A0A077YXM1_TRITR Loading...

Organic cation transporter protein

AlphaFold DB , UniProt , Accession A0A077YXM1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 521 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	46.8	Very low	40.6	Very low	250 Å²	250	144.2 Å²	144.2	100%	1.232	74%	0.735	S	S	*	*				0	52.9	0	-74.2	175.5	164	0	0	109.8
2	E	47	Very low	39.9	Very low	179 Å²	179	141.1 Å²	141.1	84%	0.836	72%	0.722	S	S	*	*			trans	-125	4.7	-158.6	-153.4	166	168	0	0	114.4
3	N	46.9	Very low	39.5	Very low	152 Å²	152	144.4 Å²	144.4	81%	0.813	73%	0.728	S	S	*	*	S	Bend	trans	-108	16.1	-173.7	-75.3	-12.8	0	0	0	115.1
4	A	47.5	Very low	39	Very low	79 Å²	79	140.6 Å²	140.6	65%	0.653	72%	0.721	S	S	*	*	S	Bend	trans	-102	-12.9	-174.9	0	0	0	0	0	115.2
5	E	44.6	Very low	38.5	Very low	154 Å²	154	139.5 Å²	139.5	72%	0.72	71%	0.712	S	S	*	*	H	α-helix	trans	-77.6	-30.7	-175.7	-83.2	-172.8	140	0	0	117.3	N7 K8	E5-N7 PolarHBondContact O-N 2.64Å; E5-K8 PolarHBondContact O-N 2.97Å
6	P	41.4	Very low	38.9	Very low	84 Å²	84	141.7 Å²	141.7	55%	0.545	72%	0.718	S	S	.	*	H	α-helix	trans	-72.8	-30.2	-176.9	24.3	-28.5	0	0	0	112.8	M10	P6-M10 PolarHBondContact O-N 2.82Å
7	N	36.3	Very low	39.4	Very low	110 Å²	110	141.2 Å²	141.2	59%	0.588	72%	0.724	S	S	*	*	H	α-helix	trans	-74.4	-27.9	176.9	-82.4	-22.2	0	0	0	113.1	E5 M10 L11	E5-N7 PolarHBondContact O-N 2.64Å; N7-M10 PolarHBondContact O-N 3.32Å; N7-L11 WeakPolarHBondContact O-CD1 3.32Å; N7-L11 PolarHBondContact O-N 3.38Å
8	K	36.8	Very low	40.3	Very low	156 Å²	156	135.6 Å²	135.6	68%	0.678	70%	0.695	S	S	*	*	H	α-helix	trans	-69.5	-36.4	178.5	-146.2	176.6	-176.5	-175.8	0	111.7	E5 L11 D12	E5-K8 PolarHBondContact O-N 2.97Å; K8-L11 PolarHBondContact O-N 2.85Å; K8-D12 WeakPolarHBondContact O-CB 3.49Å; K8-D12 PolarHBondContact O-N 3.37Å
9	K	35.8	Very low	41.3	Very low	160 Å²	160	130.8 Å²	130.8	70%	0.696	67%	0.672	S	S	*	*	H	α-helix	trans	-73.8	-23.9	175.7	-74.2	-179.2	178.8	172.5	0	114.1
10	M	31.6	Very low	42.1	Very low	150 Å²	150	125.2 Å²	125.2	74%	0.739	64%	0.641	S	S	*	*	H	α-helix	trans	-81.8	-35.1	172.1	-78.9	-171.9	175.2	0	0	112.3	P6 N7	P6-M10 PolarHBondContact O-N 2.82Å; N7-M10 PolarHBondContact O-N 3.32Å
11	L	32.2	Very low	42.9	Very low	112 Å²	112	126.3 Å²	126.3	59%	0.586	64%	0.638	S	S	*	*	H	α-helix	trans	-70.7	-37.4	172.2	-96.8	102.3	0	0	0	113	N7 K8 K13 S14	N7-L11 WeakPolarHBondContact O-CD1 3.32Å; N7-L11 PolarHBondContact O-N 3.38Å; K8-L11 PolarHBondContact O-N 2.85Å; L11-K13 PolarHBondContact O-N 2.99Å; L11-S14 PolarHBondContact O-N 3.39Å; L11-S14 PolarHBondContact O-OG 2.99Å
12	D	32.4	Very low	44.2	Very low	107 Å²	107	114.9 Å²	114.9	57%	0.572	58%	0.582	S	S	*	*	H	α-helix	trans	-63.2	-28.8	177.5	-109.1	-19.2	0	0	0	113	K8 S14 Q15	K8-D12 WeakPolarHBondContact O-CB 3.49Å; K8-D12 PolarHBondContact O-N 3.37Å; D12-S14 VanDerWaalsContact C-N 3.27Å; D12-S14 PolarHBondContact O-N 2.88Å; D12-Q15 PolarHBondContact O-N 3.21Å
13	K	34.5	Very low	45.7	Very low	184 Å²	184	106.5 Å²	106.5	80%	0.8	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-17.1	175.1	-87.4	-175.8	174.5	-179.2	0	113.9	L11	L11-K13 PolarHBondContact O-N 2.99Å
14	S	32.6	Very low	47.4	Very low	91 Å²	91	99.4 Å²	99.4	64%	0.636	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-7.3	174.7	68.7	0	0	0	0	113.4	L11 D12	L11-S14 PolarHBondContact O-N 3.39Å; L11-S14 PolarHBondContact O-OG 2.99Å; D12-S14 VanDerWaalsContact C-N 3.27Å; D12-S14 PolarHBondContact O-N 2.88Å
15	Q	31.3	Very low	48.9	Very low	124 Å²	124	100.7 Å²	100.7	58%	0.579	50%	0.495	S	S	*	.			trans	-104.9	38.7	176.7	-71.9	-174.8	-32.7	0	0	112.1	D12 T17	D12-Q15 PolarHBondContact O-N 3.21Å; Q15-T17 VanDerWaalsContact C-N 3.3Å; Q15-T17 PolarHBondContact O-N 3.07Å
16	E	44.6	Very low	50.7	Low	175 Å²	175	94.4 Å²	94.4	82%	0.818	47%	0.465	S	S	*	.			trans	-59.7	104.8	156.9	-95.8	-169.8	166.8	0	0	107	I18	E16-I18 PolarHBondContact O-N 3.19Å
17	T	48.2	Very low	52.8	Low	133 Å²	133	90.5 Å²	90.5	82%	0.816	44%	0.44	S	S	*	.			trans	-45	115.5	177.7	31.9	0	0	0	0	108.6	Q15 D19	Q15-T17 VanDerWaalsContact C-N 3.3Å; Q15-T17 PolarHBondContact O-N 3.07Å; T17-D19 PolarHBondContact O-N 3.07Å
18	I	55.1	Low	55.1	Low	41 Å²	41	88.2 Å²	88.2	21%	0.21	42%	0.424	C	S	.	.			trans	-51.2	106	176.4	-65.7	162.5	0	0	0	106.3	E16 Y20 M277 Q281	E16-I18 PolarHBondContact O-N 3.19Å; I18-Y20 HydrophobicContact CB-CD2 4.34Å; I18-Y20 HydrophobicContact CB-CE1 4.34Å; I18-Y20 HydrophobicContact CB-CE2 3.87Å; I18-Y20 HydrophobicContact CG2-CD1 3.79Å; I18-Y20 HydrophobicContact CG2-CD2 4.06Å; I18-Y20 HydrophobicContact CG2-CE1 3.57Å; I18-Y20 HydrophobicContact CG2-CE2 3.87Å; I18-Y20 HydrophobicContact CG2-CG 4.02Å; I18-Y20 WeakPolarHBondContact O-CD2 3.39Å; I18-Y20 VanDerWaalsContact O-CE2 3.31Å; I18-Y20 WeakPolarHBondContact O-CE2 3.32Å; I18-Y20 PolarHBondContact O-N 3.45Å; I18-M277 HydrophobicContact CB-CE 4.31Å; I18-M277 HydrophobicContact CD1-CE 3.4Å; I18-M277 HydrophobicContact CG1-CE 3.71Å; I18-M277 HydrophobicContact CG2-CE 3.62Å; I18-Q281 HydrophobicContact CD1-CG 4.29Å
19	D	59.6	Low	57.4	Low	45 Å²	45	84.7 Å²	84.7	24%	0.241	42%	0.419	C	S	.	.			trans	-82.3	84	-179	-172.4	11.9	0	0	0	107.3	T17 R21 D22 K25	T17-D19 PolarHBondContact O-N 3.07Å; D19-R21 PolarHBondContact O-N 2.92Å; D19-R21 WeakPolarHBondContact OD1-CB 3.24Å; D19-R21 IonicContact OD1-NE 2.58Å; D19-R21 PolarHBondContact OD1-NE 2.93Å; D19-D22 PolarHBondContact O-N 2.83Å; D19-D22 VanDerWaalsContact O-N 3.07Å; D19-K25 HydrophobicContact CB-CD 4.35Å; D19-K25 VanDerWaalsContact CB-NZ 3.3Å; D19-K25 IonicContact OD2-NZ 2.67Å; D19-K25 PolarHBondContact OD2-NZ 3.47Å
20	Y	57	Low	60	Low	18 Å²	18	77.9 Å²	77.9	7%	0.071	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-12.1	-178.7	-62.7	-85.1	0	0	0	113.7	I18 L285 Y288 P514 P515 I517	I18-Y20 HydrophobicContact CB-CD2 4.34Å; I18-Y20 HydrophobicContact CB-CE1 4.34Å; I18-Y20 HydrophobicContact CB-CE2 3.87Å; I18-Y20 HydrophobicContact CG2-CD1 3.79Å; I18-Y20 HydrophobicContact CG2-CD2 4.06Å; I18-Y20 HydrophobicContact CG2-CE1 3.57Å; I18-Y20 HydrophobicContact CG2-CE2 3.87Å; I18-Y20 HydrophobicContact CG2-CG 4.02Å; I18-Y20 WeakPolarHBondContact O-CD2 3.39Å; I18-Y20 VanDerWaalsContact O-CE2 3.31Å; I18-Y20 WeakPolarHBondContact O-CE2 3.32Å; I18-Y20 PolarHBondContact O-N 3.45Å; Y20-L285 HydrophobicContact CD1-CB 4.07Å; Y20-L285 HydrophobicContact CD1-CD1 3.61Å; Y20-L285 HydrophobicContact CD1-CG 4.46Å; Y20-L285 HydrophobicContact CE1-CB 4.29Å; Y20-L285 HydrophobicContact CG-CD1 4.23Å; Y20-Y288 WeakPolarHBondContact O-CD1 3.48Å; Y20-Y288 WeakPolarHBondContact O-CE1 3.18Å; Y20-P514 HydrophobicContact CD2-CB 3.37Å; Y20-P514 HydrophobicContact CE2-CB 4.03Å; Y20-P514 HydrophobicContact CG-CB 4.09Å; Y20-P515 HydrophobicContact CD1-CG 4.34Å; Y20-P515 HydrophobicContact CE1-CG 4.06Å; Y20-P515 HydrophobicContact CE2-CG 4.41Å; Y20-I517 VanDerWaalsContact OH-CD1 3.24Å; Y20-I517 WeakPolarHBondContact OH-CD1 3.44Å
21	R	59.8	Low	62.9	Low	148 Å²	148	75.5 Å²	75.5	56%	0.558	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-16.1	-179.1	-63.6	179.5	-84.9	-158.6	-10.6	113.9	D19 Y288	D19-R21 PolarHBondContact O-N 2.92Å; D19-R21 WeakPolarHBondContact OD1-CB 3.24Å; D19-R21 IonicContact OD1-NE 2.58Å; D19-R21 PolarHBondContact OD1-NE 2.93Å; R21-Y288 HydrophobicContact CG-CE1 4.42Å
22	D	73.3	Confident	65.9	Low	11 Å²	11	70.3 Å²	70.3	6%	0.059	36%	0.356	C	S	.	.			trans	-134.9	77.7	-172.5	-160.7	1.8	0	0	0	113.8	D19 E24 K25 K193	D19-D22 PolarHBondContact O-N 2.83Å; D19-D22 VanDerWaalsContact O-N 3.07Å; D22-E24 PolarHBondContact O-N 2.93Å; D22-E24 WeakPolarHBondContact OD1-CB 3.29Å; D22-E24 PolarHBondContact OD1-N 3.16Å; D22-K25 HydrophobicContact CB-CD 4.18Å; D22-K25 HydrophobicContact CB-CG 4.1Å; D22-K25 WeakPolarHBondContact O-CB 3.49Å; D22-K25 PolarHBondContact O-N 2.91Å; D22-K193 IonicContact OD2-NZ 3.93Å; D22-K193 PolarHBondContact OD2-NZ 3.48Å
23	L	78.9	Confident	68.8	Low	2 Å²	2	65.3 Å²	65.3	1%	0.01	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-52.5	-19.2	171.4	-74.9	171.5	0	0	0	114.1	K25 I251 Y263 L285 A289	L23-K25 VanDerWaalsContact C-N 3.28Å; L23-K25 PolarHBondContact O-N 2.92Å; L23-I251 HydrophobicContact CD1-CD1 3.53Å; L23-I251 HydrophobicContact CD2-CD1 4.32Å; L23-Y263 HydrophobicContact CD2-CE2 4.39Å; L23-L285 HydrophobicContact CD2-CD1 4.02Å; L23-L285 HydrophobicContact CD2-CD2 3.84Å; L23-L285 HydrophobicContact CD2-CG 3.72Å; L23-A289 HydrophobicContact CD1-CB 3.62Å; L23-A289 HydrophobicContact CG-CB 4.39Å
24	E	81.3	Confident	71.6	Confident	4 Å²	4	60.9 Å²	60.9	2%	0.019	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-76.8	-15.9	179.9	-61.7	168.3	-168.7	0	0	112.9	D22 Y26 L27 K193 R196 R248 L501	D22-E24 PolarHBondContact O-N 2.93Å; D22-E24 WeakPolarHBondContact OD1-CB 3.29Å; D22-E24 PolarHBondContact OD1-N 3.16Å; E24-Y26 PolarHBondContact O-N 3.46Å; E24-L27 WeakPolarHBondContact O-CB 3.34Å; E24-L27 PolarHBondContact O-N 2.9Å; E24-K193 WeakPolarHBondContact OE2-CB 3.32Å; E24-K193 PolarHBondContact OE2-N 2.65Å; E24-R196 IonicContact OE1-CZ 2.83Å; E24-R196 IonicContact OE1-NH1 3.32Å; E24-R196 IonicContact OE1-NH2 3.73Å; E24-R196 PolarHBondContact OE1-NH2 2.67Å; E24-R196 IonicContact OE2-CZ 3.32Å; E24-R196 IonicContact OE2-NH1 3.79Å; E24-R196 IonicContact OE2-NH2 2.86Å; E24-R196 PolarHBondContact OE2-NH2 3.37Å; E24-R248 IonicContact OE1-CZ 3.15Å; E24-R248 IonicContact OE1-NE 2.75Å; E24-R248 IonicContact OE1-NH2 3.77Å; E24-R248 PolarHBondContact OE1-NH2 2.96Å; E24-L501 WeakPolarHBondContact OE1-CG 3.1Å; E24-L501 PolarHBondContact OE1-N 3.07Å
25	K	80.5	Confident	74.5	Confident	106 Å²	106	58.9 Å²	58.9	46%	0.461	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-59.1	-32.5	174.4	-75	179.7	170	177.4	0	111.8	D19 D22 L23 L27 F28	D19-K25 HydrophobicContact CB-CD 4.35Å; D19-K25 VanDerWaalsContact CB-NZ 3.3Å; D19-K25 IonicContact OD2-NZ 2.67Å; D19-K25 PolarHBondContact OD2-NZ 3.47Å; D22-K25 HydrophobicContact CB-CD 4.18Å; D22-K25 HydrophobicContact CB-CG 4.1Å; D22-K25 WeakPolarHBondContact O-CB 3.49Å; D22-K25 PolarHBondContact O-N 2.91Å; L23-K25 VanDerWaalsContact C-N 3.28Å; L23-K25 PolarHBondContact O-N 2.92Å; K25-L27 VanDerWaalsContact C-N 3.28Å; K25-L27 PolarHBondContact O-N 3.1Å; K25-F28 WeakPolarHBondContact O-CZ 3.4Å
26	Y	82	Confident	77.5	Confident	22 Å²	22	53 Å²	53	9%	0.086	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-80.4	-5.2	178	-56.4	-77.8	0	0	0	113.8	E24 F28 M277 W282 L285	E24-Y26 PolarHBondContact O-N 3.46Å; Y26-F28 PolarHBondContact O-N 3.25Å; Y26-M277 HydrophobicContact CE1-CG 4.43Å; Y26-M277 HydrophobicContact CE1-SD 3.88Å; Y26-M277 PolarHBondContact OH-SD 2.79Å; Y26-W282 HydrophobicContact CD1-CH2 4.18Å; Y26-W282 HydrophobicContact CD2-CH2 4.42Å; Y26-W282 HydrophobicContact CG-CH2 4.06Å; Y26-L285 HydrophobicContact CD2-CD2 4.35Å; Y26-L285 HydrophobicContact CE2-CD2 3.72Å
27	L	85.5	Confident	79.8	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.01	24%	0.239	C	C	.	.			trans	-94.8	61.6	176.9	-62.4	175	0	0	0	110.8	E24 K25 E189 S192 Y263 I266	E24-L27 WeakPolarHBondContact O-CB 3.34Å; E24-L27 PolarHBondContact O-N 2.9Å; K25-L27 VanDerWaalsContact C-N 3.28Å; K25-L27 PolarHBondContact O-N 3.1Å; L27-E189 WeakPolarHBondContact CD1-O 3.37Å; L27-S192 WeakPolarHBondContact O-CB 3.31Å; L27-Y263 HydrophobicContact CD2-CE1 4.32Å; L27-I266 HydrophobicContact CD2-CD1 3.93Å; L27-I266 HydrophobicContact CD2-CG2 4.3Å
28	F	84.8	Confident	82	Confident	61 Å²	61	43.2 Å²	43.2	27%	0.268	22%	0.219	S	C	.	.			trans	-57.7	144.4	176.5	-60.2	-81.8	0	0	0	111.4	K25 Y26 G30 Q33 L267 N270 K272 E275	K25-F28 WeakPolarHBondContact O-CZ 3.4Å; Y26-F28 PolarHBondContact O-N 3.25Å; F28-G30 PolarHBondContact O-N 3.25Å; F28-Q33 PolarHBondContact O-NE2 3.44Å; F28-Q33 VanDerWaalsContact O-NE2 3.13Å; F28-Q33 PolarHBondContact O-OE1 2.89Å; F28-L267 HydrophobicContact CD2-CD2 3.87Å; F28-L267 HydrophobicContact CE2-CD2 3.85Å; F28-N270 PolarHBondContact O-ND2 3.09Å; F28-K272 HydrophobicContact CB-CG 4.39Å; F28-K272 HydrophobicContact CD2-CB 4.15Å; F28-K272 HydrophobicContact CD2-CG 3.97Å; F28-K272 HydrophobicContact CE2-CB 4.4Å; F28-K272 HydrophobicContact CE2-CG 4.49Å; F28-K272 HydrophobicContact CG-CG 4.14Å; F28-E275 HydrophobicContact CE2-CB 4.19Å; F28-E275 HydrophobicContact CE2-CG 3.83Å; F28-E275 HydrophobicContact CZ-CB 4.49Å; F28-E275 HydrophobicContact CZ-CG 3.79Å
29	C	85.2	Confident	83.8	Confident	82 Å²	82	41.4 Å²	41.4	55%	0.554	21%	0.21	S	C	*	.	S	Bend	trans	-73.8	97.6	172.1	-167.3	0	0	0	0	109.4
30	G	90.1	Very high	85.5	Confident	17 Å²	17	40 Å²	40	18%	0.175	20%	0.201	C	C	.	.	S	Bend	trans	-133.3	-159.7	176.3	0	0	0	0	0	112.4	F28 Y32 Q33 I34 N270	F28-G30 PolarHBondContact O-N 3.25Å; G30-Y32 PolarHBondContact O-N 3.22Å; G30-Q33 PolarHBondContact O-N 3.32Å; G30-Q33 VanDerWaalsContact O-N 3.15Å; G30-I34 WeakPolarHBondContact O-CG1 3.12Å; G30-I34 PolarHBondContact O-N 2.8Å; G30-I34 VanDerWaalsContact O-N 3.12Å; G30-N270 VanDerWaalsContact CA-OD1 3.28Å; G30-N270 WeakPolarHBondContact CA-OD1 3.35Å
31	L	93.1	Very high	87.2	Confident	100 Å²	100	41.3 Å²	41.3	52%	0.524	21%	0.208	S	C	.	.	H	α-helix	trans	-57.4	-36.1	-178	-175	66.2	0	0	0	112.5	Q33 I34 I35 I269 N270	L31-Q33 PolarHBondContact O-N 2.92Å; L31-I34 PolarHBondContact O-N 2.83Å; L31-I35 HydrophobicContact CG-CD1 4.23Å; L31-I35 WeakPolarHBondContact O-CG1 3.45Å; L31-I35 PolarHBondContact O-N 3.04Å; L31-I269 HydrophobicContact CB-CG2 4.12Å; L31-I269 HydrophobicContact CD2-CG2 4.22Å; L31-I269 HydrophobicContact CG-CG2 4.27Å; L31-N270 PolarHBondContact N-OD1 3.34Å; L31-N270 VanDerWaalsContact N-OD1 3.14Å
32	Y	93.4	Very high	88.7	Confident	3 Å²	3	35.5 Å²	35.5	1%	0.012	19%	0.188	C	C	.	.	H	α-helix	trans	-63	-44.2	178.5	-174.5	-95.9	0	0	0	111.6	G30 I34 I35 V36 Y186 N190 T243 R244 Y265 I266 I269 N270	G30-Y32 PolarHBondContact O-N 3.22Å; Y32-I34 VanDerWaalsContact C-N 3.3Å; Y32-I34 PolarHBondContact O-N 3.17Å; Y32-I35 WeakPolarHBondContact O-CB 3.26Å; Y32-I35 PolarHBondContact O-N 3.45Å; Y32-V36 HydrophobicContact CD1-CG2 3.99Å; Y32-V36 HydrophobicContact CE1-CG2 3.67Å; Y32-V36 WeakPolarHBondContact O-CG2 3.23Å; Y32-V36 PolarHBondContact O-N 2.87Å; Y32-Y186 PolarHBondContact OH-OH 2.66Å; Y32-N190 HydrophobicContact CE1-CB 4.26Å; Y32-N190 WeakPolarHBondContact CE1-OD1 3.47Å; Y32-T243 HydrophobicContact CE2-CG2 4.42Å; Y32-R244 PolarHBondContact OH-N 3.41Å; Y32-Y265 HydrophobicContact CD2-CD1 4.42Å; Y32-Y265 HydrophobicContact CD2-CE1 4.21Å; Y32-Y265 HydrophobicContact CE2-CD1 4.05Å; Y32-Y265 AromaticContact CE2-CE1 3.89Å; Y32-Y265 HydrophobicContact CE2-CE1 3.89Å; Y32-I266 HydrophobicContact CD1-CB 4.46Å; Y32-I266 HydrophobicContact CD1-CD1 4.42Å; Y32-I266 HydrophobicContact CD1-CG1 3.85Å; Y32-I266 HydrophobicContact CD1-CG2 4.05Å; Y32-I266 HydrophobicContact CD2-CG1 4.41Å; Y32-I266 HydrophobicContact CE1-CD1 3.96Å; Y32-I266 HydrophobicContact CE1-CG1 3.67Å; Y32-I266 HydrophobicContact CE2-CG1 4.26Å; Y32-I266 HydrophobicContact CG-CG1 4.22Å; Y32-I266 HydrophobicContact CG-CG2 4.35Å; Y32-I269 HydrophobicContact CD2-CB 4.48Å; Y32-I269 HydrophobicContact CD2-CG2 4.39Å; Y32-N270 VanDerWaalsContact CB-OD1 3.29Å; Y32-N270 WeakPolarHBondContact CB-OD1 3.17Å; Y32-N270 PolarHBondContact N-OD1 3.48Å
33	Q	93.9	Very high	89.6	Confident	2 Å²	2	35 Å²	35	1%	0.009	19%	0.185	C	C	.	.	H	α-helix	trans	-68.2	-32.2	178.6	-75.6	69.6	17.3	0	0	111.4	F28 G30 L31 V36 A37 N190 V191 N270	F28-Q33 PolarHBondContact O-NE2 3.44Å; F28-Q33 VanDerWaalsContact O-NE2 3.13Å; F28-Q33 PolarHBondContact O-OE1 2.89Å; G30-Q33 PolarHBondContact O-N 3.32Å; G30-Q33 VanDerWaalsContact O-N 3.15Å; L31-Q33 PolarHBondContact O-N 2.92Å; Q33-V36 PolarHBondContact O-N 3.47Å; Q33-A37 WeakPolarHBondContact O-CB 3.43Å; Q33-A37 PolarHBondContact O-N 3.22Å; Q33-N190 PolarHBondContact NE2-O 2.86Å; Q33-N190 VanDerWaalsContact NE2-O 3.12Å; Q33-V191 HydrophobicContact CG-CG2 4.23Å; Q33-N270 PolarHBondContact OE1-ND2 3.1Å; Q33-N270 PolarHBondContact OE1-OD1 3.35Å
34	I	93.2	Very high	90.2	Very high	92 Å²	92	35 Å²	35	47%	0.472	19%	0.185	S	C	.	.	H	α-helix	trans	-64.4	-45.4	171.2	-64.8	170.2	0	0	0	110.1	G30 L31 Y32 V36 A37 I38	G30-I34 WeakPolarHBondContact O-CG1 3.12Å; G30-I34 PolarHBondContact O-N 2.8Å; G30-I34 VanDerWaalsContact O-N 3.12Å; L31-I34 PolarHBondContact O-N 2.83Å; Y32-I34 VanDerWaalsContact C-N 3.3Å; Y32-I34 PolarHBondContact O-N 3.17Å; I34-V36 VanDerWaalsContact C-N 3.34Å; I34-V36 PolarHBondContact O-N 2.96Å; I34-A37 WeakPolarHBondContact O-CB 3.36Å; I34-A37 PolarHBondContact O-N 3.1Å; I34-A37 VanDerWaalsContact O-N 3.16Å; I34-I38 HydrophobicContact CG2-CD1 4Å; I34-I38 WeakPolarHBondContact O-CG1 3.42Å; I34-I38 PolarHBondContact O-N 2.63Å
35	I	94	Very high	90.7	Very high	48 Å²	48	35.1 Å²	35.1	25%	0.246	19%	0.186	C	C	.	.	H	α-helix	trans	-60.1	-44.8	175.5	-66.5	164.1	0	0	0	110.7	L31 Y32 A37 I38 I39 T243	L31-I35 HydrophobicContact CG-CD1 4.23Å; L31-I35 WeakPolarHBondContact O-CG1 3.45Å; L31-I35 PolarHBondContact O-N 3.04Å; Y32-I35 WeakPolarHBondContact O-CB 3.26Å; Y32-I35 PolarHBondContact O-N 3.45Å; I35-A37 VanDerWaalsContact C-N 3.31Å; I35-A37 PolarHBondContact O-N 2.95Å; I35-I38 PolarHBondContact O-N 2.58Å; I35-I39 HydrophobicContact CG2-CD1 4.03Å; I35-I39 WeakPolarHBondContact O-CG1 3.21Å; I35-I39 PolarHBondContact O-N 3.01Å; I35-T243 HydrophobicContact CG2-CG2 4.29Å
36	V	94	Very high	91.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-60.8	-39.8	175.7	171.4	0	0	0	0	111.5	Y32 Q33 I34 I39 Y40 Y186 V187 N190	Y32-V36 HydrophobicContact CD1-CG2 3.99Å; Y32-V36 HydrophobicContact CE1-CG2 3.67Å; Y32-V36 WeakPolarHBondContact O-CG2 3.23Å; Y32-V36 PolarHBondContact O-N 2.87Å; Q33-V36 PolarHBondContact O-N 3.47Å; I34-V36 VanDerWaalsContact C-N 3.34Å; I34-V36 PolarHBondContact O-N 2.96Å; V36-I39 PolarHBondContact O-N 2.96Å; V36-Y40 WeakPolarHBondContact O-CB 3.48Å; V36-Y40 PolarHBondContact O-N 3.46Å; V36-Y186 HydrophobicContact CG1-CD1 4.2Å; V36-Y186 HydrophobicContact CG1-CE1 4.08Å; V36-Y186 HydrophobicContact CG2-CE1 4.06Å; V36-V187 HydrophobicContact CG1-CB 4.34Å; V36-V187 HydrophobicContact CG1-CG2 3.9Å; V36-N190 HydrophobicContact CG1-CB 4.31Å; V36-N190 HydrophobicContact CG2-CB 4.27Å
37	A	93.8	Very high	91.5	Very high	26 Å²	26	30.4 Å²	30.4	22%	0.215	17%	0.166	C	C	.	.	H	α-helix	trans	-66.1	-39.7	175.5	0	0	0	0	0	112.4	Q33 I34 I35 Y40 Q41 I199	Q33-A37 WeakPolarHBondContact O-CB 3.43Å; Q33-A37 PolarHBondContact O-N 3.22Å; I34-A37 WeakPolarHBondContact O-CB 3.36Å; I34-A37 PolarHBondContact O-N 3.1Å; I34-A37 VanDerWaalsContact O-N 3.16Å; I35-A37 VanDerWaalsContact C-N 3.31Å; I35-A37 PolarHBondContact O-N 2.95Å; A37-Y40 WeakPolarHBondContact O-CB 3.23Å; A37-Y40 PolarHBondContact O-N 3.11Å; A37-Q41 WeakPolarHBondContact O-CB 3.47Å; A37-Q41 PolarHBondContact O-N 3.03Å; A37-I199 HydrophobicContact CB-CG2 3.69Å
38	I	93.8	Very high	91.5	Very high	77 Å²	77	30.3 Å²	30.3	40%	0.395	17%	0.165	S	C	.	.	H	α-helix	trans	-63.7	-45.7	174.8	-67.8	166.4	0	0	0	110.4	I34 I35 Y40 Q41 I42 L239	I34-I38 HydrophobicContact CG2-CD1 4Å; I34-I38 WeakPolarHBondContact O-CG1 3.42Å; I34-I38 PolarHBondContact O-N 2.63Å; I35-I38 PolarHBondContact O-N 2.58Å; I38-Y40 VanDerWaalsContact C-N 3.31Å; I38-Y40 PolarHBondContact O-N 2.92Å; I38-Q41 PolarHBondContact O-N 3.45Å; I38-Q41 VanDerWaalsContact O-N 3.12Å; I38-I42 HydrophobicContact CG2-CD1 3.73Å; I38-I42 HydrophobicContact CG2-CG1 4.29Å; I38-I42 WeakPolarHBondContact O-CG1 3.33Å; I38-I42 PolarHBondContact O-N 3.26Å; I38-L239 HydrophobicContact CG2-CD1 3.88Å
39	I	93.8	Very high	91.7	Very high	3 Å²	3	27.6 Å²	27.6	2%	0.015	15%	0.153	C	C	.	.	H	α-helix	trans	-56.7	-47.1	175.5	-71.5	167.3	0	0	0	110.5	I35 V36 Q41 I42 A43 T236 L239 L240 T243	I35-I39 HydrophobicContact CG2-CD1 4.03Å; I35-I39 WeakPolarHBondContact O-CG1 3.21Å; I35-I39 PolarHBondContact O-N 3.01Å; V36-I39 PolarHBondContact O-N 2.96Å; I39-Q41 VanDerWaalsContact C-N 3.3Å; I39-Q41 PolarHBondContact O-N 3.45Å; I39-I42 PolarHBondContact O-N 3.39Å; I39-A43 VanDerWaalsContact O-CB 3.24Å; I39-A43 WeakPolarHBondContact O-CB 3.31Å; I39-A43 PolarHBondContact O-N 3Å; I39-T236 HydrophobicContact CB-CG2 4.46Å; I39-T236 HydrophobicContact CG2-CG2 3.88Å; I39-L239 HydrophobicContact CD1-CB 4.07Å; I39-L239 HydrophobicContact CG1-CB 3.8Å; I39-L239 HydrophobicContact CG1-CD1 4.36Å; I39-L240 HydrophobicContact CD1-CB 4.4Å; I39-L240 HydrophobicContact CD1-CD1 4.26Å; I39-L240 HydrophobicContact CG2-CD1 4.43Å; I39-T243 HydrophobicContact CD1-CG2 3.63Å
40	Y	93.4	Very high	91.8	Very high	15 Å²	15	24 Å²	24	6%	0.059	13%	0.128	C	C	.	.	H	α-helix	trans	-59.7	-41.3	176.3	174.2	-102.6	0	0	0	112.5	V36 A37 I38 S44 M180 V183 V187 I200	V36-Y40 WeakPolarHBondContact O-CB 3.48Å; V36-Y40 PolarHBondContact O-N 3.46Å; A37-Y40 WeakPolarHBondContact O-CB 3.23Å; A37-Y40 PolarHBondContact O-N 3.11Å; I38-Y40 VanDerWaalsContact C-N 3.31Å; I38-Y40 PolarHBondContact O-N 2.92Å; Y40-S44 WeakPolarHBondContact O-CB 3.33Å; Y40-S44 PolarHBondContact O-N 3.37Å; Y40-S44 PolarHBondContact O-OG 3.23Å; Y40-M180 HydrophobicContact CE2-CE 4.2Å; Y40-V183 HydrophobicContact CD2-CG1 3.93Å; Y40-V183 HydrophobicContact CD2-CG2 4.13Å; Y40-V183 HydrophobicContact CE2-CG1 4.22Å; Y40-V187 HydrophobicContact CD2-CG2 3.74Å; Y40-V187 HydrophobicContact CG-CG2 3.77Å; Y40-I200 HydrophobicContact CE1-CG2 4.46Å; Y40-I200 WeakPolarHBondContact CE1-O 3.26Å; Y40-I200 WeakPolarHBondContact OH-CG2 3.43Å
41	Q	92.6	Very high	91.4	Very high	47 Å²	47	25.4 Å²	25.4	22%	0.22	13%	0.132	C	C	.	.	H	α-helix	trans	-67.9	-45.4	-178.9	177.6	54	15.1	0	0	112.3	A37 I38 I39 A43 S44 F45 G203	A37-Q41 WeakPolarHBondContact O-CB 3.47Å; A37-Q41 PolarHBondContact O-N 3.03Å; I38-Q41 PolarHBondContact O-N 3.45Å; I38-Q41 VanDerWaalsContact O-N 3.12Å; I39-Q41 VanDerWaalsContact C-N 3.3Å; I39-Q41 PolarHBondContact O-N 3.45Å; Q41-A43 VanDerWaalsContact C-N 3.34Å; Q41-S44 PolarHBondContact O-N 2.97Å; Q41-F45 PolarHBondContact O-N 3.13Å; Q41-G203 VanDerWaalsContact OE1-C 3.26Å
42	I	92.2	Very high	90.8	Very high	26 Å²	26	21.7 Å²	21.7	13%	0.133	11%	0.112	C	C	.	.	H	α-helix	trans	-68	-38.9	178.5	-54.6	166	0	0	0	110.1	I38 I39 S44 F45 I46 F232 V235 T236 L239	I38-I42 HydrophobicContact CG2-CD1 3.73Å; I38-I42 HydrophobicContact CG2-CG1 4.29Å; I38-I42 WeakPolarHBondContact O-CG1 3.33Å; I38-I42 PolarHBondContact O-N 3.26Å; I39-I42 PolarHBondContact O-N 3.39Å; I42-S44 VanDerWaalsContact C-N 3.33Å; I42-S44 PolarHBondContact O-N 2.88Å; I42-F45 WeakPolarHBondContact O-CB 3.47Å; I42-F45 PolarHBondContact O-N 3.45Å; I42-I46 HydrophobicContact CG2-CD1 3.97Å; I42-I46 HydrophobicContact CG2-CG1 4.43Å; I42-I46 WeakPolarHBondContact O-CD1 3.35Å; I42-I46 VanDerWaalsContact O-CG1 3.27Å; I42-I46 WeakPolarHBondContact O-CG1 3.44Å; I42-I46 PolarHBondContact O-N 2.85Å; I42-F232 HydrophobicContact CG2-CB 3.76Å; I42-F232 HydrophobicContact CG2-CD1 4.32Å; I42-F232 HydrophobicContact CG2-CG 4.48Å; I42-V235 HydrophobicContact CD1-CG1 4.29Å; I42-T236 VanDerWaalsContact CB-OG1 3.24Å; I42-T236 WeakPolarHBondContact CB-OG1 3.24Å; I42-T236 WeakPolarHBondContact CG2-OG1 3.31Å; I42-L239 HydrophobicContact CD1-CD1 4Å
43	A	92.8	Very high	90.3	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.008	11%	0.112	C	C	.	.	H	α-helix	trans	-59.3	-43.4	172.8	0	0	0	0	0	112.4	I39 Q41 I46 F47 M146 L179 V183	I39-A43 VanDerWaalsContact O-CB 3.24Å; I39-A43 WeakPolarHBondContact O-CB 3.31Å; I39-A43 PolarHBondContact O-N 3Å; Q41-A43 VanDerWaalsContact C-N 3.34Å; A43-I46 PolarHBondContact O-N 3.3Å; A43-F47 PolarHBondContact O-N 3.33Å; A43-M146 HydrophobicContact CB-CE 3.59Å; A43-L179 HydrophobicContact CB-CD1 4.11Å; A43-L179 HydrophobicContact CB-CD2 4.13Å; A43-L179 HydrophobicContact CB-CG 4.27Å; A43-V183 HydrophobicContact CB-CB 4.46Å; A43-V183 HydrophobicContact CB-CG1 4.27Å; A43-V183 HydrophobicContact CB-CG2 4.04Å
44	S	90.8	Very high	89.7	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-65	-38.4	176.4	-60.3	0	0	0	0	112.3	Y40 Q41 I42 F47 G48 G204	Y40-S44 WeakPolarHBondContact O-CB 3.33Å; Y40-S44 PolarHBondContact O-N 3.37Å; Y40-S44 PolarHBondContact O-OG 3.23Å; Q41-S44 PolarHBondContact O-N 2.97Å; I42-S44 VanDerWaalsContact C-N 3.33Å; I42-S44 PolarHBondContact O-N 2.88Å; S44-F47 PolarHBondContact O-N 3.11Å; S44-G48 PolarHBondContact O-N 3.04Å; S44-G204 WeakPolarHBondContact CB-O 2.95Å
45	F	91	Very high	88.8	Confident	8 Å²	8	19.8 Å²	19.8	4%	0.035	11%	0.106	C	C	.	.	H	α-helix	trans	-60.4	-50.8	172.6	163.4	-104.2	0	0	0	111.6	Q41 I42 F47 G48 F49 F211 S212 L215 A229 F232	Q41-F45 PolarHBondContact O-N 3.13Å; I42-F45 WeakPolarHBondContact O-CB 3.47Å; I42-F45 PolarHBondContact O-N 3.45Å; F45-F47 VanDerWaalsContact C-N 3.28Å; F45-F47 PolarHBondContact O-N 2.95Å; F45-G48 PolarHBondContact O-N 3.42Å; F45-F49 WeakPolarHBondContact O-CB 3.03Å; F45-F49 PolarHBondContact O-N 2.89Å; F45-F211 HydrophobicContact CD2-CB 4.22Å; F45-F211 AromaticContact CD2-CD1 3.47Å; F45-F211 HydrophobicContact CD2-CD1 3.47Å; F45-F211 VanDerWaalsContact CD2-CD1 3.47Å; F45-F211 HydrophobicContact CD2-CE1 4.34Å; F45-F211 HydrophobicContact CD2-CG 4.32Å; F45-F211 HydrophobicContact CE2-CB 4.38Å; F45-F211 AromaticContact CE2-CD1 3.31Å; F45-F211 HydrophobicContact CE2-CD1 3.31Å; F45-F211 AromaticContact CE2-CE1 3.95Å; F45-F211 HydrophobicContact CE2-CE1 3.95Å; F45-F211 HydrophobicContact CE2-CG 4.22Å; F45-F211 HydrophobicContact CG-CD1 4.23Å; F45-F211 AromaticContact CZ-CD1 4Å; F45-F211 HydrophobicContact CZ-CD1 4Å; F45-F211 HydrophobicContact CZ-CE1 4.18Å; F45-S212 WeakPolarHBondContact CD2-OG 3.37Å; F45-S212 WeakPolarHBondContact CE2-OG 3.46Å; F45-L215 HydrophobicContact CE2-CD1 4.3Å; F45-L215 HydrophobicContact CZ-CD1 4.3Å; F45-A229 HydrophobicContact CE1-CB 4.37Å; F45-A229 HydrophobicContact CZ-CB 4.13Å; F45-F232 HydrophobicContact CD1-CB 4.2Å; F45-F232 HydrophobicContact CD1-CD2 4.31Å; F45-F232 HydrophobicContact CD1-CG 4.22Å; F45-F232 HydrophobicContact CE1-CB 4.07Å; F45-F232 AromaticContact CE1-CD2 3.49Å; F45-F232 HydrophobicContact CE1-CD2 3.49Å; F45-F232 VanDerWaalsContact CE1-CD2 3.49Å; F45-F232 HydrophobicContact CE1-CE2 4.05Å; F45-F232 AromaticContact CE1-CG 3.84Å; F45-F232 HydrophobicContact CE1-CG 3.84Å; F45-F232 HydrophobicContact CZ-CD2 4.19Å; F45-F232 HydrophobicContact CZ-CE2 4.35Å
46	I	91	Very high	87.9	Confident	4 Å²	4	18.3 Å²	18.3	2%	0.021	10%	0.098	C	C	.	.	H	α-helix	trans	-60	-41.3	-179.7	-70.5	161.5	0	0	0	110.9	I42 A43 N50 M146 Q149 F232 G233	I42-I46 HydrophobicContact CG2-CD1 3.97Å; I42-I46 HydrophobicContact CG2-CG1 4.43Å; I42-I46 WeakPolarHBondContact O-CD1 3.35Å; I42-I46 VanDerWaalsContact O-CG1 3.27Å; I42-I46 WeakPolarHBondContact O-CG1 3.44Å; I42-I46 PolarHBondContact O-N 2.85Å; A43-I46 PolarHBondContact O-N 3.3Å; I46-N50 PolarHBondContact O-N 3.12Å; I46-N50 VanDerWaalsContact O-N 3.13Å; I46-N50 PolarHBondContact O-ND2 2.83Å; I46-M146 HydrophobicContact CD1-CE 4.05Å; I46-M146 HydrophobicContact CD1-SD 3.73Å; I46-Q149 HydrophobicContact CG2-CG 3.86Å; I46-F232 HydrophobicContact CD1-CB 4.36Å; I46-F232 HydrophobicContact CG1-CB 4.23Å; I46-G233 VanDerWaalsContact CD1-CA 3.4Å
47	F	88.8	Confident	87	Confident	24 Å²	24	19 Å²	19	11%	0.105	10%	0.101	C	C	.	.	H	α-helix	trans	-64.7	-50.4	174.2	177.7	-108.3	0	0	0	112.2	A43 S44 F45 F49 N50 L51 L122 G176 M180 V205	A43-F47 PolarHBondContact O-N 3.33Å; S44-F47 PolarHBondContact O-N 3.11Å; F45-F47 VanDerWaalsContact C-N 3.28Å; F45-F47 PolarHBondContact O-N 2.95Å; F47-F49 VanDerWaalsContact C-N 3.3Å; F47-F49 PolarHBondContact O-N 3.46Å; F47-N50 PolarHBondContact O-N 3.28Å; F47-N50 VanDerWaalsContact O-N 3.08Å; F47-L51 HydrophobicContact CD1-CD1 3.97Å; F47-L51 HydrophobicContact CE1-CD1 3.42Å; F47-L51 VanDerWaalsContact CE1-CD1 3.42Å; F47-L51 HydrophobicContact CE1-CG 4.14Å; F47-L51 HydrophobicContact CE2-CG 4.42Å; F47-L51 HydrophobicContact CZ-CD1 3.74Å; F47-L51 HydrophobicContact CZ-CD2 4.21Å; F47-L51 HydrophobicContact CZ-CG 4.09Å; F47-L51 PolarHBondContact O-N 3Å; F47-L122 HydrophobicContact CE2-CD1 4.07Å; F47-G176 WeakPolarHBondContact CD2-O 3.49Å; F47-M180 HydrophobicContact CB-CG 3.77Å; F47-M180 HydrophobicContact CB-SD 3.76Å; F47-M180 HydrophobicContact CD1-CG 3.43Å; F47-M180 VanDerWaalsContact CD1-CG 3.43Å; F47-M180 HydrophobicContact CD1-SD 4.04Å; F47-M180 HydrophobicContact CD2-CG 3.71Å; F47-M180 HydrophobicContact CE1-CG 3.83Å; F47-M180 HydrophobicContact CE2-CG 4.08Å; F47-M180 HydrophobicContact CG-CG 3.34Å; F47-M180 HydrophobicContact CG-SD 3.96Å; F47-M180 HydrophobicContact CZ-CG 4.14Å; F47-V205 HydrophobicContact CD1-CB 4.41Å; F47-V205 HydrophobicContact CD1-CG1 3.82Å; F47-V205 HydrophobicContact CD1-CG2 3.65Å; F47-V205 HydrophobicContact CE1-CG1 4.1Å; F47-V205 HydrophobicContact CE1-CG2 3.99Å
48	G	86.4	Confident	85.8	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-57.6	-41.6	177.6	0	0	0	0	0	112.6	S44 F45 N50 L51 I52	S44-G48 PolarHBondContact O-N 3.04Å; F45-G48 PolarHBondContact O-N 3.42Å; G48-N50 PolarHBondContact O-N 3.48Å; G48-L51 PolarHBondContact O-N 2.59Å; G48-I52 WeakPolarHBondContact O-CG1 3.12Å; G48-I52 PolarHBondContact O-N 3.27Å
49	F	88.1	Confident	84.4	Confident	4 Å²	4	20 Å²	20	2%	0.018	10%	0.099	C	C	.	.	H	α-helix	trans	-57.1	-48.5	172.9	175	-106.8	0	0	0	111.6	F45 F47 L51 I52 F53 S212 L225 A229	F45-F49 WeakPolarHBondContact O-CB 3.03Å; F45-F49 PolarHBondContact O-N 2.89Å; F47-F49 VanDerWaalsContact C-N 3.3Å; F47-F49 PolarHBondContact O-N 3.46Å; F49-L51 VanDerWaalsContact C-N 3.29Å; F49-L51 PolarHBondContact O-N 3.47Å; F49-I52 PolarHBondContact O-N 2.87Å; F49-F53 AromaticContact CE1-CD2 3.87Å; F49-F53 HydrophobicContact CE1-CD2 3.87Å; F49-F53 HydrophobicContact CE1-CE2 4.48Å; F49-F53 HydrophobicContact CE1-CG 4.47Å; F49-F53 AromaticContact CE2-CD2 3.76Å; F49-F53 HydrophobicContact CE2-CD2 3.76Å; F49-F53 HydrophobicContact CZ-CB 4.43Å; F49-F53 AromaticContact CZ-CD2 3.24Å; F49-F53 HydrophobicContact CZ-CD2 3.24Å; F49-F53 AromaticContact CZ-CE2 3.78Å; F49-F53 HydrophobicContact CZ-CE2 3.78Å; F49-F53 HydrophobicContact CZ-CG 4.19Å; F49-F53 VanDerWaalsContact O-CB 3.25Å; F49-F53 WeakPolarHBondContact O-CB 3.46Å; F49-F53 PolarHBondContact O-N 3.32Å; F49-S212 WeakPolarHBondContact CA-OG 3.15Å; F49-S212 WeakPolarHBondContact CB-OG 3.25Å; F49-S212 PolarHBondContact N-OG 2.95Å; F49-L225 HydrophobicContact CE2-CD1 3.99Å; F49-L225 HydrophobicContact CE2-CD2 4.17Å; F49-L225 HydrophobicContact CE2-CG 3.77Å; F49-L225 HydrophobicContact CZ-CG 4.15Å; F49-A229 HydrophobicContact CD1-CB 3.59Å; F49-A229 HydrophobicContact CD2-CB 3.57Å; F49-A229 HydrophobicContact CE1-CB 3.46Å; F49-A229 VanDerWaalsContact CE1-CB 3.46Å; F49-A229 HydrophobicContact CE2-CB 3.45Å; F49-A229 VanDerWaalsContact CE2-CB 3.45Å; F49-A229 HydrophobicContact CG-CB 3.63Å; F49-A229 HydrophobicContact CZ-CB 3.38Å
50	N	86.8	Confident	82.5	Confident	6 Å²	6	23 Å²	23	3%	0.032	11%	0.113	C	C	.	.	H	α-helix	trans	-65.3	-32.7	-178.9	-84.5	-85.5	0	0	0	112.8	I46 F47 G48 Q118 Q149	I46-N50 PolarHBondContact O-N 3.12Å; I46-N50 VanDerWaalsContact O-N 3.13Å; I46-N50 PolarHBondContact O-ND2 2.83Å; F47-N50 PolarHBondContact O-N 3.28Å; F47-N50 VanDerWaalsContact O-N 3.08Å; G48-N50 PolarHBondContact O-N 3.48Å; N50-Q118 PolarHBondContact O-NE2 3.19Å; N50-Q149 PolarHBondContact ND2-NE2 3.27Å
51	L	81.9	Confident	80.5	Confident	48 Å²	48	26 Å²	26	25%	0.251	14%	0.135	S	C	.	.	H	α-helix	trans	-64.6	-44.6	174.3	-72.6	177.2	0	0	0	112.4	F47 G48 F49 P55 L122 V205	F47-L51 HydrophobicContact CD1-CD1 3.97Å; F47-L51 HydrophobicContact CE1-CD1 3.42Å; F47-L51 VanDerWaalsContact CE1-CD1 3.42Å; F47-L51 HydrophobicContact CE1-CG 4.14Å; F47-L51 HydrophobicContact CE2-CG 4.42Å; F47-L51 HydrophobicContact CZ-CD1 3.74Å; F47-L51 HydrophobicContact CZ-CD2 4.21Å; F47-L51 HydrophobicContact CZ-CG 4.09Å; F47-L51 PolarHBondContact O-N 3Å; G48-L51 PolarHBondContact O-N 2.59Å; F49-L51 VanDerWaalsContact C-N 3.29Å; F49-L51 PolarHBondContact O-N 3.47Å; L51-P55 WeakPolarHBondContact O-CD 3.34Å; L51-L122 HydrophobicContact CD2-CD2 3.99Å; L51-V205 HydrophobicContact CD1-CG1 4.22Å
52	I	80.3	Confident	78.4	Confident	22 Å²	22	30.2 Å²	30.2	11%	0.113	16%	0.164	C	C	.	.	H	α-helix	trans	-92.9	-13.3	-173.4	70	-176.3	0	0	0	114.3	G48 F49 M54 P55 F56 I209	G48-I52 WeakPolarHBondContact O-CG1 3.12Å; G48-I52 PolarHBondContact O-N 3.27Å; F49-I52 PolarHBondContact O-N 2.87Å; I52-M54 PolarHBondContact O-N 3.14Å; I52-P55 VanDerWaalsContact O-CD 3.3Å; I52-P55 WeakPolarHBondContact O-CD 3.36Å; I52-F56 HydrophobicContact CB-CD2 4.22Å; I52-F56 HydrophobicContact CB-CE2 3.89Å; I52-F56 HydrophobicContact CB-CZ 4.33Å; I52-F56 HydrophobicContact CD1-CD2 4.2Å; I52-F56 HydrophobicContact CD1-CE2 3.27Å; I52-F56 HydrophobicContact CD1-CZ 3.81Å; I52-F56 HydrophobicContact CG1-CD2 3.89Å; I52-F56 HydrophobicContact CG1-CE2 3.44Å; I52-F56 VanDerWaalsContact CG1-CE2 3.44Å; I52-F56 HydrophobicContact CG1-CZ 4.23Å; I52-F56 WeakPolarHBondContact O-CD2 3.26Å; I52-F56 WeakPolarHBondContact O-CG 3.35Å; I52-F56 PolarHBondContact O-N 2.68Å; I52-I209 HydrophobicContact CD1-CG2 4.13Å; I52-I209 HydrophobicContact CG2-CG1 4.12Å; I52-I209 HydrophobicContact CG2-CG2 4.09Å
53	F	84.7	Confident	76.7	Confident	1 Å²	1	33.6 Å²	33.6	0%	0.004	18%	0.175	C	C	.	.	H	α-helix	trans	-57.3	-47.1	-177.5	-178.7	-89	0	0	0	112.8	F49 F56 M57 F165 W222	F49-F53 AromaticContact CE1-CD2 3.87Å; F49-F53 HydrophobicContact CE1-CD2 3.87Å; F49-F53 HydrophobicContact CE1-CE2 4.48Å; F49-F53 HydrophobicContact CE1-CG 4.47Å; F49-F53 AromaticContact CE2-CD2 3.76Å; F49-F53 HydrophobicContact CE2-CD2 3.76Å; F49-F53 HydrophobicContact CZ-CB 4.43Å; F49-F53 AromaticContact CZ-CD2 3.24Å; F49-F53 HydrophobicContact CZ-CD2 3.24Å; F49-F53 AromaticContact CZ-CE2 3.78Å; F49-F53 HydrophobicContact CZ-CE2 3.78Å; F49-F53 HydrophobicContact CZ-CG 4.19Å; F49-F53 VanDerWaalsContact O-CB 3.25Å; F49-F53 WeakPolarHBondContact O-CB 3.46Å; F49-F53 PolarHBondContact O-N 3.32Å; F53-F56 PolarHBondContact O-N 2.85Å; F53-M57 HydrophobicContact CD1-CG 3.8Å; F53-M57 HydrophobicContact CE1-CG 3.41Å; F53-M57 VanDerWaalsContact CE1-CG 3.41Å; F53-M57 HydrophobicContact CE1-SD 4.26Å; F53-M57 HydrophobicContact CE2-CG 4.42Å; F53-M57 HydrophobicContact CG-CG 4.48Å; F53-M57 HydrophobicContact CZ-CG 3.79Å; F53-M57 HydrophobicContact CZ-SD 4.17Å; F53-M57 WeakPolarHBondContact O-CB 3.23Å; F53-M57 VanDerWaalsContact O-CG 3.25Å; F53-M57 WeakPolarHBondContact O-CG 3.2Å; F53-M57 PolarHBondContact O-N 3.15Å; F53-F165 HydrophobicContact CE1-CE2 4.22Å; F53-F165 AromaticContact CE1-CZ 3.97Å; F53-F165 HydrophobicContact CE1-CZ 3.97Å; F53-W222 HydrophobicContact CE2-CB 4.33Å; F53-W222 HydrophobicContact CZ-CB 4.2Å; F53-W222 HydrophobicContact CZ-CE3 4.1Å
54	M	80.1	Confident	74.8	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-67	-46.5	-179.2	-74.2	-63.9	-67.8	0	0	112.1	I52 F56 M57 I58 I114 L115 Q118 F165	I52-M54 PolarHBondContact O-N 3.14Å; M54-F56 VanDerWaalsContact C-N 3.32Å; M54-F56 PolarHBondContact O-N 3.44Å; M54-M57 WeakPolarHBondContact O-CB 3.31Å; M54-M57 PolarHBondContact O-N 3.42Å; M54-M57 VanDerWaalsContact O-N 3.14Å; M54-I58 WeakPolarHBondContact O-CD1 3.43Å; M54-I58 VanDerWaalsContact O-CG1 3.23Å; M54-I58 WeakPolarHBondContact O-CG1 3.35Å; M54-I58 PolarHBondContact O-N 3.19Å; M54-I114 HydrophobicContact CE-CB 3.8Å; M54-I114 HydrophobicContact CE-CG2 3.52Å; M54-I114 HydrophobicContact SD-CG2 4.23Å; M54-L115 HydrophobicContact CB-CD1 3.65Å; M54-L115 HydrophobicContact CE-CB 4.12Å; M54-L115 HydrophobicContact CG-CD1 4.26Å; M54-Q118 VanDerWaalsContact CG-OE1 3.27Å; M54-F165 HydrophobicContact CE-CE1 4.37Å; M54-F165 HydrophobicContact SD-CE1 3.81Å; M54-F165 HydrophobicContact SD-CZ 3.98Å
55	P	75.3	Confident	73.3	Confident	56 Å²	56	46 Å²	46	36%	0.364	23%	0.23	S	C	.	.	H	α-helix	trans	-51.9	-44.5	170.1	-30.3	33.9	0	0	0	114.5	L51 I52 I58 F59	L51-P55 WeakPolarHBondContact O-CD 3.34Å; I52-P55 VanDerWaalsContact O-CD 3.3Å; I52-P55 WeakPolarHBondContact O-CD 3.36Å; P55-I58 PolarHBondContact O-N 3.28Å; P55-F59 PolarHBondContact O-N 3.44Å; P55-F59 VanDerWaalsContact O-N 3.13Å
56	F	74.7	Confident	71.6	Confident	16 Å²	16	52.8 Å²	52.8	7%	0.07	27%	0.266	C	S	.	.	H	α-helix	trans	-67.3	-36.2	176.8	-68.2	-37.9	0	0	0	113.2	I52 F53 M54 F59 A216 I332 Y333	I52-F56 HydrophobicContact CB-CD2 4.22Å; I52-F56 HydrophobicContact CB-CE2 3.89Å; I52-F56 HydrophobicContact CB-CZ 4.33Å; I52-F56 HydrophobicContact CD1-CD2 4.2Å; I52-F56 HydrophobicContact CD1-CE2 3.27Å; I52-F56 HydrophobicContact CD1-CZ 3.81Å; I52-F56 HydrophobicContact CG1-CD2 3.89Å; I52-F56 HydrophobicContact CG1-CE2 3.44Å; I52-F56 VanDerWaalsContact CG1-CE2 3.44Å; I52-F56 HydrophobicContact CG1-CZ 4.23Å; I52-F56 WeakPolarHBondContact O-CD2 3.26Å; I52-F56 WeakPolarHBondContact O-CG 3.35Å; I52-F56 PolarHBondContact O-N 2.68Å; F53-F56 PolarHBondContact O-N 2.85Å; M54-F56 VanDerWaalsContact C-N 3.32Å; M54-F56 PolarHBondContact O-N 3.44Å; F56-F59 PolarHBondContact O-N 2.99Å; F56-A216 HydrophobicContact CD2-CB 3.88Å; F56-A216 HydrophobicContact CE2-CB 3.88Å; F56-I332 HydrophobicContact CD1-CG2 4.1Å; F56-I332 HydrophobicContact CE1-CG2 3.78Å; F56-Y333 HydrophobicContact CB-CE1 4.36Å; F56-Y333 AromaticContact CD1-CD1 3.84Å; F56-Y333 HydrophobicContact CD1-CD1 3.84Å; F56-Y333 AromaticContact CD1-CE1 3.5Å; F56-Y333 HydrophobicContact CD1-CE1 3.5Å; F56-Y333 HydrophobicContact CD2-CE1 4.46Å; F56-Y333 AromaticContact CE1-CD1 3.6Å; F56-Y333 HydrophobicContact CE1-CD1 3.6Å; F56-Y333 AromaticContact CE1-CE1 3.79Å; F56-Y333 HydrophobicContact CE1-CE1 3.79Å; F56-Y333 HydrophobicContact CG-CD1 4.48Å; F56-Y333 AromaticContact CG-CE1 3.9Å; F56-Y333 HydrophobicContact CG-CE1 3.9Å; F56-Y333 HydrophobicContact CZ-CD1 4.03Å; F56-Y333 HydrophobicContact CZ-CE1 4.38Å
57	M	74.3	Confident	69.7	Low	14 Å²	14	55.7 Å²	55.7	7%	0.069	29%	0.287	C	S	.	.	H	α-helix	trans	-65.3	-39.3	174.6	-81.2	-69.3	-72	0	0	112.3	F53 M54 F59 W98 F165 W222	F53-M57 HydrophobicContact CD1-CG 3.8Å; F53-M57 HydrophobicContact CE1-CG 3.41Å; F53-M57 VanDerWaalsContact CE1-CG 3.41Å; F53-M57 HydrophobicContact CE1-SD 4.26Å; F53-M57 HydrophobicContact CE2-CG 4.42Å; F53-M57 HydrophobicContact CG-CG 4.48Å; F53-M57 HydrophobicContact CZ-CG 3.79Å; F53-M57 HydrophobicContact CZ-SD 4.17Å; F53-M57 WeakPolarHBondContact O-CB 3.23Å; F53-M57 VanDerWaalsContact O-CG 3.25Å; F53-M57 WeakPolarHBondContact O-CG 3.2Å; F53-M57 PolarHBondContact O-N 3.15Å; M54-M57 WeakPolarHBondContact O-CB 3.31Å; M54-M57 PolarHBondContact O-N 3.42Å; M54-M57 VanDerWaalsContact O-N 3.14Å; M57-F59 VanDerWaalsContact C-N 3.28Å; M57-W98 HydrophobicContact CB-CH2 4.08Å; M57-W98 HydrophobicContact CB-CZ2 3.63Å; M57-W98 HydrophobicContact CE-CH2 3.73Å; M57-W98 HydrophobicContact CE-CZ2 3.79Å; M57-W98 HydrophobicContact CE-CZ3 4.3Å; M57-W98 VanDerWaalsContact O-CE2 3.32Å; M57-W98 VanDerWaalsContact O-CZ2 3.25Å; M57-W98 WeakPolarHBondContact O-CZ2 3.46Å; M57-W98 PolarHBondContact O-NE1 2.92Å; M57-F165 HydrophobicContact CE-CE2 4.44Å; M57-F165 HydrophobicContact CE-CZ 4.3Å; M57-W222 HydrophobicContact CE-CB 4.28Å; M57-W222 HydrophobicContact CE-CD2 3.65Å; M57-W222 HydrophobicContact CE-CE3 4.19Å; M57-W222 HydrophobicContact CE-CG 3.69Å; M57-W222 HydrophobicContact CE-CZ2 4.38Å; M57-W222 HydrophobicContact CG-CB 4.29Å; M57-W222 HydrophobicContact SD-CB 3.08Å; M57-W222 WeakPolarHBondContact SD-CB 3.43Å; M57-W222 HydrophobicContact SD-CD2 3.69Å; M57-W222 HydrophobicContact SD-CE3 4.36Å; M57-W222 HydrophobicContact SD-CG 3.1Å
58	I	68.9	Low	67.7	Low	29 Å²	29	59.3 Å²	59.3	15%	0.149	31%	0.313	C	S	.	.	H	α-helix	trans	-69.5	-29.1	179.3	-69.1	160.5	0	0	0	111.1	M54 P55 E60 V111 Y112 L115	M54-I58 WeakPolarHBondContact O-CD1 3.43Å; M54-I58 VanDerWaalsContact O-CG1 3.23Å; M54-I58 WeakPolarHBondContact O-CG1 3.35Å; M54-I58 PolarHBondContact O-N 3.19Å; P55-I58 PolarHBondContact O-N 3.28Å; I58-E60 PolarHBondContact O-N 2.94Å; I58-V111 HydrophobicContact CD1-CG1 4.27Å; I58-V111 HydrophobicContact CG1-CG1 3.49Å; I58-V111 VanDerWaalsContact CG1-CG1 3.49Å; I58-Y112 HydrophobicContact CG2-CE1 4.2Å; I58-L115 HydrophobicContact CD1-CD2 4.1Å
59	F	63.9	Low	65.9	Low	95 Å²	95	69.8 Å²	69.8	42%	0.417	35%	0.353	S	S	.	.	S	Bend	trans	-68.4	106.6	-178	-166.5	-111.9	0	0	0	111.3	P55 F56 M57 P61 I332	P55-F59 PolarHBondContact O-N 3.44Å; P55-F59 VanDerWaalsContact O-N 3.13Å; F56-F59 PolarHBondContact O-N 2.99Å; M57-F59 VanDerWaalsContact C-N 3.28Å; F59-P61 VanDerWaalsContact O-CD 3.32Å; F59-P61 WeakPolarHBondContact O-CD 3.4Å; F59-I332 HydrophobicContact CB-CD1 4.07Å; F59-I332 HydrophobicContact CD1-CD1 4.2Å; F59-I332 HydrophobicContact CD1-CG1 4.5Å; F59-I332 HydrophobicContact CD2-CD1 3.05Å; F59-I332 HydrophobicContact CD2-CG1 3.94Å; F59-I332 HydrophobicContact CE1-CD1 4.43Å; F59-I332 HydrophobicContact CE1-CG1 4.37Å; F59-I332 HydrophobicContact CE2-CD1 3.34Å; F59-I332 HydrophobicContact CE2-CG1 3.77Å; F59-I332 HydrophobicContact CG-CD1 3.52Å; F59-I332 HydrophobicContact CG-CG1 4.27Å; F59-I332 HydrophobicContact CZ-CD1 4.04Å; F59-I332 HydrophobicContact CZ-CG1 4Å
60	E	53.9	Low	63.8	Low	67 Å²	67	76.5 Å²	76.5	31%	0.313	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-67	116.8	177.3	-67.5	167.2	-169.5	0	0	109.6	I58 W63 K108	I58-E60 PolarHBondContact O-N 2.94Å; E60-W63 HydrophobicContact CB-CZ2 4.21Å; E60-W63 HydrophobicContact CG-CH2 4.47Å; E60-W63 HydrophobicContact CG-CZ2 3.71Å; E60-W63 WeakPolarHBondContact OE2-CZ2 3.33Å; E60-W63 PolarHBondContact OE2-NE1 2.81Å; E60-K108 IonicContact OE1-NZ 3.72Å; E60-K108 PolarHBondContact OE1-NZ 3.23Å
61	P	51.6	Low	61.5	Low	79 Å²	79	82.6 Å²	82.6	51%	0.513	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-61.6	149.2	160.7	27.4	-31.4	0	0	0	108.6	F59 W63	F59-P61 VanDerWaalsContact O-CD 3.32Å; F59-P61 WeakPolarHBondContact O-CD 3.4Å; P61-W63 PolarHBondContact O-N 2.97Å; P61-W63 VanDerWaalsContact O-N 3.1Å
62	T	50	Low	59.5	Low	135 Å²	135	83.7 Å²	83.7	83%	0.828	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-55.2	119.8	179.9	42.3	0	0	0	0	110.5
63	W	55.2	Low	57.4	Low	96 Å²	96	88.4 Å²	88.4	36%	0.364	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-58.1	137	-179	-46.4	86.3	0	0	0	110.6	E60 P61 L88 P96	E60-W63 HydrophobicContact CB-CZ2 4.21Å; E60-W63 HydrophobicContact CG-CH2 4.47Å; E60-W63 HydrophobicContact CG-CZ2 3.71Å; E60-W63 WeakPolarHBondContact OE2-CZ2 3.33Å; E60-W63 PolarHBondContact OE2-NE1 2.81Å; P61-W63 PolarHBondContact O-N 2.97Å; P61-W63 VanDerWaalsContact O-N 3.1Å; W63-L88 HydrophobicContact CE3-CD2 3.75Å; W63-L88 HydrophobicContact CH2-CD2 4.25Å; W63-L88 HydrophobicContact CZ3-CD1 4.5Å; W63-L88 HydrophobicContact CZ3-CD2 3.42Å; W63-L88 VanDerWaalsContact CZ3-CD2 3.42Å; W63-P96 HydrophobicContact CH2-CG 4.13Å; W63-P96 VanDerWaalsContact CZ3-CD 3.49Å; W63-P96 HydrophobicContact CZ3-CG 4.24Å
