A0A087Y210_POEFO Loading...

Mitochondrial thiamine pyrophosphate carrier

Mitochondrial transporter mediating uptake of thiamine diphosphate into mitochondria. It is not clear if the antiporter activity is affected by the membrane potential or by the proton electrochemical gradient.

AlphaFold DB , UniProt , Accession A0A087Y210, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 322 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	31.5	Very low	44.3	Very low	248 Å²	248	137.8 Å²	137.8	100%	1.222	72%	0.718	S	S	*	*				0	134.6	0	-100.2	175.6	163.1	0	0	106.9	G3	M1-G3 PolarHBondContact O-N 2.75Å
2	V	30.8	Very low	46.1	Very low	126 Å²	126	129.8 Å²	129.8	76%	0.764	68%	0.683	S	S	*	*			trans	-68	119	175.8	-172.5	0	0	0	0	107.5
3	G	36.9	Very low	47.8	Very low	64 Å²	64	124.2 Å²	124.2	66%	0.66	66%	0.659	S	S	*	*			trans	-168	139.3	-176.9	0	0	0	0	0	110.1	M1 D5	M1-G3 PolarHBondContact O-N 2.75Å; G3-D5 PolarHBondContact O-N 3.26Å
4	Y	38.5	Very low	50.3	Low	202 Å²	202	119.1 Å²	119.1	79%	0.792	64%	0.635	S	S	*	*			trans	-61.5	120.3	178	174.3	-100.2	0	0	0	110.2	P6	Y4-P6 HydrophobicContact CE1-CB 4.05Å
5	D	44.3	Very low	52.4	Low	98 Å²	98	118.1 Å²	118.1	52%	0.524	64%	0.637	S	S	.	*			trans	-106.2	110.7	175.7	-169.9	-12.5	0	0	0	109	G3 R7 A8	G3-D5 PolarHBondContact O-N 3.26Å; D5-R7 PolarHBondContact O-N 3.28Å; D5-R7 VanDerWaalsContact O-N 3.1Å; D5-R7 PolarHBondContact OD1-N 2.93Å; D5-A8 HydrophobicContact CB-CB 4.29Å; D5-A8 VanDerWaalsContact O-CB 3.29Å; D5-A8 WeakPolarHBondContact O-CB 3.46Å; D5-A8 PolarHBondContact O-N 3.09Å
6	P	45.4	Very low	54.4	Low	103 Å²	103	120.1 Å²	120.1	67%	0.669	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-2.7	-176.6	27.4	-33.6	0	0	0	113.9	Y4	Y4-P6 HydrophobicContact CE1-CB 4.05Å
7	R	45.3	Very low	56.2	Low	230 Å²	230	114.5 Å²	114.5	87%	0.868	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.9	7.5	175.9	-63.5	-176.7	178.8	179.2	-0.2	113.6	D5 N9	D5-R7 PolarHBondContact O-N 3.28Å; D5-R7 VanDerWaalsContact O-N 3.1Å; D5-R7 PolarHBondContact OD1-N 2.93Å; R7-N9 PolarHBondContact O-N 2.86Å
8	A	49.5	Very low	57.8	Low	46 Å²	46	109.1 Å²	109.1	38%	0.38	59%	0.585	S	S	.	*			trans	-74.5	122.6	-170.9	0	0	0	0	0	111.3	D5 S12	D5-A8 HydrophobicContact CB-CB 4.29Å; D5-A8 VanDerWaalsContact O-CB 3.29Å; D5-A8 WeakPolarHBondContact O-CB 3.46Å; D5-A8 PolarHBondContact O-N 3.09Å; A8-S12 VanDerWaalsContact CB-OG 3.24Å; A8-S12 WeakPolarHBondContact CB-OG 2.94Å
9	N	54.5	Low	59.3	Low	146 Å²	146	106.4 Å²	106.4	78%	0.781	58%	0.579	S	S	*	*			trans	-56.2	166.1	179.3	-111.4	-12.3	0	0	0	112.3	R7 G11 S12	R7-N9 PolarHBondContact O-N 2.86Å; N9-G11 PolarHBondContact O-N 2.88Å; N9-S12 WeakPolarHBondContact O-CB 3.36Å; N9-S12 PolarHBondContact O-N 2.89Å; N9-S12 PolarHBondContact O-OG 3.43Å
10	R	53.3	Low	60.8	Low	209 Å²	209	106.5 Å²	106.5	79%	0.789	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.2	-19	174.4	-104.1	-177.3	176.6	-166.7	-3	115.1	R313 E321	R10-R313 PolarHBondContact O-NH2 2.72Å; R10-E321 IonicContact NH1-OE1 2.71Å
11	G	57.4	Low	62.1	Low	44 Å²	44	101.4 Å²	101.4	45%	0.454	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.3	6.8	175.4	0	0	0	0	0	116.1	N9	N9-G11 PolarHBondContact O-N 2.88Å
12	S	65.4	Low	64.8	Low	42 Å²	42	91.1 Å²	91.1	29%	0.294	51%	0.508	S	S	.	.	S	Bend	trans	-76.2	144.1	177.4	58.1	0	0	0	0	112	A8 N9 T14 R313	A8-S12 VanDerWaalsContact CB-OG 3.24Å; A8-S12 WeakPolarHBondContact CB-OG 2.94Å; N9-S12 WeakPolarHBondContact O-CB 3.36Å; N9-S12 PolarHBondContact O-N 2.89Å; N9-S12 PolarHBondContact O-OG 3.43Å; S12-T14 PolarHBondContact O-N 3.1Å; S12-R313 PolarHBondContact O-NH1 3.41Å; S12-R313 PolarHBondContact O-NH2 2.92Å
13	P	68.4	Low	67.5	Low	57 Å²	57	89 Å²	89	37%	0.37	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-68.8	133.5	-178.4	27.2	-34	0	0	0	110.3	E17 L306	P13-E17 WeakPolarHBondContact CA-OE2 3.44Å; P13-L306 HydrophobicContact CB-CD1 3.6Å; P13-L306 HydrophobicContact CB-CD2 4.31Å; P13-L306 HydrophobicContact CB-CG 4.12Å; P13-L306 HydrophobicContact CG-CD1 4.28Å; P13-L306 HydrophobicContact CG-CD2 4.19Å
14	T	83.3	Confident	70	Confident	53 Å²	53	87.5 Å²	87.5	33%	0.325	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-67.8	154.7	173.2	60.7	0	0	0	0	109.6	S12 E16 E17 A18	S12-T14 PolarHBondContact O-N 3.1Å; T14-E16 PolarHBondContact O-N 3.42Å; T14-E16 VanDerWaalsContact O-N 3.17Å; T14-E17 PolarHBondContact N-OE2 3.19Å; T14-E17 PolarHBondContact O-N 3.14Å; T14-E17 VanDerWaalsContact O-N 3.14Å; T14-E17 WeakPolarHBondContact OG1-CB 3.49Å; T14-E17 WeakPolarHBondContact OG1-CG 3.27Å; T14-E17 PolarHBondContact OG1-N 2.9Å; T14-E17 PolarHBondContact OG1-OE2 2.99Å; T14-A18 PolarHBondContact O-N 2.95Å
15	P	82.2	Confident	72.5	Confident	103 Å²	103	77.9 Å²	77.9	67%	0.669	44%	0.443	S	S	*	.	H	α-helix	trans	-55.3	-33.4	175.4	-26.4	35.1	0	0	0	112.9	A19	P15-A19 VanDerWaalsContact O-CB 3.31Å; P15-A19 WeakPolarHBondContact O-CB 3.44Å; P15-A19 PolarHBondContact O-N 3Å
16	E	84.2	Confident	74.6	Confident	151 Å²	151	74.5 Å²	74.5	71%	0.706	43%	0.431	S	S	*	.	H	α-helix	trans	-69.1	-45.5	176.8	-62.1	-176.5	-178.9	0	0	112	T14 A18 A19 L20	T14-E16 PolarHBondContact O-N 3.42Å; T14-E16 VanDerWaalsContact O-N 3.17Å; E16-A18 VanDerWaalsContact C-N 3.35Å; E16-A18 PolarHBondContact O-N 3.43Å; E16-A19 PolarHBondContact O-N 3.1Å; E16-L20 WeakPolarHBondContact O-CB 3.33Å; E16-L20 WeakPolarHBondContact O-CG 3.41Å; E16-L20 PolarHBondContact O-N 2.79Å
17	E	84.4	Confident	76.7	Confident	24 Å²	24	75.1 Å²	75.1	11%	0.112	43%	0.426	C	S	.	.	H	α-helix	trans	-62.4	-42.1	174.8	-74.2	160.4	-174.6	0	0	111.8	P13 T14 A19 L20 A21 L309 R313	P13-E17 WeakPolarHBondContact CA-OE2 3.44Å; T14-E17 PolarHBondContact N-OE2 3.19Å; T14-E17 PolarHBondContact O-N 3.14Å; T14-E17 VanDerWaalsContact O-N 3.14Å; T14-E17 WeakPolarHBondContact OG1-CB 3.49Å; T14-E17 WeakPolarHBondContact OG1-CG 3.27Å; T14-E17 PolarHBondContact OG1-N 2.9Å; T14-E17 PolarHBondContact OG1-OE2 2.99Å; E17-A19 VanDerWaalsContact C-N 3.33Å; E17-A19 PolarHBondContact O-N 3.1Å; E17-L20 PolarHBondContact O-N 3.24Å; E17-A21 VanDerWaalsContact O-CB 3.23Å; E17-A21 WeakPolarHBondContact O-CB 3.32Å; E17-A21 PolarHBondContact O-N 3.12Å; E17-L309 HydrophobicContact CB-CD1 4.33Å; E17-L309 HydrophobicContact CG-CB 4.33Å; E17-L309 WeakPolarHBondContact O-CD1 3.4Å; E17-R313 WeakPolarHBondContact OE1-CD 3.38Å; E17-R313 IonicContact OE1-CZ 2.8Å; E17-R313 IonicContact OE1-NE 3.81Å; E17-R313 IonicContact OE1-NH1 3.89Å; E17-R313 PolarHBondContact OE1-NH1 3.46Å; E17-R313 IonicContact OE2-CZ 2.75Å; E17-R313 IonicContact OE2-NH1 3.7Å; E17-R313 PolarHBondContact OE2-NH1 3.22Å
18	A	85.9	Confident	78.9	Confident	18 Å²	18	66.2 Å²	66.2	15%	0.149	40%	0.397	C	S	.	.	H	α-helix	trans	-63.6	-39.8	176.1	0	0	0	0	0	111.5	T14 E16 G22 L306	T14-A18 PolarHBondContact O-N 2.95Å; E16-A18 VanDerWaalsContact C-N 3.35Å; E16-A18 PolarHBondContact O-N 3.43Å; A18-G22 PolarHBondContact O-N 2.87Å; A18-L306 HydrophobicContact CB-CD1 4.4Å
19	A	86.1	Confident	80.9	Confident	57 Å²	57	64.3 Å²	64.3	47%	0.471	38%	0.381	S	S	.	.	H	α-helix	trans	-66.7	-41.6	175.5	0	0	0	0	0	112.3	P15 E16 E17 S23	P15-A19 VanDerWaalsContact O-CB 3.31Å; P15-A19 WeakPolarHBondContact O-CB 3.44Å; P15-A19 PolarHBondContact O-N 3Å; E16-A19 PolarHBondContact O-N 3.1Å; E17-A19 VanDerWaalsContact C-N 3.33Å; E17-A19 PolarHBondContact O-N 3.1Å; A19-S23 VanDerWaalsContact O-CB 3.32Å; A19-S23 WeakPolarHBondContact O-CB 3.14Å; A19-S23 PolarHBondContact O-N 2.88Å; A19-S23 PolarHBondContact O-OG 3.3Å
20	L	88.6	Confident	82.6	Confident	109 Å²	109	61.3 Å²	61.3	57%	0.571	36%	0.359	S	S	*	.	H	α-helix	trans	-66.2	-47	176	-73.9	171.6	0	0	0	111.5	E16 E17 G22 S23 A24 L309	E16-L20 WeakPolarHBondContact O-CB 3.33Å; E16-L20 WeakPolarHBondContact O-CG 3.41Å; E16-L20 PolarHBondContact O-N 2.79Å; E17-L20 PolarHBondContact O-N 3.24Å; L20-G22 VanDerWaalsContact C-N 3.35Å; L20-G22 PolarHBondContact O-N 2.96Å; L20-S23 PolarHBondContact O-N 3.21Å; L20-A24 WeakPolarHBondContact O-CB 3.16Å; L20-A24 PolarHBondContact O-N 3.34Å; L20-L309 HydrophobicContact CB-CD1 3.92Å
21	A	88.3	Confident	84.4	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-61.2	-42.9	175.8	0	0	0	0	0	111.7	E17 G25 Y302 F305 L306 L309	E17-A21 VanDerWaalsContact O-CB 3.23Å; E17-A21 WeakPolarHBondContact O-CB 3.32Å; E17-A21 PolarHBondContact O-N 3.12Å; A21-G25 WeakPolarHBondContact O-CA 3.25Å; A21-G25 PolarHBondContact O-N 2.89Å; A21-Y302 HydrophobicContact CB-CD2 4.31Å; A21-Y302 HydrophobicContact CB-CE2 4.38Å; A21-F305 HydrophobicContact CB-CB 3.88Å; A21-L306 HydrophobicContact CB-CB 4.05Å; A21-L306 HydrophobicContact CB-CD1 3.93Å; A21-L309 HydrophobicContact CB-CD1 4.16Å
22	G	87.9	Confident	86	Confident	32 Å²	32	54.1 Å²	54.1	33%	0.33	33%	0.329	S	S	.	.	H	α-helix	trans	-62	-42.1	174.2	0	0	0	0	0	113	A18 L20 G26	A18-G22 PolarHBondContact O-N 2.87Å; L20-G22 VanDerWaalsContact C-N 3.35Å; L20-G22 PolarHBondContact O-N 2.96Å; G22-G26 PolarHBondContact O-N 2.64Å
23	S	87.9	Confident	87.3	Confident	80 Å²	80	52.3 Å²	52.3	56%	0.559	32%	0.316	S	S	*	.	H	α-helix	trans	-68.6	-47.6	179	-60.5	0	0	0	0	112	A19 L20 G26 M27	A19-S23 VanDerWaalsContact O-CB 3.32Å; A19-S23 WeakPolarHBondContact O-CB 3.14Å; A19-S23 PolarHBondContact O-N 2.88Å; A19-S23 PolarHBondContact O-OG 3.3Å; L20-S23 PolarHBondContact O-N 3.21Å; S23-G26 PolarHBondContact O-N 2.81Å; S23-M27 WeakPolarHBondContact O-CB 3.18Å; S23-M27 PolarHBondContact O-N 3.33Å
24	A	90	Very high	88.3	Confident	33 Å²	33	50 Å²	50	27%	0.273	30%	0.302	S	S	.	.	H	α-helix	trans	-63.7	-47.1	176.9	0	0	0	0	0	111.3	L20 G26 M27 V28 F305	L20-A24 WeakPolarHBondContact O-CB 3.16Å; L20-A24 PolarHBondContact O-N 3.34Å; A24-G26 PolarHBondContact O-N 3.41Å; A24-M27 PolarHBondContact O-N 3.15Å; A24-V28 WeakPolarHBondContact O-CG2 3.37Å; A24-V28 PolarHBondContact O-N 2.91Å; A24-F305 HydrophobicContact CB-CD1 4.12Å; A24-F305 HydrophobicContact CB-CD2 3.75Å; A24-F305 HydrophobicContact CB-CE1 4.23Å; A24-F305 HydrophobicContact CB-CE2 3.88Å; A24-F305 HydrophobicContact CB-CG 3.9Å; A24-F305 HydrophobicContact CB-CZ 4.13Å
25	G	90	Very high	88.7	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.01	29%	0.293	C	S	.	.	H	α-helix	trans	-63.5	-40	178.3	0	0	0	0	0	112.8	A21 T29	A21-G25 WeakPolarHBondContact O-CA 3.25Å; A21-G25 PolarHBondContact O-N 2.89Å; G25-T29 WeakPolarHBondContact O-CB 3.43Å; G25-T29 PolarHBondContact O-N 2.95Å; G25-T29 PolarHBondContact O-OG1 2.65Å
26	G	88.8	Confident	89.2	Confident	26 Å²	26	45.8 Å²	45.8	27%	0.268	27%	0.27	S	S	.	.	H	α-helix	trans	-64.3	-38.9	173.9	0	0	0	0	0	113.1	G22 S23 A24 R30	G22-G26 PolarHBondContact O-N 2.64Å; S23-G26 PolarHBondContact O-N 2.81Å; A24-G26 PolarHBondContact O-N 3.41Å; G26-R30 WeakPolarHBondContact O-CB 3.45Å; G26-R30 PolarHBondContact O-N 3.38Å
27	M	89.9	Confident	89.5	Confident	117 Å²	117	39.5 Å²	39.5	58%	0.576	24%	0.242	S	C	*	.	H	α-helix	trans	-65.6	-49.3	177.1	-171.7	-176.6	-60.4	0	0	111.5	S23 A24 R30 A31	S23-M27 WeakPolarHBondContact O-CB 3.18Å; S23-M27 PolarHBondContact O-N 3.33Å; A24-M27 PolarHBondContact O-N 3.15Å; M27-R30 PolarHBondContact O-N 3.03Å; M27-A31 PolarHBondContact O-N 2.68Å
28	V	91.9	Very high	89.8	Confident	43 Å²	43	38.5 Å²	38.5	26%	0.261	24%	0.237	S	C	.	.	H	α-helix	trans	-64.8	-45.4	178.6	176.3	0	0	0	0	111	A24 R30 A31 L32 W301 F305	A24-V28 WeakPolarHBondContact O-CG2 3.37Å; A24-V28 PolarHBondContact O-N 2.91Å; V28-R30 VanDerWaalsContact C-N 3.28Å; V28-R30 PolarHBondContact O-N 2.69Å; V28-A31 WeakPolarHBondContact O-CB 3.34Å; V28-A31 PolarHBondContact O-N 3.41Å; V28-L32 HydrophobicContact CG1-CD1 4.2Å; V28-L32 HydrophobicContact CG1-CG 4.48Å; V28-L32 WeakPolarHBondContact O-CG 3.32Å; V28-L32 PolarHBondContact O-N 3.36Å; V28-W301 HydrophobicContact CB-CD2 4.28Å; V28-W301 HydrophobicContact CB-CG 4.4Å; V28-W301 HydrophobicContact CG1-CD2 3.65Å; V28-W301 VanDerWaalsContact CG1-CE2 3.43Å; V28-W301 HydrophobicContact CG1-CE3 4.11Å; V28-W301 HydrophobicContact CG1-CG 4.09Å; V28-W301 HydrophobicContact CG1-CH2 4.16Å; V28-W301 HydrophobicContact CG1-CZ2 3.71Å; V28-W301 HydrophobicContact CG1-CZ3 4.34Å; V28-F305 HydrophobicContact CB-CE2 4.4Å; V28-F305 HydrophobicContact CG2-CE2 3.88Å; V28-F305 HydrophobicContact CG2-CZ 3.87Å
29	T	91.2	Very high	90	Very high	5 Å²	5	37.8 Å²	37.8	3%	0.031	23%	0.231	C	C	.	.	H	α-helix	trans	-56.7	-44.8	176.5	-63.7	0	0	0	0	111	G25 A31 L32 I33 F297	G25-T29 WeakPolarHBondContact O-CB 3.43Å; G25-T29 PolarHBondContact O-N 2.95Å; G25-T29 PolarHBondContact O-OG1 2.65Å; T29-A31 VanDerWaalsContact C-N 3.33Å; T29-A31 PolarHBondContact O-N 3.09Å; T29-L32 PolarHBondContact O-N 3.19Å; T29-I33 HydrophobicContact CG2-CG1 4.14Å; T29-I33 WeakPolarHBondContact O-CB 3.36Å; T29-I33 WeakPolarHBondContact O-CG1 3.48Å; T29-I33 PolarHBondContact O-N 2.94Å; T29-F297 HydrophobicContact CG2-CB 3.7Å; T29-F297 PolarHBondContact OG1-O 2.97Å
30	R	89.3	Confident	90.3	Very high	84 Å²	84	36.1 Å²	36.1	32%	0.317	21%	0.213	S	C	.	.	H	α-helix	trans	-62	-39	175	-90.4	-173	153.1	74.5	3.1	113.2	G26 M27 V28 L32 I33 S34 A85 Q86 S89	G26-R30 WeakPolarHBondContact O-CB 3.45Å; G26-R30 PolarHBondContact O-N 3.38Å; M27-R30 PolarHBondContact O-N 3.03Å; V28-R30 VanDerWaalsContact C-N 3.28Å; V28-R30 PolarHBondContact O-N 2.69Å; R30-L32 VanDerWaalsContact C-N 3.32Å; R30-I33 PolarHBondContact O-N 3.21Å; R30-S34 WeakPolarHBondContact O-CB 3.41Å; R30-S34 PolarHBondContact O-N 3.06Å; R30-A85 PolarHBondContact NE-O 2.9Å; R30-Q86 VanDerWaalsContact CD-CD 3.45Å; R30-S89 PolarHBondContact NH1-OG 3.45Å; R30-S89 PolarHBondContact NH2-OG 3.32Å
31	A	91.3	Very high	90.4	Very high	31 Å²	31	31.1 Å²	31.1	26%	0.256	19%	0.187	S	C	.	.	H	α-helix	trans	-62.6	-42.5	178	0	0	0	0	0	111	M27 V28 T29 W79	M27-A31 PolarHBondContact O-N 2.68Å; V28-A31 WeakPolarHBondContact O-CB 3.34Å; V28-A31 PolarHBondContact O-N 3.41Å; T29-A31 VanDerWaalsContact C-N 3.33Å; T29-A31 PolarHBondContact O-N 3.09Å; A31-W79 PolarHBondContact O-NE1 3Å
32	L	91.8	Very high	90.5	Very high	71 Å²	71	31.5 Å²	31.5	37%	0.372	19%	0.188	S	C	.	.	H	α-helix	trans	-69.9	-31.5	177.3	-65.1	175.4	0	0	0	113.3	V28 T29 R30 P35 F297 W301	V28-L32 HydrophobicContact CG1-CD1 4.2Å; V28-L32 HydrophobicContact CG1-CG 4.48Å; V28-L32 WeakPolarHBondContact O-CG 3.32Å; V28-L32 PolarHBondContact O-N 3.36Å; T29-L32 PolarHBondContact O-N 3.19Å; R30-L32 VanDerWaalsContact C-N 3.32Å; L32-P35 WeakPolarHBondContact O-CD 3.29Å; L32-F297 HydrophobicContact CB-CD2 4.02Å; L32-F297 HydrophobicContact CB-CE2 3.96Å; L32-F297 HydrophobicContact CD1-CD2 4.12Å; L32-F297 HydrophobicContact CD1-CE2 4.21Å; L32-F297 HydrophobicContact CD1-CG 4.45Å; L32-W301 HydrophobicContact CD1-CZ2 4.15Å; L32-W301 VanDerWaalsContact CD1-NE1 3.25Å
33	I	91.1	Very high	90.5	Very high	4 Å²	4	30.4 Å²	30.4	2%	0.021	18%	0.175	C	C	.	.	H	α-helix	trans	-87.4	-19.9	-177.7	-66.3	-66.7	0	0	0	112.9	T29 R30 P35 F36 D37 K290 L293 F297	T29-I33 HydrophobicContact CG2-CG1 4.14Å; T29-I33 WeakPolarHBondContact O-CB 3.36Å; T29-I33 WeakPolarHBondContact O-CG1 3.48Å; T29-I33 PolarHBondContact O-N 2.94Å; R30-I33 PolarHBondContact O-N 3.21Å; I33-P35 VanDerWaalsContact C-N 3.34Å; I33-F36 PolarHBondContact O-N 3.43Å; I33-D37 PolarHBondContact O-N 3.18Å; I33-K290 HydrophobicContact CG2-CD 3.82Å; I33-K290 HydrophobicContact CG2-CG 3.64Å; I33-L293 HydrophobicContact CD1-CB 3.72Å; I33-F297 HydrophobicContact CD1-CD2 3.86Å; I33-F297 HydrophobicContact CD1-CE2 4.17Å; I33-F297 HydrophobicContact CG1-CD2 4.15Å
34	S	91	Very high	90.5	Very high	8 Å²	8	26.7 Å²	26.7	6%	0.056	15%	0.148	C	C	.	.	H	α-helix	trans	-48.8	-42.8	-179.8	-170.6	0	0	0	0	114.7	R30 F36 D37 V38 F78	R30-S34 WeakPolarHBondContact O-CB 3.41Å; R30-S34 PolarHBondContact O-N 3.06Å; S34-F36 VanDerWaalsContact C-N 3.31Å; S34-F36 PolarHBondContact O-N 3.49Å; S34-D37 WeakPolarHBondContact O-CB 3.11Å; S34-D37 PolarHBondContact O-N 3.29Å; S34-V38 PolarHBondContact O-N 3.31Å; S34-V38 VanDerWaalsContact O-N 3.12Å; S34-F78 CarbonylContact C-O 3.55Å; S34-F78 PolarHBondContact OG-O 3.31Å
35	P	91.9	Very high	90.2	Very high	23 Å²	23	25.3 Å²	25.3	15%	0.149	14%	0.137	C	C	.	.	H	α-helix	trans	-56.6	-42.1	177.5	-25.5	34.8	0	0	0	113.4	L32 I33 D37 V38 I39 F78 W79	L32-P35 WeakPolarHBondContact O-CD 3.29Å; I33-P35 VanDerWaalsContact C-N 3.34Å; P35-D37 VanDerWaalsContact C-N 3.28Å; P35-D37 PolarHBondContact O-N 3.31Å; P35-V38 PolarHBondContact O-N 3.19Å; P35-I39 VanDerWaalsContact O-CG1 3.32Å; P35-I39 WeakPolarHBondContact O-CG1 3.39Å; P35-I39 PolarHBondContact O-N 2.85Å; P35-F78 HydrophobicContact CB-CB 3.85Å; P35-F78 HydrophobicContact CB-CD1 3.79Å; P35-F78 HydrophobicContact CB-CG 4.11Å; P35-F78 HydrophobicContact CG-CB 3.96Å; P35-W79 HydrophobicContact CG-CH2 4.21Å; P35-W79 HydrophobicContact CG-CZ2 4.08Å
36	F	91.6	Very high	89.9	Confident	44 Å²	44	25.5 Å²	25.5	19%	0.193	14%	0.137	C	C	.	.	H	α-helix	trans	-68.1	-30.2	178.4	-66.4	-76.2	0	0	0	112.4	I33 S34 K40 L289 K290 L293	I33-F36 PolarHBondContact O-N 3.43Å; S34-F36 VanDerWaalsContact C-N 3.31Å; S34-F36 PolarHBondContact O-N 3.49Å; F36-K40 WeakPolarHBondContact O-CB 3.35Å; F36-K40 PolarHBondContact O-N 3.35Å; F36-L289 HydrophobicContact CD1-CD2 4.14Å; F36-L289 HydrophobicContact CD1-CG 4.42Å; F36-L289 HydrophobicContact CE1-CD2 3.5Å; F36-L289 HydrophobicContact CE1-CG 4Å; F36-L289 HydrophobicContact CZ-CD2 4.27Å; F36-K290 HydrophobicContact CB-CB 4.07Å; F36-L293 HydrophobicContact CD2-CD1 4.25Å; F36-L293 HydrophobicContact CE1-CD1 4.35Å; F36-L293 HydrophobicContact CE2-CD1 3.48Å; F36-L293 VanDerWaalsContact CE2-CD1 3.48Å; F36-L293 HydrophobicContact CZ-CD1 3.54Å
37	D	89.9	Confident	89.3	Confident	20 Å²	20	24.8 Å²	24.8	11%	0.107	13%	0.127	C	C	.	.	H	α-helix	trans	-67.7	-42.8	174.4	-84.1	-41.5	0	0	0	112.2	I33 S34 P35 K40 I41 R143 K290	I33-D37 PolarHBondContact O-N 3.18Å; S34-D37 WeakPolarHBondContact O-CB 3.11Å; S34-D37 PolarHBondContact O-N 3.29Å; P35-D37 VanDerWaalsContact C-N 3.28Å; P35-D37 PolarHBondContact O-N 3.31Å; D37-K40 PolarHBondContact O-N 3.26Å; D37-I41 WeakPolarHBondContact O-CB 3.49Å; D37-I41 WeakPolarHBondContact O-CD1 3.46Å; D37-I41 VanDerWaalsContact O-CG1 3.24Å; D37-I41 WeakPolarHBondContact O-CG1 3.27Å; D37-I41 PolarHBondContact O-N 3.4Å; D37-R143 IonicContact OD1-NH2 3.45Å; D37-R143 PolarHBondContact OD1-NH2 2.88Å; D37-R143 IonicContact OD2-CZ 3.47Å; D37-R143 IonicContact OD2-NH2 3.5Å; D37-R143 PolarHBondContact OD2-NH2 2.9Å; D37-K290 WeakPolarHBondContact OD1-CD 3.37Å; D37-K290 VanDerWaalsContact OD1-CE 3.3Å; D37-K290 WeakPolarHBondContact OD1-CE 3.4Å; D37-K290 IonicContact OD1-NZ 3.45Å; D37-K290 PolarHBondContact OD1-NZ 3.24Å; D37-K290 WeakPolarHBondContact OD2-CE 3.46Å; D37-K290 IonicContact OD2-NZ 2.69Å; D37-K290 PolarHBondContact OD2-NZ 2.8Å
38	V	91.2	Very high	88.6	Confident	2 Å²	2	20.7 Å²	20.7	1%	0.012	11%	0.106	C	C	.	.	H	α-helix	trans	-63	-46.8	175.6	176.4	0	0	0	0	110.6	S34 P35 K40 I41 R42 F78 A147	S34-V38 PolarHBondContact O-N 3.31Å; S34-V38 VanDerWaalsContact O-N 3.12Å; P35-V38 PolarHBondContact O-N 3.19Å; V38-K40 PolarHBondContact O-N 3Å; V38-I41 PolarHBondContact O-N 3.45Å; V38-R42 WeakPolarHBondContact O-CG 3.47Å; V38-R42 PolarHBondContact O-N 3.24Å; V38-F78 WeakPolarHBondContact CG2-O 3.33Å; V38-A147 HydrophobicContact CG2-CB 4.29Å
39	I	91.4	Very high	87.3	Confident	4 Å²	4	25.5 Å²	25.5	2%	0.021	12%	0.12	C	C	.	.	H	α-helix	trans	-60.5	-48	177.5	-64.9	165.1	0	0	0	110.5	P35 I41 R42 F43 S66 I69 F78 P286	P35-I39 VanDerWaalsContact O-CG1 3.32Å; P35-I39 WeakPolarHBondContact O-CG1 3.39Å; P35-I39 PolarHBondContact O-N 2.85Å; I39-I41 PolarHBondContact O-N 3.15Å; I39-R42 PolarHBondContact O-N 2.74Å; I39-F43 HydrophobicContact CG2-CD2 3.86Å; I39-F43 HydrophobicContact CG2-CE2 3.79Å; I39-F43 VanDerWaalsContact O-CD2 3.23Å; I39-F43 WeakPolarHBondContact O-CD2 3.4Å; I39-F43 PolarHBondContact O-N 3.48Å; I39-S66 WeakPolarHBondContact CD1-OG 3.31Å; I39-I69 HydrophobicContact CG1-CD1 4.19Å; I39-F78 HydrophobicContact CD1-CE1 4.2Å; I39-F78 HydrophobicContact CG1-CE1 4.37Å; I39-P286 HydrophobicContact CG2-CB 4.25Å
40	K	91.1	Very high	86.1	Confident	21 Å²	21	27.7 Å²	27.7	9%	0.091	13%	0.133	C	C	.	.	H	α-helix	trans	-55.4	-51	177.3	176.5	-173.2	171	171	0	111.1	F36 D37 V38 R42 F43 Q44 D237 P286 S287	F36-K40 WeakPolarHBondContact O-CB 3.35Å; F36-K40 PolarHBondContact O-N 3.35Å; D37-K40 PolarHBondContact O-N 3.26Å; V38-K40 PolarHBondContact O-N 3Å; K40-R42 VanDerWaalsContact C-N 3.33Å; K40-R42 PolarHBondContact O-N 3.47Å; K40-F43 PolarHBondContact O-N 2.9Å; K40-Q44 HydrophobicContact CG-CG 4.39Å; K40-Q44 WeakPolarHBondContact O-CB 3.22Å; K40-Q44 WeakPolarHBondContact O-CG 3.48Å; K40-Q44 PolarHBondContact O-N 3.34Å; K40-D237 IonicContact NZ-OD2 3.95Å; K40-P286 HydrophobicContact CB-CB 4.31Å; K40-P286 HydrophobicContact CB-CG 4.34Å; K40-S287 PolarHBondContact NZ-OG 3.42Å
41	I	90.5	Very high	85	Confident	5 Å²	5	25.5 Å²	25.5	3%	0.026	13%	0.131	C	C	.	.	H	α-helix	trans	-61.2	-44.1	-177.1	-71.2	166.5	0	0	0	110.2	D37 V38 I39 F43 Q44 L45 T144 A147 K241	D37-I41 WeakPolarHBondContact O-CB 3.49Å; D37-I41 WeakPolarHBondContact O-CD1 3.46Å; D37-I41 VanDerWaalsContact O-CG1 3.24Å; D37-I41 WeakPolarHBondContact O-CG1 3.27Å; D37-I41 PolarHBondContact O-N 3.4Å; V38-I41 PolarHBondContact O-N 3.45Å; I39-I41 PolarHBondContact O-N 3.15Å; I41-F43 PolarHBondContact O-N 3.09Å; I41-Q44 PolarHBondContact O-N 3.34Å; I41-L45 HydrophobicContact CG2-CD1 3.61Å; I41-L45 HydrophobicContact CG2-CG 4.26Å; I41-L45 VanDerWaalsContact O-CB 3.32Å; I41-L45 WeakPolarHBondContact O-CB 3.31Å; I41-L45 WeakPolarHBondContact O-CG 3.45Å; I41-L45 PolarHBondContact O-N 3.05Å; I41-T144 HydrophobicContact CG2-CG2 4.13Å; I41-A147 HydrophobicContact CB-CB 4.15Å; I41-A147 HydrophobicContact CD1-CB 3.55Å; I41-A147 HydrophobicContact CG1-CB 4.45Å; I41-A147 HydrophobicContact CG2-CB 3.96Å; I41-K241 HydrophobicContact CG1-CD 4.5Å
42	R	89.8	Confident	83.4	Confident	7 Å²	7	28 Å²	28	3%	0.026	15%	0.146	C	C	.	.	H	α-helix	trans	-64.2	-40	178.6	-71.5	179.5	176	-144.7	0.6	113	V38 I39 K40 L45 Q46 Y59 E73 A147 Q149 F255	V38-R42 WeakPolarHBondContact O-CG 3.47Å; V38-R42 PolarHBondContact O-N 3.24Å; I39-R42 PolarHBondContact O-N 2.74Å; K40-R42 VanDerWaalsContact C-N 3.33Å; K40-R42 PolarHBondContact O-N 3.47Å; R42-L45 PolarHBondContact O-N 3.27Å; R42-Q46 PolarHBondContact O-N 2.93Å; R42-Y59 HydrophobicContact CB-CD2 4.46Å; R42-Y59 HydrophobicContact CB-CE2 4.01Å; R42-Y59 PolarHBondContact NH1-OH 3.45Å; R42-E73 IonicContact CZ-OE1 2.69Å; R42-E73 IonicContact CZ-OE2 2.87Å; R42-E73 IonicContact NH1-OE1 2.74Å; R42-E73 PolarHBondContact NH1-OE1 2.69Å; R42-E73 IonicContact NH1-OE2 3.85Å; R42-E73 IonicContact NH2-OE1 3.56Å; R42-E73 PolarHBondContact NH2-OE1 2.95Å; R42-E73 IonicContact NH2-OE2 2.83Å; R42-E73 PolarHBondContact NH2-OE2 3.17Å; R42-A147 PolarHBondContact NE-O 3.43Å; R42-A147 VanDerWaalsContact NE-O 3.16Å; R42-Q149 PolarHBondContact NH2-O 3.27Å; R42-F255 VanDerWaalsContact NH1-CE1 3.28Å
43	F	88.1	Confident	81.9	Confident	10 Å²	10	33.5 Å²	33.5	4%	0.044	17%	0.17	C	C	.	.	H	α-helix	trans	-63.7	-41.9	173.8	-89.8	-115	0	0	0	112.6	I39 K40 I41 L45 Q46 V50 Y59 A65	I39-F43 HydrophobicContact CG2-CD2 3.86Å; I39-F43 HydrophobicContact CG2-CE2 3.79Å; I39-F43 VanDerWaalsContact O-CD2 3.23Å; I39-F43 WeakPolarHBondContact O-CD2 3.4Å; I39-F43 PolarHBondContact O-N 3.48Å; K40-F43 PolarHBondContact O-N 2.9Å; I41-F43 PolarHBondContact O-N 3.09Å; F43-L45 PolarHBondContact O-N 3.08Å; F43-Q46 PolarHBondContact O-N 3.27Å; F43-V50 HydrophobicContact CD1-CG1 4.2Å; F43-V50 HydrophobicContact CD1-CG2 4.17Å; F43-V50 HydrophobicContact CE1-CG1 3.82Å; F43-Y59 HydrophobicContact CE2-CG 4.22Å; F43-A65 HydrophobicContact CE2-CB 3.44Å; F43-A65 VanDerWaalsContact CE2-CB 3.44Å; F43-A65 HydrophobicContact CZ-CB 3.93Å
