*	H	α-helix	trans	-72.3	-23.9	177.7	-90.7	-171.5	172.3	-169.4	0	114.2	I277 S278 T282	I277-K280 PolarHBondContact O-N 3.46Å; S278-K280 VanDerWaalsContact C-N 3.3Å; S278-K280 PolarHBondContact O-N 3.39Å; K280-T282 VanDerWaalsContact C-N 3.28Å
281	S	46.4	Very low	44.3	Very low	95 Å²	95	117.8 Å²	117.8	66%	0.664	66%	0.656	S	S	*	*	H	α-helix	trans	-75.3	-17.8	174.8	-61.3	0	0	0	0	113.1	I277 S278 R279	I277-S281 PolarHBondContact O-N 3.16Å; S278-S281 PolarHBondContact O-N 2.63Å; R279-S281 VanDerWaalsContact C-N 3.34Å; R279-S281 PolarHBondContact O-N 2.81Å
282	T	42.8	Very low	42.6	Very low	115 Å²	115	118.6 Å²	118.6	71%	0.706	66%	0.661	S	S	*	*	H	α-helix	trans	-100.6	-27.9	-177.6	-41.7	0	0	0	0	112.8	S278 R279 K280 V284	S278-T282 PolarHBondContact O-OG1 2.91Å; R279-T282 PolarHBondContact O-N 3.33Å; K280-T282 VanDerWaalsContact C-N 3.28Å; T282-V284 VanDerWaalsContact C-N 3.34Å; T282-V284 PolarHBondContact O-N 2.9Å
283	E	34.2	Very low	40.9	Very low	162 Å²	162	119.1 Å²	119.1	76%	0.757	67%	0.666	S	S	*	*			trans	-88.6	65.6	173.1	-77.2	176.5	165.4	0	0	111.5	R279	R279-E283 PolarHBondContact O-N 3.48Å
284	V	35.6	Very low	39.5	Very low	112 Å²	112	120.2 Å²	120.2	68%	0.679	68%	0.684	S	S	*	*			trans	-99.8	111.7	152.8	179.8	0	0	0	0	105.8	T282 E286	T282-V284 VanDerWaalsContact C-N 3.34Å; T282-V284 PolarHBondContact O-N 2.9Å; V284-E286 PolarHBondContact O-N 3.16Å; V284-E286 VanDerWaalsContact O-N 3.08Å
285	P	35.9	Very low	38	Very low	104 Å²	104	125.1 Å²	125.1	68%	0.675	70%	0.701	S	S	*	*			trans	-68	108.6	-179.2	-15.4	28.6	0	0	0	110.3	T287	P285-T287 PolarHBondContact O-N 3.42Å
286	E	32.6	Very low	36.7	Very low	194 Å²	194	128.4 Å²	128.4	91%	0.907	72%	0.718	S	S	*	*			trans	-70.3	73.4	158.9	-77.5	-174.5	163.5	0	0	109.2	V284	V284-E286 PolarHBondContact O-N 3.16Å; V284-E286 VanDerWaalsContact O-N 3.08Å
287	T	29.7	Very low	35.5	Very low	114 Å²	114	134.6 Å²	134.6	70%	0.699	74%	0.739	S	S	*	*			trans	-154.7	90.1	168.5	14	0	0	0	0	108.8	P285	P285-T287 PolarHBondContact O-N 3.42Å
288	V	32.8	Very low	34.1	Very low	148 Å²	148	135.7 Å²	135.7	90%	0.897	75%	0.746	S	S	*	*				-158.1	92.2	112.6	176.4	0	0	0	0	106
289	S	28	Very low	33.2	Very low	92 Å²	92	139.7 Å²	139.7	64%	0.643	76%	0.761	S	S	*	*			trans	-75.5	144.9	159	-167.4	0	0	0	0	108.4
290	N	26.4	Very low	32.1	Very low	139 Å²	139	140.4 Å²	140.4	74%	0.743	77%	0.77	S	S	*	*			trans	67.9	90.5	155.1	-57.3	-18.3	0	0	0	118.3
291	N	30.3	Very low	31.2	Very low	171 Å²	171	138.9 Å²	138.9	91%	0.914	78%	0.776	S	S	*	*				-140.6	128	125.2	-99.5	-21.9	0	0	0	110.5
292	S	26.4	Very low	30.3	Very low	95 Å²	95	140.7 Å²	140.7	66%	0.664	78%	0.777	S	S	*	*			trans	-73.9	151.9	-166.8	47.1	0	0	0	0	114.4
293	H	25.6	Very low	29.6	Very low	178 Å²	178	144.4 Å²	144.4	82%	0.824	79%	0.786	S	S	*	*			trans	69.3	85	164.1	-61.7	-64.6	0	0	0	117.6
294	S	28.4	Very low	29.2	Very low	127 Å²	127	145.5 Å²	145.5	89%	0.888	79%	0.791	S	S	*	*			trans	-162.1	120.1	130.8	-73.9	0	0	0	0	109
295	E	27.4	Very low	28.9	Very low	188 Å²	188	146.7 Å²	146.7	88%	0.879	79%	0.793	S	S	*	*			trans	-66.1	163.5	175.2	-97.5	-178.9	150.7	0	0	113
296	P	31.2	Very low	28.3	Very low	114 Å²	114	150.4 Å²	150.4	74%	0.74	80%	0.801	S	S	*	*			trans	-95.3	131.5	-144.5	34.9	-32.4	0	0	0	113.6
297	I	27.4	Very low	28.1	Very low	173 Å²	173	147.7 Å²	147.7	89%	0.887	79%	0.791	S	S	*	*			trans	-129.4	75.2	156.2	-50.9	176	0	0	0	107.3
298	L	28.1	Very low	27.9	Very low	132 Å²	132	147.7 Å²	147.7	69%	0.691	79%	0.791	S	S	*	*			trans	-139	71.7	165	-171.4	69.9	0	0	0	108.4
299	D	28.2	Very low	27.8	Very low	155 Å²	155	146.4 Å²	146.4	83%	0.829	79%	0.789	S	S	*	*			trans	-147.7	90.5	165.3	-143.2	2.6	0	0	0	107.7
300	K	28.4	Very low	27.6	Very low	210 Å²	210	147 Å²	147	91%	0.913	79%	0.789	S	S	*	*	S	Bend	trans	174.5	2.5	153.7	-97.9	165.7	-173.2	-177.1	0	118
301	S	28.7	Very low	27.7	Very low	98 Å²	98	147.4 Å²	147.4	69%	0.685	79%	0.791	S	S	*	*	S	Bend	trans	-130	19.3	-176.7	52.2	0	0	0	0	117
302	I	27.4	Very low	27.5	Very low	134 Å²	134	147 Å²	147	69%	0.687	79%	0.787	S	S	*	*	S	Bend	trans	-89.8	-4.6	174	-68.7	179.7	0	0	0	113.3	E304	I302-E304 PolarHBondContact O-N 2.9Å
303	Q	29.2	Very low	27.4	Very low	192 Å²	192	148.8 Å²	148.8	90%	0.897	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	5.4	-171.7	-149.5	151.2	11.8	0	0	116.9
304	E	26.4	Very low	27.4	Very low	186 Å²	186	148.1 Å²	148.1	87%	0.869	79%	0.792	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.1	19.7	179.3	-71.5	-168.9	165.6	0	0	116.4	I302 Q306	I302-E304 PolarHBondContact O-N 2.9Å; E304-Q306 PolarHBondContact O-N 3.37Å
305	L	27.7	Very low	27	Very low	136 Å²	136	152.4 Å²	152.4	71%	0.712	79%	0.79	S	S	*	*			trans	-82.3	52.1	169.2	-96.6	153.8	0	0	0	112.3	I307	L305-I307 HydrophobicContact CD2-CD1 3.34Å; L305-I307 HydrophobicContact CD2-CG1 3.77Å; L305-I307 PolarHBondContact O-N 3.27Å
306	Q	25.1	Very low	26.9	Very low	183 Å²	183	149 Å²	149	86%	0.855	78%	0.781	S	S	*	*			trans	-87.2	66	154.8	-80.2	-176.3	-57.7	0	0	108.4	E304 T308	E304-Q306 PolarHBondContact O-N 3.37Å; Q306-T308 VanDerWaalsContact C-N 3.33Å; Q306-T308 PolarHBondContact O-N 3.26Å
307	I	28.4	Very low	26.5	Very low	136 Å²	136	150.7 Å²	150.7	70%	0.697	78%	0.78	S	S	*	*			trans	-75.9	95.4	170.5	-65.8	175.7	0	0	0	107.8	L305 S309	L305-I307 HydrophobicContact CD2-CD1 3.34Å; L305-I307 HydrophobicContact CD2-CG1 3.77Å; L305-I307 PolarHBondContact O-N 3.27Å; I307-S309 PolarHBondContact O-N 3.34Å; I307-S309 VanDerWaalsContact O-N 3.12Å
308	T	25.3	Very low	26.4	Very low	114 Å²	114	146.2 Å²	146.2	70%	0.699	76%	0.764	S	S	*	*			trans	-44.9	111.3	163.4	-24	0	0	0	0	109.3	Q306 T310	Q306-T308 VanDerWaalsContact C-N 3.33Å; Q306-T308 PolarHBondContact O-N 3.26Å; T308-T310 VanDerWaalsContact C-N 3.35Å; T308-T310 PolarHBondContact O-N 2.93Å; T308-T310 PolarHBondContact O-OG1 2.98Å
309	S	29.3	Very low	26.3	Very low	122 Å²	122	146.3 Å²	146.3	85%	0.853	77%	0.765	S	S	*	*			trans	-57.7	90.3	175.1	52	0	0	0	0	110.9	I307	I307-S309 PolarHBondContact O-N 3.34Å; I307-S309 VanDerWaalsContact O-N 3.12Å
310	T	25.3	Very low	26.2	Very low	103 Å²	103	145.1 Å²	145.1	63%	0.632	76%	0.758	S	S	*	*			trans	-147	108.2	172.9	-19.3	0	0	0	0	110.1	T308	T308-T310 VanDerWaalsContact C-N 3.35Å; T308-T310 PolarHBondContact O-N 2.93Å; T308-T310 PolarHBondContact O-OG1 2.98Å
311	N	26.8	Very low	26.2	Very low	148 Å²	148	144.1 Å²	144.1	79%	0.791	76%	0.757	S	S	*	*			trans	53.8	83.6	157.5	-60.4	-7.9	0	0	0	118.6
312	I	27.7	Very low	26	Very low	162 Å²	162	147.7 Å²	147.7	83%	0.831	76%	0.763	S	S	*	*			trans	-128.8	86.6	145.1	-55.3	177.5	0	0	0	107.4
313	T	24.3	Very low	26	Very low	134 Å²	134	147.7 Å²	147.7	82%	0.822	76%	0.762	S	S	*	*			trans	-105.8	83.6	155.1	40.2	0	0	0	0	106.1
314	E	24.2	Very low	25.9	Very low	164 Å²	164	145.1 Å²	145.1	77%	0.766	76%	0.76	S	S	*	*			trans	-109.7	109.1	163	-154.9	165.2	-151.2	0	0	106.3	V316	E314-V316 PolarHBondContact O-N 3.46Å
315	Y	21.2	Very low	25.9	Very low	216 Å²	216	142.7 Å²	142.7	85%	0.847	76%	0.758	S	S	*	*			trans	-60.4	100.2	172.9	-96	-105.7	0	0	0	108
316	V	24.9	Very low	25.8	Very low	116 Å²	116	145.6 Å²	145.6	70%	0.703	77%	0.765	S	S	*	*			trans	-98.8	86.3	159.3	-176.9	0	0	0	0	106.8	E314 S318	E314-V316 PolarHBondContact O-N 3.46Å; V316-S318 PolarHBondContact O-N 3.17Å; V316-S318 VanDerWaalsContact O-N 3.16Å
317	Q	22.4	Very low	25.9	Very low	150 Å²	150	141.2 Å²	141.2	70%	0.701	76%	0.76	S	S	*	*			trans	-67.1	101.2	159	-174.1	168.4	-16.5	0	0	106.2
318	S	25.8	Very low	25.9	Very low	79 Å²	79	142.2 Å²	142.2	55%	0.552	77%	0.765	S	S	*	*			trans	-106.8	103	166.6	38.7	0	0	0	0	106.7	V316 D320	V316-S318 PolarHBondContact O-N 3.17Å; V316-S318 VanDerWaalsContact O-N 3.16Å; S318-D320 PolarHBondContact O-N 3.39Å
319	D	24.5	Very low	26	Very low	134 Å²	134	143.3 Å²	143.3	72%	0.717	77%	0.766	S	S	*	*			trans	-69.3	82	168.7	-65.3	-38.3	0	0	0	108.2
320	D	26.5	Very low	26	Very low	130 Å²	130	145.2 Å²	145.2	70%	0.695	77%	0.767	S	S	*	*			trans	-133.5	58.6	170.7	-85.7	-40.7	0	0	0	110.1	S318 H322	S318-D320 PolarHBondContact O-N 3.39Å; D320-H322 VanDerWaalsContact C-N 3.27Å
321	E	28.1	Very low	26.2	Very low	190 Å²	190	143.6 Å²	143.6	89%	0.888	77%	0.771	S	S	*	*			trans	-86	10	172.1	-146.3	175.3	-168	0	0	113
322	H	25.9	Very low	26.1	Very low	173 Å²	173	142.6 Å²	142.6	80%	0.801	77%	0.77	S	S	*	*	S	Bend	trans	-121.1	11.9	-165.2	-113.4	-63.8	0	0	0	119.5	D320	D320-H322 VanDerWaalsContact C-N 3.27Å
323	I	26.3	Very low	26.2	Very low	133 Å²	133	144.9 Å²	144.9	68%	0.682	77%	0.774	S	S	*	*	S	Bend	trans	-107.1	-4.3	179.2	-57.9	-177.6	0	0	0	114.7	T325	I323-T325 PolarHBondContact O-N 2.87Å
324	V	28.4	Very low	26.4	Very low	139 Å²	139	146.9 Å²	146.9	84%	0.842	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-12.4	-169.3	-178.6	0	0	0	0	115.7
325	T	26.1	Very low	26.7	Very low	134 Å²	134	146.2 Å²	146.2	82%	0.822	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	3.8	-178	31.1	0	0	0	0	116.9	I323	I323-T325 PolarHBondContact O-N 2.87Å
326	K	24.2	Very low	27.3	Very low	197 Å²	197	145 Å²	145	86%	0.857	78%	0.775	S	S	*	*	S	Bend	trans	-101.7	0.4	-178.7	-101.4	-177.2	179.5	177.9	0	117.4
327	A	27.3	Very low	27.9	Very low	92 Å²	92	144.2 Å²	144.2	76%	0.76	77%	0.767	S	S	*	*	S	Bend	trans	-97.3	-6.7	-177.4	0	0	0	0	0	115.9
328	I	29.2	Very low	28.8	Very low	156 Å²	156	142.9 Å²	142.9	80%	0.8	77%	0.769	S	S	*	*	S	Bend	trans	-88.5	-16.9	-178.6	-62.4	-179.8	0	0	0	113
329	N	27.6	Very low	29.7	Very low	137 Å²	137	143.8 Å²	143.8	73%	0.733	77%	0.768	S	S	*	*	S	Bend	trans	-109.1	85.3	177.5	-72.5	-8.5	0	0	0	110.3
330	N	28.3	Very low	30.6	Very low	162 Å²	162	141.7 Å²	141.7	87%	0.866	76%	0.756	S	S	*	*			trans	-170	121.3	130.8	-90.2	-21.5	0	0	0	110.6
331	G	29.5	Very low	31.6	Very low	69 Å²	69	140.7 Å²	140.7	71%	0.711	75%	0.75	S	S	*	*			trans	-65.8	150.5	179.3	0	0	0	0	0	113.4
332	V	26.2	Very low	32.1	Very low	127 Å²	127	135.7 Å²	135.7	77%	0.77	74%	0.735	S	S	*	*			trans	30	100.6	140.8	-168.9	0	0	0	0	115.6	K334	V332-K334 HydrophobicContact CG1-CG 4.48Å
333	K	28.1	Very low	33	Very low	211 Å²	211	132.3 Å²	132.3	92%	0.917	72%	0.718	S	S	*	*			trans	-121.7	118.8	131	-79	-172	175.7	-179.2	0	108.2
334	K	30	Very low	33.8	Very low	175 Å²	175	129 Å²	129	76%	0.761	71%	0.711	S	S	*	*			trans	-66.5	150.9	164.9	-76.4	174.2	171.3	175.8	0	108	V332	V332-K334 HydrophobicContact CG1-CG 4.48Å
335	D	30	Very low	34.6	Very low	151 Å²	151	131.2 Å²	131.2	81%	0.807	70%	0.704	S	S	*	*			trans	104.5	117.9	167.6	-52.7	-26	0	0	0	114.9
336	E	34.6	Very low	35.7	Very low	189 Å²	189	129.7 Å²	129.7	88%	0.883	69%	0.687	S	S	*	*			trans	59.2	93.6	161.5	-61.9	-178.6	160	0	0	118
337	D	36.8	Very low	36.3	Very low	100 Å²	100	128.5 Å²	128.5	54%	0.535	68%	0.679	S	S	.	*				-173.5	115.3	109.6	-129.8	-28.2	0	0	0	111.7	N339 D340	D337-N339 HydrophobicContact CB-CB 4.42Å; D337-N339 PolarHBondContact O-N 3.21Å; D337-D340 PolarHBondContact O-N 3.04Å; D337-D340 VanDerWaalsContact O-N 3.1Å
338	T	41.8	Very low	37	Very low	123 Å²	123	128.7 Å²	128.7	76%	0.755	67%	0.667	S	S	*	*	H	α-helix	trans	-56	-18.8	171.3	-6.3	0	0	0	0	112.6
339	N	44.1	Very low	37.9	Very low	97 Å²	97	129 Å²	129	52%	0.519	66%	0.662	S	S	.	*	H	α-helix	trans	-71.6	-28.9	179.1	-127.2	-8.6	0	0	0	113.2	D337 K343	D337-N339 HydrophobicContact CB-CB 4.42Å; D337-N339 PolarHBondContact O-N 3.21Å; N339-K343 WeakPolarHBondContact O-CG 3.37Å; N339-K343 PolarHBondContact O-N 2.81Å
340	D	42.6	Very low	39.1	Very low	90 Å²	90	129.7 Å²	129.7	48%	0.481	66%	0.655	S	S	.	*	H	α-helix	trans	-81.7	-26.9	-175.9	-76.3	-11.3	0	0	0	113	D337 K343 A344	D337-D340 PolarHBondContact O-N 3.04Å; D337-D340 VanDerWaalsContact O-N 3.1Å; D340-K343 PolarHBondContact O-N 3.39Å; D340-K343 IonicContact OD1-NZ 3.76Å; D340-K343 PolarHBondContact OD1-NZ 3.43Å; D340-A344 WeakPolarHBondContact O-CB 3.33Å; D340-A344 PolarHBondContact O-N 3.06Å
341	I	47.6	Very low	40.4	Very low	110 Å²	110	127.4 Å²	127.4	56%	0.564	64%	0.642	S	S	*	*	H	α-helix	trans	-68.8	-39.1	172.5	-59.4	176.2	0	0	0	110.9	A344 R345	I341-A344 PolarHBondContact O-N 2.92Å; I341-R345 PolarHBondContact O-N 3.02Å
342	C	40.5	Very low	41.5	Very low	85 Å²	85	128.6 Å²	128.6	57%	0.574	63%	0.632	S	S	*	*	H	α-helix	trans	-65.1	-42.7	174.4	-78.8	0	0	0	0	111.7	R345 E346	C342-R345 PolarHBondContact O-N 3.24Å; C342-E346 PolarHBondContact O-N 3.21Å
343	K	43.8	Very low	43.1	Very low	102 Å²	102	124.7 Å²	124.7	44%	0.443	61%	0.61	S	S	.	*	H	α-helix	trans	-62.4	-45.9	174.7	-69.2	172.1	-161.5	155.6	0	111.6	N339 D340 R345 E346 Y347	N339-K343 WeakPolarHBondContact O-CG 3.37Å; N339-K343 PolarHBondContact O-N 2.81Å; D340-K343 PolarHBondContact O-N 3.39Å; D340-K343 IonicContact OD1-NZ 3.76Å; D340-K343 PolarHBondContact OD1-NZ 3.43Å; K343-R345 PolarHBondContact O-N 2.95Å; K343-E346 PolarHBondContact O-N 2.89Å; K343-Y347 WeakPolarHBondContact O-CD2 3.41Å; K343-Y347 PolarHBondContact O-N 2.88Å
344	A	43.5	Very low	44.5	Very low	63 Å²	63	121.1 Å²	121.1	52%	0.521	59%	0.592	S	S	.	*	H	α-helix	trans	-60.1	-44.3	179.2	0	0	0	0	0	112.4	D340 I341 E346 Y347 D348	D340-A344 WeakPolarHBondContact O-CB 3.33Å; D340-A344 PolarHBondContact O-N 3.06Å; I341-A344 PolarHBondContact O-N 2.92Å; A344-E346 VanDerWaalsContact C-N 3.34Å; A344-E346 PolarHBondContact O-N 2.76Å; A344-Y347 PolarHBondContact O-N 3.36Å; A344-D348 PolarHBondContact O-N 3.39Å; A344-D348 VanDerWaalsContact O-N 3.08Å
345	R	45.3	Very low	46.4	Very low	186 Å²	186	115.5 Å²	115.5	70%	0.702	58%	0.575	S	S	*	*	H	α-helix	trans	-63.6	-36.3	174.8	-86.9	-178.5	170.4	167.2	-1.8	113.1	I341 C342 K343 K349	I341-R345 PolarHBondContact O-N 3.02Å; C342-R345 PolarHBondContact O-N 3.24Å; K343-R345 PolarHBondContact O-N 2.95Å; R345-K349 WeakPolarHBondContact O-CG 3.15Å; R345-K349 PolarHBondContact O-N 2.93Å; R345-K349 VanDerWaalsContact O-N 3.11Å
346	E	49.4	Very low	48	Very low	102 Å²	102	111.6 Å²	111.6	48%	0.477	56%	0.559	S	S	.	*	H	α-helix	trans	-72.8	-37.4	177.9	-172.1	157.1	164.4	0	0	112.4	C342 K343 A344 K349 R350	C342-E346 PolarHBondContact O-N 3.21Å; K343-E346 PolarHBondContact O-N 2.89Å; A344-E346 VanDerWaalsContact C-N 3.34Å; A344-E346 PolarHBondContact O-N 2.76Å; E346-K349 PolarHBondContact O-N 2.97Å; E346-R350 WeakPolarHBondContact O-CG 3.43Å; E346-R350 PolarHBondContact O-N 3.4Å; E346-R350 IonicContact OE1-CZ 3.97Å; E346-R350 IonicContact OE1-NE 3.82Å; E346-R350 PolarHBondContact OE1-NE 3.18Å; E346-R350 IonicContact OE1-NH2 2.68Å; E346-R350 PolarHBondContact OE1-NH2 2.77Å