64	R	54.2	Low	55.1	Low	204 Å²	204	94.1 Å²	94.1	77%	0.77	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.3	119.3	164.4	-69	-174.6	-176.6	172.9	1	107.4
65	C	57.7	Low	53.3	Low	59 Å²	59	101.8 Å²	101.8	40%	0.399	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	125	169.5	-54.6	0	0	0	0	106.7	S67 C93	C65-S67 PolarHBondContact O-N 3.16Å; C65-C93 HydrophobicContact CB-CB 4.03Å; C65-C93 WeakPolarHBondContact CB-SG 3.26Å; C65-C93 WeakPolarHBondContact SG-CB 3.45Å; C65-C93 CovalentContact SG-SG 2.03Å; C65-C93 PolarHBondContact SG-SG 3.46Å
66	D	55.9	Low	51.7	Low	149 Å²	149	105.8 Å²	105.8	80%	0.797	56%	0.561	S	S	*	*			trans	-76.8	103	168.9	-85	-21.5	0	0	0	106.7	P68	D66-P68 VanDerWaalsContact O-CD 3.26Å; D66-P68 WeakPolarHBondContact O-CD 3.41Å
67	S	50.7	Low	49.9	Very low	66 Å²	66	112.6 Å²	112.6	46%	0.462	60%	0.598	S	S	.	*			trans	-69.4	118.8	173.1	-179.8	0	0	0	0	109	C65 R69	C65-S67 PolarHBondContact O-N 3.16Å; S67-R69 PolarHBondContact O-N 3.02Å
68	P	47.8	Very low	48.3	Very low	99 Å²	99	113.2 Å²	113.2	64%	0.643	61%	0.608	S	S	*	*	S	Bend	trans	-83.7	66.5	172.1	34.7	-29.5	0	0	0	108.6	D66	D66-P68 VanDerWaalsContact O-CD 3.26Å; D66-P68 WeakPolarHBondContact O-CD 3.41Å
69	R	48.7	Very low	46.9	Very low	220 Å²	220	117.1 Å²	117.1	83%	0.83	64%	0.638	S	S	*	*	S	Bend	trans	173.6	124.3	157.9	-96.7	152.4	-157.4	-155.4	6.7	111.3	S67	S67-R69 PolarHBondContact O-N 3.02Å
70	N	43.3	Very low	46.3	Very low	145 Å²	145	117.7 Å²	117.7	78%	0.775	65%	0.645	S	S	*	*			trans	70.2	123.2	166.5	-69	-6.5	0	0	0	119	S72	N70-S72 PolarHBondContact O-N 3.23Å
71	S	37.6	Very low	46.3	Very low	134 Å²	134	119.1 Å²	119.1	94%	0.937	66%	0.662	S	S	*	*	S	Bend	trans	-63.3	68.8	169.6	50.2	0	0	0	0	113
72	S	40.5	Very low	46.6	Very low	71 Å²	71	118.3 Å²	118.3	50%	0.497	66%	0.659	S	S	.	*			trans	-140.3	128.5	155.8	52.3	0	0	0	0	108.3	N70 D74	N70-S72 PolarHBondContact O-N 3.23Å; S72-D74 WeakPolarHBondContact CB-OD2 3.37Å; S72-D74 PolarHBondContact O-N 3.02Å; S72-D74 PolarHBondContact OG-OD2 3.19Å
73	S	37.5	Very low	47.2	Very low	122 Å²	122	116.7 Å²	116.7	85%	0.853	65%	0.645	S	S	*	*			trans	-68.5	54.3	174.5	51.4	0	0	0	0	111.4	L75	S73-L75 PolarHBondContact O-N 3.16Å
74	D	35.7	Very low	47.6	Very low	121 Å²	121	118.8 Å²	118.8	65%	0.647	65%	0.653	S	S	*	*			trans	-81.1	106.6	173.9	-68.4	-42.5	0	0	0	107.3	S72 F76	S72-D74 WeakPolarHBondContact CB-OD2 3.37Å; S72-D74 PolarHBondContact O-N 3.02Å; S72-D74 PolarHBondContact OG-OD2 3.19Å; D74-F76 PolarHBondContact O-N 3.29Å
75	L	41.2	Very low	48.3	Very low	160 Å²	160	111 Å²	111	84%	0.838	63%	0.629	S	S	*	*			trans	-46.3	116.3	162.4	-89.9	91.8	0	0	0	107.2	S73 N77	S73-L75 PolarHBondContact O-N 3.16Å; L75-N77 VanDerWaalsContact C-N 3.31Å; L75-N77 PolarHBondContact O-N 2.88Å
76	F	41.7	Very low	48.7	Very low	141 Å²	141	110.2 Å²	110.2	62%	0.618	63%	0.627	S	S	*	*			trans	-54.8	95.4	174.5	-111.7	-93	0	0	0	109.5	D74 G78	D74-F76 PolarHBondContact O-N 3.29Å; F76-G78 PolarHBondContact O-N 3.31Å
77	N	37.5	Very low	49.2	Very low	159 Å²	159	105 Å²	105	85%	0.85	60%	0.598	S	S	*	*			trans	-78	39.6	164.8	-102.9	-7.8	0	0	0	109.8	L75 S79	L75-N77 VanDerWaalsContact C-N 3.31Å; L75-N77 PolarHBondContact O-N 2.88Å; N77-S79 PolarHBondContact O-N 2.94Å
78	G	40.5	Very low	50	Low	27 Å²	27	102.8 Å²	102.8	28%	0.278	58%	0.581	S	S	.	*			trans	-72	96.7	179.7	0	0	0	0	0	110.4	F76 L80 R84	F76-G78 PolarHBondContact O-N 3.31Å; G78-L80 VanDerWaalsContact C-N 3.31Å; G78-L80 PolarHBondContact O-N 3.47Å; G78-L80 VanDerWaalsContact O-N 3.14Å; G78-R84 PolarHBondContact O-NE 3.39Å; G78-R84 VanDerWaalsContact O-NE 3.14Å; G78-R84 PolarHBondContact O-NH2 3.42Å
79	S	39.9	Very low	50.9	Low	111 Å²	111	105.3 Å²	105.3	78%	0.776	58%	0.577	S	S	*	*			trans	-78.9	68.9	174.5	57.1	0	0	0	0	111.4	N77	N77-S79 PolarHBondContact O-N 2.94Å
80	L	51.2	Low	51.8	Low	107 Å²	107	100.5 Å²	100.5	56%	0.56	57%	0.568	S	S	*	*			trans	-165.5	123.1	154.1	-137.4	66.1	0	0	0	109.1	G78 S82 D83	G78-L80 VanDerWaalsContact C-N 3.31Å; G78-L80 PolarHBondContact O-N 3.47Å; G78-L80 VanDerWaalsContact O-N 3.14Å; L80-S82 WeakPolarHBondContact CD2-OG 3.44Å; L80-S82 PolarHBondContact O-N 3.34Å; L80-D83 PolarHBondContact O-N 2.69Å
81	S	54.9	Low	52.8	Low	96 Å²	96	95.7 Å²	95.7	67%	0.671	55%	0.553	S	S	*	*	H	α-helix	trans	-62.3	-26.7	-179.2	49	0	0	0	0	113.1	C85	S81-C85 PolarHBondContact O-N 3.2Å; S81-C85 PolarHBondContact O-SG 3.49Å; S81-C85 VanDerWaalsContact O-SG 3.32Å
82	S	56.9	Low	53.9	Low	63 Å²	63	93.4 Å²	93.4	44%	0.441	53%	0.528	S	S	.	.	H	α-helix	trans	-65.8	-41.8	-179.1	56.2	0	0	0	0	113	L80 R84 C85 A86	L80-S82 WeakPolarHBondContact CD2-OG 3.44Å; L80-S82 PolarHBondContact O-N 3.34Å; S82-R84 VanDerWaalsContact C-N 3.33Å; S82-R84 PolarHBondContact O-N 3.04Å; S82-C85 PolarHBondContact O-N 2.82Å; S82-A86 PolarHBondContact O-N 3.16Å; S82-A86 VanDerWaalsContact O-N 3.09Å
83	D	62.3	Low	54.9	Low	100 Å²	100	90.3 Å²	90.3	54%	0.535	51%	0.506	S	S	.	.	H	α-helix	trans	-68.2	-38.4	-178	-71	-10.4	0	0	0	110.7	L80 C85 A86 M87	L80-D83 PolarHBondContact O-N 2.69Å; D83-C85 VanDerWaalsContact C-N 3.3Å; D83-C85 PolarHBondContact O-N 3.19Å; D83-A86 PolarHBondContact O-N 3.16Å; D83-M87 VanDerWaalsContact O-CG 3.25Å; D83-M87 WeakPolarHBondContact O-CG 3.17Å; D83-M87 PolarHBondContact O-N 3.45Å
84	R	63.5	Low	55.8	Low	141 Å²	141	89 Å²	89	53%	0.532	50%	0.497	S	S	.	.	H	α-helix	trans	-62	-39.2	177.1	-59.6	-177	-174.1	-160.8	-1.8	112	G78 S82 L88	G78-R84 PolarHBondContact O-NE 3.39Å; G78-R84 VanDerWaalsContact O-NE 3.14Å; G78-R84 PolarHBondContact O-NH2 3.42Å; S82-R84 VanDerWaalsContact C-N 3.33Å; S82-R84 PolarHBondContact O-N 3.04Å; R84-L88 WeakPolarHBondContact O-CD1 3.43Å; R84-L88 PolarHBondContact O-N 3.01Å; R84-L88 VanDerWaalsContact O-N 3.15Å
85	C	69.1	Low	56.8	Low	40 Å²	40	84.3 Å²	84.3	27%	0.27	48%	0.477	S	S	.	.	H	α-helix	trans	-68.2	-40.1	176.8	-70.2	0	0	0	0	112.6	S81 S82 D83 R89 C105	S81-C85 PolarHBondContact O-N 3.2Å; S81-C85 PolarHBondContact O-SG 3.49Å; S81-C85 VanDerWaalsContact O-SG 3.32Å; S82-C85 PolarHBondContact O-N 2.82Å; D83-C85 VanDerWaalsContact C-N 3.3Å; D83-C85 PolarHBondContact O-N 3.19Å; C85-R89 WeakPolarHBondContact O-CB 3.29Å; C85-R89 PolarHBondContact O-N 2.97Å; C85-C105 WeakPolarHBondContact CA-SG 3.36Å; C85-C105 HydrophobicContact CB-CB 3.82Å; C85-C105 WeakPolarHBondContact CB-SG 3.44Å; C85-C105 WeakPolarHBondContact SG-CB 3.43Å; C85-C105 CovalentContact SG-SG 2.01Å; C85-C105 PolarHBondContact SG-SG 3.3Å
86	A	67.3	Low	57.6	Low	42 Å²	42	78 Å²	78	35%	0.347	45%	0.445	S	S	.	.	H	α-helix	trans	-65.5	-45	175.6	0	0	0	0	0	111.6	S82 D83 L88 R89 N90	S82-A86 PolarHBondContact O-N 3.16Å; S82-A86 VanDerWaalsContact O-N 3.09Å; D83-A86 PolarHBondContact O-N 3.16Å; A86-L88 VanDerWaalsContact C-N 3.33Å; A86-L88 PolarHBondContact O-N 3.34Å; A86-R89 PolarHBondContact O-N 3.26Å; A86-R89 VanDerWaalsContact O-N 3.13Å; A86-N90 VanDerWaalsContact O-CB 3.29Å; A86-N90 WeakPolarHBondContact O-CB 3.37Å; A86-N90 PolarHBondContact O-N 2.9Å; A86-N90 PolarHBondContact O-ND2 3.15Å; A86-N90 PolarHBondContact O-OD1 3.5Å
87	M	65.8	Low	58.6	Low	40 Å²	40	72.7 Å²	72.7	20%	0.197	43%	0.425	C	S	.	.	H	α-helix	trans	-60.2	-41.2	177.9	-68.7	-179.6	81.9	0	0	112.6	D83 G91 E92	D83-M87 VanDerWaalsContact O-CG 3.25Å; D83-M87 WeakPolarHBondContact O-CG 3.17Å; D83-M87 PolarHBondContact O-N 3.45Å; M87-G91 PolarHBondContact O-N 3.38Å; M87-E92 WeakPolarHBondContact CG-OE2 3.03Å; M87-E92 PolarHBondContact O-N 3.12Å; M87-E92 VanDerWaalsContact O-N 3.09Å
88	L	66.2	Low	60	Low	19 Å²	19	65.9 Å²	65.9	10%	0.099	39%	0.387	C	S	.	.	H	α-helix	trans	-58.5	-56.6	171.1	-82.9	156	0	0	0	109.9	W63 R84 A86 N90 G91 C93 Y99	W63-L88 HydrophobicContact CE3-CD2 3.75Å; W63-L88 HydrophobicContact CH2-CD2 4.25Å; W63-L88 HydrophobicContact CZ3-CD1 4.5Å; W63-L88 HydrophobicContact CZ3-CD2 3.42Å; W63-L88 VanDerWaalsContact CZ3-CD2 3.42Å; R84-L88 WeakPolarHBondContact O-CD1 3.43Å; R84-L88 PolarHBondContact O-N 3.01Å; R84-L88 VanDerWaalsContact O-N 3.15Å; A86-L88 VanDerWaalsContact C-N 3.33Å; A86-L88 PolarHBondContact O-N 3.34Å; L88-N90 PolarHBondContact O-N 3.25Å; L88-G91 PolarHBondContact O-N 3.05Å; L88-C93 HydrophobicContact CD2-CB 4.1Å; L88-C93 HydrophobicContact CG-CB 4.4Å; L88-Y99 WeakPolarHBondContact O-CE2 3.49Å; L88-Y99 PolarHBondContact O-OH 3.29Å; L88-Y99 VanDerWaalsContact O-OH 3.11Å
89	R	68.2	Low	60.9	Low	152 Å²	152	67.7 Å²	67.7	57%	0.574	39%	0.386	S	S	*	.	H	α-helix	trans	-61.1	-31.2	-175.5	-151.2	175.5	-145.2	178.6	1.9	113.5	C85 A86 G91 D102	C85-R89 WeakPolarHBondContact O-CB 3.29Å; C85-R89 PolarHBondContact O-N 2.97Å; A86-R89 PolarHBondContact O-N 3.26Å; A86-R89 VanDerWaalsContact O-N 3.13Å; R89-G91 VanDerWaalsContact C-N 3.3Å; R89-D102 IonicContact CZ-OD1 3.17Å; R89-D102 IonicContact CZ-OD2 3.95Å; R89-D102 IonicContact NE-OD1 3.1Å; R89-D102 PolarHBondContact NE-OD1 3.18Å; R89-D102 IonicContact NE-OD2 3.49Å; R89-D102 IonicContact NH2-OD1 2.69Å; R89-D102 PolarHBondContact NH2-OD1 2.65Å; R89-D102 IonicContact NH2-OD2 3.77Å; R89-D102 PolarHBondContact NH2-OD2 2.8Å
90	N	67.6	Low	62.4	Low	120 Å²	120	67.7 Å²	67.7	64%	0.642	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-5.2	178.5	-66.5	-10.3	0	0	0	113.6	A86 L88 E92	A86-N90 VanDerWaalsContact O-CB 3.29Å; A86-N90 WeakPolarHBondContact O-CB 3.37Å; A86-N90 PolarHBondContact O-N 2.9Å; A86-N90 PolarHBondContact O-ND2 3.15Å; A86-N90 PolarHBondContact O-OD1 3.5Å; L88-N90 PolarHBondContact O-N 3.25Å; N90-E92 HydrophobicContact CB-CG 4.49Å
91	G	63.8	Low	63.7	Low	44 Å²	44	63.9 Å²	63.9	45%	0.454	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.5	12.4	175.5	0	0	0	0	0	115.1	M87 L88 R89 C93 Y99	M87-G91 PolarHBondContact O-N 3.38Å; L88-G91 PolarHBondContact O-N 3.05Å; R89-G91 VanDerWaalsContact C-N 3.3Å; G91-C93 VanDerWaalsContact C-N 3.27Å; G91-Y99 VanDerWaalsContact CA-OH 3.24Å; G91-Y99 WeakPolarHBondContact CA-OH 3.46Å; G91-Y99 PolarHBondContact N-OH 2.8Å
92	E	61.6	Low	64.7	Low	86 Å²	86	61.5 Å²	61.5	40%	0.402	34%	0.335	S	S	.	.	S	Bend	trans	-77.5	-16.9	178.4	-62.2	178.1	170.8	0	0	112.3	M87 N90	M87-E92 WeakPolarHBondContact CG-OE2 3.03Å; M87-E92 PolarHBondContact O-N 3.12Å; M87-E92 VanDerWaalsContact O-N 3.09Å; N90-E92 HydrophobicContact CB-CG 4.49Å
93	C	60.6	Low	65.6	Low	6 Å²	6	58.7 Å²	58.7	4%	0.041	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	118.5	174.7	-56.6	0	0	0	0	109.9	C65 L88 G91 G95	C65-C93 HydrophobicContact CB-CB 4.03Å; C65-C93 WeakPolarHBondContact CB-SG 3.26Å; C65-C93 WeakPolarHBondContact SG-CB 3.45Å; C65-C93 CovalentContact SG-SG 2.03Å; C65-C93 PolarHBondContact SG-SG 3.46Å; L88-C93 HydrophobicContact CD2-CB 4.1Å; L88-C93 HydrophobicContact CG-CB 4.4Å; G91-C93 VanDerWaalsContact C-N 3.27Å; C93-G95 PolarHBondContact O-N 2.93Å
94	S	55.6	Low	66	Low	95 Å²	95	54.7 Å²	54.7	66%	0.664	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	114.9	170.6	60.4	0	0	0	0	109.5
95	G	57	Low	66.6	Low	22 Å²	22	50.1 Å²	50.1	23%	0.227	28%	0.283	C	S	.	.			trans	-118.7	168.2	-177.9	0	0	0	0	0	114	C93	C93-G95 PolarHBondContact O-N 2.93Å
96	P	59.2	Low	66.9	Low	27 Å²	27	55.3 Å²	55.3	18%	0.175	31%	0.309	C	S	.	.			trans	-54.3	162.1	178.1	24.2	-35.4	0	0	0	112.5	W63 W98 Y99	W63-P96 HydrophobicContact CH2-CG 4.13Å; W63-P96 VanDerWaalsContact CZ3-CD 3.49Å; W63-P96 HydrophobicContact CZ3-CG 4.24Å; P96-W98 PolarHBondContact O-N 3.05Å; P96-Y99 WeakPolarHBondContact O-CB 3.33Å; P96-Y99 PolarHBondContact O-N 3.07Å
97	T	61	Low	67.5	Low	30 Å²	30	57.4 Å²	57.4	18%	0.184	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.8	-18.6	-170.9	36.8	0	0	0	0	118.7	Y99 N100 W222	T97-Y99 PolarHBondContact O-N 2.85Å; T97-N100 WeakPolarHBondContact O-CB 3.42Å; T97-N100 PolarHBondContact O-N 2.86Å; T97-N100 VanDerWaalsContact O-N 3.08Å; T97-W222 VanDerWaalsContact CB-NE1 3.25Å; T97-W222 HydrophobicContact CG2-CZ2 3.77Å; T97-W222 PolarHBondContact OG1-NE1 3.42Å
98	W	67.4	Low	67.9	Low	15 Å²	15	59.3 Å²	59.3	6%	0.057	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-30.1	169.1	-46.5	117.8	0	0	0	112.1	M57 P96 N100 W101 D102 L103 V111	M57-W98 HydrophobicContact CB-CH2 4.08Å; M57-W98 HydrophobicContact CB-CZ2 3.63Å; M57-W98 HydrophobicContact CE-CH2 3.73Å; M57-W98 HydrophobicContact CE-CZ2 3.79Å; M57-W98 HydrophobicContact CE-CZ3 4.3Å; M57-W98 VanDerWaalsContact O-CE2 3.32Å; M57-W98 VanDerWaalsContact O-CZ2 3.25Å; M57-W98 WeakPolarHBondContact O-CZ2 3.46Å; M57-W98 PolarHBondContact O-NE1 2.92Å; P96-W98 PolarHBondContact O-N 3.05Å; W98-N100 VanDerWaalsContact C-N 3.32Å; W98-N100 PolarHBondContact O-N 2.56Å; W98-W101 HydrophobicContact CE3-CE3 4.11Å; W98-W101 HydrophobicContact CE3-CZ3 4.16Å; W98-W101 HydrophobicContact CZ3-CE3 4.31Å; W98-W101 AromaticContact CZ3-CZ3 3.96Å; W98-W101 HydrophobicContact CZ3-CZ3 3.96Å; W98-W101 CarbonylContact O-C 3.46Å; W98-W101 PolarHBondContact O-N 2.91Å; W98-W101 VanDerWaalsContact O-N 3.12Å; W98-D102 PolarHBondContact O-N 3.05Å; W98-L103 HydrophobicContact CB-CB 4.14Å; W98-L103 HydrophobicContact CE3-CD1 4.07Å; W98-L103 PolarHBondContact O-N 2.8Å; W98-V111 HydrophobicContact CD2-CG1 4.43Å; W98-V111 HydrophobicContact CD2-CG2 3.9Å; W98-V111 HydrophobicContact CE3-CG1 4.31Å; W98-V111 HydrophobicContact CE3-CG2 3.68Å; W98-V111 HydrophobicContact CG-CG2 4.46Å; W98-V111 HydrophobicContact CH2-CB 4.46Å; W98-V111 HydrophobicContact CH2-CG1 3.4Å; W98-V111 HydrophobicContact CH2-CG2 4.29Å; W98-V111 HydrophobicContact CZ2-CG1 3.48Å; W98-V111 VanDerWaalsContact CZ2-CG1 3.48Å; W98-V111 HydrophobicContact CZ2-CG2 4.44Å; W98-V111 HydrophobicContact CZ3-CB 4.48Å; W98-V111 HydrophobicContact CZ3-CG1 3.84Å; W98-V111 HydrophobicContact CZ3-CG2 3.91Å
99	Y	60.2	Low	68.5	Low	66 Å²	66	63.4 Å²	63.4	26%	0.259	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-55.2	-45.9	172	-177.1	-110.2	0	0	0	112.1	L88 G91 P96 T97 W101 D102	L88-Y99 WeakPolarHBondContact O-CE2 3.49Å; L88-Y99 PolarHBondContact O-OH 3.29Å; L88-Y99 VanDerWaalsContact O-OH 3.11Å; G91-Y99 VanDerWaalsContact CA-OH 3.24Å; G91-Y99 WeakPolarHBondContact CA-OH 3.46Å; G91-Y99 PolarHBondContact N-OH 2.8Å; P96-Y99 WeakPolarHBondContact O-CB 3.33Å; P96-Y99 PolarHBondContact O-N 3.07Å; T97-Y99 PolarHBondContact O-N 2.85Å; Y99-W101 PolarHBondContact O-N 3.09Å; Y99-W101 VanDerWaalsContact O-N 3.09Å; Y99-D102 PolarHBondContact O-N 3.36Å
100	N	71.4	Confident	69.2	Low	111 Å²	111	57.1 Å²	57.1	59%	0.594	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-64.6	-17.8	179.8	-64.8	-6.4	0	0	0	113.2	T97 W98	T97-N100 WeakPolarHBondContact O-CB 3.42Å; T97-N100 PolarHBondContact O-N 2.86Å; T97-N100 VanDerWaalsContact O-N 3.08Å; W98-N100 VanDerWaalsContact C-N 3.32Å; W98-N100 PolarHBondContact O-N 2.56Å
101	W	77.2	Confident	69.7	Low	26 Å²	26	51.7 Å²	51.7	10%	0.098	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-107.6	11.3	177.7	-61.6	-26	0	0	0	113	W98 Y99 L103 A159 N160 W162 F165 W222	W98-W101 HydrophobicContact CE3-CE3 4.11Å; W98-W101 HydrophobicContact CE3-CZ3 4.16Å; W98-W101 HydrophobicContact CZ3-CE3 4.31Å; W98-W101 AromaticContact CZ3-CZ3 3.96Å; W98-W101 HydrophobicContact CZ3-CZ3 3.96Å; W98-W101 CarbonylContact O-C 3.46Å; W98-W101 PolarHBondContact O-N 2.91Å; W98-W101 VanDerWaalsContact O-N 3.12Å; Y99-W101 PolarHBondContact O-N 3.09Å; Y99-W101 VanDerWaalsContact O-N 3.09Å; W101-L103 HydrophobicContact CB-CD1 4.2Å; W101-L103 HydrophobicContact CB-CG 3.89Å; W101-L103 HydrophobicContact CE3-CD1 4.12Å; W101-L103 PolarHBondContact O-N 2.87Å; W101-A159 HydrophobicContact CZ2-CB 4.3Å; W101-A159 WeakPolarHBondContact CZ2-O 3.47Å; W101-N160 PolarHBondContact NE1-O 3.49Å; W101-W162 HydrophobicContact CB-CB 4.4Å; W101-W162 HydrophobicContact CD2-CB 4.09Å; W101-W162 HydrophobicContact CE3-CB 3.79Å; W101-W162 HydrophobicContact CG-CB 4.38Å; W101-W162 HydrophobicContact CZ3-CB 4.43Å; W101-F165 HydrophobicContact CH2-CB 3.74Å; W101-F165 HydrophobicContact CH2-CD1 4.46Å; W101-F165 AromaticContact CH2-CD2 3.58Å; W101-F165 HydrophobicContact CH2-CD2 3.58Å; W101-F165 HydrophobicContact CH2-CE2 4.26Å; W101-F165 AromaticContact CH2-CG 3.69Å; W101-F165 HydrophobicContact CH2-CG 3.69Å; W101-F165 HydrophobicContact CZ2-CB 4.42Å; W101-F165 HydrophobicContact CZ3-CB 4.11Å; W101-F165 HydrophobicContact CZ3-CD1 4.28Å; W101-F165 HydrophobicContact CZ3-CD2 4.15Å; W101-F165 AromaticContact CZ3-CG 3.94Å; W101-F165 HydrophobicContact CZ3-CG 3.94Å; W101-W222 HydrophobicContact CH2-CH2 4.07Å; W101-W222 HydrophobicContact CH2-CZ2 4.35Å; W101-W222 HydrophobicContact CZ2-CH2 4.33Å
102	D	76	Confident	70.4	Confident	46 Å²	46	55 Å²	55	25%	0.246	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.2	31	-175	-170.4	49.7	0	0	0	112.1	R89 W98 Y99 V104 K107	R89-D102 IonicContact CZ-OD1 3.17Å; R89-D102 IonicContact CZ-OD2 3.95Å; R89-D102 IonicContact NE-OD1 3.1Å; R89-D102 PolarHBondContact NE-OD1 3.18Å; R89-D102 IonicContact NE-OD2 3.49Å; R89-D102 IonicContact NH2-OD1 2.69Å; R89-D102 PolarHBondContact NH2-OD1 2.65Å; R89-D102 IonicContact NH2-OD2 3.77Å; R89-D102 PolarHBondContact NH2-OD2 2.8Å; W98-D102 PolarHBondContact O-N 3.05Å; Y99-D102 PolarHBondContact O-N 3.36Å; D102-V104 PolarHBondContact O-N 3.01Å; D102-K107 WeakPolarHBondContact O-CD 3.36Å; D102-K107 IonicContact OD2-NZ 3.94Å; D102-K107 PolarHBondContact OD2-NZ 3.46Å
103	L	75.7	Confident	71.4	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.021	29%	0.285	C	S	.	.			trans	-90.2	40.5	179.9	-64.7	-173.8	0	0	0	112.3	W98 W101 K107 I110 V111 W162	W98-L103 HydrophobicContact CB-CB 4.14Å; W98-L103 HydrophobicContact CE3-CD1 4.07Å; W98-L103 PolarHBondContact O-N 2.8Å; W101-L103 HydrophobicContact CB-CD1 4.2Å; W101-L103 HydrophobicContact CB-CG 3.89Å; W101-L103 HydrophobicContact CE3-CD1 4.12Å; W101-L103 PolarHBondContact O-N 2.87Å; L103-K107 HydrophobicContact CD2-CB 4.13Å; L103-I110 HydrophobicContact CD1-CG2 4.24Å; L103-I110 HydrophobicContact CD2-CB 3.91Å; L103-I110 HydrophobicContact CD2-CD1 3.64Å; L103-I110 HydrophobicContact CD2-CG1 4.29Å; L103-I110 HydrophobicContact CD2-CG2 3.92Å; L103-V111 HydrophobicContact CB-CG2 4.38Å; L103-V111 HydrophobicContact CD1-CG2 4.17Å; L103-W162 HydrophobicContact CD1-CB 3.72Å; L103-W162 HydrophobicContact CD1-CG 4.16Å; L103-W162 HydrophobicContact CD2-CG 4.26Å; L103-W162 HydrophobicContact CG-CB 4.49Å
104	V	72.1	Confident	72.6	Confident	17 Å²	17	54.3 Å²	54.3	10%	0.103	28%	0.283	C	S	.	.	S	Bend	trans	-104.7	157.4	177.4	-66.2	0	0	0	0	110.2	D102 D106 K107	D102-V104 PolarHBondContact O-N 3.01Å; V104-D106 PolarHBondContact O-N 2.82Å; V104-D106 VanDerWaalsContact O-N 3.13Å; V104-K107 PolarHBondContact O-N 3.33Å; V104-K107 VanDerWaalsContact O-N 3.17Å
105	C	74.9	Confident	73.9	Confident	44 Å²	44	51.8 Å²	51.8	30%	0.297	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	56	-112.7	173.4	-59.4	0	0	0	0	113.8	C85 K107 K108	C85-C105 WeakPolarHBondContact CA-SG 3.36Å; C85-C105 HydrophobicContact CB-CB 3.82Å; C85-C105 WeakPolarHBondContact CB-SG 3.44Å; C85-C105 WeakPolarHBondContact SG-CB 3.43Å; C85-C105 CovalentContact SG-SG 2.01Å; C85-C105 PolarHBondContact SG-SG 3.3Å; C105-K107 PolarHBondContact O-N 3.3Å; C105-K107 VanDerWaalsContact O-N 3.14Å; C105-K108 WeakPolarHBondContact O-CB 3.41Å; C105-K108 PolarHBondContact O-N 2.71Å
106	D	77	Confident	75.2	Confident	150 Å²	150	53.9 Å²	53.9	80%	0.802	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-58.3	-30.5	-177.3	-59.2	-29.5	0	0	0	112.4	V104 H109	V104-D106 PolarHBondContact O-N 2.82Å; V104-D106 VanDerWaalsContact O-N 3.13Å; D106-H109 PolarHBondContact O-CE1 3.49Å; D106-H109 VanDerWaalsContact O-CE1 3.27Å; D106-H109 PolarHBondContact O-ND1 2.9Å
107	K	79.5	Confident	76.6	Confident	85 Å²	85	55.8 Å²	55.8	37%	0.37	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-92.5	3.6	-179.4	-71.3	174.6	177.9	174.9	0	114	D102 L103 V104 C105 H109 I110	D102-K107 WeakPolarHBondContact O-CD 3.36Å; D102-K107 IonicContact OD2-NZ 3.94Å; D102-K107 PolarHBondContact OD2-NZ 3.46Å; L103-K107 HydrophobicContact CD2-CB 4.13Å; V104-K107 PolarHBondContact O-N 3.33Å; V104-K107 VanDerWaalsContact O-N 3.17Å; C105-K107 PolarHBondContact O-N 3.3Å; C105-K107 VanDerWaalsContact O-N 3.14Å; K107-H109 PolarHBondContact O-N 3.27Å; K107-I110 HydrophobicContact CB-CD1 4.08Å; K107-I110 HydrophobicContact CG-CD1 4.21Å; K107-I110 WeakPolarHBondContact O-CB 3.39Å; K107-I110 WeakPolarHBondContact O-CG1 3.34Å; K107-I110 PolarHBondContact O-N 2.92Å
108	K	73.7	Confident	77.8	Confident	81 Å²	81	54.4 Å²	54.4	35%	0.352	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-30.7	179.2	-179.1	168.9	175.5	162.2	0	112.8	E60 C105 I110 V111 Y112	E60-K108 IonicContact OE1-NZ 3.72Å; E60-K108 PolarHBondContact OE1-NZ 3.23Å; C105-K108 WeakPolarHBondContact O-CB 3.41Å; C105-K108 PolarHBondContact O-N 2.71Å; K108-I110 PolarHBondContact O-N 2.92Å; K108-V111 PolarHBondContact O-N 2.69Å; K108-Y112 HydrophobicContact CG-CE2 4.35Å
109	H	78.2	Confident	78.6	Confident	104 Å²	104	56.3 Å²	56.3	48%	0.481	28%	0.282	S	S	.	.	H	α-helix	trans	-57	-32.5	178.1	68.4	-84.3	0	0	0	112.9	D106 K107 V111 Y112 D113	D106-H109 PolarHBondContact O-CE1 3.49Å; D106-H109 VanDerWaalsContact O-CE1 3.27Å; D106-H109 PolarHBondContact O-ND1 2.9Å; K107-H109 PolarHBondContact O-N 3.27Å; H109-V111 PolarHBondContact O-N 3.31Å; H109-V111 VanDerWaalsContact O-N 3.15Å; H109-Y112 WeakPolarHBondContact O-CB 3.13Å; H109-Y112 PolarHBondContact O-N 3.31Å; H109-D113 IonicContact CD2-OD2 2.91Å; H109-D113 PolarHBondContact CD2-OD2 2.92Å; H109-D113 PolarHBondContact O-N 3.22Å
110	I	84	Confident	79.8	Confident	20 Å²	20	55.9 Å²	55.9	10%	0.103	29%	0.292	C	S	.	.	H	α-helix	trans	-58.4	-33.4	-179	-61.4	178.1	0	0	0	111.5	L103 K107 K108 Y112 D113 I114 W162	L103-I110 HydrophobicContact CD1-CG2 4.24Å; L103-I110 HydrophobicContact CD2-CB 3.91Å; L103-I110 HydrophobicContact CD2-CD1 3.64Å; L103-I110 HydrophobicContact CD2-CG1 4.29Å; L103-I110 HydrophobicContact CD2-CG2 3.92Å; K107-I110 HydrophobicContact CB-CD1 4.08Å; K107-I110 HydrophobicContact CG-CD1 4.21Å; K107-I110 WeakPolarHBondContact O-CB 3.39Å; K107-I110 WeakPolarHBondContact O-CG1 3.34Å; K107-I110 PolarHBondContact O-N 2.92Å; K108-I110 PolarHBondContact O-N 2.92Å; I110-Y112 VanDerWaalsContact C-N 3.34Å; I110-Y112 PolarHBondContact O-N 2.65Å; I110-D113 PolarHBondContact O-N 2.84Å; I110-I114 HydrophobicContact CG2-CD1 4.22Å; I110-I114 VanDerWaalsContact O-CG1 3.26Å; I110-I114 WeakPolarHBondContact O-CG1 3.45Å; I110-I114 PolarHBondContact O-N 3.31Å; I110-W162 HydrophobicContact CD1-CZ2 4.48Å; I110-W162 HydrophobicContact CG2-CD2 3.92Å; I110-W162 HydrophobicContact CG2-CE3 3.64Å; I110-W162 HydrophobicContact CG2-CH2 4.35Å; I110-W162 HydrophobicContact CG2-CZ3 3.88Å
111	V	78	Confident	80.8	Confident	7 Å²	7	50.6 Å²	50.6	4%	0.042	26%	0.264	C	S	.	.	H	α-helix	trans	-65.6	-39.9	178.2	-173.6	0	0	0	0	111.4	I58 W98 L103 K108 H109 I114 L115	I58-V111 HydrophobicContact CD1-CG1 4.27Å; I58-V111 HydrophobicContact CG1-CG1 3.49Å; I58-V111 VanDerWaalsContact CG1-CG1 3.49Å; W98-V111 HydrophobicContact CD2-CG1 4.43Å; W98-V111 HydrophobicContact CD2-CG2 3.9Å; W98-V111 HydrophobicContact CE3-CG1 4.31Å; W98-V111 HydrophobicContact CE3-CG2 3.68Å; W98-V111 HydrophobicContact CG-CG2 4.46Å; W98-V111 HydrophobicContact CH2-CB 4.46Å; W98-V111 HydrophobicContact CH2-CG1 3.4Å; W98-V111 HydrophobicContact CH2-CG2 4.29Å; W98-V111 HydrophobicContact CZ2-CG1 3.48Å; W98-V111 VanDerWaalsContact CZ2-CG1 3.48Å; W98-V111 HydrophobicContact CZ2-CG2 4.44Å; W98-V111 HydrophobicContact CZ3-CB 4.48Å; W98-V111 HydrophobicContact CZ3-CG1 3.84Å; W98-V111 HydrophobicContact CZ3-CG2 3.91Å; L103-V111 HydrophobicContact CB-CG2 4.38Å; L103-V111 HydrophobicContact CD1-CG2 4.17Å; K108-V111 PolarHBondContact O-N 2.69Å; H109-V111 PolarHBondContact O-N 3.31Å; H109-V111 VanDerWaalsContact O-N 3.15Å; V111-I114 PolarHBondContact O-N 3.19Å; V111-L115 PolarHBondContact O-N 3.11Å
112	Y	78.6	Confident	81.2	Confident	113 Å²	113	49.5 Å²	49.5	44%	0.443	26%	0.26	S	S	.	.	H	α-helix	trans	-70.8	-35.6	175.1	-65.2	-81.9	0	0	0	111.4	I58 K108 H109 I110 I114 L115 S116	I58-Y112 HydrophobicContact CG2-CE1 4.2Å; K108-Y112 HydrophobicContact CG-CE2 4.35Å; H109-Y112 WeakPolarHBondContact O-CB 3.13Å; H109-Y112 PolarHBondContact O-N 3.31Å; I110-Y112 VanDerWaalsContact C-N 3.34Å; I110-Y112 PolarHBondContact O-N 2.65Å; Y112-I114 VanDerWaalsContact C-N 3.31Å; Y112-I114 PolarHBondContact O-N 3.31Å; Y112-L115 WeakPolarHBondContact O-CB 3.09Å; Y112-L115 PolarHBondContact O-N 3.39Å; Y112-S116 PolarHBondContact O-N 3.44Å
113	D	82.4	Confident	81.7	Confident	78 Å²	78	50 Å²	50	42%	0.417	26%	0.262	S	S	.	.	H	α-helix	trans	-61.3	-40.7	173.3	-64.4	-25.4	0	0	0	111.4	H109 I110 L115 S116 I117	H109-D113 IonicContact CD2-OD2 2.91Å; H109-D113 PolarHBondContact CD2-OD2 2.92Å; H109-D113 PolarHBondContact O-N 3.22Å; I110-D113 PolarHBondContact O-N 2.84Å; D113-L115 VanDerWaalsContact C-N 3.31Å; D113-L115 PolarHBondContact O-N 2.97Å; D113-S116 PolarHBondContact O-N 2.89Å; D113-I117 WeakPolarHBondContact O-CB 3.31Å; D113-I117 VanDerWaalsContact O-CG1 3.22Å; D113-I117 WeakPolarHBondContact O-CG1 3.47Å; D113-I117 PolarHBondContact O-N 3.31Å
114	I	86.4	Confident	82.4	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-62	-40.1	175.7	-63.8	163.4	0	0	0	111.1	M54 I110 V111 Y112 I117 Q118 W162 F165 A166 R169	M54-I114 HydrophobicContact CE-CB 3.8Å; M54-I114 HydrophobicContact CE-CG2 3.52Å; M54-I114 HydrophobicContact SD-CG2 4.23Å; I110-I114 HydrophobicContact CG2-CD1 4.22Å; I110-I114 VanDerWaalsContact O-CG1 3.26Å; I110-I114 WeakPolarHBondContact O-CG1 3.45Å; I110-I114 PolarHBondContact O-N 3.31Å; V111-I114 PolarHBondContact O-N 3.19Å; Y112-I114 VanDerWaalsContact C-N 3.31Å; Y112-I114 PolarHBondContact O-N 3.31Å; I114-I117 PolarHBondContact O-N 3.4Å; I114-Q118 PolarHBondContact O-N 3.23Å; I114-W162 HydrophobicContact CD1-CE3 4.43Å; I114-F165 HydrophobicContact CD1-CD1 4.18Å; I114-F165 HydrophobicContact CG2-CD1 4.04Å; I114-F165 HydrophobicContact CG2-CE1 3.92Å; I114-A166 HydrophobicContact CD1-CB 4.41Å; I114-A166 HydrophobicContact CG1-CB 3.89Å; I114-A166 HydrophobicContact CG2-CB 4.31Å; I114-R169 HydrophobicContact CG2-CB 4.25Å; I114-R169 HydrophobicContact CG2-CG 4.31Å
115	L	83	Confident	83.3	Confident	42 Å²	42	52.6 Å²	52.6	22%	0.22	28%	0.275	C	S	.	.	H	α-helix	trans	-61.6	-46.6	174.4	173.3	66	0	0	0	110.6	M54 I58 V111 Y112 D113 I117 Q118 M119	M54-L115 HydrophobicContact CB-CD1 3.65Å; M54-L115 HydrophobicContact CE-CB 4.12Å; M54-L115 HydrophobicContact CG-CD1 4.26Å; I58-L115 HydrophobicContact CD1-CD2 4.1Å; V111-L115 PolarHBondContact O-N 3.11Å; Y112-L115 WeakPolarHBondContact O-CB 3.09Å; Y112-L115 PolarHBondContact O-N 3.39Å; D113-L115 VanDerWaalsContact C-N 3.31Å; D113-L115 PolarHBondContact O-N 2.97Å; L115-I117 PolarHBondContact O-N 2.83Å; L115-Q118 WeakPolarHBondContact O-CB 2.99Å; L115-Q118 PolarHBondContact O-N 3.43Å; L115-M119 HydrophobicContact CD1-CE 3.89Å; L115-M119 HydrophobicContact CD1-CG 4.45Å; L115-M119 WeakPolarHBondContact O-CG 3.45Å; L115-M119 PolarHBondContact O-N 3.48Å
116	S	82.9	Confident	83.8	Confident	65 Å²	65	50.6 Å²	50.6	46%	0.455	26%	0.262	S	S	.	.	H	α-helix	trans	-62.7	-40.1	176.7	-72.4	0	0	0	0	112.6	Y112 D113 Q118 M119 A120	Y112-S116 PolarHBondContact O-N 3.44Å; D113-S116 PolarHBondContact O-N 2.89Å; S116-Q118 VanDerWaalsContact C-N 3.34Å; S116-Q118 PolarHBondContact O-N 2.98Å; S116-M119 PolarHBondContact O-N 3.06Å; S116-A120 WeakPolarHBondContact O-CB 3.42Å; S116-A120 PolarHBondContact O-N 3.5Å
117	I	88.5	Confident	84.2	Confident	67 Å²	67	46.8 Å²	46.8	34%	0.344	24%	0.241	S	C	.	.	H	α-helix	trans	-60	-45.2	173.9	-71.3	165.8	0	0	0	110.2	D113 I114 L115 M119 A120 A121 F170	D113-I117 WeakPolarHBondContact O-CB 3.31Å; D113-I117 VanDerWaalsContact O-CG1 3.22Å; D113-I117 WeakPolarHBondContact O-CG1 3.47Å; D113-I117 PolarHBondContact O-N 3.31Å; I114-I117 PolarHBondContact O-N 3.4Å; L115-I117 PolarHBondContact O-N 2.83Å; I117-M119 VanDerWaalsContact C-N 3.35Å; I117-M119 PolarHBondContact O-N 3.5Å; I117-A120 PolarHBondContact O-N 3.47Å; I117-A121 WeakPolarHBondContact O-CB 3.32Å; I117-A121 PolarHBondContact O-N 2.9Å; I117-F170 HydrophobicContact CG2-CB 3.9Å; I117-F170 HydrophobicContact CG2-CD2 3.71Å; I117-F170 HydrophobicContact CG2-CG 4.28Å
118	Q	87	Confident	84.9	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-62.1	-42	176.6	-174.3	-177.9	-49.5	0	0	111.4	N50 M54 I114 L115 S116 A121 L122	N50-Q118 PolarHBondContact O-NE2 3.19Å; M54-Q118 VanDerWaalsContact CG-OE1 3.27Å; I114-Q118 PolarHBondContact O-N 3.23Å; L115-Q118 WeakPolarHBondContact O-CB 2.99Å; L115-Q118 PolarHBondContact O-N 3.43Å; S116-Q118 VanDerWaalsContact C-N 3.34Å; S116-Q118 PolarHBondContact O-N 2.98Å; Q118-A121 PolarHBondContact O-N 2.98Å; Q118-L122 WeakPolarHBondContact O-CB 3.11Å; Q118-L122 PolarHBondContact O-N 2.91Å
119	M	83.5	Confident	85.8	Confident	55 Å²	55	43.2 Å²	43.2	27%	0.271	23%	0.229	S	C	.	.	H	α-helix	trans	-68.1	-38.8	177.9	-66.1	-58.1	126.9	0	0	112.6	L115 S116 I117 A121 L122 L123	L115-M119 HydrophobicContact CD1-CE 3.89Å; L115-M119 HydrophobicContact CD1-CG 4.45Å; L115-M119 WeakPolarHBondContact O-CG 3.45Å; L115-M119 PolarHBondContact O-N 3.48Å; S116-M119 PolarHBondContact O-N 3.06Å; I117-M119 VanDerWaalsContact C-N 3.35Å; I117-M119 PolarHBondContact O-N 3.5Å; M119-A121 VanDerWaalsContact C-N 3.31Å; M119-A121 PolarHBondContact O-N 3.27Å; M119-L122 VanDerWaalsContact O-CB 3.25Å; M119-L122 WeakPolarHBondContact O-CB 3.43Å; M119-L122 PolarHBondContact O-N 3.23Å; M119-L122 HydrophobicContact SD-CD2 4Å; M119-L123 PolarHBondContact O-N 3.3Å
120	A	86.7	Confident	86.4	Confident	57 Å²	57	38.3 Å²	38.3	47%	0.471	21%	0.206	S	C	.	.	H	α-helix	trans	-64.2	-38	173.1	0	0	0	0	0	111.6	S116 I117 L123 L124	S116-A120 WeakPolarHBondContact O-CB 3.42Å; S116-A120 PolarHBondContact O-N 3.5Å; I117-A120 PolarHBondContact O-N 3.47Å; A120-L123 WeakPolarHBondContact O-CB 3.4Å; A120-L123 PolarHBondContact O-N 2.73Å; A120-L124 PolarHBondContact O-N 2.96Å; A120-L124 VanDerWaalsContact O-N 3.08Å
121	A	91.1	Very high	86.7	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-67.4	-39.5	173.8	0	0	0	0	0	112.2	I117 Q118 M119 L123 L124 G125 F170 L174	I117-A121 WeakPolarHBondContact O-CB 3.32Å; I117-A121 PolarHBondContact O-N 2.9Å; Q118-A121 PolarHBondContact O-N 2.98Å; M119-A121 VanDerWaalsContact C-N 3.31Å; M119-A121 PolarHBondContact O-N 3.27Å; A121-L123 VanDerWaalsContact C-N 3.28Å; A121-L123 PolarHBondContact O-N 3.28Å; A121-L124 PolarHBondContact O-N 3.45Å; A121-G125 PolarHBondContact O-N 2.92Å; A121-F170 HydrophobicContact CB-CB 4.46Å; A121-F170 HydrophobicContact CB-CD1 4.49Å; A121-F170 HydrophobicContact CB-CD2 3.47Å; A121-F170 VanDerWaalsContact CB-CD2 3.47Å; A121-F170 HydrophobicContact CB-CE2 3.69Å; A121-F170 HydrophobicContact CB-CG 3.91Å; A121-F170 HydrophobicContact CB-CZ 4.29Å; A121-F170 WeakPolarHBondContact CB-O 3.31Å; A121-L174 HydrophobicContact CB-CB 4.44Å; A121-L174 WeakPolarHBondContact O-CA 3.16Å
122	L	87	Confident	87.5	Confident	4 Å²	4	46.3 Å²	46.3	2%	0.021	24%	0.239	C	C	.	.	H	α-helix	trans	-54.5	-46.5	173.3	-157.3	76.3	0	0	0	110.7	F47 L51 Q118 M119 G125 T126 G173 A177	F47-L122 HydrophobicContact CE2-CD1 4.07Å; L51-L122 HydrophobicContact CD2-CD2 3.99Å; Q118-L122 WeakPolarHBondContact O-CB 3.11Å; Q118-L122 PolarHBondContact O-N 2.91Å; M119-L122 VanDerWaalsContact O-CB 3.25Å; M119-L122 WeakPolarHBondContact O-CB 3.43Å; M119-L122 PolarHBondContact O-N 3.23Å; M119-L122 HydrophobicContact SD-CD2 4Å; L122-G125 PolarHBondContact O-N 3.33Å; L122-T126 PolarHBondContact O-N 2.59Å; L122-T126 VanDerWaalsContact O-N 3.1Å; L122-T126 PolarHBondContact O-OG1 3.16Å; L122-G173 WeakPolarHBondContact CA-O 3.46Å; L122-G173 WeakPolarHBondContact CD1-O 3.29Å; L122-A177 HydrophobicContact CB-CB 4.22Å; L122-A177 HydrophobicContact CD1-CB 3.46Å; L122-A177 VanDerWaalsContact CD1-CB 3.46Å; L122-A177 HydrophobicContact CG-CB 3.41Å; L122-A177 VanDerWaalsContact CG-CB 3.41Å; L122-A177 WeakPolarHBondContact O-CB 3.43Å
123	L	85.5	Confident	88.2	Confident	56 Å²	56	41 Å²	41	29%	0.293	22%	0.218	S	C	.	.	H	α-helix	trans	-60.9	-42.5	176.3	-169.2	81.9	0	0	0	113.1	M119 A120 A121 G125 T126 T434 N437 V438	M119-L123 PolarHBondContact O-N 3.3Å; A120-L123 WeakPolarHBondContact O-CB 3.4Å; A120-L123 PolarHBondContact O-N 2.73Å; A121-L123 VanDerWaalsContact C-N 3.28Å; A121-L123 PolarHBondContact O-N 3.28Å; L123-G125 VanDerWaalsContact C-N 3.34Å; L123-T126 PolarHBondContact O-OG1 3.42Å; L123-T434 HydrophobicContact CD1-CG2 3.17Å; L123-T434 VanDerWaalsContact CD1-O 3.24Å; L123-T434 WeakPolarHBondContact CD1-O 3.36Å; L123-T434 HydrophobicContact CG-CG2 3.68Å; L123-N437 HydrophobicContact CD1-CB 4.32Å; L123-V438 HydrophobicContact CD1-CG2 3.6Å; L123-V438 HydrophobicContact CD2-CG2 4.49Å
124	L	90.5	Very high	88.7	Confident	76 Å²	76	37.8 Å²	37.8	40%	0.398	20%	0.201	S	C	.	.	H	α-helix	trans	-69.7	-37.4	177.1	-175.2	61.5	0	0	0	110.9	A120 A121 L127 L128 F170 L174	A120-L124 PolarHBondContact O-N 2.96Å; A120-L124 VanDerWaalsContact O-N 3.08Å; A121-L124 PolarHBondContact O-N 3.45Å; L124-L127 PolarHBondContact O-N 3.45Å; L124-L128 HydrophobicContact CD1-CD1 3.84Å; L124-L128 HydrophobicContact CD1-CG 4.1Å; L124-L128 HydrophobicContact CD2-CD1 4.29Å; L124-L128 HydrophobicContact CG-CD1 3.73Å; L124-L128 HydrophobicContact CG-CG 4.29Å; L124-L128 WeakPolarHBondContact O-CG 3.29Å; L124-L128 PolarHBondContact O-N 2.87Å; L124-L128 VanDerWaalsContact O-N 3.08Å; L124-F170 HydrophobicContact CD2-CZ 4.46Å; L124-L174 HydrophobicContact CB-CD1 3.84Å; L124-L174 HydrophobicContact CD2-CD1 3.9Å; L124-L174 HydrophobicContact CG-CD1 3.75Å
125	G	91.1	Very high	88.9	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-63.8	-45.9	-177.3	0	0	0	0	0	113.1	A121 L122 L123 L127 L128 I129 L174	A121-G125 PolarHBondContact O-N 2.92Å; L122-G125 PolarHBondContact O-N 3.33Å; L123-G125 VanDerWaalsContact C-N 3.34Å; G125-L127 VanDerWaalsContact C-N 3.28Å; G125-L127 PolarHBondContact O-N 3.3Å; G125-L128 PolarHBondContact O-N 3.25Å; G125-I129 WeakPolarHBondContact O-CB 3.45Å; G125-I129 VanDerWaalsContact O-CG1 3.25Å; G125-I129 WeakPolarHBondContact O-CG1 3.3Å; G125-I129 PolarHBondContact O-N 2.67Å; G125-L174 WeakPolarHBondContact CA-O 3.5Å
126	T	85.1	Confident	89.4	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.006	25%	0.246	C	C	.	.	H	α-helix	trans	-55.9	-41.2	176.4	43	0	0	0	0	112.6	L122 L123 G130 A177 G430 T434	L122-T126 PolarHBondContact O-N 2.59Å; L122-T126 VanDerWaalsContact O-N 3.1Å; L122-T126 PolarHBondContact O-OG1 3.16Å; L123-T126 PolarHBondContact O-OG1 3.42Å; T126-G130 PolarHBondContact O-N 3.27Å; T126-A177 HydrophobicContact CG2-CB 3.26Å; T126-G430 WeakPolarHBondContact CB-O 3.23Å; T126-G430 WeakPolarHBondContact O-CA 3.48Å; T126-T434 WeakPolarHBondContact CB-OG1 3.35Å; T126-T434 PolarHBondContact OG1-OG1 2.78Å
127	L	86.6	Confident	89.9	Confident	71 Å²	71	46.6 Å²	46.6	37%	0.372	23%	0.225	S	C	.	.	H	α-helix	trans	-74	-47	-178.8	-64.2	176.1	0	0	0	112.3	L124 G125 R131 I431 T434	L124-L127 PolarHBondContact O-N 3.45Å; G125-L127 VanDerWaalsContact C-N 3.28Å; G125-L127 PolarHBondContact O-N 3.3Å; L127-R131 PolarHBondContact O-N 2.97Å; L127-I431 HydrophobicContact CD2-CB 4.49Å; L127-I431 HydrophobicContact CD2-CG1 3.71Å; L127-T434 HydrophobicContact CD1-CG2 4.21Å; L127-T434 HydrophobicContact CD2-CG2 4.24Å; L127-T434 HydrophobicContact CG-CG2 4.17Å
128	L	92.6	Very high	90.2	Very high	84 Å²	84	43.4 Å²	43.4	44%	0.44	21%	0.208	S	C	.	.	H	α-helix	trans	-73.9	-50.2	-174.9	-65.6	-178.2	0	0	0	111.9	L124 G125 R131 M132	L124-L128 HydrophobicContact CD1-CD1 3.84Å; L124-L128 HydrophobicContact CD1-CG 4.1Å; L124-L128 HydrophobicContact CD2-CD1 4.29Å; L124-L128 HydrophobicContact CG-CD1 3.73Å; L124-L128 HydrophobicContact CG-CG 4.29Å; L124-L128 WeakPolarHBondContact O-CG 3.29Å; L124-L128 PolarHBondContact O-N 2.87Å; L124-L128 VanDerWaalsContact O-N 3.08Å; G125-L128 PolarHBondContact O-N 3.25Å; L128-R131 PolarHBondContact O-N 2.75Å; L128-M132 VanDerWaalsContact O-CG 3.29Å; L128-M132 WeakPolarHBondContact O-CG 3.19Å; L128-M132 PolarHBondContact O-N 3.03Å
129	I	93.3	Very high	90.5	Very high	7 Å²	7	45.2 Å²	45.2	4%	0.036	22%	0.216	C	C	.	.	H	α-helix	trans	-69.1	-37.9	-174.7	-59.8	-62	0	0	0	111.2	G125 R131 M132 A133 V141 T145 F175 V182	G125-I129 WeakPolarHBondContact O-CB 3.45Å; G125-I129 VanDerWaalsContact O-CG1 3.25Å; G125-I129 WeakPolarHBondContact O-CG1 3.3Å; G125-I129 PolarHBondContact O-N 2.67Å; I129-R131 VanDerWaalsContact C-N 3.34Å; I129-R131 PolarHBondContact O-N 2.82Å; I129-M132 HydrophobicContact CD1-SD 4.17Å; I129-M132 PolarHBondContact O-N 2.74Å; I129-A133 WeakPolarHBondContact O-CB 3.41Å; I129-A133 PolarHBondContact O-N 2.76Å; I129-V141 HydrophobicContact CG2-CG1 3.6Å; I129-T145 HydrophobicContact CD1-CG2 4.01Å; I129-T145 HydrophobicContact CG1-CG2 4.38Å; I129-T145 HydrophobicContact CG2-CG2 3.71Å; I129-F175 HydrophobicContact CD1-CD1 4.34Å; I129-V182 HydrophobicContact CG2-CG2 3.95Å
130	G	90.9	Very high	91.1	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-58.8	-45.5	174.8	0	0	0	0	0	112	T126 A133 D134 S426	T126-G130 PolarHBondContact O-N 3.27Å; G130-A133 PolarHBondContact O-N 3.08Å; G130-D134 PolarHBondContact O-N 3.48Å; G130-D134 VanDerWaalsContact O-N 3.12Å; G130-S426 WeakPolarHBondContact O-CB 3.25Å
131	R	91.3	Very high	91.6	Very high	121 Å²	121	42.8 Å²	42.8	46%	0.457	20%	0.2	S	C	.	.	H	α-helix	trans	-66.1	-40.8	175.5	-175.8	-177.8	174.4	85.2	-0.2	112.5	L127 L128 I129 A133 D134 R135 T427	L127-R131 PolarHBondContact O-N 2.97Å; L128-R131 PolarHBondContact O-N 2.75Å; I129-R131 VanDerWaalsContact C-N 3.34Å; I129-R131 PolarHBondContact O-N 2.82Å; R131-A133 VanDerWaalsContact C-N 3.29Å; R131-A133 PolarHBondContact O-N 3.49Å; R131-D134 PolarHBondContact O-N 3.25Å; R131-R135 PolarHBondContact O-N 3Å; R131-R135 VanDerWaalsContact O-N 3.15Å; R131-T427 WeakPolarHBondContact CA-OG1 3.46Å
132	M	93.8	Very high	91.7	Very high	75 Å²	75	43 Å²	43	37%	0.369	20%	0.201	S	C	.	.	H	α-helix	trans	-60.3	-41.6	174.8	-73.8	177.5	70.3	0	0	110.9	L128 I129 D134 R135 F136 V141	L128-M132 VanDerWaalsContact O-CG 3.29Å; L128-M132 WeakPolarHBondContact O-CG 3.19Å; L128-M132 PolarHBondContact O-N 3.03Å; I129-M132 HydrophobicContact CD1-SD 4.17Å; I129-M132 PolarHBondContact O-N 2.74Å; M132-D134 PolarHBondContact O-N 2.91Å; M132-R135 PolarHBondContact O-N 2.86Å; M132-F136 HydrophobicContact CB-CD2 4.1Å; M132-F136 HydrophobicContact CE-CE2 4.5Å; M132-F136 HydrophobicContact CG-CD2 4.38Å; M132-F136 HydrophobicContact CG-CE2 4.31Å; M132-F136 WeakPolarHBondContact O-CB 3.45Å; M132-F136 WeakPolarHBondContact O-CD2 3.14Å; M132-F136 PolarHBondContact O-N 3.04Å; M132-V141 HydrophobicContact CB-CG1 4.47Å; M132-V141 HydrophobicContact CB-CG2 4.09Å
133	A	93.8	Very high	92.1	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-67.8	-35.5	179.9	0	0	0	0	0	112.9	I129 G130 R131 R135 G137 R138 V141 V182	I129-A133 WeakPolarHBondContact O-CB 3.41Å; I129-A133 PolarHBondContact O-N 2.76Å; G130-A133 PolarHBondContact O-N 3.08Å; R131-A133 VanDerWaalsContact C-N 3.29Å; R131-A133 PolarHBondContact O-N 3.49Å; A133-R135 VanDerWaalsContact C-N 3.32Å; A133-G137 WeakPolarHBondContact CA-O 3.39Å; A133-G137 CarbonylContact O-C 3.54Å; A133-G137 WeakPolarHBondContact O-CA 3.33Å; A133-G137 PolarHBondContact O-N 2.97Å; A133-R138 PolarHBondContact O-NH1 3.36Å; A133-V141 HydrophobicContact CB-CB 4.11Å; A133-V141 HydrophobicContact CB-CG1 4.05Å; A133-V141 HydrophobicContact CB-CG2 4.32Å; A133-V182 HydrophobicContact CB-CB 4.14Å; A133-V182 HydrophobicContact CB-CG1 3.57Å; A133-V182 HydrophobicContact CB-CG2 3.35Å
134	D	91.3	Very high	92.6	Very high	12 Å²	12	44.1 Å²	44.1	6%	0.064	21%	0.211	C	C	.	.	H	α-helix	trans	-65.2	-37.9	174.3	-74.2	-35.2	0	0	0	111.2	G130 R131 M132 R138 W249 A423 T427	G130-D134 PolarHBondContact O-N 3.48Å; G130-D134 VanDerWaalsContact O-N 3.12Å; R131-D134 PolarHBondContact O-N 3.25Å; M132-D134 PolarHBondContact O-N 2.91Å; D134-R138 VanDerWaalsContact N-NH1 3.12Å; D134-R138 IonicContact OD1-CZ 3.74Å; D134-R138 IonicContact OD1-NH1 3.01Å; D134-R138 PolarHBondContact OD1-NH1 3.23Å; D134-R138 IonicContact OD1-NH2 3.8Å; D134-R138 PolarHBondContact OD1-NH2 3.4Å; D134-W249 PolarHBondContact O-NE1 3.18Å; D134-A423 WeakPolarHBondContact CB-O 3.29Å; D134-T427 VanDerWaalsContact OD2-CB 3.26Å; D134-T427 WeakPolarHBondContact OD2-CB 3.36Å; D134-T427 PolarHBondContact OD2-N 3.35Å; D134-T427 PolarHBondContact OD2-OG1 3.29Å
135	R	91.2	Very high	92.7	Very high	176 Å²	176	40.6 Å²	40.6	66%	0.664	19%	0.192	S	C	*	.	H	α-helix	trans	-83.1	-44.6	-177	-172.8	176.8	-174.4	-177.3	1.2	114.9	R131 M132 A133	R131-R135 PolarHBondContact O-N 3Å; R131-R135 VanDerWaalsContact O-N 3.15Å; M132-R135 PolarHBondContact O-N 2.86Å; A133-R135 VanDerWaalsContact C-N 3.32Å
136	F	93.3	Very high	92.8	Very high	116 Å²	116	40.7 Å²	40.7	51%	0.509	19%	0.193	S	C	.	.	H	α-helix	trans	-101.8	-13.2	-170	-61.6	-63.4	0	0	0	113.7	M132 P140 V141	M132-F136 HydrophobicContact CB-CD2 4.1Å; M132-F136 HydrophobicContact CE-CE2 4.5Å; M132-F136 HydrophobicContact CG-CD2 4.38Å; M132-F136 HydrophobicContact CG-CE2 4.31Å; M132-F136 WeakPolarHBondContact O-CB 3.45Å; M132-F136 WeakPolarHBondContact O-CD2 3.14Å; M132-F136 PolarHBondContact O-N 3.04Å; F136-P140 VanDerWaalsContact O-CG 3.31Å; F136-P140 WeakPolarHBondContact O-CG 3.36Å; F136-V141 HydrophobicContact CB-CG2 4.28Å
137	G	93.1	Very high	93.3	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.212	C	C	.	.			trans	113.5	155.7	-175.2	0	0	0	0	0	112.3	A133 V141 E245 W249	A133-G137 WeakPolarHBondContact CA-O 3.39Å; A133-G137 CarbonylContact O-C 3.54Å; A133-G137 WeakPolarHBondContact O-CA 3.33Å; A133-G137 PolarHBondContact O-N 2.97Å; G137-V141 WeakPolarHBondContact O-CG2 3.29Å; G137-E245 WeakPolarHBondContact CA-OE2 3.42Å; G137-W249 VanDerWaalsContact CA-CE2 3.43Å; G137-W249 VanDerWaalsContact N-CZ2 3.3Å