44	Q	87.9	Confident	80.5	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-65.1	-31.6	177.8	-78.5	-175.9	-47.6	0	0	112.3	K40 I41 Y234 L238 R242 K282	K40-Q44 HydrophobicContact CG-CG 4.39Å; K40-Q44 WeakPolarHBondContact O-CB 3.22Å; K40-Q44 WeakPolarHBondContact O-CG 3.48Å; K40-Q44 PolarHBondContact O-N 3.34Å; I41-Q44 PolarHBondContact O-N 3.34Å; Q44-Y234 PolarHBondContact NE2-OH 2.97Å; Q44-L238 HydrophobicContact CB-CD1 3.65Å; Q44-L238 HydrophobicContact CG-CD1 3.8Å; Q44-L238 WeakPolarHBondContact O-CD1 3.33Å; Q44-R242 PolarHBondContact O-NE 3.07Å; Q44-K282 VanDerWaalsContact CG-O 3.29Å; Q44-K282 WeakPolarHBondContact CG-O 3.38Å
45	L	85.2	Confident	79.2	Confident	5 Å²	5	51 Å²	51	3%	0.026	24%	0.235	C	C	.	.	H	α-helix	trans	-80	-32.6	-178.8	-75.2	177.6	0	0	0	112.7	I41 R42 F43 I47 A148 V245 R252	I41-L45 HydrophobicContact CG2-CD1 3.61Å; I41-L45 HydrophobicContact CG2-CG 4.26Å; I41-L45 VanDerWaalsContact O-CB 3.32Å; I41-L45 WeakPolarHBondContact O-CB 3.31Å; I41-L45 WeakPolarHBondContact O-CG 3.45Å; I41-L45 PolarHBondContact O-N 3.05Å; R42-L45 PolarHBondContact O-N 3.27Å; F43-L45 PolarHBondContact O-N 3.08Å; L45-I47 PolarHBondContact O-N 2.87Å; L45-A148 HydrophobicContact CD1-CB 3.33Å; L45-V245 HydrophobicContact CD1-CG2 3.85Å; L45-V245 HydrophobicContact CD2-CB 3.88Å; L45-V245 HydrophobicContact CD2-CG1 4.33Å; L45-V245 HydrophobicContact CD2-CG2 3.59Å; L45-V245 HydrophobicContact CG-CG2 4.38Å; L45-R252 VanDerWaalsContact CB-NH1 3.31Å; L45-R252 PolarHBondContact O-NH1 3Å; L45-R252 PolarHBondContact O-NH2 3.43Å
46	Q	82.9	Confident	78.1	Confident	4 Å²	4	56 Å²	56	2%	0.019	26%	0.256	C	S	.	.			trans	-60.1	123.2	179.4	-170	178.9	-71.3	0	0	112.3	R42 F43 E48 Y59 R242 K282	R42-Q46 PolarHBondContact O-N 2.93Å; F43-Q46 PolarHBondContact O-N 3.27Å; Q46-E48 HydrophobicContact CG-CB 4.23Å; Q46-E48 WeakPolarHBondContact CG-OE2 3.41Å; Q46-E48 PolarHBondContact NE2-O 3.27Å; Q46-Y59 PolarHBondContact NE2-O 3.29Å; Q46-Y59 VanDerWaalsContact OE1-CB 3.32Å; Q46-R242 PolarHBondContact O-NH2 3.31Å; Q46-K282 PolarHBondContact O-NZ 3.34Å
47	I	75.5	Confident	77.1	Confident	11 Å²	11	54.5 Å²	54.5	6%	0.056	25%	0.253	C	S	.	.			trans	-82.5	-36	-179.9	-61.3	-179.6	0	0	0	109.9	L45 Q257 R259 E275 K282	L45-I47 PolarHBondContact O-N 2.87Å; I47-Q257 HydrophobicContact CD1-CB 4.27Å; I47-Q257 WeakPolarHBondContact CD1-O 3.38Å; I47-R259 HydrophobicContact CD1-CB 3.99Å; I47-R259 HydrophobicContact CD1-CG 3.83Å; I47-E275 WeakPolarHBondContact CA-OE1 3.31Å; I47-E275 HydrophobicContact CG2-CG 4.5Å; I47-E275 WeakPolarHBondContact CG2-OE1 3.4Å; I47-K282 PolarHBondContact O-NZ 3.49Å
48	E	76.1	Confident	76.6	Confident	31 Å²	31	55.9 Å²	55.9	15%	0.145	26%	0.258	C	S	.	.	S	Bend	trans	-62.8	145.2	177	-57.1	82.4	178.8	0	0	111	Q46 V50 G57 G256 Q257 K282	Q46-E48 HydrophobicContact CG-CB 4.23Å; Q46-E48 WeakPolarHBondContact CG-OE2 3.41Å; Q46-E48 PolarHBondContact NE2-O 3.27Å; E48-V50 PolarHBondContact O-N 3.31Å; E48-G57 VanDerWaalsContact CB-CA 3.41Å; E48-G256 WeakPolarHBondContact OE1-CA 3.45Å; E48-Q257 PolarHBondContact OE1-N 3.01Å; E48-K282 WeakPolarHBondContact O-CE 3.42Å; E48-K282 PolarHBondContact O-NZ 2.68Å
49	R	64.1	Low	76.2	Confident	144 Å²	144	56 Å²	56	54%	0.543	26%	0.258	S	S	.	.			trans	-62.7	131.4	-177.4	-72.9	-178.3	173.9	165.9	2.9	110.6	S51	R49-S51 PolarHBondContact O-N 3.24Å; R49-S51 VanDerWaalsContact O-N 3.09Å
50	V	67.1	Low	75.7	Confident	52 Å²	52	60.7 Å²	60.7	32%	0.315	28%	0.276	S	S	.	.			trans	-78.8	92.4	171.6	-177.4	0	0	0	0	106.9	F43 E48 K282	F43-V50 HydrophobicContact CD1-CG1 4.2Å; F43-V50 HydrophobicContact CD1-CG2 4.17Å; F43-V50 HydrophobicContact CE1-CG1 3.82Å; E48-V50 PolarHBondContact O-N 3.31Å; V50-K282 HydrophobicContact CG2-CD 4.37Å; V50-K282 HydrophobicContact CG2-CG 4.21Å
51	S	64.6	Low	75.4	Confident	37 Å²	37	60.5 Å²	60.5	26%	0.259	28%	0.28	S	S	.	.			trans	-135.2	133.9	178.5	-177.8	0	0	0	0	110.6	R49 Q53 R54 W60	R49-S51 PolarHBondContact O-N 3.24Å; R49-S51 VanDerWaalsContact O-N 3.09Å; S51-Q53 VanDerWaalsContact C-N 3.29Å; S51-Q53 PolarHBondContact OG-N 3.4Å; S51-R54 PolarHBondContact OG-N 3.02Å; S51-W60 WeakPolarHBondContact O-CB 3.22Å
52	S	59.3	Low	75.2	Confident	84 Å²	84	62.2 Å²	62.2	59%	0.587	29%	0.289	S	S	*	.	S	Bend	trans	-72.7	-26.3	171.7	-171.1	0	0	0	0	111.8
53	Q	59	Low	75.2	Confident	186 Å²	186	70.9 Å²	70.9	87%	0.869	33%	0.327	S	S	*	.	S	Bend	trans	-84.8	-29.7	-175.2	-70.9	176.5	-19.1	0	0	113.4	S51	S51-Q53 VanDerWaalsContact C-N 3.29Å; S51-Q53 PolarHBondContact OG-N 3.4Å
54	R	61.7	Low	75.2	Confident	169 Å²	169	72.2 Å²	72.2	64%	0.638	33%	0.333	S	S	*	.	S	Bend	trans	-125.1	108.9	175.3	-68.9	-170.2	-173.1	-172.8	1.4	109.6	S51 E56	S51-R54 PolarHBondContact OG-N 3.02Å; R54-E56 PolarHBondContact O-N 3.43Å
55	R	64.4	Low	75.2	Confident	212 Å²	212	72.2 Å²	72.2	80%	0.8	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	48.6	-176.3	-62.4	-177.7	178.4	176.2	0.6	112.6
56	E	68.7	Low	75.4	Confident	127 Å²	127	73.6 Å²	73.6	59%	0.593	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-26.9	178	-70.4	169.2	-166.5	0	0	111.7	R54	R54-E56 PolarHBondContact O-N 3.43Å
57	G	70.4	Confident	75.8	Confident	13 Å²	13	82.9 Å²	82.9	13%	0.134	38%	0.378	C	S	.	.	S	Bend	trans	-101.1	152.4	179.9	0	0	0	0	0	114.7	E48 Y59	E48-G57 VanDerWaalsContact CB-CA 3.41Å; G57-Y59 VanDerWaalsContact C-N 3.34Å; G57-Y59 PolarHBondContact O-N 2.93Å
58	K	79	Confident	76.4	Confident	49 Å²	49	83.5 Å²	83.5	21%	0.213	38%	0.384	C	S	.	.	S	Bend	trans	-61.2	-38.7	179.6	-174.2	168.7	179.6	173.8	0	113.1	Q64 E72 H254 F255	K58-Q64 PolarHBondContact O-NE2 3.5Å; K58-E72 WeakPolarHBondContact CE-OE1 3.24Å; K58-E72 WeakPolarHBondContact CE-OE2 3.23Å; K58-E72 IonicContact NZ-OE1 3.8Å; K58-E72 IonicContact NZ-OE2 2.68Å; K58-E72 PolarHBondContact NZ-OE2 2.95Å; K58-H254 PolarHBondContact NZ-O 2.87Å; K58-F255 HydrophobicContact CD-CD1 3.92Å
59	Y	82.6	Confident	77	Confident	3 Å²	3	82.1 Å²	82.1	1%	0.012	38%	0.377	C	S	.	.			trans	-117	123.1	179.6	-55.3	-57.6	0	0	0	111.3	R42 F43 Q46 G57 A65 I69 F255	R42-Y59 HydrophobicContact CB-CD2 4.46Å; R42-Y59 HydrophobicContact CB-CE2 4.01Å; R42-Y59 PolarHBondContact NH1-OH 3.45Å; F43-Y59 HydrophobicContact CE2-CG 4.22Å; Q46-Y59 PolarHBondContact NE2-O 3.29Å; Q46-Y59 VanDerWaalsContact OE1-CB 3.32Å; G57-Y59 VanDerWaalsContact C-N 3.34Å; G57-Y59 PolarHBondContact O-N 2.93Å; Y59-A65 HydrophobicContact CD1-CB 3.36Å; Y59-A65 HydrophobicContact CE1-CB 3.93Å; Y59-A65 HydrophobicContact CG-CB 3.93Å; Y59-I69 HydrophobicContact CE1-CG1 4.18Å; Y59-F255 HydrophobicContact CE2-CD1 4.09Å; Y59-F255 HydrophobicContact CE2-CE1 4.37Å; Y59-F255 WeakPolarHBondContact OH-CE1 3.43Å
60	W	81.4	Confident	78.3	Confident	104 Å²	104	81.9 Å²	81.9	39%	0.394	38%	0.377	S	S	.	.	S	Bend	trans	-119.7	-15	177.2	56.5	-96.9	0	0	0	113.5	S51 Q64	S51-W60 WeakPolarHBondContact O-CB 3.22Å; W60-Q64 HydrophobicContact CD2-CB 4.25Å; W60-Q64 HydrophobicContact CD2-CG 4.45Å; W60-Q64 HydrophobicContact CH2-CB 4.03Å; W60-Q64 HydrophobicContact CZ2-CB 3.51Å; W60-Q64 HydrophobicContact CZ2-CG 3.7Å
61	G	85	Confident	79.3	Confident	17 Å²	17	84.2 Å²	84.2	18%	0.175	40%	0.396	C	S	.	.	S	Bend	trans	-156.9	156.3	178.6	0	0	0	0	0	112.5	F63 Q64 A65	G61-F63 PolarHBondContact O-N 3.3Å; G61-Q64 PolarHBondContact O-N 3.31Å; G61-A65 VanDerWaalsContact O-CB 3.28Å; G61-A65 WeakPolarHBondContact O-CB 3.33Å; G61-A65 PolarHBondContact O-N 3.08Å
62	I	87.3	Confident	80.4	Confident	41 Å²	41	87 Å²	87	21%	0.21	41%	0.405	C	S	.	.	H	α-helix	trans	-60	-47.5	-176	-62.2	175.2	0	0	0	110.7	A65 S66 P286 L289	I62-A65 PolarHBondContact O-N 3.26Å; I62-S66 PolarHBondContact O-N 3.29Å; I62-S66 PolarHBondContact O-OG 3.46Å; I62-P286 HydrophobicContact CD1-CB 4.26Å; I62-L289 HydrophobicContact CD1-CD2 4.34Å
63	F	88	Confident	81.7	Confident	189 Å²	189	83.9 Å²	83.9	83%	0.829	38%	0.381	S	S	*	.	H	α-helix	trans	-64.1	-43.5	-179.9	-68.6	-76.8	0	0	0	112.9	G61 S66 R67	G61-F63 PolarHBondContact O-N 3.3Å; F63-S66 PolarHBondContact O-N 2.99Å; F63-R67 PolarHBondContact O-N 3.1Å
64	Q	89.4	Confident	83.1	Confident	38 Å²	38	76.2 Å²	76.2	18%	0.178	35%	0.352	C	S	.	.	H	α-helix	trans	-66.1	-42.1	177	175.8	-93.1	-11	0	0	111.1	K58 W60 G61 S66 R67 S68	K58-Q64 PolarHBondContact O-NE2 3.5Å; W60-Q64 HydrophobicContact CD2-CB 4.25Å; W60-Q64 HydrophobicContact CD2-CG 4.45Å; W60-Q64 HydrophobicContact CH2-CB 4.03Å; W60-Q64 HydrophobicContact CZ2-CB 3.51Å; W60-Q64 HydrophobicContact CZ2-CG 3.7Å; G61-Q64 PolarHBondContact O-N 3.31Å; Q64-S66 PolarHBondContact O-N 3Å; Q64-R67 PolarHBondContact O-N 2.86Å; Q64-S68 PolarHBondContact NE2-OG 3.39Å; Q64-S68 WeakPolarHBondContact O-CB 3.42Å; Q64-S68 PolarHBondContact O-N 3.07Å; Q64-S68 PolarHBondContact O-OG 3.06Å
65	A	87.6	Confident	84.4	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-62.2	-43.7	176.8	0	0	0	0	0	112.1	F43 Y59 G61 I62 R67 S68 I69	F43-A65 HydrophobicContact CE2-CB 3.44Å; F43-A65 VanDerWaalsContact CE2-CB 3.44Å; F43-A65 HydrophobicContact CZ-CB 3.93Å; Y59-A65 HydrophobicContact CD1-CB 3.36Å; Y59-A65 HydrophobicContact CE1-CB 3.93Å; Y59-A65 HydrophobicContact CG-CB 3.93Å; G61-A65 VanDerWaalsContact O-CB 3.28Å; G61-A65 WeakPolarHBondContact O-CB 3.33Å; G61-A65 PolarHBondContact O-N 3.08Å; I62-A65 PolarHBondContact O-N 3.26Å; A65-R67 VanDerWaalsContact C-N 3.32Å; A65-R67 PolarHBondContact O-N 3.35Å; A65-S68 PolarHBondContact O-N 3.45Å; A65-I69 WeakPolarHBondContact O-CB 3.35Å; A65-I69 WeakPolarHBondContact O-CD1 3.4Å; A65-I69 WeakPolarHBondContact O-CG1 3.23Å; A65-I69 PolarHBondContact O-N 3.3Å
66	S	90	Very high	85.5	Confident	34 Å²	34	67.5 Å²	67.5	24%	0.238	34%	0.336	C	S	.	.	H	α-helix	trans	-58.7	-44.2	173.9	-62.5	0	0	0	0	111.7	I39 I62 F63 Q64 Y70	I39-S66 WeakPolarHBondContact CD1-OG 3.31Å; I62-S66 PolarHBondContact O-N 3.29Å; I62-S66 PolarHBondContact O-OG 3.46Å; F63-S66 PolarHBondContact O-N 2.99Å; Q64-S66 PolarHBondContact O-N 3Å; S66-Y70 VanDerWaalsContact O-CB 3.3Å; S66-Y70 WeakPolarHBondContact O-CB 3.41Å; S66-Y70 PolarHBondContact O-N 3.43Å
67	R	90.5	Very high	86.4	Confident	199 Å²	199	61.4 Å²	61.4	75%	0.751	31%	0.308	S	S	*	.	H	α-helix	trans	-64.5	-44.1	177.4	-174.9	177.5	177.7	173.9	0.1	112.2	F63 Q64 A65 Y70 S71	F63-R67 PolarHBondContact O-N 3.1Å; Q64-R67 PolarHBondContact O-N 2.86Å; A65-R67 VanDerWaalsContact C-N 3.32Å; A65-R67 PolarHBondContact O-N 3.35Å; R67-Y70 PolarHBondContact O-N 3.38Å; R67-S71 WeakPolarHBondContact O-CB 3.48Å; R67-S71 PolarHBondContact O-N 3.45Å
68	S	87.4	Confident	87.4	Confident	25 Å²	25	61.8 Å²	61.8	18%	0.175	31%	0.306	C	S	.	.	H	α-helix	trans	-64.6	-44.5	177.6	-72.5	0	0	0	0	111.8	Q64 A65 Y70 S71 E72	Q64-S68 PolarHBondContact NE2-OG 3.39Å; Q64-S68 WeakPolarHBondContact O-CB 3.42Å; Q64-S68 PolarHBondContact O-N 3.07Å; Q64-S68 PolarHBondContact O-OG 3.06Å; A65-S68 PolarHBondContact O-N 3.45Å; S68-Y70 VanDerWaalsContact C-N 3.34Å; S68-Y70 PolarHBondContact O-N 3.02Å; S68-S71 PolarHBondContact O-N 3.41Å; S68-E72 WeakPolarHBondContact O-CB 3.36Å; S68-E72 WeakPolarHBondContact O-CG 2.95Å; S68-E72 PolarHBondContact O-N 3.22Å
69	I	89.1	Confident	88	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-60.9	-45.2	176.2	-67.8	166.6	0	0	0	110.5	I39 Y59 A65 S71 E73 G74 A77 F78	I39-I69 HydrophobicContact CG1-CD1 4.19Å; Y59-I69 HydrophobicContact CE1-CG1 4.18Å; A65-I69 WeakPolarHBondContact O-CB 3.35Å; A65-I69 WeakPolarHBondContact O-CD1 3.4Å; A65-I69 WeakPolarHBondContact O-CG1 3.23Å; A65-I69 PolarHBondContact O-N 3.3Å; I69-S71 VanDerWaalsContact C-N 3.35Å; I69-S71 PolarHBondContact O-N 3.13Å; I69-E73 PolarHBondContact O-N 2.95Å; I69-G74 PolarHBondContact O-N 3.09Å; I69-A77 HydrophobicContact CG2-CB 3.63Å; I69-F78 HydrophobicContact CB-CE1 4.39Å; I69-F78 HydrophobicContact CB-CZ 4.19Å; I69-F78 HydrophobicContact CG2-CE1 4.08Å; I69-F78 HydrophobicContact CG2-CE2 4.3Å; I69-F78 HydrophobicContact CG2-CZ 3.96Å
70	Y	91	Very high	88.4	Confident	140 Å²	140	65.3 Å²	65.3	55%	0.549	32%	0.319	S	S	.	.	H	α-helix	trans	-62.3	-42.1	177.8	179.5	-99.3	0	0	0	112.1	S66 R67 S68 G74 L75	S66-Y70 VanDerWaalsContact O-CB 3.3Å; S66-Y70 WeakPolarHBondContact O-CB 3.41Å; S66-Y70 PolarHBondContact O-N 3.43Å; R67-Y70 PolarHBondContact O-N 3.38Å; S68-Y70 VanDerWaalsContact C-N 3.34Å; S68-Y70 PolarHBondContact O-N 3.02Å; Y70-G74 WeakPolarHBondContact O-CA 3.23Å; Y70-G74 PolarHBondContact O-N 2.98Å; Y70-L75 HydrophobicContact CD2-CB 4.49Å; Y70-L75 HydrophobicContact CD2-CD1 4.42Å; Y70-L75 HydrophobicContact CE2-CB 4.24Å; Y70-L75 HydrophobicContact CE2-CD1 4.37Å
71	S	89.2	Confident	88.7	Confident	101 Å²	101	60.7 Å²	60.7	71%	0.706	30%	0.303	S	S	*	.	H	α-helix	trans	-72.9	-34.4	-179	-169.4	0	0	0	0	113.7	R67 S68 I69	R67-S71 WeakPolarHBondContact O-CB 3.48Å; R67-S71 PolarHBondContact O-N 3.45Å; S68-S71 PolarHBondContact O-N 3.41Å; I69-S71 VanDerWaalsContact C-N 3.35Å; I69-S71 PolarHBondContact O-N 3.13Å
72	E	87.3	Confident	89	Confident	95 Å²	95	61.7 Å²	61.7	44%	0.444	30%	0.303	S	S	.	.	H	α-helix	trans	-87.9	-35.4	-175.9	-69.7	173.2	-156.3	0	0	112.6	K58 S68	K58-E72 WeakPolarHBondContact CE-OE1 3.24Å; K58-E72 WeakPolarHBondContact CE-OE2 3.23Å; K58-E72 IonicContact NZ-OE1 3.8Å; K58-E72 IonicContact NZ-OE2 2.68Å; K58-E72 PolarHBondContact NZ-OE2 2.95Å; S68-E72 WeakPolarHBondContact O-CB 3.36Å; S68-E72 WeakPolarHBondContact O-CG 2.95Å; S68-E72 PolarHBondContact O-N 3.22Å
73	E	86.4	Confident	89.2	Confident	18 Å²	18	65.2 Å²	65.2	8%	0.084	32%	0.322	C	S	.	.	H	α-helix	trans	-127.4	-8.2	-167.9	-49.5	-171	-160.1	0	0	113.8	R42 I69 A77 K80 E151 F255	R42-E73 IonicContact CZ-OE1 2.69Å; R42-E73 IonicContact CZ-OE2 2.87Å; R42-E73 IonicContact NH1-OE1 2.74Å; R42-E73 PolarHBondContact NH1-OE1 2.69Å; R42-E73 IonicContact NH1-OE2 3.85Å; R42-E73 IonicContact NH2-OE1 3.56Å; R42-E73 PolarHBondContact NH2-OE1 2.95Å; R42-E73 IonicContact NH2-OE2 2.83Å; R42-E73 PolarHBondContact NH2-OE2 3.17Å; I69-E73 PolarHBondContact O-N 2.95Å; E73-A77 HydrophobicContact CB-CB 3.59Å; E73-K80 IonicContact OE2-NZ 2.97Å; E73-K80 PolarHBondContact OE2-NZ 3.25Å; E73-E151 HydrophobicContact CB-CG 4.1Å; E73-E151 HydrophobicContact CG-CG 3.88Å; E73-F255 WeakPolarHBondContact OE1-CZ 3.49Å
74	G	88.8	Confident	89.4	Confident	25 Å²	25	56.4 Å²	56.4	26%	0.258	28%	0.283	S	S	.	.			trans	77	-176.8	-178.4	0	0	0	0	0	114.6	I69 Y70 T76 A77	I69-G74 PolarHBondContact O-N 3.09Å; Y70-G74 WeakPolarHBondContact O-CA 3.23Å; Y70-G74 PolarHBondContact O-N 2.98Å; G74-T76 VanDerWaalsContact C-N 3.31Å; G74-T76 PolarHBondContact O-N 3.41Å; G74-A77 WeakPolarHBondContact O-CB 3.5Å; G74-A77 PolarHBondContact O-N 2.81Å
75	L	88.8	Confident	89.5	Confident	108 Å²	108	54.9 Å²	54.9	57%	0.565	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-65.4	-30.9	-173.8	-170.8	64.8	0	0	0	113.6	Y70 A77 F78 W79	Y70-L75 HydrophobicContact CD2-CB 4.49Å; Y70-L75 HydrophobicContact CD2-CD1 4.42Å; Y70-L75 HydrophobicContact CE2-CB 4.24Å; Y70-L75 HydrophobicContact CE2-CD1 4.37Å; L75-A77 PolarHBondContact O-N 3.07Å; L75-F78 HydrophobicContact CD1-CD2 4.38Å; L75-F78 WeakPolarHBondContact O-CD2 3.47Å; L75-F78 PolarHBondContact O-N 3.48Å; L75-W79 HydrophobicContact CD1-CZ3 4.46Å; L75-W79 HydrophobicContact CG-CZ3 4.43Å
76	T	87.8	Confident	89.7	Confident	90 Å²	90	56.4 Å²	56.4	55%	0.552	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-67.6	-17.3	-178.1	65.1	0	0	0	0	113.3	G74 F78 W79	G74-T76 VanDerWaalsContact C-N 3.31Å; G74-T76 PolarHBondContact O-N 3.41Å; T76-F78 VanDerWaalsContact C-N 3.27Å; T76-F78 PolarHBondContact O-N 3.31Å; T76-W79 PolarHBondContact O-N 2.7Å
77	A	87.5	Confident	89.8	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-61.9	-32.7	-179.4	0	0	0	0	0	113.3	I69 E73 G74 L75 W79 K80	I69-A77 HydrophobicContact CG2-CB 3.63Å; E73-A77 HydrophobicContact CB-CB 3.59Å; G74-A77 WeakPolarHBondContact O-CB 3.5Å; G74-A77 PolarHBondContact O-N 2.81Å; L75-A77 PolarHBondContact O-N 3.07Å; A77-W79 PolarHBondContact O-N 3.23Å; A77-K80 HydrophobicContact CB-CD 4.4Å; A77-K80 WeakPolarHBondContact O-CB 3.18Å; A77-K80 WeakPolarHBondContact O-CG 3.15Å; A77-K80 PolarHBondContact O-N 3.47Å; A77-K80 VanDerWaalsContact O-N 3.15Å
78	F	91.3	Very high	89.9	Confident	21 Å²	21	50 Å²	50	9%	0.092	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-69.3	-15.9	-179.6	-65.7	-73.7	0	0	0	114.3	S34 P35 V38 I39 I69 L75 T76	S34-F78 CarbonylContact C-O 3.55Å; S34-F78 PolarHBondContact OG-O 3.31Å; P35-F78 HydrophobicContact CB-CB 3.85Å; P35-F78 HydrophobicContact CB-CD1 3.79Å; P35-F78 HydrophobicContact CB-CG 4.11Å; P35-F78 HydrophobicContact CG-CB 3.96Å; V38-F78 WeakPolarHBondContact CG2-O 3.33Å; I39-F78 HydrophobicContact CD1-CE1 4.2Å; I39-F78 HydrophobicContact CG1-CE1 4.37Å; I69-F78 HydrophobicContact CB-CE1 4.39Å; I69-F78 HydrophobicContact CB-CZ 4.19Å; I69-F78 HydrophobicContact CG2-CE1 4.08Å; I69-F78 HydrophobicContact CG2-CE2 4.3Å; I69-F78 HydrophobicContact CG2-CZ 3.96Å; L75-F78 HydrophobicContact CD1-CD2 4.38Å; L75-F78 WeakPolarHBondContact O-CD2 3.47Å; L75-F78 PolarHBondContact O-N 3.48Å; T76-F78 VanDerWaalsContact C-N 3.27Å; T76-F78 PolarHBondContact O-N 3.31Å
79	W	92.3	Very high	90.1	Very high	107 Å²	107	50.5 Å²	50.5	41%	0.405	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-107.9	10.2	175.3	-73.4	-91.3	0	0	0	113.1	A31 P35 L75 T76 A77 G81 H82	A31-W79 PolarHBondContact O-NE1 3Å; P35-W79 HydrophobicContact CG-CH2 4.21Å; P35-W79 HydrophobicContact CG-CZ2 4.08Å; L75-W79 HydrophobicContact CD1-CZ3 4.46Å; L75-W79 HydrophobicContact CG-CZ3 4.43Å; T76-W79 PolarHBondContact O-N 2.7Å; A77-W79 PolarHBondContact O-N 3.23Å; W79-G81 PolarHBondContact O-N 2.93Å; W79-G81 VanDerWaalsContact O-N 3.13Å; W79-H82 HydrophobicContact CB-CB 4.3Å; W79-H82 VanDerWaalsContact O-CB 3.26Å; W79-H82 WeakPolarHBondContact O-CB 3.41Å; W79-H82 PolarHBondContact O-N 2.96Å
80	K	89.4	Confident	90.1	Very high	19 Å²	19	56 Å²	56	8%	0.083	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	119.1	172	-77	178.6	175.5	-178.9	0	109.6	E73 A77 F146 Q149 E151	E73-K80 IonicContact OE2-NZ 2.97Å; E73-K80 PolarHBondContact OE2-NZ 3.25Å; A77-K80 HydrophobicContact CB-CD 4.4Å; A77-K80 WeakPolarHBondContact O-CB 3.18Å; A77-K80 WeakPolarHBondContact O-CG 3.15Å; A77-K80 PolarHBondContact O-N 3.47Å; A77-K80 VanDerWaalsContact O-N 3.15Å; K80-F146 WeakPolarHBondContact CB-O 3.28Å; K80-Q149 HydrophobicContact CD-CG 4.27Å; K80-E151 IonicContact NZ-OE1 2.68Å; K80-E151 PolarHBondContact NZ-OE1 3.34Å
81	G	87.8	Confident	90.3	Very high	7 Å²	7	51.3 Å²	51.3	7%	0.072	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	9	-178	0	0	0	0	0	115.1	W79 P84 A85	W79-G81 PolarHBondContact O-N 2.93Å; W79-G81 VanDerWaalsContact O-N 3.13Å; G81-P84 WeakPolarHBondContact O-CD 3.22Å; G81-P84 VanDerWaalsContact O-CG 3.31Å; G81-P84 WeakPolarHBondContact O-CG 3.5Å; G81-A85 VanDerWaalsContact O-CB 3.31Å; G81-A85 WeakPolarHBondContact O-CB 3.38Å; G81-A85 PolarHBondContact O-N 3.05Å; G81-A85 VanDerWaalsContact O-N 3.1Å
82	H	91.4	Very high	90.5	Very high	37 Å²	37	49.6 Å²	49.6	17%	0.171	26%	0.261	C	S	.	.	H	α-helix	trans	-61.3	-45.7	177.7	-173.1	75	0	0	0	112.9	W79 A85 Q86	W79-H82 HydrophobicContact CB-CB 4.3Å; W79-H82 VanDerWaalsContact O-CB 3.26Å; W79-H82 WeakPolarHBondContact O-CB 3.41Å; W79-H82 PolarHBondContact O-N 2.96Å; H82-A85 WeakPolarHBondContact O-CA 3.27Å; H82-A85 WeakPolarHBondContact O-CB 3.32Å; H82-A85 PolarHBondContact O-N 3.42Å; H82-A85 VanDerWaalsContact O-N 3.12Å; H82-Q86 PolarHBondContact CE1-NE2 2.89Å; H82-Q86 PolarHBondContact NE2-NE2 3.47Å; H82-Q86 WeakPolarHBondContact O-CG 3.38Å; H82-Q86 PolarHBondContact O-N 3.45Å
83	I	91.4	Very high	90.6	Very high	116 Å²	116	46.9 Å²	46.9	60%	0.595	26%	0.258	S	S	*	.	H	α-helix	trans	-57.7	-55.7	179.3	-60.1	173.7	0	0	0	112.1	A85 Q86 L87 L158	I83-A85 PolarHBondContact O-N 2.97Å; I83-Q86 PolarHBondContact O-N 3.23Å; I83-Q86 VanDerWaalsContact O-N 3.13Å; I83-L87 HydrophobicContact CG2-CD1 4.39Å; I83-L87 PolarHBondContact O-N 3.1Å; I83-L87 VanDerWaalsContact O-N 3.11Å; I83-L158 HydrophobicContact CG2-CD2 4.32Å
84	P	92.2	Very high	90.9	Very high	4 Å²	4	48.7 Å²	48.7	3%	0.026	28%	0.276	C	S	.	.	H	α-helix	trans	-63	-27.6	176.5	23.1	-32.3	0	0	0	112.4	G81 L88 L142 R143 F146 L158	G81-P84 WeakPolarHBondContact O-CD 3.22Å; G81-P84 VanDerWaalsContact O-CG 3.31Å; G81-P84 WeakPolarHBondContact O-CG 3.5Å; P84-L88 WeakPolarHBondContact O-CB 3.31Å; P84-L88 PolarHBondContact O-N 2.93Å; P84-L142 HydrophobicContact CB-CB 4.35Å; P84-R143 HydrophobicContact CB-CB 4.19Å; P84-R143 HydrophobicContact CG-CB 4.16Å; P84-F146 HydrophobicContact CG-CD2 4.43Å; P84-L158 HydrophobicContact CB-CD1 4.29Å; P84-L158 HydrophobicContact CG-CD1 4.41Å
85	A	91.5	Very high	91.3	Very high	6 Å²	6	49.3 Å²	49.3	5%	0.05	28%	0.275	C	S	.	.	H	α-helix	trans	-69.4	-32.3	174.4	0	0	0	0	0	114	R30 G81 H82 I83 S89 R143	R30-A85 PolarHBondContact NE-O 2.9Å; G81-A85 VanDerWaalsContact O-CB 3.31Å; G81-A85 WeakPolarHBondContact O-CB 3.38Å; G81-A85 PolarHBondContact O-N 3.05Å; G81-A85 VanDerWaalsContact O-N 3.1Å; H82-A85 WeakPolarHBondContact O-CA 3.27Å; H82-A85 WeakPolarHBondContact O-CB 3.32Å; H82-A85 PolarHBondContact O-N 3.42Å; H82-A85 VanDerWaalsContact O-N 3.12Å; I83-A85 PolarHBondContact O-N 2.97Å; A85-S89 PolarHBondContact O-N 3.47Å; A85-R143 HydrophobicContact CB-CG 4.05Å
86	Q	92.1	Very high	91.5	Very high	31 Å²	31	47.5 Å²	47.5	15%	0.145	26%	0.263	C	S	.	.	H	α-helix	trans	-70.6	-50.8	173.3	-69.2	-67.8	-2	0	0	110.6	R30 H82 I83 L88 S89 I90	R30-Q86 VanDerWaalsContact CD-CD 3.45Å; H82-Q86 PolarHBondContact CE1-NE2 2.89Å; H82-Q86 PolarHBondContact NE2-NE2 3.47Å; H82-Q86 WeakPolarHBondContact O-CG 3.38Å; H82-Q86 PolarHBondContact O-N 3.45Å; I83-Q86 PolarHBondContact O-N 3.23Å; I83-Q86 VanDerWaalsContact O-N 3.13Å; Q86-L88 VanDerWaalsContact C-N 3.26Å; Q86-L88 PolarHBondContact O-N 3.3Å; Q86-S89 VanDerWaalsContact O-CB 3.28Å; Q86-S89 WeakPolarHBondContact O-CB 3.29Å; Q86-S89 PolarHBondContact O-N 3.16Å; Q86-I90 WeakPolarHBondContact O-CG1 3.29Å; Q86-I90 PolarHBondContact O-N 3.35Å; Q86-I90 VanDerWaalsContact O-N 3.15Å
87	L	92.9	Very high	91.8	Very high	79 Å²	79	49 Å²	49	41%	0.414	26%	0.263	S	S	.	.	H	α-helix	trans	-56.5	-42.9	176.3	-67.4	176.2	0	0	0	111.5	I83 S89 I90 C91 L139 L158	I83-L87 HydrophobicContact CG2-CD1 4.39Å; I83-L87 PolarHBondContact O-N 3.1Å; I83-L87 VanDerWaalsContact O-N 3.11Å; L87-S89 VanDerWaalsContact C-N 3.3Å; L87-S89 PolarHBondContact O-N 3.43Å; L87-I90 PolarHBondContact O-N 2.76Å; L87-C91 VanDerWaalsContact O-CB 3.29Å; L87-C91 WeakPolarHBondContact O-CB 3.41Å; L87-C91 PolarHBondContact O-N 2.83Å; L87-L139 HydrophobicContact CB-CD1 3.97Å; L87-L139 HydrophobicContact CB-CD2 4.19Å; L87-L139 HydrophobicContact CD1-CD2 4.34Å; L87-L158 HydrophobicContact CD1-CD2 4.16Å
88	L	92.9	Very high	92.1	Very high	19 Å²	19	53.6 Å²	53.6	10%	0.099	29%	0.29	C	S	.	.	H	α-helix	trans	-55.8	-43.8	174.2	172.7	61.8	0	0	0	111.7	P84 Q86 F92 C136 L139 D140	P84-L88 WeakPolarHBondContact O-CB 3.31Å; P84-L88 PolarHBondContact O-N 2.93Å; Q86-L88 VanDerWaalsContact C-N 3.26Å; Q86-L88 PolarHBondContact O-N 3.3Å; L88-F92 WeakPolarHBondContact O-CB 3.22Å; L88-F92 PolarHBondContact O-N 2.77Å; L88-C136 HydrophobicContact CD1-CB 3.53Å; L88-L139 HydrophobicContact CB-CB 4.14Å; L88-L139 HydrophobicContact CD1-CB 4.42Å; L88-D140 HydrophobicContact CD1-CB 4.18Å; L88-D140 HydrophobicContact CD2-CB 3.94Å
89	S	90	Very high	92.2	Very high	37 Å²	37	53.9 Å²	53.9	26%	0.259	29%	0.294	S	S	.	.	H	α-helix	trans	-62.2	-47.1	179.1	-160.9	0	0	0	0	113.2	R30 A85 Q86 L87 G93	R30-S89 PolarHBondContact NH1-OG 3.45Å; R30-S89 PolarHBondContact NH2-OG 3.32Å; A85-S89 PolarHBondContact O-N 3.47Å; Q86-S89 VanDerWaalsContact O-CB 3.28Å; Q86-S89 WeakPolarHBondContact O-CB 3.29Å; Q86-S89 PolarHBondContact O-N 3.16Å; L87-S89 VanDerWaalsContact C-N 3.3Å; L87-S89 PolarHBondContact O-N 3.43Å; S89-G93 PolarHBondContact O-N 3.31Å
