A0A077Z067_TRITR Loading...

PRA1 family protein

AlphaFold DB , UniProt , Accession A0A077Z067, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 199 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	34.4	Very low	60.9	Low	242 Å²	242	102.3 Å²	102.3	100%	1.192	57%	0.569	S	S	*	*				0	103.7	0	-71.1	176.5	-176.2	0	0	106.5	G3	M1-G3 PolarHBondContact O-N 2.92Å
2	V	44.9	Very low	62.7	Low	90 Å²	90	99.3 Å²	99.3	55%	0.545	56%	0.558	S	S	.	*			trans	-62.4	110.9	174.4	-179.8	0	0	0	0	105.8	S4 Y5 L188	V2-S4 PolarHBondContact O-N 2.96Å; V2-Y5 HydrophobicContact CG1-CE1 4.32Å; V2-Y5 HydrophobicContact CG1-CE2 4.37Å; V2-L188 HydrophobicContact CG2-CD2 4.11Å
3	G	45.4	Very low	64.6	Low	59 Å²	59	99.8 Å²	99.8	61%	0.608	56%	0.558	S	S	*	*			trans	-53.4	139.2	179.5	0	0	0	0	0	109.4	M1 Y5	M1-G3 PolarHBondContact O-N 2.92Å; G3-Y5 PolarHBondContact O-N 2.82Å; G3-Y5 VanDerWaalsContact O-N 3.08Å
4	S	50.7	Low	66.2	Low	79 Å²	79	96.1 Å²	96.1	55%	0.552	53%	0.531	S	S	*	.			trans	-44.6	120.9	-179.5	-165.2	0	0	0	0	109.9	V2 S6 D7	V2-S4 PolarHBondContact O-N 2.96Å; S4-S6 PolarHBondContact O-N 3.33Å; S4-S6 PolarHBondContact OG-OG 3.46Å; S4-D7 PolarHBondContact O-N 2.76Å
5	Y	57.3	Low	67.7	Low	160 Å²	160	94.5 Å²	94.5	63%	0.627	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-53.1	-16.3	178.7	-63.3	-81.5	0	0	0	112.9	V2 G3 D7 L8 V184	V2-Y5 HydrophobicContact CG1-CE1 4.32Å; V2-Y5 HydrophobicContact CG1-CE2 4.37Å; G3-Y5 PolarHBondContact O-N 2.82Å; G3-Y5 VanDerWaalsContact O-N 3.08Å; Y5-D7 PolarHBondContact O-N 3.39Å; Y5-D7 VanDerWaalsContact O-N 3.15Å; Y5-L8 WeakPolarHBondContact O-CB 3.41Å; Y5-L8 PolarHBondContact O-N 3.02Å; Y5-V184 HydrophobicContact CE1-CG1 4.49Å
6	S	58.6	Low	68.9	Low	99 Å²	99	95.6 Å²	95.6	69%	0.692	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-50	-30.1	170.6	-36.5	0	0	0	0	114.2	S4	S4-S6 PolarHBondContact O-N 3.33Å; S4-S6 PolarHBondContact OG-OG 3.46Å
7	D	67	Low	69.9	Low	75 Å²	75	93.9 Å²	93.9	40%	0.401	52%	0.523	S	S	.	.	G	3₁₀ helix	trans	-96.2	8.2	-172	-81.1	-11.9	0	0	0	113.5	S4 Y5 Q9 K179	S4-D7 PolarHBondContact O-N 2.76Å; Y5-D7 PolarHBondContact O-N 3.39Å; Y5-D7 VanDerWaalsContact O-N 3.15Å; D7-Q9 PolarHBondContact O-N 3.48Å; D7-Q9 VanDerWaalsContact O-N 3.09Å; D7-K179 HydrophobicContact CB-CD 3.8Å; D7-K179 HydrophobicContact CB-CG 4.25Å; D7-K179 WeakPolarHBondContact O-CB 3.45Å; D7-K179 VanDerWaalsContact OD2-CE 3.28Å; D7-K179 WeakPolarHBondContact OD2-CE 3.38Å; D7-K179 IonicContact OD2-NZ 3.45Å; D7-K179 PolarHBondContact OD2-NZ 2.88Å
8	L	75.2	Confident	70.8	Confident	90 Å²	90	89.8 Å²	89.8	47%	0.471	50%	0.499	S	S	.	.			trans	-58.8	115.1	-176.6	-165.7	92.2	0	0	0	110.8	Y5 K179 P181 V184	Y5-L8 WeakPolarHBondContact O-CB 3.41Å; Y5-L8 PolarHBondContact O-N 3.02Å; L8-K179 CarbonylContact C-O 3.58Å; L8-K179 VanDerWaalsContact CA-O 3.22Å; L8-K179 WeakPolarHBondContact CA-O 3.31Å; L8-P181 HydrophobicContact CD1-CG 4.34Å; L8-P181 HydrophobicContact CD2-CG 4.08Å; L8-P181 HydrophobicContact CG-CG 4.34Å; L8-V184 HydrophobicContact CD1-CG2 4.01Å