138	R	94.8	Very high	93.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-72.8	-49	179.7	-52.4	-66	-179.3	-131.9	11.1	110.7	A133 D134 L142 V182 V185 Y186 E189 E245 T246 T422 S426	A133-R138 PolarHBondContact O-NH1 3.36Å; D134-R138 VanDerWaalsContact N-NH1 3.12Å; D134-R138 IonicContact OD1-CZ 3.74Å; D134-R138 IonicContact OD1-NH1 3.01Å; D134-R138 PolarHBondContact OD1-NH1 3.23Å; D134-R138 IonicContact OD1-NH2 3.8Å; D134-R138 PolarHBondContact OD1-NH2 3.4Å; R138-L142 WeakPolarHBondContact O-CB 3.32Å; R138-L142 VanDerWaalsContact O-CG 3.23Å; R138-L142 WeakPolarHBondContact O-CG 3.41Å; R138-L142 PolarHBondContact O-N 3.36Å; R138-V182 HydrophobicContact CB-CG1 4.21Å; R138-V185 VanDerWaalsContact NE-CG1 3.34Å; R138-Y186 HydrophobicContact CB-CD2 3.8Å; R138-E189 IonicContact NE-OE1 2.8Å; R138-E189 IonicContact NE-OE2 2.87Å; R138-E189 IonicContact NH2-OE1 3.58Å; R138-E245 VanDerWaalsContact CB-OE1 3.29Å; R138-E245 WeakPolarHBondContact CB-OE1 3.27Å; R138-E245 PolarHBondContact N-OE1 2.91Å; R138-E245 PolarHBondContact N-OE2 3.29Å; R138-T246 HydrophobicContact CB-CG2 4.26Å; R138-T246 HydrophobicContact CG-CG2 3.95Å; R138-T422 PolarHBondContact NH2-O 2.99Å; R138-S426 PolarHBondContact NH1-OG 3.25Å
139	K	95.1	Very high	93.6	Very high	39 Å²	39	37.9 Å²	37.9	17%	0.17	18%	0.181	C	C	.	.	H	α-helix	trans	-60	-53.2	-176.4	178	179.8	170.6	172.2	0	113.3	V141 L142 L143 L240 V241 T243 E245	K139-V141 VanDerWaalsContact C-N 3.31Å; K139-V141 PolarHBondContact O-N 2.73Å; K139-L142 PolarHBondContact O-N 2.67Å; K139-L143 HydrophobicContact CG-CD1 4.07Å; K139-L143 HydrophobicContact CG-CG 4.49Å; K139-L143 WeakPolarHBondContact O-CG 3.43Å; K139-L143 PolarHBondContact O-N 3.21Å; K139-L240 WeakPolarHBondContact CE-O 3.31Å; K139-L240 HydrophobicContact CG-CD1 4.4Å; K139-L240 HydrophobicContact CG-CG 4.25Å; K139-L240 PolarHBondContact NZ-O 2.86Å; K139-V241 PolarHBondContact NZ-O 2.87Å; K139-T243 PolarHBondContact NZ-O 3.26Å; K139-E245 WeakPolarHBondContact CB-OE2 3.38Å; K139-E245 PolarHBondContact N-OE1 3.29Å; K139-E245 PolarHBondContact N-OE2 3.06Å
140	P	95.4	Very high	93.6	Very high	57 Å²	57	37.6 Å²	37.6	37%	0.37	18%	0.18	S	C	.	.	H	α-helix	trans	-64.9	-37	-176.3	24.5	-32.9	0	0	0	111.9	F136 L143 S144 E245	F136-P140 VanDerWaalsContact O-CG 3.31Å; F136-P140 WeakPolarHBondContact O-CG 3.36Å; P140-L143 PolarHBondContact O-N 3.27Å; P140-S144 PolarHBondContact O-N 3.44Å; P140-S144 PolarHBondContact O-OG 2.9Å; P140-E245 WeakPolarHBondContact CD-OE2 3.14Å
141	V	96	Very high	93.9	Very high	4 Å²	4	41.2 Å²	41.2	2%	0.024	20%	0.202	C	C	.	.	H	α-helix	trans	-67.5	-44.5	177.1	175.8	0	0	0	0	110.8	I129 M132 A133 F136 G137 K139 L143 S144 T145 V182	I129-V141 HydrophobicContact CG2-CG1 3.6Å; M132-V141 HydrophobicContact CB-CG1 4.47Å; M132-V141 HydrophobicContact CB-CG2 4.09Å; A133-V141 HydrophobicContact CB-CB 4.11Å; A133-V141 HydrophobicContact CB-CG1 4.05Å; A133-V141 HydrophobicContact CB-CG2 4.32Å; F136-V141 HydrophobicContact CB-CG2 4.28Å; G137-V141 WeakPolarHBondContact O-CG2 3.29Å; K139-V141 VanDerWaalsContact C-N 3.31Å; K139-V141 PolarHBondContact O-N 2.73Å; V141-L143 VanDerWaalsContact C-N 3.34Å; V141-L143 PolarHBondContact O-N 2.95Å; V141-S144 PolarHBondContact O-N 2.93Å; V141-S144 PolarHBondContact O-OG 3.44Å; V141-T145 HydrophobicContact CG1-CG2 4.28Å; V141-T145 VanDerWaalsContact O-CG2 3.29Å; V141-T145 WeakPolarHBondContact O-CG2 3.26Å; V141-T145 PolarHBondContact O-N 2.74Å; V141-T145 PolarHBondContact O-OG1 2.92Å; V141-V182 HydrophobicContact CG1-CG2 4.42Å
142	L	95.1	Very high	94	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.021	19%	0.188	C	C	.	.	H	α-helix	trans	-60.4	-39.7	173.5	-75.4	171.4	0	0	0	113.2	R138 K139 T145 M146 L179 V182 V183 Y186 L240	R138-L142 WeakPolarHBondContact O-CB 3.32Å; R138-L142 VanDerWaalsContact O-CG 3.23Å; R138-L142 WeakPolarHBondContact O-CG 3.41Å; R138-L142 PolarHBondContact O-N 3.36Å; K139-L142 PolarHBondContact O-N 2.67Å; L142-T145 WeakPolarHBondContact CA-OG1 3.21Å; L142-T145 PolarHBondContact O-OG1 2.66Å; L142-T145 VanDerWaalsContact O-OG1 3.05Å; L142-M146 VanDerWaalsContact O-CB 3.24Å; L142-M146 WeakPolarHBondContact O-CB 3.42Å; L142-M146 WeakPolarHBondContact O-CG 3.21Å; L142-M146 PolarHBondContact O-N 3.46Å; L142-L179 HydrophobicContact CD2-CD1 3.53Å; L142-V182 HydrophobicContact CD1-CG1 4.04Å; L142-V182 HydrophobicContact CD2-CB 3.85Å; L142-V182 HydrophobicContact CD2-CG1 3.84Å; L142-V182 HydrophobicContact CG-CB 4.17Å; L142-V182 HydrophobicContact CG-CG1 3.57Å; L142-V183 HydrophobicContact CD2-CB 3.8Å; L142-V183 HydrophobicContact CD2-CG2 4.39Å; L142-Y186 HydrophobicContact CD1-CD1 4.37Å; L142-Y186 HydrophobicContact CD1-CD2 4.12Å; L142-Y186 HydrophobicContact CD1-CG 3.83Å; L142-L240 HydrophobicContact CB-CD2 3.4Å; L142-L240 VanDerWaalsContact CB-CD2 3.4Å
143	L	95.3	Very high	94	Very high	32 Å²	32	33.4 Å²	33.4	17%	0.168	17%	0.171	C	C	.	.	H	α-helix	trans	-62.1	-47.4	174.8	-78.6	170.6	0	0	0	110.9	K139 P140 V141 T145 M146 I147 A237 L240 V241	K139-L143 HydrophobicContact CG-CD1 4.07Å; K139-L143 HydrophobicContact CG-CG 4.49Å; K139-L143 WeakPolarHBondContact O-CG 3.43Å; K139-L143 PolarHBondContact O-N 3.21Å; P140-L143 PolarHBondContact O-N 3.27Å; V141-L143 VanDerWaalsContact C-N 3.34Å; V141-L143 PolarHBondContact O-N 2.95Å; L143-T145 PolarHBondContact O-N 3.21Å; L143-M146 PolarHBondContact O-N 3.43Å; L143-I147 WeakPolarHBondContact O-CB 3.35Å; L143-I147 VanDerWaalsContact O-CG1 3.27Å; L143-I147 WeakPolarHBondContact O-CG1 3.21Å; L143-I147 PolarHBondContact O-N 2.95Å; L143-A237 HydrophobicContact CD2-CB 4.34Å; L143-A237 WeakPolarHBondContact CD2-O 3.37Å; L143-L240 HydrophobicContact CB-CD2 4.3Å; L143-L240 HydrophobicContact CD2-CB 3.82Å; L143-L240 HydrophobicContact CD2-CD2 3.73Å; L143-L240 HydrophobicContact CD2-CG 3.88Å; L143-L240 HydrophobicContact CG-CB 4.45Å; L143-L240 HydrophobicContact CG-CD2 3.59Å; L143-L240 HydrophobicContact CG-CG 3.94Å; L143-V241 HydrophobicContact CD2-CG2 3.83Å
144	S	94.4	Very high	94	Very high	52 Å²	52	35.6 Å²	35.6	36%	0.364	18%	0.182	S	C	.	.	H	α-helix	trans	-63.7	-41.5	-179.4	70.7	0	0	0	0	112.6	P140 V141 G148	P140-S144 PolarHBondContact O-N 3.44Å; P140-S144 PolarHBondContact O-OG 2.9Å; V141-S144 PolarHBondContact O-N 2.93Å; V141-S144 PolarHBondContact O-OG 3.44Å; S144-G148 PolarHBondContact O-N 3.24Å
145	T	94	Very high	94.1	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.006	20%	0.195	C	C	.	.	H	α-helix	trans	-70.3	-40	179.7	57.7	0	0	0	0	111.1	I129 V141 L142 L143 Q149 F175	I129-T145 HydrophobicContact CD1-CG2 4.01Å; I129-T145 HydrophobicContact CG1-CG2 4.38Å; I129-T145 HydrophobicContact CG2-CG2 3.71Å; V141-T145 HydrophobicContact CG1-CG2 4.28Å; V141-T145 VanDerWaalsContact O-CG2 3.29Å; V141-T145 WeakPolarHBondContact O-CG2 3.26Å; V141-T145 PolarHBondContact O-N 2.74Å; V141-T145 PolarHBondContact O-OG1 2.92Å; L142-T145 WeakPolarHBondContact CA-OG1 3.21Å; L142-T145 PolarHBondContact O-OG1 2.66Å; L142-T145 VanDerWaalsContact O-OG1 3.05Å; L143-T145 PolarHBondContact O-N 3.21Å; T145-Q149 WeakPolarHBondContact O-CB 3.37Å; T145-Q149 PolarHBondContact O-N 2.92Å; T145-F175 HydrophobicContact CG2-CD1 3.87Å
146	M	93.5	Very high	94.2	Very high	2 Å²	2	28.5 Å²	28.5	1%	0.01	16%	0.163	C	C	.	.	H	α-helix	trans	-62.2	-49.2	175.8	-81.3	-71.5	139.1	0	0	112.9	A43 I46 L142 L143 G150 L179 T236 A237	A43-M146 HydrophobicContact CB-CE 3.59Å; I46-M146 HydrophobicContact CD1-CE 4.05Å; I46-M146 HydrophobicContact CD1-SD 3.73Å; L142-M146 VanDerWaalsContact O-CB 3.24Å; L142-M146 WeakPolarHBondContact O-CB 3.42Å; L142-M146 WeakPolarHBondContact O-CG 3.21Å; L142-M146 PolarHBondContact O-N 3.46Å; L143-M146 PolarHBondContact O-N 3.43Å; M146-G150 PolarHBondContact O-N 3.38Å; M146-L179 HydrophobicContact CE-CD1 3.14Å; M146-L179 HydrophobicContact CE-CD2 3.12Å; M146-L179 HydrophobicContact CE-CG 3.66Å; M146-T236 HydrophobicContact CE-CG2 4.24Å; M146-T236 HydrophobicContact CG-CG2 4.1Å; M146-T236 VanDerWaalsContact SD-CB 3.54Å; M146-T236 HydrophobicContact SD-CG2 3.61Å; M146-A237 HydrophobicContact CB-CB 4.16Å
147	I	94.4	Very high	94.1	Very high	78 Å²	78	23.1 Å²	23.1	40%	0.4	14%	0.14	S	C	.	.	H	α-helix	trans	-65.5	-47.2	179.1	-66.2	167.2	0	0	0	109.6	L143 Q149 G150 V151 A237	L143-I147 WeakPolarHBondContact O-CB 3.35Å; L143-I147 VanDerWaalsContact O-CG1 3.27Å; L143-I147 WeakPolarHBondContact O-CG1 3.21Å; L143-I147 PolarHBondContact O-N 2.95Å; I147-Q149 VanDerWaalsContact C-N 3.33Å; I147-Q149 PolarHBondContact O-N 3.33Å; I147-G150 PolarHBondContact O-N 3.31Å; I147-V151 HydrophobicContact CG2-CG2 4.28Å; I147-V151 WeakPolarHBondContact O-CG2 3.28Å; I147-V151 PolarHBondContact O-N 2.94Å; I147-A237 HydrophobicContact CG1-CB 3.85Å
148	G	93.9	Very high	94	Very high	15 Å²	15	29.4 Å²	29.4	16%	0.155	17%	0.167	C	C	.	.	H	α-helix	trans	-56.9	-46.9	178.2	0	0	0	0	0	111.9	S144 V151 L152	S144-G148 PolarHBondContact O-N 3.24Å; G148-V151 PolarHBondContact O-N 3.15Å; G148-L152 VanDerWaalsContact O-CB 3.31Å; G148-L152 WeakPolarHBondContact O-CB 3.33Å; G148-L152 WeakPolarHBondContact O-CD1 3.47Å; G148-L152 VanDerWaalsContact O-CG 3.24Å; G148-L152 WeakPolarHBondContact O-CG 3.49Å; G148-L152 PolarHBondContact O-N 2.98Å
149	Q	92.5	Very high	93.8	Very high	4 Å²	4	29.5 Å²	29.5	2%	0.019	17%	0.168	C	C	.	.	H	α-helix	trans	-66.3	-40.2	178.3	-171	169.3	14.8	0	0	112.8	I46 N50 T145 I147 G153 F175	I46-Q149 HydrophobicContact CG2-CG 3.86Å; N50-Q149 PolarHBondContact ND2-NE2 3.27Å; T145-Q149 WeakPolarHBondContact O-CB 3.37Å; T145-Q149 PolarHBondContact O-N 2.92Å; I147-Q149 VanDerWaalsContact C-N 3.33Å; I147-Q149 PolarHBondContact O-N 3.33Å; Q149-G153 PolarHBondContact O-N 3.2Å; Q149-F175 HydrophobicContact CB-CB 4.32Å
150	G	93.5	Very high	93.4	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-60.9	-48.8	174.4	0	0	0	0	0	112.1	M146 I147 I154	M146-G150 PolarHBondContact O-N 3.38Å; I147-G150 PolarHBondContact O-N 3.31Å; G150-I154 WeakPolarHBondContact O-CG1 3.35Å; G150-I154 PolarHBondContact O-N 3.26Å
151	V	95.4	Very high	93.2	Very high	76 Å²	76	33.2 Å²	33.2	46%	0.461	19%	0.189	S	C	.	.	H	α-helix	trans	-62.7	-49.6	179	172.1	0	0	0	0	111.1	I147 G148 G153 I154 A155 F234	I147-V151 HydrophobicContact CG2-CG2 4.28Å; I147-V151 WeakPolarHBondContact O-CG2 3.28Å; I147-V151 PolarHBondContact O-N 2.94Å; G148-V151 PolarHBondContact O-N 3.15Å; V151-G153 PolarHBondContact O-N 2.71Å; V151-I154 PolarHBondContact O-N 3.38Å; V151-A155 VanDerWaalsContact O-CB 3.32Å; V151-A155 WeakPolarHBondContact O-CB 3.33Å; V151-A155 PolarHBondContact O-N 2.96Å; V151-F234 HydrophobicContact CG2-CE1 4.1Å; V151-F234 HydrophobicContact CG2-CZ 3.81Å
152	L	94.8	Very high	92.8	Very high	30 Å²	30	36.8 Å²	36.8	16%	0.157	20%	0.202	C	C	.	.	H	α-helix	trans	-68.4	-34.7	-178.2	-70.6	163.2	0	0	0	112.7	G148 A155 T156 F171 A172 F175	G148-L152 VanDerWaalsContact O-CB 3.31Å; G148-L152 WeakPolarHBondContact O-CB 3.33Å; G148-L152 WeakPolarHBondContact O-CD1 3.47Å; G148-L152 VanDerWaalsContact O-CG 3.24Å; G148-L152 WeakPolarHBondContact O-CG 3.49Å; G148-L152 PolarHBondContact O-N 2.98Å; L152-A155 PolarHBondContact O-N 2.84Å; L152-T156 WeakPolarHBondContact O-CB 3.19Å; L152-T156 PolarHBondContact O-N 3.38Å; L152-T156 PolarHBondContact O-OG1 3.38Å; L152-F171 HydrophobicContact CD1-CB 3.32Å; L152-F171 HydrophobicContact CD1-CG 4.5Å; L152-F171 HydrophobicContact CD2-CB 4.06Å; L152-F171 HydrophobicContact CG-CB 4.32Å; L152-A172 HydrophobicContact CB-CB 4.43Å; L152-F175 HydrophobicContact CD1-CD2 3.63Å; L152-F175 HydrophobicContact CD1-CE2 3.55Å
153	G	92.4	Very high	92.7	Very high	2 Å²	2	40.9 Å²	40.9	2%	0.021	22%	0.222	C	C	.	.	H	α-helix	trans	-68.8	-36.5	176.1	0	0	0	0	0	113	Q149 V151 S226 S230	Q149-G153 PolarHBondContact O-N 3.2Å; V151-G153 PolarHBondContact O-N 2.71Å; G153-S226 PolarHBondContact O-OG 3.07Å; G153-S230 VanDerWaalsContact C-OG 3.26Å; G153-S230 WeakPolarHBondContact CA-OG 3.32Å
154	I	93.9	Very high	92.6	Very high	47 Å²	47	42.9 Å²	42.9	24%	0.241	24%	0.235	C	C	.	.	H	α-helix	trans	-69.3	-47	169.7	-67.2	177.6	0	0	0	110.4	G150 V151 T156 A157 F158 F234	G150-I154 WeakPolarHBondContact O-CG1 3.35Å; G150-I154 PolarHBondContact O-N 3.26Å; V151-I154 PolarHBondContact O-N 3.38Å; I154-T156 PolarHBondContact O-N 3.41Å; I154-A157 VanDerWaalsContact O-CB 3.26Å; I154-A157 WeakPolarHBondContact O-CB 3.26Å; I154-A157 PolarHBondContact O-N 3.5Å; I154-F158 HydrophobicContact CG2-CD2 4.19Å; I154-F158 HydrophobicContact CG2-CE2 3.74Å; I154-F158 VanDerWaalsContact O-CD2 3.3Å; I154-F158 WeakPolarHBondContact O-CD2 3.33Å; I154-F234 HydrophobicContact CD1-CD2 4.4Å; I154-F234 HydrophobicContact CD1-CE2 3.56Å; I154-F234 HydrophobicContact CD1-CZ 4.32Å
155	A	94.9	Very high	92.5	Very high	39 Å²	39	40.4 Å²	40.4	32%	0.322	22%	0.218	S	C	.	.	H	α-helix	trans	-56.7	-36.3	178.6	0	0	0	0	0	112.3	V151 L152 A157 F158 A159	V151-A155 VanDerWaalsContact O-CB 3.32Å; V151-A155 WeakPolarHBondContact O-CB 3.33Å; V151-A155 PolarHBondContact O-N 2.96Å; L152-A155 PolarHBondContact O-N 2.84Å; A155-A157 PolarHBondContact O-N 3.24Å; A155-F158 PolarHBondContact O-N 3.22Å; A155-A159 PolarHBondContact O-N 3.44Å
156	T	92.3	Very high	92.5	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-56.4	-37.3	174.4	-60.2	0	0	0	0	112.4	L152 I154 F158 A159 F165 C168	L152-T156 WeakPolarHBondContact O-CB 3.19Å; L152-T156 PolarHBondContact O-N 3.38Å; L152-T156 PolarHBondContact O-OG1 3.38Å; I154-T156 PolarHBondContact O-N 3.41Å; T156-F158 PolarHBondContact O-N 2.91Å; T156-A159 WeakPolarHBondContact O-CB 3.27Å; T156-A159 PolarHBondContact O-N 2.99Å; T156-F165 HydrophobicContact CG2-CD2 3.39Å; T156-F165 HydrophobicContact CG2-CE2 3.29Å; T156-F165 HydrophobicContact CG2-CG 4.38Å; T156-F165 HydrophobicContact CG2-CZ 4.22Å; T156-C168 VanDerWaalsContact OG1-CB 3.27Å; T156-C168 WeakPolarHBondContact OG1-CB 3.12Å
157	A	90.9	Very high	92.6	Very high	2 Å²	2	44.3 Å²	44.3	2%	0.017	24%	0.243	C	C	.	.	H	α-helix	trans	-67.7	-20	179.5	0	0	0	0	0	113.4	I154 A155 R223 I227	I154-A157 VanDerWaalsContact O-CB 3.26Å; I154-A157 WeakPolarHBondContact O-CB 3.26Å; I154-A157 PolarHBondContact O-N 3.5Å; A155-A157 PolarHBondContact O-N 3.24Å; A157-R223 WeakPolarHBondContact O-CD 3.42Å; A157-R223 PolarHBondContact O-NH1 2.84Å; A157-I227 HydrophobicContact CB-CD1 3.92Å; A157-I227 HydrophobicContact CB-CG1 3.48Å; A157-I227 VanDerWaalsContact CB-CG1 3.48Å
158	F	91.8	Very high	92.6	Very high	133 Å²	133	41.2 Å²	41.2	58%	0.583	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.1	5	179.2	-63.7	-76.4	0	0	0	113.2	I154 A155 T156 N160 I227	I154-F158 HydrophobicContact CG2-CD2 4.19Å; I154-F158 HydrophobicContact CG2-CE2 3.74Å; I154-F158 VanDerWaalsContact O-CD2 3.3Å; I154-F158 WeakPolarHBondContact O-CD2 3.33Å; A155-F158 PolarHBondContact O-N 3.22Å; T156-F158 PolarHBondContact O-N 2.91Å; F158-N160 PolarHBondContact O-N 3Å; F158-I227 HydrophobicContact CE2-CD1 4.32Å; F158-I227 HydrophobicContact CZ-CD1 4.19Å
159	A	91	Very high	92.5	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.008	22%	0.221	C	C	.	.			trans	-61.8	125.8	177	0	0	0	0	0	110.7	W101 A155 T156 V164 F165 R223	W101-A159 HydrophobicContact CZ2-CB 4.3Å; W101-A159 WeakPolarHBondContact CZ2-O 3.47Å; A155-A159 PolarHBondContact O-N 3.44Å; T156-A159 WeakPolarHBondContact O-CB 3.27Å; T156-A159 PolarHBondContact O-N 2.99Å; A159-V164 HydrophobicContact CB-CB 4.4Å; A159-V164 HydrophobicContact CB-CG1 4.16Å; A159-F165 HydrophobicContact CB-CB 3.74Å; A159-F165 HydrophobicContact CB-CD2 4.32Å; A159-R223 PolarHBondContact O-NH2 3.23Å
160	N	87	Confident	92.6	Very high	137 Å²	137	43.4 Å²	43.4	73%	0.733	23%	0.233	S	C	*	.	S	Bend	trans	-101.5	-10.7	176.7	-69.1	-26.2	0	0	0	112.6	W101 F158	W101-N160 PolarHBondContact NE1-O 3.49Å; F158-N160 PolarHBondContact O-N 3Å
161	S	90.4	Very high	92.7	Very high	37 Å²	37	47.6 Å²	47.6	26%	0.259	25%	0.251	S	S	.	.	S	Bend	trans	-131.7	153.5	171.9	73.8	0	0	0	0	110.5	Q163 V164 F165	S161-Q163 VanDerWaalsContact CB-OE1 3.29Å; S161-Q163 PolarHBondContact O-N 3.03Å; S161-Q163 PolarHBondContact OG-OE1 3.05Å; S161-V164 PolarHBondContact O-N 3.12Å; S161-V164 WeakPolarHBondContact OG-CG2 3.37Å; S161-V164 PolarHBondContact OG-N 2.83Å; S161-F165 PolarHBondContact O-N 3.43Å; S161-F165 VanDerWaalsContact O-N 3.15Å
162	W	88	Confident	92.5	Very high	79 Å²	79	44 Å²	44	30%	0.299	23%	0.23	S	C	.	.	H	α-helix	trans	-66.1	-26.9	179.4	68.7	-98.4	0	0	0	112.2	W101 L103 I110 I114 F165 A166	W101-W162 HydrophobicContact CB-CB 4.4Å; W101-W162 HydrophobicContact CD2-CB 4.09Å; W101-W162 HydrophobicContact CE3-CB 3.79Å; W101-W162 HydrophobicContact CG-CB 4.38Å; W101-W162 HydrophobicContact CZ3-CB 4.43Å; L103-W162 HydrophobicContact CD1-CB 3.72Å; L103-W162 HydrophobicContact CD1-CG 4.16Å; L103-W162 HydrophobicContact CD2-CG 4.26Å; L103-W162 HydrophobicContact CG-CB 4.49Å; I110-W162 HydrophobicContact CD1-CZ2 4.48Å; I110-W162 HydrophobicContact CG2-CD2 3.92Å; I110-W162 HydrophobicContact CG2-CE3 3.64Å; I110-W162 HydrophobicContact CG2-CH2 4.35Å; I110-W162 HydrophobicContact CG2-CZ3 3.88Å; I114-W162 HydrophobicContact CD1-CE3 4.43Å; W162-F165 WeakPolarHBondContact O-CB 3.39Å; W162-F165 PolarHBondContact O-N 3.49Å; W162-A166 VanDerWaalsContact O-CB 3.29Å; W162-A166 WeakPolarHBondContact O-CB 3.32Å; W162-A166 PolarHBondContact O-N 2.77Å
163	Q	93.1	Very high	92.3	Very high	91 Å²	91	42.6 Å²	42.6	43%	0.425	22%	0.223	S	C	.	.	H	α-helix	trans	-66.8	-46.8	176.8	-60.2	89.3	-23.6	0	0	111.1	S161 F165 A166 T167	S161-Q163 VanDerWaalsContact CB-OE1 3.29Å; S161-Q163 PolarHBondContact O-N 3.03Å; S161-Q163 PolarHBondContact OG-OE1 3.05Å; Q163-F165 VanDerWaalsContact C-N 3.28Å; Q163-F165 PolarHBondContact O-N 3.19Å; Q163-A166 PolarHBondContact O-N 2.93Å; Q163-T167 PolarHBondContact O-N 2.81Å; Q163-T167 PolarHBondContact O-OG1 3.3Å
164	V	93.7	Very high	92.3	Very high	73 Å²	73	43.8 Å²	43.8	44%	0.442	23%	0.228	S	C	.	.	H	α-helix	trans	-62.8	-41.1	176.6	174	0	0	0	0	110.1	A159 S161 T167 C168	A159-V164 HydrophobicContact CB-CB 4.4Å; A159-V164 HydrophobicContact CB-CG1 4.16Å; S161-V164 PolarHBondContact O-N 3.12Å; S161-V164 WeakPolarHBondContact OG-CG2 3.37Å; S161-V164 PolarHBondContact OG-N 2.83Å; V164-T167 PolarHBondContact O-N 3.02Å; V164-C168 PolarHBondContact O-N 3.3Å; V164-C168 PolarHBondContact O-SG 3.32Å
165	F	92.3	Very high	92.3	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-59.1	-48.4	173.8	-179.3	-89.7	0	0	0	111.6	F53 M54 M57 W101 I114 T156 A159 S161 W162 Q163 T167 C168 R169 W222	F53-F165 HydrophobicContact CE1-CE2 4.22Å; F53-F165 AromaticContact CE1-CZ 3.97Å; F53-F165 HydrophobicContact CE1-CZ 3.97Å; M54-F165 HydrophobicContact CE-CE1 4.37Å; M54-F165 HydrophobicContact SD-CE1 3.81Å; M54-F165 HydrophobicContact SD-CZ 3.98Å; M57-F165 HydrophobicContact CE-CE2 4.44Å; M57-F165 HydrophobicContact CE-CZ 4.3Å; W101-F165 HydrophobicContact CH2-CB 3.74Å; W101-F165 HydrophobicContact CH2-CD1 4.46Å; W101-F165 AromaticContact CH2-CD2 3.58Å; W101-F165 HydrophobicContact CH2-CD2 3.58Å; W101-F165 HydrophobicContact CH2-CE2 4.26Å; W101-F165 AromaticContact CH2-CG 3.69Å; W101-F165 HydrophobicContact CH2-CG 3.69Å; W101-F165 HydrophobicContact CZ2-CB 4.42Å; W101-F165 HydrophobicContact CZ3-CB 4.11Å; W101-F165 HydrophobicContact CZ3-CD1 4.28Å; W101-F165 HydrophobicContact CZ3-CD2 4.15Å; W101-F165 AromaticContact CZ3-CG 3.94Å; W101-F165 HydrophobicContact CZ3-CG 3.94Å; I114-F165 HydrophobicContact CD1-CD1 4.18Å; I114-F165 HydrophobicContact CG2-CD1 4.04Å; I114-F165 HydrophobicContact CG2-CE1 3.92Å; T156-F165 HydrophobicContact CG2-CD2 3.39Å; T156-F165 HydrophobicContact CG2-CE2 3.29Å; T156-F165 HydrophobicContact CG2-CG 4.38Å; T156-F165 HydrophobicContact CG2-CZ 4.22Å; A159-F165 HydrophobicContact CB-CB 3.74Å; A159-F165 HydrophobicContact CB-CD2 4.32Å; S161-F165 PolarHBondContact O-N 3.43Å; S161-F165 VanDerWaalsContact O-N 3.15Å; W162-F165 WeakPolarHBondContact O-CB 3.39Å; W162-F165 PolarHBondContact O-N 3.49Å; Q163-F165 VanDerWaalsContact C-N 3.28Å; Q163-F165 PolarHBondContact O-N 3.19Å; F165-T167 PolarHBondContact O-N 3.42Å; F165-C168 PolarHBondContact O-N 3.43Å; F165-R169 HydrophobicContact CD1-CG 3.97Å; F165-R169 HydrophobicContact CE1-CG 3.72Å; F165-R169 HydrophobicContact CZ-CG 4.08Å; F165-R169 WeakPolarHBondContact O-CB 3.19Å; F165-R169 WeakPolarHBondContact O-CG 3.24Å; F165-R169 PolarHBondContact O-N 3.24Å; F165-W222 HydrophobicContact CD2-CZ3 4.42Å; F165-W222 HydrophobicContact CE2-CZ3 4.09Å
166	A	92.2	Very high	91.9	Very high	9 Å²	9	41.8 Å²	41.8	7%	0.074	21%	0.211	C	C	.	.	H	α-helix	trans	-61.3	-42.6	178.8	0	0	0	0	0	112.2	I114 W162 Q163 R169 F170	I114-A166 HydrophobicContact CD1-CB 4.41Å; I114-A166 HydrophobicContact CG1-CB 3.89Å; I114-A166 HydrophobicContact CG2-CB 4.31Å; W162-A166 VanDerWaalsContact O-CB 3.29Å; W162-A166 WeakPolarHBondContact O-CB 3.32Å; W162-A166 PolarHBondContact O-N 2.77Å; Q163-A166 PolarHBondContact O-N 2.93Å; A166-R169 PolarHBondContact O-N 3.14Å; A166-F170 WeakPolarHBondContact O-CB 3.29Å; A166-F170 PolarHBondContact O-N 3.13Å
167	T	95.6	Very high	91.1	Very high	77 Å²	77	42 Å²	42	47%	0.472	21%	0.212	S	C	.	.	H	α-helix	trans	-63.2	-45.1	175.7	-56.1	0	0	0	0	111.5	Q163 V164 F165 R169 F170 F171	Q163-T167 PolarHBondContact O-N 2.81Å; Q163-T167 PolarHBondContact O-OG1 3.3Å; V164-T167 PolarHBondContact O-N 3.02Å; F165-T167 PolarHBondContact O-N 3.42Å; T167-R169 VanDerWaalsContact C-N 3.29Å; T167-R169 PolarHBondContact O-N 3.33Å; T167-F170 WeakPolarHBondContact O-CB 3.26Å; T167-F170 PolarHBondContact O-N 3.49Å; T167-F171 HydrophobicContact CG2-CD2 3.94Å; T167-F171 HydrophobicContact CG2-CE2 3.71Å; T167-F171 VanDerWaalsContact O-CD2 3.26Å; T167-F171 WeakPolarHBondContact O-CD2 3.18Å; T167-F171 PolarHBondContact O-N 3.08Å; T167-F171 VanDerWaalsContact O-N 3.15Å
168	C	95.3	Very high	90.6	Very high	13 Å²	13	41.9 Å²	41.9	9%	0.088	21%	0.212	C	C	.	.	H	α-helix	trans	-61	-41.8	175.9	-66.1	0	0	0	0	111.2	T156 V164 F165 F171 A172	T156-C168 VanDerWaalsContact OG1-CB 3.27Å; T156-C168 WeakPolarHBondContact OG1-CB 3.12Å; V164-C168 PolarHBondContact O-N 3.3Å; V164-C168 PolarHBondContact O-SG 3.32Å; F165-C168 PolarHBondContact O-N 3.43Å; C168-F171 PolarHBondContact O-N 3.38Å; C168-A172 VanDerWaalsContact O-CB 3.24Å; C168-A172 WeakPolarHBondContact O-CB 3.46Å; C168-A172 PolarHBondContact O-N 2.92Å
169	R	92.3	Very high	90.5	Very high	1 Å²	1	35.6 Å²	35.6	0%	0.004	18%	0.184	C	C	.	.	H	α-helix	trans	-65.3	-39.7	177.5	-72.6	-77.6	151.8	-171.7	-8.1	112.8	I114 F165 A166 T167 A172 G173	I114-R169 HydrophobicContact CG2-CB 4.25Å; I114-R169 HydrophobicContact CG2-CG 4.31Å; F165-R169 HydrophobicContact CD1-CG 3.97Å; F165-R169 HydrophobicContact CE1-CG 3.72Å; F165-R169 HydrophobicContact CZ-CG 4.08Å; F165-R169 WeakPolarHBondContact O-CB 3.19Å; F165-R169 WeakPolarHBondContact O-CG 3.24Å; F165-R169 PolarHBondContact O-N 3.24Å; A166-R169 PolarHBondContact O-N 3.14Å; T167-R169 VanDerWaalsContact C-N 3.29Å; T167-R169 PolarHBondContact O-N 3.33Å; R169-A172 PolarHBondContact O-N 3.44Å; R169-G173 PolarHBondContact O-N 3.37Å
170	F	93.9	Very high	90.4	Very high	63 Å²	63	36.9 Å²	36.9	28%	0.276	19%	0.19	S	C	.	.	H	α-helix	trans	-56.8	-56.3	173.3	178	-93.2	0	0	0	110.4	I117 A121 L124 A166 T167 A172 G173 L174	I117-F170 HydrophobicContact CG2-CB 3.9Å; I117-F170 HydrophobicContact CG2-CD2 3.71Å; I117-F170 HydrophobicContact CG2-CG 4.28Å; A121-F170 HydrophobicContact CB-CB 4.46Å; A121-F170 HydrophobicContact CB-CD1 4.49Å; A121-F170 HydrophobicContact CB-CD2 3.47Å; A121-F170 VanDerWaalsContact CB-CD2 3.47Å; A121-F170 HydrophobicContact CB-CE2 3.69Å; A121-F170 HydrophobicContact CB-CG 3.91Å; A121-F170 HydrophobicContact CB-CZ 4.29Å; A121-F170 WeakPolarHBondContact CB-O 3.31Å; L124-F170 HydrophobicContact CD2-CZ 4.46Å; A166-F170 WeakPolarHBondContact O-CB 3.29Å; A166-F170 PolarHBondContact O-N 3.13Å; T167-F170 WeakPolarHBondContact O-CB 3.26Å; T167-F170 PolarHBondContact O-N 3.49Å; F170-A172 PolarHBondContact O-N 3.29Å; F170-G173 PolarHBondContact O-N 3.47Å; F170-L174 PolarHBondContact O-N 2.84Å
171	F	94.8	Very high	90.4	Very high	89 Å²	89	30.4 Å²	30.4	39%	0.39	16%	0.155	S	C	.	.	H	α-helix	trans	-68.8	-32.4	-178.9	-69.3	-71.5	0	0	0	113.1	L152 T167 C168 G173 L174 F175	L152-F171 HydrophobicContact CD1-CB 3.32Å; L152-F171 HydrophobicContact CD1-CG 4.5Å; L152-F171 HydrophobicContact CD2-CB 4.06Å; L152-F171 HydrophobicContact CG-CB 4.32Å; T167-F171 HydrophobicContact CG2-CD2 3.94Å; T167-F171 HydrophobicContact CG2-CE2 3.71Å; T167-F171 VanDerWaalsContact O-CD2 3.26Å; T167-F171 WeakPolarHBondContact O-CD2 3.18Å; T167-F171 PolarHBondContact O-N 3.08Å; T167-F171 VanDerWaalsContact O-N 3.15Å; C168-F171 PolarHBondContact O-N 3.38Å; F171-G173 VanDerWaalsContact C-N 3.33Å; F171-L174 HydrophobicContact CD1-CD2 4.21Å; F171-L174 WeakPolarHBondContact O-CB 3.26Å; F171-L174 PolarHBondContact O-N 3.34Å; F171-F175 WeakPolarHBondContact O-CD2 3.46Å; F171-F175 PolarHBondContact O-N 3.29Å
172	A	92.8	Very high	90.6	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.008	14%	0.143	C	C	.	.	H	α-helix	trans	-63.1	-40.2	172.4	0	0	0	0	0	111.6	L152 C168 R169 F170 F175 G176	L152-A172 HydrophobicContact CB-CB 4.43Å; C168-A172 VanDerWaalsContact O-CB 3.24Å; C168-A172 WeakPolarHBondContact O-CB 3.46Å; C168-A172 PolarHBondContact O-N 2.92Å; R169-A172 PolarHBondContact O-N 3.44Å; F170-A172 PolarHBondContact O-N 3.29Å; A172-F175 PolarHBondContact O-N 3.2Å; A172-G176 PolarHBondContact O-N 3.33Å
173	G	90.8	Very high	90.9	Very high	1 Å²	1	25 Å²	25	1%	0.01	13%	0.129	C	C	.	.	H	α-helix	trans	-61.6	-46.4	171.4	0	0	0	0	0	112.1	L122 R169 F170 F171 F175 G176 A177	L122-G173 WeakPolarHBondContact CA-O 3.46Å; L122-G173 WeakPolarHBondContact CD1-O 3.29Å; R169-G173 PolarHBondContact O-N 3.37Å; F170-G173 PolarHBondContact O-N 3.47Å; F171-G173 VanDerWaalsContact C-N 3.33Å; G173-F175 VanDerWaalsContact C-N 3.31Å; G173-F175 PolarHBondContact O-N 2.98Å; G173-G176 PolarHBondContact O-N 3.13Å; G173-A177 PolarHBondContact O-N 2.97Å
174	L	92.2	Very high	90.9	Very high	26 Å²	26	20.9 Å²	20.9	14%	0.136	11%	0.112	C	C	.	.	H	α-helix	trans	-55.9	-43.1	177.7	-169.6	76.1	0	0	0	112.4	A121 L124 G125 F170 F171	A121-L174 HydrophobicContact CB-CB 4.44Å; A121-L174 WeakPolarHBondContact O-CA 3.16Å; L124-L174 HydrophobicContact CB-CD1 3.84Å; L124-L174 HydrophobicContact CD2-CD1 3.9Å; L124-L174 HydrophobicContact CG-CD1 3.75Å; G125-L174 WeakPolarHBondContact CA-O 3.5Å; F170-L174 PolarHBondContact O-N 2.84Å; F171-L174 HydrophobicContact CD1-CD2 4.21Å; F171-L174 WeakPolarHBondContact O-CB 3.26Å; F171-L174 PolarHBondContact O-N 3.34Å
175	F	92.7	Very high	90.9	Very high	44 Å²	44	17.4 Å²	17.4	19%	0.193	9%	0.091	C	C	.	.	H	α-helix	trans	-76.4	-35.7	176.7	-68	-53.7	0	0	0	113.3	I129 T145 Q149 L152 F171 A172 G173 L179	I129-F175 HydrophobicContact CD1-CD1 4.34Å; T145-F175 HydrophobicContact CG2-CD1 3.87Å; Q149-F175 HydrophobicContact CB-CB 4.32Å; L152-F175 HydrophobicContact CD1-CD2 3.63Å; L152-F175 HydrophobicContact CD1-CE2 3.55Å; F171-F175 WeakPolarHBondContact O-CD2 3.46Å; F171-F175 PolarHBondContact O-N 3.29Å; A172-F175 PolarHBondContact O-N 3.2Å; G173-F175 VanDerWaalsContact C-N 3.31Å; G173-F175 PolarHBondContact O-N 2.98Å; F175-L179 WeakPolarHBondContact O-CB 3.45Å; F175-L179 PolarHBondContact O-N 3.02Å; F175-L179 VanDerWaalsContact O-N 3.08Å
176	G	86	Confident	91	Very high	1 Å²	1	17.4 Å²	17.4	1%	0.01	9%	0.091	C	C	.	.	H	α-helix	trans	-63.6	-46.2	-171.5	0	0	0	0	0	114.4	F47 A172 G173 L179	F47-G176 WeakPolarHBondContact CD2-O 3.49Å; A172-G176 PolarHBondContact O-N 3.33Å; G173-G176 PolarHBondContact O-N 3.13Å; G176-L179 WeakPolarHBondContact O-CB 3.48Å
177	A	76.9	Confident	91.1	Very high	4 Å²	4	17 Å²	17	3%	0.033	9%	0.088	C	C	.	.	H	α-helix	trans	-71.7	-45.3	-177.4	0	0	0	0	0	112.7	L122 T126 G173 L179 M180 S181	L122-A177 HydrophobicContact CB-CB 4.22Å; L122-A177 HydrophobicContact CD1-CB 3.46Å; L122-A177 VanDerWaalsContact CD1-CB 3.46Å; L122-A177 HydrophobicContact CG-CB 3.41Å; L122-A177 VanDerWaalsContact CG-CB 3.41Å; L122-A177 WeakPolarHBondContact O-CB 3.43Å; T126-A177 HydrophobicContact CG2-CB 3.26Å; G173-A177 PolarHBondContact O-N 2.97Å; A177-L179 PolarHBondContact O-N 3.06Å; A177-M180 PolarHBondContact O-N 3.49Å; A177-M180 VanDerWaalsContact O-N 3.14Å; A177-S181 PolarHBondContact O-N 3.49Å
178	G	79.5	Confident	91	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-57.3	-37.5	177.6	0	0	0	0	0	112.1	M180 S181 V182	G178-M180 VanDerWaalsContact C-N 3.34Å; G178-M180 PolarHBondContact O-N 3.27Å; G178-S181 PolarHBondContact O-N 3.01Å; G178-V182 VanDerWaalsContact O-CG2 3.29Å; G178-V182 WeakPolarHBondContact O-CG2 3.35Å; G178-V182 PolarHBondContact O-N 3.19Å; G178-V182 VanDerWaalsContact O-N 3.14Å
179	L	89.8	Confident	90.9	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-52.8	-48.8	174.7	167.8	65.5	0	0	0	112.4	A43 L142 M146 F175 G176 A177 S181 V182 V183	A43-L179 HydrophobicContact CB-CD1 4.11Å; A43-L179 HydrophobicContact CB-CD2 4.13Å; A43-L179 HydrophobicContact CB-CG 4.27Å; L142-L179 HydrophobicContact CD2-CD1 3.53Å; M146-L179 HydrophobicContact CE-CD1 3.14Å; M146-L179 HydrophobicContact CE-CD2 3.12Å; M146-L179 HydrophobicContact CE-CG 3.66Å; F175-L179 WeakPolarHBondContact O-CB 3.45Å; F175-L179 PolarHBondContact O-N 3.02Å; F175-L179 VanDerWaalsContact O-N 3.08Å; G176-L179 WeakPolarHBondContact O-CB 3.48Å; A177-L179 PolarHBondContact O-N 3.06Å; L179-S181 PolarHBondContact O-N 3.39Å; L179-V182 PolarHBondContact O-N 3.08Å; L179-V183 HydrophobicContact CD1-CB 4.4Å; L179-V183 WeakPolarHBondContact O-CB 3.11Å; L179-V183 VanDerWaalsContact O-CG1 3.29Å; L179-V183 WeakPolarHBondContact O-CG1 3.41Å; L179-V183 PolarHBondContact O-N 3.31Å
180	M	88.3	Confident	90.9	Very high	29 Å²	29	12.7 Å²	12.7	14%	0.143	6%	0.061	C	C	.	.	H	α-helix	trans	-65.3	-40.5	-176.7	-70.7	-53.2	-59	0	0	112.5	Y40 F47 A177 G178 V182 V183 G184 V205	Y40-M180 HydrophobicContact CE2-CE 4.2Å; F47-M180 HydrophobicContact CB-CG 3.77Å; F47-M180 HydrophobicContact CB-SD 3.76Å; F47-M180 HydrophobicContact CD1-CG 3.43Å; F47-M180 VanDerWaalsContact CD1-CG 3.43Å; F47-M180 HydrophobicContact CD1-SD 4.04Å; F47-M180 HydrophobicContact CD2-CG 3.71Å; F47-M180 HydrophobicContact CE1-CG 3.83Å; F47-M180 HydrophobicContact CE2-CG 4.08Å; F47-M180 HydrophobicContact CG-CG 3.34Å; F47-M180 HydrophobicContact CG-SD 3.96Å; F47-M180 HydrophobicContact CZ-CG 4.14Å; A177-M180 PolarHBondContact O-N 3.49Å; A177-M180 VanDerWaalsContact O-N 3.14Å; G178-M180 VanDerWaalsContact C-N 3.34Å; G178-M180 PolarHBondContact O-N 3.27Å; M180-V182 VanDerWaalsContact C-N 3.26Å; M180-V182 PolarHBondContact O-N 3.39Å; M180-V183 HydrophobicContact CE-CG1 4.36Å; M180-V183 HydrophobicContact SD-CG1 4.14Å; M180-G184 PolarHBondContact O-N 2.81Å; M180-G184 VanDerWaalsContact O-N 3.13Å; M180-V205 HydrophobicContact CE-CG2 3.77Å; M180-V205 HydrophobicContact SD-CG2 4.44Å
181	S	88.9	Confident	90.8	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-65	-29.7	177.2	-52.9	0	0	0	0	112.9	A177 G178 L179 V185 G430	A177-S181 PolarHBondContact O-N 3.49Å; G178-S181 PolarHBondContact O-N 3.01Å; L179-S181 PolarHBondContact O-N 3.39Å; S181-V185 VanDerWaalsContact O-CG2 3.29Å; S181-V185 WeakPolarHBondContact O-CG2 3.22Å; S181-G430 WeakPolarHBondContact OG-CA 3.28Å; S181-G430 PolarHBondContact OG-N 3.4Å
182	V	93.9	Very high	90.4	Very high	1 Å²	1	6.3 Å²	6.3	1%	0.006	4%	0.035	C	C	.	.	H	α-helix	trans	-88.9	-41.9	179.5	-174.6	0	0	0	0	111.8	I129 A133 R138 V141 L142 G178 L179 M180 V185 Y186	I129-V182 HydrophobicContact CG2-CG2 3.95Å; A133-V182 HydrophobicContact CB-CB 4.14Å; A133-V182 HydrophobicContact CB-CG1 3.57Å; A133-V182 HydrophobicContact CB-CG2 3.35Å; R138-V182 HydrophobicContact CB-CG1 4.21Å; V141-V182 HydrophobicContact CG1-CG2 4.42Å; L142-V182 HydrophobicContact CD1-CG1 4.04Å; L142-V182 HydrophobicContact CD2-CB 3.85Å; L142-V182 HydrophobicContact CD2-CG1 3.84Å; L142-V182 HydrophobicContact CG-CB 4.17Å; L142-V182 HydrophobicContact CG-CG1 3.57Å; G178-V182 VanDerWaalsContact O-CG2 3.29Å; G178-V182 WeakPolarHBondContact O-CG2 3.35Å; G178-V182 PolarHBondContact O-N 3.19Å; G178-V182 VanDerWaalsContact O-N 3.14Å; L179-V182 PolarHBondContact O-N 3.08Å; M180-V182 VanDerWaalsContact C-N 3.26Å; M180-V182 PolarHBondContact O-N 3.39Å; V182-V185 PolarHBondContact O-N 3.19Å; V182-Y186 WeakPolarHBondContact O-CB 3.3Å; V182-Y186 PolarHBondContact O-N 3.02Å
183	V	94.1	Very high	90.1	Very high	1 Å²	1	9 Å²	9	1%	0.006	5%	0.047	C	C	.	.	H	α-helix	trans	-69.4	-36.9	-176.5	75.1	0	0	0	0	111.3	Y40 A43 L142 L179 M180 V185 Y186 V187	Y40-V183 HydrophobicContact CD2-CG1 3.93Å; Y40-V183 HydrophobicContact CD2-CG2 4.13Å; Y40-V183 HydrophobicContact CE2-CG1 4.22Å; A43-V183 HydrophobicContact CB-CB 4.46Å; A43-V183 HydrophobicContact CB-CG1 4.27Å; A43-V183 HydrophobicContact CB-CG2 4.04Å; L142-V183 HydrophobicContact CD2-CB 3.8Å; L142-V183 HydrophobicContact CD2-CG2 4.39Å; L179-V183 HydrophobicContact CD1-CB 4.4Å; L179-V183 WeakPolarHBondContact O-CB 3.11Å; L179-V183 VanDerWaalsContact O-CG1 3.29Å; L179-V183 WeakPolarHBondContact O-CG1 3.41Å; L179-V183 PolarHBondContact O-N 3.31Å; M180-V183 HydrophobicContact CE-CG1 4.36Å; M180-V183 HydrophobicContact SD-CG1 4.14Å; V183-V185 VanDerWaalsContact C-N 3.33Å; V183-V185 PolarHBondContact O-N 2.81Å; V183-Y186 WeakPolarHBondContact O-CB 3.39Å; V183-Y186 PolarHBondContact O-N 3.39Å; V183-V187 WeakPolarHBondContact O-CG2 3.29Å; V183-V187 PolarHBondContact O-N 3.27Å
184	G	93.1	Very high	89.8	Confident	6 Å²	6	12.5 Å²	12.5	6%	0.062	7%	0.071	C	C	.	.	H	α-helix	trans	-58.5	-46.3	173.5	0	0	0	0	0	111.6	M180 V187 V188 M417	M180-G184 PolarHBondContact O-N 2.81Å; M180-G184 VanDerWaalsContact O-N 3.13Å; G184-V187 PolarHBondContact O-N 3.45Å; G184-V188 WeakPolarHBondContact O-CG2 3.38Å; G184-V188 PolarHBondContact O-N 3.32Å; G184-M417 VanDerWaalsContact O-SD 3.4Å
185	V	94	Very high	89.5	Confident	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-66.1	-41.5	178.6	177.3	0	0	0	0	111	R138 S181 V182 V183 V187 V188 E189 M417 R425	R138-V185 VanDerWaalsContact NE-CG1 3.34Å; S181-V185 VanDerWaalsContact O-CG2 3.29Å; S181-V185 WeakPolarHBondContact O-CG2 3.22Å; V182-V185 PolarHBondContact O-N 3.19Å; V183-V185 VanDerWaalsContact C-N 3.33Å; V183-V185 PolarHBondContact O-N 2.81Å; V185-V187 VanDerWaalsContact C-N 3.31Å; V185-V187 PolarHBondContact O-N 3.34Å; V185-V188 PolarHBondContact O-N 2.63Å; V185-E189 HydrophobicContact CG1-CG 4.24Å; V185-E189 WeakPolarHBondContact CG1-OE1 3.33Å; V185-E189 WeakPolarHBondContact O-CB 3.37Å; V185-E189 WeakPolarHBondContact O-CG 3.39Å; V185-E189 PolarHBondContact O-N 3.1Å; V185-M417 HydrophobicContact CB-SD 4.4Å; V185-M417 HydrophobicContact CG2-CG 3.88Å; V185-M417 HydrophobicContact CG2-SD 3.78Å; V185-M417 PolarHBondContact N-SD 3.4Å; V185-R425 HydrophobicContact CG1-CB 3.87Å; V185-R425 HydrophobicContact CG2-CB 3.84Å
186	Y	95.1	Very high	89.4	Confident	0 Å²	0	10.1 Å²	10.1	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-58.2	-41.7	175.8	-178.3	-95.3	0	0	0	112.2	Y32 V36 R138 L142 V182 V183 N190 L240 T243 R244 T246	Y32-Y186 PolarHBondContact OH-OH 2.66Å; V36-Y186 HydrophobicContact CG1-CD1 4.2Å; V36-Y186 HydrophobicContact CG1-CE1 4.08Å; V36-Y186 HydrophobicContact CG2-CE1 4.06Å; R138-Y186 HydrophobicContact CB-CD2 3.8Å; L142-Y186 HydrophobicContact CD1-CD1 4.37Å; L142-Y186 HydrophobicContact CD1-CD2 4.12Å; L142-Y186 HydrophobicContact CD1-CG 3.83Å; V182-Y186 WeakPolarHBondContact O-CB 3.3Å; V182-Y186 PolarHBondContact O-N 3.02Å; V183-Y186 WeakPolarHBondContact O-CB 3.39Å; V183-Y186 PolarHBondContact O-N 3.39Å; Y186-N190 PolarHBondContact O-N 3.1Å; Y186-N190 PolarHBondContact O-ND2 3.25Å; Y186-L240 HydrophobicContact CE1-CD1 4.33Å; Y186-T243 WeakPolarHBondContact OH-CB 3.48Å; Y186-T243 PolarHBondContact OH-OG1 2.86Å; Y186-R244 PolarHBondContact OH-O 3.43Å; Y186-T246 HydrophobicContact CD2-CG2 3.47Å; Y186-T246 VanDerWaalsContact CD2-CG2 3.47Å; Y186-T246 HydrophobicContact CE2-CG2 3.86Å; Y186-T246 HydrophobicContact CG-CG2 4.32Å
187	V	94.1	Very high	89.6	Confident	0 Å²	0	10.2 Å²	10.2	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-64.9	-51.6	174.6	173.9	0	0	0	0	110.9	V36 Y40 V183 G184 V185 E189 N190 V191 I199 I200	V36-V187 HydrophobicContact CG1-CB 4.34Å; V36-V187 HydrophobicContact CG1-CG2 3.9Å; Y40-V187 HydrophobicContact CD2-CG2 3.74Å; Y40-V187 HydrophobicContact CG-CG2 3.77Å; V183-V187 WeakPolarHBondContact O-CG2 3.29Å; V183-V187 PolarHBondContact O-N 3.27Å; G184-V187 PolarHBondContact O-N 3.45Å; V185-V187 VanDerWaalsContact C-N 3.31Å; V185-V187 PolarHBondContact O-N 3.34Å; V187-E189 PolarHBondContact O-N 3.33Å; V187-N190 PolarHBondContact O-N 3.23Å; V187-V191 HydrophobicContact CG1-CG2 3.92Å; V187-V191 VanDerWaalsContact O-CB 3.3Å; V187-V191 WeakPolarHBondContact O-CB 3.33Å; V187-V191 WeakPolarHBondContact O-CG2 3.08Å; V187-V191 PolarHBondContact O-N 3.49Å; V187-I199 HydrophobicContact CG1-CG2 3.74Å; V187-I200 HydrophobicContact CG1-CG1 4.37Å
188	V	92.5	Very high	90.3	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-58.5	-34.2	-176.8	165.9	0	0	0	0	112.3	G184 V185 R196 I200 L414 M417 L501	G184-V188 WeakPolarHBondContact O-CG2 3.38Å; G184-V188 PolarHBondContact O-N 3.32Å; V185-V188 PolarHBondContact O-N 2.63Å; V188-R196 PolarHBondContact O-NE 3.17Å; V188-R196 PolarHBondContact O-NH2 3.34Å; V188-I200 HydrophobicContact CG2-CD1 3.96Å; V188-L414 HydrophobicContact CG2-CD1 3.75Å; V188-M417 HydrophobicContact CB-CB 4.46Å; V188-M417 HydrophobicContact CB-SD 4.44Å; V188-M417 HydrophobicContact CG1-CB 4.19Å; V188-M417 HydrophobicContact CG2-CB 4.18Å; V188-M417 HydrophobicContact CG2-CE 3.69Å; V188-M417 HydrophobicContact CG2-SD 3.83Å; V188-L501 HydrophobicContact CG1-CD1 3.98Å; V188-L501 HydrophobicContact CG1-CD2 3.81Å
189	E	92.8	Very high	90.8	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-80.2	-20.5	179.1	-71.1	176.8	-174.1	0	0	114.3	L27 R138 V185 V187 T246 R248 T422 R425 L501	L27-E189 WeakPolarHBondContact CD1-O 3.37Å; R138-E189 IonicContact NE-OE1 2.8Å; R138-E189 IonicContact NE-OE2 2.87Å; R138-E189 IonicContact NH2-OE1 3.58Å; V185-E189 HydrophobicContact CG1-CG 4.24Å; V185-E189 WeakPolarHBondContact CG1-OE1 3.33Å; V185-E189 WeakPolarHBondContact O-CB 3.37Å; V185-E189 WeakPolarHBondContact O-CG 3.39Å; V185-E189 PolarHBondContact O-N 3.1Å; V187-E189 PolarHBondContact O-N 3.33Å; E189-T246 HydrophobicContact CB-CG2 3.98Å; E189-T246 VanDerWaalsContact OE2-CB 3.3Å; E189-T246 WeakPolarHBondContact OE2-CB 3.46Å; E189-T246 WeakPolarHBondContact OE2-CG2 3.24Å; E189-T246 PolarHBondContact OE2-OG1 3Å; E189-R248 HydrophobicContact CG-CB 4.48Å; E189-T422 WeakPolarHBondContact OE1-CG2 3.47Å; E189-R425 IonicContact OE1-CZ 3.93Å; E189-R425 IonicContact OE1-NH1 2.67Å; E189-R425 PolarHBondContact OE1-NH1 3.3Å; E189-L501 HydrophobicContact CG-CD1 4.49Å
190	N	92.5	Very high	90.9	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-101.7	-6.3	178.3	-77.5	-75	0	0	0	113.9	Y32 Q33 V36 Y186 V187 T246	Y32-N190 HydrophobicContact CE1-CB 4.26Å; Y32-N190 WeakPolarHBondContact CE1-OD1 3.47Å; Q33-N190 PolarHBondContact NE2-O 2.86Å; Q33-N190 VanDerWaalsContact NE2-O 3.12Å; V36-N190 HydrophobicContact CG1-CB 4.31Å; V36-N190 HydrophobicContact CG2-CB 4.27Å; Y186-N190 PolarHBondContact O-N 3.1Å; Y186-N190 PolarHBondContact O-ND2 3.25Å; V187-N190 PolarHBondContact O-N 3.23Å; N190-T246 WeakPolarHBondContact ND2-CG2 3.48Å
191	V	91.4	Very high	91.1	Very high	1 Å²	1	11 Å²	11	1%	0.006	6%	0.064	C	C	.	.	S	Bend	trans	-116	140.3	-175	174.3	0	0	0	0	110.7	Q33 V187 N195 R196 I199	Q33-V191 HydrophobicContact CG-CG2 4.23Å; V187-V191 HydrophobicContact CG1-CG2 3.92Å; V187-V191 VanDerWaalsContact O-CB 3.3Å; V187-V191 WeakPolarHBondContact O-CB 3.33Å; V187-V191 WeakPolarHBondContact O-CG2 3.08Å; V187-V191 PolarHBondContact O-N 3.49Å; V191-N195 HydrophobicContact CG1-CB 3.87Å; V191-R196 HydrophobicContact CB-CG 4.46Å; V191-R196 HydrophobicContact CG1-CG 4.17Å; V191-R196 PolarHBondContact O-NE 3.17Å; V191-I199 HydrophobicContact CB-CD1 4.34Å; V191-I199 HydrophobicContact CG1-CD1 3.65Å; V191-I199 HydrophobicContact CG1-CG1 4.49Å; V191-I199 HydrophobicContact CG2-CD1 3.65Å
192	S	87.5	Confident	91.1	Very high	17 Å²	17	15.4 Å²	15.4	12%	0.119	9%	0.087	C	C	.	.			trans	-62.4	145.1	175.4	63.2	0	0	0	0	112.9	L27 S194 N195 R196	L27-S192 WeakPolarHBondContact O-CB 3.31Å; S192-S194 PolarHBondContact O-N 3.19Å; S192-N195 PolarHBondContact O-N 3.29Å; S192-N195 PolarHBondContact OG-ND2 3.43Å; S192-N195 VanDerWaalsContact OG-ND2 3.09Å; S192-R196 PolarHBondContact O-N 3.41Å
193	K	85.9	Confident	90.4	Very high	58 Å²	58	15.7 Å²	15.7	25%	0.252	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.3	-29.9	179.7	55.5	-163.8	-174.2	-170.6	0	117.1	D22 E24 R362	D22-K193 IonicContact OD2-NZ 3.93Å; D22-K193 PolarHBondContact OD2-NZ 3.48Å; E24-K193 WeakPolarHBondContact OE2-CB 3.32Å; E24-K193 PolarHBondContact OE2-N 2.65Å; K193-R362 PolarHBondContact O-NH2 2.97Å
194	S	83.9	Confident	89.9	Confident	74 Å²	74	15.9 Å²	15.9	52%	0.517	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-22.4	-178.6	54.7	0	0	0	0	113.7	S192	S192-S194 PolarHBondContact O-N 3.19Å
195	N	87	Confident	89.5	Confident	20 Å²	20	17 Å²	17	11%	0.107	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-6.8	-174.1	-64.4	-43.6	0	0	0	113.4	V191 S192 L197 L198 I199 R355	V191-N195 HydrophobicContact CG1-CB 3.87Å; S192-N195 PolarHBondContact O-N 3.29Å; S192-N195 PolarHBondContact OG-ND2 3.43Å; S192-N195 VanDerWaalsContact OG-ND2 3.09Å; N195-L197 PolarHBondContact O-N 3.07Å; N195-L198 PolarHBondContact O-N 3.15Å; N195-I199 WeakPolarHBondContact O-CG1 3.5Å; N195-I199 PolarHBondContact O-N 3.39Å; N195-R355 PolarHBondContact OD1-NH1 2.67Å
196	R	90.7	Very high	89.1	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-52.9	-54.2	-177.5	-71.1	177.2	179.4	146.9	7.6	113.3	E24 V188 V191 S192 L198 I199 I200 L414 E418 L501	E24-R196 IonicContact OE1-CZ 2.83Å; E24-R196 IonicContact OE1-NH1 3.32Å; E24-R196 IonicContact OE1-NH2 3.73Å; E24-R196 PolarHBondContact OE1-NH2 2.67Å; E24-R196 IonicContact OE2-CZ 3.32Å; E24-R196 IonicContact OE2-NH1 3.79Å; E24-R196 IonicContact OE2-NH2 2.86Å; E24-R196 PolarHBondContact OE2-NH2 3.37Å; V188-R196 PolarHBondContact O-NE 3.17Å; V188-R196 PolarHBondContact O-NH2 3.34Å; V191-R196 HydrophobicContact CB-CG 4.46Å; V191-R196 HydrophobicContact CG1-CG 4.17Å; V191-R196 PolarHBondContact O-NE 3.17Å; S192-R196 PolarHBondContact O-N 3.41Å; R196-L198 VanDerWaalsContact C-N 3.33Å; R196-L198 PolarHBondContact O-N 2.83Å; R196-I199 PolarHBondContact O-N 2.69Å; R196-I200 VanDerWaalsContact O-CG1 3.28Å; R196-I200 WeakPolarHBondContact O-CG1 3.41Å; R196-I200 PolarHBondContact O-N 2.66Å; R196-I200 VanDerWaalsContact O-N 3.09Å; R196-L414 HydrophobicContact CB-CD1 3.94Å; R196-L414 HydrophobicContact CB-CD2 4.34Å; R196-E418 IonicContact NH1-OE1 3.93Å; R196-E418 PolarHBondContact NH1-OE1 3.09Å; R196-L501 VanDerWaalsContact NH2-CG 3.26Å