90	I	91.1	Very high	92.2	Very high	117 Å²	117	51.4 Å²	51.4	60%	0.6	29%	0.286	S	S	*	.	H	α-helix	trans	-67.3	-47.9	-173.3	-64.4	166.1	0	0	0	107.9	Q86 L87 A94	Q86-I90 WeakPolarHBondContact O-CG1 3.29Å; Q86-I90 PolarHBondContact O-N 3.35Å; Q86-I90 VanDerWaalsContact O-N 3.15Å; L87-I90 PolarHBondContact O-N 2.76Å; I90-A94 WeakPolarHBondContact O-CB 3.5Å; I90-A94 PolarHBondContact O-N 3.19Å
91	C	93.9	Very high	92.3	Very high	40 Å²	40	53.9 Å²	53.9	27%	0.27	30%	0.298	S	S	.	.	H	α-helix	trans	-63.4	-44.9	178.4	-168.2	0	0	0	0	111.7	L87 G93 A94 V95 C136 L139	L87-C91 VanDerWaalsContact O-CB 3.29Å; L87-C91 WeakPolarHBondContact O-CB 3.41Å; L87-C91 PolarHBondContact O-N 2.83Å; C91-G93 PolarHBondContact O-N 2.9Å; C91-A94 PolarHBondContact O-N 3.35Å; C91-V95 WeakPolarHBondContact O-CB 3.27Å; C91-V95 VanDerWaalsContact O-CG2 3.3Å; C91-V95 WeakPolarHBondContact O-CG2 3.33Å; C91-V95 PolarHBondContact O-N 2.95Å; C91-C136 VanDerWaalsContact C-SG 3.56Å; C91-C136 PolarHBondContact SG-SG 3.48Å; C91-L139 HydrophobicContact CB-CD1 4.25Å
92	F	93.6	Very high	92.5	Very high	66 Å²	66	59.2 Å²	59.2	29%	0.289	32%	0.319	S	S	.	.	H	α-helix	trans	-63.4	-46.4	-179.3	-171.4	-91.6	0	0	0	111.6	L88 Q96 A132 C136	L88-F92 WeakPolarHBondContact O-CB 3.22Å; L88-F92 PolarHBondContact O-N 2.77Å; F92-Q96 WeakPolarHBondContact O-CB 3.3Å; F92-Q96 PolarHBondContact O-N 3.33Å; F92-A132 HydrophobicContact CD2-CB 3.74Å; F92-A132 HydrophobicContact CE2-CB 3.77Å; F92-A132 HydrophobicContact CG-CB 4.28Å; F92-A132 HydrophobicContact CZ-CB 4.33Å; F92-C136 VanDerWaalsContact CA-SG 3.51Å; F92-C136 PolarHBondContact N-SG 3.14Å
93	G	90.3	Very high	92.5	Very high	38 Å²	38	59 Å²	59	39%	0.392	32%	0.319	S	S	.	.	H	α-helix	trans	-61.5	-45.6	177	0	0	0	0	0	112.7	S89 C91 F97	S89-G93 PolarHBondContact O-N 3.31Å; C91-G93 PolarHBondContact O-N 2.9Å; G93-F97 VanDerWaalsContact O-CB 3.27Å; G93-F97 WeakPolarHBondContact O-CB 3.21Å; G93-F97 PolarHBondContact O-N 3.34Å
94	A	93	Very high	92.3	Very high	55 Å²	55	54.5 Å²	54.5	46%	0.455	30%	0.297	S	S	.	.	H	α-helix	trans	-63.4	-52.3	179.3	0	0	0	0	0	112.2	I90 C91 Q96 F97 V98	I90-A94 WeakPolarHBondContact O-CB 3.5Å; I90-A94 PolarHBondContact O-N 3.19Å; C91-A94 PolarHBondContact O-N 3.35Å; A94-Q96 PolarHBondContact O-N 2.85Å; A94-F97 PolarHBondContact O-N 3.15Å; A94-V98 WeakPolarHBondContact O-CB 3.39Å; A94-V98 VanDerWaalsContact O-CG2 3.31Å; A94-V98 WeakPolarHBondContact O-CG2 3.2Å; A94-V98 PolarHBondContact O-N 2.71Å
95	V	95.3	Very high	92.1	Very high	39 Å²	39	59.9 Å²	59.9	24%	0.236	32%	0.32	C	S	.	.	H	α-helix	trans	-66.1	-41.5	-177.8	178	0	0	0	0	110.9	C91 T99 A132 A135	C91-V95 WeakPolarHBondContact O-CB 3.27Å; C91-V95 VanDerWaalsContact O-CG2 3.3Å; C91-V95 WeakPolarHBondContact O-CG2 3.33Å; C91-V95 PolarHBondContact O-N 2.95Å; V95-T99 WeakPolarHBondContact O-CB 3.42Å; V95-T99 PolarHBondContact O-N 3.21Å; V95-T99 PolarHBondContact O-OG1 3.01Å; V95-A132 HydrophobicContact CB-CB 4.15Å; V95-A132 HydrophobicContact CG1-CB 4.07Å; V95-A135 HydrophobicContact CG1-CB 4.17Å; V95-A135 HydrophobicContact CG2-CB 4.22Å
96	Q	94.3	Very high	91.9	Very high	70 Å²	70	63.8 Å²	63.8	33%	0.327	34%	0.338	S	S	.	.	H	α-helix	trans	-62.6	-46.3	178.3	-175.3	-177.4	-10.4	0	0	110.9	F92 A94 F100 A128 A132	F92-Q96 WeakPolarHBondContact O-CB 3.3Å; F92-Q96 PolarHBondContact O-N 3.33Å; A94-Q96 PolarHBondContact O-N 2.85Å; Q96-F100 WeakPolarHBondContact O-CB 3.37Å; Q96-F100 PolarHBondContact O-N 3.26Å; Q96-A128 HydrophobicContact CG-CB 4.29Å; Q96-A132 HydrophobicContact CB-CB 3.86Å
97	F	92.9	Very high	91.6	Very high	122 Å²	122	64.1 Å²	64.1	54%	0.535	34%	0.342	S	S	.	.	H	α-helix	trans	-64.9	-49.7	-178.8	-173.9	-95.8	0	0	0	111.9	G93 A94 T99 F100 E101	G93-F97 VanDerWaalsContact O-CB 3.27Å; G93-F97 WeakPolarHBondContact O-CB 3.21Å; G93-F97 PolarHBondContact O-N 3.34Å; A94-F97 PolarHBondContact O-N 3.15Å; F97-T99 PolarHBondContact O-N 3.5Å; F97-F100 PolarHBondContact O-N 2.99Å; F97-E101 HydrophobicContact CD1-CG 4.33Å; F97-E101 HydrophobicContact CE1-CG 3.92Å; F97-E101 WeakPolarHBondContact CE1-OE1 3.31Å; F97-E101 HydrophobicContact CZ-CG 4.1Å; F97-E101 WeakPolarHBondContact CZ-OE1 3.24Å; F97-E101 PolarHBondContact O-N 3.19Å
98	V	94.6	Very high	91.2	Very high	96 Å²	96	66 Å²	66	58%	0.582	35%	0.349	S	S	*	.	H	α-helix	trans	-60.1	-45.4	178.4	171.7	0	0	0	0	111.2	A94 E101 F102	A94-V98 WeakPolarHBondContact O-CB 3.39Å; A94-V98 VanDerWaalsContact O-CG2 3.31Å; A94-V98 WeakPolarHBondContact O-CG2 3.2Å; A94-V98 PolarHBondContact O-N 2.71Å; V98-E101 PolarHBondContact O-N 3.2Å; V98-F102 WeakPolarHBondContact O-CB 3.22Å; V98-F102 PolarHBondContact O-N 3.06Å
99	T	93.8	Very high	90.8	Very high	27 Å²	27	73.7 Å²	73.7	17%	0.166	38%	0.382	C	S	.	.	H	α-helix	trans	-65.8	-41.1	179	-53.7	0	0	0	0	111	V95 F97 F102 L103 A128	V95-T99 WeakPolarHBondContact O-CB 3.42Å; V95-T99 PolarHBondContact O-N 3.21Å; V95-T99 PolarHBondContact O-OG1 3.01Å; F97-T99 PolarHBondContact O-N 3.5Å; T99-F102 PolarHBondContact O-N 3.46Å; T99-L103 HydrophobicContact CG2-CD1 3.84Å; T99-L103 HydrophobicContact CG2-CG 4.14Å; T99-L103 WeakPolarHBondContact O-CB 3.4Å; T99-L103 VanDerWaalsContact O-CG 3.25Å; T99-L103 WeakPolarHBondContact O-CG 3.38Å; T99-L103 PolarHBondContact O-N 3.26Å; T99-A128 HydrophobicContact CG2-CB 4.01Å
100	F	92.5	Very high	90.4	Very high	55 Å²	55	76.4 Å²	76.4	24%	0.241	40%	0.401	C	S	.	.	H	α-helix	trans	-63.4	-45	178.6	180	-102.1	0	0	0	112.1	Q96 F97 T104 H121 C124 A128	Q96-F100 WeakPolarHBondContact O-CB 3.37Å; Q96-F100 PolarHBondContact O-N 3.26Å; F97-F100 PolarHBondContact O-N 2.99Å; F100-T104 HydrophobicContact CD2-CG2 4.34Å; F100-T104 HydrophobicContact CE1-CG2 4.06Å; F100-T104 HydrophobicContact CE2-CG2 3.89Å; F100-T104 HydrophobicContact CZ-CG2 3.72Å; F100-T104 WeakPolarHBondContact O-CB 3.29Å; F100-T104 WeakPolarHBondContact O-CG2 3.36Å; F100-T104 PolarHBondContact O-N 3Å; F100-T104 PolarHBondContact O-OG1 3.03Å; F100-H121 AromaticContact CZ-CE1 3.98Å; F100-H121 AromaticContact CZ-ND1 3.49Å; F100-H121 WeakPolarHBondContact CZ-ND1 3.47Å; F100-C124 HydrophobicContact CD2-CB 4.15Å; F100-C124 HydrophobicContact CE2-CB 4.01Å; F100-A128 HydrophobicContact CB-CB 3.79Å; F100-A128 HydrophobicContact CD2-CB 4.49Å
101	E	90.9	Very high	89.8	Confident	71 Å²	71	73.4 Å²	73.4	33%	0.332	39%	0.387	S	S	.	.	H	α-helix	trans	-61.5	-44	173.5	-75.4	-156.2	169.5	0	0	112.1	F97 V98 T104 K105	F97-E101 HydrophobicContact CD1-CG 4.33Å; F97-E101 HydrophobicContact CE1-CG 3.92Å; F97-E101 WeakPolarHBondContact CE1-OE1 3.31Å; F97-E101 HydrophobicContact CZ-CG 4.1Å; F97-E101 WeakPolarHBondContact CZ-OE1 3.24Å; F97-E101 PolarHBondContact O-N 3.19Å; V98-E101 PolarHBondContact O-N 3.2Å; E101-T104 WeakPolarHBondContact CA-OG1 3.34Å; E101-T104 PolarHBondContact O-OG1 2.77Å; E101-T104 VanDerWaalsContact O-OG1 3.07Å; E101-K105 VanDerWaalsContact O-CB 3.3Å; E101-K105 WeakPolarHBondContact O-CB 2.77Å; E101-K105 WeakPolarHBondContact O-CD 3.3Å; E101-K105 WeakPolarHBondContact O-CG 3.48Å; E101-K105 PolarHBondContact O-N 2.9Å; E101-K105 IonicContact OE2-NZ 3.34Å; E101-K105 PolarHBondContact OE2-NZ 2.93Å
102	F	92.6	Very high	88.6	Confident	119 Å²	119	78 Å²	78	52%	0.522	42%	0.417	S	S	.	.	H	α-helix	trans	-62.1	-48.8	179.8	177	-99.4	0	0	0	111.4	V98 T99 K105 M106	V98-F102 WeakPolarHBondContact O-CB 3.22Å; V98-F102 PolarHBondContact O-N 3.06Å; T99-F102 PolarHBondContact O-N 3.46Å; F102-K105 PolarHBondContact O-N 3.32Å; F102-M106 HydrophobicContact CD1-CE 4.49Å; F102-M106 HydrophobicContact CD1-CG 4.39Å; F102-M106 HydrophobicContact CE1-CE 3.66Å; F102-M106 HydrophobicContact CE1-CG 3.98Å; F102-M106 HydrophobicContact CE1-SD 3.75Å; F102-M106 HydrophobicContact CE2-CG 4.23Å; F102-M106 HydrophobicContact CE2-SD 4.35Å; F102-M106 HydrophobicContact CZ-CE 4.09Å; F102-M106 HydrophobicContact CZ-CG 3.89Å; F102-M106 HydrophobicContact CZ-SD 3.54Å; F102-M106 VanDerWaalsContact CZ-SD 3.54Å; F102-M106 WeakPolarHBondContact O-CG 3.08Å; F102-M106 PolarHBondContact O-N 3.47Å
103	L	90.7	Very high	87.3	Confident	31 Å²	31	82.5 Å²	82.5	16%	0.162	43%	0.433	C	S	.	.	H	α-helix	trans	-63.4	-44.5	179.6	-70.6	175.3	0	0	0	112	T99 M106 V107 C124 L127 A128	T99-L103 HydrophobicContact CG2-CD1 3.84Å; T99-L103 HydrophobicContact CG2-CG 4.14Å; T99-L103 WeakPolarHBondContact O-CB 3.4Å; T99-L103 VanDerWaalsContact O-CG 3.25Å; T99-L103 WeakPolarHBondContact O-CG 3.38Å; T99-L103 PolarHBondContact O-N 3.26Å; L103-M106 PolarHBondContact O-N 3.45Å; L103-V107 WeakPolarHBondContact O-CG2 3.11Å; L103-V107 PolarHBondContact O-N 3.34Å; L103-C124 HydrophobicContact CB-CB 4.14Å; L103-L127 HydrophobicContact CD1-CB 3.62Å; L103-L127 HydrophobicContact CD1-CD1 4.45Å; L103-A128 HydrophobicContact CD1-CB 4.45Å
104	T	87.4	Confident	86.2	Confident	22 Å²	22	85 Å²	85	14%	0.135	44%	0.437	C	S	.	.	H	α-helix	trans	-65.2	-40	177.9	50	0	0	0	0	112.2	F100 E101 V107 H108 C124	F100-T104 HydrophobicContact CD2-CG2 4.34Å; F100-T104 HydrophobicContact CE1-CG2 4.06Å; F100-T104 HydrophobicContact CE2-CG2 3.89Å; F100-T104 HydrophobicContact CZ-CG2 3.72Å; F100-T104 WeakPolarHBondContact O-CB 3.29Å; F100-T104 WeakPolarHBondContact O-CG2 3.36Å; F100-T104 PolarHBondContact O-N 3Å; F100-T104 PolarHBondContact O-OG1 3.03Å; E101-T104 WeakPolarHBondContact CA-OG1 3.34Å; E101-T104 PolarHBondContact O-OG1 2.77Å; E101-T104 VanDerWaalsContact O-OG1 3.07Å; T104-V107 PolarHBondContact O-N 2.97Å; T104-H108 WeakPolarHBondContact O-CB 3.32Å; T104-H108 PolarHBondContact O-N 3.39Å; T104-C124 HydrophobicContact CG2-CB 3.97Å
105	K	87.7	Confident	84.8	Confident	117 Å²	117	83.3 Å²	83.3	51%	0.509	42%	0.423	S	S	.	.	H	α-helix	trans	-62.5	-41	173	-73.8	168.6	-171.2	162.9	0	112.1	E101 F102 H108 K109	E101-K105 VanDerWaalsContact O-CB 3.3Å; E101-K105 WeakPolarHBondContact O-CB 2.77Å; E101-K105 WeakPolarHBondContact O-CD 3.3Å; E101-K105 WeakPolarHBondContact O-CG 3.48Å; E101-K105 PolarHBondContact O-N 2.9Å; E101-K105 IonicContact OE2-NZ 3.34Å; E101-K105 PolarHBondContact OE2-NZ 2.93Å; F102-K105 PolarHBondContact O-N 3.32Å; K105-H108 PolarHBondContact O-N 3.32Å; K105-K109 WeakPolarHBondContact O-CG 3.4Å; K105-K109 PolarHBondContact O-N 2.91Å
106	M	87.9	Confident	83.3	Confident	88 Å²	88	91 Å²	91	43%	0.433	45%	0.447	S	S	.	.	H	α-helix	trans	-64.6	-44.5	176.3	-73.8	-136.4	-57.3	0	0	112.2	F102 L103 H108 K109 S110	F102-M106 HydrophobicContact CD1-CE 4.49Å; F102-M106 HydrophobicContact CD1-CG 4.39Å; F102-M106 HydrophobicContact CE1-CE 3.66Å; F102-M106 HydrophobicContact CE1-CG 3.98Å; F102-M106 HydrophobicContact CE1-SD 3.75Å; F102-M106 HydrophobicContact CE2-CG 4.23Å; F102-M106 HydrophobicContact CE2-SD 4.35Å; F102-M106 HydrophobicContact CZ-CE 4.09Å; F102-M106 HydrophobicContact CZ-CG 3.89Å; F102-M106 HydrophobicContact CZ-SD 3.54Å; F102-M106 VanDerWaalsContact CZ-SD 3.54Å; F102-M106 WeakPolarHBondContact O-CG 3.08Å; F102-M106 PolarHBondContact O-N 3.47Å; L103-M106 PolarHBondContact O-N 3.45Å; M106-H108 VanDerWaalsContact C-N 3.34Å; M106-H108 PolarHBondContact O-N 2.85Å; M106-K109 PolarHBondContact O-N 3.02Å; M106-S110 VanDerWaalsContact O-CB 3.28Å; M106-S110 WeakPolarHBondContact O-CB 3.27Å; M106-S110 PolarHBondContact O-N 2.99Å; M106-S110 PolarHBondContact O-OG 3.46Å
107	V	86.3	Confident	82.6	Confident	38 Å²	38	90.2 Å²	90.2	23%	0.23	45%	0.448	C	S	.	.	H	α-helix	trans	-63.2	-41.6	177.6	173.1	0	0	0	0	111.1	L103 T104 K109 S110 T111 V120	L103-V107 WeakPolarHBondContact O-CG2 3.11Å; L103-V107 PolarHBondContact O-N 3.34Å; T104-V107 PolarHBondContact O-N 2.97Å; V107-K109 VanDerWaalsContact C-N 3.32Å; V107-K109 PolarHBondContact O-N 2.81Å; V107-S110 PolarHBondContact O-N 3.26Å; V107-T111 WeakPolarHBondContact O-CB 3.5Å; V107-T111 PolarHBondContact O-N 2.95Å; V107-T111 VanDerWaalsContact O-N 3.08Å; V107-T111 PolarHBondContact O-OG1 3.42Å; V107-V120 HydrophobicContact CB-CG1 4.34Å; V107-V120 HydrophobicContact CG1-CG1 3.79Å; V107-V120 HydrophobicContact CG1-CG2 4.36Å
108	H	83.5	Confident	81.9	Confident	119 Å²	119	88.8 Å²	88.8	55%	0.551	45%	0.45	S	S	*	.	H	α-helix	trans	-58.6	-41.9	176.4	-168.4	64.5	0	0	0	113.1	T104 K105 M106 S115	T104-H108 WeakPolarHBondContact O-CB 3.32Å; T104-H108 PolarHBondContact O-N 3.39Å; K105-H108 PolarHBondContact O-N 3.32Å; M106-H108 VanDerWaalsContact C-N 3.34Å; M106-H108 PolarHBondContact O-N 2.85Å; H108-S115 WeakPolarHBondContact CB-OG 3.22Å; H108-S115 PolarHBondContact ND1-OG 2.99Å
109	K	84.3	Confident	81.4	Confident	181 Å²	181	86.2 Å²	86.2	79%	0.787	44%	0.443	S	S	*	.	H	α-helix	trans	-80.5	-30.5	-177	-71.5	-175.9	178.5	-173	0	113.5	K105 M106 V107	K105-K109 WeakPolarHBondContact O-CG 3.4Å; K105-K109 PolarHBondContact O-N 2.91Å; M106-K109 PolarHBondContact O-N 3.02Å; V107-K109 VanDerWaalsContact C-N 3.32Å; V107-K109 PolarHBondContact O-N 2.81Å
110	S	82.3	Confident	81	Confident	94 Å²	94	86 Å²	86	66%	0.657	44%	0.442	S	S	*	.	H	α-helix	trans	-97.1	-17	-170.5	-47.7	0	0	0	0	113.3	M106 V107	M106-S110 VanDerWaalsContact O-CB 3.28Å; M106-S110 WeakPolarHBondContact O-CB 3.27Å; M106-S110 PolarHBondContact O-N 2.99Å; M106-S110 PolarHBondContact O-OG 3.46Å; V107-S110 PolarHBondContact O-N 3.26Å
111	T	77.9	Confident	80.7	Confident	53 Å²	53	87.1 Å²	87.1	33%	0.325	45%	0.448	S	S	.	.	S	Bend	trans	-136.2	141.5	-170.4	-38.2	0	0	0	0	110.6	V107 Y113	V107-T111 WeakPolarHBondContact O-CB 3.5Å; V107-T111 PolarHBondContact O-N 2.95Å; V107-T111 VanDerWaalsContact O-N 3.08Å; V107-T111 PolarHBondContact O-OG1 3.42Å; T111-Y113 HydrophobicContact CG2-CD2 3.4Å; T111-Y113 HydrophobicContact CG2-CE2 4.09Å; T111-Y113 HydrophobicContact CG2-CG 4.29Å; T111-Y113 PolarHBondContact O-N 3.33Å; T111-Y113 VanDerWaalsContact O-N 3.08Å
112	P	69.4	Low	80.6	Confident	138 Å²	138	87.4 Å²	87.4	90%	0.896	45%	0.448	S	S	*	.	S	Bend	trans	-70.6	2.2	176.1	28.7	-36.6	0	0	0	114.1
113	Y	65.4	Low	80.6	Confident	159 Å²	159	85.2 Å²	85.2	62%	0.624	44%	0.444	S	S	*	.	S	Bend	trans	-75.2	133.6	176.7	-75.4	-66.8	0	0	0	111.2	T111 S115	T111-Y113 HydrophobicContact CG2-CD2 3.4Å; T111-Y113 HydrophobicContact CG2-CE2 4.09Å; T111-Y113 HydrophobicContact CG2-CG 4.29Å; T111-Y113 PolarHBondContact O-N 3.33Å; T111-Y113 VanDerWaalsContact O-N 3.08Å; Y113-S115 PolarHBondContact O-N 3.43Å
114	D	67.9	Low	80.6	Confident	90 Å²	90	84 Å²	84	48%	0.481	44%	0.438	S	S	.	.			trans	-61.6	127.1	172.3	-170.7	-1.8	0	0	0	109.6	R116 T117	D114-R116 PolarHBondContact O-N 3.46Å; D114-R116 PolarHBondContact OD1-N 3.34Å; D114-T117 WeakPolarHBondContact O-CB 3.18Å; D114-T117 PolarHBondContact O-N 2.99Å; D114-T117 PolarHBondContact O-OG1 3.31Å
115	S	62.1	Low	80.8	Confident	21 Å²	21	83.8 Å²	83.8	15%	0.147	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-19.7	179.5	-51.6	0	0	0	0	112.6	H108 Y113 T117 H121	H108-S115 WeakPolarHBondContact CB-OG 3.22Å; H108-S115 PolarHBondContact ND1-OG 2.99Å; Y113-S115 PolarHBondContact O-N 3.43Å; S115-T117 VanDerWaalsContact C-N 3.29Å; S115-T117 PolarHBondContact O-N 2.71Å; S115-H121 PolarHBondContact O-CD2 2.9Å; S115-H121 PolarHBondContact O-NE2 3.35Å
116	R	64.6	Low	81	Confident	200 Å²	200	78.5 Å²	78.5	76%	0.755	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-4.1	177.4	-64.9	-178.9	174.9	162.5	0.4	114.6	D114	D114-R116 PolarHBondContact O-N 3.46Å; D114-R116 PolarHBondContact OD1-N 3.34Å
117	T	80.2	Confident	81.4	Confident	54 Å²	54	78 Å²	78	33%	0.331	42%	0.418	S	S	.	.			trans	-60.5	127.4	178.1	-55	0	0	0	0	109.9	D114 S115 G119 V120 H121	D114-T117 WeakPolarHBondContact O-CB 3.18Å; D114-T117 PolarHBondContact O-N 2.99Å; D114-T117 PolarHBondContact O-OG1 3.31Å; S115-T117 VanDerWaalsContact C-N 3.29Å; S115-T117 PolarHBondContact O-N 2.71Å; T117-G119 PolarHBondContact O-N 2.66Å; T117-G119 VanDerWaalsContact O-N 3.1Å; T117-V120 WeakPolarHBondContact O-CB 3.28Å; T117-V120 PolarHBondContact O-N 3.46Å; T117-H121 PolarHBondContact O-N 2.9Å; T117-H121 VanDerWaalsContact O-N 3.14Å
118	P	78.3	Confident	81.7	Confident	91 Å²	91	76.2 Å²	76.2	59%	0.591	41%	0.407	S	S	*	.	H	α-helix	trans	-54.7	-34.5	-177.3	-28.8	35	0	0	0	113.9	H121 F122	P118-H121 PolarHBondContact O-N 2.99Å; P118-F122 WeakPolarHBondContact O-CB 3.3Å; P118-F122 PolarHBondContact O-N 3.14Å
119	G	83.2	Confident	82.2	Confident	42 Å²	42	71.2 Å²	71.2	43%	0.433	39%	0.386	S	S	.	.	H	α-helix	trans	-65.9	-38.2	175.3	0	0	0	0	0	113.7	T117 F122 V123	T117-G119 PolarHBondContact O-N 2.66Å; T117-G119 VanDerWaalsContact O-N 3.1Å; G119-F122 WeakPolarHBondContact O-CB 3.48Å; G119-F122 PolarHBondContact O-N 2.92Å; G119-V123 WeakPolarHBondContact O-CG2 3.46Å; G119-V123 PolarHBondContact O-N 3.28Å
120	V	85	Confident	82.8	Confident	22 Å²	22	63.7 Å²	63.7	13%	0.133	36%	0.356	C	S	.	.	H	α-helix	trans	-66.3	-46.2	175.7	173.8	0	0	0	0	110	V107 T117 F122 V123 C124	V107-V120 HydrophobicContact CB-CG1 4.34Å; V107-V120 HydrophobicContact CG1-CG1 3.79Å; V107-V120 HydrophobicContact CG1-CG2 4.36Å; T117-V120 WeakPolarHBondContact O-CB 3.28Å; T117-V120 PolarHBondContact O-N 3.46Å; V120-F122 VanDerWaalsContact C-N 3.28Å; V120-F122 PolarHBondContact O-N 2.86Å; V120-V123 PolarHBondContact O-N 3.4Å; V120-C124 VanDerWaalsContact O-CB 3.24Å; V120-C124 WeakPolarHBondContact O-CB 3.15Å; V120-C124 PolarHBondContact O-N 2.94Å; V120-C124 PolarHBondContact O-SG 2.88Å; V120-C124 VanDerWaalsContact O-SG 3.35Å
121	H	86.9	Confident	83.4	Confident	79 Å²	79	61.8 Å²	61.8	37%	0.366	34%	0.343	S	S	.	.	H	α-helix	trans	-59.4	-38.9	174.8	-84.2	-95.1	0	0	0	112.5	F100 S115 T117 P118 G125	F100-H121 AromaticContact CZ-CE1 3.98Å; F100-H121 AromaticContact CZ-ND1 3.49Å; F100-H121 WeakPolarHBondContact CZ-ND1 3.47Å; S115-H121 PolarHBondContact O-CD2 2.9Å; S115-H121 PolarHBondContact O-NE2 3.35Å; T117-H121 PolarHBondContact O-N 2.9Å; T117-H121 VanDerWaalsContact O-N 3.14Å; P118-H121 PolarHBondContact O-N 2.99Å; H121-G125 WeakPolarHBondContact O-CA 3.38Å; H121-G125 PolarHBondContact O-N 3.13Å
122	F	89.8	Confident	84.3	Confident	77 Å²	77	59.2 Å²	59.2	34%	0.338	33%	0.327	S	S	.	.	H	α-helix	trans	-63.5	-49.7	176.5	-179.8	-97.8	0	0	0	112.1	P118 G119 V120 G126 F186 A189	P118-F122 WeakPolarHBondContact O-CB 3.3Å; P118-F122 PolarHBondContact O-N 3.14Å; G119-F122 WeakPolarHBondContact O-CB 3.48Å; G119-F122 PolarHBondContact O-N 2.92Å; V120-F122 VanDerWaalsContact C-N 3.28Å; V120-F122 PolarHBondContact O-N 2.86Å; F122-G126 PolarHBondContact O-N 3.36Å; F122-F186 AromaticContact CE1-CD1 3.89Å; F122-F186 HydrophobicContact CE1-CD1 3.89Å; F122-F186 HydrophobicContact CE1-CE1 4.41Å; F122-F186 HydrophobicContact CZ-CD1 4.18Å; F122-A189 HydrophobicContact CD2-CB 4.3Å; F122-A189 HydrophobicContact CE2-CB 3.57Å; F122-A189 HydrophobicContact CZ-CB 4.24Å
123	V	91.1	Very high	85.5	Confident	73 Å²	73	53.2 Å²	53.2	44%	0.442	29%	0.288	S	S	.	.	H	α-helix	trans	-69	-50	-179.1	175.2	0	0	0	0	111.3	G119 V120 G125 G126 L127	G119-V123 WeakPolarHBondContact O-CG2 3.46Å; G119-V123 PolarHBondContact O-N 3.28Å; V120-V123 PolarHBondContact O-N 3.4Å; V123-G125 VanDerWaalsContact C-N 3.29Å; V123-G125 PolarHBondContact O-N 3.17Å; V123-G126 PolarHBondContact O-N 2.95Å; V123-L127 HydrophobicContact CG1-CD1 4Å; V123-L127 HydrophobicContact CG1-CG 4.39Å; V123-L127 WeakPolarHBondContact O-CB 3.38Å; V123-L127 WeakPolarHBondContact O-CG 3.35Å; V123-L127 PolarHBondContact O-N 3.35Å
124	C	90.4	Very high	86.9	Confident	6 Å²	6	48.5 Å²	48.5	4%	0.041	28%	0.275	C	S	.	.	H	α-helix	trans	-61.4	-39.3	177.5	-68.3	0	0	0	0	111.5	F100 L103 T104 V120 A128	F100-C124 HydrophobicContact CD2-CB 4.15Å; F100-C124 HydrophobicContact CE2-CB 4.01Å; L103-C124 HydrophobicContact CB-CB 4.14Å; T104-C124 HydrophobicContact CG2-CB 3.97Å; V120-C124 VanDerWaalsContact O-CB 3.24Å; V120-C124 WeakPolarHBondContact O-CB 3.15Å; V120-C124 PolarHBondContact O-N 2.94Å; V120-C124 PolarHBondContact O-SG 2.88Å; V120-C124 VanDerWaalsContact O-SG 3.35Å; C124-A128 WeakPolarHBondContact O-CB 3.43Å; C124-A128 PolarHBondContact O-N 3.36Å
125	G	91.7	Very high	88.2	Confident	18 Å²	18	46.7 Å²	46.7	19%	0.186	27%	0.273	C	S	.	.	H	α-helix	trans	-64.4	-44.8	175	0	0	0	0	0	112.6	H121 V123 A128 A129	H121-G125 WeakPolarHBondContact O-CA 3.38Å; H121-G125 PolarHBondContact O-N 3.13Å; V123-G125 VanDerWaalsContact C-N 3.29Å; V123-G125 PolarHBondContact O-N 3.17Å; G125-A128 PolarHBondContact O-N 3.06Å; G125-A129 WeakPolarHBondContact O-CB 3.24Å; G125-A129 PolarHBondContact O-N 3.45Å
126	G	93.3	Very high	89.8	Confident	5 Å²	5	45.8 Å²	45.8	5%	0.052	27%	0.267	C	S	.	.	H	α-helix	trans	-62.4	-48.2	176.1	0	0	0	0	0	112.6	F122 V123 A129 C130	F122-G126 PolarHBondContact O-N 3.36Å; V123-G126 PolarHBondContact O-N 2.95Å; G126-A129 PolarHBondContact O-N 2.87Å; G126-C130 PolarHBondContact O-N 3.39Å; G126-C130 PolarHBondContact O-SG 2.78Å; G126-C130 VanDerWaalsContact O-SG 3.33Å
127	L	94.7	Very high	91.2	Very high	78 Å²	78	36.4 Å²	36.4	41%	0.408	23%	0.231	S	C	.	.	H	α-helix	trans	-63.4	-42.2	176.7	-69.7	176.7	0	0	0	112.1	L103 V123 A129 C130 S131 F186	L103-L127 HydrophobicContact CD1-CB 3.62Å; L103-L127 HydrophobicContact CD1-CD1 4.45Å; V123-L127 HydrophobicContact CG1-CD1 4Å; V123-L127 HydrophobicContact CG1-CG 4.39Å; V123-L127 WeakPolarHBondContact O-CB 3.38Å; V123-L127 WeakPolarHBondContact O-CG 3.35Å; V123-L127 PolarHBondContact O-N 3.35Å; L127-A129 VanDerWaalsContact C-N 3.32Å; L127-A129 PolarHBondContact O-N 3.29Å; L127-C130 WeakPolarHBondContact O-CB 3.32Å; L127-C130 PolarHBondContact O-N 2.99Å; L127-S131 PolarHBondContact O-N 2.97Å; L127-S131 PolarHBondContact O-OG 2.97Å; L127-F186 HydrophobicContact CD2-CZ 4.38Å; L127-F186 HydrophobicContact CG-CZ 4.5Å
128	A	94.3	Very high	91.9	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-61.4	-40.8	174.7	0	0	0	0	0	112.1	Q96 T99 F100 L103 C124 G125 S131 A132	Q96-A128 HydrophobicContact CG-CB 4.29Å; T99-A128 HydrophobicContact CG2-CB 4.01Å; F100-A128 HydrophobicContact CB-CB 3.79Å; F100-A128 HydrophobicContact CD2-CB 4.49Å; L103-A128 HydrophobicContact CD1-CB 4.45Å; C124-A128 WeakPolarHBondContact O-CB 3.43Å; C124-A128 PolarHBondContact O-N 3.36Å; G125-A128 PolarHBondContact O-N 3.06Å; A128-S131 PolarHBondContact O-N 2.89Å; A128-A132 WeakPolarHBondContact O-CB 3.15Å; A128-A132 PolarHBondContact O-N 2.77Å
129	A	94.3	Very high	92.6	Very high	15 Å²	15	32.6 Å²	32.6	12%	0.124	21%	0.206	C	C	.	.	H	α-helix	trans	-66.3	-37.5	174.7	0	0	0	0	0	112.4	G125 G126 L127 T133 V185	G125-A129 WeakPolarHBondContact O-CB 3.24Å; G125-A129 PolarHBondContact O-N 3.45Å; G126-A129 PolarHBondContact O-N 2.87Å; L127-A129 VanDerWaalsContact C-N 3.32Å; L127-A129 PolarHBondContact O-N 3.29Å; A129-T133 VanDerWaalsContact O-CB 3.29Å; A129-T133 WeakPolarHBondContact O-CB 3.34Å; A129-T133 PolarHBondContact O-N 3.49Å; A129-T133 PolarHBondContact O-OG1 3.22Å; A129-V185 HydrophobicContact CB-CG1 3.88Å
130	C	95.8	Very high	93.1	Very high	22 Å²	22	31.1 Å²	31.1	15%	0.149	19%	0.188	C	C	.	.	H	α-helix	trans	-62.3	-47.9	172.3	-70.7	0	0	0	0	111.6	G126 L127 A132 T133 V134 L182	G126-C130 PolarHBondContact O-N 3.39Å; G126-C130 PolarHBondContact O-SG 2.78Å; G126-C130 VanDerWaalsContact O-SG 3.33Å; L127-C130 WeakPolarHBondContact O-CB 3.32Å; L127-C130 PolarHBondContact O-N 2.99Å; C130-A132 PolarHBondContact O-N 3.21Å; C130-T133 WeakPolarHBondContact O-CB 3.21Å; C130-T133 PolarHBondContact O-N 3.32Å; C130-T133 VanDerWaalsContact O-N 3.16Å; C130-V134 WeakPolarHBondContact O-CG2 3.31Å; C130-V134 PolarHBondContact O-N 3.45Å; C130-L182 HydrophobicContact CB-CD2 3.81Å
131	S	95.8	Very high	93.5	Very high	54 Å²	54	30.1 Å²	30.1	38%	0.378	18%	0.182	S	C	.	.	H	α-helix	trans	-60.9	-44.8	177	-62	0	0	0	0	112.1	L127 A128 T133 V134 A135	L127-S131 PolarHBondContact O-N 2.97Å; L127-S131 PolarHBondContact O-OG 2.97Å; A128-S131 PolarHBondContact O-N 2.89Å; S131-T133 VanDerWaalsContact C-N 3.3Å; S131-T133 PolarHBondContact O-N 3.47Å; S131-V134 PolarHBondContact O-N 2.92Å; S131-A135 PolarHBondContact O-N 3.36Å