347	Y	36.9	Very low	49.6	Very low	172 Å²	172	110.1 Å²	110.1	68%	0.675	55%	0.545	S	S	*	.	H	α-helix	trans	-59.7	-45.5	171.7	-94.9	-82.7	0	0	0	111.8	K343 A344 R350 L351	K343-Y347 WeakPolarHBondContact O-CD2 3.41Å; K343-Y347 PolarHBondContact O-N 2.88Å; A344-Y347 PolarHBondContact O-N 3.36Å; Y347-R350 PolarHBondContact O-N 3.28Å; Y347-L351 WeakPolarHBondContact O-CB 3.36Å; Y347-L351 PolarHBondContact O-N 3.37Å
348	D	41.5	Very low	51.3	Low	96 Å²	96	110.5 Å²	110.5	51%	0.513	54%	0.542	S	S	.	.	H	α-helix	trans	-66.3	-38.9	180	-159.9	23.9	0	0	0	112.1	A344 L351 N352	A344-D348 PolarHBondContact O-N 3.39Å; A344-D348 VanDerWaalsContact O-N 3.08Å; D348-L351 PolarHBondContact O-N 3.48Å; D348-N352 WeakPolarHBondContact O-CB 3.49Å; D348-N352 PolarHBondContact O-N 3.46Å; D348-N352 PolarHBondContact O-ND2 2.98Å; D348-N352 VanDerWaalsContact O-ND2 3.14Å
349	K	49	Very low	52.6	Low	161 Å²	161	109.9 Å²	109.9	70%	0.7	53%	0.534	S	S	*	.	H	α-helix	trans	-62.3	-42.8	170.8	-78.5	-178.1	179.5	-179.1	0	112.5	R345 E346 S353	R345-K349 WeakPolarHBondContact O-CG 3.15Å; R345-K349 PolarHBondContact O-N 2.93Å; R345-K349 VanDerWaalsContact O-N 3.11Å; E346-K349 PolarHBondContact O-N 2.97Å; K349-S353 WeakPolarHBondContact O-CB 3.48Å; K349-S353 PolarHBondContact O-N 3.23Å
350	R	52.7	Low	53.8	Low	153 Å²	153	110.5 Å²	110.5	58%	0.577	54%	0.537	S	S	*	.	H	α-helix	trans	-64.8	-43	177.7	-76.2	-178.3	-170.1	-172.4	5.5	111.2	E346 Y347 S353 Y354	E346-R350 WeakPolarHBondContact O-CG 3.43Å; E346-R350 PolarHBondContact O-N 3.4Å; E346-R350 IonicContact OE1-CZ 3.97Å; E346-R350 IonicContact OE1-NE 3.82Å; E346-R350 PolarHBondContact OE1-NE 3.18Å; E346-R350 IonicContact OE1-NH2 2.68Å; E346-R350 PolarHBondContact OE1-NH2 2.77Å; Y347-R350 PolarHBondContact O-N 3.28Å; R350-S353 PolarHBondContact O-N 3.45Å; R350-S353 PolarHBondContact O-OG 2.77Å; R350-Y354 WeakPolarHBondContact O-CB 3.36Å; R350-Y354 PolarHBondContact O-N 2.75Å
351	L	54.8	Low	55	Low	114 Å²	114	109.4 Å²	109.4	60%	0.597	53%	0.533	S	S	*	.	H	α-helix	trans	-61.6	-46.7	178.2	-168.4	72.4	0	0	0	111.6	Y347 D348 S353 Y354 S355	Y347-L351 WeakPolarHBondContact O-CB 3.36Å; Y347-L351 PolarHBondContact O-N 3.37Å; D348-L351 PolarHBondContact O-N 3.48Å; L351-S353 PolarHBondContact O-N 2.99Å; L351-Y354 PolarHBondContact O-N 2.95Å; L351-S355 WeakPolarHBondContact O-CB 3.34Å; L351-S355 PolarHBondContact O-N 3.28Å
352	N	51.5	Low	56	Low	93 Å²	93	107.7 Å²	107.7	50%	0.497	53%	0.525	S	S	.	.	H	α-helix	trans	-63.2	-40.1	174.8	-75.7	-40.8	0	0	0	112.1	D348 Y354 S356	D348-N352 WeakPolarHBondContact O-CB 3.49Å; D348-N352 PolarHBondContact O-N 3.46Å; D348-N352 PolarHBondContact O-ND2 2.98Å; D348-N352 VanDerWaalsContact O-ND2 3.14Å; N352-Y354 VanDerWaalsContact C-N 3.3Å; N352-Y354 PolarHBondContact O-N 3.06Å; N352-S356 WeakPolarHBondContact O-CB 3.44Å; N352-S356 PolarHBondContact O-N 3.3Å; N352-S356 PolarHBondContact O-OG 3.17Å; N352-S356 VanDerWaalsContact O-OG 3.05Å
353	S	60	Low	57.2	Low	45 Å²	45	106.5 Å²	106.5	32%	0.315	52%	0.518	S	S	.	.	H	α-helix	trans	-65	-33.7	176.1	87.5	0	0	0	0	113.2	K349 R350 L351 R357	K349-S353 WeakPolarHBondContact O-CB 3.48Å; K349-S353 PolarHBondContact O-N 3.23Å; R350-S353 PolarHBondContact O-N 3.45Å; R350-S353 PolarHBondContact O-OG 2.77Å; L351-S353 PolarHBondContact O-N 2.99Å; S353-R357 WeakPolarHBondContact O-CB 3.5Å; S353-R357 WeakPolarHBondContact O-CG 3.47Å; S353-R357 PolarHBondContact O-N 2.87Å; S353-R357 VanDerWaalsContact O-N 3.16Å; S353-R357 PolarHBondContact O-NE 3.35Å; S353-R357 PolarHBondContact OG-NH2 3.35Å
354	Y	58.7	Low	58.6	Low	136 Å²	136	107.6 Å²	107.6	53%	0.533	53%	0.526	S	S	.	.	H	α-helix	trans	-76.1	-46.5	178.9	179	-92.6	0	0	0	110.6	R350 L351 N352 S356 R357 K358	R350-Y354 WeakPolarHBondContact O-CB 3.36Å; R350-Y354 PolarHBondContact O-N 2.75Å; L351-Y354 PolarHBondContact O-N 2.95Å; N352-Y354 VanDerWaalsContact C-N 3.3Å; N352-Y354 PolarHBondContact O-N 3.06Å; Y354-S356 PolarHBondContact O-N 3.36Å; Y354-R357 PolarHBondContact O-N 3.38Å; Y354-K358 HydrophobicContact CE1-CD 4.15Å; Y354-K358 WeakPolarHBondContact O-CB 3.37Å; Y354-K358 PolarHBondContact O-N 2.86Å
355	S	69.4	Low	59.7	Low	58 Å²	58	109.1 Å²	109.1	41%	0.406	53%	0.525	S	S	.	.	H	α-helix	trans	-56.2	-48.5	174.7	-177.1	0	0	0	0	111.4	L351 R357 K358 L359	L351-S355 WeakPolarHBondContact O-CB 3.34Å; L351-S355 PolarHBondContact O-N 3.28Å; S355-R357 PolarHBondContact O-N 3.37Å; S355-K358 PolarHBondContact O-N 3.34Å; S355-L359 WeakPolarHBondContact O-CB 3.41Å; S355-L359 WeakPolarHBondContact O-CG 3.39Å; S355-L359 PolarHBondContact O-N 3.21Å
356	S	64.5	Low	60.7	Low	68 Å²	68	104.5 Å²	104.5	48%	0.476	52%	0.518	S	S	.	.	H	α-helix	trans	-62	-41.3	177.1	-65.3	0	0	0	0	112.7	N352 Y354 L360	N352-S356 WeakPolarHBondContact O-CB 3.44Å; N352-S356 PolarHBondContact O-N 3.3Å; N352-S356 PolarHBondContact O-OG 3.17Å; N352-S356 VanDerWaalsContact O-OG 3.05Å; Y354-S356 PolarHBondContact O-N 3.36Å; S356-L360 VanDerWaalsContact O-CG 3.29Å; S356-L360 WeakPolarHBondContact O-CG 3.29Å; S356-L360 PolarHBondContact O-N 3.29Å
357	R	67.8	Low	61.5	Low	158 Å²	158	102.2 Å²	102.2	60%	0.596	51%	0.511	S	S	*	.	H	α-helix	trans	-65.9	-42.6	175.2	-85.9	-175.8	-79.5	176.7	-7.2	112.2	S353 Y354 S355 L360 T361	S353-R357 WeakPolarHBondContact O-CB 3.5Å; S353-R357 WeakPolarHBondContact O-CG 3.47Å; S353-R357 PolarHBondContact O-N 2.87Å; S353-R357 VanDerWaalsContact O-N 3.16Å; S353-R357 PolarHBondContact O-NE 3.35Å; S353-R357 PolarHBondContact OG-NH2 3.35Å; Y354-R357 PolarHBondContact O-N 3.38Å; S355-R357 PolarHBondContact O-N 3.37Å; R357-L360 PolarHBondContact O-N 3.4Å; R357-T361 WeakPolarHBondContact O-CG2 3.42Å; R357-T361 PolarHBondContact O-N 3.17Å; R357-T361 PolarHBondContact O-OG1 2.96Å
358	K	72.8	Confident	63	Low	108 Å²	108	97.1 Å²	97.1	47%	0.47	50%	0.5	S	S	.	.	H	α-helix	trans	-62.3	-44.7	178	-172.8	173.5	179.5	177.4	0	111.5	Y354 S355 L360 T361 D362	Y354-K358 HydrophobicContact CE1-CD 4.15Å; Y354-K358 WeakPolarHBondContact O-CB 3.37Å; Y354-K358 PolarHBondContact O-N 2.86Å; S355-K358 PolarHBondContact O-N 3.34Å; K358-L360 VanDerWaalsContact C-N 3.34Å; K358-L360 PolarHBondContact O-N 3.38Å; K358-T361 WeakPolarHBondContact CA-OG1 3.42Å; K358-T361 PolarHBondContact O-N 3.07Å; K358-T361 PolarHBondContact O-OG1 3.02Å; K358-D362 WeakPolarHBondContact O-CB 3.42Å; K358-D362 VanDerWaalsContact O-CG 3.23Å; K358-D362 PolarHBondContact O-N 3.38Å
359	L	69	Low	64.2	Low	111 Å²	111	97.8 Å²	97.8	58%	0.581	50%	0.501	S	S	*	.	H	α-helix	trans	-61.7	-40.6	174.6	-71.6	172.3	0	0	0	112.2	S355 S363	S355-L359 WeakPolarHBondContact O-CB 3.41Å; S355-L359 WeakPolarHBondContact O-CG 3.39Å; S355-L359 PolarHBondContact O-N 3.21Å; L359-S363 VanDerWaalsContact O-CB 3.28Å; L359-S363 WeakPolarHBondContact O-CB 3.29Å; L359-S363 PolarHBondContact O-N 3.13Å; L359-S363 PolarHBondContact O-OG 3.49Å
360	L	69.5	Low	64.9	Low	109 Å²	109	94.7 Å²	94.7	57%	0.571	49%	0.491	S	S	*	.	H	α-helix	trans	-64.9	-45.4	174.6	-72.5	172.4	0	0	0	111.6	S356 R357 K358 S363 M364	S356-L360 VanDerWaalsContact O-CG 3.29Å; S356-L360 WeakPolarHBondContact O-CG 3.29Å; S356-L360 PolarHBondContact O-N 3.29Å; R357-L360 PolarHBondContact O-N 3.4Å; K358-L360 VanDerWaalsContact C-N 3.34Å; K358-L360 PolarHBondContact O-N 3.38Å; L360-S363 PolarHBondContact O-N 3.16Å; L360-S363 PolarHBondContact O-OG 2.88Å; L360-M364 WeakPolarHBondContact O-CB 3.4Å; L360-M364 WeakPolarHBondContact O-CG 3.26Å; L360-M364 PolarHBondContact O-N 3.05Å
361	T	66.6	Low	65.6	Low	67 Å²	67	91.1 Å²	91.1	41%	0.411	49%	0.489	S	S	.	.	H	α-helix	trans	-64.3	-41	178	51.5	0	0	0	0	112.3	R357 K358 M364 N365	R357-T361 WeakPolarHBondContact O-CG2 3.42Å; R357-T361 PolarHBondContact O-N 3.17Å; R357-T361 PolarHBondContact O-OG1 2.96Å; K358-T361 WeakPolarHBondContact CA-OG1 3.42Å; K358-T361 PolarHBondContact O-N 3.07Å; K358-T361 PolarHBondContact O-OG1 3.02Å; T361-M364 PolarHBondContact O-N 2.93Å; T361-N365 WeakPolarHBondContact O-CB 3.31Å; T361-N365 VanDerWaalsContact O-CG 3.3Å; T361-N365 PolarHBondContact O-N 3.49Å
362	D	69.8	Low	66.4	Low	75 Å²	75	94.5 Å²	94.5	40%	0.401	49%	0.494	S	S	.	.	H	α-helix	trans	-65.6	-41.4	176.7	-70	-15.6	0	0	0	110.3	K358 M364 N365 V366	K358-D362 WeakPolarHBondContact O-CB 3.42Å; K358-D362 VanDerWaalsContact O-CG 3.23Å; K358-D362 PolarHBondContact O-N 3.38Å; D362-M364 VanDerWaalsContact C-N 3.35Å; D362-M364 PolarHBondContact O-N 3.26Å; D362-N365 PolarHBondContact O-N 2.96Å; D362-V366 WeakPolarHBondContact O-CB 3.48Å; D362-V366 VanDerWaalsContact O-CG2 3.23Å; D362-V366 WeakPolarHBondContact O-CG2 3.32Å; D362-V366 PolarHBondContact O-N 3.47Å
363	S	65	Low	67.1	Low	60 Å²	60	94.8 Å²	94.8	42%	0.42	49%	0.493	S	S	.	.	H	α-helix	trans	-62.9	-40	174.5	80.4	0	0	0	0	112.3	L359 L360 T367	L359-S363 VanDerWaalsContact O-CB 3.28Å; L359-S363 WeakPolarHBondContact O-CB 3.29Å; L359-S363 PolarHBondContact O-N 3.13Å; L359-S363 PolarHBondContact O-OG 3.49Å; L360-S363 PolarHBondContact O-N 3.16Å; L360-S363 PolarHBondContact O-OG 2.88Å; S363-T367 WeakPolarHBondContact O-CB 3.43Å; S363-T367 VanDerWaalsContact O-CG2 3.31Å; S363-T367 WeakPolarHBondContact O-CG2 3.39Å; S363-T367 PolarHBondContact O-N 3.34Å; S363-T367 PolarHBondContact O-OG1 2.9Å; S363-T367 VanDerWaalsContact O-OG1 3.1Å
364	M	72.2	Confident	67.4	Low	125 Å²	125	95 Å²	95	62%	0.616	50%	0.497	S	S	*	.	H	α-helix	trans	-65.7	-46	176.1	-77.7	178.6	151.2	0	0	111.1	L360 T361 D362 T367 S368	L360-M364 WeakPolarHBondContact O-CB 3.4Å; L360-M364 WeakPolarHBondContact O-CG 3.26Å; L360-M364 PolarHBondContact O-N 3.05Å; T361-M364 PolarHBondContact O-N 2.93Å; D362-M364 VanDerWaalsContact C-N 3.35Å; D362-M364 PolarHBondContact O-N 3.26Å; M364-T367 WeakPolarHBondContact CA-OG1 3.24Å; M364-T367 PolarHBondContact O-N 2.96Å; M364-T367 PolarHBondContact O-OG1 2.91Å; M364-S368 WeakPolarHBondContact O-CB 3.37Å; M364-S368 PolarHBondContact O-N 3.06Å
365	N	66.7	Low	67.7	Low	94 Å²	94	95.2 Å²	95.2	50%	0.503	50%	0.502	S	S	.	.	H	α-helix	trans	-60.9	-48.8	177.6	-74.1	-17.4	0	0	0	111.1	T361 D362 T367 S368 E369	T361-N365 WeakPolarHBondContact O-CB 3.31Å; T361-N365 VanDerWaalsContact O-CG 3.3Å; T361-N365 PolarHBondContact O-N 3.49Å; D362-N365 PolarHBondContact O-N 2.96Å; N365-T367 VanDerWaalsContact C-N 3.33Å; N365-T367 PolarHBondContact O-N 2.87Å; N365-S368 WeakPolarHBondContact O-CB 3.34Å; N365-S368 PolarHBondContact O-N 3.31Å; N365-S368 VanDerWaalsContact O-N 3.11Å; N365-S368 PolarHBondContact O-OG 2.95Å; N365-E369 WeakPolarHBondContact O-CG 3.48Å; N365-E369 PolarHBondContact O-N 3.45Å
366	V	67.9	Low	67.5	Low	90 Å²	90	94.3 Å²	94.3	55%	0.545	50%	0.503	S	S	.	.	H	α-helix	trans	-60	-41.3	176.2	172.6	0	0	0	0	111.4	D362 S368 E369 L370	D362-V366 WeakPolarHBondContact O-CB 3.48Å; D362-V366 VanDerWaalsContact O-CG2 3.23Å; D362-V366 WeakPolarHBondContact O-CG2 3.32Å; D362-V366 PolarHBondContact O-N 3.47Å; V366-S368 PolarHBondContact O-N 3.12Å; V366-E369 PolarHBondContact O-N 3.13Å; V366-L370 VanDerWaalsContact O-CB 3.28Å; V366-L370 WeakPolarHBondContact O-CB 3.42Å; V366-L370 PolarHBondContact O-N 3.36Å
367	T	66	Low	67.5	Low	53 Å²	53	98.8 Å²	98.8	33%	0.325	51%	0.509	S	S	.	.	H	α-helix	trans	-66.2	-36	175.3	54	0	0	0	0	113.1	S363 M364 N365 S371	S363-T367 WeakPolarHBondContact O-CB 3.43Å; S363-T367 VanDerWaalsContact O-CG2 3.31Å; S363-T367 WeakPolarHBondContact O-CG2 3.39Å; S363-T367 PolarHBondContact O-N 3.34Å; S363-T367 PolarHBondContact O-OG1 2.9Å; S363-T367 VanDerWaalsContact O-OG1 3.1Å; M364-T367 WeakPolarHBondContact CA-OG1 3.24Å; M364-T367 PolarHBondContact O-N 2.96Å; M364-T367 PolarHBondContact O-OG1 2.91Å; N365-T367 VanDerWaalsContact C-N 3.33Å; N365-T367 PolarHBondContact O-N 2.87Å; T367-S371 WeakPolarHBondContact O-CB 3.43Å; T367-S371 PolarHBondContact O-N 2.68Å; T367-S371 PolarHBondContact O-OG 3.29Å
368	S	67.7	Low	67.2	Low	65 Å²	65	99.6 Å²	99.6	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-67.3	-42.8	177	84	0	0	0	0	111.4	M364 N365 V366 S371 R372	M364-S368 WeakPolarHBondContact O-CB 3.37Å; M364-S368 PolarHBondContact O-N 3.06Å; N365-S368 WeakPolarHBondContact O-CB 3.34Å; N365-S368 PolarHBondContact O-N 3.31Å; N365-S368 VanDerWaalsContact O-N 3.11Å; N365-S368 PolarHBondContact O-OG 2.95Å; V366-S368 PolarHBondContact O-N 3.12Å; S368-S371 PolarHBondContact O-N 2.85Å; S368-R372 VanDerWaalsContact O-CB 3.29Å; S368-R372 WeakPolarHBondContact O-CB 3.24Å; S368-R372 PolarHBondContact O-N 3.32Å
369	E	66.6	Low	66.6	Low	111 Å²	111	98.1 Å²	98.1	52%	0.519	52%	0.515	S	S	.	.	H	α-helix	trans	-67.1	-46	177.8	-72.5	-171.1	155	0	0	111.2	N365 V366 S371 R372 E373	N365-E369 WeakPolarHBondContact O-CG 3.48Å; N365-E369 PolarHBondContact O-N 3.45Å; V366-E369 PolarHBondContact O-N 3.13Å; E369-S371 VanDerWaalsContact C-N 3.32Å; E369-S371 PolarHBondContact O-N 3.49Å; E369-R372 CarbonylContact O-C 3.58Å; E369-R372 WeakPolarHBondContact O-CB 3.3Å; E369-R372 PolarHBondContact O-N 2.84Å; E369-R372 VanDerWaalsContact O-N 3.15Å; E369-E373 WeakPolarHBondContact O-CG 3.36Å; E369-E373 PolarHBondContact O-N 2.9Å
370	L	64.2	Low	66.3	Low	96 Å²	96	100.5 Å²	100.5	50%	0.503	52%	0.517	S	S	.	.	H	α-helix	trans	-63.5	-39.2	176.2	-173.5	67.9	0	0	0	111.6	V366 R372 E373 A374	V366-L370 VanDerWaalsContact O-CB 3.28Å; V366-L370 WeakPolarHBondContact O-CB 3.42Å; V366-L370 PolarHBondContact O-N 3.36Å; L370-R372 VanDerWaalsContact C-N 3.34Å; L370-E373 PolarHBondContact O-N 3.41Å; L370-A374 VanDerWaalsContact O-CB 3.3Å; L370-A374 WeakPolarHBondContact O-CB 3.33Å; L370-A374 PolarHBondContact O-N 2.89Å
371	S	67.5	Low	65.9	Low	77 Å²	77	96.9 Å²	96.9	54%	0.538	51%	0.506	S	S	.	.	H	α-helix	trans	-64.1	-41.3	173.9	-63.7	0	0	0	0	110.9	T367 S368 E369 A374 H375	T367-S371 WeakPolarHBondContact O-CB 3.43Å; T367-S371 PolarHBondContact O-N 2.68Å; T367-S371 PolarHBondContact O-OG 3.29Å; S368-S371 PolarHBondContact O-N 2.85Å; E369-S371 VanDerWaalsContact C-N 3.32Å; E369-S371 PolarHBondContact O-N 3.49Å; S371-A374 PolarHBondContact O-N 3.48Å; S371-H375 VanDerWaalsContact O-CB 3.28Å; S371-H375 WeakPolarHBondContact O-CB 3.18Å; S371-H375 PolarHBondContact O-N 2.93Å