197	L	90.8	Very high	88.6	Confident	4 Å²	4	20.4 Å²	20.4	2%	0.021	12%	0.115	C	C	.	.	H	α-helix	trans	-62.2	-44.7	-177.2	-175.2	65	0	0	0	110.9	N195 I199 I200 A201 D354 M365 I410 L414	N195-L197 PolarHBondContact O-N 3.07Å; L197-I199 PolarHBondContact O-N 2.88Å; L197-I200 PolarHBondContact O-N 2.83Å; L197-A201 VanDerWaalsContact O-CB 3.25Å; L197-A201 WeakPolarHBondContact O-CB 3.24Å; L197-A201 PolarHBondContact O-N 3.3Å; L197-D354 HydrophobicContact CD2-CB 3.45Å; L197-D354 VanDerWaalsContact CD2-CB 3.45Å; L197-M365 HydrophobicContact CD2-CE 3.91Å; L197-M365 HydrophobicContact CD2-SD 3.99Å; L197-I410 HydrophobicContact CD1-CG2 3.55Å; L197-L414 HydrophobicContact CB-CD2 3.91Å; L197-L414 HydrophobicContact CD1-CD2 3.97Å
198	L	90.6	Very high	88.2	Confident	27 Å²	27	20.4 Å²	20.4	14%	0.141	12%	0.115	C	C	.	.	H	α-helix	trans	-60.5	-46.3	178.7	-176	67.9	0	0	0	112.1	N195 R196 A201 I202	N195-L198 PolarHBondContact O-N 3.15Å; R196-L198 VanDerWaalsContact C-N 3.33Å; R196-L198 PolarHBondContact O-N 2.83Å; L198-A201 PolarHBondContact O-N 3.37Å; L198-I202 HydrophobicContact CD1-CD1 3.93Å; L198-I202 HydrophobicContact CD1-CG1 4.08Å; L198-I202 HydrophobicContact CD2-CD1 4.28Å; L198-I202 HydrophobicContact CG-CD1 3.69Å; L198-I202 HydrophobicContact CG-CG1 4.22Å; L198-I202 WeakPolarHBondContact O-CB 3.41Å; L198-I202 VanDerWaalsContact O-CG1 3.23Å; L198-I202 WeakPolarHBondContact O-CG1 3.29Å; L198-I202 PolarHBondContact O-N 2.98Å
199	I	90.9	Very high	87.9	Confident	17 Å²	17	21.9 Å²	21.9	9%	0.087	12%	0.123	C	C	.	.	H	α-helix	trans	-65.7	-40.9	-179.6	-69.9	-175.5	0	0	0	111.4	A37 V187 V191 N195 R196 L197 A201 G203	A37-I199 HydrophobicContact CB-CG2 3.69Å; V187-I199 HydrophobicContact CG1-CG2 3.74Å; V191-I199 HydrophobicContact CB-CD1 4.34Å; V191-I199 HydrophobicContact CG1-CD1 3.65Å; V191-I199 HydrophobicContact CG1-CG1 4.49Å; V191-I199 HydrophobicContact CG2-CD1 3.65Å; N195-I199 WeakPolarHBondContact O-CG1 3.5Å; N195-I199 PolarHBondContact O-N 3.39Å; R196-I199 PolarHBondContact O-N 2.69Å; L197-I199 PolarHBondContact O-N 2.88Å; I199-A201 VanDerWaalsContact C-N 3.31Å; I199-A201 PolarHBondContact O-N 3.25Å; I199-G203 PolarHBondContact O-N 2.86Å
200	I	91.4	Very high	87.5	Confident	5 Å²	5	22 Å²	22	3%	0.026	12%	0.124	C	C	.	.	H	α-helix	trans	-66.7	-35.7	178.1	-65.2	171.3	0	0	0	111.1	Y40 V187 V188 R196 L197 G203 I410 L414 M417	Y40-I200 HydrophobicContact CE1-CG2 4.46Å; Y40-I200 WeakPolarHBondContact CE1-O 3.26Å; Y40-I200 WeakPolarHBondContact OH-CG2 3.43Å; V187-I200 HydrophobicContact CG1-CG1 4.37Å; V188-I200 HydrophobicContact CG2-CD1 3.96Å; R196-I200 VanDerWaalsContact O-CG1 3.28Å; R196-I200 WeakPolarHBondContact O-CG1 3.41Å; R196-I200 PolarHBondContact O-N 2.66Å; R196-I200 VanDerWaalsContact O-N 3.09Å; L197-I200 PolarHBondContact O-N 2.83Å; I200-G203 CarbonylContact O-C 3.38Å; I200-I410 HydrophobicContact CB-CG2 4.31Å; I200-I410 HydrophobicContact CG2-CG1 4.42Å; I200-I410 HydrophobicContact CG2-CG2 3.66Å; I200-L414 HydrophobicContact CD1-CD1 3.98Å; I200-M417 HydrophobicContact CD1-CE 3.99Å
201	A	91.2	Very high	87.3	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-84.6	-31.6	-178.5	0	0	0	0	0	115.1	L197 L198 I199 G203 W344 I348 S351 I410	L197-A201 VanDerWaalsContact O-CB 3.25Å; L197-A201 WeakPolarHBondContact O-CB 3.24Å; L197-A201 PolarHBondContact O-N 3.3Å; L198-A201 PolarHBondContact O-N 3.37Å; I199-A201 VanDerWaalsContact C-N 3.31Å; I199-A201 PolarHBondContact O-N 3.25Å; A201-G203 CarbonylContact C-O 3.22Å; A201-G203 PolarHBondContact O-N 3.09Å; A201-G203 VanDerWaalsContact O-O 3.11Å; A201-W344 PolarHBondContact O-NE1 3.37Å; A201-I348 VanDerWaalsContact O-CD1 3.24Å; A201-I348 WeakPolarHBondContact O-CD1 3.28Å; A201-S351 WeakPolarHBondContact CB-OG 3.48Å; A201-I410 HydrophobicContact CB-CD1 4.15Å
202	I	89.7	Confident	87	Confident	93 Å²	93	26.6 Å²	26.6	48%	0.477	14%	0.144	S	C	.	.	H	α-helix	trans	-56.4	-38.2	170	-75.6	171.3	0	0	0	109.7	L198 W344 I348	L198-I202 HydrophobicContact CD1-CD1 3.93Å; L198-I202 HydrophobicContact CD1-CG1 4.08Å; L198-I202 HydrophobicContact CD2-CD1 4.28Å; L198-I202 HydrophobicContact CG-CD1 3.69Å; L198-I202 HydrophobicContact CG-CG1 4.22Å; L198-I202 WeakPolarHBondContact O-CB 3.41Å; L198-I202 VanDerWaalsContact O-CG1 3.23Å; L198-I202 WeakPolarHBondContact O-CG1 3.29Å; L198-I202 PolarHBondContact O-N 2.98Å; I202-W344 PolarHBondContact O-NE1 3.46Å; I202-I348 VanDerWaalsContact CA-CD1 3.48Å; I202-I348 HydrophobicContact CB-CD1 4.39Å; I202-I348 HydrophobicContact CG1-CD1 4.04Å
203	G	80	Confident	86.9	Confident	7 Å²	7	25.8 Å²	25.8	7%	0.072	14%	0.139	C	C	.	.	S	Bend	trans	-100.8	-148.1	172.3	0	0	0	0	0	114.4	Q41 I199 I200 A201	Q41-G203 VanDerWaalsContact OE1-C 3.26Å; I199-G203 PolarHBondContact O-N 2.86Å; I200-G203 CarbonylContact O-C 3.38Å; A201-G203 CarbonylContact C-O 3.22Å; A201-G203 PolarHBondContact O-N 3.09Å; A201-G203 VanDerWaalsContact O-O 3.11Å
204	G	82.8	Confident	86.9	Confident	5 Å²	5	27.6 Å²	27.6	5%	0.052	15%	0.151	C	C	.	.	S	Bend	trans	105.4	178.9	169	0	0	0	0	0	114.1	S44 N206 I207 G208	S44-G204 WeakPolarHBondContact CB-O 2.95Å; G204-N206 VanDerWaalsContact C-N 3.31Å; G204-N206 PolarHBondContact O-N 3.3Å; G204-I207 WeakPolarHBondContact O-CG2 3.34Å; G204-G208 PolarHBondContact O-N 2.88Å
205	V	84.7	Confident	87	Confident	28 Å²	28	25 Å²	25	17%	0.17	13%	0.131	C	C	.	.	H	α-helix	trans	-65.2	-35.2	-168	-174.8	0	0	0	0	111.8	F47 L51 M180 G208 I209	F47-V205 HydrophobicContact CD1-CB 4.41Å; F47-V205 HydrophobicContact CD1-CG1 3.82Å; F47-V205 HydrophobicContact CD1-CG2 3.65Å; F47-V205 HydrophobicContact CE1-CG1 4.1Å; F47-V205 HydrophobicContact CE1-CG2 3.99Å; L51-V205 HydrophobicContact CD1-CG1 4.22Å; M180-V205 HydrophobicContact CE-CG2 3.77Å; M180-V205 HydrophobicContact SD-CG2 4.44Å; V205-G208 CarbonylContact O-C 3.54Å; V205-G208 WeakPolarHBondContact O-CA 3.44Å; V205-G208 PolarHBondContact O-N 3.46Å; V205-G208 VanDerWaalsContact O-N 3.11Å; V205-I209 HydrophobicContact CG1-CD1 3.87Å; V205-I209 HydrophobicContact CG1-CG1 4.18Å; V205-I209 WeakPolarHBondContact O-CG1 3.26Å; V205-I209 PolarHBondContact O-N 3.5Å
206	N	84.9	Confident	86.8	Confident	36 Å²	36	24.3 Å²	24.3	19%	0.193	13%	0.128	C	C	.	.	H	α-helix	trans	-65.6	-44.6	-175.7	-68.2	-42.8	0	0	0	113.4	G204 G208 I209 A210 N343 W344 S406	G204-N206 VanDerWaalsContact C-N 3.31Å; G204-N206 PolarHBondContact O-N 3.3Å; N206-G208 VanDerWaalsContact C-N 3.28Å; N206-I209 PolarHBondContact O-N 3.25Å; N206-A210 PolarHBondContact O-N 3.39Å; N206-N343 HydrophobicContact CB-CB 4.01Å; N206-W344 HydrophobicContact CB-CB 4.24Å; N206-S406 WeakPolarHBondContact ND2-CB 3.42Å; N206-S406 PolarHBondContact ND2-OG 3.23Å
207	I	85.9	Confident	86.5	Confident	36 Å²	36	30.5 Å²	30.5	19%	0.185	16%	0.155	C	C	.	.	H	α-helix	trans	-68.6	-32.1	172.2	-177.5	154.1	0	0	0	111.3	G204 A210 F211 W344	G204-I207 WeakPolarHBondContact O-CG2 3.34Å; I207-A210 PolarHBondContact O-N 3.38Å; I207-F211 WeakPolarHBondContact O-CB 3.18Å; I207-F211 PolarHBondContact O-N 2.82Å; I207-W344 HydrophobicContact CB-CB 4.44Å; I207-W344 HydrophobicContact CB-CD2 4.27Å; I207-W344 HydrophobicContact CB-CG 3.89Å; I207-W344 HydrophobicContact CD1-CD2 3.92Å; I207-W344 HydrophobicContact CD1-CE3 4.36Å; I207-W344 HydrophobicContact CD1-CG 4.43Å; I207-W344 HydrophobicContact CD1-CH2 4.12Å; I207-W344 HydrophobicContact CD1-CZ2 3.65Å; I207-W344 HydrophobicContact CD1-CZ3 4.46Å; I207-W344 HydrophobicContact CG2-CG 4.49Å
208	G	86.2	Confident	86.2	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60	-43.9	170.3	0	0	0	0	0	113.1	G204 V205 N206 S212	G204-G208 PolarHBondContact O-N 2.88Å; V205-G208 CarbonylContact O-C 3.54Å; V205-G208 WeakPolarHBondContact O-CA 3.44Å; V205-G208 PolarHBondContact O-N 3.46Å; V205-G208 VanDerWaalsContact O-N 3.11Å; N206-G208 VanDerWaalsContact C-N 3.28Å; G208-S212 WeakPolarHBondContact O-CB 3.48Å; G208-S212 PolarHBondContact O-N 3.1Å; G208-S212 PolarHBondContact O-OG 3.38Å
209	I	84.4	Confident	85.8	Confident	32 Å²	32	36.6 Å²	36.6	16%	0.164	19%	0.194	C	C	.	.	H	α-helix	trans	-66	-44.9	176	-71.3	167.8	0	0	0	110.5	I52 V205 N206 S212 S213	I52-I209 HydrophobicContact CD1-CG2 4.13Å; I52-I209 HydrophobicContact CG2-CG1 4.12Å; I52-I209 HydrophobicContact CG2-CG2 4.09Å; V205-I209 HydrophobicContact CG1-CD1 3.87Å; V205-I209 HydrophobicContact CG1-CG1 4.18Å; V205-I209 WeakPolarHBondContact O-CG1 3.26Å; V205-I209 PolarHBondContact O-N 3.5Å; N206-I209 PolarHBondContact O-N 3.25Å; I209-S212 PolarHBondContact O-N 3Å; I209-S213 WeakPolarHBondContact O-CB 3.42Å; I209-S213 PolarHBondContact O-N 3.48Å; I209-S213 PolarHBondContact O-OG 2.84Å
210	A	86	Confident	85.1	Confident	3 Å²	3	42.9 Å²	42.9	3%	0.025	22%	0.224	C	C	.	.	H	α-helix	trans	-59.6	-48.9	177.1	0	0	0	0	0	111.3	N206 I207 S212 S213 L214 L341	N206-A210 PolarHBondContact O-N 3.39Å; I207-A210 PolarHBondContact O-N 3.38Å; A210-S212 PolarHBondContact O-N 2.96Å; A210-S213 PolarHBondContact O-N 3.01Å; A210-L214 WeakPolarHBondContact O-CG 3.25Å; A210-L214 PolarHBondContact O-N 2.93Å; A210-L341 HydrophobicContact CB-CD2 4.13Å; A210-L341 HydrophobicContact CB-CG 3.97Å
211	F	87.1	Confident	84.5	Confident	96 Å²	96	49 Å²	49	42%	0.421	25%	0.252	S	S	.	.	H	α-helix	trans	-64.7	-40.3	177.8	-171	-122	0	0	0	112.2	F45 I207 S213 L214 L215 F232	F45-F211 HydrophobicContact CD2-CB 4.22Å; F45-F211 AromaticContact CD2-CD1 3.47Å; F45-F211 HydrophobicContact CD2-CD1 3.47Å; F45-F211 VanDerWaalsContact CD2-CD1 3.47Å; F45-F211 HydrophobicContact CD2-CE1 4.34Å; F45-F211 HydrophobicContact CD2-CG 4.32Å; F45-F211 HydrophobicContact CE2-CB 4.38Å; F45-F211 AromaticContact CE2-CD1 3.31Å; F45-F211 HydrophobicContact CE2-CD1 3.31Å; F45-F211 AromaticContact CE2-CE1 3.95Å; F45-F211 HydrophobicContact CE2-CE1 3.95Å; F45-F211 HydrophobicContact CE2-CG 4.22Å; F45-F211 HydrophobicContact CG-CD1 4.23Å; F45-F211 AromaticContact CZ-CD1 4Å; F45-F211 HydrophobicContact CZ-CD1 4Å; F45-F211 HydrophobicContact CZ-CE1 4.18Å; I207-F211 WeakPolarHBondContact O-CB 3.18Å; I207-F211 PolarHBondContact O-N 2.82Å; F211-S213 VanDerWaalsContact C-N 3.33Å; F211-S213 PolarHBondContact O-N 2.75Å; F211-L214 PolarHBondContact O-N 2.86Å; F211-L215 HydrophobicContact CD1-CD1 3.64Å; F211-L215 HydrophobicContact CD2-CD1 4.1Å; F211-L215 HydrophobicContact CE1-CD1 3.29Å; F211-L215 HydrophobicContact CE2-CD1 3.81Å; F211-L215 HydrophobicContact CG-CD1 4.02Å; F211-L215 HydrophobicContact CZ-CD1 3.38Å; F211-L215 WeakPolarHBondContact O-CD1 3.45Å; F211-L215 PolarHBondContact O-N 3.32Å; F211-F232 HydrophobicContact CE1-CZ 4.33Å
212	S	86.2	Confident	84.1	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.6	-37.5	175.4	-62.8	0	0	0	0	112.5	F45 F49 G208 I209 A210 L215 A216	F45-S212 WeakPolarHBondContact CD2-OG 3.37Å; F45-S212 WeakPolarHBondContact CE2-OG 3.46Å; F49-S212 WeakPolarHBondContact CA-OG 3.15Å; F49-S212 WeakPolarHBondContact CB-OG 3.25Å; F49-S212 PolarHBondContact N-OG 2.95Å; G208-S212 WeakPolarHBondContact O-CB 3.48Å; G208-S212 PolarHBondContact O-N 3.1Å; G208-S212 PolarHBondContact O-OG 3.38Å; I209-S212 PolarHBondContact O-N 3Å; A210-S212 PolarHBondContact O-N 2.96Å; S212-L215 PolarHBondContact O-N 3.35Å; S212-A216 WeakPolarHBondContact O-CB 3.18Å; S212-A216 PolarHBondContact O-N 3.17Å
213	S	84.6	Confident	84	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.007	25%	0.247	C	C	.	.	H	α-helix	trans	-66.3	-39	176	-56.5	0	0	0	0	111.4	I209 A210 F211 A216 F217	I209-S213 WeakPolarHBondContact O-CB 3.42Å; I209-S213 PolarHBondContact O-N 3.48Å; I209-S213 PolarHBondContact O-OG 2.84Å; A210-S213 PolarHBondContact O-N 3.01Å; F211-S213 VanDerWaalsContact C-N 3.33Å; F211-S213 PolarHBondContact O-N 2.75Å; S213-A216 PolarHBondContact O-N 2.97Å; S213-F217 PolarHBondContact O-N 3.36Å
214	L	86	Confident	84.4	Confident	96 Å²	96	51.4 Å²	51.4	50%	0.503	26%	0.259	S	S	.	.	H	α-helix	trans	-67.1	-42.5	173.9	-67.4	171.6	0	0	0	112	A210 F211 A216 F217 A218	A210-L214 WeakPolarHBondContact O-CG 3.25Å; A210-L214 PolarHBondContact O-N 2.93Å; F211-L214 PolarHBondContact O-N 2.86Å; L214-A216 VanDerWaalsContact C-N 3.34Å; L214-A216 PolarHBondContact O-N 3.48Å; L214-F217 PolarHBondContact O-N 2.65Å; L214-A218 PolarHBondContact O-N 3.48Å
215	L	86.1	Confident	84.7	Confident	20 Å²	20	51.6 Å²	51.6	11%	0.105	26%	0.259	C	S	.	.	H	α-helix	trans	-60.8	-43.7	173.1	-101.7	102.6	0	0	0	111.6	F45 F211 S212 F217 A218 F219 L225 A228	F45-L215 HydrophobicContact CE2-CD1 4.3Å; F45-L215 HydrophobicContact CZ-CD1 4.3Å; F211-L215 HydrophobicContact CD1-CD1 3.64Å; F211-L215 HydrophobicContact CD2-CD1 4.1Å; F211-L215 HydrophobicContact CE1-CD1 3.29Å; F211-L215 HydrophobicContact CE2-CD1 3.81Å; F211-L215 HydrophobicContact CG-CD1 4.02Å; F211-L215 HydrophobicContact CZ-CD1 3.38Å; F211-L215 WeakPolarHBondContact O-CD1 3.45Å; F211-L215 PolarHBondContact O-N 3.32Å; S212-L215 PolarHBondContact O-N 3.35Å; L215-F217 VanDerWaalsContact C-N 3.3Å; L215-F217 PolarHBondContact O-N 3.12Å; L215-A218 PolarHBondContact O-N 2.89Å; L215-A218 VanDerWaalsContact O-N 3.15Å; L215-F219 HydrophobicContact CD2-CD2 4.34Å; L215-F219 HydrophobicContact CD2-CE2 3.93Å; L215-F219 HydrophobicContact CG-CE2 4.48Å; L215-F219 WeakPolarHBondContact O-CD2 3.27Å; L215-F219 PolarHBondContact O-N 3.44Å; L215-L225 HydrophobicContact CB-CD1 3.83Å; L215-L225 HydrophobicContact CD2-CD1 4.37Å; L215-A228 HydrophobicContact CD2-CB 4.35Å
216	A	83.7	Confident	84.9	Confident	4 Å²	4	50.2 Å²	50.2	3%	0.033	25%	0.251	C	S	.	.	H	α-helix	trans	-61	-41.7	178.2	0	0	0	0	0	111.5	F56 S212 S213 L214 A218 Q220 L225 Y333	F56-A216 HydrophobicContact CD2-CB 3.88Å; F56-A216 HydrophobicContact CE2-CB 3.88Å; S212-A216 WeakPolarHBondContact O-CB 3.18Å; S212-A216 PolarHBondContact O-N 3.17Å; S213-A216 PolarHBondContact O-N 2.97Å; L214-A216 VanDerWaalsContact C-N 3.34Å; L214-A216 PolarHBondContact O-N 3.48Å; A216-A218 VanDerWaalsContact C-N 3.35Å; A216-A218 PolarHBondContact O-N 2.92Å; A216-Q220 PolarHBondContact O-N 3.34Å; A216-Q220 VanDerWaalsContact O-N 3.13Å; A216-L225 HydrophobicContact CB-CD1 4.44Å; A216-L225 HydrophobicContact CB-CD2 3.85Å; A216-Y333 HydrophobicContact CB-CD1 4.05Å; A216-Y333 HydrophobicContact CB-CE1 3.86Å
217	F	82.7	Confident	85.3	Confident	131 Å²	131	51.4 Å²	51.4	58%	0.575	26%	0.256	S	S	*	.	H	α-helix	trans	-62.6	-38.5	173.7	-178.7	-101.2	0	0	0	112.9	S213 L214 L215 Q220	S213-F217 PolarHBondContact O-N 3.36Å; L214-F217 PolarHBondContact O-N 2.65Å; L215-F217 VanDerWaalsContact C-N 3.3Å; L215-F217 PolarHBondContact O-N 3.12Å; F217-Q220 VanDerWaalsContact O-CG 3.27Å; F217-Q220 WeakPolarHBondContact O-CG 3.41Å
218	A	85.7	Confident	85.6	Confident	76 Å²	76	50.8 Å²	50.8	63%	0.628	26%	0.257	S	S	*	.	H	α-helix	trans	-72.6	-42.8	-178.5	0	0	0	0	0	113.7	L214 L215 A216	L214-A218 PolarHBondContact O-N 3.48Å; L215-A218 PolarHBondContact O-N 2.89Å; L215-A218 VanDerWaalsContact O-N 3.15Å; A216-A218 VanDerWaalsContact C-N 3.35Å; A216-A218 PolarHBondContact O-N 2.92Å
219	F	82.2	Confident	85.8	Confident	82 Å²	82	50.9 Å²	50.9	36%	0.36	26%	0.257	S	S	.	.	H	α-helix	trans	-81.1	-33.8	-177	-81.7	-80.2	0	0	0	113.3	L215 H221 P224 L225 A228	L215-F219 HydrophobicContact CD2-CD2 4.34Å; L215-F219 HydrophobicContact CD2-CE2 3.93Å; L215-F219 HydrophobicContact CG-CE2 4.48Å; L215-F219 WeakPolarHBondContact O-CD2 3.27Å; L215-F219 PolarHBondContact O-N 3.44Å; F219-H221 PolarHBondContact O-N 3.32Å; F219-P224 HydrophobicContact CD1-CB 3.69Å; F219-P224 HydrophobicContact CD1-CG 3.97Å; F219-P224 HydrophobicContact CE1-CB 4.01Å; F219-L225 HydrophobicContact CB-CB 4.06Å; F219-L225 HydrophobicContact CD2-CD1 4.15Å; F219-L225 HydrophobicContact CG-CB 4.39Å; F219-A228 HydrophobicContact CE1-CB 4.36Å; F219-A228 HydrophobicContact CE2-CB 3.67Å; F219-A228 HydrophobicContact CZ-CB 3.54Å
220	Q	74.9	Confident	86.1	Confident	150 Å²	150	49.6 Å²	49.6	70%	0.701	25%	0.252	S	S	*	.			trans	57.4	-20	-175.8	-57.4	-174.9	-14.5	0	0	116.4	A216 F217	A216-Q220 PolarHBondContact O-N 3.34Å; A216-Q220 VanDerWaalsContact O-N 3.13Å; F217-Q220 VanDerWaalsContact O-CG 3.27Å; F217-Q220 WeakPolarHBondContact O-CG 3.41Å
221	H	79.3	Confident	86.4	Confident	134 Å²	134	51.7 Å²	51.7	62%	0.62	27%	0.266	S	S	*	.	S	Bend	trans	-110.4	132.1	172.7	-66.3	-64.6	0	0	0	110.4	F219 R223 P224 L225	F219-H221 PolarHBondContact O-N 3.32Å; H221-R223 PolarHBondContact O-N 2.9Å; H221-P224 HydrophobicContact CB-CG 3.85Å; H221-P224 VanDerWaalsContact O-CD 3.31Å; H221-P224 WeakPolarHBondContact O-CD 2.91Å; H221-P224 WeakPolarHBondContact O-CG 3.23Å; H221-L225 WeakPolarHBondContact O-CB 3.31Å; H221-L225 PolarHBondContact O-N 3.47Å
222	W	83.5	Confident	86.6	Confident	25 Å²	25	50.4 Å²	50.4	10%	0.095	26%	0.26	C	S	.	.	H	α-helix	trans	-73.2	-26.2	-173.4	64.1	-93.5	0	0	0	115	F53 M57 T97 W101 F165 S226	F53-W222 HydrophobicContact CE2-CB 4.33Å; F53-W222 HydrophobicContact CZ-CB 4.2Å; F53-W222 HydrophobicContact CZ-CE3 4.1Å; M57-W222 HydrophobicContact CE-CB 4.28Å; M57-W222 HydrophobicContact CE-CD2 3.65Å; M57-W222 HydrophobicContact CE-CE3 4.19Å; M57-W222 HydrophobicContact CE-CG 3.69Å; M57-W222 HydrophobicContact CE-CZ2 4.38Å; M57-W222 HydrophobicContact CG-CB 4.29Å; M57-W222 HydrophobicContact SD-CB 3.08Å; M57-W222 WeakPolarHBondContact SD-CB 3.43Å; M57-W222 HydrophobicContact SD-CD2 3.69Å; M57-W222 HydrophobicContact SD-CE3 4.36Å; M57-W222 HydrophobicContact SD-CG 3.1Å; T97-W222 VanDerWaalsContact CB-NE1 3.25Å; T97-W222 HydrophobicContact CG2-CZ2 3.77Å; T97-W222 PolarHBondContact OG1-NE1 3.42Å; W101-W222 HydrophobicContact CH2-CH2 4.07Å; W101-W222 HydrophobicContact CH2-CZ2 4.35Å; W101-W222 HydrophobicContact CZ2-CH2 4.33Å; F165-W222 HydrophobicContact CD2-CZ3 4.42Å; F165-W222 HydrophobicContact CE2-CZ3 4.09Å; W222-S226 VanDerWaalsContact O-CB 3.3Å; W222-S226 WeakPolarHBondContact O-CB 3.42Å; W222-S226 PolarHBondContact O-N 3.48Å
223	R	88.2	Confident	86.8	Confident	73 Å²	73	50.4 Å²	50.4	28%	0.275	26%	0.26	S	S	.	.	H	α-helix	trans	-62.8	-58.4	178.3	-71.2	-174.2	179.8	-112.4	1.8	111.1	A157 A159 H221 L225 S226 I227	A157-R223 WeakPolarHBondContact O-CD 3.42Å; A157-R223 PolarHBondContact O-NH1 2.84Å; A159-R223 PolarHBondContact O-NH2 3.23Å; H221-R223 PolarHBondContact O-N 2.9Å; R223-L225 VanDerWaalsContact C-N 3.28Å; R223-L225 PolarHBondContact O-N 3.03Å; R223-S226 PolarHBondContact O-N 3.33Å; R223-I227 WeakPolarHBondContact O-CG1 3.41Å; R223-I227 PolarHBondContact O-N 3.18Å; R223-I227 VanDerWaalsContact O-N 3.17Å
224	P	87.8	Confident	87.2	Confident	51 Å²	51	54.1 Å²	54.1	33%	0.331	28%	0.276	S	S	.	.	H	α-helix	trans	-64.6	-33.7	176.6	26.9	-35.3	0	0	0	112.1	F219 H221 S226 I227 A228	F219-P224 HydrophobicContact CD1-CB 3.69Å; F219-P224 HydrophobicContact CD1-CG 3.97Å; F219-P224 HydrophobicContact CE1-CB 4.01Å; H221-P224 HydrophobicContact CB-CG 3.85Å; H221-P224 VanDerWaalsContact O-CD 3.31Å; H221-P224 WeakPolarHBondContact O-CD 2.91Å; H221-P224 WeakPolarHBondContact O-CG 3.23Å; P224-S226 PolarHBondContact O-N 2.92Å; P224-I227 PolarHBondContact O-N 2.9Å; P224-A228 VanDerWaalsContact O-CB 3.31Å; P224-A228 WeakPolarHBondContact O-CB 3.36Å; P224-A228 PolarHBondContact O-N 3.4Å
225	L	88.2	Confident	87.5	Confident	9 Å²	9	52.9 Å²	52.9	5%	0.047	27%	0.273	C	S	.	.	H	α-helix	trans	-58.2	-46.2	173.2	176.2	63.9	0	0	0	112.3	F49 L215 A216 F219 H221 R223 A228 A229	F49-L225 HydrophobicContact CE2-CD1 3.99Å; F49-L225 HydrophobicContact CE2-CD2 4.17Å; F49-L225 HydrophobicContact CE2-CG 3.77Å; F49-L225 HydrophobicContact CZ-CG 4.15Å; L215-L225 HydrophobicContact CB-CD1 3.83Å; L215-L225 HydrophobicContact CD2-CD1 4.37Å; A216-L225 HydrophobicContact CB-CD1 4.44Å; A216-L225 HydrophobicContact CB-CD2 3.85Å; F219-L225 HydrophobicContact CB-CB 4.06Å; F219-L225 HydrophobicContact CD2-CD1 4.15Å; F219-L225 HydrophobicContact CG-CB 4.39Å; H221-L225 WeakPolarHBondContact O-CB 3.31Å; H221-L225 PolarHBondContact O-N 3.47Å; R223-L225 VanDerWaalsContact C-N 3.28Å; R223-L225 PolarHBondContact O-N 3.03Å; L225-A228 PolarHBondContact O-N 2.88Å; L225-A229 VanDerWaalsContact O-CB 3.28Å; L225-A229 WeakPolarHBondContact O-CB 3.32Å; L225-A229 PolarHBondContact O-N 3.37Å
226	S	90.4	Very high	87.6	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-63.4	-42.3	178.7	-164.2	0	0	0	0	111.3	G153 W222 R223 P224 S230	G153-S226 PolarHBondContact O-OG 3.07Å; W222-S226 VanDerWaalsContact O-CB 3.3Å; W222-S226 WeakPolarHBondContact O-CB 3.42Å; W222-S226 PolarHBondContact O-N 3.48Å; R223-S226 PolarHBondContact O-N 3.33Å; P224-S226 PolarHBondContact O-N 2.92Å; S226-S230 WeakPolarHBondContact O-CB 3.41Å; S226-S230 PolarHBondContact O-N 3.44Å; S226-S230 PolarHBondContact O-OG 2.9Å
227	I	92.3	Very high	88.1	Confident	60 Å²	60	52.1 Å²	52.1	31%	0.308	27%	0.269	S	S	.	.	H	α-helix	trans	-63.4	-51.3	176.5	-62.9	170.5	0	0	0	110.2	A157 F158 R223 P224 S230 S231	A157-I227 HydrophobicContact CB-CD1 3.92Å; A157-I227 HydrophobicContact CB-CG1 3.48Å; A157-I227 VanDerWaalsContact CB-CG1 3.48Å; F158-I227 HydrophobicContact CE2-CD1 4.32Å; F158-I227 HydrophobicContact CZ-CD1 4.19Å; R223-I227 WeakPolarHBondContact O-CG1 3.41Å; R223-I227 PolarHBondContact O-N 3.18Å; R223-I227 VanDerWaalsContact O-N 3.17Å; P224-I227 PolarHBondContact O-N 2.9Å; I227-S230 PolarHBondContact O-N 3.24Å; I227-S231 WeakPolarHBondContact O-CB 3.45Å; I227-S231 PolarHBondContact O-N 2.93Å; I227-S231 PolarHBondContact O-OG 2.88Å
228	A	91.5	Very high	88.7	Confident	24 Å²	24	52.1 Å²	52.1	20%	0.198	28%	0.275	C	S	.	.	H	α-helix	trans	-60	-50.4	-177.8	0	0	0	0	0	111.8	L215 F219 P224 L225 S231 F232	L215-A228 HydrophobicContact CD2-CB 4.35Å; F219-A228 HydrophobicContact CE1-CB 4.36Å; F219-A228 HydrophobicContact CE2-CB 3.67Å; F219-A228 HydrophobicContact CZ-CB 3.54Å; P224-A228 VanDerWaalsContact O-CB 3.31Å; P224-A228 WeakPolarHBondContact O-CB 3.36Å; P224-A228 PolarHBondContact O-N 3.4Å; L225-A228 PolarHBondContact O-N 2.88Å; A228-S231 PolarHBondContact O-N 3.36Å; A228-F232 WeakPolarHBondContact O-CD2 3.34Å
229	A	90.9	Very high	89.1	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.008	26%	0.26	C	S	.	.	H	α-helix	trans	-66.8	-39.4	-179.2	0	0	0	0	0	112.6	F45 F49 L225 S231 F232	F45-A229 HydrophobicContact CE1-CB 4.37Å; F45-A229 HydrophobicContact CZ-CB 4.13Å; F49-A229 HydrophobicContact CD1-CB 3.59Å; F49-A229 HydrophobicContact CD2-CB 3.57Å; F49-A229 HydrophobicContact CE1-CB 3.46Å; F49-A229 VanDerWaalsContact CE1-CB 3.46Å; F49-A229 HydrophobicContact CE2-CB 3.45Å; F49-A229 VanDerWaalsContact CE2-CB 3.45Å; F49-A229 HydrophobicContact CG-CB 3.63Å; F49-A229 HydrophobicContact CZ-CB 3.38Å; L225-A229 VanDerWaalsContact O-CB 3.28Å; L225-A229 WeakPolarHBondContact O-CB 3.32Å; L225-A229 PolarHBondContact O-N 3.37Å; A229-S231 VanDerWaalsContact C-N 3.31Å; A229-S231 PolarHBondContact O-N 3.03Å; A229-F232 PolarHBondContact O-N 2.91Å
230	S	91.9	Very high	89.6	Confident	6 Å²	6	47.6 Å²	47.6	4%	0.042	24%	0.243	C	C	.	.	H	α-helix	trans	-73.7	-24.7	-179.1	-52.1	0	0	0	0	112.6	G153 S226 I227 F232 G233	G153-S230 VanDerWaalsContact C-OG 3.26Å; G153-S230 WeakPolarHBondContact CA-OG 3.32Å; S226-S230 WeakPolarHBondContact O-CB 3.41Å; S226-S230 PolarHBondContact O-N 3.44Å; S226-S230 PolarHBondContact O-OG 2.9Å; I227-S230 PolarHBondContact O-N 3.24Å; S230-F232 PolarHBondContact O-N 3.23Å; S230-G233 PolarHBondContact O-N 3.42Å
231	S	92.4	Very high	90.5	Very high	46 Å²	46	44.9 Å²	44.9	32%	0.322	24%	0.237	S	C	.	.	H	α-helix	trans	-61.5	-29.5	175.9	-63.9	0	0	0	0	112.7	I227 A228 A229 G233 F234 V235	I227-S231 WeakPolarHBondContact O-CB 3.45Å; I227-S231 PolarHBondContact O-N 2.93Å; I227-S231 PolarHBondContact O-OG 2.88Å; A228-S231 PolarHBondContact O-N 3.36Å; A229-S231 VanDerWaalsContact C-N 3.31Å; A229-S231 PolarHBondContact O-N 3.03Å; S231-G233 PolarHBondContact O-N 3.44Å; S231-F234 PolarHBondContact O-N 2.94Å; S231-F234 VanDerWaalsContact O-N 3.12Å; S231-V235 PolarHBondContact O-N 3.44Å
232	F	90.8	Very high	91.1	Very high	69 Å²	69	40.4 Å²	40.4	30%	0.303	23%	0.227	S	C	.	.	H	α-helix	trans	-61.9	-22.9	173.9	-73.1	-83.6	0	0	0	113.3	I42 F45 I46 F211 A228 A229 S230 F234 V235 T236	I42-F232 HydrophobicContact CG2-CB 3.76Å; I42-F232 HydrophobicContact CG2-CD1 4.32Å; I42-F232 HydrophobicContact CG2-CG 4.48Å; F45-F232 HydrophobicContact CD1-CB 4.2Å; F45-F232 HydrophobicContact CD1-CD2 4.31Å; F45-F232 HydrophobicContact CD1-CG 4.22Å; F45-F232 HydrophobicContact CE1-CB 4.07Å; F45-F232 AromaticContact CE1-CD2 3.49Å; F45-F232 HydrophobicContact CE1-CD2 3.49Å; F45-F232 VanDerWaalsContact CE1-CD2 3.49Å; F45-F232 HydrophobicContact CE1-CE2 4.05Å; F45-F232 AromaticContact CE1-CG 3.84Å; F45-F232 HydrophobicContact CE1-CG 3.84Å; F45-F232 HydrophobicContact CZ-CD2 4.19Å; F45-F232 HydrophobicContact CZ-CE2 4.35Å; I46-F232 HydrophobicContact CD1-CB 4.36Å; I46-F232 HydrophobicContact CG1-CB 4.23Å; F211-F232 HydrophobicContact CE1-CZ 4.33Å; A228-F232 WeakPolarHBondContact O-CD2 3.34Å; A229-F232 PolarHBondContact O-N 2.91Å; S230-F232 PolarHBondContact O-N 3.23Å; F232-F234 VanDerWaalsContact C-N 3.33Å; F232-F234 PolarHBondContact O-N 3.2Å; F232-V235 PolarHBondContact O-N 3.28Å; F232-T236 PolarHBondContact O-N 3.12Å; F232-T236 PolarHBondContact O-OG1 3.15Å
233	G	89.9	Confident	91.6	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.01	22%	0.224	C	C	.	.	H	α-helix	trans	-61.8	-39.9	173.5	0	0	0	0	0	112.5	I46 S230 S231 T236 A237	I46-G233 VanDerWaalsContact CD1-CA 3.4Å; S230-G233 PolarHBondContact O-N 3.42Å; S231-G233 PolarHBondContact O-N 3.44Å; G233-T236 PolarHBondContact O-N 3.48Å; G233-A237 WeakPolarHBondContact O-CB 3.34Å; G233-A237 PolarHBondContact O-N 2.91Å
234	F	93.2	Very high	91.9	Very high	78 Å²	78	41.5 Å²	41.5	34%	0.342	23%	0.232	S	C	.	.	H	α-helix	trans	-70.4	-36.6	177	-62.3	-78.7	0	0	0	112.2	V151 I154 S231 F232 T236 A237 L238	V151-F234 HydrophobicContact CG2-CE1 4.1Å; V151-F234 HydrophobicContact CG2-CZ 3.81Å; I154-F234 HydrophobicContact CD1-CD2 4.4Å; I154-F234 HydrophobicContact CD1-CE2 3.56Å; I154-F234 HydrophobicContact CD1-CZ 4.32Å; S231-F234 PolarHBondContact O-N 2.94Å; S231-F234 VanDerWaalsContact O-N 3.12Å; F232-F234 VanDerWaalsContact C-N 3.33Å; F232-F234 PolarHBondContact O-N 3.2Å; F234-T236 VanDerWaalsContact C-N 3.32Å; F234-T236 PolarHBondContact O-N 2.96Å; F234-A237 PolarHBondContact O-N 3.46Å; F234-L238 WeakPolarHBondContact O-CB 3.48Å; F234-L238 PolarHBondContact O-N 3.14Å
235	V	92	Very high	92.3	Very high	71 Å²	71	40.2 Å²	40.2	43%	0.43	22%	0.221	S	C	.	.	H	α-helix	trans	-60	-45.6	173.2	-179.5	0	0	0	0	110.4	I42 S231 F232 L238 L239	I42-V235 HydrophobicContact CD1-CG1 4.29Å; S231-V235 PolarHBondContact O-N 3.44Å; F232-V235 PolarHBondContact O-N 3.28Å; V235-L238 PolarHBondContact O-N 2.75Å; V235-L239 HydrophobicContact CG1-CD1 4.48Å; V235-L239 WeakPolarHBondContact O-CG 3.34Å; V235-L239 PolarHBondContact O-N 3.21Å
236	T	89.2	Confident	92.5	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.006	22%	0.219	C	C	.	.	H	α-helix	trans	-64.9	-43.1	177.5	-50.4	0	0	0	0	111.7	I39 I42 M146 F232 G233 F234 L238 L239 L240	I39-T236 HydrophobicContact CB-CG2 4.46Å; I39-T236 HydrophobicContact CG2-CG2 3.88Å; I42-T236 VanDerWaalsContact CB-OG1 3.24Å; I42-T236 WeakPolarHBondContact CB-OG1 3.24Å; I42-T236 WeakPolarHBondContact CG2-OG1 3.31Å; M146-T236 HydrophobicContact CE-CG2 4.24Å; M146-T236 HydrophobicContact CG-CG2 4.1Å; M146-T236 VanDerWaalsContact SD-CB 3.54Å; M146-T236 HydrophobicContact SD-CG2 3.61Å; F232-T236 PolarHBondContact O-N 3.12Å; F232-T236 PolarHBondContact O-OG1 3.15Å; G233-T236 PolarHBondContact O-N 3.48Å; F234-T236 VanDerWaalsContact C-N 3.32Å; F234-T236 PolarHBondContact O-N 2.96Å; T236-L238 VanDerWaalsContact C-N 3.32Å; T236-L238 PolarHBondContact O-N 3.02Å; T236-L239 PolarHBondContact O-N 3.43Å; T236-L240 VanDerWaalsContact O-CB 3.26Å; T236-L240 WeakPolarHBondContact O-CB 3.28Å; T236-L240 PolarHBondContact O-N 3.03Å
237	A	93.5	Very high	92.6	Very high	7 Å²	7	39.8 Å²	39.8	6%	0.058	22%	0.219	C	C	.	.	H	α-helix	trans	-59.5	-43.5	176	0	0	0	0	0	111.3	L143 M146 I147 G233 F234 L240 V241	L143-A237 HydrophobicContact CD2-CB 4.34Å; L143-A237 WeakPolarHBondContact CD2-O 3.37Å; M146-A237 HydrophobicContact CB-CB 4.16Å; I147-A237 HydrophobicContact CG1-CB 3.85Å; G233-A237 WeakPolarHBondContact O-CB 3.34Å; G233-A237 PolarHBondContact O-N 2.91Å; F234-A237 PolarHBondContact O-N 3.46Å; A237-L240 PolarHBondContact O-N 3.25Å; A237-V241 WeakPolarHBondContact O-CG2 3.5Å; A237-V241 PolarHBondContact O-N 3.19Å
238	L	94.5	Very high	92.5	Very high	131 Å²	131	37.2 Å²	37.2	69%	0.686	21%	0.205	S	C	*	.	H	α-helix	trans	-61.6	-46.6	177.1	-178.4	63.1	0	0	0	112	F234 V235 T236 L240 V241	F234-L238 WeakPolarHBondContact O-CB 3.48Å; F234-L238 PolarHBondContact O-N 3.14Å; V235-L238 PolarHBondContact O-N 2.75Å; T236-L238 VanDerWaalsContact C-N 3.32Å; T236-L238 PolarHBondContact O-N 3.02Å; L238-L240 VanDerWaalsContact C-N 3.29Å; L238-L240 PolarHBondContact O-N 2.89Å; L238-V241 PolarHBondContact O-N 3.31Å
239	L	93.6	Very high	92.5	Very high	62 Å²	62	36.8 Å²	36.8	33%	0.325	20%	0.198	S	C	.	.	H	α-helix	trans	-59.7	-42	175.1	-70.9	175.4	0	0	0	111.6	I38 I39 I42 V235 T236 G242	I38-L239 HydrophobicContact CG2-CD1 3.88Å; I39-L239 HydrophobicContact CD1-CB 4.07Å; I39-L239 HydrophobicContact CG1-CB 3.8Å; I39-L239 HydrophobicContact CG1-CD1 4.36Å; I42-L239 HydrophobicContact CD1-CD1 4Å; V235-L239 HydrophobicContact CG1-CD1 4.48Å; V235-L239 WeakPolarHBondContact O-CG 3.34Å; V235-L239 PolarHBondContact O-N 3.21Å; T236-L239 PolarHBondContact O-N 3.43Å; L239-G242 PolarHBondContact O-N 3.41Å
240	L	93.9	Very high	92.6	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-70.1	-29.5	-179.2	-171.7	68.1	0	0	0	112.8	I39 K139 L142 L143 Y186 T236 A237 L238 G242 T243	I39-L240 HydrophobicContact CD1-CB 4.4Å; I39-L240 HydrophobicContact CD1-CD1 4.26Å; I39-L240 HydrophobicContact CG2-CD1 4.43Å; K139-L240 WeakPolarHBondContact CE-O 3.31Å; K139-L240 HydrophobicContact CG-CD1 4.4Å; K139-L240 HydrophobicContact CG-CG 4.25Å; K139-L240 PolarHBondContact NZ-O 2.86Å; L142-L240 HydrophobicContact CB-CD2 3.4Å; L142-L240 VanDerWaalsContact CB-CD2 3.4Å; L143-L240 HydrophobicContact CB-CD2 4.3Å; L143-L240 HydrophobicContact CD2-CB 3.82Å; L143-L240 HydrophobicContact CD2-CD2 3.73Å; L143-L240 HydrophobicContact CD2-CG 3.88Å; L143-L240 HydrophobicContact CG-CB 4.45Å; L143-L240 HydrophobicContact CG-CD2 3.59Å; L143-L240 HydrophobicContact CG-CG 3.94Å; Y186-L240 HydrophobicContact CE1-CD1 4.33Å; T236-L240 VanDerWaalsContact O-CB 3.26Å; T236-L240 WeakPolarHBondContact O-CB 3.28Å; T236-L240 PolarHBondContact O-N 3.03Å; A237-L240 PolarHBondContact O-N 3.25Å; L238-L240 VanDerWaalsContact C-N 3.29Å; L238-L240 PolarHBondContact O-N 2.89Å; L240-G242 PolarHBondContact O-N 3.42Å; L240-T243 PolarHBondContact O-N 2.97Å; L240-T243 VanDerWaalsContact O-N 3.15Å; L240-T243 PolarHBondContact O-OG1 3.28Å
241	V	94.5	Very high	92.5	Very high	92 Å²	92	36.8 Å²	36.8	56%	0.558	20%	0.198	S	C	*	.	H	α-helix	trans	-57.8	-39.4	171.2	169.2	0	0	0	0	110.5	K139 L143 A237 L238 T243	K139-V241 PolarHBondContact NZ-O 2.87Å; L143-V241 HydrophobicContact CD2-CG2 3.83Å; A237-V241 WeakPolarHBondContact O-CG2 3.5Å; A237-V241 PolarHBondContact O-N 3.19Å; L238-V241 PolarHBondContact O-N 3.31Å; V241-T243 VanDerWaalsContact C-N 3.3Å; V241-T243 PolarHBondContact O-N 3.15Å
242	G	91.5	Very high	92.2	Very high	41 Å²	41	35.2 Å²	35.2	42%	0.423	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-9.1	178.3	0	0	0	0	0	115.8	L239 L240 Y265	L239-G242 PolarHBondContact O-N 3.41Å; L240-G242 PolarHBondContact O-N 3.42Å; G242-Y265 PolarHBondContact O-OH 3.47Å
243	T	93.6	Very high	92.1	Very high	3 Å²	3	34.3 Å²	34.3	2%	0.018	18%	0.182	C	C	.	.	S	Bend	trans	-91.8	177.1	177.5	70.7	0	0	0	0	112.4	Y32 I35 I39 K139 Y186 L240 V241	Y32-T243 HydrophobicContact CE2-CG2 4.42Å; I35-T243 HydrophobicContact CG2-CG2 4.29Å; I39-T243 HydrophobicContact CD1-CG2 3.63Å; K139-T243 PolarHBondContact NZ-O 3.26Å; Y186-T243 WeakPolarHBondContact OH-CB 3.48Å; Y186-T243 PolarHBondContact OH-OG1 2.86Å; L240-T243 PolarHBondContact O-N 2.97Å; L240-T243 VanDerWaalsContact O-N 3.15Å; L240-T243 PolarHBondContact O-OG1 3.28Å; V241-T243 VanDerWaalsContact C-N 3.3Å; V241-T243 PolarHBondContact O-N 3.15Å
244	R	94.5	Very high	92.1	Very high	118 Å²	118	36.2 Å²	36.2	45%	0.445	20%	0.202	S	C	.	.			trans	-112.1	161.9	172.8	-65.6	-67.4	-177.1	153.5	-2.8	110.1	Y32 Y186 S262 Y265	Y32-R244 PolarHBondContact OH-N 3.41Å; Y186-R244 PolarHBondContact OH-O 3.43Å; R244-S262 WeakPolarHBondContact CB-OG 3.24Å; R244-Y265 HydrophobicContact CB-CD1 4.4Å; R244-Y265 HydrophobicContact CG-CD1 3.48Å; R244-Y265 VanDerWaalsContact CG-CD1 3.48Å; R244-Y265 HydrophobicContact CG-CE1 4.06Å; R244-Y265 HydrophobicContact CG-CG 3.8Å
245	E	95.4	Very high	92	Very high	23 Å²	23	36.2 Å²	36.2	11%	0.107	20%	0.202	C	C	.	.			trans	-63.2	151.9	170.5	-172.8	57.4	-89.8	0	0	110.1	G137 R138 K139 P140 W249 L250 S262	G137-E245 WeakPolarHBondContact CA-OE2 3.42Å; R138-E245 VanDerWaalsContact CB-OE1 3.29Å; R138-E245 WeakPolarHBondContact CB-OE1 3.27Å; R138-E245 PolarHBondContact N-OE1 2.91Å; R138-E245 PolarHBondContact N-OE2 3.29Å; K139-E245 WeakPolarHBondContact CB-OE2 3.38Å; K139-E245 PolarHBondContact N-OE1 3.29Å; K139-E245 PolarHBondContact N-OE2 3.06Å; P140-E245 WeakPolarHBondContact CD-OE2 3.14Å; E245-W249 HydrophobicContact CG-CD2 4.3Å; E245-W249 HydrophobicContact CG-CE3 3.59Å; E245-W249 HydrophobicContact CG-CZ3 4.13Å; E245-L250 HydrophobicContact CB-CD1 4.15Å; E245-L250 HydrophobicContact CB-CD2 4.28Å; E245-L250 HydrophobicContact CB-CG 4.24Å; E245-L250 HydrophobicContact CG-CD2 4.14Å; E245-L250 HydrophobicContact CG-CG 4.11Å; E245-S262 PolarHBondContact O-OG 3.45Å
246	T	93.7	Very high	92	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.197	C	C	.	.			trans	-61.5	130.4	-175.7	78.2	0	0	0	0	109.7	R138 Y186 E189 N190 R248 W249 L250	R138-T246 HydrophobicContact CB-CG2 4.26Å; R138-T246 HydrophobicContact CG-CG2 3.95Å; Y186-T246 HydrophobicContact CD2-CG2 3.47Å; Y186-T246 VanDerWaalsContact CD2-CG2 3.47Å; Y186-T246 HydrophobicContact CE2-CG2 3.86Å; Y186-T246 HydrophobicContact CG-CG2 4.32Å; E189-T246 HydrophobicContact CB-CG2 3.98Å; E189-T246 VanDerWaalsContact OE2-CB 3.3Å; E189-T246 WeakPolarHBondContact OE2-CB 3.46Å; E189-T246 WeakPolarHBondContact OE2-CG2 3.24Å; E189-T246 PolarHBondContact OE2-OG1 3Å; N190-T246 WeakPolarHBondContact ND2-CG2 3.48Å; T246-R248 PolarHBondContact O-N 3.4Å; T246-R248 VanDerWaalsContact O-N 3.16Å; T246-W249 PolarHBondContact O-N 3.36Å; T246-W249 VanDerWaalsContact O-N 3.16Å; T246-W249 WeakPolarHBondContact OG1-CB 3.35Å; T246-W249 PolarHBondContact OG1-N 3.48Å; T246-W249 VanDerWaalsContact OG1-N 3.16Å; T246-L250 WeakPolarHBondContact O-CG 3.47Å; T246-L250 PolarHBondContact O-N 2.86Å
247	P	92	Very high	92.1	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-56.6	-35.1	179.6	-22.8	29.5	0	0	0	112	L250 I251 Y263 I266	P247-L250 PolarHBondContact O-N 3.42Å; P247-I251 WeakPolarHBondContact O-CB 3.49Å; P247-I251 WeakPolarHBondContact O-CG1 2.97Å; P247-I251 PolarHBondContact O-N 2.95Å; P247-Y263 HydrophobicContact CB-CD1 4.41Å; P247-Y263 HydrophobicContact CB-CD2 3.84Å; P247-Y263 HydrophobicContact CB-CE1 3.97Å; P247-Y263 HydrophobicContact CB-CE2 3.32Å; P247-Y263 HydrophobicContact CB-CG 4.34Å; P247-Y263 HydrophobicContact CG-CD1 4.25Å; P247-Y263 HydrophobicContact CG-CD2 4.39Å; P247-Y263 HydrophobicContact CG-CE1 4.04Å; P247-Y263 HydrophobicContact CG-CE2 4.18Å; P247-Y263 HydrophobicContact CG-CG 4.41Å; P247-I266 HydrophobicContact CG-CD1 3.8Å
248	R	89.9	Confident	92.2	Very high	6 Å²	6	44 Å²	44	2%	0.023	24%	0.236	C	C	.	.	H	α-helix	trans	-64.3	-43.7	178.8	-66.5	-171.5	166.3	-77.5	16.4	113	E24 E189 T246 L250 Q252 T422 E503	E24-R248 IonicContact OE1-CZ 3.15Å; E24-R248 IonicContact OE1-NE 2.75Å; E24-R248 IonicContact OE1-NH2 3.77Å; E24-R248 PolarHBondContact OE1-NH2 2.96Å; E189-R248 HydrophobicContact CG-CB 4.48Å; T246-R248 PolarHBondContact O-N 3.4Å; T246-R248 VanDerWaalsContact O-N 3.16Å; R248-L250 VanDerWaalsContact C-N 3.31Å; R248-L250 PolarHBondContact O-N 3.17Å; R248-Q252 WeakPolarHBondContact O-CG 3.44Å; R248-Q252 PolarHBondContact O-N 3.29Å; R248-T422 HydrophobicContact CB-CG2 4.44Å; R248-E503 IonicContact CZ-OE1 3.3Å; R248-E503 IonicContact NH1-OE1 2.95Å; R248-E503 PolarHBondContact NH1-OE1 3.42Å
249	W	92.4	Very high	92.1	Very high	15 Å²	15	37.8 Å²	37.8	6%	0.057	20%	0.203	C	C	.	.	H	α-helix	trans	-63.6	-40.1	176	-177.3	92.5	0	0	0	111.1	D134 G137 E245 T246 Q252 H253 K255	D134-W249 PolarHBondContact O-NE1 3.18Å; G137-W249 VanDerWaalsContact CA-CE2 3.43Å; G137-W249 VanDerWaalsContact N-CZ2 3.3Å; E245-W249 HydrophobicContact CG-CD2 4.3Å; E245-W249 HydrophobicContact CG-CE3 3.59Å; E245-W249 HydrophobicContact CG-CZ3 4.13Å; T246-W249 PolarHBondContact O-N 3.36Å; T246-W249 VanDerWaalsContact O-N 3.16Å; T246-W249 WeakPolarHBondContact OG1-CB 3.35Å; T246-W249 PolarHBondContact OG1-N 3.48Å; T246-W249 VanDerWaalsContact OG1-N 3.16Å; W249-Q252 PolarHBondContact O-N 2.87Å; W249-H253 AromaticContact CD1-CE1 3.7Å; W249-H253 AromaticContact CD1-ND1 3.8Å; W249-H253 AromaticContact CD2-ND1 3.58Å; W249-H253 AromaticContact CE2-CE1 3.33Å; W249-H253 AromaticContact CE2-CG 3.85Å; W249-H253 AromaticContact CE2-ND1 3.3Å; W249-H253 VanDerWaalsContact CE2-ND1 3.3Å; W249-H253 AromaticContact CE2-NE2 3.9Å; W249-H253 AromaticContact CG-ND1 3.87Å; W249-H253 HydrophobicContact CH2-CB 4.49Å; W249-H253 AromaticContact CZ2-CD2 3.81Å; W249-H253 AromaticContact CZ2-CE1 3.7Å; W249-H253 AromaticContact CZ2-CG 3.78Å; W249-H253 AromaticContact CZ2-ND1 3.72Å; W249-H253 AromaticContact CZ2-NE2 3.79Å; W249-H253 HydrophobicContact CZ3-CB 4.48Å; W249-H253 AromaticContact NE1-CE1 3.11Å; W249-H253 PolarHBondContact NE1-CE1 2.95Å; W249-H253 AromaticContact NE1-ND1 3.46Å; W249-H253 PolarHBondContact NE1-ND1 2.96Å; W249-H253 AromaticContact NE1-NE2 3.9Å; W249-H253 WeakPolarHBondContact O-CB 3.47Å; W249-H253 PolarHBondContact O-N 2.83Å; W249-H253 PolarHBondContact O-ND1 2.93Å; W249-K255 HydrophobicContact CZ3-CD 4.09Å
250	L	93.1	Very high	92	Very high	4 Å²	4	36.6 Å²	36.6	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	-65	-47.4	178.1	-65.5	168.5	0	0	0	112.6	E245 T246 P247 R248 Q252 H253 G254 K255 E258 A259	E245-L250 HydrophobicContact CB-CD1 4.15Å; E245-L250 HydrophobicContact CB-CD2 4.28Å; E245-L250 HydrophobicContact CB-CG 4.24Å; E245-L250 HydrophobicContact CG-CD2 4.14Å; E245-L250 HydrophobicContact CG-CG 4.11Å; T246-L250 WeakPolarHBondContact O-CG 3.47Å; T246-L250 PolarHBondContact O-N 2.86Å; P247-L250 PolarHBondContact O-N 3.42Å; R248-L250 VanDerWaalsContact C-N 3.31Å; R248-L250 PolarHBondContact O-N 3.17Å; L250-Q252 VanDerWaalsContact C-N 3.32Å; L250-Q252 PolarHBondContact O-N 2.92Å; L250-H253 CarbonylContact O-C 3.52Å; L250-H253 PolarHBondContact O-N 3.14Å; L250-H253 VanDerWaalsContact O-N 3.13Å; L250-G254 PolarHBondContact O-N 3.36Å; L250-K255 HydrophobicContact CB-CB 4.37Å; L250-K255 HydrophobicContact CD2-CB 4.14Å; L250-K255 HydrophobicContact CD2-CD 3.77Å; L250-K255 PolarHBondContact O-N 3.48Å; L250-E258 HydrophobicContact CD1-CB 4.09Å; L250-E258 HydrophobicContact CD2-CB 3.85Å; L250-E258 VanDerWaalsContact CD2-OE2 3.23Å; L250-E258 WeakPolarHBondContact CD2-OE2 3.37Å; L250-E258 HydrophobicContact CG-CB 4.47Å; L250-A259 HydrophobicContact CB-CB 3.74Å
251	I	89.8	Confident	92	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.021	22%	0.215	C	C	.	.	H	α-helix	trans	-55.1	-52.2	174.7	-71.5	172.1	0	0	0	109	L23 P247 H253 G254 A259 Y263 I286 A289 Q290	L23-I251 HydrophobicContact CD1-CD1 3.53Å; L23-I251 HydrophobicContact CD2-CD1 4.32Å; P247-I251 WeakPolarHBondContact O-CB 3.49Å; P247-I251 WeakPolarHBondContact O-CG1 2.97Å; P247-I251 PolarHBondContact O-N 2.95Å; I251-H253 PolarHBondContact O-N 3.42Å; I251-G254 PolarHBondContact O-N 3.4Å; I251-G254 VanDerWaalsContact O-N 3.07Å; I251-A259 HydrophobicContact CG1-CB 3.78Å; I251-Y263 HydrophobicContact CD1-CE2 4.07Å; I251-I286 HydrophobicContact CD1-CG1 4.35Å; I251-I286 HydrophobicContact CG1-CG1 4.27Å; I251-I286 HydrophobicContact CG1-CG2 4.04Å; I251-A289 HydrophobicContact CG2-CB 4.03Å; I251-Q290 HydrophobicContact CG2-CG 3.68Å; I251-Q290 VanDerWaalsContact O-CG 3.29Å; I251-Q290 WeakPolarHBondContact O-CG 3.34Å; I251-Q290 PolarHBondContact O-NE2 3.05Å
252	Q	85.9	Confident	92	Very high	13 Å²	13	37 Å²	37	6%	0.061	19%	0.189	C	C	.	.	H	α-helix	trans	-58	-42.6	179.5	-75.6	-158.1	1.3	0	0	111.6	R248 W249 L250 G254 R296 T422 E503	R248-Q252 WeakPolarHBondContact O-CG 3.44Å; R248-Q252 PolarHBondContact O-N 3.29Å; W249-Q252 PolarHBondContact O-N 2.87Å; L250-Q252 VanDerWaalsContact C-N 3.32Å; L250-Q252 PolarHBondContact O-N 2.92Å; Q252-G254 PolarHBondContact O-N 2.8Å; Q252-R296 PolarHBondContact O-NE 3.34Å; Q252-R296 PolarHBondContact O-NH2 2.82Å; Q252-T422 PolarHBondContact NE2-OG1 2.94Å; Q252-T422 VanDerWaalsContact OE1-CB 3.28Å; Q252-E503 VanDerWaalsContact NE2-C 3.33Å; Q252-E503 PolarHBondContact NE2-O 3.47Å
253	H	89.2	Confident	92	Very high	49 Å²	49	35.1 Å²	35.1	23%	0.227	17%	0.169	C	C	.	.	H	α-helix	trans	-72.8	0.2	-178.7	-76.9	75.9	0	0	0	115.4	W249 L250 I251 K255 R296	W249-H253 AromaticContact CD1-CE1 3.7Å; W249-H253 AromaticContact CD1-ND1 3.8Å; W249-H253 AromaticContact CD2-ND1 3.58Å; W249-H253 AromaticContact CE2-CE1 3.33Å; W249-H253 AromaticContact CE2-CG 3.85Å; W249-H253 AromaticContact CE2-ND1 3.3Å; W249-H253 VanDerWaalsContact CE2-ND1 3.3Å; W249-H253 AromaticContact CE2-NE2 3.9Å; W249-H253 AromaticContact CG-ND1 3.87Å; W249-H253 HydrophobicContact CH2-CB 4.49Å; W249-H253 AromaticContact CZ2-CD2 3.81Å; W249-H253 AromaticContact CZ2-CE1 3.7Å; W249-H253 AromaticContact CZ2-CG 3.78Å; W249-H253 AromaticContact CZ2-ND1 3.72Å; W249-H253 AromaticContact CZ2-NE2 3.79Å; W249-H253 HydrophobicContact CZ3-CB 4.48Å; W249-H253 AromaticContact NE1-CE1 3.11Å; W249-H253 PolarHBondContact NE1-CE1 2.95Å; W249-H253 AromaticContact NE1-ND1 3.46Å; W249-H253 PolarHBondContact NE1-ND1 2.96Å; W249-H253 AromaticContact NE1-NE2 3.9Å; W249-H253 WeakPolarHBondContact O-CB 3.47Å; W249-H253 PolarHBondContact O-N 2.83Å; W249-H253 PolarHBondContact O-ND1 2.93Å; L250-H253 CarbonylContact O-C 3.52Å; L250-H253 PolarHBondContact O-N 3.14Å; L250-H253 VanDerWaalsContact O-N 3.13Å; I251-H253 PolarHBondContact O-N 3.42Å; H253-K255 VanDerWaalsContact C-N 3.26Å; H253-K255 HydrophobicContact CB-CD 4.32Å; H253-K255 HydrophobicContact CB-CG 4.32Å; H253-R296 VanDerWaalsContact CA-CZ 3.43Å; H253-R296 PolarHBondContact O-NH2 3.09Å