132	A	95.4	Very high	93.8	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-61.8	-39.1	175	0	0	0	0	0	111.8	F92 V95 Q96 A128 C130 A135 C136	F92-A132 HydrophobicContact CD2-CB 3.74Å; F92-A132 HydrophobicContact CE2-CB 3.77Å; F92-A132 HydrophobicContact CG-CB 4.28Å; F92-A132 HydrophobicContact CZ-CB 4.33Å; V95-A132 HydrophobicContact CB-CB 4.15Å; V95-A132 HydrophobicContact CG1-CB 4.07Å; Q96-A132 HydrophobicContact CB-CB 3.86Å; A128-A132 WeakPolarHBondContact O-CB 3.15Å; A128-A132 PolarHBondContact O-N 2.77Å; C130-A132 PolarHBondContact O-N 3.21Å; A132-A135 PolarHBondContact O-N 3.01Å; A132-C136 WeakPolarHBondContact O-CB 3.35Å; A132-C136 PolarHBondContact O-N 3.42Å; A132-C136 PolarHBondContact O-SG 3.31Å
133	T	94.3	Very high	94	Very high	12 Å²	12	24.6 Å²	24.6	7%	0.074	16%	0.156	C	C	.	.	H	α-helix	trans	-62.3	-47	175.9	-62.4	0	0	0	0	111.2	A129 C130 S131 C136 Q137 L178 T181 L182	A129-T133 VanDerWaalsContact O-CB 3.29Å; A129-T133 WeakPolarHBondContact O-CB 3.34Å; A129-T133 PolarHBondContact O-N 3.49Å; A129-T133 PolarHBondContact O-OG1 3.22Å; C130-T133 WeakPolarHBondContact O-CB 3.21Å; C130-T133 PolarHBondContact O-N 3.32Å; C130-T133 VanDerWaalsContact O-N 3.16Å; S131-T133 VanDerWaalsContact C-N 3.3Å; S131-T133 PolarHBondContact O-N 3.47Å; T133-C136 PolarHBondContact O-N 3.08Å; T133-Q137 WeakPolarHBondContact O-CB 3.38Å; T133-Q137 PolarHBondContact O-N 3.21Å; T133-L178 HydrophobicContact CG2-CD1 3.85Å; T133-T181 HydrophobicContact CG2-CG2 3.44Å; T133-T181 VanDerWaalsContact CG2-CG2 3.44Å; T133-L182 HydrophobicContact CG2-CD2 4.27Å
134	V	96.1	Very high	94	Very high	59 Å²	59	21.1 Å²	21.1	36%	0.358	14%	0.135	S	C	.	.	H	α-helix	trans	-60.7	-49.2	178.2	173.6	0	0	0	0	110.5	C130 S131 C136 Q137 Y175 L178 L182	C130-V134 WeakPolarHBondContact O-CG2 3.31Å; C130-V134 PolarHBondContact O-N 3.45Å; S131-V134 PolarHBondContact O-N 2.92Å; V134-C136 VanDerWaalsContact C-N 3.29Å; V134-C136 PolarHBondContact O-N 2.92Å; V134-Q137 PolarHBondContact O-N 3.42Å; V134-Y175 HydrophobicContact CG1-CE1 4.49Å; V134-L178 HydrophobicContact CG2-CD1 4.1Å; V134-L178 HydrophobicContact CG2-CD2 4.28Å; V134-L182 HydrophobicContact CG2-CD2 4.36Å
135	A	95.4	Very high	94	Very high	52 Å²	52	20.9 Å²	20.9	43%	0.43	13%	0.133	S	C	.	.	H	α-helix	trans	-61.9	-37	-179.8	0	0	0	0	0	112.7	V95 S131 A132	V95-A135 HydrophobicContact CG1-CB 4.17Å; V95-A135 HydrophobicContact CG2-CB 4.22Å; S131-A135 PolarHBondContact O-N 3.36Å; A132-A135 PolarHBondContact O-N 3.01Å
136	C	94.6	Very high	94	Very high	3 Å²	3	21 Å²	21	2%	0.02	13%	0.128	C	C	.	.	H	α-helix	trans	-94.2	-6.5	-174.2	-64	0	0	0	0	114.7	L88 C91 F92 A132 T133 V134 P138 L139 D140	L88-C136 HydrophobicContact CD1-CB 3.53Å; C91-C136 VanDerWaalsContact C-SG 3.56Å; C91-C136 PolarHBondContact SG-SG 3.48Å; F92-C136 VanDerWaalsContact CA-SG 3.51Å; F92-C136 PolarHBondContact N-SG 3.14Å; A132-C136 WeakPolarHBondContact O-CB 3.35Å; A132-C136 PolarHBondContact O-N 3.42Å; A132-C136 PolarHBondContact O-SG 3.31Å; T133-C136 PolarHBondContact O-N 3.08Å; V134-C136 VanDerWaalsContact C-N 3.29Å; V134-C136 PolarHBondContact O-N 2.92Å; C136-P138 VanDerWaalsContact C-CD 3.41Å; C136-P138 VanDerWaalsContact C-N 3.33Å; C136-L139 PolarHBondContact O-N 3.35Å; C136-L139 VanDerWaalsContact O-N 3.07Å; C136-D140 PolarHBondContact O-N 2.94Å
137	Q	94.5	Very high	93.7	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.009	13%	0.127	C	C	.	.	H	α-helix	trans	-53.7	-41.6	-175.1	-172.2	66.5	11.9	0	0	113.3	T133 V134 L139 D140 T141 Y175 R176 L178	T133-Q137 WeakPolarHBondContact O-CB 3.38Å; T133-Q137 PolarHBondContact O-N 3.21Å; V134-Q137 PolarHBondContact O-N 3.42Å; Q137-L139 VanDerWaalsContact C-N 3.31Å; Q137-L139 PolarHBondContact O-N 3.07Å; Q137-D140 PolarHBondContact O-N 3.21Å; Q137-T141 PolarHBondContact O-N 3.02Å; Q137-T141 PolarHBondContact O-OG1 3.5Å; Q137-Y175 HydrophobicContact CB-CD1 4.01Å; Q137-Y175 HydrophobicContact CB-CE1 4.27Å; Q137-Y175 HydrophobicContact CG-CD1 4.1Å; Q137-R176 PolarHBondContact NE2-O 2.98Å; Q137-L178 HydrophobicContact CB-CD1 4.35Å; Q137-L178 HydrophobicContact CG-CB 4.23Å; Q137-L178 HydrophobicContact CG-CD1 4.23Å
138	P	94.5	Very high	93.3	Very high	30 Å²	30	17.2 Å²	17.2	20%	0.195	11%	0.108	C	C	.	.	H	α-helix	trans	-57.9	-40.8	177.5	-26.5	36.3	0	0	0	113.5	C136 T141 L142 F174 Y175	C136-P138 VanDerWaalsContact C-CD 3.41Å; C136-P138 VanDerWaalsContact C-N 3.33Å; P138-T141 PolarHBondContact O-N 3.35Å; P138-L142 WeakPolarHBondContact O-CB 3.38Å; P138-L142 WeakPolarHBondContact O-CD1 3.47Å; P138-L142 VanDerWaalsContact O-CG 3.27Å; P138-L142 WeakPolarHBondContact O-CG 3.33Å; P138-L142 PolarHBondContact O-N 2.94Å; P138-F174 HydrophobicContact CB-CB 4.01Å; P138-F174 HydrophobicContact CB-CD1 3.98Å; P138-F174 HydrophobicContact CB-CG 4.34Å; P138-F174 HydrophobicContact CG-CB 4.2Å; P138-Y175 HydrophobicContact CG-CE1 4.46Å; P138-Y175 HydrophobicContact CG-CE2 4.34Å
139	L	94.6	Very high	92.8	Very high	36 Å²	36	17.4 Å²	17.4	19%	0.188	11%	0.109	C	C	.	.	H	α-helix	trans	-69.3	-37.1	179.4	-66.4	172.9	0	0	0	111.8	L87 L88 C91 C136 Q137 R143	L87-L139 HydrophobicContact CB-CD1 3.97Å; L87-L139 HydrophobicContact CB-CD2 4.19Å; L87-L139 HydrophobicContact CD1-CD2 4.34Å; L88-L139 HydrophobicContact CB-CB 4.14Å; L88-L139 HydrophobicContact CD1-CB 4.42Å; C91-L139 HydrophobicContact CB-CD1 4.25Å; C136-L139 PolarHBondContact O-N 3.35Å; C136-L139 VanDerWaalsContact O-N 3.07Å; Q137-L139 VanDerWaalsContact C-N 3.31Å; Q137-L139 PolarHBondContact O-N 3.07Å; L139-R143 VanDerWaalsContact O-CB 3.28Å; L139-R143 WeakPolarHBondContact O-CB 3.41Å; L139-R143 PolarHBondContact O-N 2.85Å
140	D	93.6	Very high	92	Very high	11 Å²	11	16.9 Å²	16.9	6%	0.059	11%	0.105	C	C	.	.	H	α-helix	trans	-71.4	-36.6	177.3	-173	46.3	0	0	0	112.6	L88 C136 Q137 T144 K240 K241 Q244	L88-D140 HydrophobicContact CD1-CB 4.18Å; L88-D140 HydrophobicContact CD2-CB 3.94Å; C136-D140 PolarHBondContact O-N 2.94Å; Q137-D140 PolarHBondContact O-N 3.21Å; D140-T144 WeakPolarHBondContact O-CB 3.35Å; D140-T144 PolarHBondContact O-N 3.24Å; D140-T144 PolarHBondContact O-OG1 3.37Å; D140-K240 WeakPolarHBondContact OD2-CE 3.23Å; D140-K240 IonicContact OD2-NZ 2.85Å; D140-K240 PolarHBondContact OD2-NZ 3.33Å; D140-K241 IonicContact OD1-NZ 2.64Å; D140-K241 PolarHBondContact OD1-NZ 3.37Å; D140-K241 IonicContact OD2-NZ 3.18Å; D140-K241 PolarHBondContact OD2-NZ 2.84Å; D140-Q244 PolarHBondContact OD2-NE2 2.92Å
141	T	93.1	Very high	91	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-63.5	-47.5	172.2	-59.2	0	0	0	0	110.8	Q137 P138 R143 T144 R145 M165 F174 Q244	Q137-T141 PolarHBondContact O-N 3.02Å; Q137-T141 PolarHBondContact O-OG1 3.5Å; P138-T141 PolarHBondContact O-N 3.35Å; T141-R143 PolarHBondContact O-N 3.24Å; T141-T144 PolarHBondContact O-N 2.89Å; T141-R145 WeakPolarHBondContact O-CG 3.17Å; T141-R145 PolarHBondContact O-N 3.39Å; T141-M165 HydrophobicContact CG2-CE 4.14Å; T141-F174 WeakPolarHBondContact CB-O 3.41Å; T141-F174 PolarHBondContact OG1-O 3.48Å; T141-Q244 HydrophobicContact CG2-CB 4.41Å; T141-Q244 HydrophobicContact CG2-CG 4.45Å
142	L	93.1	Very high	90.2	Very high	6 Å²	6	21.1 Å²	21.1	3%	0.031	13%	0.125	C	C	.	.	H	α-helix	trans	-57.7	-51.9	176	-75.2	162.5	0	0	0	111.1	P84 P138 T144 R145 F146 L158 A161 V162 M165 F174	P84-L142 HydrophobicContact CB-CB 4.35Å; P138-L142 WeakPolarHBondContact O-CB 3.38Å; P138-L142 WeakPolarHBondContact O-CD1 3.47Å; P138-L142 VanDerWaalsContact O-CG 3.27Å; P138-L142 WeakPolarHBondContact O-CG 3.33Å; P138-L142 PolarHBondContact O-N 2.94Å; L142-T144 PolarHBondContact O-N 2.94Å; L142-R145 PolarHBondContact O-N 2.7Å; L142-F146 VanDerWaalsContact O-CD2 3.28Å; L142-F146 WeakPolarHBondContact O-CD2 3.31Å; L142-F146 PolarHBondContact O-N 2.75Å; L142-L158 HydrophobicContact CB-CD1 4.32Å; L142-L158 HydrophobicContact CD1-CD1 4.01Å; L142-L158 HydrophobicContact CD2-CD1 4.3Å; L142-L158 HydrophobicContact CG-CD1 4.45Å; L142-A161 HydrophobicContact CD2-CB 4.13Å; L142-V162 HydrophobicContact CD1-CG2 3.68Å; L142-V162 HydrophobicContact CD2-CG2 3.96Å; L142-V162 HydrophobicContact CG-CG2 4.48Å; L142-M165 HydrophobicContact CD2-SD 3.61Å; L142-F174 HydrophobicContact CD1-CE1 4.27Å; L142-F174 HydrophobicContact CD2-CE1 4.22Å; L142-F174 HydrophobicContact CG-CD1 4.49Å; L142-F174 HydrophobicContact CG-CE1 4.25Å
143	R	92.6	Very high	89.4	Confident	35 Å²	35	26.4 Å²	26.4	13%	0.132	15%	0.148	C	C	.	.	H	α-helix	trans	-50.4	-47.1	176.2	175.4	-168.4	178.2	174.7	6.7	111.9	D37 P84 A85 L139 T141 F146 A147	D37-R143 IonicContact OD1-NH2 3.45Å; D37-R143 PolarHBondContact OD1-NH2 2.88Å; D37-R143 IonicContact OD2-CZ 3.47Å; D37-R143 IonicContact OD2-NH2 3.5Å; D37-R143 PolarHBondContact OD2-NH2 2.9Å; P84-R143 HydrophobicContact CB-CB 4.19Å; P84-R143 HydrophobicContact CG-CB 4.16Å; A85-R143 HydrophobicContact CB-CG 4.05Å; L139-R143 VanDerWaalsContact O-CB 3.28Å; L139-R143 WeakPolarHBondContact O-CB 3.41Å; L139-R143 PolarHBondContact O-N 2.85Å; T141-R143 PolarHBondContact O-N 3.24Å; R143-F146 PolarHBondContact O-N 2.89Å; R143-A147 WeakPolarHBondContact O-CB 3.43Å; R143-A147 PolarHBondContact O-N 2.9Å
144	T	91.9	Very high	88.8	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-65.9	-44	-176.8	-56.1	0	0	0	0	111.3	I41 D140 T141 L142 A147 A148 K241 Q244 V245	I41-T144 HydrophobicContact CG2-CG2 4.13Å; D140-T144 WeakPolarHBondContact O-CB 3.35Å; D140-T144 PolarHBondContact O-N 3.24Å; D140-T144 PolarHBondContact O-OG1 3.37Å; T141-T144 PolarHBondContact O-N 2.89Å; L142-T144 PolarHBondContact O-N 2.94Å; T144-A147 PolarHBondContact O-N 3.48Å; T144-A148 WeakPolarHBondContact O-CB 3.41Å; T144-A148 PolarHBondContact O-N 3.5Å; T144-K241 HydrophobicContact CG2-CB 4.44Å; T144-K241 HydrophobicContact CG2-CD 3.57Å; T144-K241 PolarHBondContact OG1-NZ 3Å; T144-Q244 HydrophobicContact CG2-CB 4.08Å; T144-Q244 PolarHBondContact OG1-OE1 2.83Å; T144-V245 HydrophobicContact CG2-CG2 3.83Å
145	R	90.6	Very high	88.2	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-66	-39.3	176.9	-69	179.7	173.8	-151.9	-3	112.6	T141 L142 A148 Q149 Y155 M165 E169 Q244 A246 F248	T141-R145 WeakPolarHBondContact O-CG 3.17Å; T141-R145 PolarHBondContact O-N 3.39Å; L142-R145 PolarHBondContact O-N 2.7Å; R145-A148 PolarHBondContact O-N 2.88Å; R145-Q149 PolarHBondContact O-N 3.01Å; R145-Y155 HydrophobicContact CB-CE2 4.12Å; R145-M165 PolarHBondContact NH1-SD 3.24Å; R145-E169 IonicContact CZ-OE1 3.67Å; R145-E169 IonicContact CZ-OE2 2.93Å; R145-E169 IonicContact NH1-OE1 3.74Å; R145-E169 PolarHBondContact NH1-OE1 3.32Å; R145-E169 IonicContact NH1-OE2 2.62Å; R145-E169 PolarHBondContact NH1-OE2 2.95Å; R145-E169 IonicContact NH2-OE1 2.75Å; R145-E169 PolarHBondContact NH2-OE1 3.01Å; R145-E169 IonicContact NH2-OE2 2.7Å; R145-E169 PolarHBondContact NH2-OE2 2.87Å; R145-Q244 PolarHBondContact NE-O 3.15Å; R145-A246 PolarHBondContact NH2-O 2.91Å; R145-F248 HydrophobicContact CB-CD1 4.22Å; R145-F248 HydrophobicContact CB-CE1 4.37Å; R145-F248 HydrophobicContact CG-CB 4.46Å; R145-F248 HydrophobicContact CG-CD1 4.35Å; R145-F248 HydrophobicContact CG-CG 4.41Å
146	F	90.6	Very high	87.5	Confident	20 Å²	20	27.9 Å²	27.9	9%	0.088	15%	0.154	C	C	.	.	H	α-helix	trans	-62	-42.6	173.7	-91.2	-82.5	0	0	0	112.1	K80 P84 L142 R143 A148 Q149 L158 A161	K80-F146 WeakPolarHBondContact CB-O 3.28Å; P84-F146 HydrophobicContact CG-CD2 4.43Å; L142-F146 VanDerWaalsContact O-CD2 3.28Å; L142-F146 WeakPolarHBondContact O-CD2 3.31Å; L142-F146 PolarHBondContact O-N 2.75Å; R143-F146 PolarHBondContact O-N 2.89Å; F146-A148 VanDerWaalsContact C-N 3.32Å; F146-Q149 WeakPolarHBondContact O-CG 3.28Å; F146-L158 HydrophobicContact CE2-CD1 3.82Å; F146-A161 HydrophobicContact CE2-CB 3.48Å; F146-A161 VanDerWaalsContact CE2-CB 3.48Å; F146-A161 HydrophobicContact CZ-CB 3.59Å
147	A	88.9	Confident	87.2	Confident	2 Å²	2	31.6 Å²	31.6	2%	0.017	17%	0.174	C	C	.	.	H	α-helix	trans	-70.8	-29.1	176.7	0	0	0	0	0	113	V38 I41 R42 R143 T144	V38-A147 HydrophobicContact CG2-CB 4.29Å; I41-A147 HydrophobicContact CB-CB 4.15Å; I41-A147 HydrophobicContact CD1-CB 3.55Å; I41-A147 HydrophobicContact CG1-CB 4.45Å; I41-A147 HydrophobicContact CG2-CB 3.96Å; R42-A147 PolarHBondContact NE-O 3.43Å; R42-A147 VanDerWaalsContact NE-O 3.16Å; R143-A147 WeakPolarHBondContact O-CB 3.43Å; R143-A147 PolarHBondContact O-N 2.9Å; T144-A147 PolarHBondContact O-N 3.48Å
148	A	86.1	Confident	86.9	Confident	2 Å²	2	33.6 Å²	33.6	2%	0.017	18%	0.184	C	C	.	.	H	α-helix	trans	-77.1	-26.9	178.7	0	0	0	0	0	114	L45 T144 R145 F146 V245 F255	L45-A148 HydrophobicContact CD1-CB 3.33Å; T144-A148 WeakPolarHBondContact O-CB 3.41Å; T144-A148 PolarHBondContact O-N 3.5Å; R145-A148 PolarHBondContact O-N 2.88Å; F146-A148 VanDerWaalsContact C-N 3.32Å; A148-V245 HydrophobicContact CB-CG1 4.44Å; A148-V245 HydrophobicContact CB-CG2 4Å; A148-F255 WeakPolarHBondContact O-CE2 3.14Å
149	Q	83.8	Confident	86.8	Confident	5 Å²	5	42.8 Å²	42.8	2%	0.023	22%	0.215	C	C	.	.			trans	-69.3	141.1	-175.5	85.4	-174.3	-47.3	0	0	111.7	R42 K80 R145 F146 Y155 F248	R42-Q149 PolarHBondContact NH2-O 3.27Å; K80-Q149 HydrophobicContact CD-CG 4.27Å; R145-Q149 PolarHBondContact O-N 3.01Å; F146-Q149 WeakPolarHBondContact O-CG 3.28Å; Q149-Y155 PolarHBondContact OE1-O 3Å; Q149-F248 HydrophobicContact CB-CE1 3.76Å; Q149-F248 HydrophobicContact CB-CZ 3.99Å
150	G	76.9	Confident	86.6	Confident	3 Å²	3	46.8 Å²	46.8	3%	0.031	23%	0.229	C	C	.	.			trans	-102.3	-156.9	175.9	0	0	0	0	0	111.5	P152 F255	G150-P152 CarbonylContact O-C 3.52Å; G150-F255 VanDerWaalsContact CA-CZ 3.45Å
151	E	75.3	Confident	86.4	Confident	69 Å²	69	46.2 Å²	46.2	32%	0.322	23%	0.226	S	C	.	.	S	Bend	trans	-101.4	138.8	166.2	-65.9	-58	142.6	0	0	109.7	E73 K80 K153 H254	E73-E151 HydrophobicContact CB-CG 4.1Å; E73-E151 HydrophobicContact CG-CG 3.88Å; K80-E151 IonicContact NZ-OE1 2.68Å; K80-E151 PolarHBondContact NZ-OE1 3.34Å; E151-K153 WeakPolarHBondContact OE1-CE 3.44Å; E151-K153 WeakPolarHBondContact OE1-CG 3.36Å; E151-K153 WeakPolarHBondContact OE2-CG 3.25Å; E151-K153 PolarHBondContact OE2-N 2.94Å; E151-H254 PolarHBondContact O-CD2 3.4Å
152	P	78.1	Confident	86.4	Confident	97 Å²	97	48.9 Å²	48.9	63%	0.63	24%	0.242	S	C	*	.	S	Bend	cis	-72.2	146.2	-0.7	29.9	-34.6	0	0	0	113.4	G150 V154	G150-P152 CarbonylContact O-C 3.52Å; P152-V154 PolarHBondContact O-N 2.93Å
153	K	79.3	Confident	86.4	Confident	111 Å²	111	50.9 Å²	50.9	48%	0.483	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-61.4	117.1	178.2	-61.4	178.7	-170.7	172	0	111.6	E151	E151-K153 WeakPolarHBondContact OE1-CE 3.44Å; E151-K153 WeakPolarHBondContact OE1-CG 3.36Å; E151-K153 WeakPolarHBondContact OE2-CG 3.25Å; E151-K153 PolarHBondContact OE2-N 2.94Å
154	V	80.9	Confident	86.3	Confident	62 Å²	62	50.9 Å²	50.9	38%	0.376	26%	0.26	S	S	.	.	S	Bend	trans	-79.7	-33.5	172.7	-179.7	0	0	0	0	111.3	P152 F248 A251	P152-V154 PolarHBondContact O-N 2.93Å; V154-F248 HydrophobicContact CB-CE2 4.08Å; V154-F248 HydrophobicContact CB-CZ 4.02Å; V154-F248 HydrophobicContact CG1-CE2 3.83Å; V154-F248 HydrophobicContact CG1-CZ 4.28Å; V154-A251 HydrophobicContact CB-CB 4.1Å; V154-A251 HydrophobicContact CG2-CB 3.5Å; V154-A251 VanDerWaalsContact CG2-CB 3.5Å
155	Y	83.4	Confident	86.2	Confident	7 Å²	7	50.9 Å²	50.9	3%	0.027	26%	0.26	C	S	.	.			trans	-112.2	107.9	177.2	-60.9	-37.8	0	0	0	111.2	R145 Q149 A161 T164 M165 F248	R145-Y155 HydrophobicContact CB-CE2 4.12Å; Q149-Y155 PolarHBondContact OE1-O 3Å; Y155-A161 HydrophobicContact CD1-CB 3.81Å; Y155-A161 HydrophobicContact CD2-CB 3.95Å; Y155-A161 HydrophobicContact CE1-CB 4.27Å; Y155-A161 HydrophobicContact CE2-CB 4.38Å; Y155-A161 HydrophobicContact CG-CB 3.63Å; Y155-T164 HydrophobicContact CE1-CG2 4.16Å; Y155-M165 VanDerWaalsContact OH-CG 3.31Å; Y155-M165 WeakPolarHBondContact OH-CG 3.16Å; Y155-F248 HydrophobicContact CD1-CE2 4.49Å; Y155-F248 AromaticContact CD2-CE2 3.84Å; Y155-F248 HydrophobicContact CD2-CE2 3.84Å; Y155-F248 AromaticContact CD2-CZ 3.63Å; Y155-F248 HydrophobicContact CD2-CZ 3.63Å; Y155-F248 AromaticContact CE1-CE2 3.88Å; Y155-F248 HydrophobicContact CE1-CE2 3.88Å; Y155-F248 AromaticContact CE2-CD2 3.78Å; Y155-F248 HydrophobicContact CE2-CD2 3.78Å; Y155-F248 HydrophobicContact CE2-CE1 4.13Å; Y155-F248 AromaticContact CE2-CE2 3.12Å; Y155-F248 HydrophobicContact CE2-CE2 3.12Å; Y155-F248 AromaticContact CE2-CZ 3.3Å; Y155-F248 HydrophobicContact CE2-CZ 3.3Å; Y155-F248 HydrophobicContact CG-CE2 4.48Å; Y155-F248 HydrophobicContact CG-CZ 4.41Å; Y155-F248 AromaticContact CZ-CD2 3.66Å; Y155-F248 AromaticContact CZ-CE2 3.14Å; Y155-F248 AromaticContact CZ-CZ 3.85Å; Y155-F248 WeakPolarHBondContact OH-CD2 3.39Å; Y155-F248 VanDerWaalsContact OH-CE2 3.24Å; Y155-F248 WeakPolarHBondContact OH-CE2 3.47Å
156	S	81.7	Confident	86.3	Confident	85 Å²	85	58.1 Å²	58.1	59%	0.594	29%	0.288	S	S	*	.	S	Bend	trans	-73.6	-39.8	177.8	56.1	0	0	0	0	112.8
157	N	87.3	Confident	86.3	Confident	80 Å²	80	67.1 Å²	67.1	43%	0.428	32%	0.321	S	S	.	.	S	Bend	trans	-149.2	164.2	-179.1	60.5	63.1	0	0	0	111.6	R159 Y160 A161	N157-R159 VanDerWaalsContact C-N 3.32Å; N157-R159 PolarHBondContact O-N 3.48Å; N157-R159 PolarHBondContact OD1-N 3Å; N157-Y160 PolarHBondContact O-N 3.16Å; N157-Y160 WeakPolarHBondContact OD1-CB 3.41Å; N157-Y160 PolarHBondContact OD1-N 2.93Å; N157-A161 PolarHBondContact O-N 2.7Å
158	L	89.3	Confident	86.2	Confident	44 Å²	44	70.9 Å²	70.9	23%	0.23	35%	0.347	C	S	.	.	H	α-helix	trans	-60.8	-40	-175.5	-174.4	61.8	0	0	0	112.3	I83 P84 L87 L142 F146 A161 V162	I83-L158 HydrophobicContact CG2-CD2 4.32Å; P84-L158 HydrophobicContact CB-CD1 4.29Å; P84-L158 HydrophobicContact CG-CD1 4.41Å; L87-L158 HydrophobicContact CD1-CD2 4.16Å; L142-L158 HydrophobicContact CB-CD1 4.32Å; L142-L158 HydrophobicContact CD1-CD1 4.01Å; L142-L158 HydrophobicContact CD2-CD1 4.3Å; L142-L158 HydrophobicContact CG-CD1 4.45Å; F146-L158 HydrophobicContact CE2-CD1 3.82Å; L158-A161 PolarHBondContact O-N 3.1Å; L158-V162 VanDerWaalsContact O-CG2 3.31Å; L158-V162 WeakPolarHBondContact O-CG2 3.48Å; L158-V162 PolarHBondContact O-N 3.4Å
159	R	91.7	Very high	86.2	Confident	223 Å²	223	72.8 Å²	72.8	84%	0.842	36%	0.356	S	S	*	.	H	α-helix	trans	-65.1	-43.7	179.6	-64.9	-178.6	180	175.2	-0.6	111.4	N157 V162 S163	N157-R159 VanDerWaalsContact C-N 3.32Å; N157-R159 PolarHBondContact O-N 3.48Å; N157-R159 PolarHBondContact OD1-N 3Å; R159-V162 PolarHBondContact O-N 3.32Å; R159-S163 WeakPolarHBondContact O-CB 3.15Å; R159-S163 PolarHBondContact O-N 2.62Å
160	Y	91.1	Very high	86.4	Confident	120 Å²	120	73.4 Å²	73.4	47%	0.471	36%	0.363	S	S	.	.	H	α-helix	trans	-65.6	-39.5	176.5	-174.2	-97.6	0	0	0	111.6	N157 S163 T164	N157-Y160 PolarHBondContact O-N 3.16Å; N157-Y160 WeakPolarHBondContact OD1-CB 3.41Å; N157-Y160 PolarHBondContact OD1-N 2.93Å; Y160-S163 PolarHBondContact O-N 3.43Å; Y160-T164 WeakPolarHBondContact CE1-OG1 3.48Å; Y160-T164 WeakPolarHBondContact O-CB 3.24Å; Y160-T164 PolarHBondContact O-N 3.49Å; Y160-T164 PolarHBondContact O-OG1 2.75Å
161	A	89.4	Confident	87	Confident	0 Å²	0	76.3 Å²	76.3	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-60.5	-48.4	173.7	0	0	0	0	0	111.5	L142 F146 Y155 N157 L158 T164 M165	L142-A161 HydrophobicContact CD2-CB 4.13Å; F146-A161 HydrophobicContact CE2-CB 3.48Å; F146-A161 VanDerWaalsContact CE2-CB 3.48Å; F146-A161 HydrophobicContact CZ-CB 3.59Å; Y155-A161 HydrophobicContact CD1-CB 3.81Å; Y155-A161 HydrophobicContact CD2-CB 3.95Å; Y155-A161 HydrophobicContact CE1-CB 4.27Å; Y155-A161 HydrophobicContact CE2-CB 4.38Å; Y155-A161 HydrophobicContact CG-CB 3.63Å; N157-A161 PolarHBondContact O-N 2.7Å; L158-A161 PolarHBondContact O-N 3.1Å; A161-T164 PolarHBondContact O-N 3Å; A161-M165 VanDerWaalsContact O-CB 3.3Å; A161-M165 WeakPolarHBondContact O-CB 3.36Å; A161-M165 WeakPolarHBondContact O-CG 3.27Å; A161-M165 PolarHBondContact O-N 2.85Å
162	V	92.9	Very high	87.7	Confident	56 Å²	56	78.1 Å²	78.1	34%	0.339	40%	0.397	S	S	.	.	H	α-helix	trans	-60.8	-49.4	177.5	172.2	0	0	0	0	111.1	L142 L158 R159 T164 M165 W166 F174	L142-V162 HydrophobicContact CD1-CG2 3.68Å; L142-V162 HydrophobicContact CD2-CG2 3.96Å; L142-V162 HydrophobicContact CG-CG2 4.48Å; L158-V162 VanDerWaalsContact O-CG2 3.31Å; L158-V162 WeakPolarHBondContact O-CG2 3.48Å; L158-V162 PolarHBondContact O-N 3.4Å; R159-V162 PolarHBondContact O-N 3.32Å; V162-T164 PolarHBondContact O-N 3.05Å; V162-M165 PolarHBondContact O-N 3.28Å; V162-W166 VanDerWaalsContact O-CB 3.27Å; V162-W166 WeakPolarHBondContact O-CB 3.37Å; V162-W166 PolarHBondContact O-N 2.65Å; V162-F174 HydrophobicContact CG1-CZ 4.2Å; V162-F174 HydrophobicContact CG2-CE1 4.44Å
163	S	92.5	Very high	88.2	Confident	47 Å²	47	73.5 Å²	73.5	33%	0.329	37%	0.367	S	S	.	.	H	α-helix	trans	-62.2	-43.4	179.7	-179.7	0	0	0	0	112.1	R159 Y160 R167	R159-S163 WeakPolarHBondContact O-CB 3.15Å; R159-S163 PolarHBondContact O-N 2.62Å; Y160-S163 PolarHBondContact O-N 3.43Å; S163-R167 WeakPolarHBondContact O-CB 3.28Å; S163-R167 WeakPolarHBondContact O-CG 3.43Å; S163-R167 PolarHBondContact O-N 3.28Å
164	T	89.9	Confident	88.8	Confident	36 Å²	36	68.9 Å²	68.9	22%	0.221	35%	0.347	C	S	.	.	H	α-helix	trans	-64.4	-51.3	178.8	-59.6	0	0	0	0	110.1	Y155 Y160 A161 V162 W166 R167 S168	Y155-T164 HydrophobicContact CE1-CG2 4.16Å; Y160-T164 WeakPolarHBondContact CE1-OG1 3.48Å; Y160-T164 WeakPolarHBondContact O-CB 3.24Å; Y160-T164 PolarHBondContact O-N 3.49Å; Y160-T164 PolarHBondContact O-OG1 2.75Å; A161-T164 PolarHBondContact O-N 3Å; V162-T164 PolarHBondContact O-N 3.05Å; T164-W166 VanDerWaalsContact C-N 3.31Å; T164-W166 PolarHBondContact O-N 3.12Å; T164-R167 PolarHBondContact O-N 3.04Å; T164-S168 WeakPolarHBondContact O-CB 3.47Å; T164-S168 PolarHBondContact O-N 2.96Å; T164-S168 PolarHBondContact O-OG 3.32Å
165	M	90.7	Very high	89.4	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-57.6	-43.7	178.2	-74.3	-179.9	54.4	0	0	112.4	T141 L142 R145 Y155 A161 V162 R167 E169 G170 A173 F174	T141-M165 HydrophobicContact CG2-CE 4.14Å; L142-M165 HydrophobicContact CD2-SD 3.61Å; R145-M165 PolarHBondContact NH1-SD 3.24Å; Y155-M165 VanDerWaalsContact OH-CG 3.31Å; Y155-M165 WeakPolarHBondContact OH-CG 3.16Å; A161-M165 VanDerWaalsContact O-CB 3.3Å; A161-M165 WeakPolarHBondContact O-CB 3.36Å; A161-M165 WeakPolarHBondContact O-CG 3.27Å; A161-M165 PolarHBondContact O-N 2.85Å; V162-M165 PolarHBondContact O-N 3.28Å; M165-R167 PolarHBondContact O-N 3.43Å; M165-E169 PolarHBondContact O-N 3.12Å; M165-G170 PolarHBondContact O-N 3.06Å; M165-A173 HydrophobicContact CE-CB 4.49Å; M165-F174 HydrophobicContact CB-CE1 4.32Å; M165-F174 HydrophobicContact CB-CE2 4.12Å; M165-F174 HydrophobicContact CB-CZ 3.69Å; M165-F174 HydrophobicContact CE-CD1 3.82Å; M165-F174 HydrophobicContact CE-CE1 3.72Å; M165-F174 HydrophobicContact CE-CE2 4.49Å; M165-F174 HydrophobicContact CE-CG 4.27Å; M165-F174 HydrophobicContact CE-CZ 4.08Å; M165-F174 HydrophobicContact SD-CE1 4.26Å
166	W	91.8	Very high	89.7	Confident	152 Å²	152	74.6 Å²	74.6	58%	0.576	36%	0.363	S	S	*	.	H	α-helix	trans	-61.8	-43.4	178.3	-173.5	-85.3	0	0	0	112.2	V162 T164 G170 P171 F174	V162-W166 VanDerWaalsContact O-CB 3.27Å; V162-W166 WeakPolarHBondContact O-CB 3.37Å; V162-W166 PolarHBondContact O-N 2.65Å; T164-W166 VanDerWaalsContact C-N 3.31Å; T164-W166 PolarHBondContact O-N 3.12Å; W166-G170 VanDerWaalsContact O-CA 3.31Å; W166-G170 WeakPolarHBondContact O-CA 3.36Å; W166-G170 PolarHBondContact O-N 2.95Å; W166-P171 HydrophobicContact CE3-CB 4.26Å; W166-P171 HydrophobicContact CH2-CB 3.85Å; W166-P171 HydrophobicContact CH2-CG 4.45Å; W166-P171 HydrophobicContact CZ3-CB 3.66Å; W166-F174 HydrophobicContact CB-CE2 4.41Å; W166-F174 AromaticContact CE3-CE2 3.97Å; W166-F174 HydrophobicContact CE3-CE2 3.97Å
167	R	90.6	Very high	90	Very high	209 Å²	209	70.8 Å²	70.8	79%	0.789	34%	0.336	S	S	*	.	H	α-helix	trans	-76.9	-37.2	-178.5	-70.5	178.7	-178.7	-177	-1	113.5	S163 T164 M165	S163-R167 WeakPolarHBondContact O-CB 3.28Å; S163-R167 WeakPolarHBondContact O-CG 3.43Å; S163-R167 PolarHBondContact O-N 3.28Å; T164-R167 PolarHBondContact O-N 3.04Å; M165-R167 PolarHBondContact O-N 3.43Å