372	R	70.1	Confident	65.7	Low	185 Å²	185	97.6 Å²	97.6	70%	0.698	51%	0.507	S	S	*	.	H	α-helix	trans	-64.9	-40.8	175.6	-166.5	174.4	71.2	165.2	-0.8	111.6	S368 E369 L370 H375 G376	S368-R372 VanDerWaalsContact O-CB 3.29Å; S368-R372 WeakPolarHBondContact O-CB 3.24Å; S368-R372 PolarHBondContact O-N 3.32Å; E369-R372 CarbonylContact O-C 3.58Å; E369-R372 WeakPolarHBondContact O-CB 3.3Å; E369-R372 PolarHBondContact O-N 2.84Å; E369-R372 VanDerWaalsContact O-N 3.15Å; L370-R372 VanDerWaalsContact C-N 3.34Å; R372-H375 PolarHBondContact O-N 3.31Å; R372-G376 PolarHBondContact O-N 3Å
373	E	67.8	Low	65.5	Low	100 Å²	100	97 Å²	97	47%	0.467	51%	0.508	S	S	.	.	H	α-helix	trans	-63.6	-46.3	172.2	-75.3	-160.5	168.5	0	0	112.1	E369 L370 H375 G376 R377	E369-E373 WeakPolarHBondContact O-CG 3.36Å; E369-E373 PolarHBondContact O-N 2.9Å; L370-E373 PolarHBondContact O-N 3.41Å; E373-H375 VanDerWaalsContact C-N 3.3Å; E373-H375 PolarHBondContact O-N 3.46Å; E373-G376 PolarHBondContact O-N 3.28Å; E373-R377 WeakPolarHBondContact O-CB 3.3Å; E373-R377 WeakPolarHBondContact O-CG 3.18Å; E373-R377 PolarHBondContact O-N 3.12Å; E373-R377 IonicContact OE2-CZ 2.9Å; E373-R377 VanDerWaalsContact OE2-CZ 3.27Å; E373-R377 IonicContact OE2-NH1 2.78Å; E373-R377 PolarHBondContact OE2-NH1 3.4Å; E373-R377 IonicContact OE2-NH2 3.52Å; E373-R377 PolarHBondContact OE2-NH2 2.9Å
374	A	64.8	Low	65.6	Low	48 Å²	48	96.7 Å²	96.7	40%	0.397	50%	0.502	S	S	.	.	H	α-helix	trans	-61.8	-41	177.5	0	0	0	0	0	110.8	L370 S371 R378	L370-A374 VanDerWaalsContact O-CB 3.3Å; L370-A374 WeakPolarHBondContact O-CB 3.33Å; L370-A374 PolarHBondContact O-N 2.89Å; S371-A374 PolarHBondContact O-N 3.48Å; A374-R378 VanDerWaalsContact O-CB 3.23Å; A374-R378 WeakPolarHBondContact O-CB 3.42Å; A374-R378 PolarHBondContact O-N 3.01Å
375	H	66.8	Low	65.6	Low	141 Å²	141	93.6 Å²	93.6	65%	0.653	49%	0.49	S	S	*	.	H	α-helix	trans	-66.2	-42.6	175.3	-143.3	65.2	0	0	0	111.7	S371 R372 E373 R378 S379	S371-H375 VanDerWaalsContact O-CB 3.28Å; S371-H375 WeakPolarHBondContact O-CB 3.18Å; S371-H375 PolarHBondContact O-N 2.93Å; R372-H375 PolarHBondContact O-N 3.31Å; E373-H375 VanDerWaalsContact C-N 3.3Å; E373-H375 PolarHBondContact O-N 3.46Å; H375-R378 PolarHBondContact O-N 3.44Å; H375-S379 VanDerWaalsContact O-CB 3.24Å; H375-S379 WeakPolarHBondContact O-CB 3.4Å; H375-S379 PolarHBondContact O-N 3.11Å
376	G	65.2	Low	65.9	Low	40 Å²	40	93.5 Å²	93.5	41%	0.412	49%	0.485	S	S	.	.	H	α-helix	trans	-61.2	-47.2	174.1	0	0	0	0	0	112.7	R372 E373 S379 R380	R372-G376 PolarHBondContact O-N 3Å; E373-G376 PolarHBondContact O-N 3.28Å; G376-S379 PolarHBondContact O-N 3.09Å; G376-R380 WeakPolarHBondContact O-CB 3.19Å; G376-R380 PolarHBondContact O-N 2.95Å
377	R	63.4	Low	66	Low	162 Å²	162	92 Å²	92	61%	0.611	48%	0.476	S	S	*	.	H	α-helix	trans	-62.4	-43.5	175.4	-72.8	-178.5	-175.8	119.4	9	111.6	E373 R380 G381	E373-R377 WeakPolarHBondContact O-CB 3.3Å; E373-R377 WeakPolarHBondContact O-CG 3.18Å; E373-R377 PolarHBondContact O-N 3.12Å; E373-R377 IonicContact OE2-CZ 2.9Å; E373-R377 VanDerWaalsContact OE2-CZ 3.27Å; E373-R377 IonicContact OE2-NH1 2.78Å; E373-R377 PolarHBondContact OE2-NH1 3.4Å; E373-R377 IonicContact OE2-NH2 3.52Å; E373-R377 PolarHBondContact OE2-NH2 2.9Å; R377-R380 PolarHBondContact O-N 3.23Å; R377-G381 PolarHBondContact O-N 3.44Å
378	R	62.5	Low	66.6	Low	174 Å²	174	89.9 Å²	89.9	66%	0.657	46%	0.463	S	S	*	.	H	α-helix	trans	-64.8	-42.2	176.5	-172.6	174.9	-177	168.8	-1	111.9	A374 H375 N382	A374-R378 VanDerWaalsContact O-CB 3.23Å; A374-R378 WeakPolarHBondContact O-CB 3.42Å; A374-R378 PolarHBondContact O-N 3.01Å; H375-R378 PolarHBondContact O-N 3.44Å; R378-N382 VanDerWaalsContact O-CB 3.3Å; R378-N382 WeakPolarHBondContact O-CB 3.25Å; R378-N382 VanDerWaalsContact O-CG 3.23Å; R378-N382 PolarHBondContact O-N 3.34Å; R378-N382 PolarHBondContact O-ND2 2.89Å
379	S	60.4	Low	67.2	Low	77 Å²	77	91.3 Å²	91.3	54%	0.538	46%	0.461	S	S	.	.	H	α-helix	trans	-62.2	-45.3	175.8	-174.6	0	0	0	0	111.3	H375 G376 N382 S383	H375-S379 VanDerWaalsContact O-CB 3.24Å; H375-S379 WeakPolarHBondContact O-CB 3.4Å; H375-S379 PolarHBondContact O-N 3.11Å; G376-S379 PolarHBondContact O-N 3.09Å; S379-N382 PolarHBondContact O-N 3.39Å; S379-S383 PolarHBondContact O-N 3.3Å
380	R	61.8	Low	67.8	Low	162 Å²	162	86.7 Å²	86.7	61%	0.611	44%	0.44	S	S	*	.	H	α-helix	trans	-62.8	-49.9	176.6	-173	172.9	167.5	132.7	-2.2	112.2	G376 R377 N382 S383 D384	G376-R380 WeakPolarHBondContact O-CB 3.19Å; G376-R380 PolarHBondContact O-N 2.95Å; R377-R380 PolarHBondContact O-N 3.23Å; R380-N382 VanDerWaalsContact C-N 3.29Å; R380-N382 PolarHBondContact O-N 2.94Å; R380-S383 WeakPolarHBondContact O-CA 3.09Å; R380-S383 VanDerWaalsContact O-CB 3.32Å; R380-S383 WeakPolarHBondContact O-CB 3.38Å; R380-S383 PolarHBondContact O-N 3.49Å; R380-D384 PolarHBondContact O-N 2.75Å
381	G	60.6	Low	68.6	Low	33 Å²	33	82.7 Å²	82.7	34%	0.34	42%	0.42	S	S	.	.	H	α-helix	trans	-59.9	-37.3	175.9	0	0	0	0	0	113.3	R377 T385	R377-G381 PolarHBondContact O-N 3.44Å; G381-T385 WeakPolarHBondContact O-CB 3.41Å; G381-T385 PolarHBondContact O-N 2.91Å; G381-T385 PolarHBondContact O-OG1 3.44Å
382	N	62.8	Low	69.5	Low	82 Å²	82	79.9 Å²	79.9	44%	0.439	40%	0.403	S	S	.	.	H	α-helix	trans	-67.1	-34.2	172.8	-79	-17.4	0	0	0	112.9	R378 S379 R380 K386	R378-N382 VanDerWaalsContact O-CB 3.3Å; R378-N382 WeakPolarHBondContact O-CB 3.25Å; R378-N382 VanDerWaalsContact O-CG 3.23Å; R378-N382 PolarHBondContact O-N 3.34Å; R378-N382 PolarHBondContact O-ND2 2.89Å; S379-N382 PolarHBondContact O-N 3.39Å; R380-N382 VanDerWaalsContact C-N 3.29Å; R380-N382 PolarHBondContact O-N 2.94Å; N382-K386 WeakPolarHBondContact O-CD 3.49Å; N382-K386 WeakPolarHBondContact O-CG 3.49Å; N382-K386 PolarHBondContact O-N 2.89Å
383	S	65.3	Low	70.4	Confident	61 Å²	61	73 Å²	73	43%	0.427	38%	0.381	S	S	.	.	H	α-helix	trans	-67.3	-49.3	174.4	-170.7	0	0	0	0	110.9	S379 R380 T385 K386 V387	S379-S383 PolarHBondContact O-N 3.3Å; R380-S383 WeakPolarHBondContact O-CA 3.09Å; R380-S383 VanDerWaalsContact O-CB 3.32Å; R380-S383 WeakPolarHBondContact O-CB 3.38Å; R380-S383 PolarHBondContact O-N 3.49Å; S383-T385 VanDerWaalsContact C-N 3.31Å; S383-T385 PolarHBondContact O-N 2.95Å; S383-K386 WeakPolarHBondContact O-CB 3.28Å; S383-K386 PolarHBondContact O-N 3.28Å; S383-V387 PolarHBondContact O-N 2.98Å; S383-V387 VanDerWaalsContact O-N 3.11Å
384	D	67.5	Low	71.3	Confident	54 Å²	54	68.8 Å²	68.8	29%	0.289	36%	0.362	S	S	.	.	H	α-helix	trans	-61.3	-42.2	-179.7	-63.6	-20.3	0	0	0	110.8	R380 K386 V387 I388	R380-D384 PolarHBondContact O-N 2.75Å; D384-K386 VanDerWaalsContact C-N 3.29Å; D384-K386 PolarHBondContact O-N 3.27Å; D384-V387 PolarHBondContact O-N 2.9Å; D384-I388 VanDerWaalsContact O-CG1 3.26Å; D384-I388 WeakPolarHBondContact O-CG1 3.41Å; D384-I388 PolarHBondContact O-N 2.92Å
385	T	72.4	Confident	72.4	Confident	60 Å²	60	67.4 Å²	67.4	37%	0.368	35%	0.347	S	S	.	.	H	α-helix	trans	-61	-35.4	175.1	-56.5	0	0	0	0	112.5	G381 S383 K389	G381-T385 WeakPolarHBondContact O-CB 3.41Å; G381-T385 PolarHBondContact O-N 2.91Å; G381-T385 PolarHBondContact O-OG1 3.44Å; S383-T385 VanDerWaalsContact C-N 3.31Å; S383-T385 PolarHBondContact O-N 2.95Å; T385-K389 WeakPolarHBondContact O-CG 3.46Å; T385-K389 PolarHBondContact O-N 3.23Å
386	K	72.9	Confident	73.4	Confident	92 Å²	92	61.7 Å²	61.7	40%	0.4	33%	0.327	S	S	.	.	H	α-helix	trans	-69.9	-43	178	-71.9	162.5	-169.8	167.2	0	111.5	N382 S383 D384 I388 K389 T390	N382-K386 WeakPolarHBondContact O-CD 3.49Å; N382-K386 WeakPolarHBondContact O-CG 3.49Å; N382-K386 PolarHBondContact O-N 2.89Å; S383-K386 WeakPolarHBondContact O-CB 3.28Å; S383-K386 PolarHBondContact O-N 3.28Å; D384-K386 VanDerWaalsContact C-N 3.29Å; D384-K386 PolarHBondContact O-N 3.27Å; K386-I388 VanDerWaalsContact C-N 3.33Å; K386-I388 PolarHBondContact O-N 3.03Å; K386-K389 WeakPolarHBondContact O-CB 3.05Å; K386-K389 PolarHBondContact O-N 3.13Å; K386-T390 PolarHBondContact O-N 3.42Å; K386-T390 PolarHBondContact O-OG1 2.92Å
387	V	70	Confident	74.7	Confident	59 Å²	59	61 Å²	61	36%	0.358	32%	0.316	S	S	.	.	H	α-helix	trans	-61.6	-43.5	177.8	175.4	0	0	0	0	110.7	S383 D384 K389 T390 L391	S383-V387 PolarHBondContact O-N 2.98Å; S383-V387 VanDerWaalsContact O-N 3.11Å; D384-V387 PolarHBondContact O-N 2.9Å; V387-K389 VanDerWaalsContact C-N 3.3Å; V387-K389 PolarHBondContact O-N 3.47Å; V387-T390 PolarHBondContact O-N 3.02Å; V387-L391 HydrophobicContact CG1-CD1 4.16Å; V387-L391 WeakPolarHBondContact O-CG 3.2Å; V387-L391 PolarHBondContact O-N 3.15Å; V387-L391 VanDerWaalsContact O-N 3.13Å
388	I	78.5	Confident	75.9	Confident	9 Å²	9	53.3 Å²	53.3	5%	0.046	29%	0.287	C	S	.	.	H	α-helix	trans	-62.1	-38.4	178	-66.1	168.8	0	0	0	111.5	I181 Y255 I258 A262 D384 K386 L391 G392	I181-I388 HydrophobicContact CD1-CD1 4.5Å; I181-I388 HydrophobicContact CD1-CG1 4.28Å; Y255-I388 HydrophobicContact CE2-CG2 4.11Å; I258-I388 HydrophobicContact CG2-CD1 3.82Å; I258-I388 HydrophobicContact CG2-CG1 3.72Å; I258-I388 HydrophobicContact CG2-CG2 4.2Å; A262-I388 HydrophobicContact CB-CD1 3.31Å; D384-I388 VanDerWaalsContact O-CG1 3.26Å; D384-I388 WeakPolarHBondContact O-CG1 3.41Å; D384-I388 PolarHBondContact O-N 2.92Å; K386-I388 VanDerWaalsContact C-N 3.33Å; K386-I388 PolarHBondContact O-N 3.03Å; I388-L391 PolarHBondContact O-N 3.03Å; I388-G392 PolarHBondContact O-N 3.02Å
389	K	79.9	Confident	77.3	Confident	94 Å²	94	46.5 Å²	46.5	41%	0.409	27%	0.265	S	S	.	.	H	α-helix	trans	-61.7	-45.5	175.9	-75.6	174.5	178.2	-173.4	0	112.3	T385 K386 V387 G392 V393	T385-K389 WeakPolarHBondContact O-CG 3.46Å; T385-K389 PolarHBondContact O-N 3.23Å; K386-K389 WeakPolarHBondContact O-CB 3.05Å; K386-K389 PolarHBondContact O-N 3.13Å; V387-K389 VanDerWaalsContact C-N 3.3Å; V387-K389 PolarHBondContact O-N 3.47Å; K389-G392 PolarHBondContact O-N 3.35Å; K389-V393 WeakPolarHBondContact O-CG2 3.23Å; K389-V393 PolarHBondContact O-N 2.88Å; K389-V393 VanDerWaalsContact O-N 3.07Å
390	T	79.9	Confident	78.8	Confident	14 Å²	14	44.7 Å²	44.7	9%	0.086	25%	0.249	C	C	.	.	H	α-helix	trans	-60.5	-46.8	177.8	-55.5	0	0	0	0	110.8	K386 V387 G392 V393 I394 I448 F452	K386-T390 PolarHBondContact O-N 3.42Å; K386-T390 PolarHBondContact O-OG1 2.92Å; V387-T390 PolarHBondContact O-N 3.02Å; T390-G392 PolarHBondContact O-N 2.63Å; T390-V393 PolarHBondContact O-N 3.36Å; T390-I394 HydrophobicContact CG2-CD1 4.14Å; T390-I394 WeakPolarHBondContact O-CG1 3.42Å; T390-I394 PolarHBondContact O-N 2.93Å; T390-I448 HydrophobicContact CG2-CG2 4.13Å; T390-F452 HydrophobicContact CG2-CB 3.9Å; T390-F452 WeakPolarHBondContact OG1-CB 3.41Å; T390-F452 PolarHBondContact OG1-O 3.45Å
391	L	81	Confident	80.4	Confident	13 Å²	13	37.3 Å²	37.3	7%	0.068	22%	0.222	C	C	.	.	H	α-helix	trans	-61.9	-42.4	178.1	-67.9	168.9	0	0	0	112.6	I173 R177 V387 I388 V393 I394 M395	I173-L391 HydrophobicContact CG2-CD2 4.04Å; R177-L391 HydrophobicContact CB-CD1 3.81Å; R177-L391 HydrophobicContact CG-CD1 3.49Å; R177-L391 VanDerWaalsContact CG-CD1 3.49Å; R177-L391 HydrophobicContact CG-CD2 3.84Å; R177-L391 HydrophobicContact CG-CG 4.31Å; V387-L391 HydrophobicContact CG1-CD1 4.16Å; V387-L391 WeakPolarHBondContact O-CG 3.2Å; V387-L391 PolarHBondContact O-N 3.15Å; V387-L391 VanDerWaalsContact O-N 3.13Å; I388-L391 PolarHBondContact O-N 3.03Å; L391-V393 VanDerWaalsContact C-N 3.29Å; L391-V393 PolarHBondContact O-N 3.34Å; L391-I394 PolarHBondContact O-N 2.71Å; L391-M395 HydrophobicContact CB-CE 4.33Å; L391-M395 VanDerWaalsContact O-CG 3.29Å; L391-M395 WeakPolarHBondContact O-CG 3.47Å; L391-M395 PolarHBondContact O-N 2.87Å
392	G	85.8	Confident	82	Confident	18 Å²	18	36.1 Å²	36.1	19%	0.186	21%	0.207	C	C	.	.	H	α-helix	trans	-61.8	-36.7	176.6	0	0	0	0	0	113.2	Y255 I388 K389 T390 G396	Y255-G392 VanDerWaalsContact CZ-CA 3.45Å; Y255-G392 VanDerWaalsContact OH-CA 3.31Å; Y255-G392 WeakPolarHBondContact OH-CA 3.49Å; I388-G392 PolarHBondContact O-N 3.02Å; K389-G392 PolarHBondContact O-N 3.35Å; T390-G392 PolarHBondContact O-N 2.63Å; G392-G396 PolarHBondContact O-N 2.97Å
393	V	88.1	Confident	83.5	Confident	41 Å²	41	34.9 Å²	34.9	25%	0.248	20%	0.201	C	C	.	.	H	α-helix	trans	-66.9	-46.5	173.8	173.3	0	0	0	0	110.8	K389 T390 L391 M395 G396 C397 I448 F452	K389-V393 WeakPolarHBondContact O-CG2 3.23Å; K389-V393 PolarHBondContact O-N 2.88Å; K389-V393 VanDerWaalsContact O-N 3.07Å; T390-V393 PolarHBondContact O-N 3.36Å; L391-V393 VanDerWaalsContact C-N 3.29Å; L391-V393 PolarHBondContact O-N 3.34Å; V393-M395 PolarHBondContact O-N 3.06Å; V393-G396 PolarHBondContact O-N 3.46Å; V393-C397 PolarHBondContact O-N 3.13Å; V393-C397 PolarHBondContact O-SG 2.93Å; V393-C397 VanDerWaalsContact O-SG 3.37Å; V393-I448 HydrophobicContact CG1-CD1 4.13Å; V393-I448 HydrophobicContact CG1-CG1 4.03Å; V393-I448 HydrophobicContact CG1-CG2 4.17Å; V393-F452 HydrophobicContact CG1-CD2 4.32Å; V393-F452 HydrophobicContact CG1-CE2 4.01Å; V393-F452 HydrophobicContact CG2-CZ 4.47Å
394	I	87.5	Confident	85	Confident	11 Å²	11	33.1 Å²	33.1	6%	0.056	19%	0.187	C	C	.	.	H	α-helix	trans	-57.2	-50.2	177.4	-64.1	170.9	0	0	0	110.7	L170 T390 L391 G396 C397 F398 I448 Y449	L170-I394 HydrophobicContact CD2-CG2 3.36Å; T390-I394 HydrophobicContact CG2-CD1 4.14Å; T390-I394 WeakPolarHBondContact O-CG1 3.42Å; T390-I394 PolarHBondContact O-N 2.93Å; L391-I394 PolarHBondContact O-N 2.71Å; I394-G396 PolarHBondContact O-N 3.46Å; I394-C397 PolarHBondContact O-N 2.78Å; I394-F398 PolarHBondContact O-N 3.43Å; I394-I448 HydrophobicContact CD1-CG2 4.18Å; I394-I448 HydrophobicContact CG1-CB 4.36Å; I394-I448 HydrophobicContact CG1-CD1 4.23Å; I394-I448 HydrophobicContact CG1-CG2 3.5Å; I394-I448 VanDerWaalsContact CG1-CG2 3.5Å; I394-Y449 HydrophobicContact CD1-CE1 3.77Å
395	M	87.2	Confident	86.2	Confident	18 Å²	18	31.3 Å²	31.3	9%	0.089	18%	0.177	C	C	.	.	H	α-helix	trans	-64	-40.6	179.6	-66.6	168.5	-174.2	0	0	112	S174 Y255 L391 V393 F398 C399	S174-M395 WeakPolarHBondContact OG-CE 3.45Å; Y255-M395 VanDerWaalsContact CB-SD 3.55Å; Y255-M395 HydrophobicContact CD1-SD 4.47Å; Y255-M395 HydrophobicContact CD2-CE 3.98Å; Y255-M395 HydrophobicContact CD2-SD 3.36Å; Y255-M395 WeakPolarHBondContact CD2-SD 3.21Å; Y255-M395 HydrophobicContact CE2-SD 4.19Å; Y255-M395 HydrophobicContact CG-CE 4.49Å; Y255-M395 HydrophobicContact CG-SD 3.53Å; Y255-M395 VanDerWaalsContact CG-SD 3.53Å; L391-M395 HydrophobicContact CB-CE 4.33Å; L391-M395 VanDerWaalsContact O-CG 3.29Å; L391-M395 WeakPolarHBondContact O-CG 3.47Å; L391-M395 PolarHBondContact O-N 2.87Å; V393-M395 PolarHBondContact O-N 3.06Å; M395-F398 PolarHBondContact O-N 3.49Å; M395-C399 PolarHBondContact O-N 3.2Å; M395-C399 PolarHBondContact O-SG 2.84Å