254	G	88.6	Confident	91.9	Very high	41 Å²	41	38.9 Å²	38.9	42%	0.423	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.3	7.7	180	0	0	0	0	0	113.1	L250 I251 Q252 T256	L250-G254 PolarHBondContact O-N 3.36Å; I251-G254 PolarHBondContact O-N 3.4Å; I251-G254 VanDerWaalsContact O-N 3.07Å; Q252-G254 PolarHBondContact O-N 2.8Å; G254-T256 VanDerWaalsContact C-N 3.32Å; G254-T256 PolarHBondContact O-N 3.49Å; G254-T256 VanDerWaalsContact O-N 3.11Å
255	K	91.8	Very high	91.9	Very high	79 Å²	79	36.4 Å²	36.4	34%	0.343	17%	0.174	S	C	.	.			trans	-89.2	67.4	-175.9	-63.9	175.9	151.4	-131.5	0	110.5	W249 L250 H253 E257 E258 A259	W249-K255 HydrophobicContact CZ3-CD 4.09Å; L250-K255 HydrophobicContact CB-CB 4.37Å; L250-K255 HydrophobicContact CD2-CB 4.14Å; L250-K255 HydrophobicContact CD2-CD 3.77Å; L250-K255 PolarHBondContact O-N 3.48Å; H253-K255 VanDerWaalsContact C-N 3.26Å; H253-K255 HydrophobicContact CB-CD 4.32Å; H253-K255 HydrophobicContact CB-CG 4.32Å; K255-E257 PolarHBondContact O-N 3.39Å; K255-E258 HydrophobicContact CB-CB 4.16Å; K255-E258 HydrophobicContact CB-CG 4.48Å; K255-E258 VanDerWaalsContact NZ-CD 3.34Å; K255-E258 IonicContact NZ-OE1 3.45Å; K255-E258 PolarHBondContact NZ-OE1 3.34Å; K255-E258 IonicContact NZ-OE2 2.98Å; K255-E258 PolarHBondContact NZ-OE2 2.93Å; K255-E258 PolarHBondContact O-N 3.48Å; K255-A259 WeakPolarHBondContact O-CB 3.46Å; K255-A259 PolarHBondContact O-N 2.96Å
256	T	90.8	Very high	91.8	Very high	54 Å²	54	35.3 Å²	35.3	33%	0.331	17%	0.169	S	C	.	.	H	α-helix	trans	-58	-48.6	-172.7	55.1	0	0	0	0	112.7	G254 E258 A259 R260 I286	G254-T256 VanDerWaalsContact C-N 3.32Å; G254-T256 PolarHBondContact O-N 3.49Å; G254-T256 VanDerWaalsContact O-N 3.11Å; T256-E258 PolarHBondContact O-N 3.25Å; T256-A259 WeakPolarHBondContact O-CB 3.08Å; T256-A259 PolarHBondContact O-N 2.89Å; T256-R260 PolarHBondContact O-N 3.49Å; T256-I286 HydrophobicContact CG2-CG2 3.75Å
257	E	93	Very high	91.7	Very high	100 Å²	100	35.3 Å²	35.3	47%	0.467	17%	0.169	S	C	.	.	H	α-helix	trans	-63.4	-42.7	-178.6	-164.2	-161.9	160.7	0	0	112.3	K255 R260 K261	K255-E257 PolarHBondContact O-N 3.39Å; E257-R260 PolarHBondContact O-N 3.22Å; E257-K261 WeakPolarHBondContact O-CG 3.46Å; E257-K261 PolarHBondContact O-N 2.84Å; E257-K261 WeakPolarHBondContact OE1-CE 3.41Å; E257-K261 IonicContact OE1-NZ 2.63Å; E257-K261 PolarHBondContact OE1-NZ 3.43Å
258	E	94	Very high	91.8	Very high	88 Å²	88	43.8 Å²	43.8	41%	0.411	20%	0.201	S	C	.	.	H	α-helix	trans	-65.7	-40.5	176	-68.2	180	-146.9	0	0	111.2	L250 K255 T256 K261 S262	L250-E258 HydrophobicContact CD1-CB 4.09Å; L250-E258 HydrophobicContact CD2-CB 3.85Å; L250-E258 VanDerWaalsContact CD2-OE2 3.23Å; L250-E258 WeakPolarHBondContact CD2-OE2 3.37Å; L250-E258 HydrophobicContact CG-CB 4.47Å; K255-E258 HydrophobicContact CB-CB 4.16Å; K255-E258 HydrophobicContact CB-CG 4.48Å; K255-E258 VanDerWaalsContact NZ-CD 3.34Å; K255-E258 IonicContact NZ-OE1 3.45Å; K255-E258 PolarHBondContact NZ-OE1 3.34Å; K255-E258 IonicContact NZ-OE2 2.98Å; K255-E258 PolarHBondContact NZ-OE2 2.93Å; K255-E258 PolarHBondContact O-N 3.48Å; T256-E258 PolarHBondContact O-N 3.25Å; E258-K261 PolarHBondContact O-N 3.19Å; E258-S262 PolarHBondContact O-N 3.35Å
259	A	92.6	Very high	92	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-60.9	-46.3	177.2	0	0	0	0	0	111.2	L250 I251 K255 T256 S262 Y263 I286	L250-A259 HydrophobicContact CB-CB 3.74Å; I251-A259 HydrophobicContact CG1-CB 3.78Å; K255-A259 WeakPolarHBondContact O-CB 3.46Å; K255-A259 PolarHBondContact O-N 2.96Å; T256-A259 WeakPolarHBondContact O-CB 3.08Å; T256-A259 PolarHBondContact O-N 2.89Å; A259-S262 WeakPolarHBondContact O-CB 3.44Å; A259-S262 PolarHBondContact O-N 3.15Å; A259-S262 VanDerWaalsContact O-N 3.16Å; A259-Y263 WeakPolarHBondContact O-CD2 3.48Å; A259-Y263 PolarHBondContact O-N 2.84Å; A259-I286 HydrophobicContact CB-CD1 3.98Å
260	R	92.2	Very high	92	Very high	38 Å²	38	45.6 Å²	45.6	14%	0.143	21%	0.212	C	C	.	.	H	α-helix	trans	-57.4	-50.5	173.9	-177.7	173.9	71.2	-165.6	12.9	111.3	T256 E257 S262 Y263 R264 D279 W282 D283 I286	T256-R260 PolarHBondContact O-N 3.49Å; E257-R260 PolarHBondContact O-N 3.22Å; R260-S262 PolarHBondContact O-N 3.24Å; R260-Y263 PolarHBondContact O-N 2.97Å; R260-R264 VanDerWaalsContact O-CG 3.26Å; R260-R264 WeakPolarHBondContact O-CG 3.28Å; R260-R264 PolarHBondContact O-N 3.44Å; R260-D279 WeakPolarHBondContact CD-OD1 3.42Å; R260-D279 IonicContact CZ-OD1 3.69Å; R260-D279 IonicContact NE-OD1 3.89Å; R260-D279 PolarHBondContact NE-OD1 3.5Å; R260-D279 IonicContact NH1-OD1 3.38Å; R260-D279 PolarHBondContact NH1-OD1 2.95Å; R260-D279 IonicContact NH2-OD1 2.99Å; R260-D279 PolarHBondContact NH2-OD1 3.24Å; R260-W282 HydrophobicContact CB-CB 4.39Å; R260-W282 HydrophobicContact CG-CB 3.73Å; R260-W282 HydrophobicContact CG-CD2 4.47Å; R260-W282 HydrophobicContact CG-CG 3.76Å; R260-D283 IonicContact CZ-OD1 3.04Å; R260-D283 VanDerWaalsContact NH1-CG 3.27Å; R260-D283 IonicContact NH1-OD1 2.82Å; R260-D283 PolarHBondContact NH1-OD1 3.27Å; R260-D283 IonicContact NH1-OD2 2.97Å; R260-D283 PolarHBondContact NH1-OD2 3.45Å; R260-I286 HydrophobicContact CB-CD1 4.04Å
261	K	93.9	Very high	91.9	Very high	101 Å²	101	53.9 Å²	53.9	44%	0.439	25%	0.25	S	S	.	.	H	α-helix	trans	-56.9	-37.8	176.2	-74.1	173.9	-175.6	169.7	0	112.2	E257 E258 Y265	E257-K261 WeakPolarHBondContact O-CG 3.46Å; E257-K261 PolarHBondContact O-N 2.84Å; E257-K261 WeakPolarHBondContact OE1-CE 3.41Å; E257-K261 IonicContact OE1-NZ 2.63Å; E257-K261 PolarHBondContact OE1-NZ 3.43Å; E258-K261 PolarHBondContact O-N 3.19Å; K261-Y265 WeakPolarHBondContact O-CB 3.22Å; K261-Y265 PolarHBondContact O-N 3.14Å
262	S	93.6	Very high	91.9	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.007	27%	0.269	C	S	.	.	H	α-helix	trans	-64.4	-48.5	176.3	-164.3	0	0	0	0	111.6	R244 E245 E258 A259 R260 R264 Y265 I266	R244-S262 WeakPolarHBondContact CB-OG 3.24Å; E245-S262 PolarHBondContact O-OG 3.45Å; E258-S262 PolarHBondContact O-N 3.35Å; A259-S262 WeakPolarHBondContact O-CB 3.44Å; A259-S262 PolarHBondContact O-N 3.15Å; A259-S262 VanDerWaalsContact O-N 3.16Å; R260-S262 PolarHBondContact O-N 3.24Å; S262-R264 PolarHBondContact O-N 3.44Å; S262-Y265 WeakPolarHBondContact O-CB 3.38Å; S262-Y265 PolarHBondContact O-N 3.46Å; S262-I266 VanDerWaalsContact O-CG1 3.32Å; S262-I266 WeakPolarHBondContact O-CG1 3.35Å; S262-I266 PolarHBondContact O-N 3.5Å
263	Y	92.4	Very high	91.8	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-60.2	-45.6	174.7	-79.3	-67.4	0	0	0	113	L23 L27 P247 I251 A259 R260 Y265 I266 L267 W282	L23-Y263 HydrophobicContact CD2-CE2 4.39Å; L27-Y263 HydrophobicContact CD2-CE1 4.32Å; P247-Y263 HydrophobicContact CB-CD1 4.41Å; P247-Y263 HydrophobicContact CB-CD2 3.84Å; P247-Y263 HydrophobicContact CB-CE1 3.97Å; P247-Y263 HydrophobicContact CB-CE2 3.32Å; P247-Y263 HydrophobicContact CB-CG 4.34Å; P247-Y263 HydrophobicContact CG-CD1 4.25Å; P247-Y263 HydrophobicContact CG-CD2 4.39Å; P247-Y263 HydrophobicContact CG-CE1 4.04Å; P247-Y263 HydrophobicContact CG-CE2 4.18Å; P247-Y263 HydrophobicContact CG-CG 4.41Å; I251-Y263 HydrophobicContact CD1-CE2 4.07Å; A259-Y263 WeakPolarHBondContact O-CD2 3.48Å; A259-Y263 PolarHBondContact O-N 2.84Å; R260-Y263 PolarHBondContact O-N 2.97Å; Y263-Y265 PolarHBondContact O-N 3.3Å; Y263-I266 PolarHBondContact O-N 2.99Å; Y263-L267 WeakPolarHBondContact O-CG 3.25Å; Y263-L267 PolarHBondContact O-N 2.93Å; Y263-W282 VanDerWaalsContact CB-CH2 3.5Å; Y263-W282 AromaticContact CD1-CH2 3.92Å; Y263-W282 HydrophobicContact CD1-CH2 3.92Å; Y263-W282 HydrophobicContact CD1-CZ3 4.06Å; Y263-W282 HydrophobicContact CD2-CE3 4.02Å; Y263-W282 HydrophobicContact CD2-CH2 4.08Å; Y263-W282 AromaticContact CD2-CZ3 3.49Å; Y263-W282 HydrophobicContact CD2-CZ3 3.49Å; Y263-W282 VanDerWaalsContact CD2-CZ3 3.49Å; Y263-W282 HydrophobicContact CE2-CZ3 4.05Å; Y263-W282 HydrophobicContact CG-CE3 4.31Å; Y263-W282 AromaticContact CG-CH2 3.58Å; Y263-W282 HydrophobicContact CG-CH2 3.58Å; Y263-W282 HydrophobicContact CG-CZ2 4.44Å; Y263-W282 AromaticContact CG-CZ3 3.5Å; Y263-W282 HydrophobicContact CG-CZ3 3.5Å; Y263-W282 VanDerWaalsContact CG-CZ3 3.5Å
264	R	92.1	Very high	91.5	Very high	83 Å²	83	65 Å²	65	31%	0.313	32%	0.318	S	S	.	.	H	α-helix	trans	-56.2	-43.4	176.1	-60	-148.2	164	152.1	-8.3	111.7	R260 S262 R268 D279	R260-R264 VanDerWaalsContact O-CG 3.26Å; R260-R264 WeakPolarHBondContact O-CG 3.28Å; R260-R264 PolarHBondContact O-N 3.44Å; S262-R264 PolarHBondContact O-N 3.44Å; R264-R268 VanDerWaalsContact O-CB 3.31Å; R264-R268 WeakPolarHBondContact O-CB 3.38Å; R264-R268 PolarHBondContact O-N 3.41Å; R264-D279 IonicContact CZ-OD1 2.76Å; R264-D279 IonicContact NH1-OD1 2.74Å; R264-D279 PolarHBondContact NH1-OD1 2.86Å; R264-D279 IonicContact NH1-OD2 3.06Å; R264-D279 IonicContact NH2-OD1 3.73Å; R264-D279 PolarHBondContact NH2-OD1 2.83Å; R264-D279 IonicContact NH2-OD2 2.73Å
265	Y	93.6	Very high	91.2	Very high	66 Å²	66	67.1 Å²	67.1	26%	0.259	32%	0.317	S	S	.	.	H	α-helix	trans	-63.6	-46.7	179.1	-174.7	-102.9	0	0	0	111.5	Y32 G242 R244 K261 S262 Y263 L267 R268 I269	Y32-Y265 HydrophobicContact CD2-CD1 4.42Å; Y32-Y265 HydrophobicContact CD2-CE1 4.21Å; Y32-Y265 HydrophobicContact CE2-CD1 4.05Å; Y32-Y265 AromaticContact CE2-CE1 3.89Å; Y32-Y265 HydrophobicContact CE2-CE1 3.89Å; G242-Y265 PolarHBondContact O-OH 3.47Å; R244-Y265 HydrophobicContact CB-CD1 4.4Å; R244-Y265 HydrophobicContact CG-CD1 3.48Å; R244-Y265 VanDerWaalsContact CG-CD1 3.48Å; R244-Y265 HydrophobicContact CG-CE1 4.06Å; R244-Y265 HydrophobicContact CG-CG 3.8Å; K261-Y265 WeakPolarHBondContact O-CB 3.22Å; K261-Y265 PolarHBondContact O-N 3.14Å; S262-Y265 WeakPolarHBondContact O-CB 3.38Å; S262-Y265 PolarHBondContact O-N 3.46Å; Y263-Y265 PolarHBondContact O-N 3.3Å; Y265-L267 PolarHBondContact O-N 2.91Å; Y265-R268 WeakPolarHBondContact O-CB 3.27Å; Y265-R268 PolarHBondContact O-N 2.96Å; Y265-I269 HydrophobicContact CD1-CG1 4.29Å; Y265-I269 HydrophobicContact CE1-CG1 3.95Å; Y265-I269 HydrophobicContact CE2-CD1 4.23Å; Y265-I269 HydrophobicContact CE2-CG1 4.17Å; Y265-I269 WeakPolarHBondContact O-CG1 3.26Å; Y265-I269 PolarHBondContact O-N 3.34Å
266	I	93.2	Very high	90.7	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-60.4	-47.7	177.8	-65	168.5	0	0	0	110.7	L27 Y32 P247 S262 Y263 R268 I269 N270	L27-I266 HydrophobicContact CD2-CD1 3.93Å; L27-I266 HydrophobicContact CD2-CG2 4.3Å; Y32-I266 HydrophobicContact CD1-CB 4.46Å; Y32-I266 HydrophobicContact CD1-CD1 4.42Å; Y32-I266 HydrophobicContact CD1-CG1 3.85Å; Y32-I266 HydrophobicContact CD1-CG2 4.05Å; Y32-I266 HydrophobicContact CD2-CG1 4.41Å; Y32-I266 HydrophobicContact CE1-CD1 3.96Å; Y32-I266 HydrophobicContact CE1-CG1 3.67Å; Y32-I266 HydrophobicContact CE2-CG1 4.26Å; Y32-I266 HydrophobicContact CG-CG1 4.22Å; Y32-I266 HydrophobicContact CG-CG2 4.35Å; P247-I266 HydrophobicContact CG-CD1 3.8Å; S262-I266 VanDerWaalsContact O-CG1 3.32Å; S262-I266 WeakPolarHBondContact O-CG1 3.35Å; S262-I266 PolarHBondContact O-N 3.5Å; Y263-I266 PolarHBondContact O-N 2.99Å; I266-R268 VanDerWaalsContact C-N 3.32Å; I266-R268 PolarHBondContact O-N 3.07Å; I266-I269 PolarHBondContact O-N 2.81Å; I266-N270 VanDerWaalsContact O-CB 3.31Å; I266-N270 WeakPolarHBondContact O-CB 3.28Å; I266-N270 PolarHBondContact O-N 3.05Å
267	L	92.6	Very high	90.4	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-63	-37	177.9	-69.8	174.6	0	0	0	112.3	F28 Y263 Y265 Q271 K272 E275 W282	F28-L267 HydrophobicContact CD2-CD2 3.87Å; F28-L267 HydrophobicContact CE2-CD2 3.85Å; Y263-L267 WeakPolarHBondContact O-CG 3.25Å; Y263-L267 PolarHBondContact O-N 2.93Å; Y265-L267 PolarHBondContact O-N 2.91Å; L267-Q271 PolarHBondContact O-N 2.95Å; L267-K272 HydrophobicContact CD2-CB 3.95Å; L267-K272 PolarHBondContact O-N 3.32Å; L267-E275 HydrophobicContact CD2-CB 4.27Å; L267-W282 HydrophobicContact CD1-CZ2 3.92Å
268	R	93.3	Very high	90	Very high	178 Å²	178	62.6 Å²	62.6	67%	0.672	30%	0.299	S	S	*	.	H	α-helix	trans	-62.6	-52.3	174.4	-170.8	177.6	174	176.2	-1.6	112.2	R264 Y265 I266 N270 Q271 Q273	R264-R268 VanDerWaalsContact O-CB 3.31Å; R264-R268 WeakPolarHBondContact O-CB 3.38Å; R264-R268 PolarHBondContact O-N 3.41Å; Y265-R268 WeakPolarHBondContact O-CB 3.27Å; Y265-R268 PolarHBondContact O-N 2.96Å; I266-R268 VanDerWaalsContact C-N 3.32Å; I266-R268 PolarHBondContact O-N 3.07Å; R268-N270 PolarHBondContact O-N 3.45Å; R268-Q271 PolarHBondContact O-N 3.4Å; R268-Q271 VanDerWaalsContact O-N 3.07Å; R268-Q273 VanDerWaalsContact CB-NE2 3.25Å
269	I	93.3	Very high	89.7	Confident	45 Å²	45	61.6 Å²	61.6	23%	0.231	30%	0.296	C	S	.	.	H	α-helix	trans	-64.7	-33.6	-178.8	-63.1	-60.9	0	0	0	111.1	L31 Y32 Y265 I266 Q271	L31-I269 HydrophobicContact CB-CG2 4.12Å; L31-I269 HydrophobicContact CD2-CG2 4.22Å; L31-I269 HydrophobicContact CG-CG2 4.27Å; Y32-I269 HydrophobicContact CD2-CB 4.48Å; Y32-I269 HydrophobicContact CD2-CG2 4.39Å; Y265-I269 HydrophobicContact CD1-CG1 4.29Å; Y265-I269 HydrophobicContact CE1-CG1 3.95Å; Y265-I269 HydrophobicContact CE2-CD1 4.23Å; Y265-I269 HydrophobicContact CE2-CG1 4.17Å; Y265-I269 WeakPolarHBondContact O-CG1 3.26Å; Y265-I269 PolarHBondContact O-N 3.34Å; I266-I269 PolarHBondContact O-N 2.81Å; I269-Q271 PolarHBondContact O-N 2.88Å
270	N	92.9	Very high	89.4	Confident	14 Å²	14	68.9 Å²	68.9	8%	0.075	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	1.7	175.9	-72.4	-11.7	0	0	0	114.5	F28 G30 L31 Y32 Q33 I266 R268 K272	F28-N270 PolarHBondContact O-ND2 3.09Å; G30-N270 VanDerWaalsContact CA-OD1 3.28Å; G30-N270 WeakPolarHBondContact CA-OD1 3.35Å; L31-N270 PolarHBondContact N-OD1 3.34Å; L31-N270 VanDerWaalsContact N-OD1 3.14Å; Y32-N270 VanDerWaalsContact CB-OD1 3.29Å; Y32-N270 WeakPolarHBondContact CB-OD1 3.17Å; Y32-N270 PolarHBondContact N-OD1 3.48Å; Q33-N270 PolarHBondContact OE1-ND2 3.1Å; Q33-N270 PolarHBondContact OE1-OD1 3.35Å; I266-N270 VanDerWaalsContact O-CB 3.31Å; I266-N270 WeakPolarHBondContact O-CB 3.28Å; I266-N270 PolarHBondContact O-N 3.05Å; R268-N270 PolarHBondContact O-N 3.45Å; N270-K272 HydrophobicContact CB-CG 4.31Å; N270-K272 PolarHBondContact O-N 2.97Å
271	Q	90.8	Very high	89.2	Confident	178 Å²	178	68.6 Å²	68.6	83%	0.832	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	32.8	-176	-57	179.1	-24.3	0	0	113.3	L267 R268 I269	L267-Q271 PolarHBondContact O-N 2.95Å; R268-Q271 PolarHBondContact O-N 3.4Å; R268-Q271 VanDerWaalsContact O-N 3.07Å; I269-Q271 PolarHBondContact O-N 2.88Å
272	K	89.3	Confident	88.9	Confident	93 Å²	93	63.8 Å²	63.8	40%	0.404	31%	0.31	S	S	.	.			trans	-109.5	37.7	177.7	-65.9	-62	-174.7	177.5	0	111.9	F28 L267 N270 A274 E275	F28-K272 HydrophobicContact CB-CG 4.39Å; F28-K272 HydrophobicContact CD2-CB 4.15Å; F28-K272 HydrophobicContact CD2-CG 3.97Å; F28-K272 HydrophobicContact CE2-CB 4.4Å; F28-K272 HydrophobicContact CE2-CG 4.49Å; F28-K272 HydrophobicContact CG-CG 4.14Å; L267-K272 HydrophobicContact CD2-CB 3.95Å; L267-K272 PolarHBondContact O-N 3.32Å; N270-K272 HydrophobicContact CB-CG 4.31Å; N270-K272 PolarHBondContact O-N 2.97Å; K272-A274 PolarHBondContact O-N 3.26Å; K272-E275 HydrophobicContact CB-CG 4.27Å; K272-E275 WeakPolarHBondContact O-CB 3.48Å; K272-E275 PolarHBondContact O-N 3.42Å
273	Q	85.5	Confident	88.6	Confident	103 Å²	103	66.6 Å²	66.6	48%	0.481	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-61.1	-22.9	177.8	-71	-86.4	-61.5	0	0	112.9	R268 E275 Q276	R268-Q273 VanDerWaalsContact CB-NE2 3.25Å; Q273-E275 PolarHBondContact O-N 3.12Å; Q273-Q276 WeakPolarHBondContact O-CB 3.34Å; Q273-Q276 PolarHBondContact O-N 3Å; Q273-Q276 VanDerWaalsContact O-N 3.11Å
274	A	81.7	Confident	88.4	Confident	102 Å²	102	68.3 Å²	68.3	84%	0.843	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-63.7	-24.5	173.8	0	0	0	0	0	113.4	K272 Q276	K272-A274 PolarHBondContact O-N 3.26Å; A274-Q276 PolarHBondContact O-N 3.17Å
275	E	82.3	Confident	88.1	Confident	86 Å²	86	64.4 Å²	64.4	40%	0.402	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-86.7	5	177.2	-55.4	-69	162.6	0	0	112.2	F28 L267 K272 Q273 M277	F28-E275 HydrophobicContact CE2-CB 4.19Å; F28-E275 HydrophobicContact CE2-CG 3.83Å; F28-E275 HydrophobicContact CZ-CB 4.49Å; F28-E275 HydrophobicContact CZ-CG 3.79Å; L267-E275 HydrophobicContact CD2-CB 4.27Å; K272-E275 HydrophobicContact CB-CG 4.27Å; K272-E275 WeakPolarHBondContact O-CB 3.48Å; K272-E275 PolarHBondContact O-N 3.42Å; Q273-E275 PolarHBondContact O-N 3.12Å; E275-M277 PolarHBondContact O-N 2.97Å
276	Q	82.4	Confident	87.8	Confident	49 Å²	49	61.2 Å²	61.2	23%	0.229	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-74.4	118	-175	-175.5	57.4	49.4	0	0	110.5	Q273 A274	Q273-Q276 WeakPolarHBondContact O-CB 3.34Å; Q273-Q276 PolarHBondContact O-N 3Å; Q273-Q276 VanDerWaalsContact O-N 3.11Å; A274-Q276 PolarHBondContact O-N 3.17Å
277	M	82.9	Confident	87.5	Confident	14 Å²	14	65.3 Å²	65.3	7%	0.069	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-82.2	159.2	177.2	-49.1	169.8	79.4	0	0	112.1	I18 Y26 E275 Q281 W282 L285	I18-M277 HydrophobicContact CB-CE 4.31Å; I18-M277 HydrophobicContact CD1-CE 3.4Å; I18-M277 HydrophobicContact CG1-CE 3.71Å; I18-M277 HydrophobicContact CG2-CE 3.62Å; Y26-M277 HydrophobicContact CE1-CG 4.43Å; Y26-M277 HydrophobicContact CE1-SD 3.88Å; Y26-M277 PolarHBondContact OH-SD 2.79Å; E275-M277 PolarHBondContact O-N 2.97Å; M277-Q281 HydrophobicContact CB-CB 3.74Å; M277-Q281 HydrophobicContact CE-CB 3.68Å; M277-Q281 HydrophobicContact CE-CG 4.37Å; M277-W282 HydrophobicContact CB-CD2 4.46Å; M277-W282 HydrophobicContact CB-CG 4.36Å; M277-W282 HydrophobicContact CG-CZ2 4.29Å; M277-W282 VanDerWaalsContact O-CD1 3.24Å; M277-W282 PolarHBondContact O-NE1 3.19Å; M277-W282 HydrophobicContact SD-CD2 4.37Å; M277-W282 HydrophobicContact SD-CH2 4.36Å; M277-W282 HydrophobicContact SD-CZ2 4.21Å; M277-L285 HydrophobicContact CE-CD2 4.48Å; M277-L285 HydrophobicContact SD-CD2 4Å
278	T	86.3	Confident	87.1	Confident	76 Å²	76	65.9 Å²	65.9	47%	0.466	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-62.8	160.8	171.2	64.1	0	0	0	0	111	E280 Q281 W282	T278-E280 VanDerWaalsContact C-N 3.27Å; T278-E280 PolarHBondContact O-N 3.47Å; T278-Q281 PolarHBondContact O-N 2.7Å; T278-Q281 WeakPolarHBondContact OG1-CB 3.15Å; T278-Q281 VanDerWaalsContact OG1-CG 3.26Å; T278-Q281 WeakPolarHBondContact OG1-CG 3.16Å; T278-Q281 PolarHBondContact OG1-N 3.18Å; T278-Q281 PolarHBondContact OG1-OE1 2.89Å; T278-W282 VanDerWaalsContact O-CD1 3.26Å; T278-W282 PolarHBondContact O-N 2.99Å
279	D	87.1	Confident	86.7	Confident	67 Å²	67	57.5 Å²	57.5	36%	0.358	30%	0.298	S	S	.	.	H	α-helix	trans	-56.1	-43.1	177.3	-78.8	-42.5	0	0	0	111.7	R260 R264 Q281 W282 D283	R260-D279 WeakPolarHBondContact CD-OD1 3.42Å; R260-D279 IonicContact CZ-OD1 3.69Å; R260-D279 IonicContact NE-OD1 3.89Å; R260-D279 PolarHBondContact NE-OD1 3.5Å; R260-D279 IonicContact NH1-OD1 3.38Å; R260-D279 PolarHBondContact NH1-OD1 2.95Å; R260-D279 IonicContact NH2-OD1 2.99Å; R260-D279 PolarHBondContact NH2-OD1 3.24Å; R264-D279 IonicContact CZ-OD1 2.76Å; R264-D279 IonicContact NH1-OD1 2.74Å; R264-D279 PolarHBondContact NH1-OD1 2.86Å; R264-D279 IonicContact NH1-OD2 3.06Å; R264-D279 IonicContact NH2-OD1 3.73Å; R264-D279 PolarHBondContact NH2-OD1 2.83Å; R264-D279 IonicContact NH2-OD2 2.73Å; D279-Q281 PolarHBondContact O-N 3.42Å; D279-W282 PolarHBondContact O-N 3.26Å; D279-D283 WeakPolarHBondContact O-CB 3.26Å; D279-D283 PolarHBondContact O-N 3.21Å
280	E	86.3	Confident	86.3	Confident	153 Å²	153	57.9 Å²	57.9	72%	0.715	30%	0.299	S	S	*	.	H	α-helix	trans	-62.1	-41.5	177.9	-62.4	177.3	177.1	0	0	112.8	T278 D283 T284	T278-E280 VanDerWaalsContact C-N 3.27Å; T278-E280 PolarHBondContact O-N 3.47Å; E280-D283 PolarHBondContact O-N 2.94Å; E280-T284 WeakPolarHBondContact O-CB 3.38Å; E280-T284 WeakPolarHBondContact O-CG2 3.42Å; E280-T284 PolarHBondContact O-N 2.93Å; E280-T284 PolarHBondContact O-OG1 3.29Å
281	Q	86.9	Confident	85.7	Confident	31 Å²	31	64.8 Å²	64.8	15%	0.145	32%	0.324	C	S	.	.	H	α-helix	trans	-67.2	-36.6	176.9	-78	175.8	-26.7	0	0	112.2	I18 M277 T278 D279 T284 L285	I18-Q281 HydrophobicContact CD1-CG 4.29Å; M277-Q281 HydrophobicContact CB-CB 3.74Å; M277-Q281 HydrophobicContact CE-CB 3.68Å; M277-Q281 HydrophobicContact CE-CG 4.37Å; T278-Q281 PolarHBondContact O-N 2.7Å; T278-Q281 WeakPolarHBondContact OG1-CB 3.15Å; T278-Q281 VanDerWaalsContact OG1-CG 3.26Å; T278-Q281 WeakPolarHBondContact OG1-CG 3.16Å; T278-Q281 PolarHBondContact OG1-N 3.18Å; T278-Q281 PolarHBondContact OG1-OE1 2.89Å; D279-Q281 PolarHBondContact O-N 3.42Å; Q281-T284 WeakPolarHBondContact CA-OG1 3.37Å; Q281-T284 PolarHBondContact O-OG1 3.33Å; Q281-L285 VanDerWaalsContact O-CB 3.26Å; Q281-L285 WeakPolarHBondContact O-CB 3.4Å; Q281-L285 PolarHBondContact O-N 3.41Å; Q281-L285 VanDerWaalsContact O-N 3.12Å
282	W	88.3	Confident	85.1	Confident	0 Å²	0	60 Å²	60	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-67.3	-44.2	173	-83	110.2	0	0	0	111.9	Y26 R260 Y263 L267 M277 T278 D279 L285 I286	Y26-W282 HydrophobicContact CD1-CH2 4.18Å; Y26-W282 HydrophobicContact CD2-CH2 4.42Å; Y26-W282 HydrophobicContact CG-CH2 4.06Å; R260-W282 HydrophobicContact CB-CB 4.39Å; R260-W282 HydrophobicContact CG-CB 3.73Å; R260-W282 HydrophobicContact CG-CD2 4.47Å; R260-W282 HydrophobicContact CG-CG 3.76Å; Y263-W282 VanDerWaalsContact CB-CH2 3.5Å; Y263-W282 AromaticContact CD1-CH2 3.92Å; Y263-W282 HydrophobicContact CD1-CH2 3.92Å; Y263-W282 HydrophobicContact CD1-CZ3 4.06Å; Y263-W282 HydrophobicContact CD2-CE3 4.02Å; Y263-W282 HydrophobicContact CD2-CH2 4.08Å; Y263-W282 AromaticContact CD2-CZ3 3.49Å; Y263-W282 HydrophobicContact CD2-CZ3 3.49Å; Y263-W282 VanDerWaalsContact CD2-CZ3 3.49Å; Y263-W282 HydrophobicContact CE2-CZ3 4.05Å; Y263-W282 HydrophobicContact CG-CE3 4.31Å; Y263-W282 AromaticContact CG-CH2 3.58Å; Y263-W282 HydrophobicContact CG-CH2 3.58Å; Y263-W282 HydrophobicContact CG-CZ2 4.44Å; Y263-W282 AromaticContact CG-CZ3 3.5Å; Y263-W282 HydrophobicContact CG-CZ3 3.5Å; Y263-W282 VanDerWaalsContact CG-CZ3 3.5Å; L267-W282 HydrophobicContact CD1-CZ2 3.92Å; M277-W282 HydrophobicContact CB-CD2 4.46Å; M277-W282 HydrophobicContact CB-CG 4.36Å; M277-W282 HydrophobicContact CG-CZ2 4.29Å; M277-W282 VanDerWaalsContact O-CD1 3.24Å; M277-W282 PolarHBondContact O-NE1 3.19Å; M277-W282 HydrophobicContact SD-CD2 4.37Å; M277-W282 HydrophobicContact SD-CH2 4.36Å; M277-W282 HydrophobicContact SD-CZ2 4.21Å; T278-W282 VanDerWaalsContact O-CD1 3.26Å; T278-W282 PolarHBondContact O-N 2.99Å; D279-W282 PolarHBondContact O-N 3.26Å; W282-L285 HydrophobicContact CE3-CD2 4.01Å; W282-L285 HydrophobicContact CZ3-CD2 3.8Å; W282-L285 PolarHBondContact O-N 2.93Å; W282-I286 WeakPolarHBondContact O-CB 3.4Å; W282-I286 WeakPolarHBondContact O-CD1 3.4Å; W282-I286 VanDerWaalsContact O-CG1 3.23Å; W282-I286 WeakPolarHBondContact O-CG1 3.3Å; W282-I286 PolarHBondContact O-N 3.34Å
283	D	88.1	Confident	84.5	Confident	61 Å²	61	55.8 Å²	55.8	33%	0.326	28%	0.28	S	S	.	.	H	α-helix	trans	-65.4	-42.1	-176.4	-66.8	-13.8	0	0	0	110.5	R260 D279 E280 I286 E287	R260-D283 IonicContact CZ-OD1 3.04Å; R260-D283 VanDerWaalsContact NH1-CG 3.27Å; R260-D283 IonicContact NH1-OD1 2.82Å; R260-D283 PolarHBondContact NH1-OD1 3.27Å; R260-D283 IonicContact NH1-OD2 2.97Å; R260-D283 PolarHBondContact NH1-OD2 3.45Å; D279-D283 WeakPolarHBondContact O-CB 3.26Å; D279-D283 PolarHBondContact O-N 3.21Å; E280-D283 PolarHBondContact O-N 2.94Å; D283-I286 PolarHBondContact O-N 3.2Å; D283-E287 WeakPolarHBondContact O-CB 3.45Å; D283-E287 PolarHBondContact O-N 3.33Å
284	T	87.2	Confident	84	Confident	36 Å²	36	52.6 Å²	52.6	22%	0.221	28%	0.276	C	S	.	.	H	α-helix	trans	-64.1	-41.3	173.9	49.3	0	0	0	0	113	E280 Q281 Y288 I517	E280-T284 WeakPolarHBondContact O-CB 3.38Å; E280-T284 WeakPolarHBondContact O-CG2 3.42Å; E280-T284 PolarHBondContact O-N 2.93Å; E280-T284 PolarHBondContact O-OG1 3.29Å; Q281-T284 WeakPolarHBondContact CA-OG1 3.37Å; Q281-T284 PolarHBondContact O-OG1 3.33Å; T284-Y288 VanDerWaalsContact O-CB 3.32Å; T284-Y288 WeakPolarHBondContact O-CB 3.38Å; T284-Y288 PolarHBondContact O-N 3.49Å; T284-I517 HydrophobicContact CG2-CD1 3.85Å; T284-I517 WeakPolarHBondContact OG1-CD1 3.46Å
285	L	86.4	Confident	83.9	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-65.2	-45.1	176.2	176.2	64	0	0	0	112.4	Y20 L23 Y26 M277 Q281 W282 Y288 A289	Y20-L285 HydrophobicContact CD1-CB 4.07Å; Y20-L285 HydrophobicContact CD1-CD1 3.61Å; Y20-L285 HydrophobicContact CD1-CG 4.46Å; Y20-L285 HydrophobicContact CE1-CB 4.29Å; Y20-L285 HydrophobicContact CG-CD1 4.23Å; L23-L285 HydrophobicContact CD2-CD1 4.02Å; L23-L285 HydrophobicContact CD2-CD2 3.84Å; L23-L285 HydrophobicContact CD2-CG 3.72Å; Y26-L285 HydrophobicContact CD2-CD2 4.35Å; Y26-L285 HydrophobicContact CE2-CD2 3.72Å; M277-L285 HydrophobicContact CE-CD2 4.48Å; M277-L285 HydrophobicContact SD-CD2 4Å; Q281-L285 VanDerWaalsContact O-CB 3.26Å; Q281-L285 WeakPolarHBondContact O-CB 3.4Å; Q281-L285 PolarHBondContact O-N 3.41Å; Q281-L285 VanDerWaalsContact O-N 3.12Å; W282-L285 HydrophobicContact CE3-CD2 4.01Å; W282-L285 HydrophobicContact CZ3-CD2 3.8Å; W282-L285 PolarHBondContact O-N 2.93Å; L285-Y288 PolarHBondContact O-N 3.27Å; L285-A289 WeakPolarHBondContact O-CB 3.3Å; L285-A289 PolarHBondContact O-N 2.89Å
286	I	87.6	Confident	83.8	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-66.5	-43.2	178.1	-71.5	165.2	0	0	0	110.3	I251 T256 A259 R260 W282 D283 A289 Q290	I251-I286 HydrophobicContact CD1-CG1 4.35Å; I251-I286 HydrophobicContact CG1-CG1 4.27Å; I251-I286 HydrophobicContact CG1-CG2 4.04Å; T256-I286 HydrophobicContact CG2-CG2 3.75Å; A259-I286 HydrophobicContact CB-CD1 3.98Å; R260-I286 HydrophobicContact CB-CD1 4.04Å; W282-I286 WeakPolarHBondContact O-CB 3.4Å; W282-I286 WeakPolarHBondContact O-CD1 3.4Å; W282-I286 VanDerWaalsContact O-CG1 3.23Å; W282-I286 WeakPolarHBondContact O-CG1 3.3Å; W282-I286 PolarHBondContact O-N 3.34Å; D283-I286 PolarHBondContact O-N 3.2Å; I286-A289 PolarHBondContact O-N 3.43Å; I286-Q290 HydrophobicContact CG2-CG 4.39Å; I286-Q290 WeakPolarHBondContact O-CB 3.26Å; I286-Q290 WeakPolarHBondContact O-CG 3.43Å; I286-Q290 PolarHBondContact O-N 2.77Å
287	E	86.8	Confident	83.8	Confident	86 Å²	86	55.7 Å²	55.7	40%	0.402	27%	0.266	S	S	.	.	H	α-helix	trans	-63.5	-42.6	177.6	-173.4	179.2	-171.3	0	0	111.3	D283 A289 Q290 R291	D283-E287 WeakPolarHBondContact O-CB 3.45Å; D283-E287 PolarHBondContact O-N 3.33Å; E287-A289 VanDerWaalsContact C-N 3.34Å; E287-A289 PolarHBondContact O-N 3.27Å; E287-Q290 PolarHBondContact O-N 3.03Å; E287-R291 WeakPolarHBondContact O-CG 3.46Å; E287-R291 PolarHBondContact O-N 3.01Å; E287-R291 IonicContact OE1-CZ 3.29Å; E287-R291 VanDerWaalsContact OE1-CZ 3.29Å; E287-R291 IonicContact OE1-NE 3.32Å; E287-R291 PolarHBondContact OE1-NE 3.46Å; E287-R291 IonicContact OE1-NH2 2.64Å; E287-R291 PolarHBondContact OE1-NH2 3.41Å
288	Y	84.7	Confident	83.9	Confident	11 Å²	11	59 Å²	59	4%	0.043	29%	0.287	C	S	.	.	H	α-helix	trans	-58.9	-46	173.6	-178.7	-95.6	0	0	0	111.5	Y20 R21 T284 L285 Q290 R291 R292 L512	Y20-Y288 WeakPolarHBondContact O-CD1 3.48Å; Y20-Y288 WeakPolarHBondContact O-CE1 3.18Å; R21-Y288 HydrophobicContact CG-CE1 4.42Å; T284-Y288 VanDerWaalsContact O-CB 3.32Å; T284-Y288 WeakPolarHBondContact O-CB 3.38Å; T284-Y288 PolarHBondContact O-N 3.49Å; L285-Y288 PolarHBondContact O-N 3.27Å; Y288-Q290 PolarHBondContact O-N 2.72Å; Y288-R291 PolarHBondContact O-N 3.28Å; Y288-R292 VanDerWaalsContact O-CB 3.31Å; Y288-R292 WeakPolarHBondContact O-CB 3.47Å; Y288-R292 PolarHBondContact O-N 2.96Å; Y288-L512 HydrophobicContact CE2-CB 4.28Å; Y288-L512 PolarHBondContact OH-O 3.19Å
289	A	84.4	Confident	83.9	Confident	2 Å²	2	58.7 Å²	58.7	2%	0.017	28%	0.279	C	S	.	.	H	α-helix	trans	-63.9	-38.6	176.4	0	0	0	0	0	112.7	L23 I251 L285 I286 E287 R292 S293	L23-A289 HydrophobicContact CD1-CB 3.62Å; L23-A289 HydrophobicContact CG-CB 4.39Å; I251-A289 HydrophobicContact CG2-CB 4.03Å; L285-A289 WeakPolarHBondContact O-CB 3.3Å; L285-A289 PolarHBondContact O-N 2.89Å; I286-A289 PolarHBondContact O-N 3.43Å; E287-A289 VanDerWaalsContact C-N 3.34Å; E287-A289 PolarHBondContact O-N 3.27Å; A289-R292 PolarHBondContact O-N 3.44Å; A289-S293 WeakPolarHBondContact O-CB 3.17Å; A289-S293 PolarHBondContact O-N 2.88Å
290	Q	83.6	Confident	83.9	Confident	53 Å²	53	59.6 Å²	59.6	25%	0.248	29%	0.29	C	S	.	.	H	α-helix	trans	-63.4	-46	175.1	-77	177	-11.9	0	0	112.1	I251 I286 E287 Y288 S293	I251-Q290 HydrophobicContact CG2-CG 3.68Å; I251-Q290 VanDerWaalsContact O-CG 3.29Å; I251-Q290 WeakPolarHBondContact O-CG 3.34Å; I251-Q290 PolarHBondContact O-NE2 3.05Å; I286-Q290 HydrophobicContact CG2-CG 4.39Å; I286-Q290 WeakPolarHBondContact O-CB 3.26Å; I286-Q290 WeakPolarHBondContact O-CG 3.43Å; I286-Q290 PolarHBondContact O-N 2.77Å; E287-Q290 PolarHBondContact O-N 3.03Å; Y288-Q290 PolarHBondContact O-N 2.72Å; Q290-S293 PolarHBondContact O-N 2.62Å
291	R	82	Confident	83.9	Confident	160 Å²	160	53.8 Å²	53.8	60%	0.604	26%	0.264	S	S	*	.	H	α-helix	trans	-61.9	-44.2	176.6	-70.6	176.2	-176.2	-169.6	1.7	111	E287 Y288 S293 G294	E287-R291 WeakPolarHBondContact O-CG 3.46Å; E287-R291 PolarHBondContact O-N 3.01Å; E287-R291 IonicContact OE1-CZ 3.29Å; E287-R291 VanDerWaalsContact OE1-CZ 3.29Å; E287-R291 IonicContact OE1-NE 3.32Å; E287-R291 PolarHBondContact OE1-NE 3.46Å; E287-R291 IonicContact OE1-NH2 2.64Å; E287-R291 PolarHBondContact OE1-NH2 3.41Å; Y288-R291 PolarHBondContact O-N 3.28Å; R291-S293 VanDerWaalsContact C-N 3.35Å; R291-S293 PolarHBondContact O-N 3.41Å; R291-G294 PolarHBondContact O-N 3.16Å
292	R	77.7	Confident	83.8	Confident	77 Å²	77	52.4 Å²	52.4	29%	0.291	26%	0.257	S	S	.	.	H	α-helix	trans	-65.8	-33.7	177.3	-172.9	-179.1	175.4	95	3.6	113.1	Y288 A289 G294	Y288-R292 VanDerWaalsContact O-CB 3.31Å; Y288-R292 WeakPolarHBondContact O-CB 3.47Å; Y288-R292 PolarHBondContact O-N 2.96Å; A289-R292 PolarHBondContact O-N 3.44Å; R292-G294 PolarHBondContact O-N 3.36Å
293	S	76.9	Confident	83.8	Confident	4 Å²	4	57.8 Å²	57.8	3%	0.028	28%	0.281	C	S	.	.	H	α-helix	trans	-63.7	-20.8	176.9	-173.7	0	0	0	0	112.7	A289 Q290 R291 E503 G504	A289-S293 WeakPolarHBondContact O-CB 3.17Å; A289-S293 PolarHBondContact O-N 2.88Å; Q290-S293 PolarHBondContact O-N 2.62Å; R291-S293 VanDerWaalsContact C-N 3.35Å; R291-S293 PolarHBondContact O-N 3.41Å; S293-E503 PolarHBondContact OG-O 3.14Å; S293-G504 CarbonylContact O-C 3.58Å; S293-G504 WeakPolarHBondContact O-CA 3.12Å; S293-G504 PolarHBondContact O-N 3.02Å
294	G	74.5	Confident	83.8	Confident	37 Å²	37	64.9 Å²	64.9	38%	0.381	30%	0.303	S	S	.	.			trans	60.7	-153.6	-179.8	0	0	0	0	0	113.3	R291 R292	R291-G294 PolarHBondContact O-N 3.16Å; R292-G294 PolarHBondContact O-N 3.36Å
295	K	78.5	Confident	83.8	Confident	175 Å²	175	68.3 Å²	68.3	76%	0.761	31%	0.312	S	S	*	.	B	Isolated β-bridge	trans	-71.4	133.1	-179.5	-67.5	-174.5	-179.1	-178.6	0	110.7	P297	K295-P297 WeakPolarHBondContact O-CD 2.94Å
296	R	81.5	Confident	83.8	Confident	116 Å²	116	78.5 Å²	78.5	44%	0.438	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-65	123.1	172.7	-61	-176.9	-158.5	163.9	9.3	109.2	Q252 H253	Q252-R296 PolarHBondContact O-NE 3.34Å; Q252-R296 PolarHBondContact O-NH2 2.82Å; H253-R296 VanDerWaalsContact CA-CZ 3.43Å; H253-R296 PolarHBondContact O-NH2 3.09Å
297	P	82.7	Confident	83.8	Confident	10 Å²	10	85.7 Å²	85.7	7%	0.065	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-59.9	140.1	171.9	-0.5	1.2	0	0	0	111.1	K295 D301 P421 A423 L424 I505	K295-P297 WeakPolarHBondContact O-CD 2.94Å; P297-D301 HydrophobicContact CB-CB 4.37Å; P297-P421 HydrophobicContact CG-CB 3.91Å; P297-P421 HydrophobicContact CG-CG 3.46Å; P297-P421 VanDerWaalsContact CG-CG 3.46Å; P297-A423 HydrophobicContact CG-CB 4.31Å; P297-L424 HydrophobicContact CB-CD1 3.53Å; P297-L424 HydrophobicContact CB-CG 3.9Å; P297-L424 HydrophobicContact CG-CD1 3.9Å; P297-L424 HydrophobicContact CG-CG 4.06Å; P297-I505 HydrophobicContact CB-CD1 3.5Å; P297-I505 VanDerWaalsContact CB-CD1 3.5Å; P297-I505 HydrophobicContact CB-CG1 4.39Å; P297-I505 HydrophobicContact CG-CD1 3.62Å; P297-I505 HydrophobicContact CG-CG1 3.97Å
298	T	85.2	Confident	83.7	Confident	85 Å²	85	82 Å²	82	52%	0.521	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-87.3	157.2	162.8	-55.2	0	0	0	0	109.5	C300 D301	T298-C300 PolarHBondContact O-N 3.15Å; T298-C300 VanDerWaalsContact O-N 3.15Å; T298-D301 PolarHBondContact N-OD2 3.36Å; T298-D301 WeakPolarHBondContact O-CA 3.24Å; T298-D301 VanDerWaalsContact O-CB 3.23Å; T298-D301 WeakPolarHBondContact O-CB 3.43Å; T298-D301 PolarHBondContact O-N 2.84Å
299	F	85.1	Confident	83.9	Confident	68 Å²	68	86 Å²	86	30%	0.298	39%	0.385	S	S	.	.	H	α-helix	trans	-49.9	-38.6	173	178.4	-105	0	0	0	113.6	D301 L302 F303 T427 I431	F299-D301 PolarHBondContact O-N 2.82Å; F299-L302 WeakPolarHBondContact O-CB 3.35Å; F299-L302 PolarHBondContact O-N 3.44Å; F299-L302 VanDerWaalsContact O-N 3.14Å; F299-F303 HydrophobicContact CD1-CE2 4.43Å; F299-F303 AromaticContact CE1-CE2 3.78Å; F299-F303 HydrophobicContact CE1-CE2 3.78Å; F299-F303 HydrophobicContact CE2-CE2 4.24Å; F299-F303 AromaticContact CZ-CE2 3.69Å; F299-F303 HydrophobicContact CZ-CE2 3.69Å; F299-F303 HydrophobicContact CZ-CZ 4.3Å; F299-T427 HydrophobicContact CD2-CG2 3.62Å; F299-T427 HydrophobicContact CE2-CG2 3.46Å; F299-T427 VanDerWaalsContact CE2-CG2 3.46Å; F299-I431 HydrophobicContact CE2-CD1 4.19Å
300	C	86.8	Confident	84.1	Confident	86 Å²	86	87.4 Å²	87.4	58%	0.581	39%	0.393	S	S	*	.	H	α-helix	trans	-65.3	-26.7	176.8	-56.6	0	0	0	0	112.7	T298 L302 F303 R304	T298-C300 PolarHBondContact O-N 3.15Å; T298-C300 VanDerWaalsContact O-N 3.15Å; C300-L302 PolarHBondContact O-N 2.94Å; C300-F303 PolarHBondContact O-N 2.9Å; C300-R304 WeakPolarHBondContact O-CB 3.41Å; C300-R304 PolarHBondContact O-N 3.29Å
301	D	86.1	Confident	84.3	Confident	32 Å²	32	86.9 Å²	86.9	17%	0.171	39%	0.391	C	S	.	.	H	α-helix	trans	-66.2	-22.9	176.5	-65.3	-37.4	0	0	0	112.1	P297 T298 F299 F303 R304 R305	P297-D301 HydrophobicContact CB-CB 4.37Å; T298-D301 PolarHBondContact N-OD2 3.36Å; T298-D301 WeakPolarHBondContact O-CA 3.24Å; T298-D301 VanDerWaalsContact O-CB 3.23Å; T298-D301 WeakPolarHBondContact O-CB 3.43Å; T298-D301 PolarHBondContact O-N 2.84Å; F299-D301 PolarHBondContact O-N 2.82Å; D301-F303 VanDerWaalsContact C-N 3.28Å; D301-F303 PolarHBondContact O-N 3.43Å; D301-R304 PolarHBondContact O-N 2.89Å; D301-R305 WeakPolarHBondContact O-CB 3.34Å; D301-R305 PolarHBondContact O-N 3.13Å
302	L	86.2	Confident	84.5	Confident	1 Å²	1	79.7 Å²	79.7	1%	0.005	37%	0.365	C	S	.	.	H	α-helix	trans	-59.4	-40.5	174	-172.2	67.9	0	0	0	111.6	F299 C300 L308 F309 T312 F420 L424 V428 I431	F299-L302 WeakPolarHBondContact O-CB 3.35Å; F299-L302 PolarHBondContact O-N 3.44Å; F299-L302 VanDerWaalsContact O-N 3.14Å; C300-L302 PolarHBondContact O-N 2.94Å; L302-L308 HydrophobicContact CD1-CB 4.26Å; L302-F309 WeakPolarHBondContact O-CA 3.43Å; L302-F309 WeakPolarHBondContact O-CB 3.29Å; L302-F309 PolarHBondContact O-N 3.23Å; L302-T312 WeakPolarHBondContact CD1-OG1 3.47Å; L302-F420 HydrophobicContact CD1-CD1 4.38Å; L302-F420 HydrophobicContact CD1-CE1 3.91Å; L302-L424 HydrophobicContact CB-CD1 4.5Å; L302-L424 HydrophobicContact CD1-CD1 4.28Å; L302-V428 HydrophobicContact CD1-CG2 3.55Å; L302-V428 HydrophobicContact CD2-CG2 4.03Å; L302-V428 HydrophobicContact CG-CG2 4.47Å; L302-I431 HydrophobicContact CD2-CD1 3.53Å
303	F	87.5	Confident	85	Confident	113 Å²	113	79.5 Å²	79.5	50%	0.496	37%	0.372	S	S	.	.	H	α-helix	trans	-91.5	-25.7	-180	-59.3	-77.8	0	0	0	112.5	F299 C300 D301 F309	F299-F303 HydrophobicContact CD1-CE2 4.43Å; F299-F303 AromaticContact CE1-CE2 3.78Å; F299-F303 HydrophobicContact CE1-CE2 3.78Å; F299-F303 HydrophobicContact CE2-CE2 4.24Å; F299-F303 AromaticContact CZ-CE2 3.69Å; F299-F303 HydrophobicContact CZ-CE2 3.69Å; F299-F303 HydrophobicContact CZ-CZ 4.3Å; C300-F303 PolarHBondContact O-N 2.9Å; D301-F303 VanDerWaalsContact C-N 3.28Å; D301-F303 PolarHBondContact O-N 3.43Å; F303-F309 HydrophobicContact CD1-CD2 4.02Å; F303-F309 HydrophobicContact CD1-CE2 4.08Å
304	R	88.7	Confident	85.6	Confident	211 Å²	211	79.7 Å²	79.7	80%	0.796	37%	0.373	S	S	*	.	H	α-helix	trans	-79.2	-37.3	-179.3	-169.5	178.6	-179.2	175.3	2.8	112.9	C300 D301	C300-R304 WeakPolarHBondContact O-CB 3.41Å; C300-R304 PolarHBondContact O-N 3.29Å; D301-R304 PolarHBondContact O-N 2.89Å
305	R	87.5	Confident	86.1	Confident	108 Å²	108	77.9 Å²	77.9	41%	0.408	36%	0.355	S	S	.	.	S	Bend	trans	-89.4	117.3	-177.5	-68.5	-178.3	-179.3	-101.9	6.5	110.6	D301 E307 L308 F309 I505	D301-R305 WeakPolarHBondContact O-CB 3.34Å; D301-R305 PolarHBondContact O-N 3.13Å; R305-E307 PolarHBondContact O-N 2.98Å; R305-E307 VanDerWaalsContact O-N 3.16Å; R305-L308 HydrophobicContact CB-CB 4.45Å; R305-L308 HydrophobicContact CB-CD1 4.3Å; R305-L308 HydrophobicContact CB-CG 4.37Å; R305-L308 PolarHBondContact O-N 2.76Å; R305-F309 WeakPolarHBondContact O-CB 3.2Å; R305-F309 PolarHBondContact O-N 2.92Å; R305-I505 VanDerWaalsContact CZ-CG2 3.43Å; R305-I505 VanDerWaalsContact NH1-CG2 3.28Å
306	R	86.7	Confident	86.4	Confident	213 Å²	213	69.7 Å²	69.7	80%	0.804	32%	0.319	S	S	*	.	H	α-helix	trans	-53	-39.2	-177.1	-171.5	178.6	179.2	-173.4	0.6	113.3	T310	R306-T310 WeakPolarHBondContact O-CB 3.41Å; R306-T310 PolarHBondContact O-N 3.08Å; R306-T310 PolarHBondContact O-OG1 3.12Å
307	E	86.3	Confident	86.5	Confident	152 Å²	152	67.8 Å²	67.8	71%	0.71	31%	0.313	S	S	*	.	H	α-helix	trans	-64.9	-53.6	-180	-66.1	177.1	178.6	0	0	112.1	R305 F309 T310 Q311	R305-E307 PolarHBondContact O-N 2.98Å; R305-E307 VanDerWaalsContact O-N 3.16Å; E307-F309 PolarHBondContact O-N 3.05Å; E307-T310 PolarHBondContact O-N 3.36Å; E307-Q311 WeakPolarHBondContact O-CB 3.49Å; E307-Q311 WeakPolarHBondContact O-CG 3.27Å; E307-Q311 PolarHBondContact O-N 2.9Å
308	L	85.6	Confident	86.4	Confident	8 Å²	8	67.4 Å²	67.4	4%	0.042	31%	0.31	C	S	.	.	H	α-helix	trans	-63.8	-42.8	179.8	-64.2	179.4	0	0	0	111.6	L302 R305 Q311 T312 F420 L424 I505	L302-L308 HydrophobicContact CD1-CB 4.26Å; R305-L308 HydrophobicContact CB-CB 4.45Å; R305-L308 HydrophobicContact CB-CD1 4.3Å; R305-L308 HydrophobicContact CB-CG 4.37Å; R305-L308 PolarHBondContact O-N 2.76Å; L308-Q311 PolarHBondContact O-N 2.82Å; L308-T312 WeakPolarHBondContact O-CB 3.43Å; L308-T312 PolarHBondContact O-N 3.37Å; L308-T312 PolarHBondContact O-OG1 3.29Å; L308-F420 HydrophobicContact CB-CE1 4.3Å; L308-F420 HydrophobicContact CD2-CD1 4Å; L308-F420 HydrophobicContact CD2-CE1 3.99Å; L308-L424 HydrophobicContact CD1-CD1 4.2Å; L308-I505 HydrophobicContact CD1-CD1 3.68Å; L308-I505 HydrophobicContact CD1-CG1 4.45Å
309	F	88.6	Confident	85.9	Confident	94 Å²	94	63.5 Å²	63.5	41%	0.412	29%	0.286	S	S	.	.	H	α-helix	trans	-60.6	-49.1	176	-179.3	-104.7	0	0	0	110.9	L302 F303 R305 E307 Q311 T312 V313	L302-F309 WeakPolarHBondContact O-CA 3.43Å; L302-F309 WeakPolarHBondContact O-CB 3.29Å; L302-F309 PolarHBondContact O-N 3.23Å; F303-F309 HydrophobicContact CD1-CD2 4.02Å; F303-F309 HydrophobicContact CD1-CE2 4.08Å; R305-F309 WeakPolarHBondContact O-CB 3.2Å; R305-F309 PolarHBondContact O-N 2.92Å; E307-F309 PolarHBondContact O-N 3.05Å; F309-Q311 PolarHBondContact O-N 2.86Å; F309-T312 PolarHBondContact O-N 3.47Å; F309-V313 HydrophobicContact CD1-CG2 4.3Å; F309-V313 HydrophobicContact CD2-CG2 4.35Å; F309-V313 HydrophobicContact CE1-CG2 3.9Å; F309-V313 HydrophobicContact CE2-CG2 3.96Å; F309-V313 HydrophobicContact CZ-CG2 3.72Å; F309-V313 WeakPolarHBondContact O-CG2 3.35Å; F309-V313 PolarHBondContact O-N 3.37Å
310	T	87.7	Confident	85.4	Confident	33 Å²	33	62.7 Å²	62.7	20%	0.202	28%	0.284	C	S	.	.	H	α-helix	trans	-61.7	-43.9	-179.8	-61.6	0	0	0	0	111.5	R306 E307 V313 V314 K492	R306-T310 WeakPolarHBondContact O-CB 3.41Å; R306-T310 PolarHBondContact O-N 3.08Å; R306-T310 PolarHBondContact O-OG1 3.12Å; E307-T310 PolarHBondContact O-N 3.36Å; T310-V313 PolarHBondContact O-N 2.81Å; T310-V314 HydrophobicContact CG2-CG2 4.3Å; T310-V314 WeakPolarHBondContact O-CB 3.33Å; T310-V314 WeakPolarHBondContact O-CG2 3.26Å; T310-V314 PolarHBondContact O-N 3.5Å; T310-K492 HydrophobicContact CG2-CD 3.56Å; T310-K492 HydrophobicContact CG2-CG 4.42Å
311	Q	87.8	Confident	84.4	Confident	41 Å²	41	60 Å²	60	19%	0.192	26%	0.264	C	S	.	.	H	α-helix	trans	-63.2	-42.1	176.4	-72.8	175.8	-6.1	0	0	111.8	E307 L308 F309 V314 L315 F420 I493	E307-Q311 WeakPolarHBondContact O-CB 3.49Å; E307-Q311 WeakPolarHBondContact O-CG 3.27Å; E307-Q311 PolarHBondContact O-N 2.9Å; L308-Q311 PolarHBondContact O-N 2.82Å; F309-Q311 PolarHBondContact O-N 2.86Å; Q311-V314 PolarHBondContact O-N 3.36Å; Q311-L315 WeakPolarHBondContact O-CB 3.47Å; Q311-L315 WeakPolarHBondContact O-CD1 3.43Å; Q311-L315 VanDerWaalsContact O-CG 3.28Å; Q311-L315 WeakPolarHBondContact O-CG 3.38Å; Q311-L315 PolarHBondContact O-N 3.09Å; Q311-F420 HydrophobicContact CB-CE2 4.25Å; Q311-F420 HydrophobicContact CB-CZ 3.76Å; Q311-I493 HydrophobicContact CB-CD1 4.3Å; Q311-I493 HydrophobicContact CG-CD1 4.05Å
312	T	87.3	Confident	83.5	Confident	10 Å²	10	60 Å²	60	6%	0.061	26%	0.264	C	S	.	.	H	α-helix	trans	-62.5	-45.9	178.7	-56.2	0	0	0	0	110.8	L302 L308 F309 S316 F420 V428 I431	L302-T312 WeakPolarHBondContact CD1-OG1 3.47Å; L308-T312 WeakPolarHBondContact O-CB 3.43Å; L308-T312 PolarHBondContact O-N 3.37Å; L308-T312 PolarHBondContact O-OG1 3.29Å; F309-T312 PolarHBondContact O-N 3.47Å; T312-S316 WeakPolarHBondContact O-CB 3.23Å; T312-S316 PolarHBondContact O-N 3.48Å; T312-S316 PolarHBondContact O-OG 3.48Å; T312-F420 WeakPolarHBondContact OG1-CE1 3.38Å; T312-F420 WeakPolarHBondContact OG1-CZ 3.4Å; T312-V428 HydrophobicContact CG2-CG1 4.23Å; T312-I431 HydrophobicContact CG2-CG2 4.29Å
313	V	88.5	Confident	82	Confident	73 Å²	73	64.1 Å²	64.1	44%	0.442	28%	0.281	S	S	.	.	H	α-helix	trans	-64.6	-47.4	178.6	172.2	0	0	0	0	111	F309 T310 S316 Y317	F309-V313 HydrophobicContact CD1-CG2 4.3Å; F309-V313 HydrophobicContact CD2-CG2 4.35Å; F309-V313 HydrophobicContact CE1-CG2 3.9Å; F309-V313 HydrophobicContact CE2-CG2 3.96Å; F309-V313 HydrophobicContact CZ-CG2 3.72Å; F309-V313 WeakPolarHBondContact O-CG2 3.35Å; F309-V313 PolarHBondContact O-N 3.37Å; T310-V313 PolarHBondContact O-N 2.81Å; V313-S316 PolarHBondContact O-N 2.96Å; V313-Y317 WeakPolarHBondContact O-CB 2.92Å; V313-Y317 PolarHBondContact O-N 3.18Å