9	Q	78.7	Confident	71.7	Confident	102 Å²	102	85.4 Å²	85.4	48%	0.477	47%	0.474	S	S	.	.			trans	-116.3	130.9	179.6	-74.3	-178.8	-3.1	0	0	109.9	D7 K179 T180	D7-Q9 PolarHBondContact O-N 3.48Å; D7-Q9 VanDerWaalsContact O-N 3.09Å; Q9-K179 PolarHBondContact N-O 3.49Å; Q9-T180 VanDerWaalsContact O-CA 3.27Å; Q9-T180 WeakPolarHBondContact O-CA 3.41Å; Q9-T180 VanDerWaalsContact O-CG2 3.29Å; Q9-T180 WeakPolarHBondContact O-CG2 3.3Å
10	L	77.2	Confident	72.4	Confident	118 Å²	118	85.3 Å²	85.3	62%	0.618	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-72.2	135.9	169.9	-75.9	168.2	0	0	0	109.5	F53 P181	L10-F53 HydrophobicContact CD2-CD2 4.34Å; L10-F53 HydrophobicContact CD2-CE2 4.17Å; L10-P181 HydrophobicContact CD2-CG 3.99Å
11	S	80.6	Confident	73	Confident	11 Å²	11	86.5 Å²	86.5	8%	0.077	48%	0.477	C	S	.	.	P	Polyproline II helix	trans	-57.2	146.7	170.8	-60.2	0	0	0	0	109.8	L13 T50 T180	S11-L13 PolarHBondContact O-N 2.88Å; S11-T50 WeakPolarHBondContact O-CB 3.36Å; S11-T50 PolarHBondContact O-OG1 2.98Å; S11-T180 WeakPolarHBondContact OG-CG2 3.46Å
12	P	82.7	Confident	74.9	Confident	67 Å²	67	78.2 Å²	78.2	44%	0.435	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-61.4	139.5	174.7	26.4	-34.4	0	0	0	110.2	R14	P12-R14 PolarHBondContact O-N 3.25Å
13	L	86.6	Confident	76.5	Confident	106 Å²	106	77.1 Å²	77.1	56%	0.555	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-65.3	123.6	171.6	-175.8	70.5	0	0	0	108.7	S11 T50 N51 V54	S11-L13 PolarHBondContact O-N 2.88Å; L13-T50 HydrophobicContact CB-CG2 4.04Å; L13-T50 HydrophobicContact CD1-CG2 3.92Å; L13-N51 HydrophobicContact CD1-CB 4.49Å; L13-V54 HydrophobicContact CD1-CG2 3.86Å
14	R	86.9	Confident	78.2	Confident	47 Å²	47	75.2 Å²	75.2	18%	0.177	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-86	153.4	177.3	-55.9	-61.1	178.6	171.9	-5	110	P12 Y47 Y48 N51 E173	P12-R14 PolarHBondContact O-N 3.25Å; R14-Y47 HydrophobicContact CG-CE1 4.28Å; R14-Y47 VanDerWaalsContact NH2-CE2 3.31Å; R14-Y48 HydrophobicContact CB-CD1 4.18Å; R14-Y48 HydrophobicContact CB-CE1 4.3Å; R14-Y48 HydrophobicContact CG-CD1 4.1Å; R14-Y48 HydrophobicContact CG-CE1 4.32Å; R14-N51 PolarHBondContact N-OD1 3.08Å; R14-N51 PolarHBondContact O-ND2 2.89Å; R14-E173 IonicContact CZ-OE1 3.96Å; R14-E173 IonicContact NH1-OE1 2.65Å; R14-E173 VanDerWaalsContact NH2-CD 3.34Å; R14-E173 IonicContact NH2-OE1 2.8Å; R14-E173 PolarHBondContact NH2-OE1 2.79Å; R14-E173 IonicContact NH2-OE2 3.97Å; R14-E173 PolarHBondContact NH2-OE2 3.3Å