396	G	89.2	Confident	87.2	Confident	22 Å²	22	29.5 Å²	29.5	23%	0.227	16%	0.164	C	C	.	.	H	α-helix	trans	-61.9	-46	176.5	0	0	0	0	0	112.5	G392 V393 I394 C399 L400	G392-G396 PolarHBondContact O-N 2.97Å; V393-G396 PolarHBondContact O-N 3.46Å; I394-G396 PolarHBondContact O-N 3.46Å; G396-C399 PolarHBondContact O-N 3.18Å; G396-L400 WeakPolarHBondContact O-CB 3.46Å; G396-L400 VanDerWaalsContact O-CG 3.31Å; G396-L400 WeakPolarHBondContact O-CG 3.5Å; G396-L400 PolarHBondContact O-N 3.3Å
397	C	91.2	Very high	88.3	Confident	26 Å²	26	28.9 Å²	28.9	18%	0.176	16%	0.163	C	C	.	.	H	α-helix	trans	-61	-45.2	175.2	-71.3	0	0	0	0	111.7	V393 I394 C399 L400 C401 L444 I448	V393-C397 PolarHBondContact O-N 3.13Å; V393-C397 PolarHBondContact O-SG 2.93Å; V393-C397 VanDerWaalsContact O-SG 3.37Å; I394-C397 PolarHBondContact O-N 2.78Å; C397-C399 PolarHBondContact O-N 3.46Å; C397-L400 PolarHBondContact O-N 3.04Å; C397-C401 VanDerWaalsContact O-CB 3.27Å; C397-C401 WeakPolarHBondContact O-CB 3.4Å; C397-C401 PolarHBondContact O-N 3.41Å; C397-C401 PolarHBondContact O-SG 2.92Å; C397-C401 VanDerWaalsContact O-SG 3.35Å; C397-L444 HydrophobicContact CB-CD1 4.04Å; C397-I448 HydrophobicContact CB-CD1 4.12Å
398	F	90.3	Very high	89.3	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-55.4	-51.4	174.3	158.1	-100.1	0	0	0	112.2	I167 L170 F244 L248 M251 I394 M395 L400 C401 W402	I167-F398 HydrophobicContact CB-CE2 4.15Å; I167-F398 HydrophobicContact CD1-CE2 3.8Å; I167-F398 HydrophobicContact CG1-CD2 4.16Å; I167-F398 HydrophobicContact CG1-CE2 3.53Å; I167-F398 HydrophobicContact CG1-CZ 4.43Å; I167-F398 HydrophobicContact CG2-CE2 3.66Å; I167-F398 HydrophobicContact CG2-CZ 3.74Å; L170-F398 HydrophobicContact CD1-CB 3.95Å; L170-F398 HydrophobicContact CD1-CD2 4.06Å; L170-F398 HydrophobicContact CD1-CG 4.09Å; F244-F398 HydrophobicContact CD2-CE2 4.04Å; F244-F398 AromaticContact CD2-CZ 3.6Å; F244-F398 HydrophobicContact CD2-CZ 3.6Å; F244-F398 HydrophobicContact CE2-CE1 4.14Å; F244-F398 AromaticContact CE2-CE2 3.96Å; F244-F398 HydrophobicContact CE2-CE2 3.96Å; F244-F398 AromaticContact CE2-CZ 3.43Å; F244-F398 HydrophobicContact CE2-CZ 3.43Å; F244-F398 VanDerWaalsContact CE2-CZ 3.43Å; L248-F398 HydrophobicContact CB-CE1 4.38Å; L248-F398 HydrophobicContact CD1-CD1 4.47Å; L248-F398 HydrophobicContact CD1-CE1 3.72Å; M251-F398 HydrophobicContact CE-CD1 3.51Å; M251-F398 HydrophobicContact CE-CE1 3.11Å; M251-F398 HydrophobicContact CE-CG 4.36Å; M251-F398 HydrophobicContact CE-CZ 3.69Å; I394-F398 PolarHBondContact O-N 3.43Å; M395-F398 PolarHBondContact O-N 3.49Å; F398-L400 VanDerWaalsContact C-N 3.35Å; F398-L400 PolarHBondContact O-N 3.32Å; F398-C401 PolarHBondContact O-N 3.43Å; F398-W402 HydrophobicContact CD2-CB 4.44Å; F398-W402 AromaticContact CD2-CD1 3.54Å; F398-W402 HydrophobicContact CD2-CG 4.27Å; F398-W402 HydrophobicContact CE2-CB 4.08Å; F398-W402 AromaticContact CE2-CD1 3.78Å; F398-W402 HydrophobicContact CE2-CG 4.11Å; F398-W402 WeakPolarHBondContact O-CB 3.35Å; F398-W402 PolarHBondContact O-N 3.22Å
399	C	91.2	Very high	90	Very high	30 Å²	30	27.4 Å²	27.4	20%	0.203	15%	0.153	C	C	.	.	H	α-helix	trans	-61.9	-44.8	-178.5	-62.3	0	0	0	0	111.1	L248 M395 G396 C397 C401 L403	L248-C399 HydrophobicContact CD1-CB 4.41Å; L248-C399 WeakPolarHBondContact CD1-SG 3.34Å; M395-C399 PolarHBondContact O-N 3.2Å; M395-C399 PolarHBondContact O-SG 2.84Å; G396-C399 PolarHBondContact O-N 3.18Å; C397-C399 PolarHBondContact O-N 3.46Å; C399-C401 PolarHBondContact O-N 2.85Å; C399-L403 WeakPolarHBondContact O-CB 3.18Å; C399-L403 PolarHBondContact O-N 3.03Å
400	L	91.8	Very high	90.6	Very high	40 Å²	40	24.5 Å²	24.5	21%	0.209	14%	0.142	C	C	.	.	H	α-helix	trans	-65	-38.5	-179.1	-78.8	170.8	0	0	0	112.9	L15 L19 G396 C397 F398 P404	L15-L400 HydrophobicContact CD1-CD1 3.7Å; L19-L400 HydrophobicContact CD2-CD1 4.34Å; L19-L400 HydrophobicContact CD2-CD2 3.32Å; L19-L400 HydrophobicContact CD2-CG 3.87Å; L19-L400 HydrophobicContact CG-CD2 3.99Å; G396-L400 WeakPolarHBondContact O-CB 3.46Å; G396-L400 VanDerWaalsContact O-CG 3.31Å; G396-L400 WeakPolarHBondContact O-CG 3.5Å; G396-L400 PolarHBondContact O-N 3.3Å; C397-L400 PolarHBondContact O-N 3.04Å; F398-L400 VanDerWaalsContact C-N 3.35Å; F398-L400 PolarHBondContact O-N 3.32Å; L400-P404 WeakPolarHBondContact O-CD 3.43Å
401	C	94.3	Very high	91.3	Very high	6 Å²	6	27.1 Å²	27.1	4%	0.041	16%	0.155	C	C	.	.	H	α-helix	trans	-75.4	-42.5	-177.5	-76.9	0	0	0	0	112.6	C397 F398 C399 L437 G438 N441	C397-C401 VanDerWaalsContact O-CB 3.27Å; C397-C401 WeakPolarHBondContact O-CB 3.4Å; C397-C401 PolarHBondContact O-N 3.41Å; C397-C401 PolarHBondContact O-SG 2.92Å; C397-C401 VanDerWaalsContact O-SG 3.35Å; F398-C401 PolarHBondContact O-N 3.43Å; C399-C401 PolarHBondContact O-N 2.85Å; C401-L437 WeakPolarHBondContact CB-O 3.48Å; C401-L437 PolarHBondContact SG-O 3.41Å; C401-G438 PolarHBondContact O-N 3.28Å; C401-N441 HydrophobicContact CB-CB 3.79Å
402	W	94.9	Very high	91.9	Very high	9 Å²	9	27.3 Å²	27.3	3%	0.034	16%	0.156	C	C	.	.	H	α-helix	trans	-98.3	-32.2	-169	-77.4	107.9	0	0	0	114.6	C163 I167 F244 F398 F405 F406 N441	C163-W402 HydrophobicContact CB-CH2 3.71Å; C163-W402 HydrophobicContact CB-CZ2 3.86Å; C163-W402 VanDerWaalsContact SG-CH2 3.54Å; I167-W402 HydrophobicContact CD1-CD2 4.49Å; I167-W402 HydrophobicContact CD1-CG 4.49Å; F244-W402 HydrophobicContact CD2-CB 4.08Å; F244-W402 HydrophobicContact CE2-CB 3.64Å; F398-W402 HydrophobicContact CD2-CB 4.44Å; F398-W402 AromaticContact CD2-CD1 3.54Å; F398-W402 HydrophobicContact CD2-CG 4.27Å; F398-W402 HydrophobicContact CE2-CB 4.08Å; F398-W402 AromaticContact CE2-CD1 3.78Å; F398-W402 HydrophobicContact CE2-CG 4.11Å; F398-W402 WeakPolarHBondContact O-CB 3.35Å; F398-W402 PolarHBondContact O-N 3.22Å; W402-F405 HydrophobicContact CE3-CD1 4.47Å; W402-F405 HydrophobicContact CZ3-CD1 4.39Å; W402-F405 PolarHBondContact O-N 3.16Å; W402-F406 HydrophobicContact CB-CD2 3.91Å; W402-F406 HydrophobicContact CB-CE2 3.87Å; W402-F406 AromaticContact CD2-CE2 3.82Å; W402-F406 HydrophobicContact CD2-CE2 3.82Å; W402-F406 HydrophobicContact CE3-CD2 4.07Å; W402-F406 AromaticContact CE3-CE2 3.33Å; W402-F406 HydrophobicContact CE3-CE2 3.33Å; W402-F406 AromaticContact CE3-CZ 3.93Å; W402-F406 HydrophobicContact CE3-CZ 3.93Å; W402-F406 HydrophobicContact CG-CE2 4.09Å; W402-F406 HydrophobicContact CZ3-CE2 4.13Å; W402-F406 HydrophobicContact CZ3-CZ 4.3Å; W402-F406 VanDerWaalsContact O-CD2 3.24Å; W402-F406 WeakPolarHBondContact O-CD2 3.36Å; W402-F406 PolarHBondContact O-N 3.19Å; W402-N441 PolarHBondContact NE1-ND2 2.77Å
403	L	95.2	Very high	92.1	Very high	56 Å²	56	26.8 Å²	26.8	29%	0.293	15%	0.149	S	C	.	.	H	α-helix	trans	-55.5	-46.2	-174.2	-178	65.6	0	0	0	113.5	F244 L248 C399 F405 F406 M407	F244-L403 HydrophobicContact CE1-CB 4.49Å; F244-L403 HydrophobicContact CE1-CD1 3.54Å; F244-L403 VanDerWaalsContact CZ-CA 3.43Å; F244-L403 HydrophobicContact CZ-CB 3.8Å; F244-L403 HydrophobicContact CZ-CD1 3.62Å; F244-L403 HydrophobicContact CZ-CG 4.33Å; L248-L403 HydrophobicContact CD2-CD1 4.19Å; C399-L403 WeakPolarHBondContact O-CB 3.18Å; C399-L403 PolarHBondContact O-N 3.03Å; L403-F405 VanDerWaalsContact C-N 3.35Å; L403-F405 PolarHBondContact O-N 3.24Å; L403-F406 PolarHBondContact O-N 3.42Å; L403-M407 HydrophobicContact CD1-CG 3.73Å; L403-M407 HydrophobicContact CD1-SD 4.18Å; L403-M407 HydrophobicContact CG-CG 4.03Å; L403-M407 WeakPolarHBondContact O-CB 3.48Å; L403-M407 WeakPolarHBondContact O-CG 3.45Å; L403-M407 PolarHBondContact O-N 3.23Å
404	P	95.2	Very high	92.4	Very high	23 Å²	23	28.9 Å²	28.9	15%	0.149	16%	0.159	C	C	.	.	H	α-helix	trans	-61.5	-41.2	-178	-24.6	36.5	0	0	0	113.2	L400 I408 L434 L437	L400-P404 WeakPolarHBondContact O-CD 3.43Å; P404-I408 WeakPolarHBondContact O-CG1 3.48Å; P404-I408 PolarHBondContact O-N 3.26Å; P404-I408 VanDerWaalsContact O-N 3.15Å; P404-L434 HydrophobicContact CB-CD1 4.24Å; P404-L434 HydrophobicContact CB-CD2 3.72Å; P404-L437 HydrophobicContact CG-CD2 4.37Å
405	F	93.6	Very high	92.8	Very high	16 Å²	16	30.1 Å²	30.1	7%	0.07	17%	0.165	C	C	.	.	H	α-helix	trans	-64.2	-50.9	179.2	178.8	-100.3	0	0	0	111.4	Y229 W402 L403 M407 I408 Q409 L434 Q435	Y229-F405 HydrophobicContact CD2-CZ 4.4Å; Y229-F405 AromaticContact CE2-CZ 3.97Å; Y229-F405 HydrophobicContact CE2-CZ 3.97Å; W402-F405 HydrophobicContact CE3-CD1 4.47Å; W402-F405 HydrophobicContact CZ3-CD1 4.39Å; W402-F405 PolarHBondContact O-N 3.16Å; L403-F405 VanDerWaalsContact C-N 3.35Å; L403-F405 PolarHBondContact O-N 3.24Å; F405-M407 VanDerWaalsContact C-N 3.32Å; F405-M407 PolarHBondContact O-N 3.47Å; F405-I408 PolarHBondContact O-N 3.39Å; F405-Q409 HydrophobicContact CD1-CG 4.15Å; F405-Q409 HydrophobicContact CD2-CG 4.4Å; F405-Q409 HydrophobicContact CE1-CG 3.78Å; F405-Q409 HydrophobicContact CE2-CG 4.05Å; F405-Q409 HydrophobicContact CG-CG 4.45Å; F405-Q409 HydrophobicContact CZ-CG 3.73Å; F405-Q409 WeakPolarHBondContact O-CG 3.19Å; F405-Q409 PolarHBondContact O-N 3.34Å; F405-L434 HydrophobicContact CB-CB 4.23Å; F405-L434 HydrophobicContact CD2-CB 4.28Å; F405-Q435 HydrophobicContact CD2-CB 4.28Å; F405-Q435 HydrophobicContact CE2-CB 4.09Å; F405-Q435 HydrophobicContact CE2-CG 4.45Å
406	F	94.4	Very high	92.9	Very high	22 Å²	22	32 Å²	32	10%	0.096	18%	0.18	C	C	.	.	H	α-helix	trans	-66.9	-31.4	-179.4	-74.3	-67.4	0	0	0	113.5	I167 T240 F244 Y245 W402 L403 L410	I167-F406 HydrophobicContact CD1-CE2 4.02Å; I167-F406 HydrophobicContact CD1-CZ 4.2Å; T240-F406 HydrophobicContact CG2-CD1 3.95Å; F244-F406 HydrophobicContact CB-CB 4.39Å; F244-F406 HydrophobicContact CB-CD1 3.9Å; F244-F406 HydrophobicContact CB-CD2 3.64Å; F244-F406 HydrophobicContact CB-CE1 4.01Å; F244-F406 HydrophobicContact CB-CE2 3.75Å; F244-F406 HydrophobicContact CB-CG 3.71Å; F244-F406 HydrophobicContact CB-CZ 3.94Å; F244-F406 HydrophobicContact CD1-CB 3.54Å; F244-F406 AromaticContact CD1-CD2 3.77Å; F244-F406 HydrophobicContact CD1-CD2 3.77Å; F244-F406 AromaticContact CD1-CG 3.74Å; F244-F406 HydrophobicContact CD1-CG 3.74Å; F244-F406 AromaticContact CD2-CD2 3.19Å; F244-F406 HydrophobicContact CD2-CD2 3.19Å; F244-F406 AromaticContact CD2-CE2 3.46Å; F244-F406 HydrophobicContact CD2-CE2 3.46Å; F244-F406 VanDerWaalsContact CD2-CE2 3.46Å; F244-F406 HydrophobicContact CD2-CG 4Å; F244-F406 HydrophobicContact CD2-CZ 4.44Å; F244-F406 HydrophobicContact CE1-CB 3.91Å; F244-F406 HydrophobicContact CE1-CD2 4.24Å; F244-F406 HydrophobicContact CE1-CG 4.38Å; F244-F406 AromaticContact CE2-CD2 3.73Å; F244-F406 HydrophobicContact CE2-CD2 3.73Å; F244-F406 HydrophobicContact CE2-CE2 4.25Å; F244-F406 HydrophobicContact CG-CB 3.89Å; F244-F406 HydrophobicContact CG-CD1 4.22Å; F244-F406 AromaticContact CG-CD2 3.21Å; F244-F406 HydrophobicContact CG-CD2 3.21Å; F244-F406 AromaticContact CG-CE2 3.7Å; F244-F406 HydrophobicContact CG-CE2 3.7Å; F244-F406 AromaticContact CG-CG 3.52Å; F244-F406 HydrophobicContact CG-CG 3.52Å; F244-F406 HydrophobicContact CG-CZ 4.38Å; F244-F406 HydrophobicContact CZ-CD2 4.23Å; Y245-F406 PolarHBondContact OH-O 2.79Å; W402-F406 HydrophobicContact CB-CD2 3.91Å; W402-F406 HydrophobicContact CB-CE2 3.87Å; W402-F406 AromaticContact CD2-CE2 3.82Å; W402-F406 HydrophobicContact CD2-CE2 3.82Å; W402-F406 HydrophobicContact CE3-CD2 4.07Å; W402-F406 AromaticContact CE3-CE2 3.33Å; W402-F406 HydrophobicContact CE3-CE2 3.33Å; W402-F406 AromaticContact CE3-CZ 3.93Å; W402-F406 HydrophobicContact CE3-CZ 3.93Å; W402-F406 HydrophobicContact CG-CE2 4.09Å; W402-F406 HydrophobicContact CZ3-CE2 4.13Å; W402-F406 HydrophobicContact CZ3-CZ 4.3Å; W402-F406 VanDerWaalsContact O-CD2 3.24Å; W402-F406 WeakPolarHBondContact O-CD2 3.36Å; W402-F406 PolarHBondContact O-N 3.19Å; L403-F406 PolarHBondContact O-N 3.42Å; F406-L410 WeakPolarHBondContact O-CB 3.48Å; F406-L410 PolarHBondContact O-N 2.96Å; F406-L410 VanDerWaalsContact O-N 3.17Å
407	M	94.4	Very high	93	Very high	79 Å²	79	34 Å²	34	39%	0.389	19%	0.194	S	C	.	.	H	α-helix	trans	-64.6	-46.6	173.8	-74.2	-67.9	-62.8	0	0	111.3	Y245 L403 F405 L411	Y245-M407 HydrophobicContact CE1-SD 3.94Å; Y245-M407 WeakPolarHBondContact OH-CA 3.32Å; Y245-M407 PolarHBondContact OH-SD 3.21Å; L403-M407 HydrophobicContact CD1-CG 3.73Å; L403-M407 HydrophobicContact CD1-SD 4.18Å; L403-M407 HydrophobicContact CG-CG 4.03Å; L403-M407 WeakPolarHBondContact O-CB 3.48Å; L403-M407 WeakPolarHBondContact O-CG 3.45Å; L403-M407 PolarHBondContact O-N 3.23Å; F405-M407 VanDerWaalsContact C-N 3.32Å; F405-M407 PolarHBondContact O-N 3.47Å; M407-L411 WeakPolarHBondContact O-CB 3.22Å; M407-L411 PolarHBondContact O-N 3.46Å
408	I	92.9	Very high	93.1	Very high	12 Å²	12	36 Å²	36	6%	0.062	21%	0.214	C	C	.	.	H	α-helix	trans	-69.1	-44.3	-179.5	-70.7	-174.8	0	0	0	111.8	P404 F405 L410 L411 L412 I426 F431 L434	P404-I408 WeakPolarHBondContact O-CG1 3.48Å; P404-I408 PolarHBondContact O-N 3.26Å; P404-I408 VanDerWaalsContact O-N 3.15Å; F405-I408 PolarHBondContact O-N 3.39Å; I408-L410 VanDerWaalsContact C-N 3.33Å; I408-L410 PolarHBondContact O-N 2.91Å; I408-L411 PolarHBondContact O-N 2.95Å; I408-L412 HydrophobicContact CG2-CD1 3.72Å; I408-L412 HydrophobicContact CG2-CG 4.2Å; I408-L412 WeakPolarHBondContact O-CG 3.32Å; I408-L412 PolarHBondContact O-N 3.3Å; I408-I426 HydrophobicContact CD1-CD1 4.07Å; I408-I426 HydrophobicContact CG1-CD1 4.36Å; I408-I426 HydrophobicContact CG2-CD1 3.51Å; I408-F431 HydrophobicContact CG2-CD1 4.4Å; I408-F431 HydrophobicContact CG2-CE1 3.8Å; I408-F431 HydrophobicContact CG2-CZ 4.22Å; I408-L434 HydrophobicContact CD1-CD1 3.34Å; I408-L434 HydrophobicContact CG1-CD1 4.3Å
409	Q	92.2	Very high	93.2	Very high	25 Å²	25	39.3 Å²	39.3	12%	0.117	25%	0.247	C	C	.	.	H	α-helix	trans	-56.2	-47.4	177.1	-73.8	-74.2	92.8	0	0	111.6	F405 A413	F405-Q409 HydrophobicContact CD1-CG 4.15Å; F405-Q409 HydrophobicContact CD2-CG 4.4Å; F405-Q409 HydrophobicContact CE1-CG 3.78Å; F405-Q409 HydrophobicContact CE2-CG 4.05Å; F405-Q409 HydrophobicContact CG-CG 4.45Å; F405-Q409 HydrophobicContact CZ-CG 3.73Å; F405-Q409 WeakPolarHBondContact O-CG 3.19Å; F405-Q409 PolarHBondContact O-N 3.34Å; Q409-A413 WeakPolarHBondContact O-CB 3.33Å; Q409-A413 PolarHBondContact O-N 2.92Å; Q409-A413 VanDerWaalsContact O-N 3.15Å