314	V	88.7	Confident	80.2	Confident	7 Å²	7	59.4 Å²	59.4	4%	0.042	26%	0.262	C	S	.	.	H	α-helix	trans	-62.5	-48.9	-179.5	171	0	0	0	0	111.2	T310 Q311 S316 Y317 S318 F489 K492 I493	T310-V314 HydrophobicContact CG2-CG2 4.3Å; T310-V314 WeakPolarHBondContact O-CB 3.33Å; T310-V314 WeakPolarHBondContact O-CG2 3.26Å; T310-V314 PolarHBondContact O-N 3.5Å; Q311-V314 PolarHBondContact O-N 3.36Å; V314-S316 PolarHBondContact O-N 3.27Å; V314-Y317 PolarHBondContact O-N 2.96Å; V314-S318 PolarHBondContact O-N 3.32Å; V314-S318 PolarHBondContact O-OG 3.02Å; V314-S318 VanDerWaalsContact O-OG 3.1Å; V314-F489 HydrophobicContact CG1-CB 4.36Å; V314-K492 HydrophobicContact CG2-CB 4.2Å; V314-K492 HydrophobicContact CG2-CD 3.54Å; V314-K492 HydrophobicContact CG2-CG 4.49Å; V314-I493 HydrophobicContact CB-CD1 4.43Å; V314-I493 HydrophobicContact CG1-CD1 4.15Å; V314-I493 HydrophobicContact CG1-CG1 3.94Å
315	L	86.1	Confident	78.3	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-66.1	-40.8	-179.1	-69	165.4	0	0	0	111.4	Q311 Y317 S318 I319 L412 V415 I416 F420 F489 I493	Q311-L315 WeakPolarHBondContact O-CB 3.47Å; Q311-L315 WeakPolarHBondContact O-CD1 3.43Å; Q311-L315 VanDerWaalsContact O-CG 3.28Å; Q311-L315 WeakPolarHBondContact O-CG 3.38Å; Q311-L315 PolarHBondContact O-N 3.09Å; L315-Y317 VanDerWaalsContact C-N 3.34Å; L315-S318 PolarHBondContact O-N 3.32Å; L315-I319 VanDerWaalsContact O-CG1 3.25Å; L315-I319 WeakPolarHBondContact O-CG1 3.41Å; L315-I319 PolarHBondContact O-N 3.47Å; L315-L412 HydrophobicContact CD2-CD2 4.3Å; L315-V415 HydrophobicContact CD1-CG1 4.41Å; L315-V415 HydrophobicContact CD2-CB 4.5Å; L315-V415 HydrophobicContact CD2-CG1 3.77Å; L315-I416 HydrophobicContact CB-CD1 4.32Å; L315-I416 HydrophobicContact CB-CG1 3.95Å; L315-I416 HydrophobicContact CD1-CG1 3.77Å; L315-I416 HydrophobicContact CG-CG1 4.29Å; L315-F420 HydrophobicContact CD1-CE2 3.84Å; L315-F489 HydrophobicContact CD2-CD2 4.02Å; L315-F489 HydrophobicContact CD2-CE2 3.76Å; L315-I493 HydrophobicContact CD1-CD1 4.23Å; L315-I493 HydrophobicContact CD2-CD1 4.18Å; L315-I493 HydrophobicContact CD2-CG1 4.2Å; L315-I493 HydrophobicContact CG-CD1 3.95Å; L315-I493 HydrophobicContact CG-CG1 4.47Å
316	S	83.7	Confident	76.5	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.014	23%	0.234	C	C	.	.	H	α-helix	trans	-68.9	-35.1	177.5	-51.2	0	0	0	0	112.3	T312 V313 V314 I319 L320 S432	T312-S316 WeakPolarHBondContact O-CB 3.23Å; T312-S316 PolarHBondContact O-N 3.48Å; T312-S316 PolarHBondContact O-OG 3.48Å; V313-S316 PolarHBondContact O-N 2.96Å; V314-S316 PolarHBondContact O-N 3.27Å; S316-I319 PolarHBondContact O-N 3.18Å; S316-L320 PolarHBondContact O-N 2.98Å; S316-S432 PolarHBondContact OG-OG 2.95Å
317	Y	83.9	Confident	74.3	Confident	77 Å²	77	45.9 Å²	45.9	30%	0.302	23%	0.23	S	C	.	.	H	α-helix	trans	-63.7	-42.9	174.2	-178.7	-120.2	0	0	0	112.1	V313 V314 L315 I319 L320 L321 A481 S484 S485	V313-Y317 WeakPolarHBondContact O-CB 2.92Å; V313-Y317 PolarHBondContact O-N 3.18Å; V314-Y317 PolarHBondContact O-N 2.96Å; L315-Y317 VanDerWaalsContact C-N 3.34Å; Y317-I319 VanDerWaalsContact C-N 3.27Å; Y317-I319 PolarHBondContact O-N 3.26Å; Y317-L320 PolarHBondContact O-N 2.92Å; Y317-L321 HydrophobicContact CE2-CD1 4.5Å; Y317-A481 WeakPolarHBondContact OH-CA 3.39Å; Y317-A481 PolarHBondContact OH-O 2.79Å; Y317-S484 WeakPolarHBondContact CE1-OG 3.25Å; Y317-S484 PolarHBondContact OH-OG 3.41Å; Y317-S485 VanDerWaalsContact CE1-CA 3.47Å; Y317-S485 VanDerWaalsContact CE1-CB 3.43Å
318	S	80.8	Confident	72.3	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.007	21%	0.209	C	C	.	.	H	α-helix	trans	-61	-34.8	175.8	-59.3	0	0	0	0	113	V314 L315	V314-S318 PolarHBondContact O-N 3.32Å; V314-S318 PolarHBondContact O-OG 3.02Å; V314-S318 VanDerWaalsContact O-OG 3.1Å; L315-S318 PolarHBondContact O-N 3.32Å
319	I	75.5	Confident	69.7	Low	3 Å²	3	47.7 Å²	47.7	2%	0.015	25%	0.249	C	C	.	.	H	α-helix	trans	-83.1	-32.1	-177.4	-54.3	165.4	0	0	0	111.8	L315 S316 Y317 L321 M322 W409 L412 I416 V436	L315-I319 VanDerWaalsContact O-CG1 3.25Å; L315-I319 WeakPolarHBondContact O-CG1 3.41Å; L315-I319 PolarHBondContact O-N 3.47Å; S316-I319 PolarHBondContact O-N 3.18Å; Y317-I319 VanDerWaalsContact C-N 3.27Å; Y317-I319 PolarHBondContact O-N 3.26Å; I319-L321 PolarHBondContact O-N 3.44Å; I319-L321 VanDerWaalsContact O-N 3.1Å; I319-M322 HydrophobicContact CB-SD 4.32Å; I319-M322 HydrophobicContact CG2-SD 3.77Å; I319-M322 WeakPolarHBondContact O-CB 3.46Å; I319-M322 WeakPolarHBondContact O-CG 3.01Å; I319-M322 PolarHBondContact O-N 3.42Å; I319-M322 VanDerWaalsContact O-N 3.09Å; I319-W409 HydrophobicContact CG2-CD2 4.47Å; I319-W409 HydrophobicContact CG2-CE3 3.59Å; I319-W409 HydrophobicContact CG2-CH2 3.72Å; I319-W409 HydrophobicContact CG2-CZ3 3.14Å; I319-L412 HydrophobicContact CD1-CB 4.16Å; I319-L412 HydrophobicContact CG1-CB 3.92Å; I319-L412 HydrophobicContact CG1-CD1 3.68Å; I319-L412 HydrophobicContact CG1-CG 4.36Å; I319-I416 HydrophobicContact CD1-CD1 3.5Å; I319-V436 HydrophobicContact CB-CG2 3.91Å; I319-V436 HydrophobicContact CG2-CB 4.43Å; I319-V436 HydrophobicContact CG2-CG2 3.16Å
320	L	72.6	Confident	67.8	Low	51 Å²	51	45.6 Å²	45.6	27%	0.267	25%	0.254	S	S	.	.	H	α-helix	trans	-55.2	-31.7	178.9	-177.3	146.5	0	0	0	113.1	S316 Y317 M322	S316-L320 PolarHBondContact O-N 2.98Å; Y317-L320 PolarHBondContact O-N 2.92Å; L320-M322 VanDerWaalsContact C-N 3.32Å; L320-M322 PolarHBondContact O-N 2.77Å
321	L	67.5	Low	66.4	Low	29 Å²	29	47.1 Å²	47.1	15%	0.152	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-82	-5.3	-176.6	-62.6	174.9	0	0	0	114.5	Y317 I319 F323 A481 A482	Y317-L321 HydrophobicContact CE2-CD1 4.5Å; I319-L321 PolarHBondContact O-N 3.44Å; I319-L321 VanDerWaalsContact O-N 3.1Å; L321-F323 PolarHBondContact O-N 3.01Å; L321-A481 HydrophobicContact CD1-CB 3.82Å; L321-A481 WeakPolarHBondContact CD1-O 3.47Å; L321-A481 HydrophobicContact CD2-CB 3.72Å; L321-A481 HydrophobicContact CG-CB 4.46Å; L321-A482 HydrophobicContact CD1-CB 4.36Å
322	M	65.9	Low	65.4	Low	34 Å²	34	47.7 Å²	47.7	17%	0.167	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-76	-20.4	-172.6	-66.4	179.5	129.5	0	0	115	I319 L320 S324 L408 W409 L412	I319-M322 HydrophobicContact CB-SD 4.32Å; I319-M322 HydrophobicContact CG2-SD 3.77Å; I319-M322 WeakPolarHBondContact O-CB 3.46Å; I319-M322 WeakPolarHBondContact O-CG 3.01Å; I319-M322 PolarHBondContact O-N 3.42Å; I319-M322 VanDerWaalsContact O-N 3.09Å; L320-M322 VanDerWaalsContact C-N 3.32Å; L320-M322 PolarHBondContact O-N 2.77Å; M322-S324 PolarHBondContact O-N 3.03Å; M322-S324 VanDerWaalsContact O-N 3.15Å; M322-L408 VanDerWaalsContact CE-C 3.48Å; M322-L408 HydrophobicContact CE-CB 3.55Å; M322-L408 HydrophobicContact CE-CD1 4.42Å; M322-L408 HydrophobicContact CE-CD2 3.22Å; M322-L408 HydrophobicContact CE-CG 3.11Å; M322-W409 HydrophobicContact CE-CB 4.2Å; M322-W409 VanDerWaalsContact CE-N 3.33Å; M322-W409 HydrophobicContact SD-CB 4.23Å; M322-W409 HydrophobicContact SD-CD2 4.35Å; M322-W409 HydrophobicContact SD-CE3 3.49Å; M322-W409 HydrophobicContact SD-CZ3 4.23Å; M322-L412 HydrophobicContact CE-CD1 3.6Å; M322-L412 HydrophobicContact SD-CD1 4.04Å
323	F	55.9	Low	64.7	Low	86 Å²	86	50.4 Å²	50.4	38%	0.377	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-79.6	9.9	-171.3	-112.4	-89.2	0	0	0	115.4	L321 M325 V436	L321-F323 PolarHBondContact O-N 3.01Å; F323-M325 PolarHBondContact O-N 3.16Å; F323-V436 HydrophobicContact CD2-CG1 3.35Å; F323-V436 HydrophobicContact CE2-CG1 3.41Å; F323-V436 VanDerWaalsContact CE2-CG1 3.41Å
324	S	49.9	Very low	64	Low	14 Å²	14	51.9 Å²	51.9	10%	0.098	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	7.6	-167.2	-57.5	0	0	0	0	115.2	M322 M377	M322-S324 PolarHBondContact O-N 3.03Å; M322-S324 VanDerWaalsContact O-N 3.15Å; S324-M377 VanDerWaalsContact CB-CE 3.42Å
325	M	48.8	Very low	63.4	Low	28 Å²	28	53.1 Å²	53.1	14%	0.138	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134	19.8	-166.8	-65.7	-60	-139.6	0	0	117.4	F323 Y339 M377 A401 W475	F323-M325 PolarHBondContact O-N 3.16Å; M325-Y339 PolarHBondContact O-OH 2.95Å; M325-M377 HydrophobicContact CE-CE 3.56Å; M325-M377 HydrophobicContact CE-CG 3.69Å; M325-M377 HydrophobicContact CE-SD 3.18Å; M325-M377 WeakPolarHBondContact CE-SD 3.23Å; M325-M377 HydrophobicContact CG-CE 3.73Å; M325-M377 HydrophobicContact SD-CE 3.65Å; M325-M377 HydrophobicContact SD-SD 3.87Å; M325-A401 HydrophobicContact CE-CB 4.32Å; M325-W475 HydrophobicContact SD-CZ3 4.34Å
326	D	49.3	Very low	62.9	Low	86 Å²	86	54.7 Å²	54.7	46%	0.46	30%	0.302	S	S	.	.			trans	-93.7	9.7	-169.5	-65.6	-29.9	0	0	0	116.3	L328 Y339	D326-L328 PolarHBondContact O-N 3.28Å; D326-Y339 PolarHBondContact OD1-OH 2.65Å; D326-Y339 VanDerWaalsContact OD1-OH 3.13Å
327	D	40.5	Very low	62.9	Low	135 Å²	135	54.9 Å²	54.9	72%	0.722	30%	0.303	S	S	*	.			trans	-87.2	92	-178.9	-79.7	-14.8	0	0	0	112.6
328	L	43	Very low	62.8	Low	53 Å²	53	54.9 Å²	54.9	28%	0.277	31%	0.307	S	S	.	.			trans	-96	120	165.1	-117.9	76.4	0	0	0	111.4	D326 N335 Y339 V398	D326-L328 PolarHBondContact O-N 3.28Å; L328-N335 HydrophobicContact CD2-CB 4.22Å; L328-Y339 HydrophobicContact CD1-CD2 3.64Å; L328-Y339 HydrophobicContact CD1-CE2 3.84Å; L328-Y339 HydrophobicContact CD2-CD2 4.16Å; L328-Y339 HydrophobicContact CG-CD2 4.46Å; L328-V398 HydrophobicContact CD1-CG1 3.65Å
329	V	31.9	Very low	62.8	Low	145 Å²	145	56 Å²	56	88%	0.879	31%	0.312	S	S	*	.			trans	-77.7	126.3	176	-178.1	0	0	0	0	110.8	N335	V329-N335 VanDerWaalsContact C-ND2 3.33Å; V329-N335 PolarHBondContact O-ND2 3.36Å
330	G	47.7	Very low	63.1	Low	50 Å²	50	55.9 Å²	55.9	52%	0.515	31%	0.312	S	S	.	.	S	Bend	trans	141.4	-158.6	171.3	0	0	0	0	0	113.4	I332 N335	G330-I332 PolarHBondContact O-N 3.34Å; G330-N335 VanDerWaalsContact C-ND2 3.29Å; G330-N335 WeakPolarHBondContact CA-ND2 3.29Å; G330-N335 PolarHBondContact N-ND2 2.92Å
331	S	58.7	Low	63.8	Low	65 Å²	65	57 Å²	57	46%	0.455	32%	0.318	S	S	.	.			trans	-62.9	117.7	-177.3	59.9	0	0	0	0	111.1	Y333 L334 N335	S331-Y333 VanDerWaalsContact C-N 3.33Å; S331-Y333 PolarHBondContact O-N 2.69Å; S331-L334 PolarHBondContact O-N 3.16Å; S331-N335 WeakPolarHBondContact O-CB 3.24Å; S331-N335 VanDerWaalsContact O-CG 3.31Å; S331-N335 PolarHBondContact O-N 3.37Å
332	I	67.9	Low	64.7	Low	52 Å²	52	58.8 Å²	58.8	27%	0.267	32%	0.324	S	S	.	.	H	α-helix	trans	-57.2	-44.5	-168.9	-51.6	-163.3	0	0	0	111.9	F56 F59 G330 S336	F56-I332 HydrophobicContact CD1-CG2 4.1Å; F56-I332 HydrophobicContact CE1-CG2 3.78Å; F59-I332 HydrophobicContact CB-CD1 4.07Å; F59-I332 HydrophobicContact CD1-CD1 4.2Å; F59-I332 HydrophobicContact CD1-CG1 4.5Å; F59-I332 HydrophobicContact CD2-CD1 3.05Å; F59-I332 HydrophobicContact CD2-CG1 3.94Å; F59-I332 HydrophobicContact CE1-CD1 4.43Å; F59-I332 HydrophobicContact CE1-CG1 4.37Å; F59-I332 HydrophobicContact CE2-CD1 3.34Å; F59-I332 HydrophobicContact CE2-CG1 3.77Å; F59-I332 HydrophobicContact CG-CD1 3.52Å; F59-I332 HydrophobicContact CG-CG1 4.27Å; F59-I332 HydrophobicContact CZ-CD1 4.04Å; F59-I332 HydrophobicContact CZ-CG1 4Å; G330-I332 PolarHBondContact O-N 3.34Å; I332-S336 WeakPolarHBondContact O-CB 3.42Å; I332-S336 PolarHBondContact O-N 2.88Å; I332-S336 PolarHBondContact O-OG 3.4Å
333	Y	71.5	Confident	65.7	Low	68 Å²	68	57.5 Å²	57.5	27%	0.267	32%	0.318	S	S	.	.	H	α-helix	trans	-63.9	-56.6	-176.8	-57.8	-71.1	0	0	0	113	F56 A216 S331 S336 A337	F56-Y333 HydrophobicContact CB-CE1 4.36Å; F56-Y333 AromaticContact CD1-CD1 3.84Å; F56-Y333 HydrophobicContact CD1-CD1 3.84Å; F56-Y333 AromaticContact CD1-CE1 3.5Å; F56-Y333 HydrophobicContact CD1-CE1 3.5Å; F56-Y333 HydrophobicContact CD2-CE1 4.46Å; F56-Y333 AromaticContact CE1-CD1 3.6Å; F56-Y333 HydrophobicContact CE1-CD1 3.6Å; F56-Y333 AromaticContact CE1-CE1 3.79Å; F56-Y333 HydrophobicContact CE1-CE1 3.79Å; F56-Y333 HydrophobicContact CG-CD1 4.48Å; F56-Y333 AromaticContact CG-CE1 3.9Å; F56-Y333 HydrophobicContact CG-CE1 3.9Å; F56-Y333 HydrophobicContact CZ-CD1 4.03Å; F56-Y333 HydrophobicContact CZ-CE1 4.38Å; A216-Y333 HydrophobicContact CB-CD1 4.05Å; A216-Y333 HydrophobicContact CB-CE1 3.86Å; S331-Y333 VanDerWaalsContact C-N 3.33Å; S331-Y333 PolarHBondContact O-N 2.69Å; Y333-S336 PolarHBondContact O-N 2.7Å; Y333-A337 WeakPolarHBondContact O-CB 3.01Å; Y333-A337 PolarHBondContact O-N 2.7Å
334	L	74.4	Confident	67.3	Low	104 Å²	104	56.5 Å²	56.5	55%	0.545	31%	0.312	S	S	.	.	H	α-helix	trans	-69.1	-40.1	-176	-175.2	66.2	0	0	0	111.4	S331 A337 I338	S331-L334 PolarHBondContact O-N 3.16Å; L334-A337 PolarHBondContact O-N 2.91Å; L334-I338 HydrophobicContact CD1-CD1 4.11Å; L334-I338 HydrophobicContact CD1-CG1 4.35Å; L334-I338 HydrophobicContact CD2-CD1 4.36Å; L334-I338 HydrophobicContact CG-CD1 3.79Å; L334-I338 HydrophobicContact CG-CG1 4.4Å; L334-I338 WeakPolarHBondContact O-CB 3.46Å; L334-I338 VanDerWaalsContact O-CG1 3.27Å; L334-I338 WeakPolarHBondContact O-CG1 3.28Å; L334-I338 PolarHBondContact O-N 2.9Å
335	N	76.8	Confident	69.3	Low	32 Å²	32	59.6 Å²	59.6	17%	0.171	33%	0.327	C	S	.	.	H	α-helix	trans	-65	-42.3	177.7	-73.6	4.2	0	0	0	111.2	L328 V329 G330 S331 A337 I338 Y339	L328-N335 HydrophobicContact CD2-CB 4.22Å; V329-N335 VanDerWaalsContact C-ND2 3.33Å; V329-N335 PolarHBondContact O-ND2 3.36Å; G330-N335 VanDerWaalsContact C-ND2 3.29Å; G330-N335 WeakPolarHBondContact CA-ND2 3.29Å; G330-N335 PolarHBondContact N-ND2 2.92Å; S331-N335 WeakPolarHBondContact O-CB 3.24Å; S331-N335 VanDerWaalsContact O-CG 3.31Å; S331-N335 PolarHBondContact O-N 3.37Å; N335-A337 VanDerWaalsContact C-N 3.33Å; N335-A337 PolarHBondContact O-N 3.27Å; N335-I338 PolarHBondContact O-N 3.21Å; N335-Y339 WeakPolarHBondContact O-CB 3.36Å; N335-Y339 PolarHBondContact O-N 3.33Å
336	S	75.6	Confident	71.3	Confident	34 Å²	34	58.3 Å²	58.3	24%	0.238	32%	0.32	C	S	.	.	H	α-helix	trans	-64.6	-38.6	176.4	-59.4	0	0	0	0	111.7	I332 Y333 G340	I332-S336 WeakPolarHBondContact O-CB 3.42Å; I332-S336 PolarHBondContact O-N 2.88Å; I332-S336 PolarHBondContact O-OG 3.4Å; Y333-S336 PolarHBondContact O-N 2.7Å; S336-G340 PolarHBondContact O-N 3.47Å
337	A	81.8	Confident	73.3	Confident	6 Å²	6	54.2 Å²	54.2	5%	0.05	30%	0.299	C	S	.	.	H	α-helix	trans	-65.8	-48.8	176.4	0	0	0	0	0	112	Y333 L334 N335 G340 L341	Y333-A337 WeakPolarHBondContact O-CB 3.01Å; Y333-A337 PolarHBondContact O-N 2.7Å; L334-A337 PolarHBondContact O-N 2.91Å; N335-A337 VanDerWaalsContact C-N 3.33Å; N335-A337 PolarHBondContact O-N 3.27Å; A337-G340 PolarHBondContact O-N 3.46Å; A337-L341 WeakPolarHBondContact O-CB 3.27Å; A337-L341 VanDerWaalsContact O-CG 3.28Å; A337-L341 WeakPolarHBondContact O-CG 3.45Å; A337-L341 PolarHBondContact O-N 3.3Å
338	I	83.1	Confident	75.8	Confident	76 Å²	76	49 Å²	49	39%	0.39	27%	0.27	S	S	.	.	H	α-helix	trans	-61.7	-46.5	178	-68.1	169.4	0	0	0	110.4	L334 N335 L341 F342	L334-I338 HydrophobicContact CD1-CD1 4.11Å; L334-I338 HydrophobicContact CD1-CG1 4.35Å; L334-I338 HydrophobicContact CD2-CD1 4.36Å; L334-I338 HydrophobicContact CG-CD1 3.79Å; L334-I338 HydrophobicContact CG-CG1 4.4Å; L334-I338 WeakPolarHBondContact O-CB 3.46Å; L334-I338 VanDerWaalsContact O-CG1 3.27Å; L334-I338 WeakPolarHBondContact O-CG1 3.28Å; L334-I338 PolarHBondContact O-N 2.9Å; N335-I338 PolarHBondContact O-N 3.21Å; I338-L341 PolarHBondContact O-N 3.28Å; I338-F342 WeakPolarHBondContact O-CB 3.48Å; I338-F342 PolarHBondContact O-N 2.97Å
339	Y	79.8	Confident	78.2	Confident	24 Å²	24	49.7 Å²	49.7	9%	0.094	28%	0.277	C	S	.	.	H	α-helix	trans	-61.8	-46.7	178.2	-170.8	-97.4	0	0	0	111.7	M325 D326 L328 N335 L341 F342 N343 A402	M325-Y339 PolarHBondContact O-OH 2.95Å; D326-Y339 PolarHBondContact OD1-OH 2.65Å; D326-Y339 VanDerWaalsContact OD1-OH 3.13Å; L328-Y339 HydrophobicContact CD1-CD2 3.64Å; L328-Y339 HydrophobicContact CD1-CE2 3.84Å; L328-Y339 HydrophobicContact CD2-CD2 4.16Å; L328-Y339 HydrophobicContact CG-CD2 4.46Å; N335-Y339 WeakPolarHBondContact O-CB 3.36Å; N335-Y339 PolarHBondContact O-N 3.33Å; Y339-L341 PolarHBondContact O-N 3.01Å; Y339-F342 PolarHBondContact O-N 3.19Å; Y339-N343 WeakPolarHBondContact CD1-ND2 3.27Å; Y339-N343 WeakPolarHBondContact CE1-ND2 3.3Å; Y339-N343 WeakPolarHBondContact O-CB 3.45Å; Y339-N343 PolarHBondContact O-N 2.88Å; Y339-A402 HydrophobicContact CD2-CB 4.15Å; Y339-A402 HydrophobicContact CE2-CB 3.39Å
340	G	82.3	Confident	81	Confident	2 Å²	2	43.6 Å²	43.6	2%	0.021	24%	0.24	C	C	.	.	H	α-helix	trans	-60.7	-41.7	176.3	0	0	0	0	0	113	S336 A337 W344	S336-G340 PolarHBondContact O-N 3.47Å; A337-G340 PolarHBondContact O-N 3.46Å; G340-W344 WeakPolarHBondContact O-CB 3.28Å; G340-W344 PolarHBondContact O-N 3.18Å
341	L	87.2	Confident	83	Confident	75 Å²	75	41.3 Å²	41.3	39%	0.393	22%	0.217	S	C	.	.	H	α-helix	trans	-65.2	-42.9	174.3	-73.9	171.1	0	0	0	111.7	A210 A337 I338 Y339 W344 L345	A210-L341 HydrophobicContact CB-CD2 4.13Å; A210-L341 HydrophobicContact CB-CG 3.97Å; A337-L341 WeakPolarHBondContact O-CB 3.27Å; A337-L341 VanDerWaalsContact O-CG 3.28Å; A337-L341 WeakPolarHBondContact O-CG 3.45Å; A337-L341 PolarHBondContact O-N 3.3Å; I338-L341 PolarHBondContact O-N 3.28Å; Y339-L341 PolarHBondContact O-N 3.01Å; L341-W344 HydrophobicContact CD2-CE3 4.48Å; L341-W344 WeakPolarHBondContact O-CB 3.48Å; L341-W344 PolarHBondContact O-N 3.04Å; L341-L345 VanDerWaalsContact O-CG 3.31Å; L341-L345 WeakPolarHBondContact O-CG 3.4Å; L341-L345 PolarHBondContact O-N 3.18Å
342	F	87.1	Confident	84.5	Confident	65 Å²	65	43.5 Å²	43.5	29%	0.285	22%	0.218	S	C	.	.	H	α-helix	trans	-64.8	-42.6	179.3	-159.7	-107	0	0	0	112.1	I338 Y339 W344 L345 G346 F399 A402 F403	I338-F342 WeakPolarHBondContact O-CB 3.48Å; I338-F342 PolarHBondContact O-N 2.97Å; Y339-F342 PolarHBondContact O-N 3.19Å; F342-W344 VanDerWaalsContact C-N 3.33Å; F342-W344 PolarHBondContact O-N 2.94Å; F342-L345 PolarHBondContact O-N 2.79Å; F342-G346 PolarHBondContact O-N 3.2Å; F342-F399 HydrophobicContact CD1-CB 4.49Å; F342-F399 AromaticContact CD1-CD1 3.81Å; F342-F399 HydrophobicContact CD1-CD1 3.81Å; F342-F399 HydrophobicContact CE1-CB 3.85Å; F342-F399 AromaticContact CE1-CD1 3.91Å; F342-F399 HydrophobicContact CE1-CD1 3.91Å; F342-F399 HydrophobicContact CE1-CG 4.36Å; F342-F399 WeakPolarHBondContact CE1-O 3.4Å; F342-F399 HydrophobicContact CG-CD1 4.16Å; F342-F399 HydrophobicContact CZ-CB 4.29Å; F342-F399 HydrophobicContact CZ-CD1 4.4Å; F342-A402 HydrophobicContact CD1-CB 4.42Å; F342-F403 HydrophobicContact CD1-CB 4.14Å; F342-F403 HydrophobicContact CD1-CD2 4.32Å; F342-F403 HydrophobicContact CE1-CB 3.61Å; F342-F403 AromaticContact CE1-CD2 3.92Å; F342-F403 HydrophobicContact CE1-CD2 3.92Å; F342-F403 HydrophobicContact CE1-CG 4.22Å; F342-F403 HydrophobicContact CE2-CD2 4.42Å; F342-F403 HydrophobicContact CZ-CB 4.3Å; F342-F403 AromaticContact CZ-CD2 3.96Å; F342-F403 HydrophobicContact CZ-CD2 3.96Å
343	N	85.8	Confident	85.5	Confident	7 Å²	7	43.6 Å²	43.6	4%	0.037	22%	0.221	C	C	.	.	H	α-helix	trans	-59.4	-43.7	171.3	-78.5	-1.6	0	0	0	111.7	N206 Y339 G346 G347 A402 S406	N206-N343 HydrophobicContact CB-CB 4.01Å; Y339-N343 WeakPolarHBondContact CD1-ND2 3.27Å; Y339-N343 WeakPolarHBondContact CE1-ND2 3.3Å; Y339-N343 WeakPolarHBondContact O-CB 3.45Å; Y339-N343 PolarHBondContact O-N 2.88Å; N343-G346 PolarHBondContact O-N 2.93Å; N343-G347 PolarHBondContact O-N 2.82Å; N343-A402 WeakPolarHBondContact OD1-CA 3.41Å; N343-A402 VanDerWaalsContact OD1-CB 3.3Å; N343-A402 WeakPolarHBondContact OD1-CB 3.34Å; N343-A402 PolarHBondContact OD1-O 3.45Å; N343-S406 WeakPolarHBondContact O-CB 3.44Å; N343-S406 PolarHBondContact O-OG 2.94Å
344	W	89.7	Confident	86.3	Confident	65 Å²	65	40.7 Å²	40.7	25%	0.246	21%	0.21	C	C	.	.	H	α-helix	trans	-62.4	-45.4	177.1	178.6	65.6	0	0	0	111.6	A201 I202 N206 I207 G340 L341 F342 G346 G347 I348	A201-W344 PolarHBondContact O-NE1 3.37Å; I202-W344 PolarHBondContact O-NE1 3.46Å; N206-W344 HydrophobicContact CB-CB 4.24Å; I207-W344 HydrophobicContact CB-CB 4.44Å; I207-W344 HydrophobicContact CB-CD2 4.27Å; I207-W344 HydrophobicContact CB-CG 3.89Å; I207-W344 HydrophobicContact CD1-CD2 3.92Å; I207-W344 HydrophobicContact CD1-CE3 4.36Å; I207-W344 HydrophobicContact CD1-CG 4.43Å; I207-W344 HydrophobicContact CD1-CH2 4.12Å; I207-W344 HydrophobicContact CD1-CZ2 3.65Å; I207-W344 HydrophobicContact CD1-CZ3 4.46Å; I207-W344 HydrophobicContact CG2-CG 4.49Å; G340-W344 WeakPolarHBondContact O-CB 3.28Å; G340-W344 PolarHBondContact O-N 3.18Å; L341-W344 HydrophobicContact CD2-CE3 4.48Å; L341-W344 WeakPolarHBondContact O-CB 3.48Å; L341-W344 PolarHBondContact O-N 3.04Å; F342-W344 VanDerWaalsContact C-N 3.33Å; F342-W344 PolarHBondContact O-N 2.94Å; W344-G346 VanDerWaalsContact C-N 3.29Å; W344-G346 PolarHBondContact O-N 3.42Å; W344-G347 WeakPolarHBondContact O-CA 3.35Å; W344-G347 PolarHBondContact O-N 3.3Å; W344-I348 HydrophobicContact CD2-CG1 4.22Å; W344-I348 HydrophobicContact CZ2-CD1 3.97Å; W344-I348 HydrophobicContact CZ2-CG1 4.12Å; W344-I348 WeakPolarHBondContact O-CG1 3.3Å; W344-I348 PolarHBondContact O-N 3.45Å
345	L	92.2	Very high	86.8	Confident	80 Å²	80	42.3 Å²	42.3	42%	0.419	21%	0.209	S	C	.	.	H	α-helix	trans	-56.7	-41.6	175.1	-71	174.5	0	0	0	112.3	L341 F342 G347 I348 V349 F403	L341-L345 VanDerWaalsContact O-CG 3.31Å; L341-L345 WeakPolarHBondContact O-CG 3.4Å; L341-L345 PolarHBondContact O-N 3.18Å; F342-L345 PolarHBondContact O-N 2.79Å; L345-G347 VanDerWaalsContact C-N 3.31Å; L345-G347 PolarHBondContact O-N 2.97Å; L345-I348 PolarHBondContact O-N 3.35Å; L345-V349 WeakPolarHBondContact O-CG2 3.48Å; L345-V349 PolarHBondContact O-N 3.05Å; L345-F403 HydrophobicContact CB-CE2 4.32Å
346	G	91.4	Very high	87.3	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-56.5	-43.1	173.4	0	0	0	0	0	113.3	F342 N343 W344 C350 F403	F342-G346 PolarHBondContact O-N 3.2Å; N343-G346 PolarHBondContact O-N 2.93Å; W344-G346 VanDerWaalsContact C-N 3.29Å; W344-G346 PolarHBondContact O-N 3.42Å; G346-C350 VanDerWaalsContact O-CB 3.29Å; G346-C350 WeakPolarHBondContact O-CB 3.44Å; G346-C350 PolarHBondContact O-N 3.27Å; G346-C350 VanDerWaalsContact O-N 3.07Å; G346-F403 VanDerWaalsContact CA-CE2 3.47Å; G346-F403 WeakPolarHBondContact CA-O 3.38Å
347	G	91.3	Very high	87.8	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60.8	-47.1	174.8	0	0	0	0	0	113	N343 W344 L345 S351	N343-G347 PolarHBondContact O-N 2.82Å; W344-G347 WeakPolarHBondContact O-CA 3.35Å; W344-G347 PolarHBondContact O-N 3.3Å; L345-G347 VanDerWaalsContact C-N 3.31Å; L345-G347 PolarHBondContact O-N 2.97Å; G347-S351 WeakPolarHBondContact O-CB 3.38Å; G347-S351 PolarHBondContact O-N 2.95Å; G347-S351 PolarHBondContact O-OG 2.93Å
348	I	92.5	Very high	87.7	Confident	25 Å²	25	60.2 Å²	60.2	13%	0.128	28%	0.283	C	S	.	.	H	α-helix	trans	-61.9	-52.2	179.3	-62.3	-64.2	0	0	0	111.1	A201 I202 W344 L345 C350 S351 F352	A201-I348 VanDerWaalsContact O-CD1 3.24Å; A201-I348 WeakPolarHBondContact O-CD1 3.28Å; I202-I348 VanDerWaalsContact CA-CD1 3.48Å; I202-I348 HydrophobicContact CB-CD1 4.39Å; I202-I348 HydrophobicContact CG1-CD1 4.04Å; W344-I348 HydrophobicContact CD2-CG1 4.22Å; W344-I348 HydrophobicContact CZ2-CD1 3.97Å; W344-I348 HydrophobicContact CZ2-CG1 4.12Å; W344-I348 WeakPolarHBondContact O-CG1 3.3Å; W344-I348 PolarHBondContact O-N 3.45Å; L345-I348 PolarHBondContact O-N 3.35Å; I348-C350 VanDerWaalsContact C-N 3.33Å; I348-C350 PolarHBondContact O-N 2.84Å; I348-S351 WeakPolarHBondContact O-CB 3.36Å; I348-S351 PolarHBondContact O-N 3.49Å; I348-S351 VanDerWaalsContact O-N 3.12Å; I348-F352 HydrophobicContact CG2-CD2 3.59Å; I348-F352 HydrophobicContact CG2-CE2 3.43Å; I348-F352 VanDerWaalsContact CG2-CE2 3.43Å; I348-F352 VanDerWaalsContact O-CD2 3.24Å; I348-F352 WeakPolarHBondContact O-CD2 3.49Å; I348-F352 PolarHBondContact O-N 3.16Å
349	V	92.7	Very high	87.5	Confident	69 Å²	69	68.5 Å²	68.5	42%	0.418	31%	0.309	S	S	.	.	H	α-helix	trans	-60.1	-45.9	-177.8	171.3	0	0	0	0	110.4	L345 S351 F352 V353 F403	L345-V349 WeakPolarHBondContact O-CG2 3.48Å; L345-V349 PolarHBondContact O-N 3.05Å; V349-S351 VanDerWaalsContact C-N 3.28Å; V349-S351 PolarHBondContact O-N 3.46Å; V349-F352 PolarHBondContact O-N 3.44Å; V349-V353 WeakPolarHBondContact O-CG2 3.21Å; V349-V353 PolarHBondContact O-N 3.44Å; V349-F403 HydrophobicContact CB-CZ 3.87Å; V349-F403 HydrophobicContact CG1-CE1 4.47Å; V349-F403 HydrophobicContact CG1-CZ 4.1Å; V349-F403 HydrophobicContact CG2-CZ 3.97Å
350	C	91	Very high	87.6	Confident	16 Å²	16	70.3 Å²	70.3	11%	0.108	32%	0.317	C	S	.	.	H	α-helix	trans	-61.7	-37.5	177.5	-165.9	0	0	0	0	112.3	G346 I348 V353 D354 M365 P407	G346-C350 VanDerWaalsContact O-CB 3.29Å; G346-C350 WeakPolarHBondContact O-CB 3.44Å; G346-C350 PolarHBondContact O-N 3.27Å; G346-C350 VanDerWaalsContact O-N 3.07Å; I348-C350 VanDerWaalsContact C-N 3.33Å; I348-C350 PolarHBondContact O-N 2.84Å; C350-V353 PolarHBondContact O-N 3.49Å; C350-D354 PolarHBondContact O-N 2.88Å; C350-M365 PolarHBondContact SG-SD 2.88Å; C350-P407 HydrophobicContact CB-CB 3.42Å; C350-P407 VanDerWaalsContact CB-CB 3.42Å; C350-P407 HydrophobicContact CB-CG 4.15Å
351	S	90.2	Very high	87.8	Confident	3 Å²	3	70.6 Å²	70.6	2%	0.021	32%	0.32	C	S	.	.	H	α-helix	trans	-67.5	-37.3	176.5	-59.1	0	0	0	0	112.9	A201 G347 I348 V349 R355	A201-S351 WeakPolarHBondContact CB-OG 3.48Å; G347-S351 WeakPolarHBondContact O-CB 3.38Å; G347-S351 PolarHBondContact O-N 2.95Å; G347-S351 PolarHBondContact O-OG 2.93Å; I348-S351 WeakPolarHBondContact O-CB 3.36Å; I348-S351 PolarHBondContact O-N 3.49Å; I348-S351 VanDerWaalsContact O-N 3.12Å; V349-S351 VanDerWaalsContact C-N 3.28Å; V349-S351 PolarHBondContact O-N 3.46Å; S351-R355 WeakPolarHBondContact O-CB 3.35Å; S351-R355 PolarHBondContact O-N 2.81Å
352	F	89.9	Confident	87.8	Confident	110 Å²	110	67.2 Å²	67.2	48%	0.482	30%	0.302	S	S	.	.	H	α-helix	trans	-66.8	-39	171.9	-81.9	-69.9	0	0	0	112	I348 V349 R355 T356	I348-F352 HydrophobicContact CG2-CD2 3.59Å; I348-F352 HydrophobicContact CG2-CE2 3.43Å; I348-F352 VanDerWaalsContact CG2-CE2 3.43Å; I348-F352 VanDerWaalsContact O-CD2 3.24Å; I348-F352 WeakPolarHBondContact O-CD2 3.49Å; I348-F352 PolarHBondContact O-N 3.16Å; V349-F352 PolarHBondContact O-N 3.44Å; F352-R355 PolarHBondContact O-N 3.42Å; F352-T356 VanDerWaalsContact O-CB 3.31Å; F352-T356 WeakPolarHBondContact O-CB 3.1Å; F352-T356 PolarHBondContact O-N 3.07Å; F352-T356 PolarHBondContact O-OG1 3.44Å
353	V	90.3	Very high	87.9	Confident	55 Å²	55	66.9 Å²	66.9	33%	0.333	30%	0.3	S	S	.	.	H	α-helix	trans	-61.8	-47.8	173.9	171.7	0	0	0	0	110.5	V349 C350 R355 T356 F357	V349-V353 WeakPolarHBondContact O-CG2 3.21Å; V349-V353 PolarHBondContact O-N 3.44Å; C350-V353 PolarHBondContact O-N 3.49Å; V353-R355 VanDerWaalsContact C-N 3.31Å; V353-R355 PolarHBondContact O-N 2.98Å; V353-T356 PolarHBondContact O-N 3.04Å; V353-F357 HydrophobicContact CG1-CD2 3.9Å; V353-F357 HydrophobicContact CG1-CE2 4.44Å; V353-F357 WeakPolarHBondContact O-CD2 3.36Å; V353-F357 PolarHBondContact O-N 2.73Å
354	D	87.6	Confident	88.1	Confident	7 Å²	7	71.9 Å²	71.9	4%	0.037	32%	0.323	C	S	.	.	H	α-helix	trans	-58.5	-42.7	176.4	-175.6	67.6	0	0	0	111.7	L197 C350 M365 K497	L197-D354 HydrophobicContact CD2-CB 3.45Å; L197-D354 VanDerWaalsContact CD2-CB 3.45Å; C350-D354 PolarHBondContact O-N 2.88Å; D354-M365 HydrophobicContact CB-SD 4.14Å; D354-K497 VanDerWaalsContact CG-NZ 3.29Å; D354-K497 PolarHBondContact O-NZ 3.46Å; D354-K497 VanDerWaalsContact OD1-CE 3.26Å; D354-K497 WeakPolarHBondContact OD1-CE 3.03Å; D354-K497 IonicContact OD1-NZ 2.82Å; D354-K497 PolarHBondContact OD1-NZ 3.12Å; D354-K497 IonicContact OD2-NZ 3.92Å
355	R	85.2	Confident	88.1	Confident	138 Å²	138	68.9 Å²	68.9	52%	0.521	31%	0.312	S	S	.	.	H	α-helix	trans	-67.4	-40.1	179	-175.1	178.7	173.4	113.6	-4.4	112.6	N195 S351 F352 V353	N195-R355 PolarHBondContact OD1-NH1 2.67Å; S351-R355 WeakPolarHBondContact O-CB 3.35Å; S351-R355 PolarHBondContact O-N 2.81Å; F352-R355 PolarHBondContact O-N 3.42Å; V353-R355 VanDerWaalsContact C-N 3.31Å; V353-R355 PolarHBondContact O-N 2.98Å
356	T	87.5	Confident	88.1	Confident	99 Å²	99	65.1 Å²	65.1	61%	0.607	29%	0.292	S	S	*	.	H	α-helix	trans	-75.8	-44.6	-175.8	-54.1	0	0	0	0	111.2	F352 V353 R358	F352-T356 VanDerWaalsContact O-CB 3.31Å; F352-T356 WeakPolarHBondContact O-CB 3.1Å; F352-T356 PolarHBondContact O-N 3.07Å; F352-T356 PolarHBondContact O-OG1 3.44Å; V353-T356 PolarHBondContact O-N 3.04Å; T356-R358 PolarHBondContact O-N 3.28Å
357	F	86.3	Confident	88	Confident	125 Å²	125	65.4 Å²	65.4	55%	0.548	30%	0.295	S	S	.	.			trans	-97.7	88	-177.6	-63.1	-79.5	0	0	0	111.2	V353 R359 F360 K497	V353-F357 HydrophobicContact CG1-CD2 3.9Å; V353-F357 HydrophobicContact CG1-CE2 4.44Å; V353-F357 WeakPolarHBondContact O-CD2 3.36Å; V353-F357 PolarHBondContact O-N 2.73Å; F357-R359 PolarHBondContact O-N 3.39Å; F357-F360 HydrophobicContact CB-CB 3.78Å; F357-F360 WeakPolarHBondContact O-CB 3.13Å; F357-F360 PolarHBondContact O-N 3.17Å; F357-K497 PolarHBondContact O-NZ 2.94Å; F357-K497 VanDerWaalsContact O-NZ 3.16Å
358	R	77.9	Confident	88	Confident	224 Å²	224	68.4 Å²	68.4	85%	0.845	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-31.9	178.5	-68.3	-173.9	179.1	177.5	0.8	114	T356 F360	T356-R358 PolarHBondContact O-N 3.28Å; R358-F360 VanDerWaalsContact C-N 3.32Å
359	R	79.2	Confident	88	Confident	250 Å²	250	68.2 Å²	68.2	94%	0.943	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-21.1	178.2	-66.2	-176.5	-176.4	166.1	1.2	113.3	F357 G361	F357-R359 PolarHBondContact O-N 3.39Å; R359-G361 PolarHBondContact O-N 3.23Å
360	F	83.5	Confident	87.8	Confident	62 Å²	62	65.3 Å²	65.3	27%	0.272	30%	0.295	S	S	.	.	S	Bend	trans	-80.9	99.3	179.9	-160	-109.5	0	0	0	108.6	F357 R358 H364 M365 T368 K497	F357-F360 HydrophobicContact CB-CB 3.78Å; F357-F360 WeakPolarHBondContact O-CB 3.13Å; F357-F360 PolarHBondContact O-N 3.17Å; R358-F360 VanDerWaalsContact C-N 3.32Å; F360-H364 HydrophobicContact CD2-CB 4.22Å; F360-H364 HydrophobicContact CE2-CB 3.94Å; F360-H364 HydrophobicContact CZ-CB 4.21Å; F360-M365 HydrophobicContact CD1-CB 4.06Å; F360-M365 VanDerWaalsContact CE1-CA 3.42Å; F360-M365 HydrophobicContact CE1-CB 3.61Å; F360-M365 HydrophobicContact CE1-CG 4.11Å; F360-T368 HydrophobicContact CE2-CG2 4.45Å; F360-T368 HydrophobicContact CZ-CG2 3.96Å; F360-K497 VanDerWaalsContact O-CD 3.28Å; F360-K497 WeakPolarHBondContact O-CD 3.27Å; F360-K497 PolarHBondContact O-NZ 3.17Å
361	G	85.2	Confident	87.8	Confident	7 Å²	7	66.9 Å²	66.9	7%	0.072	31%	0.306	C	S	.	.			trans	-72	163.7	-178.4	0	0	0	0	0	113.7	R359 K363 H364 M365 E495	R359-G361 PolarHBondContact O-N 3.23Å; G361-K363 PolarHBondContact O-N 2.91Å; G361-H364 PolarHBondContact O-N 3.43Å; G361-M365 PolarHBondContact O-N 2.87Å; G361-E495 VanDerWaalsContact C-OE2 3.23Å; G361-E495 VanDerWaalsContact CA-CD 3.48Å; G361-E495 WeakPolarHBondContact CA-OE2 3.49Å
362	R	87.5	Confident	87.9	Confident	5 Å²	5	69.5 Å²	69.5	2%	0.019	32%	0.322	C	S	.	.	H	α-helix	trans	-60.4	-33.7	174.5	-76.5	95.6	-164.5	-130.9	5.9	111.2	K193 M365 V366 V415 E418 E495 T496 K497	K193-R362 PolarHBondContact O-NH2 2.97Å; R362-M365 HydrophobicContact CG-CE 4.22Å; R362-M365 PolarHBondContact O-N 2.99Å; R362-V366 WeakPolarHBondContact O-CG2 3.37Å; R362-V366 PolarHBondContact O-N 3.47Å; R362-V415 HydrophobicContact CB-CG2 4.29Å; R362-E418 IonicContact CZ-OE1 3.87Å; R362-E418 IonicContact CZ-OE2 2.69Å; R362-E418 IonicContact NH1-OE1 2.81Å; R362-E418 PolarHBondContact NH1-OE1 3.14Å; R362-E418 IonicContact NH1-OE2 3.71Å; R362-E418 PolarHBondContact NH1-OE2 3.17Å; R362-E495 WeakPolarHBondContact CB-OE1 3.23Å; R362-E495 VanDerWaalsContact N-CD 3.26Å; R362-E495 PolarHBondContact N-OE1 3.45Å; R362-E495 PolarHBondContact N-OE2 3.32Å; R362-E495 VanDerWaalsContact N-OE2 3.12Å; R362-T496 PolarHBondContact NH1-O 2.83Å; R362-K497 VanDerWaalsContact CD-CB 3.44Å; R362-K497 VanDerWaalsContact CD-N 3.31Å; R362-K497 VanDerWaalsContact NH1-CA 3.32Å
363	K	89.1	Confident	87.7	Confident	57 Å²	57	65.6 Å²	65.6	25%	0.248	31%	0.307	C	S	.	.	H	α-helix	trans	-64.1	-45.7	177.8	-176.7	175.6	180	164.5	0	111.9	G361 G367 F489 L490 I493 E495	G361-K363 PolarHBondContact O-N 2.91Å; K363-G367 PolarHBondContact O-N 3.44Å; K363-F489 HydrophobicContact CG-CE1 4.37Å; K363-L490 WeakPolarHBondContact CE-O 3.27Å; K363-L490 HydrophobicContact CG-CD2 3.91Å; K363-L490 PolarHBondContact NZ-O 3.18Å; K363-I493 PolarHBondContact NZ-O 3.33Å; K363-E495 WeakPolarHBondContact CB-OE2 3.41Å; K363-E495 PolarHBondContact N-OE2 3.18Å
364	H	90	Very high	87.5	Confident	113 Å²	113	63.5 Å²	63.5	52%	0.523	29%	0.294	S	S	.	.	H	α-helix	trans	-66.9	-41.1	177.1	-72.8	-74.6	0	0	0	111.4	F360 G361 G367 T368	F360-H364 HydrophobicContact CD2-CB 4.22Å; F360-H364 HydrophobicContact CE2-CB 3.94Å; F360-H364 HydrophobicContact CZ-CB 4.21Å; G361-H364 PolarHBondContact O-N 3.43Å; H364-G367 PolarHBondContact O-N 3.35Å; H364-T368 WeakPolarHBondContact O-CG2 3.25Å; H364-T368 PolarHBondContact O-N 2.87Å; H364-T368 PolarHBondContact O-OG1 3.48Å; H364-T368 VanDerWaalsContact O-OG1 3.05Å
365	M	90.7	Very high	87.7	Confident	2 Å²	2	67.6 Å²	67.6	1%	0.01	32%	0.319	C	S	.	.	H	α-helix	trans	-58.7	-53.6	176.5	-174.9	178.3	65.1	0	0	112.4	L197 C350 D354 F360 G361 R362 G367 T368 L369 S411	L197-M365 HydrophobicContact CD2-CE 3.91Å; L197-M365 HydrophobicContact CD2-SD 3.99Å; C350-M365 PolarHBondContact SG-SD 2.88Å; D354-M365 HydrophobicContact CB-SD 4.14Å; F360-M365 HydrophobicContact CD1-CB 4.06Å; F360-M365 VanDerWaalsContact CE1-CA 3.42Å; F360-M365 HydrophobicContact CE1-CB 3.61Å; F360-M365 HydrophobicContact CE1-CG 4.11Å; G361-M365 PolarHBondContact O-N 2.87Å; R362-M365 HydrophobicContact CG-CE 4.22Å; R362-M365 PolarHBondContact O-N 2.99Å; M365-G367 VanDerWaalsContact C-N 3.31Å; M365-G367 PolarHBondContact O-N 2.81Å; M365-T368 PolarHBondContact O-N 3.28Å; M365-T368 PolarHBondContact O-OG1 2.76Å; M365-L369 HydrophobicContact CG-CD1 4.05Å; M365-L369 WeakPolarHBondContact O-CB 3.46Å; M365-L369 VanDerWaalsContact O-CG 3.29Å; M365-L369 WeakPolarHBondContact O-CG 3.2Å; M365-L369 PolarHBondContact O-N 2.69Å; M365-S411 WeakPolarHBondContact CE-OG 3.4Å
366	V	90.2	Very high	87.8	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-60.6	-42.8	176.4	172.9	0	0	0	0	110.8	R362 T368 L369 L370 L408 L412 F489	R362-V366 WeakPolarHBondContact O-CG2 3.37Å; R362-V366 PolarHBondContact O-N 3.47Å; V366-T368 PolarHBondContact O-N 2.79Å; V366-L369 PolarHBondContact O-N 3.21Å; V366-L370 HydrophobicContact CG1-CD1 3.91Å; V366-L370 HydrophobicContact CG1-CG 4.45Å; V366-L370 WeakPolarHBondContact O-CB 3.34Å; V366-L370 WeakPolarHBondContact O-CG 3.35Å; V366-L370 PolarHBondContact O-N 3.3Å; V366-L408 HydrophobicContact CB-CD1 4.38Å; V366-L408 HydrophobicContact CG1-CD1 3.81Å; V366-L412 HydrophobicContact CG1-CD2 3.76Å; V366-L412 HydrophobicContact CG1-CG 4.29Å; V366-F489 HydrophobicContact CB-CD1 4.4Å; V366-F489 HydrophobicContact CB-CE1 3.57Å; V366-F489 HydrophobicContact CB-CZ 3.66Å; V366-F489 HydrophobicContact CG1-CD1 3.82Å; V366-F489 HydrophobicContact CG1-CD2 4.3Å; V366-F489 HydrophobicContact CG1-CE1 3.39Å; V366-F489 HydrophobicContact CG1-CE2 3.91Å; V366-F489 HydrophobicContact CG1-CG 4.27Å; V366-F489 HydrophobicContact CG1-CZ 3.45Å; V366-F489 VanDerWaalsContact CG1-CZ 3.45Å; V366-F489 HydrophobicContact CG2-CE1 4.36Å; V366-F489 HydrophobicContact CG2-CZ 3.96Å
367	G	91	Very high	87.5	Confident	6 Å²	6	57 Å²	57	6%	0.062	27%	0.269	C	S	.	.	H	α-helix	trans	-57.9	-46.5	175.9	0	0	0	0	0	113	K363 H364 M365 S371 Q486	K363-G367 PolarHBondContact O-N 3.44Å; H364-G367 PolarHBondContact O-N 3.35Å; M365-G367 VanDerWaalsContact C-N 3.31Å; M365-G367 PolarHBondContact O-N 2.81Å; G367-S371 PolarHBondContact O-N 3.37Å; G367-S371 PolarHBondContact O-OG 2.95Å; G367-Q486 PolarHBondContact O-NE2 3.4Å
368	T	91.5	Very high	87.5	Confident	64 Å²	64	54.5 Å²	54.5	39%	0.393	26%	0.261	S	S	.	.	H	α-helix	trans	-67.2	-40.8	178.5	49.7	0	0	0	0	112.6	F360 H364 M365 V366 S371 V372	F360-T368 HydrophobicContact CE2-CG2 4.45Å; F360-T368 HydrophobicContact CZ-CG2 3.96Å; H364-T368 WeakPolarHBondContact O-CG2 3.25Å; H364-T368 PolarHBondContact O-N 2.87Å; H364-T368 PolarHBondContact O-OG1 3.48Å; H364-T368 VanDerWaalsContact O-OG1 3.05Å; M365-T368 PolarHBondContact O-N 3.28Å; M365-T368 PolarHBondContact O-OG1 2.76Å; V366-T368 PolarHBondContact O-N 2.79Å; T368-S371 WeakPolarHBondContact O-CB 3.25Å; T368-S371 PolarHBondContact O-N 3.2Å; T368-V372 WeakPolarHBondContact O-CG2 3.37Å; T368-V372 PolarHBondContact O-N 3.11Å
369	L	91.2	Very high	87.9	Confident	20 Å²	20	45.7 Å²	45.7	11%	0.105	23%	0.234	C	C	.	.	H	α-helix	trans	-66.6	-39.8	178.8	-70.9	169.4	0	0	0	111.3	M365 V366 V372 V373 A404 P407 L408	M365-L369 HydrophobicContact CG-CD1 4.05Å; M365-L369 WeakPolarHBondContact O-CB 3.46Å; M365-L369 VanDerWaalsContact O-CG 3.29Å; M365-L369 WeakPolarHBondContact O-CG 3.2Å; M365-L369 PolarHBondContact O-N 2.69Å; V366-L369 PolarHBondContact O-N 3.21Å; L369-V372 PolarHBondContact O-N 3.22Å; L369-V373 WeakPolarHBondContact O-CG2 3.46Å; L369-V373 PolarHBondContact O-N 3.27Å; L369-V373 VanDerWaalsContact O-N 3.07Å; L369-A404 HydrophobicContact CD2-CB 4.25Å; L369-P407 HydrophobicContact CD1-CB 3.98Å; L369-P407 HydrophobicContact CD1-CG 4.26Å; L369-P407 HydrophobicContact CD2-CB 4.49Å; L369-P407 HydrophobicContact CD2-CG 3.96Å; L369-L408 HydrophobicContact CB-CB 4.03Å; L369-L408 HydrophobicContact CB-CD1 3.61Å; L369-L408 HydrophobicContact CB-CG 4.28Å; L369-L408 HydrophobicContact CD1-CB 4.21Å; L369-L408 HydrophobicContact CD1-CD1 4.43Å
370	L	89	Confident	87.8	Confident	9 Å²	9	34.7 Å²	34.7	5%	0.047	19%	0.193	C	C	.	.	H	α-helix	trans	-60.9	-44.7	171.7	-77.4	168.1	0	0	0	111.5	V366 V372 V373 I374 L408 Q486	V366-L370 HydrophobicContact CG1-CD1 3.91Å; V366-L370 HydrophobicContact CG1-CG 4.45Å; V366-L370 WeakPolarHBondContact O-CB 3.34Å; V366-L370 WeakPolarHBondContact O-CG 3.35Å; V366-L370 PolarHBondContact O-N 3.3Å; L370-V372 VanDerWaalsContact C-N 3.32Å; L370-V372 PolarHBondContact O-N 3.34Å; L370-V373 PolarHBondContact O-N 2.79Å; L370-I374 WeakPolarHBondContact O-CB 3.43Å; L370-I374 WeakPolarHBondContact O-CD1 3.41Å; L370-I374 VanDerWaalsContact O-CG1 3.23Å; L370-I374 WeakPolarHBondContact O-CG1 3.43Å; L370-I374 PolarHBondContact O-N 3.15Å; L370-L408 HydrophobicContact CD2-CD1 4.17Å; L370-L408 HydrophobicContact CD2-CD2 3.62Å; L370-L408 HydrophobicContact CD2-CG 4.46Å; L370-L408 HydrophobicContact CG-CD1 3.73Å; L370-L408 HydrophobicContact CG-CD2 4.06Å; L370-Q486 HydrophobicContact CB-CB 4.22Å; L370-Q486 HydrophobicContact CB-CG 3.92Å; L370-Q486 HydrophobicContact CD1-CB 3.97Å; L370-Q486 HydrophobicContact CD1-CG 3.98Å
371	S	91.3	Very high	87.6	Confident	49 Å²	49	32.4 Å²	32.4	34%	0.343	18%	0.184	S	C	.	.	H	α-helix	trans	-57.7	-44.1	175.5	-65	0	0	0	0	112	G367 T368 I374 V375 Q486	G367-S371 PolarHBondContact O-N 3.37Å; G367-S371 PolarHBondContact O-OG 2.95Å; T368-S371 WeakPolarHBondContact O-CB 3.25Å; T368-S371 PolarHBondContact O-N 3.2Å; S371-I374 PolarHBondContact O-N 3.2Å; S371-V375 WeakPolarHBondContact O-CB 3.12Å; S371-V375 VanDerWaalsContact O-CG2 3.25Å; S371-V375 WeakPolarHBondContact O-CG2 3.46Å; S371-V375 PolarHBondContact O-N 2.89Å; S371-Q486 PolarHBondContact OG-NE2 3.43Å
372	V	91.3	Very high	87.7	Confident	58 Å²	58	36.6 Å²	36.6	35%	0.352	20%	0.204	S	C	.	.	H	α-helix	trans	-60.8	-47.9	178.2	172.9	0	0	0	0	110.8	T368 L369 L370 I374 V375 C376 V400 A404	T368-V372 WeakPolarHBondContact O-CG2 3.37Å; T368-V372 PolarHBondContact O-N 3.11Å; L369-V372 PolarHBondContact O-N 3.22Å; L370-V372 VanDerWaalsContact C-N 3.32Å; L370-V372 PolarHBondContact O-N 3.34Å; V372-I374 VanDerWaalsContact C-N 3.35Å; V372-I374 PolarHBondContact O-N 2.86Å; V372-V375 PolarHBondContact O-N 3.2Å; V372-C376 PolarHBondContact O-N 3.33Å; V372-C376 PolarHBondContact O-SG 3.41Å; V372-V400 HydrophobicContact CG1-CG1 3.94Å; V372-A404 HydrophobicContact CB-CB 4.26Å; V372-A404 HydrophobicContact CG1-CB 3.78Å
373	V	86.2	Confident	87.3	Confident	28 Å²	28	36.6 Å²	36.6	17%	0.17	21%	0.205	C	C	.	.	H	α-helix	trans	-62.5	-41.1	178.2	175	0	0	0	0	111.6	L369 L370 C376 M377 A404 L408	L369-V373 WeakPolarHBondContact O-CG2 3.46Å; L369-V373 PolarHBondContact O-N 3.27Å; L369-V373 VanDerWaalsContact O-N 3.07Å; L370-V373 PolarHBondContact O-N 2.79Å; V373-C376 PolarHBondContact O-N 3.18Å; V373-M377 WeakPolarHBondContact O-CB 3.44Å; V373-M377 VanDerWaalsContact O-CG 3.31Å; V373-M377 WeakPolarHBondContact O-CG 3.38Å; V373-M377 PolarHBondContact O-N 3.24Å; V373-A404 HydrophobicContact CG2-CB 3.97Å; V373-L408 HydrophobicContact CG2-CD2 4.39Å
374	I	87.3	Confident	86.7	Confident	11 Å²	11	38 Å²	38	6%	0.056	21%	0.211	C	C	.	.	H	α-helix	trans	-64	-42.5	176.9	-70.3	161.9	0	0	0	111.2	L370 S371 V372 M377 L378 A482 V483 Q486	L370-I374 WeakPolarHBondContact O-CB 3.43Å; L370-I374 WeakPolarHBondContact O-CD1 3.41Å; L370-I374 VanDerWaalsContact O-CG1 3.23Å; L370-I374 WeakPolarHBondContact O-CG1 3.43Å; L370-I374 PolarHBondContact O-N 3.15Å; S371-I374 PolarHBondContact O-N 3.2Å; V372-I374 VanDerWaalsContact C-N 3.35Å; V372-I374 PolarHBondContact O-N 2.86Å; I374-M377 WeakPolarHBondContact O-CB 3.29Å; I374-M377 PolarHBondContact O-N 3.22Å; I374-L378 HydrophobicContact CG2-CD1 3.96Å; I374-L378 HydrophobicContact CG2-CG 4.45Å; I374-L378 WeakPolarHBondContact O-CB 3.35Å; I374-L378 WeakPolarHBondContact O-CG 3.24Å; I374-L378 PolarHBondContact O-N 2.99Å; I374-A482 HydrophobicContact CD1-CB 4.11Å; I374-A482 HydrophobicContact CG1-CB 3.65Å; I374-V483 HydrophobicContact CD1-CG2 4.15Å; I374-V483 HydrophobicContact CG2-CG2 3.91Å; I374-Q486 HydrophobicContact CD1-CB 4.23Å
375	V	90.5	Very high	86.2	Confident	92 Å²	92	39.6 Å²	39.6	56%	0.558	21%	0.212	S	C	*	.	H	α-helix	trans	-64.2	-42.1	176.6	170.5	0	0	0	0	110.9	S371 V372 L378 C379	S371-V375 WeakPolarHBondContact O-CB 3.12Å; S371-V375 VanDerWaalsContact O-CG2 3.25Å; S371-V375 WeakPolarHBondContact O-CG2 3.46Å; S371-V375 PolarHBondContact O-N 2.89Å; V372-V375 PolarHBondContact O-N 3.2Å; V375-L378 PolarHBondContact O-N 3.13Å; V375-C379 WeakPolarHBondContact O-CB 3.24Å; V375-C379 PolarHBondContact O-N 3.05Å
376	C	86.6	Confident	85.9	Confident	9 Å²	9	44 Å²	44	6%	0.061	24%	0.235	C	C	.	.	H	α-helix	trans	-60.9	-44.9	173.6	-69.9	0	0	0	0	111.8	V372 V373 C379 M380 V397 A401	V372-C376 PolarHBondContact O-N 3.33Å; V372-C376 PolarHBondContact O-SG 3.41Å; V373-C376 PolarHBondContact O-N 3.18Å; C376-C379 WeakPolarHBondContact O-CB 3.01Å; C376-C379 PolarHBondContact O-N 3.24Å; C376-M380 WeakPolarHBondContact O-CG 3.09Å; C376-M380 PolarHBondContact O-N 3.12Å; C376-V397 HydrophobicContact CB-CG1 3.74Å; C376-V397 WeakPolarHBondContact O-CG1 3.35Å; C376-A401 HydrophobicContact CB-CB 3.94Å