168	S	86.8	Confident	90.2	Very high	80 Å²	80	68.5 Å²	68.5	56%	0.559	32%	0.324	S	S	*	.	H	α-helix	trans	-90	-35.5	-173.1	65.1	0	0	0	0	113.9	T164	T164-S168 WeakPolarHBondContact O-CB 3.47Å; T164-S168 PolarHBondContact O-N 2.96Å; T164-S168 PolarHBondContact O-OG 3.32Å
169	E	86.1	Confident	90.4	Very high	43 Å²	43	69.2 Å²	69.2	20%	0.201	33%	0.333	C	S	.	.	H	α-helix	trans	-121.1	-11.9	-173.3	-61.6	176.2	-119.2	0	0	113.5	R145 M165 A173 R176	R145-E169 IonicContact CZ-OE1 3.67Å; R145-E169 IonicContact CZ-OE2 2.93Å; R145-E169 IonicContact NH1-OE1 3.74Å; R145-E169 PolarHBondContact NH1-OE1 3.32Å; R145-E169 IonicContact NH1-OE2 2.62Å; R145-E169 PolarHBondContact NH1-OE2 2.95Å; R145-E169 IonicContact NH2-OE1 2.75Å; R145-E169 PolarHBondContact NH2-OE1 3.01Å; R145-E169 IonicContact NH2-OE2 2.7Å; R145-E169 PolarHBondContact NH2-OE2 2.87Å; M165-E169 PolarHBondContact O-N 3.12Å; E169-A173 HydrophobicContact CB-CB 3.6Å; E169-R176 IonicContact OE2-CZ 3.6Å; E169-R176 IonicContact OE2-NH1 2.86Å; E169-R176 PolarHBondContact OE2-NH1 3.28Å
170	G	89.6	Confident	90.4	Very high	18 Å²	18	58.6 Å²	58.6	19%	0.186	29%	0.293	C	S	.	.			trans	79.4	177.9	-179.2	0	0	0	0	0	114.7	M165 W166 V172 A173	M165-G170 PolarHBondContact O-N 3.06Å; W166-G170 VanDerWaalsContact O-CA 3.31Å; W166-G170 WeakPolarHBondContact O-CA 3.36Å; W166-G170 PolarHBondContact O-N 2.95Å; G170-V172 VanDerWaalsContact C-N 3.28Å; G170-V172 PolarHBondContact O-N 3.32Å; G170-A173 WeakPolarHBondContact O-CB 3.28Å; G170-A173 PolarHBondContact O-N 2.91Å
171	P	89.8	Confident	90.4	Very high	64 Å²	64	53.9 Å²	53.9	42%	0.416	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-65	-28.3	-175.8	23.4	-33.4	0	0	0	113.8	W166 A173 F174	W166-P171 HydrophobicContact CE3-CB 4.26Å; W166-P171 HydrophobicContact CH2-CB 3.85Å; W166-P171 HydrophobicContact CH2-CG 4.45Å; W166-P171 HydrophobicContact CZ3-CB 3.66Å; P171-A173 PolarHBondContact O-N 2.95Å; P171-F174 PolarHBondContact O-N 3.43Å
172	V	89.7	Confident	90.7	Very high	107 Å²	107	56.4 Å²	56.4	65%	0.648	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-63.7	-27.8	-178.9	-178.1	0	0	0	0	111.5	G170 F174 Y175 R176	G170-V172 VanDerWaalsContact C-N 3.28Å; G170-V172 PolarHBondContact O-N 3.32Å; V172-F174 PolarHBondContact O-N 2.85Å; V172-Y175 PolarHBondContact O-N 3.27Å; V172-Y175 VanDerWaalsContact O-N 3.09Å; V172-R176 PolarHBondContact O-N 3.42Å
173	A	88.3	Confident	90.7	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-58.5	-35	179	0	0	0	0	0	112.9	M165 E169 G170 P171 Y175 R176	M165-A173 HydrophobicContact CE-CB 4.49Å; E169-A173 HydrophobicContact CB-CB 3.6Å; G170-A173 WeakPolarHBondContact O-CB 3.28Å; G170-A173 PolarHBondContact O-N 2.91Å; P171-A173 PolarHBondContact O-N 2.95Å; A173-Y175 PolarHBondContact O-N 2.93Å; A173-R176 PolarHBondContact O-N 2.99Å
174	F	91.7	Very high	90.8	Very high	14 Å²	14	55.6 Å²	55.6	6%	0.061	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-67.8	-25.6	179.9	-67.2	-85.9	0	0	0	113.1	P138 T141 L142 V162 M165 W166 P171 V172	P138-F174 HydrophobicContact CB-CB 4.01Å; P138-F174 HydrophobicContact CB-CD1 3.98Å; P138-F174 HydrophobicContact CB-CG 4.34Å; P138-F174 HydrophobicContact CG-CB 4.2Å; T141-F174 WeakPolarHBondContact CB-O 3.41Å; T141-F174 PolarHBondContact OG1-O 3.48Å; L142-F174 HydrophobicContact CD1-CE1 4.27Å; L142-F174 HydrophobicContact CD2-CE1 4.22Å; L142-F174 HydrophobicContact CG-CD1 4.49Å; L142-F174 HydrophobicContact CG-CE1 4.25Å; V162-F174 HydrophobicContact CG1-CZ 4.2Å; V162-F174 HydrophobicContact CG2-CE1 4.44Å; M165-F174 HydrophobicContact CB-CE1 4.32Å; M165-F174 HydrophobicContact CB-CE2 4.12Å; M165-F174 HydrophobicContact CB-CZ 3.69Å; M165-F174 HydrophobicContact CE-CD1 3.82Å; M165-F174 HydrophobicContact CE-CE1 3.72Å; M165-F174 HydrophobicContact CE-CE2 4.49Å; M165-F174 HydrophobicContact CE-CG 4.27Å; M165-F174 HydrophobicContact CE-CZ 4.08Å; M165-F174 HydrophobicContact SD-CE1 4.26Å; W166-F174 HydrophobicContact CB-CE2 4.41Å; W166-F174 AromaticContact CE3-CE2 3.97Å; W166-F174 HydrophobicContact CE3-CE2 3.97Å; P171-F174 PolarHBondContact O-N 3.43Å; V172-F174 PolarHBondContact O-N 2.85Å
175	Y	92.9	Very high	90.9	Very high	103 Å²	103	55 Å²	55	40%	0.404	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-99.6	3.2	-177.4	-69.2	-86.1	0	0	0	113.7	V134 Q137 P138 V172 A173 G177 L178	V134-Y175 HydrophobicContact CG1-CE1 4.49Å; Q137-Y175 HydrophobicContact CB-CD1 4.01Å; Q137-Y175 HydrophobicContact CB-CE1 4.27Å; Q137-Y175 HydrophobicContact CG-CD1 4.1Å; P138-Y175 HydrophobicContact CG-CE1 4.46Å; P138-Y175 HydrophobicContact CG-CE2 4.34Å; V172-Y175 PolarHBondContact O-N 3.27Å; V172-Y175 VanDerWaalsContact O-N 3.09Å; A173-Y175 PolarHBondContact O-N 2.93Å; Y175-G177 PolarHBondContact O-N 3.45Å; Y175-L178 HydrophobicContact CD1-CD2 4.26Å; Y175-L178 WeakPolarHBondContact O-CB 3.18Å; Y175-L178 PolarHBondContact O-N 3.42Å; Y175-L178 VanDerWaalsContact O-N 3.15Å
176	R	89.3	Confident	91	Very high	86 Å²	86	58.4 Å²	58.4	33%	0.325	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	137.9	172.6	-69.9	-173.9	175.2	144.5	5.9	110.5	Q137 E169 V172 A173 L178 L243 Q244 A246	Q137-R176 PolarHBondContact NE2-O 2.98Å; E169-R176 IonicContact OE2-CZ 3.6Å; E169-R176 IonicContact OE2-NH1 2.86Å; E169-R176 PolarHBondContact OE2-NH1 3.28Å; V172-R176 PolarHBondContact O-N 3.42Å; A173-R176 PolarHBondContact O-N 2.99Å; R176-L178 VanDerWaalsContact C-N 3.34Å; R176-L243 WeakPolarHBondContact CB-O 3.49Å; R176-Q244 VanDerWaalsContact O-CG 3.23Å; R176-Q244 WeakPolarHBondContact O-CG 3.38Å; R176-A246 PolarHBondContact NH1-O 3.49Å
177	G	88.1	Confident	91.1	Very high	4 Å²	4	53.8 Å²	53.8	4%	0.041	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.9	8.4	-175.4	0	0	0	0	0	115.2	Y175 P180 T181	Y175-G177 PolarHBondContact O-N 3.45Å; G177-P180 WeakPolarHBondContact O-CD 3.49Å; G177-P180 WeakPolarHBondContact O-CG 3.49Å; G177-T181 PolarHBondContact O-OG1 3.17Å
178	L	92.8	Very high	91.1	Very high	33 Å²	33	48 Å²	48	17%	0.173	26%	0.263	C	S	.	.	H	α-helix	trans	-65	-44.3	174	-179.6	62.7	0	0	0	111.7	T133 V134 Q137 Y175 R176 T181 L182	T133-L178 HydrophobicContact CG2-CD1 3.85Å; V134-L178 HydrophobicContact CG2-CD1 4.1Å; V134-L178 HydrophobicContact CG2-CD2 4.28Å; Q137-L178 HydrophobicContact CB-CD1 4.35Å; Q137-L178 HydrophobicContact CG-CB 4.23Å; Q137-L178 HydrophobicContact CG-CD1 4.23Å; Y175-L178 HydrophobicContact CD1-CD2 4.26Å; Y175-L178 WeakPolarHBondContact O-CB 3.18Å; Y175-L178 PolarHBondContact O-N 3.42Å; Y175-L178 VanDerWaalsContact O-N 3.15Å; R176-L178 VanDerWaalsContact C-N 3.34Å; L178-T181 WeakPolarHBondContact O-CB 3.41Å; L178-T181 PolarHBondContact O-N 3.36Å; L178-T181 VanDerWaalsContact O-N 3.08Å; L178-L182 HydrophobicContact CD1-CD1 4Å; L178-L182 HydrophobicContact CD1-CD2 4.28Å; L178-L182 HydrophobicContact CD1-CG 3.91Å; L178-L182 HydrophobicContact CD2-CD1 4.19Å; L178-L182 HydrophobicContact CG-CD1 3.75Å; L178-L182 HydrophobicContact CG-CG 4.08Å; L178-L182 PolarHBondContact O-N 3.35Å
179	S	92.9	Very high	91.3	Very high	58 Å²	58	45.8 Å²	45.8	41%	0.406	25%	0.25	S	C	.	.	H	α-helix	trans	-56.2	-52	-177.4	50.5	0	0	0	0	114.6	T181 L182 V183	S179-T181 PolarHBondContact O-N 2.9Å; S179-L182 PolarHBondContact O-N 3.45Å; S179-V183 WeakPolarHBondContact O-CG2 3.41Å; S179-V183 PolarHBondContact O-N 2.91Å
180	P	92.3	Very high	91.5	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-61.8	-32.7	176	21.4	-32.4	0	0	0	112.5	G177 A184 F236 F239 K240 L243 L264	G177-P180 WeakPolarHBondContact O-CD 3.49Å; G177-P180 WeakPolarHBondContact O-CG 3.49Å; P180-A184 VanDerWaalsContact O-CB 3.23Å; P180-A184 WeakPolarHBondContact O-CB 3.19Å; P180-A184 PolarHBondContact O-N 3.04Å; P180-A184 VanDerWaalsContact O-N 3.08Å; P180-F236 HydrophobicContact CB-CB 4.44Å; P180-F236 HydrophobicContact CB-CD1 4.36Å; P180-F239 HydrophobicContact CB-CB 4.28Å; P180-K240 HydrophobicContact CB-CB 4.28Å; P180-K240 HydrophobicContact CG-CB 3.83Å; P180-L243 HydrophobicContact CG-CD1 4.09Å; P180-L264 HydrophobicContact CB-CD1 3.72Å; P180-L264 HydrophobicContact CB-CD2 4.38Å; P180-L264 HydrophobicContact CG-CD1 4.17Å
181	T	91.4	Very high	91.7	Very high	21 Å²	21	46.6 Å²	46.6	13%	0.129	26%	0.257	C	S	.	.	H	α-helix	trans	-66.9	-48.2	179.9	-46.2	0	0	0	0	110.7	T133 G177 L178 S179 A184 V185 K240	T133-T181 HydrophobicContact CG2-CG2 3.44Å; T133-T181 VanDerWaalsContact CG2-CG2 3.44Å; G177-T181 PolarHBondContact O-OG1 3.17Å; L178-T181 WeakPolarHBondContact O-CB 3.41Å; L178-T181 PolarHBondContact O-N 3.36Å; L178-T181 VanDerWaalsContact O-N 3.08Å; S179-T181 PolarHBondContact O-N 2.9Å; T181-A184 PolarHBondContact O-N 3.31Å; T181-V185 VanDerWaalsContact O-CG2 3.3Å; T181-V185 WeakPolarHBondContact O-CG2 3.35Å; T181-V185 PolarHBondContact O-N 3Å; T181-K240 HydrophobicContact CG2-CD 4.4Å; T181-K240 WeakPolarHBondContact OG1-CD 3.34Å; T181-K240 WeakPolarHBondContact OG1-CE 2.97Å; T181-K240 PolarHBondContact OG1-NZ 2.85Å
182	L	94.1	Very high	91.8	Very high	53 Å²	53	46.9 Å²	46.9	28%	0.277	25%	0.253	S	S	.	.	H	α-helix	trans	-63.8	-44.7	179.8	-67.9	177.7	0	0	0	112	C130 T133 V134 L178 S179 A184 V185	C130-L182 HydrophobicContact CB-CD2 3.81Å; T133-L182 HydrophobicContact CG2-CD2 4.27Å; V134-L182 HydrophobicContact CG2-CD2 4.36Å; L178-L182 HydrophobicContact CD1-CD1 4Å; L178-L182 HydrophobicContact CD1-CD2 4.28Å; L178-L182 HydrophobicContact CD1-CG 3.91Å; L178-L182 HydrophobicContact CD2-CD1 4.19Å; L178-L182 HydrophobicContact CG-CD1 3.75Å; L178-L182 HydrophobicContact CG-CG 4.08Å; L178-L182 PolarHBondContact O-N 3.35Å; S179-L182 PolarHBondContact O-N 3.45Å; L182-A184 PolarHBondContact O-N 2.9Å; L182-V185 PolarHBondContact O-N 2.98Å
183	V	94	Very high	91.8	Very high	75 Å²	75	47.3 Å²	47.3	46%	0.455	25%	0.247	S	C	.	.	H	α-helix	trans	-61.1	-34	177.4	172	0	0	0	0	111.3	S179 P187 F236	S179-V183 WeakPolarHBondContact O-CG2 3.41Å; S179-V183 PolarHBondContact O-N 2.91Å; V183-P187 WeakPolarHBondContact O-CD 3.3Å; V183-P187 VanDerWaalsContact O-CG 3.24Å; V183-P187 WeakPolarHBondContact O-CG 3.24Å; V183-F236 HydrophobicContact CB-CE1 4.5Å; V183-F236 HydrophobicContact CG1-CD1 4.38Å; V183-F236 HydrophobicContact CG1-CE1 3.75Å; V183-F236 HydrophobicContact CG1-CZ 4.01Å
184	A	93.1	Very high	92	Very high	11 Å²	11	53 Å²	53	9%	0.091	27%	0.271	C	S	.	.	H	α-helix	trans	-78.4	-20	-178.3	0	0	0	0	0	114.8	P180 T181 L182 Y188 F236	P180-A184 VanDerWaalsContact O-CB 3.23Å; P180-A184 WeakPolarHBondContact O-CB 3.19Å; P180-A184 PolarHBondContact O-N 3.04Å; P180-A184 VanDerWaalsContact O-N 3.08Å; T181-A184 PolarHBondContact O-N 3.31Å; L182-A184 PolarHBondContact O-N 2.9Å; A184-Y188 WeakPolarHBondContact O-CB 3.1Å; A184-Y188 PolarHBondContact O-N 2.91Å; A184-F236 HydrophobicContact CB-CB 3.73Å; A184-F236 HydrophobicContact CB-CD2 4.27Å; A184-F236 HydrophobicContact CB-CG 4.05Å
185	V	92.3	Very high	92	Very high	23 Å²	23	54.2 Å²	54.2	14%	0.139	28%	0.277	C	S	.	.	H	α-helix	trans	-58.4	-56.4	-174.3	176.7	0	0	0	0	111.7	A129 T181 L182 Y188 A189	A129-V185 HydrophobicContact CB-CG1 3.88Å; T181-V185 VanDerWaalsContact O-CG2 3.3Å; T181-V185 WeakPolarHBondContact O-CG2 3.35Å; T181-V185 PolarHBondContact O-N 3Å; L182-V185 PolarHBondContact O-N 2.98Å; V185-Y188 PolarHBondContact O-N 3.25Å; V185-A189 PolarHBondContact O-N 2.83Å
186	F	92.5	Very high	91.8	Very high	73 Å²	73	52.5 Å²	52.5	32%	0.32	27%	0.27	S	S	.	.	H	α-helix	trans	-68.6	-46	-175.9	-75.8	-79.9	0	0	0	113.3	F122 L127 Y188 A189 G190	F122-F186 AromaticContact CE1-CD1 3.89Å; F122-F186 HydrophobicContact CE1-CD1 3.89Å; F122-F186 HydrophobicContact CE1-CE1 4.41Å; F122-F186 HydrophobicContact CZ-CD1 4.18Å; L127-F186 HydrophobicContact CD2-CZ 4.38Å; L127-F186 HydrophobicContact CG-CZ 4.5Å; F186-Y188 VanDerWaalsContact C-N 3.3Å; F186-Y188 PolarHBondContact O-N 3.36Å; F186-A189 PolarHBondContact O-N 3Å; F186-G190 PolarHBondContact O-N 2.83Å
187	P	94	Very high	91.8	Very high	55 Å²	55	50.9 Å²	50.9	36%	0.357	27%	0.268	S	S	.	.	H	α-helix	trans	-57.5	-42	173.6	-26.7	35.5	0	0	0	112.6	V183 G190 L191 T233	V183-P187 WeakPolarHBondContact O-CD 3.3Å; V183-P187 VanDerWaalsContact O-CG 3.24Å; V183-P187 WeakPolarHBondContact O-CG 3.24Å; P187-G190 PolarHBondContact O-N 2.95Å; P187-L191 VanDerWaalsContact O-CB 3.28Å; P187-L191 WeakPolarHBondContact O-CB 3.24Å; P187-L191 WeakPolarHBondContact O-CD1 3.46Å; P187-L191 WeakPolarHBondContact O-CG 3.07Å; P187-L191 PolarHBondContact O-N 3.03Å; P187-T233 HydrophobicContact CB-CG2 4.23Å
188	Y	91.9	Very high	91.9	Very high	87 Å²	87	52.8 Å²	52.8	34%	0.341	28%	0.279	S	S	.	.	H	α-helix	trans	-62	-50.4	178.1	174	-106	0	0	0	111.6	A184 V185 F186 G190 Q192 K230	A184-Y188 WeakPolarHBondContact O-CB 3.1Å; A184-Y188 PolarHBondContact O-N 2.91Å; V185-Y188 PolarHBondContact O-N 3.25Å; F186-Y188 VanDerWaalsContact C-N 3.3Å; F186-Y188 PolarHBondContact O-N 3.36Å; Y188-G190 PolarHBondContact O-N 3.38Å; Y188-Q192 VanDerWaalsContact O-CB 3.27Å; Y188-Q192 WeakPolarHBondContact O-CB 3.18Å; Y188-Q192 PolarHBondContact O-N 3.2Å; Y188-Q192 PolarHBondContact OH-OE1 3.49Å; Y188-K230 HydrophobicContact CE2-CB 4.33Å
189	A	90.1	Very high	91.7	Very high	33 Å²	33	53.5 Å²	53.5	27%	0.273	28%	0.28	S	S	.	.	H	α-helix	trans	-62.8	-42.1	179	0	0	0	0	0	111.9	F122 V185 F186 Q192 F193	F122-A189 HydrophobicContact CD2-CB 4.3Å; F122-A189 HydrophobicContact CE2-CB 3.57Å; F122-A189 HydrophobicContact CZ-CB 4.24Å; V185-A189 PolarHBondContact O-N 2.83Å; F186-A189 PolarHBondContact O-N 3Å; A189-Q192 PolarHBondContact O-N 3.47Å; A189-F193 PolarHBondContact O-N 3.44Å
190	G	91.4	Very high	91.4	Very high	28 Å²	28	55.6 Å²	55.6	29%	0.289	28%	0.282	S	S	.	.	H	α-helix	trans	-66.1	-47.3	-178.6	0	0	0	0	0	112.1	F186 P187 Y188 Q192 F193 F194	F186-G190 PolarHBondContact O-N 2.83Å; P187-G190 PolarHBondContact O-N 2.95Å; Y188-G190 PolarHBondContact O-N 3.38Å; G190-Q192 VanDerWaalsContact C-N 3.32Å; G190-Q192 PolarHBondContact O-N 3.28Å; G190-F193 PolarHBondContact O-N 3.44Å; G190-F194 WeakPolarHBondContact O-CB 3.4Å; G190-F194 PolarHBondContact O-N 2.96Å
191	L	93.7	Very high	91.1	Very high	50 Å²	50	62.8 Å²	62.8	26%	0.262	32%	0.316	S	S	.	.	H	α-helix	trans	-62.5	-40.8	175.3	-69.6	170.4	0	0	0	111.1	P187 F193 F194 F195 S229 L232 T233	P187-L191 VanDerWaalsContact O-CB 3.28Å; P187-L191 WeakPolarHBondContact O-CB 3.24Å; P187-L191 WeakPolarHBondContact O-CD1 3.46Å; P187-L191 WeakPolarHBondContact O-CG 3.07Å; P187-L191 PolarHBondContact O-N 3.03Å; L191-F193 PolarHBondContact O-N 3.46Å; L191-F194 PolarHBondContact O-N 3.31Å; L191-F195 HydrophobicContact CB-CD2 4.32Å; L191-F195 HydrophobicContact CB-CE2 4.4Å; L191-F195 HydrophobicContact CD2-CE2 4.06Å; L191-F195 WeakPolarHBondContact O-CD2 3.26Å; L191-F195 PolarHBondContact O-N 3.4Å; L191-S229 PolarHBondContact O-OG 3.45Å; L191-L232 HydrophobicContact CD1-CB 3.91Å; L191-L232 HydrophobicContact CD1-CD1 4Å; L191-L232 HydrophobicContact CD2-CD1 4.18Å; L191-T233 HydrophobicContact CD1-CG2 4Å
192	Q	91.4	Very high	90.8	Very high	71 Å²	71	67.9 Å²	67.9	33%	0.332	34%	0.342	S	S	.	.	H	α-helix	trans	-62.8	-44	179.2	-177.1	174.1	-5.6	0	0	111.3	Y188 A189 G190 Y196 S229	Y188-Q192 VanDerWaalsContact O-CB 3.27Å; Y188-Q192 WeakPolarHBondContact O-CB 3.18Å; Y188-Q192 PolarHBondContact O-N 3.2Å; Y188-Q192 PolarHBondContact OH-OE1 3.49Å; A189-Q192 PolarHBondContact O-N 3.47Å; G190-Q192 VanDerWaalsContact C-N 3.32Å; G190-Q192 PolarHBondContact O-N 3.28Å; Q192-Y196 WeakPolarHBondContact O-CB 3.3Å; Q192-Y196 PolarHBondContact O-N 3.17Å; Q192-S229 WeakPolarHBondContact CA-OG 3.34Å; Q192-S229 PolarHBondContact N-OG 3.01Å
193	F	90	Very high	90.2	Very high	116 Å²	116	68.7 Å²	68.7	51%	0.509	35%	0.346	S	S	.	.	H	α-helix	trans	-65.2	-43.5	175.6	-174.9	-105.6	0	0	0	112	A189 G190 L191 Y196 N197	A189-F193 PolarHBondContact O-N 3.44Å; G190-F193 PolarHBondContact O-N 3.44Å; L191-F193 PolarHBondContact O-N 3.46Å; F193-Y196 PolarHBondContact O-N 3.29Å; F193-N197 WeakPolarHBondContact CD1-ND2 3.44Å; F193-N197 WeakPolarHBondContact CE1-ND2 3.13Å; F193-N197 WeakPolarHBondContact CZ-ND2 3.37Å; F193-N197 PolarHBondContact O-N 2.93Å; F193-N197 PolarHBondContact O-ND2 2.97Å
194	F	92.1	Very high	89.3	Confident	118 Å²	118	67.7 Å²	67.7	52%	0.518	35%	0.346	S	S	.	.	H	α-helix	trans	-58.6	-56.9	177.5	175.9	-98.8	0	0	0	111.8	G190 L191 Y196 N197 V198	G190-F194 WeakPolarHBondContact O-CB 3.4Å; G190-F194 PolarHBondContact O-N 2.96Å; L191-F194 PolarHBondContact O-N 3.31Å; F194-Y196 VanDerWaalsContact C-N 3.29Å; F194-Y196 PolarHBondContact O-N 3.39Å; F194-N197 PolarHBondContact O-N 3.08Å; F194-V198 HydrophobicContact CD1-CG2 4.35Å; F194-V198 HydrophobicContact CE1-CG2 3.96Å; F194-V198 HydrophobicContact CE2-CG2 4.29Å; F194-V198 HydrophobicContact CZ-CG2 3.93Å; F194-V198 WeakPolarHBondContact O-CG2 3.35Å; F194-V198 PolarHBondContact O-N 3.07Å
195	F	92.5	Very high	88.1	Confident	41 Å²	41	70 Å²	70	18%	0.18	36%	0.36	C	S	.	.	H	α-helix	trans	-66.4	-31.8	-179.3	-75.4	-66.4	0	0	0	112.5	L191 V198 F199 A225 I228 L232	L191-F195 HydrophobicContact CB-CD2 4.32Å; L191-F195 HydrophobicContact CB-CE2 4.4Å; L191-F195 HydrophobicContact CD2-CE2 4.06Å; L191-F195 WeakPolarHBondContact O-CD2 3.26Å; L191-F195 PolarHBondContact O-N 3.4Å; F195-V198 PolarHBondContact O-N 2.78Å; F195-F199 HydrophobicContact CB-CE2 4.29Å; F195-F199 WeakPolarHBondContact O-CB 3.2Å; F195-F199 WeakPolarHBondContact O-CD2 3.33Å; F195-F199 WeakPolarHBondContact O-CG 3.22Å; F195-F199 PolarHBondContact O-N 3.49Å; F195-A225 HydrophobicContact CB-CB 3.7Å; F195-I228 HydrophobicContact CD1-CD1 4.49Å; F195-I228 HydrophobicContact CD1-CG2 4.25Å; F195-I228 HydrophobicContact CD2-CB 4.35Å; F195-I228 HydrophobicContact CD2-CG2 3.81Å; F195-I228 HydrophobicContact CE1-CG2 3.95Å; F195-I228 HydrophobicContact CE2-CB 4.49Å; F195-I228 HydrophobicContact CE2-CG2 3.49Å; F195-I228 VanDerWaalsContact CE2-CG2 3.49Å; F195-I228 HydrophobicContact CG-CG2 4.19Å; F195-I228 HydrophobicContact CZ-CG2 3.57Å; F195-L232 HydrophobicContact CE2-CD1 3.69Å; F195-L232 HydrophobicContact CZ-CD1 4.07Å
196	Y	88.5	Confident	86.8	Confident	67 Å²	67	74.2 Å²	74.2	26%	0.263	39%	0.388	S	S	.	.	H	α-helix	trans	-61.3	-45.2	173.5	177.6	-98.3	0	0	0	111.2	Q192 F193 F194 F199 K200 C221 A225	Q192-Y196 WeakPolarHBondContact O-CB 3.3Å; Q192-Y196 PolarHBondContact O-N 3.17Å; F193-Y196 PolarHBondContact O-N 3.29Å; F194-Y196 VanDerWaalsContact C-N 3.29Å; F194-Y196 PolarHBondContact O-N 3.39Å; Y196-F199 PolarHBondContact O-N 3.37Å; Y196-K200 HydrophobicContact CE1-CD 4.13Å; Y196-K200 VanDerWaalsContact O-CB 3.26Å; Y196-K200 WeakPolarHBondContact O-CB 3.35Å; Y196-K200 PolarHBondContact O-N 3.38Å; Y196-C221 HydrophobicContact CD2-CB 4.09Å; Y196-C221 HydrophobicContact CE2-CB 4.08Å; Y196-A225 VanDerWaalsContact N-CB 3.33Å
197	N	88.3	Confident	85.1	Confident	52 Å²	52	76.9 Å²	76.9	28%	0.278	42%	0.415	S	S	.	.	H	α-helix	trans	-65.9	-42.7	177.1	-71.6	-29	0	0	0	112.1	F193 F194 F199 K200 Q201	F193-N197 WeakPolarHBondContact CD1-ND2 3.44Å; F193-N197 WeakPolarHBondContact CE1-ND2 3.13Å; F193-N197 WeakPolarHBondContact CZ-ND2 3.37Å; F193-N197 PolarHBondContact O-N 2.93Å; F193-N197 PolarHBondContact O-ND2 2.97Å; F194-N197 PolarHBondContact O-N 3.08Å; N197-F199 PolarHBondContact O-N 2.97Å; N197-K200 PolarHBondContact O-N 3.4Å; N197-Q201 WeakPolarHBondContact O-CG 3.32Å; N197-Q201 PolarHBondContact O-N 2.97Å
198	V	90.7	Very high	83.2	Confident	44 Å²	44	84.1 Å²	84.1	27%	0.267	44%	0.441	S	S	.	.	H	α-helix	trans	-57.5	-50.2	174.9	171.1	0	0	0	0	110.6	F194 F195 K200 Q201 L202	F194-V198 HydrophobicContact CD1-CG2 4.35Å; F194-V198 HydrophobicContact CE1-CG2 3.96Å; F194-V198 HydrophobicContact CE2-CG2 4.29Å; F194-V198 HydrophobicContact CZ-CG2 3.93Å; F194-V198 WeakPolarHBondContact O-CG2 3.35Å; F194-V198 PolarHBondContact O-N 3.07Å; F195-V198 PolarHBondContact O-N 2.78Å; V198-K200 VanDerWaalsContact C-N 3.35Å; V198-K200 PolarHBondContact O-N 2.99Å; V198-Q201 PolarHBondContact O-N 2.89Å; V198-L202 HydrophobicContact CG1-CD1 3.81Å; V198-L202 HydrophobicContact CG1-CG 4.43Å; V198-L202 WeakPolarHBondContact O-CG 3.3Å; V198-L202 PolarHBondContact O-N 3.48Å
199	F	88.6	Confident	81.3	Confident	47 Å²	47	83.6 Å²	83.6	21%	0.206	45%	0.45	C	S	.	.	H	α-helix	trans	-66.9	-35.4	178.5	-69.1	-40.7	0	0	0	113.3	F195 Y196 N197 Q201 L202 L203 C221 A225 I228	F195-F199 HydrophobicContact CB-CE2 4.29Å; F195-F199 WeakPolarHBondContact O-CB 3.2Å; F195-F199 WeakPolarHBondContact O-CD2 3.33Å; F195-F199 WeakPolarHBondContact O-CG 3.22Å; F195-F199 PolarHBondContact O-N 3.49Å; Y196-F199 PolarHBondContact O-N 3.37Å; N197-F199 PolarHBondContact O-N 2.97Å; F199-Q201 VanDerWaalsContact C-N 3.29Å; F199-Q201 PolarHBondContact O-N 2.96Å; F199-L202 HydrophobicContact CD1-CD1 4.2Å; F199-L202 PolarHBondContact O-N 3.24Å; F199-L203 WeakPolarHBondContact O-CB 3.47Å; F199-L203 WeakPolarHBondContact O-CD1 3.38Å; F199-L203 PolarHBondContact O-N 2.87Å; F199-C221 HydrophobicContact CB-CB 3.85Å; F199-A225 HydrophobicContact CD2-CB 4.15Å; F199-A225 HydrophobicContact CE2-CB 4.42Å; F199-I228 HydrophobicContact CE2-CD1 3.7Å; F199-I228 HydrophobicContact CZ-CD1 3.4Å
200	K	85.8	Confident	79.4	Confident	103 Å²	103	91.5 Å²	91.5	45%	0.448	48%	0.478	S	S	.	.	H	α-helix	trans	-63.8	-37.3	176.6	-171.3	176.3	-179.7	179.5	0	111.7	Y196 N197 V198 A204 R217	Y196-K200 HydrophobicContact CE1-CD 4.13Å; Y196-K200 VanDerWaalsContact O-CB 3.26Å; Y196-K200 WeakPolarHBondContact O-CB 3.35Å; Y196-K200 PolarHBondContact O-N 3.38Å; N197-K200 PolarHBondContact O-N 3.4Å; V198-K200 VanDerWaalsContact C-N 3.35Å; V198-K200 PolarHBondContact O-N 2.99Å; K200-A204 PolarHBondContact O-N 2.69Å; K200-R217 PolarHBondContact O-NH2 3.32Å
201	Q	86	Confident	77.7	Confident	150 Å²	150	96.4 Å²	96.4	70%	0.701	50%	0.498	S	S	*	.	H	α-helix	trans	-70.2	-45.4	174.4	-71.8	177.5	1.7	0	0	111.8	N197 V198 F199 L203 A204	N197-Q201 WeakPolarHBondContact O-CG 3.32Å; N197-Q201 PolarHBondContact O-N 2.97Å; V198-Q201 PolarHBondContact O-N 2.89Å; F199-Q201 VanDerWaalsContact C-N 3.29Å; F199-Q201 PolarHBondContact O-N 2.96Å; Q201-L203 PolarHBondContact O-N 2.92Å; Q201-A204 VanDerWaalsContact O-CB 3.27Å; Q201-A204 WeakPolarHBondContact O-CB 3.4Å; Q201-A204 PolarHBondContact O-N 3.43Å
202	L	86.1	Confident	75.6	Confident	128 Å²	128	99.9 Å²	99.9	67%	0.67	53%	0.526	S	S	*	.	H	α-helix	trans	-64.7	-36.2	179.2	-70.6	171.2	0	0	0	113.3	V198 F199 A204	V198-L202 HydrophobicContact CG1-CD1 3.81Å; V198-L202 HydrophobicContact CG1-CG 4.43Å; V198-L202 WeakPolarHBondContact O-CG 3.3Å; V198-L202 PolarHBondContact O-N 3.48Å; F199-L202 HydrophobicContact CD1-CD1 4.2Å; F199-L202 PolarHBondContact O-N 3.24Å; L202-A204 VanDerWaalsContact C-N 3.33Å
203	L	81.4	Confident	74.2	Confident	70 Å²	70	98.5 Å²	98.5	37%	0.366	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	14	178.3	-81.5	70.2	0	0	0	112.5	F199 Q201 R217 I220	F199-L203 WeakPolarHBondContact O-CB 3.47Å; F199-L203 WeakPolarHBondContact O-CD1 3.38Å; F199-L203 PolarHBondContact O-N 2.87Å; Q201-L203 PolarHBondContact O-N 2.92Å; L203-R217 HydrophobicContact CB-CG 3.96Å; L203-R217 HydrophobicContact CD2-CG 4.05Å; L203-R217 WeakPolarHBondContact O-CD 3.13Å; L203-R217 PolarHBondContact O-NE 2.94Å; L203-I220 HydrophobicContact CD2-CG2 4.26Å
204	A	74.4	Confident	73.2	Confident	55 Å²	55	93.8 Å²	93.8	46%	0.455	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-60.6	129.6	177.3	0	0	0	0	0	110.6	K200 Q201 L202	K200-A204 PolarHBondContact O-N 2.69Å; Q201-A204 VanDerWaalsContact O-CB 3.27Å; Q201-A204 WeakPolarHBondContact O-CB 3.4Å; Q201-A204 PolarHBondContact O-N 3.43Å; L202-A204 VanDerWaalsContact C-N 3.33Å
205	P	67.8	Low	72.4	Confident	60 Å²	60	95.2 Å²	95.2	39%	0.39	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-72.1	147	-179.3	3.1	15.7	0	0	0	108.6	S207 R217	P205-S207 PolarHBondContact O-N 2.93Å; P205-R217 VanDerWaalsContact CD-NH1 3.29Å