410	L	93.5	Very high	93.2	Very high	34 Å²	34	43 Å²	43	18%	0.178	26%	0.257	C	S	.	.	H	α-helix	trans	-68	-43.5	178	-178.7	61.3	0	0	0	111.9	V237 Y245 F406 I408 L412 A413 L414	V237-L410 HydrophobicContact CG2-CD1 3.99Å; Y245-L410 HydrophobicContact CD2-CD2 4.4Å; Y245-L410 HydrophobicContact CE2-CB 4.44Å; Y245-L410 HydrophobicContact CE2-CD2 3.53Å; F406-L410 WeakPolarHBondContact O-CB 3.48Å; F406-L410 PolarHBondContact O-N 2.96Å; F406-L410 VanDerWaalsContact O-N 3.17Å; I408-L410 VanDerWaalsContact C-N 3.33Å; I408-L410 PolarHBondContact O-N 2.91Å; L410-L412 PolarHBondContact O-N 3.17Å; L410-A413 PolarHBondContact O-N 2.94Å; L410-L414 HydrophobicContact CD1-CD1 4.15Å; L410-L414 HydrophobicContact CD1-CG 4.16Å; L410-L414 HydrophobicContact CG-CD1 3.96Å; L410-L414 HydrophobicContact CG-CG 4.39Å; L410-L414 VanDerWaalsContact O-CG 3.27Å; L410-L414 WeakPolarHBondContact O-CG 3.39Å; L410-L414 PolarHBondContact O-N 2.92Å
411	L	94.1	Very high	93.1	Very high	69 Å²	69	45.4 Å²	45.4	36%	0.361	27%	0.27	S	S	.	.	H	α-helix	trans	-58.1	-48.2	179.3	175.5	61.5	0	0	0	111.6	M407 I408 L414 L415	M407-L411 WeakPolarHBondContact O-CB 3.22Å; M407-L411 PolarHBondContact O-N 3.46Å; I408-L411 PolarHBondContact O-N 2.95Å; L411-L414 PolarHBondContact O-N 3.49Å; L411-L415 HydrophobicContact CD1-CD1 4.05Å; L411-L415 HydrophobicContact CD1-CG 4.13Å; L411-L415 HydrophobicContact CG-CD1 4.03Å; L411-L415 HydrophobicContact CG-CG 4.48Å; L411-L415 WeakPolarHBondContact O-CG 3.49Å; L411-L415 PolarHBondContact O-N 3.42Å
412	L	92.2	Very high	92.8	Very high	17 Å²	17	46.7 Å²	46.7	9%	0.089	28%	0.278	C	S	.	.	H	α-helix	trans	-68.2	-36.9	-179.2	-67	175.3	0	0	0	112.3	I408 L410 L414 L415 S416 T422 M425 I426 F431	I408-L412 HydrophobicContact CG2-CD1 3.72Å; I408-L412 HydrophobicContact CG2-CG 4.2Å; I408-L412 WeakPolarHBondContact O-CG 3.32Å; I408-L412 PolarHBondContact O-N 3.3Å; L410-L412 PolarHBondContact O-N 3.17Å; L412-L414 VanDerWaalsContact C-N 3.31Å; L412-L414 PolarHBondContact O-N 3.38Å; L412-L415 PolarHBondContact O-N 3.47Å; L412-S416 VanDerWaalsContact O-CB 3.28Å; L412-S416 WeakPolarHBondContact O-CB 3.32Å; L412-S416 PolarHBondContact O-N 2.91Å; L412-T422 HydrophobicContact CD2-CG2 4.26Å; L412-M425 HydrophobicContact CD2-CB 4.46Å; L412-M425 HydrophobicContact CD2-SD 3.94Å; L412-I426 HydrophobicContact CD1-CD1 4.04Å; L412-I426 HydrophobicContact CD2-CD1 4.15Å; L412-I426 HydrophobicContact CD2-CG1 4.38Å; L412-I426 HydrophobicContact CG-CD1 4.31Å; L412-F431 HydrophobicContact CD1-CE1 3.74Å; L412-F431 HydrophobicContact CD1-CE2 4Å; L412-F431 HydrophobicContact CD1-CZ 3.09Å
413	A	91.9	Very high	92.2	Very high	6 Å²	6	51 Å²	51	5%	0.05	31%	0.306	C	S	.	.	H	α-helix	trans	-61.7	-40.7	173.4	0	0	0	0	0	112	Q236 Q409 L410 A417	Q236-A413 HydrophobicContact CB-CB 3.49Å; Q236-A413 VanDerWaalsContact CB-CB 3.49Å; Q236-A413 HydrophobicContact CG-CB 3.7Å; Q409-A413 WeakPolarHBondContact O-CB 3.33Å; Q409-A413 PolarHBondContact O-N 2.92Å; Q409-A413 VanDerWaalsContact O-N 3.15Å; L410-A413 PolarHBondContact O-N 2.94Å; A413-A417 WeakPolarHBondContact O-CB 3.18Å; A413-A417 PolarHBondContact O-N 3.34Å
414	L	94	Very high	91.5	Very high	85 Å²	85	54.9 Å²	54.9	45%	0.445	33%	0.327	S	S	.	.	H	α-helix	trans	-70	-40.9	177.5	-69.4	172.8	0	0	0	112.5	V233 V237 L410 L411 L412 A417 A418	V233-L414 HydrophobicContact CG2-CD2 4.35Å; V237-L414 HydrophobicContact CG2-CD2 4.44Å; L410-L414 HydrophobicContact CD1-CD1 4.15Å; L410-L414 HydrophobicContact CD1-CG 4.16Å; L410-L414 HydrophobicContact CG-CD1 3.96Å; L410-L414 HydrophobicContact CG-CG 4.39Å; L410-L414 VanDerWaalsContact O-CG 3.27Å; L410-L414 WeakPolarHBondContact O-CG 3.39Å; L410-L414 PolarHBondContact O-N 2.92Å; L411-L414 PolarHBondContact O-N 3.49Å; L412-L414 VanDerWaalsContact C-N 3.31Å; L412-L414 PolarHBondContact O-N 3.38Å; L414-A417 PolarHBondContact O-N 2.86Å; L414-A418 WeakPolarHBondContact O-CB 3.08Å; L414-A418 PolarHBondContact O-N 3.34Å
415	L	94.4	Very high	91.1	Very high	37 Å²	37	55.6 Å²	55.6	19%	0.194	33%	0.328	C	S	.	.	H	α-helix	trans	-64.5	-44.2	176.2	-73.5	175.4	0	0	0	111.6	L411 L412 A417 A418 G419 Y420 T422 M425	L411-L415 HydrophobicContact CD1-CD1 4.05Å; L411-L415 HydrophobicContact CD1-CG 4.13Å; L411-L415 HydrophobicContact CG-CD1 4.03Å; L411-L415 HydrophobicContact CG-CG 4.48Å; L411-L415 WeakPolarHBondContact O-CG 3.49Å; L411-L415 PolarHBondContact O-N 3.42Å; L412-L415 PolarHBondContact O-N 3.47Å; L415-A417 VanDerWaalsContact C-N 3.33Å; L415-A417 PolarHBondContact O-N 2.69Å; L415-A418 CarbonylContact O-C 3.55Å; L415-A418 PolarHBondContact O-N 3.5Å; L415-A418 VanDerWaalsContact O-N 3.11Å; L415-G419 PolarHBondContact O-N 2.97Å; L415-Y420 HydrophobicContact CD2-CD2 3.89Å; L415-Y420 HydrophobicContact CD2-CE2 4.3Å; L415-Y420 HydrophobicContact CD2-CG 4.37Å; L415-Y420 WeakPolarHBondContact O-CB 3.26Å; L415-Y420 PolarHBondContact O-N 3.42Å; L415-T422 HydrophobicContact CB-CG2 3.75Å; L415-M425 HydrophobicContact CD1-CE 3.91Å; L415-M425 HydrophobicContact CD1-SD 3.77Å
416	S	90.8	Very high	90.9	Very high	58 Å²	58	55.7 Å²	55.7	41%	0.406	33%	0.329	S	S	.	.	H	α-helix	trans	-59.6	-44.4	174.4	178.4	0	0	0	0	111.3	L412 A418 G419	L412-S416 VanDerWaalsContact O-CB 3.28Å; L412-S416 WeakPolarHBondContact O-CB 3.32Å; L412-S416 PolarHBondContact O-N 2.91Å; S416-A418 VanDerWaalsContact C-N 3.27Å; S416-A418 PolarHBondContact O-N 2.88Å; S416-G419 PolarHBondContact O-N 3.27Å
417	A	91.3	Very high	90.6	Very high	63 Å²	63	58.1 Å²	58.1	52%	0.521	35%	0.347	S	S	.	.	H	α-helix	trans	-65.5	-27.5	175.2	0	0	0	0	0	113.9	V233 A413 L414 L415 G419	V233-A417 HydrophobicContact CB-CB 3.87Å; V233-A417 HydrophobicContact CG1-CB 4Å; V233-A417 HydrophobicContact CG2-CB 3.68Å; A413-A417 WeakPolarHBondContact O-CB 3.18Å; A413-A417 PolarHBondContact O-N 3.34Å; L414-A417 PolarHBondContact O-N 2.86Å; L415-A417 VanDerWaalsContact C-N 3.33Å; L415-A417 PolarHBondContact O-N 2.69Å; A417-G419 PolarHBondContact O-N 3.37Å
418	A	93.6	Very high	90.1	Very high	70 Å²	70	57.5 Å²	57.5	58%	0.579	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-0.2	173.4	0	0	0	0	0	113.5	L414 L415 S416 Y420	L414-A418 WeakPolarHBondContact O-CB 3.08Å; L414-A418 PolarHBondContact O-N 3.34Å; L415-A418 CarbonylContact O-C 3.55Å; L415-A418 PolarHBondContact O-N 3.5Å; L415-A418 VanDerWaalsContact O-N 3.11Å; S416-A418 VanDerWaalsContact C-N 3.27Å; S416-A418 PolarHBondContact O-N 2.88Å; A418-Y420 HydrophobicContact CB-CD2 3.84Å; A418-Y420 HydrophobicContact CB-CE2 3.93Å
419	G	91.5	Very high	89.7	Confident	68 Å²	68	60.7 Å²	60.7	70%	0.701	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.6	8.2	176.3	0	0	0	0	0	115.2	L415 S416 A417	L415-G419 PolarHBondContact O-N 2.97Å; S416-G419 PolarHBondContact O-N 3.27Å; A417-G419 PolarHBondContact O-N 3.37Å
420	Y	91.6	Very high	89.5	Confident	108 Å²	108	62 Å²	62	42%	0.424	38%	0.381	S	S	.	.			trans	-78.8	143.3	175.2	-66.4	-85.6	0	0	0	111.2	I39 L415 A418 T422	I39-Y420 HydrophobicContact CG1-CE1 4.17Å; L415-Y420 HydrophobicContact CD2-CD2 3.89Å; L415-Y420 HydrophobicContact CD2-CE2 4.3Å; L415-Y420 HydrophobicContact CD2-CG 4.37Å; L415-Y420 WeakPolarHBondContact O-CB 3.26Å; L415-Y420 PolarHBondContact O-N 3.42Å; A418-Y420 HydrophobicContact CB-CD2 3.84Å; A418-Y420 HydrophobicContact CB-CE2 3.93Å; Y420-T422 PolarHBondContact O-N 2.98Å; Y420-T422 VanDerWaalsContact O-N 3.13Å
421	N	89.7	Confident	89.4	Confident	90 Å²	90	62.9 Å²	62.9	48%	0.481	38%	0.383	S	S	.	.			trans	-73.6	104.7	172.3	-175.7	9.6	0	0	0	110.6	V423	N421-V423 VanDerWaalsContact OD1-CB 3.28Å; N421-V423 WeakPolarHBondContact OD1-CB 3.29Å; N421-V423 WeakPolarHBondContact OD1-CG2 3.38Å; N421-V423 PolarHBondContact OD1-N 2.89Å; N421-V423 VanDerWaalsContact OD1-N 3.09Å
422	T	87.4	Confident	89.1	Confident	33 Å²	33	61.6 Å²	61.6	20%	0.202	37%	0.374	C	S	.	.			trans	-90.1	-2.5	178.7	60.6	0	0	0	0	113.5	L412 L415 Y420 N424 M425	L412-T422 HydrophobicContact CD2-CG2 4.26Å; L415-T422 HydrophobicContact CB-CG2 3.75Å; Y420-T422 PolarHBondContact O-N 2.98Å; Y420-T422 VanDerWaalsContact O-N 3.13Å; T422-N424 PolarHBondContact O-N 3.5Å; T422-M425 PolarHBondContact O-N 2.98Å
423	V	82.8	Confident	89.1	Confident	101 Å²	101	67.3 Å²	67.3	61%	0.612	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	126.3	179	-177.6	0	0	0	0	108.7	N421 M425	N421-V423 VanDerWaalsContact OD1-CB 3.28Å; N421-V423 WeakPolarHBondContact OD1-CB 3.29Å; N421-V423 WeakPolarHBondContact OD1-CG2 3.38Å; N421-V423 PolarHBondContact OD1-N 2.89Å; N421-V423 VanDerWaalsContact OD1-N 3.09Å; V423-M425 PolarHBondContact O-N 3.43Å
424	N	80.6	Confident	89.2	Confident	137 Å²	137	67.8 Å²	67.8	73%	0.733	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	10.1	-178.1	-55.6	-34	0	0	0	115.9	T422 I426	T422-N424 PolarHBondContact O-N 3.5Å; N424-I426 PolarHBondContact O-N 2.92Å
425	M	87.2	Confident	89.2	Confident	37 Å²	37	64.9 Å²	64.9	18%	0.182	38%	0.384	C	S	.	.	S	Bend	trans	-59.9	-34.6	175.4	-173.4	178.2	-168.4	0	0	111.4	L412 L415 T422 V423	L412-M425 HydrophobicContact CD2-CB 4.46Å; L412-M425 HydrophobicContact CD2-SD 3.94Å; L415-M425 HydrophobicContact CD1-CE 3.91Å; L415-M425 HydrophobicContact CD1-SD 3.77Å; T422-M425 PolarHBondContact O-N 2.98Å; V423-M425 PolarHBondContact O-N 3.43Å
426	I	88.1	Confident	89.2	Confident	18 Å²	18	65.1 Å²	65.1	9%	0.092	38%	0.382	C	S	.	.	S	Bend	trans	-124.3	127.9	174.8	-59.9	-173.7	0	0	0	108.2	I408 L412 N424 V430 F431	I408-I426 HydrophobicContact CD1-CD1 4.07Å; I408-I426 HydrophobicContact CG1-CD1 4.36Å; I408-I426 HydrophobicContact CG2-CD1 3.51Å; L412-I426 HydrophobicContact CD1-CD1 4.04Å; L412-I426 HydrophobicContact CD2-CD1 4.15Å; L412-I426 HydrophobicContact CD2-CG1 4.38Å; L412-I426 HydrophobicContact CG-CD1 4.31Å; N424-I426 PolarHBondContact O-N 2.92Å; I426-V430 HydrophobicContact CG2-CB 3.81Å; I426-V430 HydrophobicContact CG2-CG1 3.86Å; I426-F431 HydrophobicContact CB-CD2 4.25Å; I426-F431 HydrophobicContact CB-CE2 3.73Å; I426-F431 HydrophobicContact CB-CZ 4.43Å; I426-F431 HydrophobicContact CG2-CD2 3.87Å; I426-F431 HydrophobicContact CG2-CE2 3.85Å
427	P	87.8	Confident	89.4	Confident	74 Å²	74	64.7 Å²	64.7	48%	0.481	38%	0.375	S	S	.	.			trans	-58.6	142	177.5	-23.8	32.9	0	0	0	112.3	S429 V430 F431	P427-S429 PolarHBondContact O-N 3.39Å; P427-V430 HydrophobicContact CB-CG2 4.25Å; P427-V430 HydrophobicContact CG-CG2 4.31Å; P427-V430 WeakPolarHBondContact O-CB 3.49Å; P427-V430 PolarHBondContact O-N 2.94Å; P427-F431 PolarHBondContact O-N 3.44Å
428	V	83.9	Confident	89.5	Confident	66 Å²	66	61.7 Å²	61.7	40%	0.4	35%	0.35	S	S	.	.	H	α-helix	trans	-55.2	-35.8	177.7	177.5	0	0	0	0	111.7	V430 F431 R432	V428-V430 VanDerWaalsContact C-N 3.29Å; V428-V430 PolarHBondContact O-N 3.48Å; V428-F431 WeakPolarHBondContact O-CB 3.36Å; V428-F431 PolarHBondContact O-N 2.94Å; V428-R432 HydrophobicContact CG1-CG 4.32Å; V428-R432 WeakPolarHBondContact O-CG 3.41Å; V428-R432 PolarHBondContact O-N 3.4Å
429	S	85	Confident	89.6	Confident	79 Å²	79	58.5 Å²	58.5	55%	0.552	32%	0.323	S	S	*	.	H	α-helix	trans	-59.8	-36.1	176.2	57.9	0	0	0	0	113.3	P427 F433	P427-S429 PolarHBondContact O-N 3.39Å; S429-F433 VanDerWaalsContact O-CB 3.29Å; S429-F433 WeakPolarHBondContact O-CB 3.42Å; S429-F433 PolarHBondContact O-N 3.15Å
430	V	89	Confident	89.7	Confident	52 Å²	52	57.4 Å²	57.4	32%	0.315	30%	0.303	S	S	.	.	H	α-helix	trans	-69.3	-43.6	176.7	176.7	0	0	0	0	110.3	I426 P427 V428 F433 L434	I426-V430 HydrophobicContact CG2-CB 3.81Å; I426-V430 HydrophobicContact CG2-CG1 3.86Å; P427-V430 HydrophobicContact CB-CG2 4.25Å; P427-V430 HydrophobicContact CG-CG2 4.31Å; P427-V430 WeakPolarHBondContact O-CB 3.49Å; P427-V430 PolarHBondContact O-N 2.94Å; V428-V430 VanDerWaalsContact C-N 3.29Å; V428-V430 PolarHBondContact O-N 3.48Å; V430-F433 PolarHBondContact O-N 3.28Å; V430-L434 HydrophobicContact CG1-CD1 4.29Å; V430-L434 HydrophobicContact CG1-CG 4.47Å; V430-L434 WeakPolarHBondContact O-CG 3.44Å; V430-L434 PolarHBondContact O-N 3.4Å
431	F	89.8	Confident	89.7	Confident	52 Å²	52	52.3 Å²	52.3	23%	0.228	28%	0.283	C	S	.	.	H	α-helix	trans	-59.5	-49.2	174.5	-81.1	-80.9	0	0	0	112.4	I408 L412 I426 P427 V428 F433 L434 Q435	I408-F431 HydrophobicContact CG2-CD1 4.4Å; I408-F431 HydrophobicContact CG2-CE1 3.8Å; I408-F431 HydrophobicContact CG2-CZ 4.22Å; L412-F431 HydrophobicContact CD1-CE1 3.74Å; L412-F431 HydrophobicContact CD1-CE2 4Å; L412-F431 HydrophobicContact CD1-CZ 3.09Å; I426-F431 HydrophobicContact CB-CD2 4.25Å; I426-F431 HydrophobicContact CB-CE2 3.73Å; I426-F431 HydrophobicContact CB-CZ 4.43Å; I426-F431 HydrophobicContact CG2-CD2 3.87Å; I426-F431 HydrophobicContact CG2-CE2 3.85Å; P427-F431 PolarHBondContact O-N 3.44Å; V428-F431 WeakPolarHBondContact O-CB 3.36Å; V428-F431 PolarHBondContact O-N 2.94Å; F431-F433 VanDerWaalsContact C-N 3.31Å; F431-F433 PolarHBondContact O-N 2.97Å; F431-L434 PolarHBondContact O-N 3.39Å; F431-Q435 WeakPolarHBondContact O-CB 3.36Å; F431-Q435 PolarHBondContact O-N 3.29Å
432	R	89.7	Confident	90	Very high	43 Å²	43	48 Å²	48	16%	0.162	26%	0.26	C	S	.	.	H	α-helix	trans	-58.2	-45.1	176.6	-73	-178.7	177	148	2.3	110.8	E72 D139 G143 V428 L434 Q435 W436	E72-R432 IonicContact OE1-NH1 2.77Å; E72-R432 IonicContact OE2-CZ 2.68Å; E72-R432 IonicContact OE2-NH1 2.72Å; E72-R432 PolarHBondContact OE2-NH1 3.38Å; D139-R432 IonicContact OD2-NE 3.76Å; G143-R432 PolarHBondContact O-NH2 3Å; V428-R432 HydrophobicContact CG1-CG 4.32Å; V428-R432 WeakPolarHBondContact O-CG 3.41Å; V428-R432 PolarHBondContact O-N 3.4Å; R432-L434 PolarHBondContact O-N 3.15Å; R432-Q435 PolarHBondContact O-N 2.89Å; R432-W436 WeakPolarHBondContact O-CB 3.36Å; R432-W436 PolarHBondContact O-N 3.2Å
433	F	91.4	Very high	90.3	Very high	136 Å²	136	48.9 Å²	48.9	60%	0.596	26%	0.261	S	S	*	.	H	α-helix	trans	-58.5	-46.5	176.7	173	-99.5	0	0	0	112.4	S429 V430 F431 W436 L437	S429-F433 VanDerWaalsContact O-CB 3.29Å; S429-F433 WeakPolarHBondContact O-CB 3.42Å; S429-F433 PolarHBondContact O-N 3.15Å; V430-F433 PolarHBondContact O-N 3.28Å; F431-F433 VanDerWaalsContact C-N 3.31Å; F431-F433 PolarHBondContact O-N 2.97Å; F433-W436 PolarHBondContact O-N 3.14Å; F433-L437 WeakPolarHBondContact O-CB 3.44Å; F433-L437 PolarHBondContact O-N 3.1Å