15	S	89.2	Confident	79.7	Confident	72 Å²	72	78.8 Å²	78.8	50%	0.503	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-61.8	150.8	179	63.4	0	0	0	0	111	D17 D18 F19	S15-D17 PolarHBondContact O-N 3.35Å; S15-D18 PolarHBondContact O-N 3.07Å; S15-D18 PolarHBondContact OG-N 3.43Å; S15-F19 WeakPolarHBondContact O-CB 3.32Å; S15-F19 PolarHBondContact O-N 2.98Å
16	L	87.3	Confident	81.1	Confident	112 Å²	112	76 Å²	76	59%	0.586	42%	0.423	S	S	*	.	H	α-helix	trans	-61.5	-28.6	173.1	-70	178	0	0	0	111.9	F19 L20 L21	L16-F19 PolarHBondContact O-N 3.29Å; L16-L20 PolarHBondContact O-N 3.34Å; L16-L21 HydrophobicContact CB-CD1 4.17Å; L16-L21 PolarHBondContact O-N 3.19Å; L16-L21 VanDerWaalsContact O-N 3.13Å
17	D	86.4	Confident	82.4	Confident	68 Å²	68	75.3 Å²	75.3	36%	0.364	41%	0.412	S	S	.	.	H	α-helix	trans	-64.1	-42.9	177.7	-171.1	69.5	0	0	0	113.3	S15 L21 G22 T23 A24	S15-D17 PolarHBondContact O-N 3.35Å; D17-L21 CarbonylContact O-C 3.59Å; D17-L21 VanDerWaalsContact O-C 3.3Å; D17-L21 PolarHBondContact O-N 3.5Å; D17-G22 PolarHBondContact OD1-N 3.25Å; D17-T23 PolarHBondContact O-N 3.35Å; D17-T23 PolarHBondContact O-OG1 2.85Å; D17-T23 WeakPolarHBondContact OD2-CB 3.43Å; D17-T23 WeakPolarHBondContact OD2-CG2 3.43Å; D17-T23 PolarHBondContact OD2-N 2.85Å; D17-T23 PolarHBondContact OD2-OG1 3.12Å; D17-A24 PolarHBondContact O-N 2.85Å
18	D	85.2	Confident	83.3	Confident	20 Å²	20	81 Å²	81	11%	0.107	43%	0.428	C	S	.	.	H	α-helix	trans	-75.4	-31	175.4	179.7	49.9	0	0	0	112.4	S15 T23 Y48 R160 N166	S15-D18 PolarHBondContact O-N 3.07Å; S15-D18 PolarHBondContact OG-N 3.43Å; D18-T23 VanDerWaalsContact CA-OG1 3.27Å; D18-T23 WeakPolarHBondContact CA-OG1 3.49Å; D18-T23 PolarHBondContact N-OG1 3.36Å; D18-Y48 WeakPolarHBondContact OD2-CE1 3.38Å; D18-Y48 PolarHBondContact OD2-OH 2.68Å; D18-R160 VanDerWaalsContact O-CZ 3.32Å; D18-R160 PolarHBondContact O-NE 3Å; D18-R160 VanDerWaalsContact O-NE 3.14Å; D18-R160 PolarHBondContact O-NH2 3.03Å; D18-R160 IonicContact OD1-NH2 3.71Å; D18-R160 PolarHBondContact OD1-NH2 3.08Å; D18-R160 VanDerWaalsContact OD1-NH2 3.12Å; D18-N166 PolarHBondContact OD1-ND2 2.97Å
19	F	87.9	Confident	83.9	Confident	5 Å²	5	77 Å²	77	2%	0.022	41%	0.407	C	S	.	.	H	α-helix	trans	-76.6	-53.5	-177.8	-173.2	-127.7	0	0	0	112.2	S15 L16 Y48 N51 Y52 H156	S15-F19 WeakPolarHBondContact O-CB 3.32Å; S15-F19 PolarHBondContact O-N 2.98Å; L16-F19 PolarHBondContact O-N 3.29Å; F19-Y48 AromaticContact CD2-CD1 3.54Å; F19-Y48 HydrophobicContact CD2-CD1 3.54Å; F19-Y48 HydrophobicContact CD2-CD2 4.37Å; F19-Y48 HydrophobicContact CD2-CE1 4.12Å; F19-Y48 AromaticContact CD2-CG 3.68Å; F19-Y48 HydrophobicContact CD2-CG 3.68Å; F19-Y48 HydrophobicContact CE2-CD1 4.25Å; F19-Y48 AromaticContact CE2-CG 3.94Å; F19-Y48 HydrophobicContact CE2-CG 3.94Å; F19-Y48 HydrophobicContact CG-CD1 4.43Å; F19-N51 HydrophobicContact