206	P	65.7	Low	71.8	Confident	111 Å²	111	97.7 Å²	97.7	72%	0.721	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-58.7	139.8	164.4	24.2	-30.4	0	0	0	109.3	K208 S209	P206-K208 PolarHBondContact O-N 3.49Å; P206-S209 PolarHBondContact O-N 2.93Å
207	S	57.2	Low	71.4	Confident	128 Å²	128	97.1 Å²	97.1	90%	0.895	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	6	-164.7	-171.4	0	0	0	0	118.9	P205	P205-S207 PolarHBondContact O-N 2.93Å
208	K	53.2	Low	71.1	Confident	208 Å²	208	97.2 Å²	97.2	90%	0.904	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124	1.8	-172.6	-69.4	-170.6	177.4	-178.5	0	116.1	P206	P206-K208 PolarHBondContact O-N 3.49Å
209	S	51.8	Low	70.8	Confident	75 Å²	75	99.6 Å²	99.6	52%	0.524	56%	0.56	S	S	.	*	S	Bend	trans	-95.6	127.3	178.1	52.9	0	0	0	0	112.8	P206 D211	P206-S209 PolarHBondContact O-N 2.93Å; S209-D211 PolarHBondContact O-N 2.92Å
210	K	50.1	Low	70.7	Confident	199 Å²	199	102 Å²	102	87%	0.865	57%	0.574	S	S	*	*			trans	-54.5	134.6	169.2	-99.5	175.9	173.4	175.6	0	109.7	S212	K210-S212 PolarHBondContact O-N 3.32Å
211	D	56.3	Low	70.7	Confident	131 Å²	131	97.1 Å²	97.1	70%	0.701	55%	0.553	S	S	*	*	S	Bend	trans	-70.8	36	-165	-142	-0.5	0	0	0	115.3	S209 G213	S209-D211 PolarHBondContact O-N 2.92Å; D211-G213 PolarHBondContact O-N 3.44Å; D211-G213 VanDerWaalsContact O-N 3.12Å
212	S	50.8	Low	70.7	Confident	123 Å²	123	91.1 Å²	91.1	86%	0.86	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-1.9	-175.8	-63.3	0	0	0	0	114.3	K210	K210-S212 PolarHBondContact O-N 3.32Å
213	G	60.5	Low	70.7	Confident	43 Å²	43	87.7 Å²	87.7	44%	0.443	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	3.2	-178.8	0	0	0	0	0	115.7	D211 N215 V216 R217	D211-G213 PolarHBondContact O-N 3.44Å; D211-G213 VanDerWaalsContact O-N 3.12Å; G213-N215 VanDerWaalsContact C-N 3.33Å; G213-N215 PolarHBondContact O-N 3.39Å; G213-V216 PolarHBondContact O-N 3.5Å; G213-R217 WeakPolarHBondContact O-CB 3.19Å; G213-R217 PolarHBondContact O-N 3.38Å
214	G	69.4	Low	71.1	Confident	17 Å²	17	85.4 Å²	85.4	18%	0.175	51%	0.511	C	S	.	.	H	α-helix	trans	-58.2	-37.4	-170	0	0	0	0	0	115	S218	G214-S218 VanDerWaalsContact O-CB 3.31Å; G214-S218 WeakPolarHBondContact O-CB 3.4Å; G214-S218 PolarHBondContact O-N 3.3Å; G214-S218 PolarHBondContact O-OG 3.25Å
215	N	75	Confident	71.8	Confident	147 Å²	147	82.8 Å²	82.8	79%	0.786	49%	0.49	S	S	*	.	H	α-helix	trans	-71	-45.8	-178.9	-70.3	-10.3	0	0	0	112.4	G213 S218 L219	G213-N215 VanDerWaalsContact C-N 3.33Å; G213-N215 PolarHBondContact O-N 3.39Å; N215-S218 PolarHBondContact O-N 3.04Å; N215-L219 WeakPolarHBondContact O-CB 3.5Å; N215-L219 PolarHBondContact O-N 3.29Å
216	V	79.9	Confident	72.8	Confident	94 Å²	94	80.6 Å²	80.6	57%	0.57	48%	0.478	S	S	*	.	H	α-helix	trans	-66.7	-41.8	178.4	178.5	0	0	0	0	110.4	G213 L219 I220	G213-V216 PolarHBondContact O-N 3.5Å; V216-L219 WeakPolarHBondContact O-CB 3.43Å; V216-L219 PolarHBondContact O-N 2.77Å; V216-I220 HydrophobicContact CG1-CD1 3.96Å; V216-I220 WeakPolarHBondContact O-CG1 3.32Å; V216-I220 PolarHBondContact O-N 3.01Å
217	R	80.1	Confident	73.9	Confident	54 Å²	54	79.9 Å²	79.9	20%	0.204	47%	0.466	C	S	.	.	H	α-helix	trans	-60.8	-47.8	175.1	178.2	178.2	147.1	-145.8	4	111.7	K200 L203 P205 G213 L219 I220 C221	K200-R217 PolarHBondContact O-NH2 3.32Å; L203-R217 HydrophobicContact CB-CG 3.96Å; L203-R217 HydrophobicContact CD2-CG 4.05Å; L203-R217 WeakPolarHBondContact O-CD 3.13Å; L203-R217 PolarHBondContact O-NE 2.94Å; P205-R217 VanDerWaalsContact CD-NH1 3.29Å; G213-R217 WeakPolarHBondContact O-CB 3.19Å; G213-R217 PolarHBondContact O-N 3.38Å; R217-L219 VanDerWaalsContact C-N 3.25Å; R217-L219 PolarHBondContact O-N 3Å; R217-I220 PolarHBondContact O-N 3.49Å; R217-C221 WeakPolarHBondContact O-CB 3.45Å; R217-C221 PolarHBondContact O-N 3.01Å; R217-C221 PolarHBondContact O-SG 3Å
218	S	82.8	Confident	75.6	Confident	54 Å²	54	76.6 Å²	76.6	38%	0.378	44%	0.438	S	S	.	.	H	α-helix	trans	-61.8	-35.5	177.6	-62.5	0	0	0	0	112.1	G214 N215 G222	G214-S218 VanDerWaalsContact O-CB 3.31Å; G214-S218 WeakPolarHBondContact O-CB 3.4Å; G214-S218 PolarHBondContact O-N 3.3Å; G214-S218 PolarHBondContact O-OG 3.25Å; N215-S218 PolarHBondContact O-N 3.04Å; S218-G222 PolarHBondContact O-N 2.89Å
219	L	83.8	Confident	77.4	Confident	94 Å²	94	66.7 Å²	66.7	49%	0.492	40%	0.395	S	S	.	.	H	α-helix	trans	-65.5	-44.5	174.4	-173.6	71.7	0	0	0	111.9	N215 V216 R217 G222 S223	N215-L219 WeakPolarHBondContact O-CB 3.5Å; N215-L219 PolarHBondContact O-N 3.29Å; V216-L219 WeakPolarHBondContact O-CB 3.43Å; V216-L219 PolarHBondContact O-N 2.77Å; R217-L219 VanDerWaalsContact C-N 3.25Å; R217-L219 PolarHBondContact O-N 3Å; L219-G222 PolarHBondContact O-N 3.24Å; L219-S223 WeakPolarHBondContact O-CB 3.36Å; L219-S223 PolarHBondContact O-N 3.31Å; L219-S223 PolarHBondContact O-OG 3.02Å
220	I	86.5	Confident	79.2	Confident	98 Å²	98	65.5 Å²	65.5	50%	0.503	38%	0.38	S	S	.	.	H	α-helix	trans	-64.5	-48.3	176.8	-67.1	166.3	0	0	0	110.2	L203 V216 R217 G222 S223 G224	L203-I220 HydrophobicContact CD2-CG2 4.26Å; V216-I220 HydrophobicContact CG1-CD1 3.96Å; V216-I220 WeakPolarHBondContact O-CG1 3.32Å; V216-I220 PolarHBondContact O-N 3.01Å; R217-I220 PolarHBondContact O-N 3.49Å; I220-G222 PolarHBondContact O-N 2.97Å; I220-S223 PolarHBondContact O-N 2.89Å; I220-G224 PolarHBondContact O-N 3.44Å
221	C	86.2	Confident	81.2	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.007	35%	0.352	C	S	.	.	H	α-helix	trans	-59.4	-46.1	177.3	-62.3	0	0	0	0	111.2	Y196 F199 R217 A225	Y196-C221 HydrophobicContact CD2-CB 4.09Å; Y196-C221 HydrophobicContact CE2-CB 4.08Å; F199-C221 HydrophobicContact CB-CB 3.85Å; R217-C221 WeakPolarHBondContact O-CB 3.45Å; R217-C221 PolarHBondContact O-N 3.01Å; R217-C221 PolarHBondContact O-SG 3Å; C221-A225 WeakPolarHBondContact O-CB 3.35Å; C221-A225 PolarHBondContact O-N 3.25Å
222	G	86.5	Confident	82.9	Confident	24 Å²	24	56.4 Å²	56.4	25%	0.247	34%	0.342	C	S	.	.	H	α-helix	trans	-65.5	-44.6	178.8	0	0	0	0	0	113.2	S218 L219 I220 G226	S218-G222 PolarHBondContact O-N 2.89Å; L219-G222 PolarHBondContact O-N 3.24Å; I220-G222 PolarHBondContact O-N 2.97Å; G222-G226 PolarHBondContact O-N 3.12Å
223	S	86.4	Confident	84.9	Confident	56 Å²	56	50.9 Å²	50.9	39%	0.392	30%	0.303	S	S	.	.	H	α-helix	trans	-68	-45.2	180	-57.4	0	0	0	0	111.6	L219 I220 G226 M227	L219-S223 WeakPolarHBondContact O-CB 3.36Å; L219-S223 PolarHBondContact O-N 3.31Å; L219-S223 PolarHBondContact O-OG 3.02Å; I220-S223 PolarHBondContact O-N 2.89Å; S223-G226 PolarHBondContact O-N 3.1Å; S223-M227 WeakPolarHBondContact O-CB 3.16Å; S223-M227 WeakPolarHBondContact O-CG 3.47Å; S223-M227 PolarHBondContact O-N 3.11Å
224	G	89.1	Confident	86.4	Confident	22 Å²	22	48.9 Å²	48.9	23%	0.227	28%	0.282	C	S	.	.	H	α-helix	trans	-62.1	-46.4	176.3	0	0	0	0	0	112	I220 G226 M227 I228	I220-G224 PolarHBondContact O-N 3.44Å; G224-G226 VanDerWaalsContact C-N 3.34Å; G224-G226 PolarHBondContact O-N 3.13Å; G224-M227 PolarHBondContact O-N 3.14Å; G224-I228 WeakPolarHBondContact O-CG1 3.44Å; G224-I228 PolarHBondContact O-N 2.93Å
225	A	89.7	Confident	87.5	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-61	-43.7	176.4	0	0	0	0	0	111.7	F195 Y196 F199 C221 S229	F195-A225 HydrophobicContact CB-CB 3.7Å; Y196-A225 VanDerWaalsContact N-CB 3.33Å; F199-A225 HydrophobicContact CD2-CB 4.15Å; F199-A225 HydrophobicContact CE2-CB 4.42Å; C221-A225 WeakPolarHBondContact O-CB 3.35Å; C221-A225 PolarHBondContact O-N 3.25Å; A225-S229 VanDerWaalsContact O-CB 3.24Å; A225-S229 WeakPolarHBondContact O-CB 3.44Å; A225-S229 PolarHBondContact O-N 2.68Å; A225-S229 PolarHBondContact O-OG 3.13Å
226	G	88.1	Confident	88.3	Confident	13 Å²	13	45 Å²	45	13%	0.134	26%	0.256	C	S	.	.	H	α-helix	trans	-62.5	-42.5	176.8	0	0	0	0	0	112.9	G222 S223 G224 K230	G222-G226 PolarHBondContact O-N 3.12Å; S223-G226 PolarHBondContact O-N 3.1Å; G224-G226 VanDerWaalsContact C-N 3.34Å; G224-G226 PolarHBondContact O-N 3.13Å; G226-K230 WeakPolarHBondContact O-CB 3.2Å; G226-K230 PolarHBondContact O-N 3.15Å
227	M	89.5	Confident	88.8	Confident	97 Å²	97	42.3 Å²	42.3	48%	0.478	24%	0.238	S	C	.	.	H	α-helix	trans	-64.1	-47.8	177.7	-78.7	179.9	58.8	0	0	112.2	S223 G224 K230 T231 L288	S223-M227 WeakPolarHBondContact O-CB 3.16Å; S223-M227 WeakPolarHBondContact O-CG 3.47Å; S223-M227 PolarHBondContact O-N 3.11Å; G224-M227 PolarHBondContact O-N 3.14Å; M227-K230 PolarHBondContact O-N 3.3Å; M227-T231 PolarHBondContact O-N 2.87Å; M227-T231 PolarHBondContact O-OG1 3.42Å; M227-T231 VanDerWaalsContact O-OG1 3.06Å; M227-L288 HydrophobicContact CE-CD2 4.2Å; M227-L288 HydrophobicContact CG-CD2 4.3Å
228	I	91.9	Very high	89.3	Confident	59 Å²	59	39.7 Å²	39.7	30%	0.303	23%	0.229	S	C	.	.	H	α-helix	trans	-65.9	-45.8	-179.2	-67.1	164.5	0	0	0	110.5	F195 F199 G224 K230 T231 L232	F195-I228 HydrophobicContact CD1-CD1 4.49Å; F195-I228 HydrophobicContact CD1-CG2 4.25Å; F195-I228 HydrophobicContact CD2-CB 4.35Å; F195-I228 HydrophobicContact CD2-CG2 3.81Å; F195-I228 HydrophobicContact CE1-CG2 3.95Å; F195-I228 HydrophobicContact CE2-CB 4.49Å; F195-I228 HydrophobicContact CE2-CG2 3.49Å; F195-I228 VanDerWaalsContact CE2-CG2 3.49Å; F195-I228 HydrophobicContact CG-CG2 4.19Å; F195-I228 HydrophobicContact CZ-CG2 3.57Å; F199-I228 HydrophobicContact CE2-CD1 3.7Å; F199-I228 HydrophobicContact CZ-CD1 3.4Å; G224-I228 WeakPolarHBondContact O-CG1 3.44Å; G224-I228 PolarHBondContact O-N 2.93Å; I228-K230 VanDerWaalsContact C-N 3.28Å; I228-K230 PolarHBondContact O-N 3.22Å; I228-T231 PolarHBondContact O-N 3.35Å; I228-T231 VanDerWaalsContact O-N 3.14Å; I228-L232 HydrophobicContact CG2-CD1 4.07Å; I228-L232 HydrophobicContact CG2-CG 4.47Å; I228-L232 WeakPolarHBondContact O-CG 3.37Å; I228-L232 PolarHBondContact O-N 3.07Å
229	S	92	Very high	89.8	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59.7	-42.2	177.5	-54.3	0	0	0	0	111.1	L191 Q192 A225 L232 T233	L191-S229 PolarHBondContact O-OG 3.45Å; Q192-S229 WeakPolarHBondContact CA-OG 3.34Å; Q192-S229 PolarHBondContact N-OG 3.01Å; A225-S229 VanDerWaalsContact O-CB 3.24Å; A225-S229 WeakPolarHBondContact O-CB 3.44Å; A225-S229 PolarHBondContact O-N 2.68Å; A225-S229 PolarHBondContact O-OG 3.13Å; S229-L232 PolarHBondContact O-N 3.05Å; S229-T233 PolarHBondContact O-N 3.24Å; S229-T233 PolarHBondContact O-OG1 3.32Å
230	K	89.7	Confident	90.2	Very high	50 Å²	50	34.7 Å²	34.7	22%	0.217	20%	0.196	C	C	.	.	H	α-helix	trans	-66.7	-37.1	176.6	-172.4	166.7	-172.2	66.9	0	112.8	Y188 G226 M227 I228 Y234 D237 S287	Y188-K230 HydrophobicContact CE2-CB 4.33Å; G226-K230 WeakPolarHBondContact O-CB 3.2Å; G226-K230 PolarHBondContact O-N 3.15Å; M227-K230 PolarHBondContact O-N 3.3Å; I228-K230 VanDerWaalsContact C-N 3.28Å; I228-K230 PolarHBondContact O-N 3.22Å; K230-Y234 WeakPolarHBondContact O-CA 3.49Å; K230-Y234 VanDerWaalsContact O-CB 3.27Å; K230-Y234 WeakPolarHBondContact O-CB 3.1Å; K230-Y234 PolarHBondContact O-N 3.48Å; K230-D237 IonicContact NZ-OD2 2.65Å; K230-D237 PolarHBondContact NZ-OD2 2.84Å; K230-S287 VanDerWaalsContact CE-OG 3.26Å; K230-S287 WeakPolarHBondContact CE-OG 3.3Å
231	T	91.5	Very high	90.4	Very high	45 Å²	45	31.1 Å²	31.1	28%	0.276	18%	0.177	S	C	.	.	H	α-helix	trans	-64.4	-45.6	174.9	-63.5	0	0	0	0	110.7	M227 I228 T233 Y234 F281 L284	M227-T231 PolarHBondContact O-N 2.87Å; M227-T231 PolarHBondContact O-OG1 3.42Å; M227-T231 VanDerWaalsContact O-OG1 3.06Å; I228-T231 PolarHBondContact O-N 3.35Å; I228-T231 VanDerWaalsContact O-N 3.14Å; T231-T233 PolarHBondContact O-N 3.14Å; T231-Y234 VanDerWaalsContact O-CB 3.22Å; T231-Y234 WeakPolarHBondContact O-CB 3.09Å; T231-Y234 PolarHBondContact O-N 3.19Å; T231-F281 HydrophobicContact CG2-CE1 4.12Å; T231-F281 WeakPolarHBondContact O-CE1 3.45Å; T231-L284 HydrophobicContact CG2-CD2 4.18Å
232	L	92.4	Very high	90.6	Very high	93 Å²	93	31.4 Å²	31.4	49%	0.487	18%	0.178	S	C	.	.	H	α-helix	trans	-65.6	-37.7	179.7	-68.3	174.1	0	0	0	112.6	L191 F195 I228 S229 P235	L191-L232 HydrophobicContact CD1-CB 3.91Å; L191-L232 HydrophobicContact CD1-CD1 4Å; L191-L232 HydrophobicContact CD2-CD1 4.18Å; F195-L232 HydrophobicContact CE2-CD1 3.69Å; F195-L232 HydrophobicContact CZ-CD1 4.07Å; I228-L232 HydrophobicContact CG2-CD1 4.07Å; I228-L232 HydrophobicContact CG2-CG 4.47Å; I228-L232 WeakPolarHBondContact O-CG 3.37Å; I228-L232 PolarHBondContact O-N 3.07Å; S229-L232 PolarHBondContact O-N 3.05Å; L232-P235 WeakPolarHBondContact O-CD 3.29Å
233	T	92.4	Very high	90.8	Very high	8 Å²	8	30.8 Å²	30.8	5%	0.049	17%	0.169	C	C	.	.	H	α-helix	trans	-89.4	0.4	177.3	63.4	0	0	0	0	113.9	P187 L191 S229 T231 F236	P187-T233 HydrophobicContact CB-CG2 4.23Å; L191-T233 HydrophobicContact CD1-CG2 4Å; S229-T233 PolarHBondContact O-N 3.24Å; S229-T233 PolarHBondContact O-OG1 3.32Å; T231-T233 PolarHBondContact O-N 3.14Å; T233-F236 PolarHBondContact O-N 3.46Å; T233-F236 VanDerWaalsContact O-N 3.13Å
234	Y	91.4	Very high	90.9	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-56.9	-35.9	-177.1	-161.9	-91.4	0	0	0	114.9	Q44 K230 T231 F236 D237 L238 C280 F281 K282 G283 L284	Q44-Y234 PolarHBondContact NE2-OH 2.97Å; K230-Y234 WeakPolarHBondContact O-CA 3.49Å; K230-Y234 VanDerWaalsContact O-CB 3.27Å; K230-Y234 WeakPolarHBondContact O-CB 3.1Å; K230-Y234 PolarHBondContact O-N 3.48Å; T231-Y234 VanDerWaalsContact O-CB 3.22Å; T231-Y234 WeakPolarHBondContact O-CB 3.09Å; T231-Y234 PolarHBondContact O-N 3.19Å; Y234-F236 PolarHBondContact O-N 3.19Å; Y234-D237 WeakPolarHBondContact O-CA 3.49Å; Y234-D237 VanDerWaalsContact O-CB 3.3Å; Y234-D237 WeakPolarHBondContact O-CB 3.31Å; Y234-D237 PolarHBondContact O-N 3.09Å; Y234-L238 PolarHBondContact O-N 3.4Å; Y234-L238 VanDerWaalsContact O-N 3.09Å; Y234-C280 VanDerWaalsContact CD1-O 3.29Å; Y234-C280 WeakPolarHBondContact CD1-O 3.43Å; Y234-F281 HydrophobicContact CD1-CD1 4.42Å; Y234-K282 VanDerWaalsContact CE1-O 3.31Å; Y234-K282 WeakPolarHBondContact CE1-O 3.19Å; Y234-K282 PolarHBondContact OH-O 3.24Å; Y234-G283 WeakPolarHBondContact OH-CA 3.09Å; Y234-G283 PolarHBondContact OH-O 3.33Å; Y234-L284 HydrophobicContact CD2-CD1 3.53Å; Y234-L284 HydrophobicContact CE1-CB 4.35Å; Y234-L284 HydrophobicContact CE2-CB 4.28Å; Y234-L284 HydrophobicContact CE2-CD1 3.83Å; Y234-L284 HydrophobicContact CG-CD1 3.99Å; Y234-L284 PolarHBondContact OH-N 3.32Å; Y234-L284 VanDerWaalsContact OH-N 3.17Å
235	P	92.9	Very high	90.7	Very high	24 Å²	24	27.4 Å²	27.4	16%	0.156	14%	0.142	C	C	.	.	H	α-helix	trans	-55.5	-37.4	176.6	-27.8	36.4	0	0	0	113	L232 L238 F239 C280 F281	L232-P235 WeakPolarHBondContact O-CD 3.29Å; P235-L238 WeakPolarHBondContact O-CB 3.1Å; P235-L238 PolarHBondContact O-N 3.33Å; P235-L238 VanDerWaalsContact O-N 3.17Å; P235-F239 HydrophobicContact CB-CE2 4.05Å; P235-F239 HydrophobicContact CB-CZ 3.99Å; P235-F239 WeakPolarHBondContact O-CD1 3.26Å; P235-F239 VanDerWaalsContact O-CD2 3.29Å; P235-F239 WeakPolarHBondContact O-CD2 3.49Å; P235-F239 WeakPolarHBondContact O-CG 3.31Å; P235-F239 PolarHBondContact O-N 3.05Å; P235-C280 HydrophobicContact CB-CB 4.12Å; P235-C280 HydrophobicContact CG-CB 4.1Å; P235-F281 HydrophobicContact CG-CZ 4.36Å
236	F	92.6	Very high	90.2	Very high	58 Å²	58	27.7 Å²	27.7	25%	0.254	14%	0.144	S	C	.	.	H	α-helix	trans	-67.8	-36.3	176.3	-63.6	-74.6	0	0	0	112.7	P180 V183 A184 T233 Y234 L238 F239 K240	P180-F236 HydrophobicContact CB-CB 4.44Å; P180-F236 HydrophobicContact CB-CD1 4.36Å; V183-F236 HydrophobicContact CB-CE1 4.5Å; V183-F236 HydrophobicContact CG1-CD1 4.38Å; V183-F236 HydrophobicContact CG1-CE1 3.75Å; V183-F236 HydrophobicContact CG1-CZ 4.01Å; A184-F236 HydrophobicContact CB-CB 3.73Å; A184-F236 HydrophobicContact CB-CD2 4.27Å; A184-F236 HydrophobicContact CB-CG 4.05Å; T233-F236 PolarHBondContact O-N 3.46Å; T233-F236 VanDerWaalsContact O-N 3.13Å; Y234-F236 PolarHBondContact O-N 3.19Å; F236-L238 VanDerWaalsContact C-N 3.26Å; F236-L238 PolarHBondContact O-N 3.34Å; F236-F239 HydrophobicContact CD1-CD2 4.32Å; F236-F239 PolarHBondContact O-N 3.42Å; F236-K240 VanDerWaalsContact O-CB 3.23Å; F236-K240 WeakPolarHBondContact O-CB 3.47Å; F236-K240 PolarHBondContact O-N 3.45Å
237	D	90.2	Very high	89.4	Confident	38 Å²	38	28.9 Å²	28.9	20%	0.203	16%	0.156	C	C	.	.	H	α-helix	trans	-59.5	-39	172	-90.6	9.4	0	0	0	110.6	K40 K230 Y234 K241	K40-D237 IonicContact NZ-OD2 3.95Å; K230-D237 IonicContact NZ-OD2 2.65Å; K230-D237 PolarHBondContact NZ-OD2 2.84Å; Y234-D237 WeakPolarHBondContact O-CA 3.49Å; Y234-D237 VanDerWaalsContact O-CB 3.3Å; Y234-D237 WeakPolarHBondContact O-CB 3.31Å; Y234-D237 PolarHBondContact O-N 3.09Å; D237-K241 VanDerWaalsContact O-CG 3.32Å; D237-K241 WeakPolarHBondContact O-CG 3.35Å; D237-K241 PolarHBondContact O-N 3.45Å
238	L	90.7	Very high	88.6	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-69.3	-51.5	177.6	-174.5	74.7	0	0	0	111.7	Q44 Y234 P235 F236 K240 K241 R242 I271 G279	Q44-L238 HydrophobicContact CB-CD1 3.65Å; Q44-L238 HydrophobicContact CG-CD1 3.8Å; Q44-L238 WeakPolarHBondContact O-CD1 3.33Å; Y234-L238 PolarHBondContact O-N 3.4Å; Y234-L238 VanDerWaalsContact O-N 3.09Å; P235-L238 WeakPolarHBondContact O-CB 3.1Å; P235-L238 PolarHBondContact O-N 3.33Å; P235-L238 VanDerWaalsContact O-N 3.17Å; F236-L238 VanDerWaalsContact C-N 3.26Å; F236-L238 PolarHBondContact O-N 3.34Å; L238-K240 PolarHBondContact O-N 2.84Å; L238-K241 PolarHBondContact O-N 2.87Å; L238-R242 PolarHBondContact O-N 3.44Å; L238-R242 VanDerWaalsContact O-N 3.1Å; L238-I271 HydrophobicContact CD2-CD1 4.34Å; L238-I271 HydrophobicContact CD2-CG2 4.41Å; L238-G279 VanDerWaalsContact CD2-O 3.31Å; L238-G279 WeakPolarHBondContact CD2-O 3.43Å
239	F	92.7	Very high	87.5	Confident	16 Å²	16	24.4 Å²	24.4	7%	0.07	13%	0.133	C	C	.	.	H	α-helix	trans	-57.3	-42.1	-178.8	-57.8	-24.4	0	0	0	111.4	P180 P235 F236 K241 R242 L243 L264 A268 I271	P180-F239 HydrophobicContact CB-CB 4.28Å; P235-F239 HydrophobicContact CB-CE2 4.05Å; P235-F239 HydrophobicContact CB-CZ 3.99Å; P235-F239 WeakPolarHBondContact O-CD1 3.26Å; P235-F239 VanDerWaalsContact O-CD2 3.29Å; P235-F239 WeakPolarHBondContact O-CD2 3.49Å; P235-F239 WeakPolarHBondContact O-CG 3.31Å; P235-F239 PolarHBondContact O-N 3.05Å; F236-F239 HydrophobicContact CD1-CD2 4.32Å; F236-F239 PolarHBondContact O-N 3.42Å; F239-K241 PolarHBondContact O-N 2.88Å; F239-R242 PolarHBondContact O-N 3.48Å; F239-L243 WeakPolarHBondContact O-CB 3.2Å; F239-L243 WeakPolarHBondContact O-CG 3.49Å; F239-L243 PolarHBondContact O-N 2.88Å; F239-L264 HydrophobicContact CB-CD1 3.74Å; F239-L264 HydrophobicContact CD2-CD1 3.72Å; F239-L264 HydrophobicContact CG-CD1 4.08Å; F239-A268 HydrophobicContact CD2-CB 4.47Å; F239-A268 HydrophobicContact CE1-CB 4.29Å; F239-A268 HydrophobicContact CE2-CB 3.86Å; F239-A268 HydrophobicContact CZ-CB 3.76Å; F239-I271 HydrophobicContact CD1-CD1 3.46Å; F239-I271 VanDerWaalsContact CD1-CD1 3.46Å; F239-I271 HydrophobicContact CE1-CB 4.43Å; F239-I271 HydrophobicContact CE1-CD1 3.57Å; F239-I271 HydrophobicContact CE1-CG2 4.45Å
240	K	92.4	Very high	86.2	Confident	27 Å²	27	34.2 Å²	34.2	12%	0.117	18%	0.175	C	C	.	.	H	α-helix	trans	-52.8	-53.3	173.2	176.3	-175.8	-174.7	167.3	0	112.1	D140 P180 T181 F236 L238 R242 L243 Q244	D140-K240 WeakPolarHBondContact OD2-CE 3.23Å; D140-K240 IonicContact OD2-NZ 2.85Å; D140-K240 PolarHBondContact OD2-NZ 3.33Å; P180-K240 HydrophobicContact CB-CB 4.28Å; P180-K240 HydrophobicContact CG-CB 3.83Å; T181-K240 HydrophobicContact CG2-CD 4.4Å; T181-K240 WeakPolarHBondContact OG1-CD 3.34Å; T181-K240 WeakPolarHBondContact OG1-CE 2.97Å; T181-K240 PolarHBondContact OG1-NZ 2.85Å; F236-K240 VanDerWaalsContact O-CB 3.23Å; F236-K240 WeakPolarHBondContact O-CB 3.47Å; F236-K240 PolarHBondContact O-N 3.45Å; L238-K240 PolarHBondContact O-N 2.84Å; K240-R242 VanDerWaalsContact C-N 3.33Å; K240-R242 PolarHBondContact O-N 3.42Å; K240-L243 PolarHBondContact O-N 3.49Å; K240-Q244 WeakPolarHBondContact O-CB 3.16Å; K240-Q244 WeakPolarHBondContact O-CG 3.26Å; K240-Q244 PolarHBondContact O-N 3.44Å
241	K	91.3	Very high	85	Confident	22 Å²	22	32.6 Å²	32.6	10%	0.096	17%	0.171	C	C	.	.	H	α-helix	trans	-68.6	-34.2	-173.3	-65.6	-69	166.3	-154.1	0	112	I41 D140 T144 D237 L238 F239 Q244 V245	I41-K241 HydrophobicContact CG1-CD 4.5Å; D140-K241 IonicContact OD1-NZ 2.64Å; D140-K241 PolarHBondContact OD1-NZ 3.37Å; D140-K241 IonicContact OD2-NZ 3.18Å; D140-K241 PolarHBondContact OD2-NZ 2.84Å; T144-K241 HydrophobicContact CG2-CB 4.44Å; T144-K241 HydrophobicContact CG2-CD 3.57Å; T144-K241 PolarHBondContact OG1-NZ 3Å; D237-K241 VanDerWaalsContact O-CG 3.32Å; D237-K241 WeakPolarHBondContact O-CG 3.35Å; D237-K241 PolarHBondContact O-N 3.45Å; L238-K241 PolarHBondContact O-N 2.87Å; F239-K241 PolarHBondContact O-N 2.88Å; K241-Q244 PolarHBondContact O-N 3.44Å; K241-V245 WeakPolarHBondContact O-CG2 3.39Å; K241-V245 PolarHBondContact O-N 3.02Å
242	R	89.6	Confident	84	Confident	7 Å²	7	31.1 Å²	31.1	3%	0.026	16%	0.161	C	C	.	.	H	α-helix	trans	-67.4	-45.1	173.7	-71.1	-179.8	173.8	-139.4	6	112.5	Q44 Q46 L238 F239 K240 Q244 V245 A246 Y261 E275	Q44-R242 PolarHBondContact O-NE 3.07Å; Q46-R242 PolarHBondContact O-NH2 3.31Å; L238-R242 PolarHBondContact O-N 3.44Å; L238-R242 VanDerWaalsContact O-N 3.1Å; F239-R242 PolarHBondContact O-N 3.48Å; K240-R242 VanDerWaalsContact C-N 3.33Å; K240-R242 PolarHBondContact O-N 3.42Å; R242-Q244 VanDerWaalsContact C-N 3.33Å; R242-Q244 PolarHBondContact O-N 2.89Å; R242-V245 PolarHBondContact O-N 3.01Å; R242-A246 PolarHBondContact O-N 3.01Å; R242-Y261 HydrophobicContact CB-CD2 4.23Å; R242-Y261 HydrophobicContact CB-CE2 3.89Å; R242-Y261 HydrophobicContact CG-CE2 4.47Å; R242-Y261 PolarHBondContact NH1-OH 3.33Å; R242-E275 IonicContact CZ-OE1 3.96Å; R242-E275 IonicContact CZ-OE2 3.57Å; R242-E275 IonicContact NH1-OE1 2.88Å; R242-E275 PolarHBondContact NH1-OE1 3.22Å; R242-E275 IonicContact NH2-OE1 3.74Å; R242-E275 PolarHBondContact NH2-OE1 3.27Å; R242-E275 IonicContact NH2-OE2 2.71Å; R242-E275 PolarHBondContact NH2-OE2 2.88Å
243	L	89.8	Confident	82.5	Confident	12 Å²	12	29.8 Å²	29.8	6%	0.063	16%	0.163	C	C	.	.	H	α-helix	trans	-63.7	-36.5	175.5	-72.7	167.5	0	0	0	112.5	R176 P180 F239 K240 V245 A246 C267	R176-L243 WeakPolarHBondContact CB-O 3.49Å; P180-L243 HydrophobicContact CG-CD1 4.09Å; F239-L243 WeakPolarHBondContact O-CB 3.2Å; F239-L243 WeakPolarHBondContact O-CG 3.49Å; F239-L243 PolarHBondContact O-N 2.88Å; K240-L243 PolarHBondContact O-N 3.49Å; L243-V245 PolarHBondContact O-N 3.4Å; L243-A246 WeakPolarHBondContact O-CB 3.48Å; L243-A246 PolarHBondContact O-N 3.15Å; L243-C267 HydrophobicContact CD2-CB 4.44Å; L243-C267 HydrophobicContact CG-CB 4.47Å
244	Q	89.8	Confident	81.1	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-65.6	-24.1	177.7	-79.1	177.4	-29.8	0	0	113.7	D140 T141 T144 R145 R176 K240 K241 R242	D140-Q244 PolarHBondContact OD2-NE2 2.92Å; T141-Q244 HydrophobicContact CG2-CB 4.41Å; T141-Q244 HydrophobicContact CG2-CG 4.45Å; T144-Q244 HydrophobicContact CG2-CB 4.08Å; T144-Q244 PolarHBondContact OG1-OE1 2.83Å; R145-Q244 PolarHBondContact NE-O 3.15Å; R176-Q244 VanDerWaalsContact O-CG 3.23Å; R176-Q244 WeakPolarHBondContact O-CG 3.38Å; K240-Q244 WeakPolarHBondContact O-CB 3.16Å; K240-Q244 WeakPolarHBondContact O-CG 3.26Å; K240-Q244 PolarHBondContact O-N 3.44Å; K241-Q244 PolarHBondContact O-N 3.44Å; R242-Q244 VanDerWaalsContact C-N 3.33Å; R242-Q244 PolarHBondContact O-N 2.89Å
245	V	85.3	Confident	79.6	Confident	7 Å²	7	36.8 Å²	36.8	4%	0.042	20%	0.195	C	C	.	.	H	α-helix	trans	-96.5	-8.3	179.2	179.7	0	0	0	0	112.3	L45 T144 A148 K241 R242 L243 G247 F248	L45-V245 HydrophobicContact CD1-CG2 3.85Å; L45-V245 HydrophobicContact CD2-CB 3.88Å; L45-V245 HydrophobicContact CD2-CG1 4.33Å; L45-V245 HydrophobicContact CD2-CG2 3.59Å; L45-V245 HydrophobicContact CG-CG2 4.38Å; T144-V245 HydrophobicContact CG2-CG2 3.83Å; A148-V245 HydrophobicContact CB-CG1 4.44Å; A148-V245 HydrophobicContact CB-CG2 4Å; K241-V245 WeakPolarHBondContact O-CG2 3.39Å; K241-V245 PolarHBondContact O-N 3.02Å; R242-V245 PolarHBondContact O-N 3.01Å; L243-V245 PolarHBondContact O-N 3.4Å; V245-G247 PolarHBondContact O-N 2.94Å; V245-F248 HydrophobicContact CG1-CB 4.33Å; V245-F248 WeakPolarHBondContact O-CB 3.22Å; V245-F248 PolarHBondContact O-N 2.79Å