434	L	94.3	Very high	90.8	Very high	17 Å²	17	46.1 Å²	46.1	9%	0.089	24%	0.243	C	C	.	.	H	α-helix	trans	-69.8	-34.2	179.7	-67.3	-176.3	0	0	0	113.2	P404 F405 I408 V430 F431 R432 L437 G438	P404-L434 HydrophobicContact CB-CD1 4.24Å; P404-L434 HydrophobicContact CB-CD2 3.72Å; F405-L434 HydrophobicContact CB-CB 4.23Å; F405-L434 HydrophobicContact CD2-CB 4.28Å; I408-L434 HydrophobicContact CD1-CD1 3.34Å; I408-L434 HydrophobicContact CG1-CD1 4.3Å; V430-L434 HydrophobicContact CG1-CD1 4.29Å; V430-L434 HydrophobicContact CG1-CG 4.47Å; V430-L434 WeakPolarHBondContact O-CG 3.44Å; V430-L434 PolarHBondContact O-N 3.4Å; F431-L434 PolarHBondContact O-N 3.39Å; R432-L434 PolarHBondContact O-N 3.15Å; L434-L437 HydrophobicContact CD2-CD2 4.22Å; L434-L437 WeakPolarHBondContact O-CB 3.48Å; L434-L437 PolarHBondContact O-N 3.47Å; L434-G438 PolarHBondContact O-N 3.27Å
435	Q	93.7	Very high	91.4	Very high	24 Å²	24	39.6 Å²	39.6	11%	0.112	21%	0.208	C	C	.	.	H	α-helix	trans	-64	-47.5	172.8	-172.9	-174	15.4	0	0	110.8	Y155 Y229 F405 F431 R432 L437 G438 Y439	Y155-Q435 PolarHBondContact OH-NE2 2.94Å; Y155-Q435 VanDerWaalsContact OH-NE2 3.12Å; Y229-Q435 PolarHBondContact OH-NE2 3.31Å; F405-Q435 HydrophobicContact CD2-CB 4.28Å; F405-Q435 HydrophobicContact CE2-CB 4.09Å; F405-Q435 HydrophobicContact CE2-CG 4.45Å; F431-Q435 WeakPolarHBondContact O-CB 3.36Å; F431-Q435 PolarHBondContact O-N 3.29Å; R432-Q435 PolarHBondContact O-N 2.89Å; Q435-L437 VanDerWaalsContact C-N 3.3Å; Q435-L437 PolarHBondContact O-N 3.23Å; Q435-G438 WeakPolarHBondContact O-CA 3.43Å; Q435-G438 PolarHBondContact O-N 2.9Å; Q435-Y439 HydrophobicContact CG-CD2 4.45Å; Q435-Y439 HydrophobicContact CG-CE2 3.69Å; Q435-Y439 PolarHBondContact NE2-OH 3.34Å; Q435-Y439 VanDerWaalsContact NE2-OH 3.16Å; Q435-Y439 PolarHBondContact O-N 3.41Å
436	W	94.4	Very high	91.7	Very high	41 Å²	41	38.3 Å²	38.3	16%	0.155	20%	0.202	C	C	.	.	H	α-helix	trans	-60.8	-38	173.8	-87	102.5	0	0	0	112.5	S86 L133 T136 I137 R432 F433 G438 Y439 V440	S86-W436 VanDerWaalsContact CB-CH2 3.5Å; L133-W436 HydrophobicContact CD2-CH2 4.41Å; L133-W436 HydrophobicContact CD2-CZ3 4.28Å; T136-W436 HydrophobicContact CG2-CH2 4.41Å; T136-W436 HydrophobicContact CG2-CZ2 3.6Å; I137-W436 HydrophobicContact CD1-CH2 4.25Å; I137-W436 HydrophobicContact CG1-CH2 3.56Å; I137-W436 HydrophobicContact CG1-CZ2 3.82Å; R432-W436 WeakPolarHBondContact O-CB 3.36Å; R432-W436 PolarHBondContact O-N 3.2Å; F433-W436 PolarHBondContact O-N 3.14Å; W436-G438 PolarHBondContact O-N 3.34Å; W436-Y439 HydrophobicContact CD2-CD2 4.29Å; W436-Y439 HydrophobicContact CE3-CD2 4.23Å; W436-Y439 PolarHBondContact O-N 2.91Å; W436-Y439 VanDerWaalsContact O-N 3.16Å; W436-V440 WeakPolarHBondContact O-CG2 3.16Å; W436-V440 PolarHBondContact O-N 3.29Å
437	L	94.5	Very high	91.9	Very high	50 Å²	50	41.5 Å²	41.5	26%	0.262	22%	0.219	S	C	.	.	H	α-helix	trans	-60.2	-36.2	172.7	-179.1	63.2	0	0	0	111.8	C401 P404 F433 L434 Q435 V440	C401-L437 WeakPolarHBondContact CB-O 3.48Å; C401-L437 PolarHBondContact SG-O 3.41Å; P404-L437 HydrophobicContact CG-CD2 4.37Å; F433-L437 WeakPolarHBondContact O-CB 3.44Å; F433-L437 PolarHBondContact O-N 3.1Å; L434-L437 HydrophobicContact CD2-CD2 4.22Å; L434-L437 WeakPolarHBondContact O-CB 3.48Å; L434-L437 PolarHBondContact O-N 3.47Å; Q435-L437 VanDerWaalsContact C-N 3.3Å; Q435-L437 PolarHBondContact O-N 3.23Å; L437-V440 WeakPolarHBondContact O-CB 3.46Å; L437-V440 PolarHBondContact O-N 2.83Å
438	G	94	Very high	92.1	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-61.1	-50.4	169.8	0	0	0	0	0	112.5	C401 L434 Q435 W436 V440 N441	C401-G438 PolarHBondContact O-N 3.28Å; L434-G438 PolarHBondContact O-N 3.27Å; Q435-G438 WeakPolarHBondContact O-CA 3.43Å; Q435-G438 PolarHBondContact O-N 2.9Å; W436-G438 PolarHBondContact O-N 3.34Å; G438-V440 PolarHBondContact O-N 3.09Å; G438-N441 WeakPolarHBondContact O-CB 3.08Å; G438-N441 PolarHBondContact O-N 2.84Å
439	Y	95.4	Very high	92.5	Very high	3 Å²	3	35.4 Å²	35.4	1%	0.012	18%	0.18	C	C	.	.	H	α-helix	trans	-61.4	-29.9	177.9	-63	-38.7	0	0	0	113.9	V128 V132 L133 T136 Y155 D159 Q435 W436 N441 S442	V128-Y439 HydrophobicContact CG1-CD1 4.12Å; V128-Y439 HydrophobicContact CG1-CE1 4.48Å; V132-Y439 HydrophobicContact CG1-CE1 3.81Å; V132-Y439 WeakPolarHBondContact CG1-OH 3.32Å; L133-Y439 HydrophobicContact CD2-CD1 4.06Å; L133-Y439 HydrophobicContact CD2-CD2 3.65Å; L133-Y439 HydrophobicContact CD2-CE2 4.16Å; L133-Y439 HydrophobicContact CD2-CG 3.61Å; T136-Y439 HydrophobicContact CG2-CD2 4.23Å; T136-Y439 HydrophobicContact CG2-CE2 3.56Å; Y155-Y439 PolarHBondContact OH-OH 3.47Å; D159-Y439 WeakPolarHBondContact OD1-CE1 3.31Å; Q435-Y439 HydrophobicContact CG-CD2 4.45Å; Q435-Y439 HydrophobicContact CG-CE2 3.69Å; Q435-Y439 PolarHBondContact NE2-OH 3.34Å; Q435-Y439 VanDerWaalsContact NE2-OH 3.16Å; Q435-Y439 PolarHBondContact O-N 3.41Å; W436-Y439 HydrophobicContact CD2-CD2 4.29Å; W436-Y439 HydrophobicContact CE3-CD2 4.23Å; W436-Y439 PolarHBondContact O-N 2.91Å; W436-Y439 VanDerWaalsContact O-N 3.16Å; Y439-N441 PolarHBondContact O-N 2.87Å; Y439-N441 VanDerWaalsContact O-N 3.17Å; Y439-S442 PolarHBondContact O-N 3.28Å; Y439-S442 VanDerWaalsContact O-N 3.13Å
440	V	93	Very high	92.8	Very high	45 Å²	45	33.5 Å²	33.5	27%	0.273	17%	0.169	S	C	.	.	H	α-helix	trans	-58.4	-26.4	172.9	168.3	0	0	0	0	111.7	W436 L437 G438 S442 F443 L444	W436-V440 WeakPolarHBondContact O-CG2 3.16Å; W436-V440 PolarHBondContact O-N 3.29Å; L437-V440 WeakPolarHBondContact O-CB 3.46Å; L437-V440 PolarHBondContact O-N 2.83Å; G438-V440 PolarHBondContact O-N 3.09Å; V440-S442 PolarHBondContact O-N 2.64Å; V440-F443 WeakPolarHBondContact O-CB 3.5Å; V440-F443 PolarHBondContact O-N 3.34Å; V440-F443 VanDerWaalsContact O-N 3.16Å; V440-L444 HydrophobicContact CG1-CD1 3.84Å; V440-L444 HydrophobicContact CG1-CD2 4.49Å; V440-L444 HydrophobicContact CG1-CG 3.86Å; V440-L444 VanDerWaalsContact O-CG 3.27Å; V440-L444 WeakPolarHBondContact O-CG 3.35Å; V440-L444 PolarHBondContact O-N 2.46Å
441	N	92.9	Very high	92.7	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-57.9	-47.8	174.2	-173.4	9.8	0	0	0	112	C401 W402 G438 Y439 F443 L444 N445	C401-N441 HydrophobicContact CB-CB 3.79Å; W402-N441 PolarHBondContact NE1-ND2 2.77Å; G438-N441 WeakPolarHBondContact O-CB 3.08Å; G438-N441 PolarHBondContact O-N 2.84Å; Y439-N441 PolarHBondContact O-N 2.87Å; Y439-N441 VanDerWaalsContact O-N 3.17Å; N441-F443 PolarHBondContact O-N 3.49Å; N441-L444 PolarHBondContact O-N 3.14Å; N441-N445 PolarHBondContact O-N 3.12Å
442	S	94.8	Very high	92.5	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.007	19%	0.192	C	C	.	.	H	α-helix	trans	-61.4	-30.4	178.5	-63.1	0	0	0	0	112.3	N97 D125 Y439 V440	N97-S442 PolarHBondContact ND2-O 3.11Å; D125-S442 WeakPolarHBondContact OD1-CB 3.32Å; D125-S442 PolarHBondContact OD1-OG 3.41Å; Y439-S442 PolarHBondContact O-N 3.28Å; Y439-S442 VanDerWaalsContact O-N 3.13Å; V440-S442 PolarHBondContact O-N 2.64Å
443	F	93.7	Very high	92.3	Very high	51 Å²	51	39.2 Å²	39.2	22%	0.224	19%	0.192	C	C	.	.	H	α-helix	trans	-73.5	-39.7	172.5	174	-124.1	0	0	0	113.2	V89 A92 T93 V440 N441 N445 P446 L447	V89-F443 HydrophobicContact CG1-CB 4.38Å; V89-F443 HydrophobicContact CG1-CG 4.42Å; A92-F443 HydrophobicContact CB-CD2 4.03Å; A92-F443 HydrophobicContact CB-CE2 3.52Å; A92-F443 HydrophobicContact CB-CZ 4.41Å; T93-F443 VanDerWaalsContact OG1-CB 3.31Å; T93-F443 WeakPolarHBondContact OG1-CB 3.32Å; V440-F443 WeakPolarHBondContact O-CB 3.5Å; V440-F443 PolarHBondContact O-N 3.34Å; V440-F443 VanDerWaalsContact O-N 3.16Å; N441-F443 PolarHBondContact O-N 3.49Å; F443-N445 VanDerWaalsContact C-N 3.33Å; F443-N445 PolarHBondContact O-N 3.19Å; F443-P446 WeakPolarHBondContact O-CD 3.34Å; F443-L447 HydrophobicContact CD1-CD1 4.27Å; F443-L447 HydrophobicContact CE1-CD1 3.63Å; F443-L447 HydrophobicContact CE2-CD1 4.15Å; F443-L447 HydrophobicContact CE2-CG 4.42Å; F443-L447 HydrophobicContact CZ-CD1 3.56Å; F443-L447 HydrophobicContact CZ-CG 4.28Å
444	L	94.3	Very high	92	Very high	42 Å²	42	40.4 Å²	40.4	22%	0.22	19%	0.193	C	C	.	.	H	α-helix	trans	-68.7	-30	-175	-73.1	174.5	0	0	0	112.8	C397 V440 N441 L447 I448	C397-L444 HydrophobicContact CB-CD1 4.04Å; V440-L444 HydrophobicContact CG1-CD1 3.84Å; V440-L444 HydrophobicContact CG1-CD2 4.49Å; V440-L444 HydrophobicContact CG1-CG 3.86Å; V440-L444 VanDerWaalsContact O-CG 3.27Å; V440-L444 WeakPolarHBondContact O-CG 3.35Å; V440-L444 PolarHBondContact O-N 2.46Å; N441-L444 PolarHBondContact O-N 3.14Å; L444-L447 HydrophobicContact CD2-CD1 4.31Å; L444-L447 WeakPolarHBondContact O-CB 3.28Å; L444-L447 PolarHBondContact O-N 3.06Å; L444-L447 VanDerWaalsContact O-N 3.09Å; L444-I448 HydrophobicContact CB-CD1 4.22Å; L444-I448 VanDerWaalsContact O-CG1 3.27Å; L444-I448 WeakPolarHBondContact O-CG1 3.37Å; L444-I448 PolarHBondContact O-N 3.29Å
445	N	92.7	Very high	91.6	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-52.6	-57.7	-177.4	-78.2	-23.6	0	0	0	113.2	D125 N441 F443 L447 I448 Y449	D125-N445 PolarHBondContact OD2-ND2 3.01Å; N441-N445 PolarHBondContact O-N 3.12Å; F443-N445 VanDerWaalsContact C-N 3.33Å; F443-N445 PolarHBondContact O-N 3.19Å; N445-L447 VanDerWaalsContact C-N 3.3Å; N445-L447 PolarHBondContact O-N 2.94Å; N445-I448 PolarHBondContact O-N 3.06Å; N445-I448 VanDerWaalsContact O-N 3.14Å; N445-Y449 HydrophobicContact CB-CE2 4.13Å; N445-Y449 WeakPolarHBondContact O-CD2 3.37Å; N445-Y449 WeakPolarHBondContact O-CE2 3.17Å; N445-Y449 PolarHBondContact O-N 3.32Å
446	P	93.8	Very high	91.5	Very high	10 Å²	10	42.5 Å²	42.5	7%	0.065	20%	0.202	C	C	.	.	H	α-helix	trans	-54.2	-40.1	173.4	-28.5	34.3	0	0	0	114.8	N97 V100 F443 I448 Y449 A450	N97-P446 HydrophobicContact CB-CG 4.38Å; N97-P446 WeakPolarHBondContact OD1-CG 3.22Å; V100-P446 HydrophobicContact CG2-CB 4.3Å; V100-P446 HydrophobicContact CG2-CG 4.26Å; F443-P446 WeakPolarHBondContact O-CD 3.34Å; P446-I448 VanDerWaalsContact C-N 3.33Å; P446-I448 PolarHBondContact O-N 3Å; P446-Y449 PolarHBondContact O-N 3.21Å; P446-A450 WeakPolarHBondContact O-CB 3.49Å; P446-A450 PolarHBondContact O-N 2.98Å
447	L	92.4	Very high	91.3	Very high	85 Å²	85	46 Å²	46	45%	0.445	22%	0.215	S	C	.	.	H	α-helix	trans	-64.6	-39.8	178.6	-65.9	-179	0	0	0	111.5	F443 L444 N445 A450 K451	F443-L447 HydrophobicContact CD1-CD1 4.27Å; F443-L447 HydrophobicContact CE1-CD1 3.63Å; F443-L447 HydrophobicContact CE2-CD1 4.15Å; F443-L447 HydrophobicContact CE2-CG 4.42Å; F443-L447 HydrophobicContact CZ-CD1 3.56Å; F443-L447 HydrophobicContact CZ-CG 4.28Å; L444-L447 HydrophobicContact CD2-CD1 4.31Å; L444-L447 WeakPolarHBondContact O-CB 3.28Å; L444-L447 PolarHBondContact O-N 3.06Å; L444-L447 VanDerWaalsContact O-N 3.09Å; N445-L447 VanDerWaalsContact C-N 3.3Å; N445-L447 PolarHBondContact O-N 2.94Å; L447-A450 PolarHBondContact O-N 3.5Å; L447-K451 WeakPolarHBondContact O-CB 3.3Å; L447-K451 PolarHBondContact O-N 3.49Å
448	I	91.5	Very high	91.1	Very high	8 Å²	8	44.9 Å²	44.9	4%	0.041	22%	0.217	C	C	.	.	H	α-helix	trans	-65.6	-43.6	177	-65.4	163.1	0	0	0	110.3	T390 V393 I394 C397 L444 N445 P446 K451 F452	T390-I448 HydrophobicContact CG2-CG2 4.13Å; V393-I448 HydrophobicContact CG1-CD1 4.13Å; V393-I448 HydrophobicContact CG1-CG1 4.03Å; V393-I448 HydrophobicContact CG1-CG2 4.17Å; I394-I448 HydrophobicContact CD1-CG2 4.18Å; I394-I448 HydrophobicContact CG1-CB 4.36Å; I394-I448 HydrophobicContact CG1-CD1 4.23Å; I394-I448 HydrophobicContact CG1-CG2 3.5Å; I394-I448 VanDerWaalsContact CG1-CG2 3.5Å; C397-I448 HydrophobicContact CB-CD1 4.12Å; L444-I448 HydrophobicContact CB-CD1 4.22Å; L444-I448 VanDerWaalsContact O-CG1 3.27Å; L444-I448 WeakPolarHBondContact O-CG1 3.37Å; L444-I448 PolarHBondContact O-N 3.29Å; N445-I448 PolarHBondContact O-N 3.06Å; N445-I448 VanDerWaalsContact O-N 3.14Å; P446-I448 VanDerWaalsContact C-N 3.33Å; P446-I448 PolarHBondContact O-N 3Å; I448-K451 PolarHBondContact O-N 2.82Å; I448-F452 HydrophobicContact CG2-CD2 4Å; I448-F452 WeakPolarHBondContact O-CB 3.47Å; I448-F452 PolarHBondContact O-N 3.39Å
449	Y	91.3	Very high	91	Very high	4 Å²	4	45.1 Å²	45.1	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-62.8	-47.1	175	-59.1	-50.8	0	0	0	111.8	V100 I118 L121 I394 N445 P446 K451 D453	V100-Y449 HydrophobicContact CG1-CD2 4.44Å; V100-Y449 HydrophobicContact CG1-CE2 4.47Å; V100-Y449 HydrophobicContact CG2-CD2 3.78Å; V100-Y449 HydrophobicContact CG2-CE2 4.32Å; I118-Y449 HydrophobicContact CD1-CE1 4.44Å; I118-Y449 HydrophobicContact CG2-CE1 4.15Å; I118-Y449 HydrophobicContact CG2-CE2 4Å; L121-Y449 WeakPolarHBondContact CD2-OH 3.39Å; I394-Y449 HydrophobicContact CD1-CE1 3.77Å; N445-Y449 HydrophobicContact CB-CE2 4.13Å; N445-Y449 WeakPolarHBondContact O-CD2 3.37Å; N445-Y449 WeakPolarHBondContact O-CE2 3.17Å; N445-Y449 PolarHBondContact O-N 3.32Å; P446-Y449 PolarHBondContact O-N 3.21Å; Y449-K451 VanDerWaalsContact C-N 3.3Å; Y449-K451 PolarHBondContact O-N 2.99Å; Y449-D453 WeakPolarHBondContact O-CA 3.27Å; Y449-D453 VanDerWaalsContact O-CB 3.3Å; Y449-D453 WeakPolarHBondContact O-CB 3.45Å; Y449-D453 PolarHBondContact O-N 3.25Å; Y449-D453 VanDerWaalsContact O-O 3.13Å
450	A	91.2	Very high	91	Very high	40 Å²	40	45.5 Å²	45.5	33%	0.331	22%	0.22	S	C	.	.	H	α-helix	trans	-59.8	-40.1	177.1	0	0	0	0	0	112	P446 L447 R457 F460	P446-A450 WeakPolarHBondContact O-CB 3.49Å; P446-A450 PolarHBondContact O-N 2.98Å; L447-A450 PolarHBondContact O-N 3.5Å; A450-R457 WeakPolarHBondContact O-CG 3.36Å; A450-R457 PolarHBondContact O-NE 2.94Å; A450-F460 HydrophobicContact CB-CD2 3.83Å; A450-F460 HydrophobicContact CB-CE2 3.94Å
451	K	88.8	Confident	91	Very high	141 Å²	141	50.1 Å²	50.1	61%	0.613	24%	0.236	S	C	*	.	H	α-helix	trans	-86.4	-39.4	-174.5	-176	61.6	173.1	-165.3	0	113.8	L447 I448 Y449 R457	L447-K451 WeakPolarHBondContact O-CB 3.3Å; L447-K451 PolarHBondContact O-N 3.49Å; I448-K451 PolarHBondContact O-N 2.82Å; Y449-K451 VanDerWaalsContact C-N 3.3Å; Y449-K451 PolarHBondContact O-N 2.99Å; K451-R457 VanDerWaalsContact O-CZ 3.28Å; K451-R457 PolarHBondContact O-NE 2.85Å; K451-R457 PolarHBondContact O-NH2 3.49Å
452	F	84.7	Confident	91	Very high	93 Å²	93	51.9 Å²	51.9	41%	0.408	25%	0.245	S	C	.	.	H	α-helix	trans	-111.3	-24.3	-169.2	-63.8	-77.1	0	0	0	113.1	T390 V393 I448	T390-F452 HydrophobicContact CG2-CB 3.9Å; T390-F452 WeakPolarHBondContact OG1-CB 3.41Å; T390-F452 PolarHBondContact OG1-O 3.45Å; V393-F452 HydrophobicContact CG1-CD2 4.32Å; V393-F452 HydrophobicContact CG1-CE2 4.01Å; V393-F452 HydrophobicContact CG2-CZ 4.47Å; I448-F452 HydrophobicContact CG2-CD2 4Å; I448-F452 WeakPolarHBondContact O-CB 3.47Å; I448-F452 PolarHBondContact O-N 3.39Å