377	M	81.2	Confident	85.5	Confident	6 Å²	6	50.1 Å²	50.1	3%	0.03	26%	0.264	C	S	.	.	H	α-helix	trans	-60	-45.1	175.4	-78.1	-71	-164.6	0	0	112.5	S324 M325 V373 I374 M380 T381 W475 V478 V479	S324-M377 VanDerWaalsContact CB-CE 3.42Å; M325-M377 HydrophobicContact CE-CE 3.56Å; M325-M377 HydrophobicContact CE-CG 3.69Å; M325-M377 HydrophobicContact CE-SD 3.18Å; M325-M377 WeakPolarHBondContact CE-SD 3.23Å; M325-M377 HydrophobicContact CG-CE 3.73Å; M325-M377 HydrophobicContact SD-CE 3.65Å; M325-M377 HydrophobicContact SD-SD 3.87Å; V373-M377 WeakPolarHBondContact O-CB 3.44Å; V373-M377 VanDerWaalsContact O-CG 3.31Å; V373-M377 WeakPolarHBondContact O-CG 3.38Å; V373-M377 PolarHBondContact O-N 3.24Å; I374-M377 WeakPolarHBondContact O-CB 3.29Å; I374-M377 PolarHBondContact O-N 3.22Å; M377-M380 PolarHBondContact O-N 2.96Å; M377-T381 PolarHBondContact O-N 3.03Å; M377-T381 PolarHBondContact O-OG1 3.2Å; M377-W475 HydrophobicContact SD-CE3 3.87Å; M377-W475 HydrophobicContact SD-CZ3 3.74Å; M377-V478 HydrophobicContact CE-CG1 3.73Å; M377-V478 HydrophobicContact SD-CG1 4.23Å; M377-V479 HydrophobicContact CB-CG2 3.77Å
378	L	86.4	Confident	84.8	Confident	73 Å²	73	53.4 Å²	53.4	38%	0.382	28%	0.28	S	S	.	.	H	α-helix	trans	-61.7	-43.2	175.7	-79.5	169.1	0	0	0	111.5	I374 V375 M380 T381 L382 V479	I374-L378 HydrophobicContact CG2-CD1 3.96Å; I374-L378 HydrophobicContact CG2-CG 4.45Å; I374-L378 WeakPolarHBondContact O-CB 3.35Å; I374-L378 WeakPolarHBondContact O-CG 3.24Å; I374-L378 PolarHBondContact O-N 2.99Å; V375-L378 PolarHBondContact O-N 3.13Å; L378-M380 PolarHBondContact O-N 3.4Å; L378-T381 WeakPolarHBondContact O-CB 3.42Å; L378-T381 PolarHBondContact O-N 3.07Å; L378-L382 WeakPolarHBondContact O-CB 3.29Å; L378-L382 VanDerWaalsContact O-CG 3.32Å; L378-L382 WeakPolarHBondContact O-CG 3.35Å; L378-L382 PolarHBondContact O-N 2.7Å; L378-V479 HydrophobicContact CD1-CG1 4.5Å; L378-V479 HydrophobicContact CD2-CB 4.46Å; L378-V479 HydrophobicContact CD2-CG1 3.62Å; L378-V479 HydrophobicContact CD2-CG2 4.11Å; L378-V479 HydrophobicContact CG-CG1 3.91Å; L378-V479 HydrophobicContact CG-CG2 4.14Å
379	C	86.1	Confident	84.1	Confident	39 Å²	39	56.2 Å²	56.2	26%	0.264	29%	0.293	S	S	.	.	H	α-helix	trans	-59.5	-47	176.8	-171.6	0	0	0	0	111.5	V375 C376 T381 L382 E383 V397	V375-C379 WeakPolarHBondContact O-CB 3.24Å; V375-C379 PolarHBondContact O-N 3.05Å; C376-C379 WeakPolarHBondContact O-CB 3.01Å; C376-C379 PolarHBondContact O-N 3.24Å; C379-T381 VanDerWaalsContact C-N 3.31Å; C379-T381 PolarHBondContact O-N 3.35Å; C379-L382 PolarHBondContact O-N 3.41Å; C379-E383 WeakPolarHBondContact O-CB 3.48Å; C379-E383 PolarHBondContact O-N 2.94Å; C379-V397 HydrophobicContact CB-CG1 4.45Å; C379-V397 HydrophobicContact CB-CG2 4.34Å
380	M	78.7	Confident	83.6	Confident	19 Å²	19	60.5 Å²	60.5	9%	0.094	31%	0.312	C	S	.	.	H	α-helix	trans	-63.5	-35.1	175.1	-66.4	-60.6	-67.5	0	0	112.8	C376 M377 L378 K384 Q394 V397	C376-M380 WeakPolarHBondContact O-CG 3.09Å; C376-M380 PolarHBondContact O-N 3.12Å; M377-M380 PolarHBondContact O-N 2.96Å; L378-M380 PolarHBondContact O-N 3.4Å; M380-K384 WeakPolarHBondContact O-CG 3.31Å; M380-K384 PolarHBondContact O-N 3.22Å; M380-Q394 HydrophobicContact CE-CB 4.43Å; M380-Q394 HydrophobicContact CE-CG 4.29Å; M380-V397 HydrophobicContact CG-CG1 3.69Å; M380-V397 HydrophobicContact SD-CB 4.04Å; M380-V397 HydrophobicContact SD-CG1 3.81Å
381	T	79.5	Confident	83.2	Confident	13 Å²	13	65.7 Å²	65.7	8%	0.08	34%	0.335	C	S	.	.	H	α-helix	trans	-66.2	-46.3	176.5	-51.5	0	0	0	0	110.9	M377 L378 C379 K384 W385 P472 W475 I476	M377-T381 PolarHBondContact O-N 3.03Å; M377-T381 PolarHBondContact O-OG1 3.2Å; L378-T381 WeakPolarHBondContact O-CB 3.42Å; L378-T381 PolarHBondContact O-N 3.07Å; C379-T381 VanDerWaalsContact C-N 3.31Å; C379-T381 PolarHBondContact O-N 3.35Å; T381-K384 PolarHBondContact O-N 2.9Å; T381-W385 VanDerWaalsContact O-CB 3.31Å; T381-W385 WeakPolarHBondContact O-CB 3.31Å; T381-W385 PolarHBondContact O-N 2.84Å; T381-P472 HydrophobicContact CG2-CB 4.26Å; T381-W475 HydrophobicContact CG2-CB 3.82Å; T381-W475 VanDerWaalsContact OG1-CB 3.24Å; T381-W475 WeakPolarHBondContact OG1-CB 2.91Å; T381-I476 HydrophobicContact CG2-CG1 4.11Å
382	L	85.7	Confident	82.9	Confident	95 Å²	95	70.5 Å²	70.5	50%	0.497	36%	0.356	S	S	.	.	H	α-helix	trans	-66.1	-41.7	-179.9	-73	170.5	0	0	0	111.8	L378 C379 K384 W385 L386	L378-L382 WeakPolarHBondContact O-CB 3.29Å; L378-L382 VanDerWaalsContact O-CG 3.32Å; L378-L382 WeakPolarHBondContact O-CG 3.35Å; L378-L382 PolarHBondContact O-N 2.7Å; C379-L382 PolarHBondContact O-N 3.41Å; L382-K384 VanDerWaalsContact C-N 3.35Å; L382-K384 PolarHBondContact O-N 3.25Å; L382-W385 PolarHBondContact O-N 3.44Å; L382-L386 WeakPolarHBondContact O-CB 3.39Å; L382-L386 WeakPolarHBondContact O-CG 3.29Å; L382-L386 PolarHBondContact O-N 3.27Å
383	E	80.7	Confident	82.7	Confident	6 Å²	6	71.4 Å²	71.4	3%	0.028	36%	0.359	C	S	.	.	H	α-helix	trans	-59.9	-46	176.3	-175	178.5	176.4	0	0	111.4	C379 W385 L386 E387 L388 H390 Q394	C379-E383 WeakPolarHBondContact O-CB 3.48Å; C379-E383 PolarHBondContact O-N 2.94Å; E383-W385 VanDerWaalsContact C-N 3.33Å; E383-W385 PolarHBondContact O-N 3.43Å; E383-L386 PolarHBondContact O-N 2.71Å; E383-E387 PolarHBondContact O-N 3.41Å; E383-E387 VanDerWaalsContact O-N 3.11Å; E383-L388 HydrophobicContact CG-CB 3.99Å; E383-L388 WeakPolarHBondContact CG-O 3.45Å; E383-L388 PolarHBondContact O-N 2.96Å; E383-L388 VanDerWaalsContact O-N 3.07Å; E383-L388 VanDerWaalsContact OE1-O 3.12Å; E383-H390 PolarHBondContact OE1-N 3.15Å; E383-Q394 VanDerWaalsContact CD-NE2 3.35Å; E383-Q394 VanDerWaalsContact OE1-CD 3.29Å; E383-Q394 WeakPolarHBondContact OE1-CG 3.44Å; E383-Q394 PolarHBondContact OE1-NE2 3.26Å; E383-Q394 WeakPolarHBondContact OE2-CG 3.23Å
384	K	75.1	Confident	82.4	Confident	87 Å²	87	72.6 Å²	72.6	38%	0.378	36%	0.363	S	S	.	.	H	α-helix	trans	-66.8	-32.6	175.4	-74	-177.9	179.7	179.5	0	113.2	M380 T381 L382 W475	M380-K384 WeakPolarHBondContact O-CG 3.31Å; M380-K384 PolarHBondContact O-N 3.22Å; T381-K384 PolarHBondContact O-N 2.9Å; L382-K384 VanDerWaalsContact C-N 3.35Å; L382-K384 PolarHBondContact O-N 3.25Å; K384-W475 VanDerWaalsContact NZ-CE2 3.28Å
385	W	80.8	Confident	82	Confident	145 Å²	145	80.3 Å²	80.3	55%	0.549	39%	0.391	S	S	.	.	H	α-helix	trans	-72.2	-39	178.2	-174.2	72.2	0	0	0	112.2	T381 L382 E383 E387 W470	T381-W385 VanDerWaalsContact O-CB 3.31Å; T381-W385 WeakPolarHBondContact O-CB 3.31Å; T381-W385 PolarHBondContact O-N 2.84Å; L382-W385 PolarHBondContact O-N 3.44Å; E383-W385 VanDerWaalsContact C-N 3.33Å; E383-W385 PolarHBondContact O-N 3.43Å; W385-E387 VanDerWaalsContact C-N 3.28Å; W385-E387 PolarHBondContact O-N 2.95Å; W385-W470 AromaticContact NE1-CH2 3.5Å; W385-W470 AromaticContact NE1-CZ3 3.74Å
386	L	84.7	Confident	81.8	Confident	95 Å²	95	78.4 Å²	78.4	50%	0.497	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	0	177.3	-65.4	171.7	0	0	0	113.4	L382 E383 L388	L382-L386 WeakPolarHBondContact O-CB 3.39Å; L382-L386 WeakPolarHBondContact O-CG 3.29Å; L382-L386 PolarHBondContact O-N 3.27Å; E383-L386 PolarHBondContact O-N 2.71Å; L386-L388 HydrophobicContact CB-CD1 3.8Å; L386-L388 HydrophobicContact CB-CG 3.73Å; L386-L388 HydrophobicContact CD1-CD1 3.79Å; L386-L388 HydrophobicContact CG-CD1 4.45Å; L386-L388 PolarHBondContact O-N 3.28Å; L386-L388 VanDerWaalsContact O-N 3.1Å
387	E	80.2	Confident	81.8	Confident	128 Å²	128	78.6 Å²	78.6	60%	0.598	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	31.6	-173.9	-56.8	-164.4	147.4	0	0	113.6	E383 W385 K471	E383-E387 PolarHBondContact O-N 3.41Å; E383-E387 VanDerWaalsContact O-N 3.11Å; W385-E387 VanDerWaalsContact C-N 3.28Å; W385-E387 PolarHBondContact O-N 2.95Å; E387-K471 IonicContact OE1-NZ 3.96Å; E387-K471 PolarHBondContact OE1-NZ 3.24Å; E387-K471 VanDerWaalsContact OE1-NZ 3.1Å
388	L	77.3	Confident	81.7	Confident	75 Å²	75	79.6 Å²	79.6	39%	0.393	39%	0.393	S	S	.	.			trans	-76.7	126.3	175.7	-66.3	171	0	0	0	108.7	E383 L386	E383-L388 HydrophobicContact CG-CB 3.99Å; E383-L388 WeakPolarHBondContact CG-O 3.45Å; E383-L388 PolarHBondContact O-N 2.96Å; E383-L388 VanDerWaalsContact O-N 3.07Å; E383-L388 VanDerWaalsContact OE1-O 3.12Å; L386-L388 HydrophobicContact CB-CD1 3.8Å; L386-L388 HydrophobicContact CB-CG 3.73Å; L386-L388 HydrophobicContact CD1-CD1 3.79Å; L386-L388 HydrophobicContact CG-CD1 4.45Å; L386-L388 PolarHBondContact O-N 3.28Å; L386-L388 VanDerWaalsContact O-N 3.1Å
389	N	75.8	Confident	81.6	Confident	124 Å²	124	79.3 Å²	79.3	66%	0.663	39%	0.388	S	S	*	.			trans	-106	57.8	-179.2	-73.6	-44.3	0	0	0	111.2	H391	N389-H391 PolarHBondContact O-N 3.28Å
390	H	81.2	Confident	81.7	Confident	110 Å²	110	81 Å²	81	51%	0.509	40%	0.397	S	S	.	.			trans	-93.2	85.2	-179.9	-70.5	-55.6	0	0	0	110.9	E383 L392 L393 Q394	E383-H390 PolarHBondContact OE1-N 3.15Å; H390-L392 PolarHBondContact O-N 3.07Å; H390-L392 VanDerWaalsContact O-N 3.08Å; H390-L393 HydrophobicContact CB-CB 3.95Å; H390-L393 WeakPolarHBondContact O-CB 3.44Å; H390-L393 PolarHBondContact O-N 3.3Å; H390-Q394 PolarHBondContact O-N 2.99Å; H390-Q394 VanDerWaalsContact O-N 3.12Å
391	H	81.3	Confident	81.9	Confident	117 Å²	117	80.2 Å²	80.2	54%	0.542	39%	0.394	S	S	.	.	H	α-helix	trans	-53.9	-32.8	-178.2	-60.1	-57.6	0	0	0	114.8	N389 R395	N389-H391 PolarHBondContact O-N 3.28Å; H391-R395 WeakPolarHBondContact O-CB 3.48Å; H391-R395 VanDerWaalsContact O-CG 3.23Å; H391-R395 WeakPolarHBondContact O-CG 3.46Å; H391-R395 PolarHBondContact O-N 3.32Å; H391-R395 VanDerWaalsContact O-N 3.12Å
392	L	84.9	Confident	82	Confident	150 Å²	150	79.6 Å²	79.6	79%	0.785	39%	0.39	S	S	*	.	H	α-helix	trans	-66.7	-41.9	175.2	-87.9	110.1	0	0	0	112.3	H390 R395 A396	H390-L392 PolarHBondContact O-N 3.07Å; H390-L392 VanDerWaalsContact O-N 3.08Å; L392-R395 PolarHBondContact O-N 3.13Å; L392-A396 WeakPolarHBondContact O-CB 3.46Å; L392-A396 PolarHBondContact O-N 2.89Å
393	L	86	Confident	82.1	Confident	78 Å²	78	78.4 Å²	78.4	41%	0.408	38%	0.381	S	S	.	.	H	α-helix	trans	-65	-47.3	178.6	-178.7	63.2	0	0	0	110.2	H390 R395 A396 V397	H390-L393 HydrophobicContact CB-CB 3.95Å; H390-L393 WeakPolarHBondContact O-CB 3.44Å; H390-L393 PolarHBondContact O-N 3.3Å; L393-R395 VanDerWaalsContact C-N 3.33Å; L393-R395 PolarHBondContact O-N 3.39Å; L393-A396 PolarHBondContact O-N 2.86Å; L393-A396 VanDerWaalsContact O-N 3.17Å; L393-V397 HydrophobicContact CD1-CG2 4.09Å; L393-V397 HydrophobicContact CG-CG2 4.31Å; L393-V397 WeakPolarHBondContact O-CB 3.4Å; L393-V397 VanDerWaalsContact O-CG2 3.27Å; L393-V397 WeakPolarHBondContact O-CG2 3.39Å; L393-V397 PolarHBondContact O-N 3.3Å
394	Q	79.6	Confident	82.5	Confident	52 Å²	52	78.3 Å²	78.3	24%	0.243	38%	0.381	C	S	.	.	H	α-helix	trans	-54.3	-49.2	176	-67	177.1	-2.8	0	0	111.6	M380 E383 H390 V397 V398	M380-Q394 HydrophobicContact CE-CB 4.43Å; M380-Q394 HydrophobicContact CE-CG 4.29Å; E383-Q394 VanDerWaalsContact CD-NE2 3.35Å; E383-Q394 VanDerWaalsContact OE1-CD 3.29Å; E383-Q394 WeakPolarHBondContact OE1-CG 3.44Å; E383-Q394 PolarHBondContact OE1-NE2 3.26Å; E383-Q394 WeakPolarHBondContact OE2-CG 3.23Å; H390-Q394 PolarHBondContact O-N 2.99Å; H390-Q394 VanDerWaalsContact O-N 3.12Å; Q394-V397 PolarHBondContact O-N 3.4Å; Q394-V398 WeakPolarHBondContact O-CB 3.44Å; Q394-V398 VanDerWaalsContact O-CG2 3.24Å; Q394-V398 WeakPolarHBondContact O-CG2 3.25Å; Q394-V398 PolarHBondContact O-N 2.89Å
395	R	80.6	Confident	82.9	Confident	173 Å²	173	75.5 Å²	75.5	65%	0.653	37%	0.372	S	S	*	.	H	α-helix	trans	-60.4	-48.4	178.2	-72.6	172.4	-175.6	-176.6	2.5	111	H391 L392 L393 V397 V398 F399	H391-R395 WeakPolarHBondContact O-CB 3.48Å; H391-R395 VanDerWaalsContact O-CG 3.23Å; H391-R395 WeakPolarHBondContact O-CG 3.46Å; H391-R395 PolarHBondContact O-N 3.32Å; H391-R395 VanDerWaalsContact O-N 3.12Å; L392-R395 PolarHBondContact O-N 3.13Å; L393-R395 VanDerWaalsContact C-N 3.33Å; L393-R395 PolarHBondContact O-N 3.39Å; R395-V397 PolarHBondContact O-N 3.28Å; R395-V398 PolarHBondContact O-N 2.87Å; R395-F399 WeakPolarHBondContact O-CD2 3.31Å; R395-F399 PolarHBondContact O-N 3.34Å
396	A	86.4	Confident	83.1	Confident	53 Å²	53	68.8 Å²	68.8	44%	0.438	35%	0.348	S	S	.	.	H	α-helix	trans	-59.7	-45	179.5	0	0	0	0	0	112.1	L392 L393 F399 V400	L392-A396 WeakPolarHBondContact O-CB 3.46Å; L392-A396 PolarHBondContact O-N 2.89Å; L393-A396 PolarHBondContact O-N 2.86Å; L393-A396 VanDerWaalsContact O-N 3.17Å; A396-F399 PolarHBondContact O-N 3.36Å; A396-V400 WeakPolarHBondContact O-CG2 3.23Å; A396-V400 PolarHBondContact O-N 2.9Å
397	V	85.5	Confident	83.3	Confident	13 Å²	13	64.5 Å²	64.5	8%	0.079	33%	0.325	C	S	.	.	H	α-helix	trans	-63.7	-42.5	178.8	174.2	0	0	0	0	111.5	C376 C379 M380 L393 Q394 R395 V400 A401	C376-V397 HydrophobicContact CB-CG1 3.74Å; C376-V397 WeakPolarHBondContact O-CG1 3.35Å; C379-V397 HydrophobicContact CB-CG1 4.45Å; C379-V397 HydrophobicContact CB-CG2 4.34Å; M380-V397 HydrophobicContact CG-CG1 3.69Å; M380-V397 HydrophobicContact SD-CB 4.04Å; M380-V397 HydrophobicContact SD-CG1 3.81Å; L393-V397 HydrophobicContact CD1-CG2 4.09Å; L393-V397 HydrophobicContact CG-CG2 4.31Å; L393-V397 WeakPolarHBondContact O-CB 3.4Å; L393-V397 VanDerWaalsContact O-CG2 3.27Å; L393-V397 WeakPolarHBondContact O-CG2 3.39Å; L393-V397 PolarHBondContact O-N 3.3Å; Q394-V397 PolarHBondContact O-N 3.4Å; R395-V397 PolarHBondContact O-N 3.28Å; V397-V400 PolarHBondContact O-N 2.9Å; V397-A401 WeakPolarHBondContact O-CB 3.47Å; V397-A401 PolarHBondContact O-N 3.19Å
398	V	79.7	Confident	83.8	Confident	27 Å²	27	58.6 Å²	58.6	16%	0.164	30%	0.298	C	S	.	.	H	α-helix	trans	-62.4	-43.7	176.1	170.3	0	0	0	0	111.1	L328 Q394 R395 A401 A402	L328-V398 HydrophobicContact CD1-CG1 3.65Å; Q394-V398 WeakPolarHBondContact O-CB 3.44Å; Q394-V398 VanDerWaalsContact O-CG2 3.24Å; Q394-V398 WeakPolarHBondContact O-CG2 3.25Å; Q394-V398 PolarHBondContact O-N 2.89Å; R395-V398 PolarHBondContact O-N 2.87Å; V398-A401 PolarHBondContact O-N 3.29Å; V398-A402 VanDerWaalsContact O-CB 3.28Å; V398-A402 WeakPolarHBondContact O-CB 3.37Å; V398-A402 PolarHBondContact O-N 3.02Å
399	F	83.3	Confident	84.2	Confident	67 Å²	67	58.8 Å²	58.8	29%	0.294	29%	0.294	S	S	.	.	H	α-helix	trans	-62.7	-48.2	175	-81.3	-70	0	0	0	111.3	F342 R395 A396 A401 A402 F403	F342-F399 HydrophobicContact CD1-CB 4.49Å; F342-F399 AromaticContact CD1-CD1 3.81Å; F342-F399 HydrophobicContact CD1-CD1 3.81Å; F342-F399 HydrophobicContact CE1-CB 3.85Å; F342-F399 AromaticContact CE1-CD1 3.91Å; F342-F399 HydrophobicContact CE1-CD1 3.91Å; F342-F399 HydrophobicContact CE1-CG 4.36Å; F342-F399 WeakPolarHBondContact CE1-O 3.4Å; F342-F399 HydrophobicContact CG-CD1 4.16Å; F342-F399 HydrophobicContact CZ-CB 4.29Å; F342-F399 HydrophobicContact CZ-CD1 4.4Å; R395-F399 WeakPolarHBondContact O-CD2 3.31Å; R395-F399 PolarHBondContact O-N 3.34Å; A396-F399 PolarHBondContact O-N 3.36Å; F399-A401 VanDerWaalsContact C-N 3.29Å; F399-A401 PolarHBondContact O-N 2.92Å; F399-A402 WeakPolarHBondContact O-CB 3.23Å; F399-A402 PolarHBondContact O-N 3.09Å; F399-A402 VanDerWaalsContact O-N 3.1Å; F399-F403 PolarHBondContact O-N 3.09Å
400	V	88.6	Confident	84.8	Confident	75 Å²	75	53.7 Å²	53.7	46%	0.455	27%	0.266	S	S	.	.	H	α-helix	trans	-58.9	-41.8	178	174.9	0	0	0	0	111.7	V372 A396 V397 F403 A404	V372-V400 HydrophobicContact CG1-CG1 3.94Å; A396-V400 WeakPolarHBondContact O-CG2 3.23Å; A396-V400 PolarHBondContact O-N 2.9Å; V397-V400 PolarHBondContact O-N 2.9Å; V400-F403 PolarHBondContact O-N 3.12Å; V400-A404 PolarHBondContact O-N 3.45Å; V400-A404 VanDerWaalsContact O-N 3.14Å
401	A	83.8	Confident	85.3	Confident	2 Å²	2	48.5 Å²	48.5	2%	0.017	24%	0.242	C	C	.	.	H	α-helix	trans	-62.4	-43.3	175.3	0	0	0	0	0	112	M325 C376 V397 V398 F399 A404 S405	M325-A401 HydrophobicContact CE-CB 4.32Å; C376-A401 HydrophobicContact CB-CB 3.94Å; V397-A401 WeakPolarHBondContact O-CB 3.47Å; V397-A401 PolarHBondContact O-N 3.19Å; V398-A401 PolarHBondContact O-N 3.29Å; F399-A401 VanDerWaalsContact C-N 3.29Å; F399-A401 PolarHBondContact O-N 2.92Å; A401-A404 PolarHBondContact O-N 3.08Å; A401-S405 WeakPolarHBondContact O-CB 3.42Å; A401-S405 PolarHBondContact O-N 3.28Å
402	A	81.8	Confident	85.7	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-61.9	-45.1	176.4	0	0	0	0	0	111.9	Y339 F342 N343 V398 F399 A404 S405	Y339-A402 HydrophobicContact CD2-CB 4.15Å; Y339-A402 HydrophobicContact CE2-CB 3.39Å; F342-A402 HydrophobicContact CD1-CB 4.42Å; N343-A402 WeakPolarHBondContact OD1-CA 3.41Å; N343-A402 VanDerWaalsContact OD1-CB 3.3Å; N343-A402 WeakPolarHBondContact OD1-CB 3.34Å; N343-A402 PolarHBondContact OD1-O 3.45Å; V398-A402 VanDerWaalsContact O-CB 3.28Å; V398-A402 WeakPolarHBondContact O-CB 3.37Å; V398-A402 PolarHBondContact O-N 3.02Å; F399-A402 WeakPolarHBondContact O-CB 3.23Å; F399-A402 PolarHBondContact O-N 3.09Å; F399-A402 VanDerWaalsContact O-N 3.1Å; A402-A404 PolarHBondContact O-N 3.3Å; A402-S405 PolarHBondContact O-N 3.02Å; A402-S405 PolarHBondContact O-OG 3.26Å
403	F	87.7	Confident	85.9	Confident	69 Å²	69	36.9 Å²	36.9	30%	0.303	19%	0.186	S	C	.	.	H	α-helix	trans	-59.1	-35.5	175.7	-166.8	-95.2	0	0	0	112.7	F342 L345 G346 V349 F399 V400 P407	F342-F403 HydrophobicContact CD1-CB 4.14Å; F342-F403 HydrophobicContact CD1-CD2 4.32Å; F342-F403 HydrophobicContact CE1-CB 3.61Å; F342-F403 AromaticContact CE1-CD2 3.92Å; F342-F403 HydrophobicContact CE1-CD2 3.92Å; F342-F403 HydrophobicContact CE1-CG 4.22Å; F342-F403 HydrophobicContact CE2-CD2 4.42Å; F342-F403 HydrophobicContact CZ-CB 4.3Å; F342-F403 AromaticContact CZ-CD2 3.96Å; F342-F403 HydrophobicContact CZ-CD2 3.96Å; L345-F403 HydrophobicContact CB-CE2 4.32Å; G346-F403 VanDerWaalsContact CA-CE2 3.47Å; G346-F403 WeakPolarHBondContact CA-O 3.38Å; V349-F403 HydrophobicContact CB-CZ 3.87Å; V349-F403 HydrophobicContact CG1-CE1 4.47Å; V349-F403 HydrophobicContact CG1-CZ 4.1Å; V349-F403 HydrophobicContact CG2-CZ 3.97Å; F399-F403 PolarHBondContact O-N 3.09Å; V400-F403 PolarHBondContact O-N 3.12Å; F403-P407 WeakPolarHBondContact O-CD 3.31Å; F403-P407 VanDerWaalsContact O-CG 3.29Å; F403-P407 WeakPolarHBondContact O-CG 3.34Å
404	A	88.9	Confident	86.2	Confident	4 Å²	4	33.1 Å²	33.1	3%	0.033	17%	0.167	C	C	.	.	H	α-helix	trans	-84.7	-27.6	-179.9	0	0	0	0	0	114	L369 V372 V373 V400 A401 A402 P407 L408	L369-A404 HydrophobicContact CD2-CB 4.25Å; V372-A404 HydrophobicContact CB-CB 4.26Å; V372-A404 HydrophobicContact CG1-CB 3.78Å; V373-A404 HydrophobicContact CG2-CB 3.97Å; V400-A404 PolarHBondContact O-N 3.45Å; V400-A404 VanDerWaalsContact O-N 3.14Å; A401-A404 PolarHBondContact O-N 3.08Å; A402-A404 PolarHBondContact O-N 3.3Å; A404-P407 WeakPolarHBondContact O-CD 3.42Å; A404-P407 WeakPolarHBondContact O-CG 3.33Å; A404-L408 VanDerWaalsContact O-CB 3.27Å; A404-L408 WeakPolarHBondContact O-CB 3.39Å; A404-L408 PolarHBondContact O-N 2.8Å
405	S	82.9	Confident	86.8	Confident	28 Å²	28	30.8 Å²	30.8	20%	0.196	16%	0.156	C	C	.	.	H	α-helix	trans	-68.6	-44.5	-173	66.4	0	0	0	0	112.9	A401 A402 L408 W409	A401-S405 WeakPolarHBondContact O-CB 3.42Å; A401-S405 PolarHBondContact O-N 3.28Å; A402-S405 PolarHBondContact O-N 3.02Å; A402-S405 PolarHBondContact O-OG 3.26Å; S405-L408 WeakPolarHBondContact O-CB 3.08Å; S405-L408 PolarHBondContact O-N 2.71Å; S405-W409 PolarHBondContact O-N 2.89Å
406	S	85.1	Confident	87.3	Confident	5 Å²	5	22.6 Å²	22.6	4%	0.035	13%	0.125	C	C	.	.	H	α-helix	trans	-60	-55.4	178.9	168.9	0	0	0	0	114.1	N206 N343 L408 W409 I410	N206-S406 WeakPolarHBondContact ND2-CB 3.42Å; N206-S406 PolarHBondContact ND2-OG 3.23Å; N343-S406 WeakPolarHBondContact O-CB 3.44Å; N343-S406 PolarHBondContact O-OG 2.94Å; S406-L408 PolarHBondContact O-N 2.83Å; S406-W409 WeakPolarHBondContact O-CB 3.38Å; S406-W409 PolarHBondContact O-N 3.41Å; S406-W409 VanDerWaalsContact O-N 3.16Å; S406-I410 WeakPolarHBondContact O-CG1 3.4Å; S406-I410 PolarHBondContact O-N 2.87Å
407	P	89.6	Confident	87.5	Confident	4 Å²	4	20.4 Å²	20.4	3%	0.026	11%	0.106	C	C	.	.	H	α-helix	trans	-62.1	-31.4	176.3	22.3	-31.6	0	0	0	112.2	C350 L369 F403 A404 S411	C350-P407 HydrophobicContact CB-CB 3.42Å; C350-P407 VanDerWaalsContact CB-CB 3.42Å; C350-P407 HydrophobicContact CB-CG 4.15Å; L369-P407 HydrophobicContact CD1-CB 3.98Å; L369-P407 HydrophobicContact CD1-CG 4.26Å; L369-P407 HydrophobicContact CD2-CB 4.49Å; L369-P407 HydrophobicContact CD2-CG 3.96Å; F403-P407 WeakPolarHBondContact O-CD 3.31Å; F403-P407 VanDerWaalsContact O-CG 3.29Å; F403-P407 WeakPolarHBondContact O-CG 3.34Å; A404-P407 WeakPolarHBondContact O-CD 3.42Å; A404-P407 WeakPolarHBondContact O-CG 3.33Å; P407-S411 VanDerWaalsContact O-CB 3.23Å; P407-S411 WeakPolarHBondContact O-CB 3.31Å; P407-S411 PolarHBondContact O-N 2.91Å; P407-S411 PolarHBondContact O-OG 3.45Å
408	L	89.2	Confident	87.7	Confident	4 Å²	4	20.4 Å²	20.4	2%	0.021	11%	0.105	C	C	.	.	H	α-helix	trans	-64.5	-44.5	176	-174.3	67.4	0	0	0	110.8	M322 V366 L369 L370 V373 A404 S405 S406 S411 L412	M322-L408 VanDerWaalsContact CE-C 3.48Å; M322-L408 HydrophobicContact CE-CB 3.55Å; M322-L408 HydrophobicContact CE-CD1 4.42Å; M322-L408 HydrophobicContact CE-CD2 3.22Å; M322-L408 HydrophobicContact CE-CG 3.11Å; V366-L408 HydrophobicContact CB-CD1 4.38Å; V366-L408 HydrophobicContact CG1-CD1 3.81Å; L369-L408 HydrophobicContact CB-CB 4.03Å; L369-L408 HydrophobicContact CB-CD1 3.61Å; L369-L408 HydrophobicContact CB-CG 4.28Å; L369-L408 HydrophobicContact CD1-CB 4.21Å; L369-L408 HydrophobicContact CD1-CD1 4.43Å; L370-L408 HydrophobicContact CD2-CD1 4.17Å; L370-L408 HydrophobicContact CD2-CD2 3.62Å; L370-L408 HydrophobicContact CD2-CG 4.46Å; L370-L408 HydrophobicContact CG-CD1 3.73Å; L370-L408 HydrophobicContact CG-CD2 4.06Å; V373-L408 HydrophobicContact CG2-CD2 4.39Å; A404-L408 VanDerWaalsContact O-CB 3.27Å; A404-L408 WeakPolarHBondContact O-CB 3.39Å; A404-L408 PolarHBondContact O-N 2.8Å; S405-L408 WeakPolarHBondContact O-CB 3.08Å; S405-L408 PolarHBondContact O-N 2.71Å; S406-L408 PolarHBondContact O-N 2.83Å; L408-S411 PolarHBondContact O-N 3.27Å; L408-L412 HydrophobicContact CG-CD1 4.33Å; L408-L412 WeakPolarHBondContact O-CG 3.43Å; L408-L412 PolarHBondContact O-N 2.91Å
409	W	86.5	Confident	88.1	Confident	80 Å²	80	19.8 Å²	19.8	30%	0.303	10%	0.102	S	C	.	.	H	α-helix	trans	-61	-48.4	176.6	177.8	-83.7	0	0	0	112	I319 M322 S405 S406 S411 L412 S413 V436	I319-W409 HydrophobicContact CG2-CD2 4.47Å; I319-W409 HydrophobicContact CG2-CE3 3.59Å; I319-W409 HydrophobicContact CG2-CH2 3.72Å; I319-W409 HydrophobicContact CG2-CZ3 3.14Å; M322-W409 HydrophobicContact CE-CB 4.2Å; M322-W409 VanDerWaalsContact CE-N 3.33Å; M322-W409 HydrophobicContact SD-CB 4.23Å; M322-W409 HydrophobicContact SD-CD2 4.35Å; M322-W409 HydrophobicContact SD-CE3 3.49Å; M322-W409 HydrophobicContact SD-CZ3 4.23Å; S405-W409 PolarHBondContact O-N 2.89Å; S406-W409 WeakPolarHBondContact O-CB 3.38Å; S406-W409 PolarHBondContact O-N 3.41Å; S406-W409 VanDerWaalsContact O-N 3.16Å; W409-S411 VanDerWaalsContact C-N 3.29Å; W409-S411 PolarHBondContact O-N 3.48Å; W409-L412 PolarHBondContact O-N 3.33Å; W409-S413 WeakPolarHBondContact O-CB 3.23Å; W409-S413 PolarHBondContact O-N 3.17Å; W409-S413 PolarHBondContact O-OG 3.35Å; W409-V436 HydrophobicContact CH2-CB 3.88Å; W409-V436 HydrophobicContact CH2-CG1 3.54Å; W409-V436 HydrophobicContact CH2-CG2 3.54Å; W409-V436 HydrophobicContact CZ3-CB 4.15Å; W409-V436 HydrophobicContact CZ3-CG1 3.47Å; W409-V436 VanDerWaalsContact CZ3-CG1 3.47Å; W409-V436 HydrophobicContact CZ3-CG2 3.74Å
410	I	89.2	Confident	88.4	Confident	16 Å²	16	16.6 Å²	16.6	8%	0.082	9%	0.088	C	C	.	.	H	α-helix	trans	-58.4	-45.2	178.1	-70.1	166.9	0	0	0	110.2	L197 I200 A201 S406 S413 L414	L197-I410 HydrophobicContact CD1-CG2 3.55Å; I200-I410 HydrophobicContact CB-CG2 4.31Å; I200-I410 HydrophobicContact CG2-CG1 4.42Å; I200-I410 HydrophobicContact CG2-CG2 3.66Å; A201-I410 HydrophobicContact CB-CD1 4.15Å; S406-I410 WeakPolarHBondContact O-CG1 3.4Å; S406-I410 PolarHBondContact O-N 2.87Å; I410-S413 PolarHBondContact O-N 3.23Å; I410-L414 WeakPolarHBondContact O-CB 3.32Å; I410-L414 PolarHBondContact O-N 3.14Å
411	S	90.8	Very high	88.4	Confident	1 Å²	1	13 Å²	13	1%	0.007	7%	0.067	C	C	.	.	H	α-helix	trans	-67.9	-44.2	-177.3	-58.7	0	0	0	0	112.3	M365 P407 L408 W409 L414 V415	M365-S411 WeakPolarHBondContact CE-OG 3.4Å; P407-S411 VanDerWaalsContact O-CB 3.23Å; P407-S411 WeakPolarHBondContact O-CB 3.31Å; P407-S411 PolarHBondContact O-N 2.91Å; P407-S411 PolarHBondContact O-OG 3.45Å; L408-S411 PolarHBondContact O-N 3.27Å; W409-S411 VanDerWaalsContact C-N 3.29Å; W409-S411 PolarHBondContact O-N 3.48Å; S411-L414 PolarHBondContact O-N 3.41Å; S411-V415 VanDerWaalsContact O-CG2 3.27Å; S411-V415 WeakPolarHBondContact O-CG2 3.25Å; S411-V415 PolarHBondContact O-N 3.35Å
412	L	90.2	Very high	88.5	Confident	0 Å²	0	13 Å²	13	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-63	-43.1	175.5	-74	173.8	0	0	0	111.5	L315 I319 M322 V366 L408 W409 L414 V415 I416 F489	L315-L412 HydrophobicContact CD2-CD2 4.3Å; I319-L412 HydrophobicContact CD1-CB 4.16Å; I319-L412 HydrophobicContact CG1-CB 3.92Å; I319-L412 HydrophobicContact CG1-CD1 3.68Å; I319-L412 HydrophobicContact CG1-CG 4.36Å; M322-L412 HydrophobicContact CE-CD1 3.6Å; M322-L412 HydrophobicContact SD-CD1 4.04Å; V366-L412 HydrophobicContact CG1-CD2 3.76Å; V366-L412 HydrophobicContact CG1-CG 4.29Å; L408-L412 HydrophobicContact CG-CD1 4.33Å; L408-L412 WeakPolarHBondContact O-CG 3.43Å; L408-L412 PolarHBondContact O-N 2.91Å; W409-L412 PolarHBondContact O-N 3.33Å; L412-L414 VanDerWaalsContact C-N 3.32Å; L412-L414 PolarHBondContact O-N 3.49Å; L412-V415 PolarHBondContact O-N 3.05Å; L412-I416 WeakPolarHBondContact O-CG1 3.19Å; L412-I416 PolarHBondContact O-N 3.27Å; L412-F489 HydrophobicContact CD2-CD2 3.95Å; L412-F489 HydrophobicContact CD2-CE2 3.63Å; L412-F489 HydrophobicContact CD2-CZ 4.39Å
413	S	89.1	Confident	88.7	Confident	23 Å²	23	13.7 Å²	13.7	16%	0.161	7%	0.072	C	C	.	.	H	α-helix	trans	-60.2	-42.9	175.6	-60.3	0	0	0	0	111.4	W409 I410 I416 M417	W409-S413 WeakPolarHBondContact O-CB 3.23Å; W409-S413 PolarHBondContact O-N 3.17Å; W409-S413 PolarHBondContact O-OG 3.35Å; I410-S413 PolarHBondContact O-N 3.23Å; S413-I416 PolarHBondContact O-N 2.86Å; S413-M417 WeakPolarHBondContact O-CE 3.31Å; S413-M417 WeakPolarHBondContact O-CG 3.34Å; S413-M417 PolarHBondContact O-N 2.88Å; S413-M417 VanDerWaalsContact O-N 3.15Å
414	L	91.8	Very high	88.8	Confident	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-65.3	-43.2	176.1	-177.5	60.7	0	0	0	111.9	V188 R196 L197 I200 I410 S411 L412 I416 M417 E418	V188-L414 HydrophobicContact CG2-CD1 3.75Å; R196-L414 HydrophobicContact CB-CD1 3.94Å; R196-L414 HydrophobicContact CB-CD2 4.34Å; L197-L414 HydrophobicContact CB-CD2 3.91Å; L197-L414 HydrophobicContact CD1-CD2 3.97Å; I200-L414 HydrophobicContact CD1-CD1 3.98Å; I410-L414 WeakPolarHBondContact O-CB 3.32Å; I410-L414 PolarHBondContact O-N 3.14Å; S411-L414 PolarHBondContact O-N 3.41Å; L412-L414 VanDerWaalsContact C-N 3.32Å; L412-L414 PolarHBondContact O-N 3.49Å; L414-I416 VanDerWaalsContact C-N 3.28Å; L414-I416 PolarHBondContact O-N 2.83Å; L414-M417 PolarHBondContact O-N 3.42Å; L414-M417 VanDerWaalsContact O-N 3.09Å; L414-E418 HydrophobicContact CD1-CG 3.96Å; L414-E418 HydrophobicContact CG-CG 4.18Å; L414-E418 WeakPolarHBondContact O-CB 3.45Å; L414-E418 WeakPolarHBondContact O-CG 3.3Å; L414-E418 PolarHBondContact O-N 2.97Å
415	V	91.8	Very high	88.9	Confident	2 Å²	2	10.4 Å²	10.4	1%	0.012	6%	0.057	C	C	.	.	H	α-helix	trans	-60.4	-38.5	176.8	169	0	0	0	0	111.3	L315 R362 S411 L412 E418 S419 F489 I493 T496	L315-V415 HydrophobicContact CD1-CG1 4.41Å; L315-V415 HydrophobicContact CD2-CB 4.5Å; L315-V415 HydrophobicContact CD2-CG1 3.77Å; R362-V415 HydrophobicContact CB-CG2 4.29Å; S411-V415 VanDerWaalsContact O-CG2 3.27Å; S411-V415 WeakPolarHBondContact O-CG2 3.25Å; S411-V415 PolarHBondContact O-N 3.35Å; L412-V415 PolarHBondContact O-N 3.05Å; V415-E418 PolarHBondContact O-N 3.01Å; V415-S419 WeakPolarHBondContact O-CB 3.37Å; V415-S419 PolarHBondContact O-N 3.03Å; V415-S419 PolarHBondContact O-OG 2.74Å; V415-F489 HydrophobicContact CG1-CE2 4.38Å; V415-I493 HydrophobicContact CG1-CG2 3.85Å; V415-T496 HydrophobicContact CG1-CG2 4.34Å
416	I	91.1	Very high	89.3	Confident	2 Å²	2	9.1 Å²	9.1	1%	0.01	5%	0.048	C	C	.	.	H	α-helix	trans	-59.1	-50.6	172.1	-69.2	163.6	0	0	0	110.1	L315 I319 L412 S413 L414 E418 S419 F420 V428 S432	L315-I416 HydrophobicContact CB-CD1 4.32Å; L315-I416 HydrophobicContact CB-CG1 3.95Å; L315-I416 HydrophobicContact CD1-CG1 3.77Å; L315-I416 HydrophobicContact CG-CG1 4.29Å; I319-I416 HydrophobicContact CD1-CD1 3.5Å; L412-I416 WeakPolarHBondContact O-CG1 3.19Å; L412-I416 PolarHBondContact O-N 3.27Å; S413-I416 PolarHBondContact O-N 2.86Å; L414-I416 VanDerWaalsContact C-N 3.28Å; L414-I416 PolarHBondContact O-N 2.83Å; I416-E418 VanDerWaalsContact C-N 3.3Å; I416-E418 PolarHBondContact O-N 2.93Å; I416-S419 PolarHBondContact O-N 3.13Å; I416-F420 HydrophobicContact CG2-CD2 4.26Å; I416-F420 VanDerWaalsContact O-CD2 3.26Å; I416-F420 WeakPolarHBondContact O-CD2 3.45Å; I416-F420 PolarHBondContact O-N 2.85Å; I416-V428 HydrophobicContact CG2-CB 4.3Å; I416-V428 HydrophobicContact CG2-CG1 3.76Å; I416-S432 WeakPolarHBondContact CD1-OG 3.46Å
417	M	90.9	Very high	89.6	Confident	7 Å²	7	9.1 Å²	9.1	3%	0.034	5%	0.048	C	C	.	.	H	α-helix	trans	-67.8	-30.9	-177.6	-63.2	-176.2	-77.1	0	0	112.9	G184 V185 V188 I200 S413 L414 R425	G184-M417 VanDerWaalsContact O-SD 3.4Å; V185-M417 HydrophobicContact CB-SD 4.4Å; V185-M417 HydrophobicContact CG2-CG 3.88Å; V185-M417 HydrophobicContact CG2-SD 3.78Å; V185-M417 PolarHBondContact N-SD 3.4Å; V188-M417 HydrophobicContact CB-CB 4.46Å; V188-M417 HydrophobicContact CB-SD 4.44Å; V188-M417 HydrophobicContact CG1-CB 4.19Å; V188-M417 HydrophobicContact CG2-CB 4.18Å; V188-M417 HydrophobicContact CG2-CE 3.69Å; V188-M417 HydrophobicContact CG2-SD 3.83Å; I200-M417 HydrophobicContact CD1-CE 3.99Å; S413-M417 WeakPolarHBondContact O-CE 3.31Å; S413-M417 WeakPolarHBondContact O-CG 3.34Å; S413-M417 PolarHBondContact O-N 2.88Å; S413-M417 VanDerWaalsContact O-N 3.15Å; L414-M417 PolarHBondContact O-N 3.42Å; L414-M417 VanDerWaalsContact O-N 3.09Å; M417-R425 WeakPolarHBondContact O-CD 3.4Å; M417-R425 PolarHBondContact O-NE 3.02Å
418	E	90.7	Very high	89.7	Confident	12 Å²	12	9 Å²	9	6%	0.056	5%	0.047	C	C	.	.	H	α-helix	trans	-80.3	-32.5	178.7	-69.5	-172.5	150	0	0	113.5	R196 R362 L414 V415 I416 T496 L501	R196-E418 IonicContact NH1-OE1 3.93Å; R196-E418 PolarHBondContact NH1-OE1 3.09Å; R362-E418 IonicContact CZ-OE1 3.87Å; R362-E418 IonicContact CZ-OE2 2.69Å; R362-E418 IonicContact NH1-OE1 2.81Å; R362-E418 PolarHBondContact NH1-OE1 3.14Å; R362-E418 IonicContact NH1-OE2 3.71Å; R362-E418 PolarHBondContact NH1-OE2 3.17Å; L414-E418 HydrophobicContact CD1-CG 3.96Å; L414-E418 HydrophobicContact CG-CG 4.18Å; L414-E418 WeakPolarHBondContact O-CB 3.45Å; L414-E418 WeakPolarHBondContact O-CG 3.3Å; L414-E418 PolarHBondContact O-N 2.97Å; V415-E418 PolarHBondContact O-N 3.01Å; I416-E418 VanDerWaalsContact C-N 3.3Å; I416-E418 PolarHBondContact O-N 2.93Å; E418-T496 HydrophobicContact CB-CG2 4.2Å; E418-T496 WeakPolarHBondContact OE2-CB 3.43Å; E418-T496 PolarHBondContact OE2-OG1 3.13Å; E418-L501 HydrophobicContact CB-CD2 4.22Å; E418-L501 HydrophobicContact CG-CD2 3.96Å
419	S	88	Confident	89.8	Confident	15 Å²	15	9.3 Å²	9.3	11%	0.105	5%	0.05	C	C	.	.	H	α-helix	trans	-83.4	-28.3	-174.6	-55.9	0	0	0	0	113.4	V415 I416	V415-S419 WeakPolarHBondContact O-CB 3.37Å; V415-S419 PolarHBondContact O-N 3.03Å; V415-S419 PolarHBondContact O-OG 2.74Å; I416-S419 PolarHBondContact O-N 3.13Å
420	F	89.6	Confident	89.8	Confident	0 Å²	0	5.5 Å²	5.5	0%	0	4%	0.035	C	C	.	.	S	Bend	trans	-95.7	148.3	-174.7	-75	-91.7	0	0	0	113	L302 L308 Q311 T312 L315 I416 R425 V428	L302-F420 HydrophobicContact CD1-CD1 4.38Å; L302-F420 HydrophobicContact CD1-CE1 3.91Å; L308-F420 HydrophobicContact CB-CE1 4.3Å; L308-F420 HydrophobicContact CD2-CD1 4Å; L308-F420 HydrophobicContact CD2-CE1 3.99Å; Q311-F420 HydrophobicContact CB-CE2 4.25Å; Q311-F420 HydrophobicContact CB-CZ 3.76Å; T312-F420 WeakPolarHBondContact OG1-CE1 3.38Å; T312-F420 WeakPolarHBondContact OG1-CZ 3.4Å; L315-F420 HydrophobicContact CD1-CE2 3.84Å; I416-F420 HydrophobicContact CG2-CD2 4.26Å; I416-F420 VanDerWaalsContact O-CD2 3.26Å; I416-F420 WeakPolarHBondContact O-CD2 3.45Å; I416-F420 PolarHBondContact O-N 2.85Å; F420-R425 HydrophobicContact CB-CG 4.28Å; F420-R425 VanDerWaalsContact O-CG 3.29Å; F420-R425 WeakPolarHBondContact O-CG 3.45Å; F420-R425 PolarHBondContact O-NE 3.23Å; F420-V428 HydrophobicContact CD1-CB 4.33Å; F420-V428 HydrophobicContact CD1-CG1 4.25Å; F420-V428 HydrophobicContact CD1-CG2 3.7Å; F420-V428 HydrophobicContact CD2-CB 4.45Å; F420-V428 HydrophobicContact CD2-CG1 3.89Å; F420-V428 HydrophobicContact CE1-CG1 4.06Å; F420-V428 HydrophobicContact CE1-CG2 3.88Å; F420-V428 HydrophobicContact CE2-CG1 3.69Å; F420-V428 HydrophobicContact CG-CB 4.28Å; F420-V428 HydrophobicContact CG-CG1 4.16Å; F420-V428 HydrophobicContact CG-CG2 4.12Å; F420-V428 HydrophobicContact CZ-CG1 3.78Å; F420-V428 HydrophobicContact CZ-CG2 4.44Å
421	P	87.1	Confident	89.7	Confident	0 Å²	0	5.9 Å²	5.9	0%	0	4%	0.037	C	C	.	.			trans	-64.7	145.8	175.7	27.8	-34.8	0	0	0	111.5	P297 A423 L424 R425 M502 E503	P297-P421 HydrophobicContact CG-CB 3.91Å; P297-P421 HydrophobicContact CG-CG 3.46Å; P297-P421 VanDerWaalsContact CG-CG 3.46Å; P421-A423 PolarHBondContact O-N 3.37Å; P421-L424 HydrophobicContact CG-CB 4.35Å; P421-L424 HydrophobicContact CG-CD1 4.14Å; P421-L424 HydrophobicContact CG-CG 4.43Å; P421-L424 PolarHBondContact O-N 2.91Å; P421-R425 WeakPolarHBondContact O-CG 3.07Å; P421-R425 PolarHBondContact O-N 3.41Å; P421-M502 WeakPolarHBondContact CA-O 3.26Å; P421-M502 HydrophobicContact CB-CG 4.47Å; P421-E503 WeakPolarHBondContact CB-O 3.47Å
422	T	86.6	Confident	89.5	Confident	1 Å²	1	5.9 Å²	5.9	1%	0.006	4%	0.037	C	C	.	.	H	α-helix	trans	-49.2	-41	-174.3	-39.3	0	0	0	0	112.4	R138 E189 R248 Q252 L424 R425	R138-T422 PolarHBondContact NH2-O 2.99Å; E189-T422 WeakPolarHBondContact OE1-CG2 3.47Å; R248-T422 HydrophobicContact CB-CG2 4.44Å; Q252-T422 PolarHBondContact NE2-OG1 2.94Å; Q252-T422 VanDerWaalsContact OE1-CB 3.28Å; T422-L424 PolarHBondContact O-N 3.45Å; T422-L424 VanDerWaalsContact O-N 3.09Å; T422-R425 VanDerWaalsContact CA-CZ 3.42Å; T422-R425 VanDerWaalsContact CG2-NH1 3.32Å; T422-R425 PolarHBondContact O-N 3.21Å; T422-R425 PolarHBondContact OG1-NH1 3.47Å; T422-R425 PolarHBondContact OG1-NH2 2.86Å
423	A	86.4	Confident	89.2	Confident	15 Å²	15	7 Å²	7	12%	0.124	5%	0.045	C	C	.	.	H	α-helix	trans	-62.2	-13.9	179.2	0	0	0	0	0	115.8	D134 P297 P421	D134-A423 WeakPolarHBondContact CB-O 3.29Å; P297-A423 HydrophobicContact CG-CB 4.31Å; P421-A423 PolarHBondContact O-N 3.37Å
424	L	89.3	Confident	88.8	Confident	4 Å²	4	6.7 Å²	6.7	2%	0.021	4%	0.042	C	C	.	.	H	α-helix	trans	-122.8	-7	179.8	-65.7	177.5	0	0	0	113.5	P297 L302 L308 P421 T422 S426 T427 V428	P297-L424 HydrophobicContact CB-CD1 3.53Å; P297-L424 HydrophobicContact CB-CG 3.9Å; P297-L424 HydrophobicContact CG-CD1 3.9Å; P297-L424 HydrophobicContact CG-CG 4.06Å; L302-L424 HydrophobicContact CB-CD1 4.5Å; L302-L424 HydrophobicContact CD1-CD1 4.28Å; L308-L424 HydrophobicContact CD1-CD1 4.2Å; P421-L424 HydrophobicContact CG-CB 4.35Å; P421-L424 HydrophobicContact CG-CD1 4.14Å; P421-L424 HydrophobicContact CG-CG 4.43Å; P421-L424 PolarHBondContact O-N 2.91Å; T422-L424 PolarHBondContact O-N 3.45Å; T422-L424 VanDerWaalsContact O-N 3.09Å; L424-S426 PolarHBondContact O-N 2.89Å; L424-T427 PolarHBondContact O-N 2.96Å; L424-V428 HydrophobicContact CB-CG2 4.27Å; L424-V428 WeakPolarHBondContact O-CG2 3.41Å; L424-V428 PolarHBondContact O-N 3.32Å
425	R	91.2	Very high	88.2	Confident	0 Å²	0	9.8 Å²	9.8	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-57.6	-47.4	-170.8	-76.6	-177	-164.7	124.2	11.2	112.8	V185 E189 M417 F420 P421 T422 S429 M502	V185-R425 HydrophobicContact CG1-CB 3.87Å; V185-R425 HydrophobicContact CG2-CB 3.84Å; E189-R425 IonicContact OE1-CZ 3.93Å; E189-R425 IonicContact OE1-NH1 2.67Å; E189-R425 PolarHBondContact OE1-NH1 3.3Å; M417-R425 WeakPolarHBondContact O-CD 3.4Å; M417-R425 PolarHBondContact O-NE 3.02Å; F420-R425 HydrophobicContact CB-CG 4.28Å; F420-R425 VanDerWaalsContact O-CG 3.29Å; F420-R425 WeakPolarHBondContact O-CG 3.45Å; F420-R425 PolarHBondContact O-NE 3.23Å; P421-R425 WeakPolarHBondContact O-CG 3.07Å; P421-R425 PolarHBondContact O-N 3.41Å; T422-R425 VanDerWaalsContact CA-CZ 3.42Å; T422-R425 VanDerWaalsContact CG2-NH1 3.32Å; T422-R425 PolarHBondContact O-N 3.21Å; T422-R425 PolarHBondContact OG1-NH1 3.47Å; T422-R425 PolarHBondContact OG1-NH2 2.86Å; R425-S429 VanDerWaalsContact O-CB 3.31Å; R425-S429 WeakPolarHBondContact O-CB 3.3Å; R425-S429 PolarHBondContact O-N 3.32Å; R425-M502 PolarHBondContact NH2-O 3.1Å
426	S	91.7	Very high	87.3	Confident	0 Å²	0	9.7 Å²	9.7	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-70.8	-38.7	-178.6	-69.4	0	0	0	0	111.3	G130 R138 L424 G430	G130-S426 WeakPolarHBondContact O-CB 3.25Å; R138-S426 PolarHBondContact NH1-OG 3.25Å; L424-S426 PolarHBondContact O-N 2.89Å; S426-G430 PolarHBondContact O-N 2.84Å
427	T	91.2	Very high	86.4	Confident	6 Å²	6	11.2 Å²	11.2	4%	0.037	7%	0.066	C	C	.	.	H	α-helix	trans	-62.9	-45.8	175.4	-59.9	0	0	0	0	112.5	R131 D134 F299 L424 G430 I431	R131-T427 WeakPolarHBondContact CA-OG1 3.46Å; D134-T427 VanDerWaalsContact OD2-CB 3.26Å; D134-T427 WeakPolarHBondContact OD2-CB 3.36Å; D134-T427 PolarHBondContact OD2-N 3.35Å; D134-T427 PolarHBondContact OD2-OG1 3.29Å; F299-T427 HydrophobicContact CD2-CG2 3.62Å; F299-T427 HydrophobicContact CE2-CG2 3.46Å; F299-T427 VanDerWaalsContact CE2-CG2 3.46Å; L424-T427 PolarHBondContact O-N 2.96Å; T427-G430 WeakPolarHBondContact O-CA 3.18Å; T427-G430 PolarHBondContact O-N 3.25Å; T427-I431 HydrophobicContact CG2-CD1 3.96Å; T427-I431 HydrophobicContact CG2-CG1 4.49Å; T427-I431 WeakPolarHBondContact O-CG1 3.36Å; T427-I431 PolarHBondContact O-N 3.1Å
428	V	91.8	Very high	85.6	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-68.7	-42.3	180	177	0	0	0	0	111.1	L302 T312 I416 F420 L424 G430 I431 S432	L302-V428 HydrophobicContact CD1-CG2 3.55Å; L302-V428 HydrophobicContact CD2-CG2 4.03Å; L302-V428 HydrophobicContact CG-CG2 4.47Å; T312-V428 HydrophobicContact CG2-CG1 4.23Å; I416-V428 HydrophobicContact CG2-CB 4.3Å; I416-V428 HydrophobicContact CG2-CG1 3.76Å; F420-V428 HydrophobicContact CD1-CB 4.33Å; F420-V428 HydrophobicContact CD1-CG1 4.25Å; F420-V428 HydrophobicContact CD1-CG2 3.7Å; F420-V428 HydrophobicContact CD2-CB 4.45Å; F420-V428 HydrophobicContact CD2-CG1 3.89Å; F420-V428 HydrophobicContact CE1-CG1 4.06Å; F420-V428 HydrophobicContact CE1-CG2 3.88Å; F420-V428 HydrophobicContact CE2-CG1 3.69Å; F420-V428 HydrophobicContact CG-CB 4.28Å; F420-V428 HydrophobicContact CG-CG1 4.16Å; F420-V428 HydrophobicContact CG-CG2 4.12Å; F420-V428 HydrophobicContact CZ-CG1 3.78Å; F420-V428 HydrophobicContact CZ-CG2 4.44Å; L424-V428 HydrophobicContact CB-CG2 4.27Å; L424-V428 WeakPolarHBondContact O-CG2 3.41Å; L424-V428 PolarHBondContact O-N 3.32Å; V428-G430 PolarHBondContact O-N 3.14Å; V428-I431 PolarHBondContact O-N 2.9Å; V428-S432 PolarHBondContact O-N 3.33Å; V428-S432 PolarHBondContact O-OG 3.05Å
429	S	90.2	Very high	84.5	Confident	12 Å²	12	13.1 Å²	13.1	8%	0.084	8%	0.079	C	C	.	.	H	α-helix	trans	-56	-42.6	171.6	178.8	0	0	0	0	111.1	R425 S432 S433	R425-S429 VanDerWaalsContact O-CB 3.31Å; R425-S429 WeakPolarHBondContact O-CB 3.3Å; R425-S429 PolarHBondContact O-N 3.32Å; S429-S432 PolarHBondContact O-N 2.89Å; S429-S433 WeakPolarHBondContact O-CB 3.39Å; S429-S433 PolarHBondContact O-N 3.28Å; S429-S433 PolarHBondContact O-OG 2.94Å; S429-S433 VanDerWaalsContact O-OG 3.07Å
430	G	87.7	Confident	83.3	Confident	0 Å²	0	13.5 Å²	13.5	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-60	-51.1	173.4	0	0	0	0	0	113.3	T126 S181 S426 T427 V428 S432 S433 T434	T126-G430 WeakPolarHBondContact CB-O 3.23Å; T126-G430 WeakPolarHBondContact O-CA 3.48Å; S181-G430 WeakPolarHBondContact OG-CA 3.28Å; S181-G430 PolarHBondContact OG-N 3.4Å; S426-G430 PolarHBondContact O-N 2.84Å; T427-G430 WeakPolarHBondContact O-CA 3.18Å; T427-G430 PolarHBondContact O-N 3.25Å; V428-G430 PolarHBondContact O-N 3.14Å; G430-S432 VanDerWaalsContact C-N 3.34Å; G430-S432 PolarHBondContact O-N 3.41Å; G430-S433 PolarHBondContact O-N 2.86Å; G430-T434 WeakPolarHBondContact O-CB 3.48Å; G430-T434 PolarHBondContact O-N 3.11Å; G430-T434 PolarHBondContact O-OG1 3.02Å
431	I	87.6	Confident	82.2	Confident	23 Å²	23	18.7 Å²	18.7	12%	0.118	11%	0.112	C	C	.	.	H	α-helix	trans	-59	-44.5	178	-68.8	165.3	0	0	0	111.1	L127 F299 L302 T312 T427 V428 T434 L435	L127-I431 HydrophobicContact CD2-CB 4.49Å; L127-I431 HydrophobicContact CD2-CG1 3.71Å; F299-I431 HydrophobicContact CE2-CD1 4.19Å; L302-I431 HydrophobicContact CD2-CD1 3.53Å; T312-I431 HydrophobicContact CG2-CG2 4.29Å; T427-I431 HydrophobicContact CG2-CD1 3.96Å; T427-I431 HydrophobicContact CG2-CG1 4.49Å; T427-I431 WeakPolarHBondContact O-CG1 3.36Å; T427-I431 PolarHBondContact O-N 3.1Å; V428-I431 PolarHBondContact O-N 2.9Å; I431-T434 VanDerWaalsContact O-CB 3.26Å; I431-T434 WeakPolarHBondContact O-CB 3.36Å; I431-T434 PolarHBondContact O-N 3.23Å; I431-L435 HydrophobicContact CG2-CD1 4.46Å; I431-L435 PolarHBondContact O-N 3.32Å
432	S	86.1	Confident	81.2	Confident	1 Å²	1	21.8 Å²	21.8	1%	0.007	13%	0.131	C	C	.	.	H	α-helix	trans	-62.8	-48	177.8	-65.6	0	0	0	0	111.1	S316 I416 V428 S429 G430 T434 L435 V436	S316-S432 PolarHBondContact OG-OG 2.95Å; I416-S432 WeakPolarHBondContact CD1-OG 3.46Å; V428-S432 PolarHBondContact O-N 3.33Å; V428-S432 PolarHBondContact O-OG 3.05Å; S429-S432 PolarHBondContact O-N 2.89Å; G430-S432 VanDerWaalsContact C-N 3.34Å; G430-S432 PolarHBondContact O-N 3.41Å; S432-T434 VanDerWaalsContact C-N 3.28Å; S432-T434 PolarHBondContact O-N 3.36Å; S432-L435 PolarHBondContact O-N 3.41Å; S432-V436 WeakPolarHBondContact O-CG2 3.41Å; S432-V436 PolarHBondContact O-N 3.31Å
433	S	82.6	Confident	80.1	Confident	25 Å²	25	22.7 Å²	22.7	18%	0.175	14%	0.136	C	C	.	.	H	α-helix	trans	-61.3	-33.8	176	-64.2	0	0	0	0	113.4	S429 G430 L435 V436 N437	S429-S433 WeakPolarHBondContact O-CB 3.39Å; S429-S433 PolarHBondContact O-N 3.28Å; S429-S433 PolarHBondContact O-OG 2.94Å; S429-S433 VanDerWaalsContact O-OG 3.07Å; G430-S433 PolarHBondContact O-N 2.86Å; S433-L435 VanDerWaalsContact C-N 3.35Å; S433-L435 PolarHBondContact O-N 3.44Å; S433-V436 WeakPolarHBondContact O-CB 3.49Å; S433-V436 PolarHBondContact O-N 3.14Å; S433-N437 PolarHBondContact O-N 2.88Å; S433-N437 VanDerWaalsContact O-N 3.15Å; S433-N437 PolarHBondContact O-ND2 3.4Å