246	A	78.1	Confident	78	Confident	5 Å²	5	37.1 Å²	37.1	4%	0.041	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	132.5	172.2	0	0	0	0	0	110.5	R145 R176 R242 L243 F248	R145-A246 PolarHBondContact NH2-O 2.91Å; R176-A246 PolarHBondContact NH1-O 3.49Å; R242-A246 PolarHBondContact O-N 3.01Å; L243-A246 WeakPolarHBondContact O-CB 3.48Å; L243-A246 PolarHBondContact O-N 3.15Å; A246-F248 VanDerWaalsContact C-N 3.34Å
247	G	71	Confident	76.7	Confident	39 Å²	39	40.1 Å²	40.1	40%	0.402	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.6	-10.6	-173	0	0	0	0	0	115.1	V245	V245-G247 PolarHBondContact O-N 2.94Å
248	F	73.3	Confident	75.6	Confident	9 Å²	9	40.5 Å²	40.5	4%	0.039	22%	0.221	C	C	.	.			trans	-105	35.8	178.3	-163.6	-120	0	0	0	112.5	R145 Q149 V154 Y155 V245 A246 A251	R145-F248 HydrophobicContact CB-CD1 4.22Å; R145-F248 HydrophobicContact CB-CE1 4.37Å; R145-F248 HydrophobicContact CG-CB 4.46Å; R145-F248 HydrophobicContact CG-CD1 4.35Å; R145-F248 HydrophobicContact CG-CG 4.41Å; Q149-F248 HydrophobicContact CB-CE1 3.76Å; Q149-F248 HydrophobicContact CB-CZ 3.99Å; V154-F248 HydrophobicContact CB-CE2 4.08Å; V154-F248 HydrophobicContact CB-CZ 4.02Å; V154-F248 HydrophobicContact CG1-CE2 3.83Å; V154-F248 HydrophobicContact CG1-CZ 4.28Å; Y155-F248 HydrophobicContact CD1-CE2 4.49Å; Y155-F248 AromaticContact CD2-CE2 3.84Å; Y155-F248 HydrophobicContact CD2-CE2 3.84Å; Y155-F248 AromaticContact CD2-CZ 3.63Å; Y155-F248 HydrophobicContact CD2-CZ 3.63Å; Y155-F248 AromaticContact CE1-CE2 3.88Å; Y155-F248 HydrophobicContact CE1-CE2 3.88Å; Y155-F248 AromaticContact CE2-CD2 3.78Å; Y155-F248 HydrophobicContact CE2-CD2 3.78Å; Y155-F248 HydrophobicContact CE2-CE1 4.13Å; Y155-F248 AromaticContact CE2-CE2 3.12Å; Y155-F248 HydrophobicContact CE2-CE2 3.12Å; Y155-F248 AromaticContact CE2-CZ 3.3Å; Y155-F248 HydrophobicContact CE2-CZ 3.3Å; Y155-F248 HydrophobicContact CG-CE2 4.48Å; Y155-F248 HydrophobicContact CG-CZ 4.41Å; Y155-F248 AromaticContact CZ-CD2 3.66Å; Y155-F248 AromaticContact CZ-CE2 3.14Å; Y155-F248 AromaticContact CZ-CZ 3.85Å; Y155-F248 WeakPolarHBondContact OH-CD2 3.39Å; Y155-F248 VanDerWaalsContact OH-CE2 3.24Å; Y155-F248 WeakPolarHBondContact OH-CE2 3.47Å; V245-F248 HydrophobicContact CG1-CB 4.33Å; V245-F248 WeakPolarHBondContact O-CB 3.22Å; V245-F248 PolarHBondContact O-N 2.79Å; A246-F248 VanDerWaalsContact C-N 3.34Å; F248-A251 HydrophobicContact CD1-CB 3.75Å; F248-A251 HydrophobicContact CD2-CB 3.87Å; F248-A251 HydrophobicContact CE1-CB 3.38Å; F248-A251 HydrophobicContact CE2-CB 3.46Å; F248-A251 VanDerWaalsContact CE2-CB 3.46Å; F248-A251 HydrophobicContact CG-CB 4Å; F248-A251 HydrophobicContact CZ-CB 3.22Å
249	E	68.6	Low	74.7	Confident	53 Å²	53	46.3 Å²	46.3	25%	0.248	24%	0.243	C	C	.	.			trans	-80.9	-40.3	-162	-59.7	177.2	152.6	0	0	112.8	A251 R252 A253 V258 T260	E249-A251 PolarHBondContact O-N 3.36Å; E249-R252 CarbonylContact O-C 3.52Å; E249-R252 WeakPolarHBondContact O-CA 3.42Å; E249-R252 PolarHBondContact O-N 2.98Å; E249-A253 PolarHBondContact O-N 3.09Å; E249-A253 VanDerWaalsContact O-N 3.12Å; E249-V258 HydrophobicContact CB-CB 4.3Å; E249-V258 HydrophobicContact CB-CG1 3.42Å; E249-V258 VanDerWaalsContact CB-CG1 3.42Å; E249-V258 HydrophobicContact CG-CG1 3.47Å; E249-V258 VanDerWaalsContact CG-CG1 3.47Å; E249-T260 VanDerWaalsContact OE1-CA 3.27Å; E249-T260 WeakPolarHBondContact OE1-CA 3.3Å; E249-T260 WeakPolarHBondContact OE1-CB 3.18Å; E249-T260 WeakPolarHBondContact OE1-CG2 3.31Å; E249-T260 PolarHBondContact OE1-N 3.32Å
250	K	64.7	Low	73.8	Confident	206 Å²	206	49.9 Å²	49.9	90%	0.896	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-59.6	-34.9	176	-66.5	-175.5	178.5	-178.5	0	112.1	R252	K250-R252 PolarHBondContact O-N 2.92Å
251	A	64.8	Low	73.2	Confident	16 Å²	16	49.5 Å²	49.5	13%	0.132	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-70.9	-13.8	175.6	0	0	0	0	0	113.4	V154 F248 E249	V154-A251 HydrophobicContact CB-CB 4.1Å; V154-A251 HydrophobicContact CG2-CB 3.5Å; V154-A251 VanDerWaalsContact CG2-CB 3.5Å; F248-A251 HydrophobicContact CD1-CB 3.75Å; F248-A251 HydrophobicContact CD2-CB 3.87Å; F248-A251 HydrophobicContact CE1-CB 3.38Å; F248-A251 HydrophobicContact CE2-CB 3.46Å; F248-A251 VanDerWaalsContact CE2-CB 3.46Å; F248-A251 HydrophobicContact CG-CB 4Å; F248-A251 HydrophobicContact CZ-CB 3.22Å; E249-A251 PolarHBondContact O-N 3.36Å
252	R	69.3	Low	72.7	Confident	14 Å²	14	54.8 Å²	54.8	5%	0.053	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-111.5	-3.7	-175.7	-134.9	-165.6	92.3	169	12.1	113.9	L45 E249 K250 H254 F255 Q257 V258	L45-R252 VanDerWaalsContact CB-NH1 3.31Å; L45-R252 PolarHBondContact O-NH1 3Å; L45-R252 PolarHBondContact O-NH2 3.43Å; E249-R252 CarbonylContact O-C 3.52Å; E249-R252 WeakPolarHBondContact O-CA 3.42Å; E249-R252 PolarHBondContact O-N 2.98Å; K250-R252 PolarHBondContact O-N 2.92Å; R252-H254 PolarHBondContact O-N 2.95Å; R252-F255 HydrophobicContact CG-CB 4.28Å; R252-F255 HydrophobicContact CG-CD2 3.82Å; R252-F255 HydrophobicContact CG-CG 4.44Å; R252-F255 WeakPolarHBondContact O-CB 3.27Å; R252-F255 PolarHBondContact O-N 3.3Å; R252-Q257 PolarHBondContact NH2-O 2.94Å; R252-V258 HydrophobicContact CB-CG2 4.12Å
253	A	62.5	Low	72.5	Confident	65 Å²	65	55.6 Å²	55.6	54%	0.537	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-56.1	-27.1	-177.7	0	0	0	0	0	113.1	E249 F255	E249-A253 PolarHBondContact O-N 3.09Å; E249-A253 VanDerWaalsContact O-N 3.12Å; A253-F255 VanDerWaalsContact C-N 3.3Å; A253-F255 PolarHBondContact O-N 3.02Å
254	H	61.8	Low	72.5	Confident	138 Å²	138	56.8 Å²	56.8	64%	0.639	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-77.2	-4.5	174.7	-75.3	-48.3	0	0	0	115.4	K58 E151 R252	K58-H254 PolarHBondContact NZ-O 2.87Å; E151-H254 PolarHBondContact O-CD2 3.4Å; R252-H254 PolarHBondContact O-N 2.95Å
255	F	59.8	Low	72.6	Confident	16 Å²	16	63.3 Å²	63.3	7%	0.07	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-100.8	-1.4	177.6	-69.9	-79.3	0	0	0	114.4	R42 K58 Y59 E73 A148 G150 R252 A253	R42-F255 VanDerWaalsContact NH1-CE1 3.28Å; K58-F255 HydrophobicContact CD-CD1 3.92Å; Y59-F255 HydrophobicContact CE2-CD1 4.09Å; Y59-F255 HydrophobicContact CE2-CE1 4.37Å; Y59-F255 WeakPolarHBondContact OH-CE1 3.43Å; E73-F255 WeakPolarHBondContact OE1-CZ 3.49Å; A148-F255 WeakPolarHBondContact O-CE2 3.14Å; G150-F255 VanDerWaalsContact CA-CZ 3.45Å; R252-F255 HydrophobicContact CG-CB 4.28Å; R252-F255 HydrophobicContact CG-CD2 3.82Å; R252-F255 HydrophobicContact CG-CG 4.44Å; R252-F255 WeakPolarHBondContact O-CB 3.27Å; R252-F255 PolarHBondContact O-N 3.3Å; A253-F255 VanDerWaalsContact C-N 3.3Å; A253-F255 PolarHBondContact O-N 3.02Å
256	G	60.5	Low	72.8	Confident	32 Å²	32	65.3 Å²	65.3	33%	0.33	36%	0.359	S	S	.	.	S	Bend	trans	118.8	-155.1	-177.1	0	0	0	0	0	112.3	E48	E48-G256 WeakPolarHBondContact OE1-CA 3.45Å
257	Q	63.7	Low	73.3	Confident	121 Å²	121	65 Å²	65	57%	0.565	36%	0.357	S	S	*	.			trans	-60.6	142	-178.8	-70	-177.6	-13.5	0	0	111.5	I47 E48 R252	I47-Q257 HydrophobicContact CD1-CB 4.27Å; I47-Q257 WeakPolarHBondContact CD1-O 3.38Å; E48-Q257 PolarHBondContact OE1-N 3.01Å; R252-Q257 PolarHBondContact NH2-O 2.94Å
258	V	68.1	Low	74.2	Confident	46 Å²	46	64.4 Å²	64.4	28%	0.279	35%	0.348	S	S	.	.			trans	-127.5	134	177.6	-165.1	0	0	0	0	109	E249 R252	E249-V258 HydrophobicContact CB-CB 4.3Å; E249-V258 HydrophobicContact CB-CG1 3.42Å; E249-V258 VanDerWaalsContact CB-CG1 3.42Å; E249-V258 HydrophobicContact CG-CG1 3.47Å; E249-V258 VanDerWaalsContact CG-CG1 3.47Å; R252-V258 HydrophobicContact CB-CG2 4.12Å
259	R	70.9	Confident	75	Confident	122 Å²	122	67.2 Å²	67.2	46%	0.46	37%	0.365	S	S	.	.			trans	-129.4	144	-179.1	-76.8	-68.7	-158.2	178.8	7.2	110.8	I47 Y261 E274	I47-R259 HydrophobicContact CD1-CB 3.99Å; I47-R259 HydrophobicContact CD1-CG 3.83Å; R259-Y261 HydrophobicContact CB-CE2 4.27Å; R259-E274 IonicContact CZ-OE1 3.03Å; R259-E274 IonicContact NE-OE1 3.58Å; R259-E274 IonicContact NH2-OE1 2.81Å; R259-E274 PolarHBondContact NH2-OE1 2.77Å
260	T	73.9	Confident	75.9	Confident	90 Å²	90	66.5 Å²	66.5	55%	0.552	36%	0.362	S	S	*	.			trans	-88.8	137.1	169.4	13.6	0	0	0	0	109	E249	E249-T260 VanDerWaalsContact OE1-CA 3.27Å; E249-T260 WeakPolarHBondContact OE1-CA 3.3Å; E249-T260 WeakPolarHBondContact OE1-CB 3.18Å; E249-T260 WeakPolarHBondContact OE1-CG2 3.31Å; E249-T260 PolarHBondContact OE1-N 3.32Å
261	Y	80.7	Confident	77	Confident	20 Å²	20	56.7 Å²	56.7	8%	0.078	32%	0.32	C	S	.	.			trans	-120.3	130.9	172.9	-57.9	-78.3	0	0	0	108.8	R242 R259 C267 Q270	R242-Y261 HydrophobicContact CB-CD2 4.23Å; R242-Y261 HydrophobicContact CB-CE2 3.89Å; R242-Y261 HydrophobicContact CG-CE2 4.47Å; R242-Y261 PolarHBondContact NH1-OH 3.33Å; R259-Y261 HydrophobicContact CB-CE2 4.27Å; Y261-C267 VanDerWaalsContact CD1-CA 3.49Å; Y261-C267 HydrophobicContact CD1-CB 3.77Å; Y261-C267 HydrophobicContact CE1-CB 4.39Å; Y261-C267 HydrophobicContact CG-CB 3.97Å; Y261-Q270 HydrophobicContact CE1-CB 4.12Å
262	T	80.1	Confident	78.1	Confident	133 Å²	133	59.4 Å²	59.4	82%	0.816	33%	0.334	S	S	*	.			trans	-80	-30.8	-179.3	58.8	0	0	0	0	112	D266	T262-D266 PolarHBondContact N-OD2 2.81Å; T262-D266 WeakPolarHBondContact OG1-CB 3.46Å; T262-D266 VanDerWaalsContact OG1-CG 3.23Å; T262-D266 PolarHBondContact OG1-OD2 2.96Å
263	G	86.3	Confident	79	Confident	24 Å²	24	66 Å²	66	25%	0.247	37%	0.366	C	S	.	.	S	Bend	trans	-165.6	-175	-177.4	0	0	0	0	0	113.9	C267	G263-C267 WeakPolarHBondContact O-CB 3.33Å; G263-C267 PolarHBondContact O-N 3.48Å
264	L	89.6	Confident	80	Confident	36 Å²	36	66.6 Å²	66.6	19%	0.188	36%	0.357	C	S	.	.	H	α-helix	trans	-66.1	-46.2	-178	177	58.1	0	0	0	112.6	P180 F239 C267 A268	P180-L264 HydrophobicContact CB-CD1 3.72Å; P180-L264 HydrophobicContact CB-CD2 4.38Å; P180-L264 HydrophobicContact CG-CD1 4.17Å; F239-L264 HydrophobicContact CB-CD1 3.74Å; F239-L264 HydrophobicContact CD2-CD1 3.72Å; F239-L264 HydrophobicContact CG-CD1 4.08Å; L264-C267 PolarHBondContact O-N 3.4Å; L264-A268 WeakPolarHBondContact O-CB 3.27Å; L264-A268 PolarHBondContact O-N 2.93Å
265	I	91.3	Very high	81	Confident	137 Å²	137	60.4 Å²	60.4	70%	0.703	33%	0.329	S	S	*	.	H	α-helix	trans	-67.2	-47.4	-177.6	-60.9	173	0	0	0	109.7	C267 A268 V269	I265-C267 VanDerWaalsContact C-N 3.33Å; I265-C267 PolarHBondContact O-N 3.19Å; I265-A268 PolarHBondContact O-N 2.75Å; I265-A268 VanDerWaalsContact O-N 3.1Å; I265-V269 HydrophobicContact CG2-CG2 4.34Å; I265-V269 WeakPolarHBondContact O-CG2 3.49Å; I265-V269 PolarHBondContact O-N 2.96Å
266	D	90.1	Very high	82.2	Confident	49 Å²	49	60.6 Å²	60.6	26%	0.262	34%	0.336	S	S	.	.	H	α-helix	trans	-55	-47.5	174.6	-179.4	43.5	0	0	0	111.8	T262 A268 V269 Q270	T262-D266 PolarHBondContact N-OD2 2.81Å; T262-D266 WeakPolarHBondContact OG1-CB 3.46Å; T262-D266 VanDerWaalsContact OG1-CG 3.23Å; T262-D266 PolarHBondContact OG1-OD2 2.96Å; D266-A268 PolarHBondContact O-N 3.25Å; D266-V269 PolarHBondContact O-N 3.35Å; D266-Q270 WeakPolarHBondContact O-CB 3.28Å; D266-Q270 WeakPolarHBondContact O-CG 3.46Å; D266-Q270 PolarHBondContact O-N 2.87Å; D266-Q270 PolarHBondContact OD1-NE2 3.03Å; D266-Q270 PolarHBondContact OD2-NE2 2.99Å
267	C	88	Confident	83.4	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-58.8	-44.9	173.9	-174.6	0	0	0	0	112.6	L243 Y261 G263 L264 I265 I271	L243-C267 HydrophobicContact CD2-CB 4.44Å; L243-C267 HydrophobicContact CG-CB 4.47Å; Y261-C267 VanDerWaalsContact CD1-CA 3.49Å; Y261-C267 HydrophobicContact CD1-CB 3.77Å; Y261-C267 HydrophobicContact CE1-CB 4.39Å; Y261-C267 HydrophobicContact CG-CB 3.97Å; G263-C267 WeakPolarHBondContact O-CB 3.33Å; G263-C267 PolarHBondContact O-N 3.48Å; L264-C267 PolarHBondContact O-N 3.4Å; I265-C267 VanDerWaalsContact C-N 3.33Å; I265-C267 PolarHBondContact O-N 3.19Å; C267-I271 WeakPolarHBondContact O-CB 3.36Å; C267-I271 VanDerWaalsContact O-CD1 3.25Å; C267-I271 WeakPolarHBondContact O-CD1 3.4Å; C267-I271 WeakPolarHBondContact O-CG1 3.36Å; C267-I271 PolarHBondContact O-N 3.03Å; C267-I271 VanDerWaalsContact O-N 3.1Å; C267-I271 VanDerWaalsContact SG-CD1 3.57Å
268	A	90	Very high	84.4	Confident	25 Å²	25	70.1 Å²	70.1	21%	0.207	36%	0.364	C	S	.	.	H	α-helix	trans	-65.3	-44.4	-180	0	0	0	0	0	112.4	F239 L264 I265 D266 V272	F239-A268 HydrophobicContact CD2-CB 4.47Å; F239-A268 HydrophobicContact CE1-CB 4.29Å; F239-A268 HydrophobicContact CE2-CB 3.86Å; F239-A268 HydrophobicContact CZ-CB 3.76Å; L264-A268 WeakPolarHBondContact O-CB 3.27Å; L264-A268 PolarHBondContact O-N 2.93Å; I265-A268 PolarHBondContact O-N 2.75Å; I265-A268 VanDerWaalsContact O-N 3.1Å; D266-A268 PolarHBondContact O-N 3.25Å; A268-V272 WeakPolarHBondContact O-CG2 3.45Å; A268-V272 PolarHBondContact O-N 2.88Å; A268-V272 VanDerWaalsContact O-N 3.14Å
269	V	90.6	Very high	85	Confident	68 Å²	68	68 Å²	68	41%	0.412	35%	0.352	S	S	.	.	H	α-helix	trans	-63.4	-52.6	179.1	172.6	0	0	0	0	110.4	I265 D266 I271 V272 E273	I265-V269 HydrophobicContact CG2-CG2 4.34Å; I265-V269 WeakPolarHBondContact O-CG2 3.49Å; I265-V269 PolarHBondContact O-N 2.96Å; D266-V269 PolarHBondContact O-N 3.35Å; V269-I271 VanDerWaalsContact C-N 3.29Å; V269-I271 PolarHBondContact O-N 2.98Å; V269-V272 PolarHBondContact O-N 3.21Å; V269-V272 VanDerWaalsContact O-N 3.09Å; V269-E273 HydrophobicContact CG1-CG 4.31Å; V269-E273 WeakPolarHBondContact O-CG 3.32Å; V269-E273 PolarHBondContact O-N 3.02Å
270	Q	87.3	Confident	85.7	Confident	38 Å²	38	62.6 Å²	62.6	18%	0.178	33%	0.333	C	S	.	.	H	α-helix	trans	-59.1	-39.5	-179.4	-71.1	-176.3	35.2	0	0	112.5	Y261 D266 E273 E274	Y261-Q270 HydrophobicContact CE1-CB 4.12Å; D266-Q270 WeakPolarHBondContact O-CB 3.28Å; D266-Q270 WeakPolarHBondContact O-CG 3.46Å; D266-Q270 PolarHBondContact O-N 2.87Å; D266-Q270 PolarHBondContact OD1-NE2 3.03Å; D266-Q270 PolarHBondContact OD2-NE2 2.99Å; Q270-E273 PolarHBondContact O-N 3.48Å; Q270-E274 WeakPolarHBondContact O-CB 3.16Å; Q270-E274 PolarHBondContact O-N 3.45Å
271	I	87.4	Confident	86.4	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-65.2	-42.2	177.7	-70.6	165.4	0	0	0	111.2	L238 F239 C267 V269 E275 G276	L238-I271 HydrophobicContact CD2-CD1 4.34Å; L238-I271 HydrophobicContact CD2-CG2 4.41Å; F239-I271 HydrophobicContact CD1-CD1 3.46Å; F239-I271 VanDerWaalsContact CD1-CD1 3.46Å; F239-I271 HydrophobicContact CE1-CB 4.43Å; F239-I271 HydrophobicContact CE1-CD1 3.57Å; F239-I271 HydrophobicContact CE1-CG2 4.45Å; C267-I271 WeakPolarHBondContact O-CB 3.36Å; C267-I271 VanDerWaalsContact O-CD1 3.25Å; C267-I271 WeakPolarHBondContact O-CD1 3.4Å; C267-I271 WeakPolarHBondContact O-CG1 3.36Å; C267-I271 PolarHBondContact O-N 3.03Å; C267-I271 VanDerWaalsContact O-N 3.1Å; C267-I271 VanDerWaalsContact SG-CD1 3.57Å; V269-I271 VanDerWaalsContact C-N 3.29Å; V269-I271 PolarHBondContact O-N 2.98Å; I271-E275 WeakPolarHBondContact O-CA 3.49Å; I271-E275 WeakPolarHBondContact O-CB 3.4Å; I271-E275 PolarHBondContact O-N 3.34Å; I271-G276 PolarHBondContact O-N 2.67Å
272	V	89.3	Confident	86.5	Confident	72 Å²	72	61.7 Å²	61.7	44%	0.436	32%	0.322	S	S	.	.	H	α-helix	trans	-68.3	-39.2	179.8	171.8	0	0	0	0	111	A268 V269 G276	A268-V272 WeakPolarHBondContact O-CG2 3.45Å; A268-V272 PolarHBondContact O-N 2.88Å; A268-V272 VanDerWaalsContact O-N 3.14Å; V269-V272 PolarHBondContact O-N 3.21Å; V269-V272 VanDerWaalsContact O-N 3.09Å; V272-G276 WeakPolarHBondContact O-CA 3.45Å; V272-G276 PolarHBondContact O-N 3.06Å
273	E	87.6	Confident	86.7	Confident	152 Å²	152	55.6 Å²	55.6	71%	0.71	29%	0.286	S	S	*	.	H	α-helix	trans	-71.5	-48.1	179.2	-70.6	-178.6	166	0	0	112.7	V269 Q270	V269-E273 HydrophobicContact CG1-CG 4.31Å; V269-E273 WeakPolarHBondContact O-CG 3.32Å; V269-E273 PolarHBondContact O-N 3.02Å; Q270-E273 PolarHBondContact O-N 3.48Å
274	E	82.7	Confident	86.7	Confident	78 Å²	78	55.8 Å²	55.8	36%	0.364	28%	0.281	S	S	.	.	H	α-helix	trans	-83.5	-42.5	-174.4	-64.6	-172.2	159.1	0	0	112.5	R259 Q270	R259-E274 IonicContact CZ-OE1 3.03Å; R259-E274 IonicContact NE-OE1 3.58Å; R259-E274 IonicContact NH2-OE1 2.81Å; R259-E274 PolarHBondContact NH2-OE1 2.77Å; Q270-E274 WeakPolarHBondContact O-CB 3.16Å; Q270-E274 PolarHBondContact O-N 3.45Å
275	E	82.4	Confident	86.5	Confident	8 Å²	8	58.2 Å²	58.2	4%	0.037	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-18.5	-172.3	-56.9	-176.2	-159.6	0	0	113.4	I47 R242 I271 K282	I47-E275 WeakPolarHBondContact CA-OE1 3.31Å; I47-E275 HydrophobicContact CG2-CG 4.5Å; I47-E275 WeakPolarHBondContact CG2-OE1 3.4Å; R242-E275 IonicContact CZ-OE1 3.96Å; R242-E275 IonicContact CZ-OE2 3.57Å; R242-E275 IonicContact NH1-OE1 2.88Å; R242-E275 PolarHBondContact NH1-OE1 3.22Å; R242-E275 IonicContact NH2-OE1 3.74Å; R242-E275 PolarHBondContact NH2-OE1 3.27Å; R242-E275 IonicContact NH2-OE2 2.71Å; R242-E275 PolarHBondContact NH2-OE2 2.88Å; I271-E275 WeakPolarHBondContact O-CA 3.49Å; I271-E275 WeakPolarHBondContact O-CB 3.4Å; I271-E275 PolarHBondContact O-N 3.34Å; E275-K282 VanDerWaalsContact CD-NZ 3.32Å; E275-K282 IonicContact OE1-NZ 3.09Å; E275-K282 VanDerWaalsContact OE2-CE 3.27Å; E275-K282 WeakPolarHBondContact OE2-CE 3.48Å; E275-K282 IonicContact OE2-NZ 3.86Å; E275-K282 PolarHBondContact OE2-NZ 2.77Å
276	G	86	Confident	86.3	Confident	21 Å²	21	51.8 Å²	51.8	22%	0.216	27%	0.268	C	S	.	.			trans	76.7	173.2	-171.2	0	0	0	0	0	112.9	I271 V272 R278 G279	I271-G276 PolarHBondContact O-N 2.67Å; V272-G276 WeakPolarHBondContact O-CA 3.45Å; V272-G276 PolarHBondContact O-N 3.06Å; G276-R278 PolarHBondContact O-N 3.48Å; G276-R278 VanDerWaalsContact O-N 3.1Å; G276-G279 WeakPolarHBondContact O-CA 3.42Å; G276-G279 PolarHBondContact O-N 3.28Å
277	I	85.2	Confident	86.2	Confident	126 Å²	126	49.6 Å²	49.6	65%	0.646	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-57.3	-31.2	-178.8	-61.9	168.2	0	0	0	112.3	G279 C280 F281	I277-G279 VanDerWaalsContact C-N 3.27Å; I277-G279 PolarHBondContact O-N 3.46Å; I277-C280 WeakPolarHBondContact O-CB 3.07Å; I277-C280 PolarHBondContact O-N 3.01Å; I277-F281 WeakPolarHBondContact O-CD2 3.2Å
278	R	84.3	Confident	86.1	Confident	226 Å²	226	51.9 Å²	51.9	85%	0.853	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-69.1	-24.3	176.6	-66.8	-176.7	-179.2	-176.9	0.8	112.9	G276 C280 F281	G276-R278 PolarHBondContact O-N 3.48Å; G276-R278 VanDerWaalsContact O-N 3.1Å; R278-C280 PolarHBondContact O-N 3.48Å; R278-F281 PolarHBondContact O-N 2.9Å
279	G	81.8	Confident	86	Confident	2 Å²	2	54.1 Å²	54.1	2%	0.021	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-59.5	-35.5	174	0	0	0	0	0	112.5	L238 G276 I277 F281 K282	L238-G279 VanDerWaalsContact CD2-O 3.31Å; L238-G279 WeakPolarHBondContact CD2-O 3.43Å; G276-G279 WeakPolarHBondContact O-CA 3.42Å; G276-G279 PolarHBondContact O-N 3.28Å; I277-G279 VanDerWaalsContact C-N 3.27Å; I277-G279 PolarHBondContact O-N 3.46Å; G279-F281 PolarHBondContact O-N 3.48Å; G279-K282 WeakPolarHBondContact O-CB 3.33Å; G279-K282 WeakPolarHBondContact O-CG 3.1Å; G279-K282 PolarHBondContact O-N 3.31Å; G279-K282 VanDerWaalsContact O-N 3.15Å
280	C	85.3	Confident	85.9	Confident	8 Å²	8	53.1 Å²	53.1	5%	0.054	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-58.9	-20.1	178.1	-63.4	0	0	0	0	114.2	Y234 P235 I277 R278	Y234-C280 VanDerWaalsContact CD1-O 3.29Å; Y234-C280 WeakPolarHBondContact CD1-O 3.43Å; P235-C280 HydrophobicContact CB-CB 4.12Å; P235-C280 HydrophobicContact CG-CB 4.1Å; I277-C280 WeakPolarHBondContact O-CB 3.07Å; I277-C280 PolarHBondContact O-N 3.01Å; R278-C280 PolarHBondContact O-N 3.48Å
281	F	87.6	Confident	85.8	Confident	76 Å²	76	53.2 Å²	53.2	33%	0.333	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-106.2	11.7	-176.3	-62.3	-87.5	0	0	0	113.8	T231 Y234 P235 I277 R278 G279 G283 L284	T231-F281 HydrophobicContact CG2-CE1 4.12Å; T231-F281 WeakPolarHBondContact O-CE1 3.45Å; Y234-F281 HydrophobicContact CD1-CD1 4.42Å; P235-F281 HydrophobicContact CG-CZ 4.36Å; I277-F281 WeakPolarHBondContact O-CD2 3.2Å; R278-F281 PolarHBondContact O-N 2.9Å; G279-F281 PolarHBondContact O-N 3.48Å; F281-G283 PolarHBondContact O-N 2.91Å; F281-L284 HydrophobicContact CD1-CD2 4.22Å; F281-L284 WeakPolarHBondContact O-CB 3.14Å; F281-L284 PolarHBondContact O-N 3.43Å; F281-L284 VanDerWaalsContact O-N 3.1Å
282	K	84.8	Confident	85.7	Confident	15 Å²	15	56.6 Å²	56.6	7%	0.065	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	129.6	175.8	-76.8	175.6	174.1	178.1	0	111.6	Q44 Q46 I47 E48 V50 Y234 E275 G279	Q44-K282 VanDerWaalsContact CG-O 3.29Å; Q44-K282 WeakPolarHBondContact CG-O 3.38Å; Q46-K282 PolarHBondContact O-NZ 3.34Å; I47-K282 PolarHBondContact O-NZ 3.49Å; E48-K282 WeakPolarHBondContact O-CE 3.42Å; E48-K282 PolarHBondContact O-NZ 2.68Å; V50-K282 HydrophobicContact CG2-CD 4.37Å; V50-K282 HydrophobicContact CG2-CG 4.21Å; Y234-K282 VanDerWaalsContact CE1-O 3.31Å; Y234-K282 WeakPolarHBondContact CE1-O 3.19Å; Y234-K282 PolarHBondContact OH-O 3.24Å; E275-K282 VanDerWaalsContact CD-NZ 3.32Å; E275-K282 IonicContact OE1-NZ 3.09Å; E275-K282 VanDerWaalsContact OE2-CE 3.27Å; E275-K282 WeakPolarHBondContact OE2-CE 3.48Å; E275-K282 IonicContact OE2-NZ 3.86Å; E275-K282 PolarHBondContact OE2-NZ 2.77Å; G279-K282 WeakPolarHBondContact O-CB 3.33Å; G279-K282 WeakPolarHBondContact O-CG 3.1Å; G279-K282 PolarHBondContact O-N 3.31Å; G279-K282 VanDerWaalsContact O-N 3.15Å
283	G	83.7	Confident	85.6	Confident	6 Å²	6	55.7 Å²	55.7	6%	0.062	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.1	7.5	-176.6	0	0	0	0	0	114.2	Y234 F281 P286 S287	Y234-G283 WeakPolarHBondContact OH-CA 3.09Å; Y234-G283 PolarHBondContact OH-O 3.33Å; F281-G283 PolarHBondContact O-N 2.91Å; G283-P286 WeakPolarHBondContact O-CD 3.34Å; G283-P286 VanDerWaalsContact O-CG 3.31Å; G283-P286 WeakPolarHBondContact O-CG 3.24Å; G283-S287 WeakPolarHBondContact O-CB 3.31Å; G283-S287 PolarHBondContact O-N 3.48Å; G283-S287 VanDerWaalsContact O-N 3.13Å
284	L	86.2	Confident	85.6	Confident	28 Å²	28	50.1 Å²	50.1	15%	0.147	27%	0.272	C	S	.	.	H	α-helix	trans	-62	-46.2	175.3	-179	64.5	0	0	0	110.7	T231 Y234 F281 S287 L288	T231-L284 HydrophobicContact CG2-CD2 4.18Å; Y234-L284 HydrophobicContact CD2-CD1 3.53Å; Y234-L284 HydrophobicContact CE1-CB 4.35Å; Y234-L284 HydrophobicContact CE2-CB 4.28Å; Y234-L284 HydrophobicContact CE2-CD1 3.83Å; Y234-L284 HydrophobicContact CG-CD1 3.99Å; Y234-L284 PolarHBondContact OH-N 3.32Å; Y234-L284 VanDerWaalsContact OH-N 3.17Å; F281-L284 HydrophobicContact CD1-CD2 4.22Å; F281-L284 WeakPolarHBondContact O-CB 3.14Å; F281-L284 PolarHBondContact O-N 3.43Å; F281-L284 VanDerWaalsContact O-N 3.1Å; L284-S287 CarbonylContact O-C 3.35Å; L284-S287 WeakPolarHBondContact O-CA 3.5Å; L284-S287 VanDerWaalsContact O-CB 3.3Å; L284-S287 WeakPolarHBondContact O-CB 3.37Å; L284-S287 PolarHBondContact O-N 3.24Å; L284-L288 HydrophobicContact CD1-CD1 4.24Å; L284-L288 HydrophobicContact CD1-CD2 4.3Å; L284-L288 HydrophobicContact CD1-CG 4.03Å; L284-L288 HydrophobicContact CD2-CD1 4.44Å; L284-L288 HydrophobicContact CG-CD1 3.95Å; L284-L288 HydrophobicContact CG-CG 4.15Å; L284-L288 WeakPolarHBondContact O-CG 3.44Å; L284-L288 PolarHBondContact O-N 2.86Å
285	S	86.1	Confident	85.6	Confident	86 Å²	86	49.5 Å²	49.5	60%	0.601	27%	0.274	S	S	*	.	H	α-helix	trans	-55.8	-53.6	179.3	-40.9	0	0	0	0	113.6	S287 L288 L289	S285-S287 PolarHBondContact O-N 3.48Å; S285-L288 PolarHBondContact O-N 3.33Å; S285-L289 PolarHBondContact O-N 2.99Å