453	D	86	Confident	90.9	Very high	32 Å²	32	52.7 Å²	52.7	17%	0.171	25%	0.249	C	C	.	.			trans	-94	110.7	178.4	-160.5	-34.7	0	0	0	112.3	Y449 E455 F456 R457	Y449-D453 WeakPolarHBondContact O-CA 3.27Å; Y449-D453 VanDerWaalsContact O-CB 3.3Å; Y449-D453 WeakPolarHBondContact O-CB 3.45Å; Y449-D453 PolarHBondContact O-N 3.25Å; Y449-D453 VanDerWaalsContact O-O 3.13Å; D453-E455 PolarHBondContact O-N 3.36Å; D453-E455 WeakPolarHBondContact OD1-CB 3.39Å; D453-E455 PolarHBondContact OD1-N 3.26Å; D453-F456 HydrophobicContact CB-CB 4.39Å; D453-F456 HydrophobicContact CB-CD2 4Å; D453-F456 PolarHBondContact O-N 2.68Å; D453-F456 WeakPolarHBondContact OD2-CD2 3.42Å; D453-R457 WeakPolarHBondContact O-CG 3.15Å; D453-R457 PolarHBondContact O-N 2.92Å
454	R	83.9	Confident	90.9	Very high	162 Å²	162	56.2 Å²	56.2	61%	0.611	27%	0.269	S	S	*	.	H	α-helix	trans	-68.5	-24.6	179.9	-63.7	-178.5	-178.8	-157.6	-6	112.7
455	E	87	Confident	90.8	Very high	84 Å²	84	58.5 Å²	58.5	39%	0.393	28%	0.281	S	S	.	.	H	α-helix	trans	-76	-29.5	-178.3	-55	-152.3	109.4	0	0	111.7	K109 L110 D453 P459	K109-E455 WeakPolarHBondContact CE-OE1 3.45Å; K109-E455 IonicContact NZ-OE1 2.73Å; K109-E455 PolarHBondContact NZ-OE1 3.4Å; K109-E455 VanDerWaalsContact NZ-OE1 3.16Å; L110-E455 HydrophobicContact CD2-CB 3.77Å; D453-E455 PolarHBondContact O-N 3.36Å; D453-E455 WeakPolarHBondContact OD1-CB 3.39Å; D453-E455 PolarHBondContact OD1-N 3.26Å; E455-P459 WeakPolarHBondContact O-CD 3.21Å; E455-P459 VanDerWaalsContact O-CG 3.3Å; E455-P459 WeakPolarHBondContact O-CG 3.31Å
456	F	90.7	Very high	90.8	Very high	1 Å²	1	63.8 Å²	63.8	0%	0.004	32%	0.317	C	S	.	.	H	α-helix	trans	-84.9	-30.2	177.2	-79.3	-88.1	0	0	0	114.4	V100 A103 V104 L110 I118 D453 G458 P459 F460	V100-F456 HydrophobicContact CG1-CE1 4.11Å; A103-F456 HydrophobicContact CB-CD1 4.12Å; A103-F456 HydrophobicContact CB-CE1 4.26Å; V104-F456 HydrophobicContact CG2-CE1 4Å; V104-F456 HydrophobicContact CG2-CZ 4.08Å; L110-F456 HydrophobicContact CD1-CD1 3.95Å; L110-F456 HydrophobicContact CD1-CE1 3.94Å; L110-F456 HydrophobicContact CD1-CG 4.45Å; L110-F456 HydrophobicContact CD1-CZ 4.42Å; L110-F456 HydrophobicContact CD2-CD2 4.47Å; L110-F456 HydrophobicContact CD2-CE2 4.35Å; L110-F456 HydrophobicContact CD2-CZ 4.5Å; I118-F456 HydrophobicContact CD1-CE2 4.24Å; I118-F456 HydrophobicContact CD1-CZ 4.43Å; I118-F456 HydrophobicContact CG2-CZ 4.06Å; D453-F456 HydrophobicContact CB-CB 4.39Å; D453-F456 HydrophobicContact CB-CD2 4Å; D453-F456 PolarHBondContact O-N 2.68Å; D453-F456 WeakPolarHBondContact OD2-CD2 3.42Å; F456-G458 PolarHBondContact O-N 2.85Å; F456-P459 VanDerWaalsContact O-CD 3.31Å; F456-P459 WeakPolarHBondContact O-CD 3.39Å; F456-F460 HydrophobicContact CB-CD1 4.49Å; F456-F460 HydrophobicContact CB-CE1 4.18Å; F456-F460 HydrophobicContact CB-CE2 4.28Å; F456-F460 HydrophobicContact CB-CZ 4.05Å; F456-F460 HydrophobicContact CD1-CD1 4.44Å; F456-F460 AromaticContact CD1-CE1 3.6Å; F456-F460 HydrophobicContact CD1-CE1 3.6Å; F456-F460 AromaticContact CD1-CZ 3.8Å; F456-F460 HydrophobicContact CD1-CZ 3.8Å; F456-F460 HydrophobicContact CG-CE1 4.35Å; F456-F460 HydrophobicContact CG-CZ 4.29Å; F456-F460 WeakPolarHBondContact O-CB 3.28Å; F456-F460 WeakPolarHBondContact O-CD1 3.26Å; F456-F460 VanDerWaalsContact O-CG 3.31Å; F456-F460 WeakPolarHBondContact O-CG 3.38Å; F456-F460 PolarHBondContact O-N 3.26Å
457	R	91.6	Very high	90.6	Very high	113 Å²	113	67 Å²	67	43%	0.426	33%	0.331	S	S	.	.	H	α-helix	trans	-52.7	-48.8	-178.1	-76.7	174.8	-158.8	-176.3	9.5	114.7	A450 K451 D453 K461	A450-R457 WeakPolarHBondContact O-CG 3.36Å; A450-R457 PolarHBondContact O-NE 2.94Å; K451-R457 VanDerWaalsContact O-CZ 3.28Å; K451-R457 PolarHBondContact O-NE 2.85Å; K451-R457 PolarHBondContact O-NH2 3.49Å; D453-R457 WeakPolarHBondContact O-CG 3.15Å; D453-R457 PolarHBondContact O-N 2.92Å; R457-K461 PolarHBondContact O-N 3.07Å; R457-K461 VanDerWaalsContact O-N 3.13Å
458	G	89.8	Confident	90.4	Very high	28 Å²	28	65.2 Å²	65.2	29%	0.289	33%	0.325	S	S	.	.	H	α-helix	trans	-63.2	-54.4	-179.2	0	0	0	0	0	112.1	F456 F460 K461 M462	F456-G458 PolarHBondContact O-N 2.85Å; G458-F460 PolarHBondContact O-N 3.48Å; G458-K461 PolarHBondContact O-N 3.08Å; G458-M462 WeakPolarHBondContact O-CG 3.33Å; G458-M462 PolarHBondContact O-N 3.31Å; G458-M462 VanDerWaalsContact O-N 3.1Å
459	P	92.4	Very high	90.2	Very high	4 Å²	4	74.5 Å²	74.5	3%	0.026	36%	0.36	C	S	.	.	H	α-helix	trans	-50	-49.7	171.3	-33.3	39.2	0	0	0	114	A103 V107 L110 E455 F456 K461 M462 I463 L475	A103-P459 HydrophobicContact CB-CB 4.07Å; V107-P459 HydrophobicContact CB-CG 4.49Å; V107-P459 HydrophobicContact CG1-CG 4.25Å; V107-P459 HydrophobicContact CG2-CB 3.91Å; V107-P459 HydrophobicContact CG2-CG 3.93Å; L110-P459 HydrophobicContact CD1-CB 4.14Å; L110-P459 HydrophobicContact CD1-CG 3.79Å; L110-P459 HydrophobicContact CG-CG 4.48Å; E455-P459 WeakPolarHBondContact O-CD 3.21Å; E455-P459 VanDerWaalsContact O-CG 3.3Å; E455-P459 WeakPolarHBondContact O-CG 3.31Å; F456-P459 VanDerWaalsContact O-CD 3.31Å; F456-P459 WeakPolarHBondContact O-CD 3.39Å; P459-K461 PolarHBondContact O-N 3.25Å; P459-M462 PolarHBondContact O-N 3.02Å; P459-M462 VanDerWaalsContact O-N 3.14Å; P459-I463 VanDerWaalsContact O-CG1 3.32Å; P459-I463 WeakPolarHBondContact O-CG1 3.31Å; P459-I463 PolarHBondContact O-N 2.94Å; P459-L475 HydrophobicContact CG-CD1 3.96Å; P459-L475 HydrophobicContact CG-CD2 4.42Å
460	F	94.5	Very high	90.1	Very high	12 Å²	12	79.7 Å²	79.7	5%	0.053	39%	0.388	C	S	.	.	H	α-helix	trans	-57.8	-48.3	-179.9	-75.3	4.7	0	0	0	112	L99 V100 A103 A450 F456 G458 M462 I463 L464	L99-F460 HydrophobicContact CD1-CD1 4.12Å; L99-F460 HydrophobicContact CD2-CB 3.96Å; L99-F460 HydrophobicContact CD2-CD1 3.82Å; L99-F460 HydrophobicContact CD2-CD2 3.92Å; L99-F460 HydrophobicContact CD2-CE1 4.22Å; L99-F460 HydrophobicContact CD2-CE2 4.34Å; L99-F460 HydrophobicContact CD2-CG 3.64Å; L99-F460 HydrophobicContact CD2-CZ 4.48Å; L99-F460 HydrophobicContact CG-CD1 3.58Å; L99-F460 HydrophobicContact CG-CE1 3.79Å; L99-F460 HydrophobicContact CG-CG 3.98Å; L99-F460 HydrophobicContact CG-CZ 4.37Å; V100-F460 HydrophobicContact CG2-CE1 4.37Å; V100-F460 HydrophobicContact CG2-CZ 3.73Å; A103-F460 HydrophobicContact CB-CD1 4.05Å; A103-F460 HydrophobicContact CB-CE1 3.81Å; A450-F460 HydrophobicContact CB-CD2 3.83Å; A450-F460 HydrophobicContact CB-CE2 3.94Å; F456-F460 HydrophobicContact CB-CD1 4.49Å; F456-F460 HydrophobicContact CB-CE1 4.18Å; F456-F460 HydrophobicContact CB-CE2 4.28Å; F456-F460 HydrophobicContact CB-CZ 4.05Å; F456-F460 HydrophobicContact CD1-CD1 4.44Å; F456-F460 AromaticContact CD1-CE1 3.6Å; F456-F460 HydrophobicContact CD1-CE1 3.6Å; F456-F460 AromaticContact CD1-CZ 3.8Å; F456-F460 HydrophobicContact CD1-CZ 3.8Å; F456-F460 HydrophobicContact CG-CE1 4.35Å; F456-F460 HydrophobicContact CG-CZ 4.29Å; F456-F460 WeakPolarHBondContact O-CB 3.28Å; F456-F460 WeakPolarHBondContact O-CD1 3.26Å; F456-F460 VanDerWaalsContact O-CG 3.31Å; F456-F460 WeakPolarHBondContact O-CG 3.38Å; F456-F460 PolarHBondContact O-N 3.26Å; G458-F460 PolarHBondContact O-N 3.48Å; F460-M462 VanDerWaalsContact C-N 3.3Å; F460-M462 PolarHBondContact O-N 2.55Å; F460-I463 PolarHBondContact O-N 3.25Å; F460-L464 WeakPolarHBondContact O-CB 3.43Å; F460-L464 VanDerWaalsContact O-CG 3.3Å; F460-L464 WeakPolarHBondContact O-CG 3.18Å; F460-L464 PolarHBondContact O-N 3.44Å
461	K	93.1	Very high	90.1	Very high	141 Å²	141	78.1 Å²	78.1	61%	0.613	37%	0.374	S	S	*	.	H	α-helix	trans	-59	-41.7	177.1	-175.4	177	-178.4	177.3	0	112	R457 G458 P459 L465	R457-K461 PolarHBondContact O-N 3.07Å; R457-K461 VanDerWaalsContact O-N 3.13Å; G458-K461 PolarHBondContact O-N 3.08Å; P459-K461 PolarHBondContact O-N 3.25Å; K461-L465 HydrophobicContact CG-CD1 3.95Å; K461-L465 WeakPolarHBondContact O-CB 3.02Å; K461-L465 WeakPolarHBondContact O-CD1 3.26Å; K461-L465 WeakPolarHBondContact O-CG 3.2Å; K461-L465 PolarHBondContact O-N 2.9Å
462	M	91.8	Very high	90.3	Very high	37 Å²	37	73.3 Å²	73.3	18%	0.182	36%	0.355	C	S	.	.	H	α-helix	trans	-70.4	-41.2	-179.5	-68.2	-67.7	176.7	0	0	112	G458 P459 F460 L465 C466 H467 I471	G458-M462 WeakPolarHBondContact O-CG 3.33Å; G458-M462 PolarHBondContact O-N 3.31Å; G458-M462 VanDerWaalsContact O-N 3.1Å; P459-M462 PolarHBondContact O-N 3.02Å; P459-M462 VanDerWaalsContact O-N 3.14Å; F460-M462 VanDerWaalsContact C-N 3.3Å; F460-M462 PolarHBondContact O-N 2.55Å; M462-L465 PolarHBondContact O-N 3.17Å; M462-C466 PolarHBondContact O-N 2.95Å; M462-H467 HydrophobicContact CB-CB 4.28Å; M462-H467 WeakPolarHBondContact O-CA 3.2Å; M462-H467 WeakPolarHBondContact O-CB 3.05Å; M462-H467 PolarHBondContact O-N 3.03Å; M462-H467 HydrophobicContact SD-CB 3.91Å; M462-I471 HydrophobicContact CB-CD1 3.94Å; M462-I471 HydrophobicContact CB-CG1 4.11Å
463	I	93.6	Very high	90.7	Very high	18 Å²	18	70.9 Å²	70.9	9%	0.092	35%	0.352	C	S	.	.	H	α-helix	trans	-65.5	-47	178.7	-67.7	164.2	0	0	0	110.7	L99 L102 A103 L106 P459 F460 L465 C466 I471	L99-I463 HydrophobicContact CD1-CB 3.62Å; L99-I463 HydrophobicContact CD1-CD1 3.99Å; L99-I463 HydrophobicContact CD1-CG1 4.42Å; L99-I463 HydrophobicContact CD1-CG2 3.32Å; L102-I463 HydrophobicContact CB-CD1 4.39Å; L102-I463 HydrophobicContact CD2-CB 4.5Å; L102-I463 HydrophobicContact CD2-CD1 4.19Å; L102-I463 HydrophobicContact CD2-CG1 4.24Å; L102-I463 HydrophobicContact CD2-CG2 3.46Å; L102-I463 VanDerWaalsContact CD2-CG2 3.46Å; A103-I463 HydrophobicContact CB-CD1 3.94Å; L106-I463 HydrophobicContact CD1-CG1 4.46Å; P459-I463 VanDerWaalsContact O-CG1 3.32Å; P459-I463 WeakPolarHBondContact O-CG1 3.31Å; P459-I463 PolarHBondContact O-N 2.94Å; F460-I463 PolarHBondContact O-N 3.25Å; I463-L465 PolarHBondContact O-N 2.68Å; I463-C466 WeakPolarHBondContact O-CA 3.41Å; I463-C466 PolarHBondContact O-N 2.96Å; I463-I471 HydrophobicContact CG1-CD1 4.04Å
464	L	93	Very high	90.9	Very high	125 Å²	125	73.9 Å²	73.9	65%	0.654	36%	0.361	S	S	*	.	H	α-helix	trans	-63.3	-28.5	178.4	-70.8	171.1	0	0	0	113	L99 F460 C466	L99-L464 HydrophobicContact CD1-CG 4.44Å; L99-L464 HydrophobicContact CD2-CD1 4.13Å; L99-L464 HydrophobicContact CD2-CD2 4.27Å; L99-L464 HydrophobicContact CD2-CG 4.11Å; F460-L464 WeakPolarHBondContact O-CB 3.43Å; F460-L464 VanDerWaalsContact O-CG 3.3Å; F460-L464 WeakPolarHBondContact O-CG 3.18Å; F460-L464 PolarHBondContact O-N 3.44Å; L464-C466 PolarHBondContact O-N 3.41Å
465	L	93.7	Very high	91.2	Very high	91 Å²	91	68 Å²	68	48%	0.476	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	11.4	173	-65.5	174.1	0	0	0	113	K461 M462 I463 H467	K461-L465 HydrophobicContact CG-CD1 3.95Å; K461-L465 WeakPolarHBondContact O-CB 3.02Å; K461-L465 WeakPolarHBondContact O-CD1 3.26Å; K461-L465 WeakPolarHBondContact O-CG 3.2Å; K461-L465 PolarHBondContact O-N 2.9Å; M462-L465 PolarHBondContact O-N 3.17Å; I463-L465 PolarHBondContact O-N 2.68Å; L465-H467 WeakPolarHBondContact CB-ND1 3.43Å; L465-H467 PolarHBondContact O-N 3.39Å
466	C	91.3	Very high	91.3	Very high	111 Å²	111	71.4 Å²	71.4	75%	0.75	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	23.8	-175.7	-61.6	0	0	0	0	113.9	M462 I463 L464 C468	M462-C466 PolarHBondContact O-N 2.95Å; I463-C466 WeakPolarHBondContact O-CA 3.41Å; I463-C466 PolarHBondContact O-N 2.96Å; L464-C466 PolarHBondContact O-N 3.41Å; C466-C468 PolarHBondContact O-N 3.49Å; C466-C468 VanDerWaalsContact O-N 3.12Å
467	H	90	Very high	91.2	Very high	76 Å²	76	73.5 Å²	73.5	35%	0.352	37%	0.368	S	S	.	.			trans	-86.8	40.5	179.1	-72.1	151.2	0	0	0	112.2	M462 L465 R469 R474	M462-H467 HydrophobicContact CB-CB 4.28Å; M462-H467 WeakPolarHBondContact O-CA 3.2Å; M462-H467 WeakPolarHBondContact O-CB 3.05Å; M462-H467 PolarHBondContact O-N 3.03Å; M462-H467 HydrophobicContact SD-CB 3.91Å; L465-H467 WeakPolarHBondContact CB-ND1 3.43Å; L465-H467 PolarHBondContact O-N 3.39Å; H467-R469 VanDerWaalsContact C-N 3.32Å; H467-R469 PolarHBondContact O-N 3.48Å; H467-R474 VanDerWaalsContact CB-NH1 3.3Å; H467-R474 PolarHBondContact CD2-NH1 2.99Å
468	C	88.4	Confident	90.9	Very high	49 Å²	49	71.5 Å²	71.5	33%	0.331	37%	0.368	S	S	.	.			trans	-71.3	-27.5	-177.7	-60.7	0	0	0	0	112.2	L106 C466 N470 I471	L106-C468 HydrophobicContact CD1-CB 4.43Å; C466-C468 PolarHBondContact O-N 3.49Å; C466-C468 VanDerWaalsContact O-N 3.12Å; C468-N470 PolarHBondContact O-N 3.38Å; C468-I471 WeakPolarHBondContact O-CB 3.5Å; C468-I471 WeakPolarHBondContact O-CG2 3.23Å; C468-I471 PolarHBondContact O-N 2.04Å
469	R	87.8	Confident	90.7	Very high	203 Å²	203	74.8 Å²	74.8	77%	0.766	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	125.6	176.6	-167.8	174	75.1	165.6	1.8	110.6	H467 I471	H467-R469 VanDerWaalsContact C-N 3.32Å; H467-R469 PolarHBondContact O-N 3.48Å; R469-I471 PolarHBondContact O-N 2.89Å
470	N	88.8	Confident	90.4	Very high	113 Å²	113	80.9 Å²	80.9	60%	0.604	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	27.4	-177.5	-64.4	-21	0	0	0	114	C468 N472 A473 R474	C468-N470 PolarHBondContact O-N 3.38Å; N470-N472 PolarHBondContact O-N 3.21Å; N470-A473 HydrophobicContact CB-CB 4.2Å; N470-A473 WeakPolarHBondContact O-CB 3.46Å; N470-A473 PolarHBondContact O-N 2.91Å; N470-R474 PolarHBondContact O-N 3.34Å
471	I	92	Very high	90	Very high	6 Å²	6	81.2 Å²	81.2	3%	0.031	40%	0.403	C	S	.	.	H	α-helix	trans	-51.2	-42.8	179.5	-170.2	168.5	0	0	0	112.2	V107 M462 I463 C468 R469 A473 R474 L475	V107-I471 HydrophobicContact CG2-CD1 3.81Å; V107-I471 HydrophobicContact CG2-CG1 4.23Å; M462-I471 HydrophobicContact CB-CD1 3.94Å; M462-I471 HydrophobicContact CB-CG1 4.11Å; I463-I471 HydrophobicContact CG1-CD1 4.04Å; C468-I471 WeakPolarHBondContact O-CB 3.5Å; C468-I471 WeakPolarHBondContact O-CG2 3.23Å; C468-I471 PolarHBondContact O-N 2.04Å; R469-I471 PolarHBondContact O-N 2.89Å; I471-A473 PolarHBondContact O-N 3.42Å; I471-R474 PolarHBondContact O-N 3.13Å; I471-L475 HydrophobicContact CG1-CD1 3.94Å; I471-L475 HydrophobicContact CG1-CG 4.41Å; I471-L475 WeakPolarHBondContact O-CB 3.36Å; I471-L475 WeakPolarHBondContact O-CG 3.44Å; I471-L475 PolarHBondContact O-N 2.94Å