434	T	81.3	Confident	78.8	Confident	15 Å²	15	25.2 Å²	25.2	9%	0.092	15%	0.152	C	C	.	.	H	α-helix	trans	-57.8	-48.7	174.3	-56.4	0	0	0	0	110.4	L123 T126 L127 G430 I431 S432 V436 N437 V438	L123-T434 HydrophobicContact CD1-CG2 3.17Å; L123-T434 VanDerWaalsContact CD1-O 3.24Å; L123-T434 WeakPolarHBondContact CD1-O 3.36Å; L123-T434 HydrophobicContact CG-CG2 3.68Å; T126-T434 WeakPolarHBondContact CB-OG1 3.35Å; T126-T434 PolarHBondContact OG1-OG1 2.78Å; L127-T434 HydrophobicContact CD1-CG2 4.21Å; L127-T434 HydrophobicContact CD2-CG2 4.24Å; L127-T434 HydrophobicContact CG-CG2 4.17Å; G430-T434 WeakPolarHBondContact O-CB 3.48Å; G430-T434 PolarHBondContact O-N 3.11Å; G430-T434 PolarHBondContact O-OG1 3.02Å; I431-T434 VanDerWaalsContact O-CB 3.26Å; I431-T434 WeakPolarHBondContact O-CB 3.36Å; I431-T434 PolarHBondContact O-N 3.23Å; S432-T434 VanDerWaalsContact C-N 3.28Å; S432-T434 PolarHBondContact O-N 3.36Å; T434-V436 VanDerWaalsContact C-N 3.25Å; T434-V436 PolarHBondContact O-N 3.38Å; T434-N437 PolarHBondContact O-N 2.7Å; T434-V438 WeakPolarHBondContact O-CG2 3.37Å; T434-V438 PolarHBondContact O-N 2.93Å; T434-V438 VanDerWaalsContact O-N 3.1Å
435	L	78.6	Confident	77.6	Confident	65 Å²	65	30 Å²	30	34%	0.34	17%	0.174	S	C	.	.	H	α-helix	trans	-66.4	-28	-179.9	-72.7	167.3	0	0	0	112.8	I431 S432 S433 G439	I431-L435 HydrophobicContact CG2-CD1 4.46Å; I431-L435 PolarHBondContact O-N 3.32Å; S432-L435 PolarHBondContact O-N 3.41Å; S433-L435 VanDerWaalsContact C-N 3.35Å; S433-L435 PolarHBondContact O-N 3.44Å; L435-G439 PolarHBondContact O-N 3.13Å
436	V	74.5	Confident	76.3	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65.5	-48.3	171.2	-172.9	0	0	0	0	111.6	I319 F323 W409 S432 S433 T434 V438 G439 G440	I319-V436 HydrophobicContact CB-CG2 3.91Å; I319-V436 HydrophobicContact CG2-CB 4.43Å; I319-V436 HydrophobicContact CG2-CG2 3.16Å; F323-V436 HydrophobicContact CD2-CG1 3.35Å; F323-V436 HydrophobicContact CE2-CG1 3.41Å; F323-V436 VanDerWaalsContact CE2-CG1 3.41Å; W409-V436 HydrophobicContact CH2-CB 3.88Å; W409-V436 HydrophobicContact CH2-CG1 3.54Å; W409-V436 HydrophobicContact CH2-CG2 3.54Å; W409-V436 HydrophobicContact CZ3-CB 4.15Å; W409-V436 HydrophobicContact CZ3-CG1 3.47Å; W409-V436 VanDerWaalsContact CZ3-CG1 3.47Å; W409-V436 HydrophobicContact CZ3-CG2 3.74Å; S432-V436 WeakPolarHBondContact O-CG2 3.41Å; S432-V436 PolarHBondContact O-N 3.31Å; S433-V436 WeakPolarHBondContact O-CB 3.49Å; S433-V436 PolarHBondContact O-N 3.14Å; T434-V436 VanDerWaalsContact C-N 3.25Å; T434-V436 PolarHBondContact O-N 3.38Å; V436-V438 PolarHBondContact O-N 2.87Å; V436-G439 CarbonylContact O-C 3.54Å; V436-G439 WeakPolarHBondContact O-CA 3.4Å; V436-G439 PolarHBondContact O-N 2.99Å; V436-G440 PolarHBondContact O-N 3.29Å
437	N	71.7	Confident	74.8	Confident	35 Å²	35	37.4 Å²	37.4	19%	0.187	21%	0.213	C	C	.	.	H	α-helix	trans	-63.4	-34.9	-178.8	-64.8	-31.4	0	0	0	111.1	L123 S433 T434 G440 L441	L123-N437 HydrophobicContact CD1-CB 4.32Å; S433-N437 PolarHBondContact O-N 2.88Å; S433-N437 VanDerWaalsContact O-N 3.15Å; S433-N437 PolarHBondContact O-ND2 3.4Å; T434-N437 PolarHBondContact O-N 2.7Å; N437-G440 PolarHBondContact O-N 3.07Å; N437-L441 PolarHBondContact O-N 3.17Å; N437-L441 VanDerWaalsContact O-N 3.14Å
438	V	74	Confident	73.3	Confident	57 Å²	57	44.5 Å²	44.5	35%	0.345	24%	0.239	S	C	.	.	H	α-helix	trans	-64.4	-44.8	169.8	177.9	0	0	0	0	111	L123 T434 V436 G440 L441 V442	L123-V438 HydrophobicContact CD1-CG2 3.6Å; L123-V438 HydrophobicContact CD2-CG2 4.49Å; T434-V438 WeakPolarHBondContact O-CG2 3.37Å; T434-V438 PolarHBondContact O-N 2.93Å; T434-V438 VanDerWaalsContact O-N 3.1Å; V436-V438 PolarHBondContact O-N 2.87Å; V438-G440 VanDerWaalsContact C-N 3.31Å; V438-G440 PolarHBondContact O-N 3.1Å; V438-L441 WeakPolarHBondContact O-CB 3.24Å; V438-L441 PolarHBondContact O-N 3.09Å; V438-L441 VanDerWaalsContact O-N 3.07Å; V438-V442 HydrophobicContact CG1-CG2 4.17Å; V438-V442 WeakPolarHBondContact O-CG2 3.45Å; V438-V442 PolarHBondContact O-N 2.71Å
439	G	66.8	Low	71.8	Confident	2 Å²	2	53.6 Å²	53.6	2%	0.021	27%	0.273	C	S	.	.	H	α-helix	trans	-55.3	-45.1	173.7	0	0	0	0	0	112.5	L435 V436 L441 V442 V443	L435-G439 PolarHBondContact O-N 3.13Å; V436-G439 CarbonylContact O-C 3.54Å; V436-G439 WeakPolarHBondContact O-CA 3.4Å; V436-G439 PolarHBondContact O-N 2.99Å; G439-L441 VanDerWaalsContact C-N 3.26Å; G439-L441 PolarHBondContact O-N 3.19Å; G439-V442 PolarHBondContact O-N 2.83Å; G439-V443 WeakPolarHBondContact O-CB 3.32Å; G439-V443 VanDerWaalsContact O-CG2 3.24Å; G439-V443 WeakPolarHBondContact O-CG2 3.47Å; G439-V443 PolarHBondContact O-N 3.48Å
440	G	64.1	Low	70.3	Confident	22 Å²	22	54.5 Å²	54.5	23%	0.227	28%	0.278	C	S	.	.	H	α-helix	trans	-63.9	-26.5	175.8	0	0	0	0	0	114.1	V436 N437 V438 P444	V436-G440 PolarHBondContact O-N 3.29Å; N437-G440 PolarHBondContact O-N 3.07Å; V438-G440 VanDerWaalsContact C-N 3.31Å; V438-G440 PolarHBondContact O-N 3.1Å; G440-P444 WeakPolarHBondContact O-CD 3.24Å; G440-P444 VanDerWaalsContact O-CG 3.28Å; G440-P444 WeakPolarHBondContact O-CG 2.93Å
441	L	65.3	Low	68.5	Low	109 Å²	109	62.5 Å²	62.5	57%	0.571	31%	0.308	S	S	*	.	H	α-helix	trans	-79.8	-38.5	173.1	-172.8	67	0	0	0	112.1	N437 V438 G439 Q445	N437-L441 PolarHBondContact O-N 3.17Å; N437-L441 VanDerWaalsContact O-N 3.14Å; V438-L441 WeakPolarHBondContact O-CB 3.24Å; V438-L441 PolarHBondContact O-N 3.09Å; V438-L441 VanDerWaalsContact O-N 3.07Å; G439-L441 VanDerWaalsContact C-N 3.26Å; G439-L441 PolarHBondContact O-N 3.19Å; L441-Q445 VanDerWaalsContact O-CG 3.29Å; L441-Q445 WeakPolarHBondContact O-CG 3.19Å
442	V	65.6	Low	66.6	Low	66 Å²	66	66 Å²	66	40%	0.4	33%	0.333	S	S	.	.	H	α-helix	trans	-82.3	-41.1	-173.4	175	0	0	0	0	112.3	V438 G439 Q445 L446	V438-V442 HydrophobicContact CG1-CG2 4.17Å; V438-V442 WeakPolarHBondContact O-CG2 3.45Å; V438-V442 PolarHBondContact O-N 2.71Å; G439-V442 PolarHBondContact O-N 2.83Å; V442-Q445 WeakPolarHBondContact O-CB 3.44Å; V442-Q445 PolarHBondContact O-N 2.98Å; V442-L446 HydrophobicContact CG1-CD1 3.77Å; V442-L446 HydrophobicContact CG1-CG 4.05Å; V442-L446 WeakPolarHBondContact O-CG 3.38Å; V442-L446 PolarHBondContact O-N 3.49Å
443	V	63.8	Low	64.5	Low	19 Å²	19	75.8 Å²	75.8	12%	0.115	38%	0.375	C	S	.	.	H	α-helix	trans	-62.2	-48.2	-173.2	169.7	0	0	0	0	112.9	G439 Q445 L446 L447	G439-V443 WeakPolarHBondContact O-CB 3.32Å; G439-V443 VanDerWaalsContact O-CG2 3.24Å; G439-V443 WeakPolarHBondContact O-CG2 3.47Å; G439-V443 PolarHBondContact O-N 3.48Å; V443-Q445 PolarHBondContact O-N 3.11Å; V443-L446 PolarHBondContact O-N 3.15Å; V443-L447 HydrophobicContact CG1-CD1 4.1Å; V443-L447 HydrophobicContact CG1-CG 4.45Å; V443-L447 WeakPolarHBondContact O-CG 3.45Å; V443-L447 PolarHBondContact O-N 2.98Å
444	P	60.3	Low	62	Low	69 Å²	69	77.1 Å²	77.1	45%	0.448	39%	0.393	S	S	.	.	H	α-helix	trans	-61	-33.2	176.4	-24.9	36	0	0	0	112.9	G440 L447 W448	G440-P444 WeakPolarHBondContact O-CD 3.24Å; G440-P444 VanDerWaalsContact O-CG 3.28Å; G440-P444 WeakPolarHBondContact O-CG 2.93Å; P444-L447 PolarHBondContact O-N 3.44Å; P444-W448 VanDerWaalsContact O-CB 3.31Å; P444-W448 WeakPolarHBondContact O-CB 3.34Å; P444-W448 PolarHBondContact O-N 3.02Å
445	Q	62.5	Low	59.6	Low	104 Å²	104	83.8 Å²	83.8	49%	0.486	43%	0.434	S	S	.	.	H	α-helix	trans	-69.1	-43.1	176.5	-59.1	-60.6	-31.6	0	0	111.1	L441 V442 V443 L447 W448 W449	L441-Q445 VanDerWaalsContact O-CG 3.29Å; L441-Q445 WeakPolarHBondContact O-CG 3.19Å; V442-Q445 WeakPolarHBondContact O-CB 3.44Å; V442-Q445 PolarHBondContact O-N 2.98Å; V443-Q445 PolarHBondContact O-N 3.11Å; Q445-L447 VanDerWaalsContact C-N 3.32Å; Q445-L447 PolarHBondContact O-N 3.32Å; Q445-W448 PolarHBondContact O-N 3.5Å; Q445-W449 PolarHBondContact O-N 3.45Å
446	L	64.1	Low	57.4	Low	107 Å²	107	85 Å²	85	56%	0.56	45%	0.453	S	S	*	.	H	α-helix	trans	-60.4	-41.2	173.4	-69.9	173	0	0	0	111.9	V442 V443	V442-L446 HydrophobicContact CG1-CD1 3.77Å; V442-L446 HydrophobicContact CG1-CG 4.05Å; V442-L446 WeakPolarHBondContact O-CG 3.38Å; V442-L446 PolarHBondContact O-N 3.49Å; V443-L446 PolarHBondContact O-N 3.15Å
447	L	60.9	Low	55.3	Low	48 Å²	48	92.7 Å²	92.7	25%	0.251	49%	0.493	S	S	.	.	H	α-helix	trans	-69.4	-36.8	176.4	-68.6	175.4	0	0	0	112.3	V443 P444 Q445 V450 R451 P474	V443-L447 HydrophobicContact CG1-CD1 4.1Å; V443-L447 HydrophobicContact CG1-CG 4.45Å; V443-L447 WeakPolarHBondContact O-CG 3.45Å; V443-L447 PolarHBondContact O-N 2.98Å; P444-L447 PolarHBondContact O-N 3.44Å; Q445-L447 VanDerWaalsContact C-N 3.32Å; Q445-L447 PolarHBondContact O-N 3.32Å; L447-V450 PolarHBondContact O-N 3.06Å; L447-R451 PolarHBondContact O-N 3.13Å; L447-P474 HydrophobicContact CD2-CB 3.93Å
448	W	60	Low	53.3	Low	155 Å²	155	100.7 Å²	100.7	59%	0.587	53%	0.529	S	S	*	.	H	α-helix	trans	-65.5	-41.9	176.5	-176.3	77.9	0	0	0	111.9	P444 Q445 V450 R451	P444-W448 VanDerWaalsContact O-CB 3.31Å; P444-W448 WeakPolarHBondContact O-CB 3.34Å; P444-W448 PolarHBondContact O-N 3.02Å; Q445-W448 PolarHBondContact O-N 3.5Å; W448-V450 PolarHBondContact O-N 3.04Å; W448-V450 VanDerWaalsContact O-N 3.13Å; W448-R451 PolarHBondContact O-N 3.44Å; W448-R451 VanDerWaalsContact O-N 3.11Å
449	W	60.4	Low	51.1	Low	192 Å²	192	102.9 Å²	102.9	73%	0.727	55%	0.547	S	S	*	.	H	α-helix	trans	-59.2	-24.2	176.5	-85.6	52.5	0	0	0	113.6	Q445	Q445-W449 PolarHBondContact O-N 3.45Å
450	V	57.4	Low	49.5	Very low	30 Å²	30	108.5 Å²	108.5	18%	0.182	59%	0.585	C	S	.	*	H	α-helix	trans	-102.3	-4.8	-179.7	-174.4	0	0	0	0	113.3	L447 W448 I469 P474	L447-V450 PolarHBondContact O-N 3.06Å; W448-V450 PolarHBondContact O-N 3.04Å; W448-V450 VanDerWaalsContact O-N 3.13Å; V450-I469 HydrophobicContact CG1-CB 4.44Å; V450-I469 HydrophobicContact CG1-CG2 4.02Å; V450-I469 HydrophobicContact CG2-CG2 4.1Å; V450-P474 HydrophobicContact CB-CG 3.43Å; V450-P474 VanDerWaalsContact CB-CG 3.43Å; V450-P474 HydrophobicContact CG1-CG 3.33Å; V450-P474 HydrophobicContact CG2-CG 3.52Å
451	R	50.8	Low	47.9	Very low	168 Å²	168	116.2 Å²	116.2	63%	0.634	61%	0.612	S	S	*	*	S	Bend	trans	-67.4	134.7	167.4	-71.9	-158.8	-173.2	-174.4	4.7	109	L447 W448 K453	L447-R451 PolarHBondContact O-N 3.13Å; W448-R451 PolarHBondContact O-N 3.44Å; W448-R451 VanDerWaalsContact O-N 3.11Å; R451-K453 PolarHBondContact O-N 3.44Å; R451-K453 VanDerWaalsContact O-N 3.14Å
452	P	47	Very low	46.3	Very low	97 Å²	97	117.2 Å²	117.2	63%	0.63	62%	0.618	S	S	*	*			trans	-57.6	125.1	173	23.1	-30.7	0	0	0	108.4	G454	P452-G454 PolarHBondContact O-N 2.98Å
453	K	41.8	Very low	44.8	Very low	206 Å²	206	121.6 Å²	121.6	90%	0.896	64%	0.639	S	S	*	*			trans	-67.8	73.9	165.7	-69.9	-176.4	179.2	178.2	0	107.9	R451	R451-K453 PolarHBondContact O-N 3.44Å; R451-K453 VanDerWaalsContact O-N 3.14Å
454	G	31.1	Very low	43.3	Very low	54 Å²	54	130.4 Å²	130.4	56%	0.557	67%	0.672	S	S	*	*			trans	-134.3	127.3	179	0	0	0	0	0	108.3	P452	P452-G454 PolarHBondContact O-N 2.98Å
455	V	31.3	Very low	42.1	Very low	155 Å²	155	136.9 Å²	136.9	94%	0.939	69%	0.693	S	S	*	*			trans	92	56.2	-175	-162.7	0	0	0	0	113.9
456	A	32.1	Very low	40.7	Very low	90 Å²	90	139.2 Å²	139.2	74%	0.744	70%	0.704	S	S	*	*	S	Bend	trans	-125	119.5	139.5	0	0	0	0	0	106.8
457	L	31.1	Very low	39.5	Very low	162 Å²	162	137.3 Å²	137.3	85%	0.848	71%	0.71	S	S	*	*			trans	67	111.9	-179.9	-81.3	92.6	0	0	0	118.5	S459	L457-S459 PolarHBondContact O-N 3.22Å
458	Q	28.8	Very low	38.9	Very low	202 Å²	202	141.1 Å²	141.1	94%	0.944	74%	0.736	S	S	*	*	S	Bend	trans	-62.8	88.6	157.8	-175.4	156.4	-7.5	0	0	110.7
459	S	27	Very low	38.9	Very low	104 Å²	104	138 Å²	138	73%	0.727	73%	0.729	S	S	*	*			trans	-172.5	152.1	154.2	-157	0	0	0	0	109.7	L457	L457-S459 PolarHBondContact O-N 3.22Å
460	C	33.4	Very low	39.1	Very low	119 Å²	119	136.3 Å²	136.3	80%	0.804	72%	0.723	S	S	*	*			trans	80.3	79.3	-177.9	-62.9	0	0	0	0	116
461	K	31.5	Very low	39.3	Very low	184 Å²	184	141.1 Å²	141.1	80%	0.8	74%	0.742	S	S	*	*				-27.9	141.1	129.8	-100.2	177.8	172.2	178.9	0	112.3
462	D	32	Very low	40.2	Very low	131 Å²	131	133.5 Å²	133.5	70%	0.701	71%	0.714	S	S	*	*			trans	64.2	85.6	156.5	-46.7	-30.3	0	0	0	114.8
463	N	32.8	Very low	41.5	Very low	158 Å²	158	132.3 Å²	132.3	85%	0.845	70%	0.702	S	S	*	*				-171.2	123.2	127.3	-89.7	-37.2	0	0	0	111.6	F465	N463-F465 PolarHBondContact O-N 3.09Å; N463-F465 VanDerWaalsContact O-N 3.1Å
464	Y	32.5	Very low	42.7	Very low	204 Å²	204	123.3 Å²	123.3	80%	0.8	66%	0.664	S	S	*	*			trans	-32.2	105.4	153.8	-128.8	-108.2	0	0	0	110.7	E466	Y464-E466 HydrophobicContact CD1-CG 4.3Å; Y464-E466 HydrophobicContact CE1-CG 4.42Å
465	F	36.2	Very low	44.6	Very low	204 Å²	204	122.3 Å²	122.3	90%	0.895	64%	0.644	S	S	*	*			trans	-135.7	110.3	156.5	-145.5	-96.1	0	0	0	110.1	N463	N463-F465 PolarHBondContact O-N 3.09Å; N463-F465 VanDerWaalsContact O-N 3.1Å
466	E	32.8	Very low	46.9	Very low	153 Å²	153	118.6 Å²	118.6	72%	0.715	62%	0.618	S	S	*	*			trans	-67.2	136.5	-177.1	-66.7	160.1	145	0	0	110.7	Y464	Y464-E466 HydrophobicContact CD1-CG 4.3Å; Y464-E466 HydrophobicContact CE1-CG 4.42Å
467	G	38.3	Very low	49.1	Very low	67 Å²	67	118.6 Å²	118.6	69%	0.691	61%	0.608	S	S	*	*			trans	165.1	20.5	176.9	0	0	0	0	0	113.7	I469	G467-I469 PolarHBondContact O-N 3.32Å; G467-I469 VanDerWaalsContact O-N 3.1Å
468	T	49.8	Very low	51.2	Low	128 Å²	128	112 Å²	112	79%	0.785	58%	0.575	S	S	*	*			trans	-79.1	91.1	175.9	28	0	0	0	0	109.3	W470	T468-W470 PolarHBondContact O-N 2.69Å; T468-W470 VanDerWaalsContact O-N 3.09Å
469	I	58	Low	53.7	Low	89 Å²	89	103.1 Å²	103.1	46%	0.456	53%	0.534	S	S	.	.			trans	-50.9	121.3	159.2	-64.8	173.1	0	0	0	106.4	V450 G467 K471 I473	V450-I469 HydrophobicContact CG1-CB 4.44Å; V450-I469 HydrophobicContact CG1-CG2 4.02Å; V450-I469 HydrophobicContact CG2-CG2 4.1Å; G467-I469 PolarHBondContact O-N 3.32Å; G467-I469 VanDerWaalsContact O-N 3.1Å; I469-K471 PolarHBondContact O-N 2.01Å; I469-I473 HydrophobicContact CG2-CB 4.3Å; I469-I473 HydrophobicContact CG2-CD1 3.87Å; I469-I473 HydrophobicContact CG2-CG2 4.44Å
470	W	64.6	Low	56.5	Low	157 Å²	157	102.5 Å²	102.5	60%	0.595	53%	0.526	S	S	*	.			trans	-44.6	116.8	-177.3	-126.6	57.9	0	0	0	109.7	W385 T468 P472 I473	W385-W470 AromaticContact NE1-CH2 3.5Å; W385-W470 AromaticContact NE1-CZ3 3.74Å; T468-W470 PolarHBondContact O-N 2.69Å; T468-W470 VanDerWaalsContact O-N 3.09Å; W470-P472 HydrophobicContact CD2-CG 4.19Å; W470-P472 HydrophobicContact CE3-CG 3.34Å; W470-P472 HydrophobicContact CZ3-CG 3.76Å; W470-P472 WeakPolarHBondContact O-CD 3.32Å; W470-I473 HydrophobicContact CB-CD1 3.39Å; W470-I473 HydrophobicContact CB-CG1 3.72Å; W470-I473 WeakPolarHBondContact O-CB 2.94Å; W470-I473 WeakPolarHBondContact O-CG1 3.43Å; W470-I473 PolarHBondContact O-N 3.24Å
471	K	63.5	Low	59	Low	131 Å²	131	97.7 Å²	97.7	57%	0.57	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-42.4	-38.1	-175.4	-65.7	178.3	-173	168	0	115	E387 I469	E387-K471 IonicContact OE1-NZ 3.96Å; E387-K471 PolarHBondContact OE1-NZ 3.24Å; E387-K471 VanDerWaalsContact OE1-NZ 3.1Å; I469-K471 PolarHBondContact O-N 2.01Å
472	P	68.9	Low	61.5	Low	9 Å²	9	89.5 Å²	89.5	6%	0.058	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-9.3	-178.4	35.3	-41.1	0	0	0	115	T381 W470 P474 W475 I476	T381-P472 HydrophobicContact CG2-CB 4.26Å; W470-P472 HydrophobicContact CD2-CG 4.19Å; W470-P472 HydrophobicContact CE3-CG 3.34Å; W470-P472 HydrophobicContact CZ3-CG 3.76Å; W470-P472 WeakPolarHBondContact O-CD 3.32Å; P472-P474 VanDerWaalsContact C-CD 3.47Å; P472-W475 PolarHBondContact O-N 2.89Å; P472-W475 VanDerWaalsContact O-N 3.09Å; P472-I476 HydrophobicContact CB-CD1 4.22Å; P472-I476 HydrophobicContact CG-CD1 4.34Å; P472-I476 WeakPolarHBondContact O-CG1 3.28Å; P472-I476 PolarHBondContact O-N 3.48Å
473	I	73.6	Confident	64.3	Low	71 Å²	71	86.5 Å²	86.5	36%	0.364	45%	0.448	S	S	.	.	H	α-helix	trans	-51.2	-47.5	-175	-77.2	168.3	0	0	0	113.6	I469 W470 W475 I476 V477	I469-I473 HydrophobicContact CG2-CB 4.3Å; I469-I473 HydrophobicContact CG2-CD1 3.87Å; I469-I473 HydrophobicContact CG2-CG2 4.44Å; W470-I473 HydrophobicContact CB-CD1 3.39Å; W470-I473 HydrophobicContact CB-CG1 3.72Å; W470-I473 WeakPolarHBondContact O-CB 2.94Å; W470-I473 WeakPolarHBondContact O-CG1 3.43Å; W470-I473 PolarHBondContact O-N 3.24Å; I473-W475 VanDerWaalsContact C-N 3.25Å; I473-W475 PolarHBondContact O-N 2.62Å; I473-I476 PolarHBondContact O-N 2.96Å; I473-V477 HydrophobicContact CG2-CG2 4.21Å; I473-V477 WeakPolarHBondContact O-CG2 3.2Å; I473-V477 PolarHBondContact O-N 2.86Å
474	P	68.4	Low	67	Low	17 Å²	17	81 Å²	81	11%	0.11	42%	0.421	C	S	.	.	H	α-helix	trans	-60.7	-39.4	-178.2	-23.5	33.6	0	0	0	112	L447 V450 P472 V477 V478	L447-P474 HydrophobicContact CD2-CB 3.93Å; V450-P474 HydrophobicContact CB-CG 3.43Å; V450-P474 VanDerWaalsContact CB-CG 3.43Å; V450-P474 HydrophobicContact CG1-CG 3.33Å; V450-P474 HydrophobicContact CG2-CG 3.52Å; P472-P474 VanDerWaalsContact C-CD 3.47Å; P474-V477 PolarHBondContact O-N 3.45Å; P474-V478 WeakPolarHBondContact O-CB 3.47Å; P474-V478 VanDerWaalsContact O-CG2 3.23Å; P474-V478 WeakPolarHBondContact O-CG2 3.42Å; P474-V478 PolarHBondContact O-N 3.23Å
475	W	71.1	Confident	69.7	Low	34 Å²	34	71.3 Å²	71.3	13%	0.129	38%	0.384	C	S	.	.	H	α-helix	trans	-69.3	-40.6	-180	-60	96.2	0	0	0	111	M325 M377 T381 K384 P472 I473 V478 V479	M325-W475 HydrophobicContact SD-CZ3 4.34Å; M377-W475 HydrophobicContact SD-CE3 3.87Å; M377-W475 HydrophobicContact SD-CZ3 3.74Å; T381-W475 HydrophobicContact CG2-CB 3.82Å; T381-W475 VanDerWaalsContact OG1-CB 3.24Å; T381-W475 WeakPolarHBondContact OG1-CB 2.91Å; K384-W475 VanDerWaalsContact NZ-CE2 3.28Å; P472-W475 PolarHBondContact O-N 2.89Å; P472-W475 VanDerWaalsContact O-N 3.09Å; I473-W475 VanDerWaalsContact C-N 3.25Å; I473-W475 PolarHBondContact O-N 2.62Å; W475-V478 PolarHBondContact O-N 3.35Å; W475-V479 WeakPolarHBondContact O-CB 3.35Å; W475-V479 VanDerWaalsContact O-CG2 3.23Å; W475-V479 WeakPolarHBondContact O-CG2 3.11Å; W475-V479 PolarHBondContact O-N 2.98Å
476	I	77.8	Confident	72.3	Confident	77 Å²	77	63 Å²	63	40%	0.395	35%	0.347	S	S	.	.	H	α-helix	trans	-60.8	-46.4	173.4	-64.6	168.7	0	0	0	110.6	T381 P472 I473 V478 V479 V480	T381-I476 HydrophobicContact CG2-CG1 4.11Å; P472-I476 HydrophobicContact CB-CD1 4.22Å; P472-I476 HydrophobicContact CG-CD1 4.34Å; P472-I476 WeakPolarHBondContact O-CG1 3.28Å; P472-I476 PolarHBondContact O-N 3.48Å; I473-I476 PolarHBondContact O-N 2.96Å; I476-V478 VanDerWaalsContact C-N 3.34Å; I476-V478 PolarHBondContact O-N 2.92Å; I476-V479 PolarHBondContact O-N 2.96Å; I476-V480 HydrophobicContact CG2-CG2 4.29Å; I476-V480 WeakPolarHBondContact O-CB 3.27Å; I476-V480 VanDerWaalsContact O-CG2 3.28Å; I476-V480 WeakPolarHBondContact O-CG2 3.37Å; I476-V480 PolarHBondContact O-N 3.4Å
477	V	78.7	Confident	75.1	Confident	90 Å²	90	60.5 Å²	60.5	55%	0.545	34%	0.339	S	S	.	.	H	α-helix	trans	-60.5	-44.8	178.4	172	0	0	0	0	111	I473 P474 V480 A481	I473-V477 HydrophobicContact CG2-CG2 4.21Å; I473-V477 WeakPolarHBondContact O-CG2 3.2Å; I473-V477 PolarHBondContact O-N 2.86Å; P474-V477 PolarHBondContact O-N 3.45Å; V477-V480 PolarHBondContact O-N 3.31Å; V477-A481 VanDerWaalsContact O-CB 3.3Å; V477-A481 WeakPolarHBondContact O-CB 3.19Å; V477-A481 PolarHBondContact O-N 2.89Å
478	V	76	Confident	77.6	Confident	24 Å²	24	59.4 Å²	59.4	15%	0.145	32%	0.318	C	S	.	.	H	α-helix	trans	-64.7	-41.6	177.8	171.6	0	0	0	0	111.4	M377 P474 W475 I476 A481 A482	M377-V478 HydrophobicContact CE-CG1 3.73Å; M377-V478 HydrophobicContact SD-CG1 4.23Å; P474-V478 WeakPolarHBondContact O-CB 3.47Å; P474-V478 VanDerWaalsContact O-CG2 3.23Å; P474-V478 WeakPolarHBondContact O-CG2 3.42Å; P474-V478 PolarHBondContact O-N 3.23Å; W475-V478 PolarHBondContact O-N 3.35Å; I476-V478 VanDerWaalsContact C-N 3.34Å; I476-V478 PolarHBondContact O-N 2.92Å; V478-A481 PolarHBondContact O-N 3.32Å; V478-A482 VanDerWaalsContact O-CB 3.27Å; V478-A482 WeakPolarHBondContact O-CB 3.43Å; V478-A482 PolarHBondContact O-N 3.47Å
479	V	81.4	Confident	79.6	Confident	14 Å²	14	53.3 Å²	53.3	9%	0.085	28%	0.281	C	S	.	.	H	α-helix	trans	-62.9	-48.1	176	166.8	0	0	0	0	111.2	M377 L378 W475 I476 A481 A482 V483	M377-V479 HydrophobicContact CB-CG2 3.77Å; L378-V479 HydrophobicContact CD1-CG1 4.5Å; L378-V479 HydrophobicContact CD2-CB 4.46Å; L378-V479 HydrophobicContact CD2-CG1 3.62Å; L378-V479 HydrophobicContact CD2-CG2 4.11Å; L378-V479 HydrophobicContact CG-CG1 3.91Å; L378-V479 HydrophobicContact CG-CG2 4.14Å; W475-V479 WeakPolarHBondContact O-CB 3.35Å; W475-V479 VanDerWaalsContact O-CG2 3.23Å; W475-V479 WeakPolarHBondContact O-CG2 3.11Å; W475-V479 PolarHBondContact O-N 2.98Å; I476-V479 PolarHBondContact O-N 2.96Å; V479-A481 VanDerWaalsContact C-N 3.31Å; V479-A481 PolarHBondContact O-N 2.87Å; V479-A482 PolarHBondContact O-N 3.19Å; V479-A482 VanDerWaalsContact O-N 3.16Å; V479-V483 HydrophobicContact CG1-CG2 4.41Å; V479-V483 WeakPolarHBondContact O-CG2 3.12Å; V479-V483 PolarHBondContact O-N 2.96Å
480	V	86	Confident	81.1	Confident	92 Å²	92	51.8 Å²	51.8	56%	0.558	27%	0.273	S	S	*	.	H	α-helix	trans	-60.8	-44.3	178.8	170.6	0	0	0	0	110.4	I476 V477 A482 V483 S484	I476-V480 HydrophobicContact CG2-CG2 4.29Å; I476-V480 WeakPolarHBondContact O-CB 3.27Å; I476-V480 VanDerWaalsContact O-CG2 3.28Å; I476-V480 WeakPolarHBondContact O-CG2 3.37Å; I476-V480 PolarHBondContact O-N 3.4Å; V477-V480 PolarHBondContact O-N 3.31Å; V480-A482 PolarHBondContact O-N 3.42Å; V480-V483 PolarHBondContact O-N 2.87Å; V480-S484 WeakPolarHBondContact O-CB 3.5Å; V480-S484 PolarHBondContact O-N 3.31Å
481	A	84.7	Confident	82.4	Confident	18 Å²	18	50.4 Å²	50.4	15%	0.149	28%	0.277	C	S	.	.	H	α-helix	trans	-60.2	-45.9	174.7	0	0	0	0	0	111.2	Y317 L321 V477 V478 V479 V483 S484 S485	Y317-A481 WeakPolarHBondContact OH-CA 3.39Å; Y317-A481 PolarHBondContact OH-O 2.79Å; L321-A481 HydrophobicContact CD1-CB 3.82Å; L321-A481 WeakPolarHBondContact CD1-O 3.47Å; L321-A481 HydrophobicContact CD2-CB 3.72Å; L321-A481 HydrophobicContact CG-CB 4.46Å; V477-A481 VanDerWaalsContact O-CB 3.3Å; V477-A481 WeakPolarHBondContact O-CB 3.19Å; V477-A481 PolarHBondContact O-N 2.89Å; V478-A481 PolarHBondContact O-N 3.32Å; V479-A481 VanDerWaalsContact C-N 3.31Å; V479-A481 PolarHBondContact O-N 2.87Å; A481-V483 PolarHBondContact O-N 3.21Å; A481-S484 PolarHBondContact O-N 3.49Å; A481-S484 PolarHBondContact O-OG 3.1Å; A481-S485 WeakPolarHBondContact O-CB 3.24Å; A481-S485 PolarHBondContact O-N 2.9Å
482	A	85	Confident	83.7	Confident	11 Å²	11	49.8 Å²	49.8	9%	0.091	27%	0.274	C	S	.	.	H	α-helix	trans	-63	-45	-179.4	0	0	0	0	0	112.2	L321 I374 V478 V479 V480 S484 S485 Q486	L321-A482 HydrophobicContact CD1-CB 4.36Å; I374-A482 HydrophobicContact CD1-CB 4.11Å; I374-A482 HydrophobicContact CG1-CB 3.65Å; V478-A482 VanDerWaalsContact O-CB 3.27Å; V478-A482 WeakPolarHBondContact O-CB 3.43Å; V478-A482 PolarHBondContact O-N 3.47Å; V479-A482 PolarHBondContact O-N 3.19Å; V479-A482 VanDerWaalsContact O-N 3.16Å; V480-A482 PolarHBondContact O-N 3.42Å; A482-S484 VanDerWaalsContact C-N 3.34Å; A482-S484 PolarHBondContact O-N 3.47Å; A482-S485 PolarHBondContact O-N 3.1Å; A482-S485 PolarHBondContact O-OG 3.09Å; A482-Q486 PolarHBondContact O-N 3.31Å
483	V	89.4	Confident	84.6	Confident	69 Å²	69	49.5 Å²	49.5	42%	0.418	27%	0.272	S	S	.	.	H	α-helix	trans	-60.3	-44.3	174.7	172.1	0	0	0	0	110.9	I374 V479 V480 A481 S485 Q486 L487	I374-V483 HydrophobicContact CD1-CG2 4.15Å; I374-V483 HydrophobicContact CG2-CG2 3.91Å; V479-V483 HydrophobicContact CG1-CG2 4.41Å; V479-V483 WeakPolarHBondContact O-CG2 3.12Å; V479-V483 PolarHBondContact O-N 2.96Å; V480-V483 PolarHBondContact O-N 2.87Å; A481-V483 PolarHBondContact O-N 3.21Å; V483-S485 VanDerWaalsContact C-N 3.3Å; V483-S485 PolarHBondContact O-N 3.5Å; V483-Q486 PolarHBondContact O-N 3.38Å; V483-L487 WeakPolarHBondContact O-CB 3.35Å; V483-L487 PolarHBondContact O-N 3.39Å
484	S	91	Very high	85.3	Confident	42 Å²	42	49.4 Å²	49.4	29%	0.294	28%	0.278	S	S	.	.	H	α-helix	trans	-65.5	-35.1	177.5	82.5	0	0	0	0	112.2	Y317 V480 A481 A482 L487 T488	Y317-S484 WeakPolarHBondContact CE1-OG 3.25Å; Y317-S484 PolarHBondContact OH-OG 3.41Å; V480-S484 WeakPolarHBondContact O-CB 3.5Å; V480-S484 PolarHBondContact O-N 3.31Å; A481-S484 PolarHBondContact O-N 3.49Å; A481-S484 PolarHBondContact O-OG 3.1Å; A482-S484 VanDerWaalsContact C-N 3.34Å; A482-S484 PolarHBondContact O-N 3.47Å; S484-L487 PolarHBondContact O-N 3.15Å; S484-T488 WeakPolarHBondContact O-CB 3.31Å; S484-T488 VanDerWaalsContact O-CG2 3.31Å; S484-T488 WeakPolarHBondContact O-CG2 3.49Å; S484-T488 PolarHBondContact O-N 2.03Å; S484-T488 PolarHBondContact O-OG1 3.1Å
485	S	89.2	Confident	86.3	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.007	28%	0.282	C	S	.	.	H	α-helix	trans	-67.5	-39	176.2	84.4	0	0	0	0	111.7	Y317 A481 A482 V483 T488 F489	Y317-S485 VanDerWaalsContact CE1-CA 3.47Å; Y317-S485 VanDerWaalsContact CE1-CB 3.43Å; A481-S485 WeakPolarHBondContact O-CB 3.24Å; A481-S485 PolarHBondContact O-N 2.9Å; A482-S485 PolarHBondContact O-N 3.1Å; A482-S485 PolarHBondContact O-OG 3.09Å; V483-S485 VanDerWaalsContact C-N 3.3Å; V483-S485 PolarHBondContact O-N 3.5Å; S485-T488 WeakPolarHBondContact CA-OG1 3.36Å; S485-T488 PolarHBondContact O-OG1 3.46Å; S485-F489 VanDerWaalsContact O-CB 3.26Å; S485-F489 WeakPolarHBondContact O-CB 3.4Å; S485-F489 PolarHBondContact O-N 3.36Å
486	Q	90.4	Very high	87.1	Confident	29 Å²	29	49.6 Å²	49.6	14%	0.136	28%	0.28	C	S	.	.	H	α-helix	trans	-67.2	-45.4	176	-174	-175	9.3	0	0	111	G367 L370 S371 I374 A482 V483 F489 L490	G367-Q486 PolarHBondContact O-NE2 3.4Å; L370-Q486 HydrophobicContact CB-CB 4.22Å; L370-Q486 HydrophobicContact CB-CG 3.92Å; L370-Q486 HydrophobicContact CD1-CB 3.97Å; L370-Q486 HydrophobicContact CD1-CG 3.98Å; S371-Q486 PolarHBondContact OG-NE2 3.43Å; I374-Q486 HydrophobicContact CD1-CB 4.23Å; A482-Q486 PolarHBondContact O-N 3.31Å; V483-Q486 PolarHBondContact O-N 3.38Å; Q486-F489 PolarHBondContact O-N 3.3Å; Q486-L490 HydrophobicContact CG-CD1 4Å; Q486-L490 HydrophobicContact CG-CG 4.45Å; Q486-L490 WeakPolarHBondContact O-CB 3.29Å; Q486-L490 VanDerWaalsContact O-CG 3.3Å; Q486-L490 WeakPolarHBondContact O-CG 3.04Å; Q486-L490 PolarHBondContact O-N 3.47Å
487	L	91.6	Very high	87.4	Confident	101 Å²	101	48 Å²	48	53%	0.529	27%	0.27	S	S	.	.	H	α-helix	trans	-62.2	-46.8	178.4	-176.1	63.5	0	0	0	111.1	V483 S484 F489 L490 L491	V483-L487 WeakPolarHBondContact O-CB 3.35Å; V483-L487 PolarHBondContact O-N 3.39Å; S484-L487 PolarHBondContact O-N 3.15Å; L487-F489 PolarHBondContact O-N 3.32Å; L487-L490 PolarHBondContact O-N 2.9Å; L487-L491 HydrophobicContact CD1-CD1 3.83Å; L487-L491 HydrophobicContact CD1-CG 4.12Å; L487-L491 HydrophobicContact CG-CD1 3.8Å; L487-L491 HydrophobicContact CG-CG 4.41Å; L487-L491 WeakPolarHBondContact O-CB 3.07Å; L487-L491 VanDerWaalsContact O-CG 3.23Å; L487-L491 WeakPolarHBondContact O-CG 3.43Å; L487-L491 PolarHBondContact O-N 2.96Å
488	T	91.2	Very high	87.4	Confident	43 Å²	43	45.5 Å²	45.5	26%	0.264	26%	0.262	S	S	.	.	H	α-helix	trans	-64.3	-40.2	178.2	51.1	0	0	0	0	112.3	S484 S485 L491 K492	S484-T488 WeakPolarHBondContact O-CB 3.31Å; S484-T488 VanDerWaalsContact O-CG2 3.31Å; S484-T488 WeakPolarHBondContact O-CG2 3.49Å; S484-T488 PolarHBondContact O-N 2.03Å; S484-T488 PolarHBondContact O-OG1 3.1Å; S485-T488 WeakPolarHBondContact CA-OG1 3.36Å; S485-T488 PolarHBondContact O-OG1 3.46Å; T488-L491 PolarHBondContact O-N 3.27Å; T488-K492 WeakPolarHBondContact O-CB 3.4Å; T488-K492 PolarHBondContact O-N 3.28Å
489	F	90.8	Very high	87.7	Confident	1 Å²	1	48 Å²	48	0%	0.004	27%	0.271	C	S	.	.	H	α-helix	trans	-60.2	-51.6	173.3	179.5	-89.8	0	0	0	111.5	V314 L315 K363 V366 L412 V415 S485 Q486 L487 L491 I493	V314-F489 HydrophobicContact CG1-CB 4.36Å; L315-F489 HydrophobicContact CD2-CD2 4.02Å; L315-F489 HydrophobicContact CD2-CE2 3.76Å; K363-F489 HydrophobicContact CG-CE1 4.37Å; V366-F489 HydrophobicContact CB-CD1 4.4Å; V366-F489 HydrophobicContact CB-CE1 3.57Å; V366-F489 HydrophobicContact CB-CZ 3.66Å; V366-F489 HydrophobicContact CG1-CD1 3.82Å; V366-F489 HydrophobicContact CG1-CD2 4.3Å; V366-F489 HydrophobicContact CG1-CE1 3.39Å; V366-F489 HydrophobicContact CG1-CE2 3.91Å; V366-F489 HydrophobicContact CG1-CG 4.27Å; V366-F489 HydrophobicContact CG1-CZ 3.45Å; V366-F489 VanDerWaalsContact CG1-CZ 3.45Å; V366-F489 HydrophobicContact CG2-CE1 4.36Å; V366-F489 HydrophobicContact CG2-CZ 3.96Å; L412-F489 HydrophobicContact CD2-CD2 3.95Å; L412-F489 HydrophobicContact CD2-CE2 3.63Å; L412-F489 HydrophobicContact CD2-CZ 4.39Å; V415-F489 HydrophobicContact CG1-CE2 4.38Å; S485-F489 VanDerWaalsContact O-CB 3.26Å; S485-F489 WeakPolarHBondContact O-CB 3.4Å; S485-F489 PolarHBondContact O-N 3.36Å; Q486-F489 PolarHBondContact O-N 3.3Å; L487-F489 PolarHBondContact O-N 3.32Å; F489-L491 VanDerWaalsContact C-N 3.3Å; F489-L491 PolarHBondContact O-N 3.48Å; F489-I493 HydrophobicContact CD2-CB 4.18Å; F489-I493 HydrophobicContact CD2-CG1 3.75Å; F489-I493 HydrophobicContact CE2-CB 4.09Å; F489-I493 HydrophobicContact CE2-CG1 4Å; F489-I493 HydrophobicContact CE2-CG2 3.99Å; F489-I493 HydrophobicContact CG-CG1 4.32Å; F489-I493 HydrophobicContact CZ-CB 4.38Å; F489-I493 HydrophobicContact CZ-CG2 4.15Å; F489-I493 VanDerWaalsContact O-CB 3.27Å; F489-I493 WeakPolarHBondContact O-CB 3.11Å; F489-I493 PolarHBondContact O-N 3.06Å
490	L	90.7	Very high	87.7	Confident	56 Å²	56	50.1 Å²	50.1	29%	0.293	29%	0.285	S	S	.	.	H	α-helix	trans	-66.3	-29.5	-178.6	-70	176.4	0	0	0	113	K363 Q486 L487	K363-L490 WeakPolarHBondContact CE-O 3.27Å; K363-L490 HydrophobicContact CG-CD2 3.91Å; K363-L490 PolarHBondContact NZ-O 3.18Å; Q486-L490 HydrophobicContact CG-CD1 4Å; Q486-L490 HydrophobicContact CG-CG 4.45Å; Q486-L490 WeakPolarHBondContact O-CB 3.29Å; Q486-L490 VanDerWaalsContact O-CG 3.3Å; Q486-L490 WeakPolarHBondContact O-CG 3.04Å; Q486-L490 PolarHBondContact O-N 3.47Å; L487-L490 PolarHBondContact O-N 2.9Å
491	L	91	Very high	87.5	Confident	129 Å²	129	46 Å²	46	68%	0.675	26%	0.26	S	S	*	.	H	α-helix	trans	-82.9	-40.7	178.7	-69.4	175.1	0	0	0	112.9	L487 T488 F489	L487-L491 HydrophobicContact CD1-CD1 3.83Å; L487-L491 HydrophobicContact CD1-CG 4.12Å; L487-L491 HydrophobicContact CG-CD1 3.8Å; L487-L491 HydrophobicContact CG-CG 4.41Å; L487-L491 WeakPolarHBondContact O-CB 3.07Å; L487-L491 VanDerWaalsContact O-CG 3.23Å; L487-L491 WeakPolarHBondContact O-CG 3.43Å; L487-L491 PolarHBondContact O-N 2.96Å; T488-L491 PolarHBondContact O-N 3.27Å; F489-L491 VanDerWaalsContact C-N 3.3Å; F489-L491 PolarHBondContact O-N 3.48Å
492	K	89.9	Confident	87.3	Confident	117 Å²	117	48.2 Å²	48.2	51%	0.509	27%	0.268	S	S	.	.	H	α-helix	trans	-100.2	-23.6	-168.6	-67.5	176.3	163.2	-169.2	0	114.4	T310 V314 T488	T310-K492 HydrophobicContact CG2-CD 3.56Å; T310-K492 HydrophobicContact CG2-CG 4.42Å; V314-K492 HydrophobicContact CG2-CB 4.2Å; V314-K492 HydrophobicContact CG2-CD 3.54Å; V314-K492 HydrophobicContact CG2-CG 4.49Å; T488-K492 WeakPolarHBondContact O-CB 3.4Å; T488-K492 PolarHBondContact O-N 3.28Å
493	I	89.4	Confident	86.8	Confident	4 Å²	4	49 Å²	49	2%	0.021	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-94.8	130	-178.2	-53.8	-58.5	0	0	0	110.4	Q311 V314 L315 K363 V415 F489	Q311-I493 HydrophobicContact CB-CD1 4.3Å; Q311-I493 HydrophobicContact CG-CD1 4.05Å; V314-I493 HydrophobicContact CB-CD1 4.43Å; V314-I493 HydrophobicContact CG1-CD1 4.15Å; V314-I493 HydrophobicContact CG1-CG1 3.94Å; L315-I493 HydrophobicContact CD1-CD1 4.23Å; L315-I493 HydrophobicContact CD2-CD1 4.18Å; L315-I493 HydrophobicContact CD2-CG1 4.2Å; L315-I493 HydrophobicContact CG-CD1 3.95Å; L315-I493 HydrophobicContact CG-CG1 4.47Å; K363-I493 PolarHBondContact NZ-O 3.33Å; V415-I493 HydrophobicContact CG1-CG2 3.85Å; F489-I493 HydrophobicContact CD2-CB 4.18Å; F489-I493 HydrophobicContact CD2-CG1 3.75Å; F489-I493 HydrophobicContact CE2-CB 4.09Å; F489-I493 HydrophobicContact CE2-CG1 4Å; F489-I493 HydrophobicContact CE2-CG2 3.99Å; F489-I493 HydrophobicContact CG-CG1 4.32Å; F489-I493 HydrophobicContact CZ-CB 4.38Å; F489-I493 HydrophobicContact CZ-CG2 4.15Å; F489-I493 VanDerWaalsContact O-CB 3.27Å; F489-I493 WeakPolarHBondContact O-CB 3.11Å; F489-I493 PolarHBondContact O-N 3.06Å
494	S	87.5	Confident	85.9	Confident	68 Å²	68	46.1 Å²	46.1	48%	0.476	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-86.1	156.2	177.5	78.9	0	0	0	0	111.5	T496	S494-T496 PolarHBondContact O-N 3.12Å
495	E	88.7	Confident	84.7	Confident	45 Å²	45	45.7 Å²	45.7	21%	0.21	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-63.4	127.7	176.6	-178.2	52.3	-109.6	0	0	111.3	G361 R362 K363 K497 K499	G361-E495 VanDerWaalsContact C-OE2 3.23Å; G361-E495 VanDerWaalsContact CA-CD 3.48Å; G361-E495 WeakPolarHBondContact CA-OE2 3.49Å; R362-E495 WeakPolarHBondContact CB-OE1 3.23Å; R362-E495 VanDerWaalsContact N-CD 3.26Å; R362-E495 PolarHBondContact N-OE1 3.45Å; R362-E495 PolarHBondContact N-OE2 3.32Å; R362-E495 VanDerWaalsContact N-OE2 3.12Å; K363-E495 WeakPolarHBondContact CB-OE2 3.41Å; K363-E495 PolarHBondContact N-OE2 3.18Å; E495-K497 HydrophobicContact CG-CB 4.27Å; E495-K497 VanDerWaalsContact OE1-CB 3.25Å; E495-K497 WeakPolarHBondContact OE1-CB 3.15Å; E495-K497 PolarHBondContact OE1-N 3.36Å; E495-K499 WeakPolarHBondContact O-CD 3.09Å; E495-K499 VanDerWaalsContact O-CE 3.26Å; E495-K499 WeakPolarHBondContact O-CE 3.45Å; E495-K499 PolarHBondContact O-NZ 3.2Å
496	T	88	Confident	83.3	Confident	11 Å²	11	47.8 Å²	47.8	7%	0.067	27%	0.27	C	S	.	.			trans	-100	-11.5	179.4	65.4	0	0	0	0	112.9	R362 V415 E418 S494 G498 K499	R362-T496 PolarHBondContact NH1-O 2.83Å; V415-T496 HydrophobicContact CG1-CG2 4.34Å; E418-T496 HydrophobicContact CB-CG2 4.2Å; E418-T496 WeakPolarHBondContact OE2-CB 3.43Å; E418-T496 PolarHBondContact OE2-OG1 3.13Å; S494-T496 PolarHBondContact O-N 3.12Å; T496-G498 PolarHBondContact O-N 2.96Å; T496-K499 PolarHBondContact O-N 3.07Å
497	K	85.1	Confident	81.2	Confident	43 Å²	43	54.6 Å²	54.6	19%	0.187	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	122.4	-176.4	-157.2	155	176.8	172.5	0	113.7	D354 F357 F360 R362 E495 K499	D354-K497 VanDerWaalsContact CG-NZ 3.29Å; D354-K497 PolarHBondContact O-NZ 3.46Å; D354-K497 VanDerWaalsContact OD1-CE 3.26Å; D354-K497 WeakPolarHBondContact OD1-CE 3.03Å; D354-K497 IonicContact OD1-NZ 2.82Å; D354-K497 PolarHBondContact OD1-NZ 3.12Å; D354-K497 IonicContact OD2-NZ 3.92Å; F357-K497 PolarHBondContact O-NZ 2.94Å; F357-K497 VanDerWaalsContact O-NZ 3.16Å; F360-K497 VanDerWaalsContact O-CD 3.28Å; F360-K497 WeakPolarHBondContact O-CD 3.27Å; F360-K497 PolarHBondContact O-NZ 3.17Å; R362-K497 VanDerWaalsContact CD-CB 3.44Å; R362-K497 VanDerWaalsContact CD-N 3.31Å; R362-K497 VanDerWaalsContact NH1-CA 3.32Å; E495-K497 HydrophobicContact CG-CB 4.27Å; E495-K497 VanDerWaalsContact OE1-CB 3.25Å; E495-K497 WeakPolarHBondContact OE1-CB 3.15Å; E495-K497 PolarHBondContact OE1-N 3.36Å; K497-K499 PolarHBondContact O-N 2.76Å; K497-K499 VanDerWaalsContact O-N 3.09Å
498	G	78.7	Confident	79.1	Confident	37 Å²	37	58 Å²	58	38%	0.381	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.2	1.7	171.3	0	0	0	0	0	115.2	T496	T496-G498 PolarHBondContact O-N 2.96Å
499	K	82.8	Confident	76.4	Confident	78 Å²	78	60 Å²	60	34%	0.339	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-80.6	144.5	173.6	-66.4	-179.6	-177	165.6	0	109.9	E495 T496 K497	E495-K499 WeakPolarHBondContact O-CD 3.09Å; E495-K499 VanDerWaalsContact O-CE 3.26Å; E495-K499 WeakPolarHBondContact O-CE 3.45Å; E495-K499 PolarHBondContact O-NZ 3.2Å; T496-K499 PolarHBondContact O-N 3.07Å; K497-K499 PolarHBondContact O-N 2.76Å; K497-K499 VanDerWaalsContact O-N 3.09Å
500	P	80.6	Confident	74.2	Confident	57 Å²	57	67.3 Å²	67.3	37%	0.37	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-62.7	150.9	171.4	28.7	-34.3	0	0	0	109.6
501	L	82.8	Confident	71.8	Confident	6 Å²	6	70.4 Å²	70.4	3%	0.031	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-57.6	142.3	176.9	-69.8	171.8	0	0	0	111.8	E24 V188 E189 R196 E418 E503	E24-L501 WeakPolarHBondContact OE1-CG 3.1Å; E24-L501 PolarHBondContact OE1-N 3.07Å; V188-L501 HydrophobicContact CG1-CD1 3.98Å; V188-L501 HydrophobicContact CG1-CD2 3.81Å; E189-L501 HydrophobicContact CG-CD1 4.49Å; R196-L501 VanDerWaalsContact NH2-CG 3.26Å; E418-L501 HydrophobicContact CB-CD2 4.22Å; E418-L501 HydrophobicContact CG-CD2 3.96Å; L501-E503 PolarHBondContact O-N 3.11Å
502	M	79.2	Confident	69.8	Low	65 Å²	65	67.4 Å²	67.4	32%	0.32	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-66.1	123.3	175.6	-175.1	170.9	-174.5	0	0	110.3	P421 R425 G504	P421-M502 WeakPolarHBondContact CA-O 3.26Å; P421-M502 HydrophobicContact CB-CG 4.47Å; R425-M502 PolarHBondContact NH2-O 3.1Å; M502-G504 WeakPolarHBondContact CE-O 3.25Å
503	E	74.3	Confident	67.7	Low	27 Å²	27	65.5 Å²	65.5	13%	0.126	36%	0.362	C	S	.	.			trans	-89	-53.7	-176.7	-67.4	174.8	170	0	0	110.8	R248 Q252 S293 P421 L501	R248-E503 IonicContact CZ-OE1 3.3Å; R248-E503 IonicContact NH1-OE1 2.95Å; R248-E503 PolarHBondContact NH1-OE1 3.42Å; Q252-E503 VanDerWaalsContact NE2-C 3.33Å; Q252-E503 PolarHBondContact NE2-O 3.47Å; S293-E503 PolarHBondContact OG-O 3.14Å; P421-E503 WeakPolarHBondContact CB-O 3.47Å; L501-E503 PolarHBondContact O-N 3.11Å
504	G	71.4	Confident	65.9	Low	9 Å²	9	67.7 Å²	67.7	9%	0.093	38%	0.376	C	S	.	.	S	Bend	trans	-153.8	-157.2	171.5	0	0	0	0	0	112.8	S293 M502	S293-G504 CarbonylContact O-C 3.58Å; S293-G504 WeakPolarHBondContact O-CA 3.12Å; S293-G504 PolarHBondContact O-N 3.02Å; M502-G504 WeakPolarHBondContact CE-O 3.25Å
505	I	66.1	Low	64.3	Low	32 Å²	32	66.7 Å²	66.7	16%	0.164	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-106.1	78.8	-173	-50	165.3	0	0	0	108.1	P297 R305 L308	P297-I505 HydrophobicContact CB-CD1 3.5Å; P297-I505 VanDerWaalsContact CB-CD1 3.5Å; P297-I505 HydrophobicContact CB-CG1 4.39Å; P297-I505 HydrophobicContact CG-CD1 3.62Å; P297-I505 HydrophobicContact CG-CG1 3.97Å; R305-I505 VanDerWaalsContact CZ-CG2 3.43Å; R305-I505 VanDerWaalsContact NH1-CG2 3.28Å; L308-I505 HydrophobicContact CD1-CD1 3.68Å; L308-I505 HydrophobicContact CD1-CG1 4.45Å
506	G	59	Low	62.3	Low	45 Å²	45	72 Å²	72	46%	0.464	40%	0.398	S	S	.	.	S	Bend	trans	-129.1	152.9	167.3	0	0	0	0	0	108.5	R508	G506-R508 PolarHBondContact O-N 2.77Å
507	H	46.2	Very low	60.4	Low	173 Å²	173	74.6 Å²	74.6	80%	0.801	41%	0.411	S	S	*	.			trans	-52	142	165.4	-95.4	-78.2	0	0	0	107.9	D509	H507-D509 PolarHBondContact O-N 3.14Å
508	R	46.9	Very low	58.1	Low	171 Å²	171	81.1 Å²	81.1	65%	0.645	44%	0.442	S	S	*	.			trans	-62.2	80.2	162.6	-73.9	-176.5	-171.9	-179.3	3.7	106.8	G506 E510	G506-R508 PolarHBondContact O-N 2.77Å; R508-E510 HydrophobicContact CB-CG 4.49Å; R508-E510 PolarHBondContact O-N 3.08Å
509	D	36.3	Very low	56.1	Low	85 Å²	85	84.6 Å²	84.6	46%	0.455	45%	0.451	S	S	.	.			trans	-72.2	82.7	167.7	-75.1	-14.4	0	0	0	104.9	H507 T511 L512	H507-D509 PolarHBondContact O-N 3.14Å; D509-T511 PolarHBondContact O-N 3.32Å; D509-T511 VanDerWaalsContact O-N 3.1Å; D509-L512 HydrophobicContact CB-CD1 4.11Å; D509-L512 PolarHBondContact O-N 2.98Å
510	E	44.3	Very low	53.7	Low	156 Å²	156	90.7 Å²	90.7	73%	0.729	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-4.4	164.2	-69.2	-179.6	173.1	0	0	111.1	R508	R508-E510 HydrophobicContact CB-CG 4.49Å; R508-E510 PolarHBondContact O-N 3.08Å
511	T	38.9	Very low	51.3	Low	120 Å²	120	100.9 Å²	100.9	74%	0.736	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-12	172.7	52.9	0	0	0	0	114.5	D509 A513	D509-T511 PolarHBondContact O-N 3.32Å; D509-T511 VanDerWaalsContact O-N 3.1Å; T511-A513 VanDerWaalsContact C-N 3.29Å; T511-A513 PolarHBondContact O-N 3Å
512	L	49.4	Very low	49.8	Very low	67 Å²	67	105.6 Å²	105.6	35%	0.351	54%	0.54	S	S	.	.			trans	-73.1	87.3	170.8	-92.4	147	0	0	0	109.4	Y288 D509	Y288-L512 HydrophobicContact CE2-CB 4.28Å; Y288-L512 PolarHBondContact OH-O 3.19Å; D509-L512 HydrophobicContact CB-CD1 4.11Å; D509-L512 PolarHBondContact O-N 2.98Å
513	A	45.6	Very low	48.2	Very low	76 Å²	76	107.7 Å²	107.7	63%	0.628	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-53.2	134.9	171.3	0	0	0	0	0	109.4	T511	T511-A513 VanDerWaalsContact C-N 3.29Å; T511-A513 PolarHBondContact O-N 3Å
514	P	52.4	Low	46.8	Very low	51 Å²	51	112.2 Å²	112.2	33%	0.331	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-55.9	148.1	171.9	24.3	-32.1	0	0	0	109.6	Y20 N516	Y20-P514 HydrophobicContact CD2-CB 3.37Å; Y20-P514 HydrophobicContact CE2-CB 4.03Å; Y20-P514 HydrophobicContact CG-CB 4.09Å; P514-N516 PolarHBondContact O-N 2.73Å; P514-N516 VanDerWaalsContact O-N 3.1Å
515	P	53.6	Low	45.3	Very low	47 Å²	47	118.3 Å²	118.3	31%	0.305	60%	0.604	S	S	.	*	P	Polyproline II helix	trans	-57.9	121.3	173.2	23.5	-30.5	0	0	0	109	Y20 I517	Y20-P515 HydrophobicContact CD1-CG 4.34Å; Y20-P515 HydrophobicContact CE1-CG 4.06Å; Y20-P515 HydrophobicContact CE2-CG 4.41Å; P515-I517 VanDerWaalsContact C-N 3.26Å; P515-I517 PolarHBondContact O-N 3.02Å
516	N	46.7	Very low	44	Very low	157 Å²	157	123.7 Å²	123.7	84%	0.84	63%	0.632	S	S	*	*			trans	-69.2	87.9	169.8	-79.1	-18.6	0	0	0	107.9	P514 E518	P514-N516 PolarHBondContact O-N 2.73Å; P514-N516 VanDerWaalsContact O-N 3.1Å; N516-E518 VanDerWaalsContact C-N 3.29Å; N516-E518 PolarHBondContact O-N 2.78Å; N516-E518 VanDerWaalsContact O-N 3.16Å
517	I	48	Very low	43	Very low	65 Å²	65	128.9 Å²	128.9	33%	0.333	64%	0.643	S	S	.	*			trans	-80.6	89.6	163.1	-52.9	-178.8	0	0	0	105.6	Y20 T284 P515 L519	Y20-I517 VanDerWaalsContact OH-CD1 3.24Å; Y20-I517 WeakPolarHBondContact OH-CD1 3.44Å; T284-I517 HydrophobicContact CG2-CD1 3.85Å; T284-I517 WeakPolarHBondContact OG1-CD1 3.46Å; P515-I517 VanDerWaalsContact C-N 3.26Å; P515-I517 PolarHBondContact O-N 3.02Å; I517-L519 HydrophobicContact CG2-CG 4.39Å; I517-L519 PolarHBondContact O-N 2.9Å
518	E	37.3	Very low	42.8	Very low	180 Å²	180	125.8 Å²	125.8	84%	0.841	63%	0.631	S	S	*	*			trans	-60.9	98.4	154.1	-75.2	-168	162.5	0	0	106.2	N516 K520	N516-E518 VanDerWaalsContact C-N 3.29Å; N516-E518 PolarHBondContact O-N 2.78Å; N516-E518 VanDerWaalsContact O-N 3.16Å; E518-K520 VanDerWaalsContact C-N 3.33Å; E518-K520 PolarHBondContact O-N 3.3Å
519	L	36.1	Very low	42.5	Very low	110 Å²	110	122.3 Å²	122.3	58%	0.576	63%	0.63	S	S	*	*			trans	-56	103.5	165.1	-77.6	160.1	0	0	0	106	I517 K521	I517-L519 HydrophobicContact CG2-CG 4.39Å; I517-L519 PolarHBondContact O-N 2.9Å; L519-K521 PolarHBondContact O-N 2.78Å
520	K	32.1	Very low	43	Very low	205 Å²	205	125.4 Å²	125.4	89%	0.891	65%	0.645	S	S	*	*			trans	-50.8	115	166.6	-91	-176.9	173.2	-180	0	106.6	E518	E518-K520 VanDerWaalsContact C-N 3.33Å; E518-K520 PolarHBondContact O-N 3.3Å
521	K	31.6	Very low	42.9	Very low	271 Å²	271	122.6 Å²	122.6	100%	1.178	64%	0.637	S	S	*	*			trans	-53.3	0	172	-83.9	-178.2	174.6	176.7	0	111.7	L519	L519-K521 PolarHBondContact O-N 2.78Å

Retrieved 521 of 521 residues in 447.6 ms (Link to these results)

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