286	P	86.1	Confident	85.7	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.013	29%	0.293	C	S	.	.	H	α-helix	trans	-63.6	-29.8	174.4	23.1	-32.1	0	0	0	112.4	I39 K40 I62 G283 K290	I39-P286 HydrophobicContact CG2-CB 4.25Å; K40-P286 HydrophobicContact CB-CB 4.31Å; K40-P286 HydrophobicContact CB-CG 4.34Å; I62-P286 HydrophobicContact CD1-CB 4.26Å; G283-P286 WeakPolarHBondContact O-CD 3.34Å; G283-P286 VanDerWaalsContact O-CG 3.31Å; G283-P286 WeakPolarHBondContact O-CG 3.24Å; P286-K290 WeakPolarHBondContact O-CB 3.32Å; P286-K290 PolarHBondContact O-N 2.87Å
287	S	87.5	Confident	85.9	Confident	4 Å²	4	53.3 Å²	53.3	3%	0.028	30%	0.297	C	S	.	.	H	α-helix	trans	-68.6	-37.5	175.2	-167.4	0	0	0	0	113.4	K40 K230 G283 L284 S285 A291	K40-S287 PolarHBondContact NZ-OG 3.42Å; K230-S287 VanDerWaalsContact CE-OG 3.26Å; K230-S287 WeakPolarHBondContact CE-OG 3.3Å; G283-S287 WeakPolarHBondContact O-CB 3.31Å; G283-S287 PolarHBondContact O-N 3.48Å; G283-S287 VanDerWaalsContact O-N 3.13Å; L284-S287 CarbonylContact O-C 3.35Å; L284-S287 WeakPolarHBondContact O-CA 3.5Å; L284-S287 VanDerWaalsContact O-CB 3.3Å; L284-S287 WeakPolarHBondContact O-CB 3.37Å; L284-S287 PolarHBondContact O-N 3.24Å; S285-S287 PolarHBondContact O-N 3.48Å; S287-A291 PolarHBondContact O-N 2.83Å; S287-A291 VanDerWaalsContact O-N 3.12Å
288	L	87.1	Confident	85.9	Confident	48 Å²	48	50.3 Å²	50.3	25%	0.251	28%	0.284	S	S	.	.	H	α-helix	trans	-73.4	-43.4	177.7	-68.4	178.2	0	0	0	110.8	M227 L284 S285 K290 A291 A292	M227-L288 HydrophobicContact CE-CD2 4.2Å; M227-L288 HydrophobicContact CG-CD2 4.3Å; L284-L288 HydrophobicContact CD1-CD1 4.24Å; L284-L288 HydrophobicContact CD1-CD2 4.3Å; L284-L288 HydrophobicContact CD1-CG 4.03Å; L284-L288 HydrophobicContact CD2-CD1 4.44Å; L284-L288 HydrophobicContact CG-CD1 3.95Å; L284-L288 HydrophobicContact CG-CG 4.15Å; L284-L288 WeakPolarHBondContact O-CG 3.44Å; L284-L288 PolarHBondContact O-N 2.86Å; S285-L288 PolarHBondContact O-N 3.33Å; L288-K290 VanDerWaalsContact C-N 3.32Å; L288-K290 PolarHBondContact O-N 2.96Å; L288-A291 WeakPolarHBondContact O-CB 3.32Å; L288-A291 PolarHBondContact O-N 3.12Å; L288-A291 VanDerWaalsContact O-N 3.09Å; L288-A292 PolarHBondContact O-N 3.17Å
289	L	88.1	Confident	86	Confident	72 Å²	72	45.1 Å²	45.1	38%	0.377	27%	0.268	S	S	.	.	H	α-helix	trans	-59.5	-44.6	174.7	-178.9	58.6	0	0	0	111.3	F36 I62 S285 A291 A292 L293	F36-L289 HydrophobicContact CD1-CD2 4.14Å; F36-L289 HydrophobicContact CD1-CG 4.42Å; F36-L289 HydrophobicContact CE1-CD2 3.5Å; F36-L289 HydrophobicContact CE1-CG 4Å; F36-L289 HydrophobicContact CZ-CD2 4.27Å; I62-L289 HydrophobicContact CD1-CD2 4.34Å; S285-L289 PolarHBondContact O-N 2.99Å; L289-A291 VanDerWaalsContact C-N 3.33Å; L289-A291 PolarHBondContact O-N 3.48Å; L289-A292 PolarHBondContact O-N 2.97Å; L289-L293 HydrophobicContact CD1-CD1 4.15Å; L289-L293 HydrophobicContact CD1-CG 4.34Å; L289-L293 HydrophobicContact CG-CD1 4.17Å; L289-L293 WeakPolarHBondContact O-CG 3.09Å; L289-L293 PolarHBondContact O-N 3.48Å
290	K	87.9	Confident	86.4	Confident	47 Å²	47	50.6 Å²	50.6	20%	0.204	29%	0.292	C	S	.	.	H	α-helix	trans	-54.4	-48.9	171.5	169.9	178.3	176.4	-170.3	0	111.7	I33 F36 D37 P286 L288 A292 L293 S294	I33-K290 HydrophobicContact CG2-CD 3.82Å; I33-K290 HydrophobicContact CG2-CG 3.64Å; F36-K290 HydrophobicContact CB-CB 4.07Å; D37-K290 WeakPolarHBondContact OD1-CD 3.37Å; D37-K290 VanDerWaalsContact OD1-CE 3.3Å; D37-K290 WeakPolarHBondContact OD1-CE 3.4Å; D37-K290 IonicContact OD1-NZ 3.45Å; D37-K290 PolarHBondContact OD1-NZ 3.24Å; D37-K290 WeakPolarHBondContact OD2-CE 3.46Å; D37-K290 IonicContact OD2-NZ 2.69Å; D37-K290 PolarHBondContact OD2-NZ 2.8Å; P286-K290 WeakPolarHBondContact O-CB 3.32Å; P286-K290 PolarHBondContact O-N 2.87Å; L288-K290 VanDerWaalsContact C-N 3.32Å; L288-K290 PolarHBondContact O-N 2.96Å; K290-A292 VanDerWaalsContact C-N 3.34Å; K290-A292 PolarHBondContact O-N 3.44Å; K290-L293 PolarHBondContact O-N 3.44Å; K290-S294 WeakPolarHBondContact O-CB 3.39Å; K290-S294 PolarHBondContact O-N 2.92Å
291	A	84.8	Confident	86.7	Confident	40 Å²	40	53 Å²	53	33%	0.331	30%	0.3	S	S	.	.	H	α-helix	trans	-62.4	-42.8	-176.2	0	0	0	0	0	111.5	S287 L288 L289 T295	S287-A291 PolarHBondContact O-N 2.83Å; S287-A291 VanDerWaalsContact O-N 3.12Å; L288-A291 WeakPolarHBondContact O-CB 3.32Å; L288-A291 PolarHBondContact O-N 3.12Å; L288-A291 VanDerWaalsContact O-N 3.09Å; L289-A291 VanDerWaalsContact C-N 3.33Å; L289-A291 PolarHBondContact O-N 3.48Å; A291-T295 PolarHBondContact O-N 3.2Å; A291-T295 PolarHBondContact O-OG1 3.14Å
292	A	84.8	Confident	86.7	Confident	71 Å²	71	52.1 Å²	52.1	59%	0.587	29%	0.294	S	S	*	.	H	α-helix	trans	-60.3	-49.1	176.4	0	0	0	0	0	112.1	L288 L289 K290	L288-A292 PolarHBondContact O-N 3.17Å; L289-A292 PolarHBondContact O-N 2.97Å; K290-A292 VanDerWaalsContact C-N 3.34Å; K290-A292 PolarHBondContact O-N 3.44Å
293	L	88	Confident	86.7	Confident	54 Å²	54	56.7 Å²	56.7	28%	0.283	32%	0.316	S	S	.	.	H	α-helix	trans	-69.1	-38.8	-179.6	-66.8	174.4	0	0	0	112.7	I33 F36 L289 K290 T295 G296 F297	I33-L293 HydrophobicContact CD1-CB 3.72Å; F36-L293 HydrophobicContact CD2-CD1 4.25Å; F36-L293 HydrophobicContact CE1-CD1 4.35Å; F36-L293 HydrophobicContact CE2-CD1 3.48Å; F36-L293 VanDerWaalsContact CE2-CD1 3.48Å; F36-L293 HydrophobicContact CZ-CD1 3.54Å; L289-L293 HydrophobicContact CD1-CD1 4.15Å; L289-L293 HydrophobicContact CD1-CG 4.34Å; L289-L293 HydrophobicContact CG-CD1 4.17Å; L289-L293 WeakPolarHBondContact O-CG 3.09Å; L289-L293 PolarHBondContact O-N 3.48Å; K290-L293 PolarHBondContact O-N 3.44Å; L293-T295 VanDerWaalsContact C-N 3.33Å; L293-T295 PolarHBondContact O-N 3.25Å; L293-G296 PolarHBondContact O-N 2.86Å; L293-F297 HydrophobicContact CB-CE2 4.32Å; L293-F297 WeakPolarHBondContact O-CB 3.33Å; L293-F297 WeakPolarHBondContact O-CG 3.44Å; L293-F297 PolarHBondContact O-N 3.34Å
294	S	86.4	Confident	87	Confident	35 Å²	35	61 Å²	61	25%	0.245	33%	0.333	C	S	.	.	H	α-helix	trans	-61	-42.4	-177.2	-173.4	0	0	0	0	111.9	K290 T298	K290-S294 WeakPolarHBondContact O-CB 3.39Å; K290-S294 PolarHBondContact O-N 2.92Å; S294-T298 WeakPolarHBondContact O-CB 3.23Å; S294-T298 PolarHBondContact O-N 3.49Å; S294-T298 PolarHBondContact O-OG1 3.38Å
295	T	82.8	Confident	87.2	Confident	65 Å²	65	62 Å²	62	40%	0.399	34%	0.336	S	S	.	.	H	α-helix	trans	-64.7	-48.7	178.9	-54.2	0	0	0	0	110.6	A291 L293 F297 T298 F299	A291-T295 PolarHBondContact O-N 3.2Å; A291-T295 PolarHBondContact O-OG1 3.14Å; L293-T295 VanDerWaalsContact C-N 3.33Å; L293-T295 PolarHBondContact O-N 3.25Å; T295-F297 PolarHBondContact O-N 3.33Å; T295-T298 PolarHBondContact O-N 3.4Å; T295-F299 HydrophobicContact CG2-CD2 4.03Å; T295-F299 HydrophobicContact CG2-CE2 3.77Å; T295-F299 VanDerWaalsContact O-CD2 3.24Å; T295-F299 WeakPolarHBondContact O-CD2 3.39Å; T295-F299 PolarHBondContact O-N 3.46Å
296	G	84.8	Confident	87.2	Confident	43 Å²	43	58.9 Å²	58.9	44%	0.443	31%	0.313	S	S	.	.	H	α-helix	trans	-60	-47.1	179.3	0	0	0	0	0	112.9	L293 T298 F299 F300	L293-G296 PolarHBondContact O-N 2.86Å; G296-T298 PolarHBondContact O-N 3.47Å; G296-F299 PolarHBondContact O-N 3.42Å; G296-F300 WeakPolarHBondContact O-CB 3.48Å; G296-F300 PolarHBondContact O-N 2.94Å
297	F	90.1	Very high	87.3	Confident	65 Å²	65	63.3 Å²	63.3	29%	0.285	34%	0.336	S	S	.	.	H	α-helix	trans	-65.5	-37.6	178.3	-70.6	-16.7	0	0	0	113.1	T29 L32 I33 L293 T295 F299 F300 W301	T29-F297 HydrophobicContact CG2-CB 3.7Å; T29-F297 PolarHBondContact OG1-O 2.97Å; L32-F297 HydrophobicContact CB-CD2 4.02Å; L32-F297 HydrophobicContact CB-CE2 3.96Å; L32-F297 HydrophobicContact CD1-CD2 4.12Å; L32-F297 HydrophobicContact CD1-CE2 4.21Å; L32-F297 HydrophobicContact CD1-CG 4.45Å; I33-F297 HydrophobicContact CD1-CD2 3.86Å; I33-F297 HydrophobicContact CD1-CE2 4.17Å; I33-F297 HydrophobicContact CG1-CD2 4.15Å; L293-F297 HydrophobicContact CB-CE2 4.32Å; L293-F297 WeakPolarHBondContact O-CB 3.33Å; L293-F297 WeakPolarHBondContact O-CG 3.44Å; L293-F297 PolarHBondContact O-N 3.34Å; T295-F297 PolarHBondContact O-N 3.33Å; F297-F299 PolarHBondContact O-N 3.04Å; F297-F300 PolarHBondContact O-N 2.8Å; F297-W301 WeakPolarHBondContact O-CB 3.15Å; F297-W301 PolarHBondContact O-N 2.94Å
298	T	86.7	Confident	87.3	Confident	63 Å²	63	65.8 Å²	65.8	39%	0.387	35%	0.351	S	S	.	.	H	α-helix	trans	-60.7	-47.5	179.4	-57.6	0	0	0	0	110.9	S294 T295 G296 Y302	S294-T298 WeakPolarHBondContact O-CB 3.23Å; S294-T298 PolarHBondContact O-N 3.49Å; S294-T298 PolarHBondContact O-OG1 3.38Å; T295-T298 PolarHBondContact O-N 3.4Å; G296-T298 PolarHBondContact O-N 3.47Å; T298-Y302 WeakPolarHBondContact O-CB 3.25Å; T298-Y302 PolarHBondContact O-N 2.95Å
299	F	86.1	Confident	87.3	Confident	117 Å²	117	65.8 Å²	65.8	51%	0.513	35%	0.352	S	S	.	.	H	α-helix	trans	-67.3	-47.6	178.2	-74.9	-69.1	0	0	0	111.9	T295 G296 F297 W301 Y302 E303	T295-F299 HydrophobicContact CG2-CD2 4.03Å; T295-F299 HydrophobicContact CG2-CE2 3.77Å; T295-F299 VanDerWaalsContact O-CD2 3.24Å; T295-F299 WeakPolarHBondContact O-CD2 3.39Å; T295-F299 PolarHBondContact O-N 3.46Å; G296-F299 PolarHBondContact O-N 3.42Å; F297-F299 PolarHBondContact O-N 3.04Å; F299-W301 PolarHBondContact O-N 3.42Å; F299-Y302 PolarHBondContact O-N 3.1Å; F299-E303 WeakPolarHBondContact O-CG 3.3Å; F299-E303 PolarHBondContact O-N 3.43Å
300	F	90.4	Very high	87.1	Confident	118 Å²	118	63 Å²	63	52%	0.518	34%	0.338	S	S	.	.	H	α-helix	trans	-57.2	-51.2	-179.8	177.2	-93.3	0	0	0	112.3	G296 F297 E303 F304	G296-F300 WeakPolarHBondContact O-CB 3.48Å; G296-F300 PolarHBondContact O-N 2.94Å; F297-F300 PolarHBondContact O-N 2.8Å; F300-E303 PolarHBondContact O-N 3.49Å; F300-F304 WeakPolarHBondContact O-CB 3.42Å; F300-F304 PolarHBondContact O-N 3.27Å
301	W	90.3	Very high	87	Confident	58 Å²	58	65 Å²	65	22%	0.22	35%	0.351	C	S	.	.	H	α-helix	trans	-71.1	-34.3	-178.2	-74.2	111.3	0	0	0	112.4	V28 L32 F297 F299 F304 F305	V28-W301 HydrophobicContact CB-CD2 4.28Å; V28-W301 HydrophobicContact CB-CG 4.4Å; V28-W301 HydrophobicContact CG1-CD2 3.65Å; V28-W301 VanDerWaalsContact CG1-CE2 3.43Å; V28-W301 HydrophobicContact CG1-CE3 4.11Å; V28-W301 HydrophobicContact CG1-CG 4.09Å; V28-W301 HydrophobicContact CG1-CH2 4.16Å; V28-W301 HydrophobicContact CG1-CZ2 3.71Å; V28-W301 HydrophobicContact CG1-CZ3 4.34Å; L32-W301 HydrophobicContact CD1-CZ2 4.15Å; L32-W301 VanDerWaalsContact CD1-NE1 3.25Å; F297-W301 WeakPolarHBondContact O-CB 3.15Å; F297-W301 PolarHBondContact O-N 2.94Å; F299-W301 PolarHBondContact O-N 3.42Å; W301-F304 HydrophobicContact CE3-CB 4.45Å; W301-F304 AromaticContact CE3-CD1 3.9Å; W301-F304 HydrophobicContact CE3-CD1 3.9Å; W301-F304 HydrophobicContact CE3-CG 4.35Å; W301-F304 AromaticContact CZ3-CD1 3.86Å; W301-F304 HydrophobicContact CZ3-CD1 3.86Å; W301-F304 HydrophobicContact CZ3-CE1 4.1Å; W301-F304 HydrophobicContact CZ3-CG 4.42Å; W301-F304 PolarHBondContact O-N 3.28Å; W301-F305 HydrophobicContact CB-CD2 4.41Å; W301-F305 HydrophobicContact CB-CE2 4.37Å; W301-F305 HydrophobicContact CD2-CE2 4.48Å; W301-F305 HydrophobicContact CE3-CD2 4.41Å; W301-F305 AromaticContact CE3-CE2 3.75Å; W301-F305 HydrophobicContact CE3-CE2 3.75Å; W301-F305 HydrophobicContact CE3-CZ 4.15Å; W301-F305 HydrophobicContact CZ3-CE2 4.48Å; W301-F305 HydrophobicContact CZ3-CZ 4.44Å; W301-F305 WeakPolarHBondContact O-CD2 3.41Å; W301-F305 PolarHBondContact O-N 3.22Å
302	Y	87.2	Confident	87.1	Confident	57 Å²	57	67.1 Å²	67.1	22%	0.224	36%	0.356	C	S	.	.	H	α-helix	trans	-58.4	-52.6	172.3	171.9	-100.8	0	0	0	111.1	A21 T298 F299 F304 F305 L306	A21-Y302 HydrophobicContact CB-CD2 4.31Å; A21-Y302 HydrophobicContact CB-CE2 4.38Å; T298-Y302 WeakPolarHBondContact O-CB 3.25Å; T298-Y302 PolarHBondContact O-N 2.95Å; F299-Y302 PolarHBondContact O-N 3.1Å; Y302-F304 PolarHBondContact O-N 2.89Å; Y302-F305 PolarHBondContact O-N 2.94Å; Y302-L306 HydrophobicContact CE1-CD2 4.06Å; Y302-L306 VanDerWaalsContact O-CB 3.25Å; Y302-L306 WeakPolarHBondContact O-CB 3.4Å; Y302-L306 PolarHBondContact O-N 3.46Å
303	E	86.1	Confident	87.1	Confident	112 Å²	112	65.6 Å²	65.6	52%	0.523	34%	0.335	S	S	.	.	H	α-helix	trans	-63.2	-41.1	179.2	-71.4	-179.6	176.2	0	0	112	F299 F300 L306 N307	F299-E303 WeakPolarHBondContact O-CG 3.3Å; F299-E303 PolarHBondContact O-N 3.43Å; F300-E303 PolarHBondContact O-N 3.49Å; E303-L306 PolarHBondContact O-N 3.19Å; E303-N307 WeakPolarHBondContact O-CB 3.29Å; E303-N307 PolarHBondContact O-N 3.21Å; E303-N307 PolarHBondContact O-ND2 2.88Å
304	F	90.6	Very high	86.9	Confident	96 Å²	96	67.9 Å²	67.9	42%	0.421	34%	0.344	S	S	.	.	H	α-helix	trans	-58.3	-53	176.5	178.3	-95.3	0	0	0	112	F300 W301 Y302 L306 N307 V308	F300-F304 WeakPolarHBondContact O-CB 3.42Å; F300-F304 PolarHBondContact O-N 3.27Å; W301-F304 HydrophobicContact CE3-CB 4.45Å; W301-F304 AromaticContact CE3-CD1 3.9Å; W301-F304 HydrophobicContact CE3-CD1 3.9Å; W301-F304 HydrophobicContact CE3-CG 4.35Å; W301-F304 AromaticContact CZ3-CD1 3.86Å; W301-F304 HydrophobicContact CZ3-CD1 3.86Å; W301-F304 HydrophobicContact CZ3-CE1 4.1Å; W301-F304 HydrophobicContact CZ3-CG 4.42Å; W301-F304 PolarHBondContact O-N 3.28Å; Y302-F304 PolarHBondContact O-N 2.89Å; F304-L306 VanDerWaalsContact C-N 3.33Å; F304-L306 PolarHBondContact O-N 3.2Å; F304-N307 PolarHBondContact O-N 2.75Å; F304-V308 HydrophobicContact CD1-CG2 4.44Å; F304-V308 HydrophobicContact CE1-CG2 4.08Å; F304-V308 HydrophobicContact CE2-CG2 4.46Å; F304-V308 HydrophobicContact CZ-CG2 4.09Å; F304-V308 VanDerWaalsContact O-CG2 3.3Å; F304-V308 WeakPolarHBondContact O-CG2 3.24Å; F304-V308 PolarHBondContact O-N 2.8Å
305	F	90.3	Very high	86.8	Confident	48 Å²	48	73.6 Å²	73.6	21%	0.211	37%	0.365	C	S	.	.	H	α-helix	trans	-67.5	-35.2	-179.6	-75.5	-61.6	0	0	0	112.4	A21 A24 V28 W301 Y302 V308 L309	A21-F305 HydrophobicContact CB-CB 3.88Å; A24-F305 HydrophobicContact CB-CD1 4.12Å; A24-F305 HydrophobicContact CB-CD2 3.75Å; A24-F305 HydrophobicContact CB-CE1 4.23Å; A24-F305 HydrophobicContact CB-CE2 3.88Å; A24-F305 HydrophobicContact CB-CG 3.9Å; A24-F305 HydrophobicContact CB-CZ 4.13Å; V28-F305 HydrophobicContact CB-CE2 4.4Å; V28-F305 HydrophobicContact CG2-CE2 3.88Å; V28-F305 HydrophobicContact CG2-CZ 3.87Å; W301-F305 HydrophobicContact CB-CD2 4.41Å; W301-F305 HydrophobicContact CB-CE2 4.37Å; W301-F305 HydrophobicContact CD2-CE2 4.48Å; W301-F305 HydrophobicContact CE3-CD2 4.41Å; W301-F305 AromaticContact CE3-CE2 3.75Å; W301-F305 HydrophobicContact CE3-CE2 3.75Å; W301-F305 HydrophobicContact CE3-CZ 4.15Å; W301-F305 HydrophobicContact CZ3-CE2 4.48Å; W301-F305 HydrophobicContact CZ3-CZ 4.44Å; W301-F305 WeakPolarHBondContact O-CD2 3.41Å; W301-F305 PolarHBondContact O-N 3.22Å; Y302-F305 PolarHBondContact O-N 2.94Å; F305-V308 PolarHBondContact O-N 2.93Å; F305-L309 WeakPolarHBondContact O-CG 3.49Å; F305-L309 PolarHBondContact O-N 3.01Å
306	L	85.9	Confident	86.7	Confident	22 Å²	22	78.5 Å²	78.5	12%	0.115	38%	0.376	C	S	.	.	H	α-helix	trans	-61.6	-49.3	176.1	-163.7	72.4	0	0	0	111	P13 A18 A21 Y302 E303 F304 V308 L309 C310	P13-L306 HydrophobicContact CB-CD1 3.6Å; P13-L306 HydrophobicContact CB-CD2 4.31Å; P13-L306 HydrophobicContact CB-CG 4.12Å; P13-L306 HydrophobicContact CG-CD1 4.28Å; P13-L306 HydrophobicContact CG-CD2 4.19Å; A18-L306 HydrophobicContact CB-CD1 4.4Å; A21-L306 HydrophobicContact CB-CB 4.05Å; A21-L306 HydrophobicContact CB-CD1 3.93Å; Y302-L306 HydrophobicContact CE1-CD2 4.06Å; Y302-L306 VanDerWaalsContact O-CB 3.25Å; Y302-L306 WeakPolarHBondContact O-CB 3.4Å; Y302-L306 PolarHBondContact O-N 3.46Å; E303-L306 PolarHBondContact O-N 3.19Å; F304-L306 VanDerWaalsContact C-N 3.33Å; F304-L306 PolarHBondContact O-N 3.2Å; L306-V308 VanDerWaalsContact C-N 3.31Å; L306-V308 PolarHBondContact O-N 3.35Å; L306-L309 PolarHBondContact O-N 3.4Å; L306-C310 PolarHBondContact O-N 3.11Å; L306-C310 PolarHBondContact O-SG 3.09Å; L306-C310 VanDerWaalsContact O-SG 3.35Å
307	N	86.7	Confident	86.5	Confident	94 Å²	94	80.3 Å²	80.3	50%	0.503	37%	0.373	S	S	.	.	H	α-helix	trans	-62.1	-39.5	177.9	-70.2	-20.6	0	0	0	111.8	E303 F304 N311	E303-N307 WeakPolarHBondContact O-CB 3.29Å; E303-N307 PolarHBondContact O-N 3.21Å; E303-N307 PolarHBondContact O-ND2 2.88Å; F304-N307 PolarHBondContact O-N 2.75Å; N307-N311 VanDerWaalsContact O-CB 3.26Å; N307-N311 WeakPolarHBondContact O-CB 3.32Å; N307-N311 PolarHBondContact O-N 2.96Å; N307-N311 PolarHBondContact O-ND2 3.19Å
308	V	89.2	Confident	85.7	Confident	56 Å²	56	78.9 Å²	78.9	34%	0.339	38%	0.376	S	S	.	.	H	α-helix	trans	-62.4	-45.4	175.4	169.3	0	0	0	0	111.3	F304 F305 L306 N311 I312	F304-V308 HydrophobicContact CD1-CG2 4.44Å; F304-V308 HydrophobicContact CE1-CG2 4.08Å; F304-V308 HydrophobicContact CE2-CG2 4.46Å; F304-V308 HydrophobicContact CZ-CG2 4.09Å; F304-V308 VanDerWaalsContact O-CG2 3.3Å; F304-V308 WeakPolarHBondContact O-CG2 3.24Å; F304-V308 PolarHBondContact O-N 2.8Å; F305-V308 PolarHBondContact O-N 2.93Å; L306-V308 VanDerWaalsContact C-N 3.31Å; L306-V308 PolarHBondContact O-N 3.35Å; V308-N311 PolarHBondContact O-N 2.94Å; V308-I312 HydrophobicContact CG1-CD1 3.86Å; V308-I312 WeakPolarHBondContact O-CD1 3.25Å; V308-I312 VanDerWaalsContact O-CG1 3.25Å; V308-I312 WeakPolarHBondContact O-CG1 3.49Å; V308-I312 PolarHBondContact O-N 3.48Å
309	L	87.1	Confident	84.7	Confident	49 Å²	49	82.9 Å²	82.9	26%	0.257	39%	0.39	S	S	.	.	H	α-helix	trans	-66	-45.1	179.5	-71.7	173.5	0	0	0	112	E17 L20 A21 F305 L306 N311 I312 R313	E17-L309 HydrophobicContact CB-CD1 4.33Å; E17-L309 HydrophobicContact CG-CB 4.33Å; E17-L309 WeakPolarHBondContact O-CD1 3.4Å; L20-L309 HydrophobicContact CB-CD1 3.92Å; A21-L309 HydrophobicContact CB-CD1 4.16Å; F305-L309 WeakPolarHBondContact O-CG 3.49Å; F305-L309 PolarHBondContact O-N 3.01Å; L306-L309 PolarHBondContact O-N 3.4Å; L309-N311 PolarHBondContact O-N 3.46Å; L309-I312 PolarHBondContact O-N 2.94Å; L309-R313 PolarHBondContact O-N 2.94Å
310	C	83.4	Confident	83.5	Confident	14 Å²	14	84.4 Å²	84.4	10%	0.095	40%	0.401	C	S	.	.	H	α-helix	trans	-59.4	-46.2	175.5	-67.5	0	0	0	0	111.4	L306 I312 R313 E314	L306-C310 PolarHBondContact O-N 3.11Å; L306-C310 PolarHBondContact O-SG 3.09Å; L306-C310 VanDerWaalsContact O-SG 3.35Å; C310-I312 VanDerWaalsContact C-N 3.27Å; C310-I312 PolarHBondContact O-N 3.05Å; C310-R313 WeakPolarHBondContact O-CB 3.46Å; C310-R313 PolarHBondContact O-N 2.85Å; C310-R313 VanDerWaalsContact O-N 3.11Å; C310-E314 WeakPolarHBondContact O-CG 3.31Å; C310-E314 PolarHBondContact O-N 2.84Å
311	N	86.4	Confident	81.9	Confident	88 Å²	88	85.9 Å²	85.9	47%	0.471	41%	0.409	S	S	.	.	H	α-helix	trans	-61.4	-34.3	177.5	-73.5	-18.1	0	0	0	112.8	N307 V308 L309 K315	N307-N311 VanDerWaalsContact O-CB 3.26Å; N307-N311 WeakPolarHBondContact O-CB 3.32Å; N307-N311 PolarHBondContact O-N 2.96Å; N307-N311 PolarHBondContact O-ND2 3.19Å; V308-N311 PolarHBondContact O-N 2.94Å; L309-N311 PolarHBondContact O-N 3.46Å; N311-K315 WeakPolarHBondContact O-CB 3.47Å; N311-K315 VanDerWaalsContact O-CG 3.31Å; N311-K315 WeakPolarHBondContact O-CG 3.26Å; N311-K315 PolarHBondContact O-N 3.31Å
312	I	87.1	Confident	79.9	Confident	85 Å²	85	96.3 Å²	96.3	44%	0.436	45%	0.449	S	S	.	.	H	α-helix	trans	-70.1	-40.2	175.9	-70.4	165.5	0	0	0	110.7	V308 L309 C310 K315 R316	V308-I312 HydrophobicContact CG1-CD1 3.86Å; V308-I312 WeakPolarHBondContact O-CD1 3.25Å; V308-I312 VanDerWaalsContact O-CG1 3.25Å; V308-I312 WeakPolarHBondContact O-CG1 3.49Å; V308-I312 PolarHBondContact O-N 3.48Å; L309-I312 PolarHBondContact O-N 2.94Å; C310-I312 VanDerWaalsContact C-N 3.27Å; C310-I312 PolarHBondContact O-N 3.05Å; I312-K315 PolarHBondContact O-N 3.3Å; I312-R316 PolarHBondContact O-N 3.37Å; I312-R316 VanDerWaalsContact O-N 3.09Å
313	R	83.9	Confident	79.5	Confident	38 Å²	38	98.3 Å²	98.3	14%	0.143	46%	0.46	C	S	.	.	H	α-helix	trans	-62.7	-50.7	176.1	-175.5	177.9	76.2	-151.4	10.4	111.3	R10 S12 E17 L309 C310 K315 R316 E317	R10-R313 PolarHBondContact O-NH2 2.72Å; S12-R313 PolarHBondContact O-NH1 3.41Å; S12-R313 PolarHBondContact O-NH2 2.92Å; E17-R313 WeakPolarHBondContact OE1-CD 3.38Å; E17-R313 IonicContact OE1-CZ 2.8Å; E17-R313 IonicContact OE1-NE 3.81Å; E17-R313 IonicContact OE1-NH1 3.89Å; E17-R313 PolarHBondContact OE1-NH1 3.46Å; E17-R313 IonicContact OE2-CZ 2.75Å; E17-R313 IonicContact OE2-NH1 3.7Å; E17-R313 PolarHBondContact OE2-NH1 3.22Å; L309-R313 PolarHBondContact O-N 2.94Å; C310-R313 WeakPolarHBondContact O-CB 3.46Å; C310-R313 PolarHBondContact O-N 2.85Å; C310-R313 VanDerWaalsContact O-N 3.11Å; R313-K315 VanDerWaalsContact C-N 3.26Å; R313-K315 PolarHBondContact O-N 2.92Å; R313-R316 WeakPolarHBondContact O-CB 3.41Å; R313-R316 PolarHBondContact O-N 3.28Å; R313-E317 WeakPolarHBondContact CD-OE1 3.32Å; R313-E317 HydrophobicContact CG-CG 4.34Å; R313-E317 WeakPolarHBondContact CG-OE1 3.47Å; R313-E317 IonicContact NE-OE1 3.98Å; R313-E317 PolarHBondContact O-N 3.32Å
314	E	82.7	Confident	79.2	Confident	102 Å²	102	97.6 Å²	97.6	48%	0.477	46%	0.457	S	S	.	.	H	α-helix	trans	-57.4	-40	179.1	-71.4	178.9	174.5	0	0	111.9	C310 G318	C310-E314 WeakPolarHBondContact O-CG 3.31Å; C310-E314 PolarHBondContact O-N 2.84Å; E314-G318 PolarHBondContact O-N 3.26Å
315	K	84.4	Confident	78.6	Confident	156 Å²	156	97.7 Å²	97.7	68%	0.678	46%	0.458	S	S	*	.	H	α-helix	trans	-65.3	-36.4	174.3	-76.5	179.9	-177.9	-175.9	0	113.3	N311 I312 R313 Q319	N311-K315 WeakPolarHBondContact O-CB 3.47Å; N311-K315 VanDerWaalsContact O-CG 3.31Å; N311-K315 WeakPolarHBondContact O-CG 3.26Å; N311-K315 PolarHBondContact O-N 3.31Å; I312-K315 PolarHBondContact O-N 3.3Å; R313-K315 VanDerWaalsContact C-N 3.26Å; R313-K315 PolarHBondContact O-N 2.92Å; K315-Q319 WeakPolarHBondContact O-CG 3.38Å; K315-Q319 PolarHBondContact O-N 2.98Å
316	R	81.8	Confident	77.9	Confident	168 Å²	168	100.6 Å²	100.6	63%	0.634	47%	0.473	S	S	*	.	H	α-helix	trans	-70.6	-42.7	176.7	-83.1	-174.5	178	-174.3	0.1	112	I312 R313 Q319 M320	I312-R316 PolarHBondContact O-N 3.37Å; I312-R316 VanDerWaalsContact O-N 3.09Å; R313-R316 WeakPolarHBondContact O-CB 3.41Å; R313-R316 PolarHBondContact O-N 3.28Å; R316-Q319 PolarHBondContact O-N 3.2Å; R316-M320 HydrophobicContact CB-CE 4.28Å; R316-M320 WeakPolarHBondContact O-CE 3.49Å; R316-M320 PolarHBondContact O-N 2.96Å
317	E	79.8	Confident	77.4	Confident	81 Å²	81	105.5 Å²	105.5	38%	0.379	50%	0.495	S	S	.	.	H	α-helix	trans	-66.5	-43.8	178.7	-69.8	176.3	-178.3	0	0	111	R313 Q319 M320 E321	R313-E317 WeakPolarHBondContact CD-OE1 3.32Å; R313-E317 HydrophobicContact CG-CG 4.34Å; R313-E317 WeakPolarHBondContact CG-OE1 3.47Å; R313-E317 IonicContact NE-OE1 3.98Å; R313-E317 PolarHBondContact O-N 3.32Å; E317-Q319 PolarHBondContact O-N 3.17Å; E317-M320 PolarHBondContact O-N 3.03Å; E317-E321 PolarHBondContact O-N 3.18Å
318	G	74.1	Confident	76.7	Confident	34 Å²	34	106.3 Å²	106.3	35%	0.351	50%	0.495	S	S	.	.	H	α-helix	trans	-67.9	-12.8	175.9	0	0	0	0	0	115.3	E314	E314-G318 PolarHBondContact O-N 3.26Å
319	Q	66.3	Low	75.9	Confident	148 Å²	148	109.9 Å²	109.9	69%	0.692	51%	0.506	S	S	*	.	H	α-helix	trans	-90.5	-21.8	170.4	-79.2	-178.5	-12.7	0	0	113.1	K315 R316 E317	K315-Q319 WeakPolarHBondContact O-CG 3.38Å; K315-Q319 PolarHBondContact O-N 2.98Å; R316-Q319 PolarHBondContact O-N 3.2Å; E317-Q319 PolarHBondContact O-N 3.17Å
320	M	59.4	Low	75	Confident	149 Å²	149	114.5 Å²	114.5	73%	0.734	53%	0.525	S	S	*	.	H	α-helix	trans	-87	-20.9	176.4	-78.2	-175.8	-93.1	0	0	113	R316 E317 R322	R316-M320 HydrophobicContact CB-CE 4.28Å; R316-M320 WeakPolarHBondContact O-CE 3.49Å; R316-M320 PolarHBondContact O-N 2.96Å; E317-M320 PolarHBondContact O-N 3.03Å; M320-R322 VanDerWaalsContact C-N 3.34Å
321	E	57.7	Low	74.3	Confident	148 Å²	148	122.9 Å²	122.9	69%	0.692	56%	0.561	S	S	*	*			trans	-85.9	0.3	175.4	-68	-177.2	163.4	0	0	113.8	R10 E317	R10-E321 IonicContact NH1-OE1 2.71Å; E317-E321 PolarHBondContact O-N 3.18Å
322	R	48	Very low	73.2	Confident	278 Å²	278	126.1 Å²	126.1	100%	1.049	57%	0.569	S	S	*	*			trans	-109.7	0	174.2	-68.9	-173.9	-167	-165	1.6	111.3	M320	M320-R322 VanDerWaalsContact C-N 3.34Å

Retrieved 322 of 322 residues in 548.6 ms (Link to these results)

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