472	N	93.1	Very high	89.5	Confident	40 Å²	40	78.5 Å²	78.5	21%	0.214	41%	0.407	C	S	.	.	H	α-helix	trans	-65	-35.2	177.6	-70.7	-68.4	0	0	0	113.3	L106 K108 N470 R476	L106-N472 PolarHBondContact O-ND2 3Å; K108-N472 PolarHBondContact N-OD1 3.19Å; N470-N472 PolarHBondContact O-N 3.21Å; N472-R476 WeakPolarHBondContact O-CB 3.47Å; N472-R476 VanDerWaalsContact O-CG 3.28Å; N472-R476 WeakPolarHBondContact O-CG 3.46Å; N472-R476 PolarHBondContact O-N 3.27Å; N472-R476 PolarHBondContact O-NE 3.5Å
473	A	92.2	Very high	89	Confident	42 Å²	42	82.1 Å²	82.1	35%	0.347	42%	0.424	S	S	.	.	H	α-helix	trans	-72.1	-41.5	175.9	0	0	0	0	0	111.2	N470 I471 R476 A477	N470-A473 HydrophobicContact CB-CB 4.2Å; N470-A473 WeakPolarHBondContact O-CB 3.46Å; N470-A473 PolarHBondContact O-N 2.91Å; I471-A473 PolarHBondContact O-N 3.42Å; A473-R476 PolarHBondContact O-N 3.11Å; A473-A477 WeakPolarHBondContact O-CB 3.27Å; A473-A477 PolarHBondContact O-N 2.9Å
474	R	90.2	Very high	88.7	Confident	95 Å²	95	88.2 Å²	88.2	36%	0.358	45%	0.446	S	S	.	.	H	α-helix	trans	-63.2	-46.4	177.1	-67.4	179.4	178.4	-156.9	0.4	112	H467 N470 I471 R476 A477 V478	H467-R474 VanDerWaalsContact CB-NH1 3.3Å; H467-R474 PolarHBondContact CD2-NH1 2.99Å; N470-R474 PolarHBondContact O-N 3.34Å; I471-R474 PolarHBondContact O-N 3.13Å; R474-R476 VanDerWaalsContact C-N 3.32Å; R474-R476 PolarHBondContact O-N 3.43Å; R474-A477 PolarHBondContact O-N 3.48Å; R474-V478 WeakPolarHBondContact O-CG2 3.2Å; R474-V478 PolarHBondContact O-N 3.49Å
475	L	90	Very high	88.1	Confident	38 Å²	38	85.6 Å²	85.6	20%	0.199	45%	0.449	C	S	.	.	H	α-helix	trans	-62.9	-39.5	177.4	-72.7	169.7	0	0	0	111.9	V107 P459 I471 H479	V107-L475 HydrophobicContact CB-CD1 4.36Å; V107-L475 HydrophobicContact CG1-CD1 3.55Å; V107-L475 HydrophobicContact CG2-CD1 3.83Å; P459-L475 HydrophobicContact CG-CD1 3.96Å; P459-L475 HydrophobicContact CG-CD2 4.42Å; I471-L475 HydrophobicContact CG1-CD1 3.94Å; I471-L475 HydrophobicContact CG1-CG 4.41Å; I471-L475 WeakPolarHBondContact O-CB 3.36Å; I471-L475 WeakPolarHBondContact O-CG 3.44Å; I471-L475 PolarHBondContact O-N 2.94Å; L475-H479 WeakPolarHBondContact O-CB 3.39Å; L475-H479 PolarHBondContact O-N 2.77Å
476	R	89.5	Confident	87.2	Confident	156 Å²	156	86.7 Å²	86.7	59%	0.589	46%	0.455	S	S	*	.	H	α-helix	trans	-61	-49.8	172.1	-78.4	-174.2	-65.1	168.6	2.6	111.2	N472 A473 R474 V478 H479 Y480	N472-R476 WeakPolarHBondContact O-CB 3.47Å; N472-R476 VanDerWaalsContact O-CG 3.28Å; N472-R476 WeakPolarHBondContact O-CG 3.46Å; N472-R476 PolarHBondContact O-N 3.27Å; N472-R476 PolarHBondContact O-NE 3.5Å; A473-R476 PolarHBondContact O-N 3.11Å; R474-R476 VanDerWaalsContact C-N 3.32Å; R474-R476 PolarHBondContact O-N 3.43Å; R476-V478 VanDerWaalsContact C-N 3.34Å; R476-V478 PolarHBondContact O-N 3.44Å; R476-H479 WeakPolarHBondContact O-CB 3.49Å; R476-H479 PolarHBondContact O-N 3.3Å; R476-H479 VanDerWaalsContact O-N 3.1Å; R476-Y480 HydrophobicContact CB-CD2 4.27Å; R476-Y480 HydrophobicContact CB-CE2 4.19Å; R476-Y480 WeakPolarHBondContact O-CD2 3.26Å; R476-Y480 PolarHBondContact O-N 3Å
477	A	88.5	Confident	85.8	Confident	46 Å²	46	86.7 Å²	86.7	38%	0.38	45%	0.453	S	S	.	.	H	α-helix	trans	-58	-43.9	179.8	0	0	0	0	0	112.6	A473 R474 H479 Y480 S481	A473-A477 WeakPolarHBondContact O-CB 3.27Å; A473-A477 PolarHBondContact O-N 2.9Å; R474-A477 PolarHBondContact O-N 3.48Å; A477-H479 VanDerWaalsContact C-N 3.33Å; A477-H479 PolarHBondContact O-N 3.07Å; A477-Y480 PolarHBondContact O-N 3.16Å; A477-S481 PolarHBondContact O-N 3Å; A477-S481 PolarHBondContact O-OG 2.94Å
478	V	86.4	Confident	83.9	Confident	70 Å²	70	84.2 Å²	84.2	42%	0.424	45%	0.445	S	S	.	.	H	α-helix	trans	-61.1	-42.6	175.4	172.8	0	0	0	0	111.2	R474 R476 S481 A482	R474-V478 WeakPolarHBondContact O-CG2 3.2Å; R474-V478 PolarHBondContact O-N 3.49Å; R476-V478 VanDerWaalsContact C-N 3.34Å; R476-V478 PolarHBondContact O-N 3.44Å; V478-S481 WeakPolarHBondContact CA-OG 3.48Å; V478-S481 PolarHBondContact O-N 3.41Å; V478-S481 PolarHBondContact O-OG 2.73Å; V478-A482 WeakPolarHBondContact O-CB 3.35Å; V478-A482 PolarHBondContact O-N 2.72Å
479	H	84.7	Confident	82.3	Confident	98 Å²	98	86.7 Å²	86.7	45%	0.454	46%	0.463	S	S	.	.	H	α-helix	trans	-64.8	-45.2	177.2	-171.6	58.2	0	0	0	112.3	L475 R476 A477 S481 A482 Q483	L475-H479 WeakPolarHBondContact O-CB 3.39Å; L475-H479 PolarHBondContact O-N 2.77Å; R476-H479 WeakPolarHBondContact O-CB 3.49Å; R476-H479 PolarHBondContact O-N 3.3Å; R476-H479 VanDerWaalsContact O-N 3.1Å; A477-H479 VanDerWaalsContact C-N 3.33Å; A477-H479 PolarHBondContact O-N 3.07Å; H479-S481 PolarHBondContact O-N 3.5Å; H479-A482 PolarHBondContact O-N 2.89Å; H479-Q483 WeakPolarHBondContact O-CB 3.46Å; H479-Q483 PolarHBondContact O-N 3.13Å
480	Y	86.2	Confident	80.6	Confident	131 Å²	131	80.8 Å²	80.8	51%	0.514	45%	0.453	S	S	.	.	H	α-helix	trans	-58.9	-46	174.6	-79.3	-70	0	0	0	111.6	R476 A477 A482 Q483 Y484	R476-Y480 HydrophobicContact CB-CD2 4.27Å; R476-Y480 HydrophobicContact CB-CE2 4.19Å; R476-Y480 WeakPolarHBondContact O-CD2 3.26Å; R476-Y480 PolarHBondContact O-N 3Å; A477-Y480 PolarHBondContact O-N 3.16Å; Y480-A482 VanDerWaalsContact C-N 3.31Å; Y480-A482 PolarHBondContact O-N 3.31Å; Y480-Q483 PolarHBondContact O-N 3.46Å; Y480-Y484 HydrophobicContact CD1-CD2 4.02Å; Y480-Y484 AromaticContact CD1-CE2 3.73Å; Y480-Y484 HydrophobicContact CD1-CE2 3.73Å; Y480-Y484 HydrophobicContact CE1-CE2 4.22Å; Y480-Y484 WeakPolarHBondContact O-CD2 3.35Å; Y480-Y484 PolarHBondContact O-N 3.1Å
481	S	86.2	Confident	78.5	Confident	20 Å²	20	78 Å²	78	14%	0.14	44%	0.442	C	S	.	.	H	α-helix	trans	-60.9	-39.3	175.5	54.8	0	0	0	0	112.8	A477 V478 H479 G485 L486	A477-S481 PolarHBondContact O-N 3Å; A477-S481 PolarHBondContact O-OG 2.94Å; V478-S481 WeakPolarHBondContact CA-OG 3.48Å; V478-S481 PolarHBondContact O-N 3.41Å; V478-S481 PolarHBondContact O-OG 2.73Å; H479-S481 PolarHBondContact O-N 3.5Å; S481-G485 VanDerWaalsContact O-CA 3.31Å; S481-G485 WeakPolarHBondContact O-CA 3.48Å; S481-G485 PolarHBondContact O-N 3.19Å; S481-L486 WeakPolarHBondContact CB-O 3.45Å; S481-L486 PolarHBondContact O-N 2.03Å
482	A	82.4	Confident	76.1	Confident	83 Å²	83	85 Å²	85	69%	0.686	47%	0.472	S	S	*	.	H	α-helix	trans	-72.1	-31.1	179.5	0	0	0	0	0	112.9	V478 H479 Y480	V478-A482 WeakPolarHBondContact O-CB 3.35Å; V478-A482 PolarHBondContact O-N 2.72Å; H479-A482 PolarHBondContact O-N 2.89Å; Y480-A482 VanDerWaalsContact C-N 3.31Å; Y480-A482 PolarHBondContact O-N 3.31Å
483	Q	80.8	Confident	73.4	Confident	114 Å²	114	94 Å²	94	53%	0.533	50%	0.503	S	S	.	.	H	α-helix	trans	-82	-37.3	-179.6	-177.2	173.1	-12.9	0	0	112.7	H479 Y480	H479-Q483 WeakPolarHBondContact O-CB 3.46Å; H479-Q483 PolarHBondContact O-N 3.13Å; Y480-Q483 PolarHBondContact O-N 3.46Å
484	Y	88.3	Confident	70.6	Confident	146 Å²	146	99.9 Å²	99.9	57%	0.573	52%	0.524	S	S	*	.	H	α-helix	trans	-109.4	0.7	-174.3	-63.3	-79.4	0	0	0	114.2	Y480 L486	Y480-Y484 HydrophobicContact CD1-CD2 4.02Å; Y480-Y484 AromaticContact CD1-CE2 3.73Å; Y480-Y484 HydrophobicContact CD1-CE2 3.73Å; Y480-Y484 HydrophobicContact CE1-CE2 4.22Å; Y480-Y484 WeakPolarHBondContact O-CD2 3.35Å; Y480-Y484 PolarHBondContact O-N 3.1Å; Y484-L486 VanDerWaalsContact C-N 3.27Å; Y484-L486 PolarHBondContact O-N 3.41Å
485	G	78.9	Confident	67.9	Low	69 Å²	69	99.1 Å²	99.1	71%	0.711	53%	0.533	S	S	*	.			trans	72	13	177.1	0	0	0	0	0	115.4	S481	S481-G485 VanDerWaalsContact O-CA 3.31Å; S481-G485 WeakPolarHBondContact O-CA 3.48Å; S481-G485 PolarHBondContact O-N 3.19Å
486	L	76.1	Confident	65.1	Low	115 Å²	115	104 Å²	104	60%	0.602	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-76.3	146.1	179.7	-67	169.7	0	0	0	111.5	S481 Y484 S488	S481-L486 WeakPolarHBondContact CB-O 3.45Å; S481-L486 PolarHBondContact O-N 2.03Å; Y484-L486 VanDerWaalsContact C-N 3.27Å; Y484-L486 PolarHBondContact O-N 3.41Å; L486-S488 PolarHBondContact O-N 3.47Å; L486-S488 VanDerWaalsContact O-N 3.15Å
487	P	61.1	Low	62.3	Low	110 Å²	110	102.6 Å²	102.6	71%	0.714	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-61	120.3	174.9	23.1	-31.6	0	0	0	110.6
488	S	51	Low	59.7	Low	24 Å²	24	107.7 Å²	107.7	17%	0.168	59%	0.585	C	S	.	*	P	Polyproline II helix	trans	-54.1	142	173.5	167.5	0	0	0	0	110.9	L486 S490 S491	L486-S488 PolarHBondContact O-N 3.47Å; L486-S488 VanDerWaalsContact O-N 3.15Å; S488-S490 PolarHBondContact O-N 3.44Å; S488-S490 PolarHBondContact OG-N 3.35Å; S488-S490 VanDerWaalsContact OG-N 3.11Å; S488-S490 PolarHBondContact OG-OG 3.46Å; S488-S491 WeakPolarHBondContact O-CB 3.02Å; S488-S491 PolarHBondContact O-N 2.94Å
489	S	54.5	Low	56.9	Low	101 Å²	101	109.5 Å²	109.5	71%	0.706	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.6	-20.3	171.5	135.9	0	0	0	0	113.3
490	S	52.1	Low	54.2	Low	80 Å²	80	110.1 Å²	110.1	56%	0.559	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-29.1	172.3	62.3	0	0	0	0	113.2	S488 K492 R493	S488-S490 PolarHBondContact O-N 3.44Å; S488-S490 PolarHBondContact OG-N 3.35Å; S488-S490 VanDerWaalsContact OG-N 3.11Å; S488-S490 PolarHBondContact OG-OG 3.46Å; S490-K492 VanDerWaalsContact C-N 3.3Å; S490-R493 PolarHBondContact O-N 3.43Å
491	S	44.4	Very low	52.1	Low	54 Å²	54	108.8 Å²	108.8	38%	0.378	62%	0.623	S	S	.	*	G	3₁₀ helix	trans	-71.5	-26.3	176.9	-62.3	0	0	0	0	112	S488 R493 Q494 S495	S488-S491 WeakPolarHBondContact O-CB 3.02Å; S488-S491 PolarHBondContact O-N 2.94Å; S491-R493 PolarHBondContact O-N 3.33Å; S491-R493 VanDerWaalsContact O-N 3.13Å; S491-Q494 PolarHBondContact O-N 3.15Å; S491-Q494 VanDerWaalsContact O-N 3.09Å; S491-S495 WeakPolarHBondContact O-CB 3.09Å; S491-S495 PolarHBondContact O-N 3.36Å; S491-S495 PolarHBondContact O-OG 2.75Å; S491-S495 VanDerWaalsContact O-OG 3.12Å
492	K	41.5	Very low	49.4	Very low	154 Å²	154	118.4 Å²	118.4	67%	0.67	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-60.5	-21.3	172.7	-77	-168.1	175.7	-174.8	0	113.5	S490 I496	S490-K492 VanDerWaalsContact C-N 3.3Å; K492-I496 VanDerWaalsContact O-CD1 3.31Å; K492-I496 WeakPolarHBondContact O-CD1 3.35Å; K492-I496 WeakPolarHBondContact O-CG1 3.37Å
493	R	36	Very low	46.9	Very low	228 Å²	228	121.3 Å²	121.3	86%	0.86	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-84.5	-21.1	176.8	-125.9	-177.7	-164.5	-174	2.6	113.7	S490 S491	S490-R493 PolarHBondContact O-N 3.43Å; S491-R493 PolarHBondContact O-N 3.33Å; S491-R493 VanDerWaalsContact O-N 3.13Å
494	Q	34.1	Very low	44.3	Very low	166 Å²	166	126.9 Å²	126.9	78%	0.776	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	-27.6	175.4	-80.2	179.3	-30.1	0	0	112.4	S491 I496 V497	S491-Q494 PolarHBondContact O-N 3.15Å; S491-Q494 VanDerWaalsContact O-N 3.09Å; Q494-I496 VanDerWaalsContact C-N 3.27Å; Q494-I496 PolarHBondContact O-N 2.81Å; Q494-V497 PolarHBondContact O-N 3.17Å
495	S	32.5	Very low	41.4	Very low	79 Å²	79	127.5 Å²	127.5	55%	0.552	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	3.8	179.9	69.3	0	0	0	0	114.7	S491 V497	S491-S495 WeakPolarHBondContact O-CB 3.09Å; S491-S495 PolarHBondContact O-N 3.36Å; S491-S495 PolarHBondContact O-OG 2.75Å; S491-S495 VanDerWaalsContact O-OG 3.12Å; S495-V497 VanDerWaalsContact C-N 3.26Å
496	I	32.1	Very low	39	Very low	141 Å²	141	131.7 Å²	131.7	72%	0.723	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-9.8	170.6	-69.2	169.5	0	0	0	111.2	K492 Q494	K492-I496 VanDerWaalsContact O-CD1 3.31Å; K492-I496 WeakPolarHBondContact O-CD1 3.35Å; K492-I496 WeakPolarHBondContact O-CG1 3.37Å; Q494-I496 VanDerWaalsContact C-N 3.27Å; Q494-I496 PolarHBondContact O-N 2.81Å
497	V	31.6	Very low	36.8	Very low	126 Å²	126	133 Å²	133	76%	0.764	72%	0.716	S	S	*	*	S	Bend	trans	-116.8	54.7	176.1	-164.9	0	0	0	0	110.4	Q494 S495	Q494-V497 PolarHBondContact O-N 3.17Å; S495-V497 VanDerWaalsContact C-N 3.26Å
498	I	32.8	Very low	35.4	Very low	153 Å²	153	132.7 Å²	132.7	79%	0.785	72%	0.723	S	S	*	*			trans	-136.8	101.5	147.7	-57.1	-177.9	0	0	0	106.4
499	S	27.5	Very low	34.4	Very low	107 Å²	107	137.2 Å²	137.2	75%	0.748	75%	0.754	S	S	*	*			trans	-71.6	131.4	173.3	45.1	0	0	0	0	112.3
500	S	28.6	Very low	33.2	Very low	112 Å²	112	143.7 Å²	143.7	78%	0.783	76%	0.763	S	S	*	*			trans	63.6	164.9	144	-149	0	0	0	0	119.5
501	P	41.2	Very low	32.1	Very low	102 Å²	102	150.7 Å²	150.7	66%	0.662	78%	0.778	S	S	*	*			cis	-122.1	-178.2	-20.1	14.3	10.4	0	0	0	112
502	Y	30.8	Very low	31.4	Very low	223 Å²	223	155.8 Å²	155.8	88%	0.875	80%	0.8	S	S	*	*			trans	113.7	50.6	172.7	-71.6	-80.5	0	0	0	115.2
503	T	28.6	Very low	30.7	Very low	143 Å²	143	152.1 Å²	152.1	88%	0.877	81%	0.805	S	S	*	*			trans	-130.1	79	152.5	54.5	0	0	0	0	108.4
504	R	26.6	Very low	30.8	Very low	232 Å²	232	151.1 Å²	151.1	88%	0.875	81%	0.807	S	S	*	*			trans	-168.7	96.5	159.5	-119	-179.3	179.1	-178.7	-0.4	108.4
505	N	27.4	Very low	30.7	Very low	158 Å²	158	152.3 Å²	152.3	85%	0.845	83%	0.834	S	S	*	*			trans	178.1	66.3	143.2	-87.8	-6.4	0	0	0	108.1
506	D	29.1	Very low	30.7	Very low	157 Å²	157	156 Å²	156	84%	0.84	85%	0.848	S	S	*	*	S	Bend	trans	-142.8	50.5	168.9	-105.5	-19.6	0	0	0	109.9
507	T	30.1	Very low	30.6	Very low	142 Å²	142	156.7 Å²	156.7	87%	0.871	86%	0.855	S	S	*	*	S	Bend	trans	-155.1	70.4	164	51.5	0	0	0	0	109.5
508	A	31.6	Very low	30.5	Very low	104 Å²	104	158.4 Å²	158.4	86%	0.86	86%	0.86	S	S	*	*	S	Bend	trans	-156.3	7.6	169.8	0	0	0	0	0	116.9
509	S	30.4	Very low	30.4	Very low	119 Å²	119	158.8 Å²	158.8	83%	0.832	86%	0.864	S	S	*	*	S	Bend	trans	-120.5	23.6	-174.8	47.3	0	0	0	0	115.3
510	R	28.8	Very low	30.6	Very low	237 Å²	237	162 Å²	162	89%	0.894	87%	0.871	S	S	*	*	S	Bend	trans	-117.3	16.5	176.7	-131.8	-179.4	-165.3	173.6	4.7	116.7
511	W	28.8	Very low	30.7	Very low	227 Å²	227	165.3 Å²	165.3	86%	0.86	88%	0.877	S	S	*	*	S	Bend	trans	-131.2	117.6	171.4	-80.2	89.9	0	0	0	111.6
512	L	29.9	Very low	30	Very low	162 Å²	162	169.9 Å²	169.9	85%	0.848	89%	0.893	S	S	*	*			trans	78.9	97.3	153.4	-54.5	167.5	0	0	0	117.3
513	G	26.7	Very low	29.9	Very low	76 Å²	76	165.8 Å²	165.8	78%	0.784	89%	0.894	S	S	*	*			trans	-174.6	75	164.5	0	0	0	0	0	112.4
514	K	36.9	Very low	30	Very low	207 Å²	207	167.7 Å²	167.7	90%	0.9	90%	0.895	S	S	*	*			trans	-158.7	119	141.2	-105.3	173.1	-170.7	-171.5	0	108.4
515	S	33.8	Very low	30.3	Very low	191 Å²	191	161.8 Å²	161.8	100%	1.336	90%	0.897	S	S	*	*			trans	-49	0	179.2	56.3	0	0	0	0	114.4

Retrieved 515 of 515 residues in 654.8 ms (Link to these results)

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