CD1-CB 3.99Å; F19-N51 HydrophobicContact CD2-CB 3.87Å; F19-N51 HydrophobicContact CE1-CB 3.97Å; F19-N51 HydrophobicContact CE2-CB 3.8Å; F19-N51 HydrophobicContact CG-CB 3.98Å; F19-N51 HydrophobicContact CZ-CB 3.88Å; F19-Y52 HydrophobicContact CE2-CD1 4.28Å; F19-Y52 AromaticContact CE2-CE1 3.89Å; F19-Y52 HydrophobicContact CE2-CE1 3.89Å; F19-Y52 AromaticContact CZ-CD1 3.91Å; F19-Y52 HydrophobicContact CZ-CD1 3.91Å; F19-Y52 AromaticContact CZ-CE1 3.77Å; F19-Y52 HydrophobicContact CZ-CE1 3.77Å; F19-H156 AromaticContact CD2-CE1 3.52Å; F19-H156 AromaticContact CE2-CE1 3.16Å; F19-H156 WeakPolarHBondContact CE2-CE1 3.44Å; F19-H156 AromaticContact CE2-ND1 3.61Å; F19-H156 AromaticContact CZ-CE1 3.77Å; F19-H156 AromaticContact CZ-ND1 3.9Å; F19-H156 PolarHBondContact O-NE2 2.77Å
20	L	85.7	Confident	84.2	Confident	84 Å²	84	73.3 Å²	73.3	44%	0.44	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128	-24.9	-170.4	-67.1	172.7	0	0	0	115.1	L16	L16-L20 PolarHBondContact O-N 3.34Å
21	L	84.9	Confident	84.6	Confident	110 Å²	110	74 Å²	74	58%	0.576	39%	0.388	S	S	*	.	S	Bend	trans	-102.3	-135.7	-167.7	-42.7	164.8	0	0	0	111.9	L16 D17 T23 A24	L16-L21 HydrophobicContact CB-CD1 4.17Å; L16-L21 PolarHBondContact O-N 3.19Å; L16-L21 VanDerWaalsContact O-N 3.13Å; D17-L21 CarbonylContact O-C 3.59Å; D17-L21 VanDerWaalsContact O-C 3.3Å; D17-L21 PolarHBondContact O-N 3.5Å; L21-T23 VanDerWaalsContact C-N 3.32Å; L21-T23 PolarHBondContact O-N 2.92Å; L21-A24 VanDerWaalsContact O-CB 3.23Å; L21-A24 WeakPolarHBondContact O-CB 3.23Å; L21-A24 PolarHBondContact O-N 3.03Å
22	G	74	Confident	84.9	Confident	69 Å²	69	81.8 Å²	81.8	71%	0.711	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-29.1	-156.9	0	0	0	0	0	114.9	D17	D17-G22 PolarHBondContact OD1-N 3.25Å
23	T	78.1	Confident	85.2	Confident	66 Å²	66	82.1 Å²	82.1	41%	0.405	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-3.4	176.9	52.4	0	0	0	0	113.4	D17 D18 L21 R25	D17-T23 PolarHBondContact O-N 3.35Å; D17-T23 PolarHBondContact O-OG1 2.85Å; D17-T23 WeakPolarHBondContact OD2-CB 3.43Å; D17-T23 WeakPolarHBondContact OD2-CG2 3.43Å; D17-T23 PolarHBondContact OD2-N 2.85Å; D17-T23 PolarHBondContact OD2-OG1 3.12Å; D18-T23 VanDerWaalsContact CA-OG1 3.27Å; D18-T23 WeakPolarHBondContact CA-OG1 3.49Å; D18-T23 PolarHBondContact N-OG1 3.36Å; L21-T23 VanDerWaalsContact C-N 3.32Å; L21-T23 PolarHBondContact O-N 2.92Å; T23-R25 PolarHBondContact O-N 3.32Å
24	A	81.6	Confident	85.4	Confident	20 Å²	20	83 Å²	83	17%	0.165	43%	0.432	C	S	.	.			trans	-72.1	111.2	176.2	0	0	0	0	0	111	D17 L21	D17-A24 PolarHBondContact O-N 2.85Å; L21-A24 VanDerWaalsContact O-CB 3.23Å; L21-A24 WeakPolarHBondContact O-CB 3.23Å; L21-A24 PolarHBondContact O-N 3.03Å
25	R	82.8	Confident	85.4	Confident	154 Å²	154	86.3 Å²	86.3	58%	0.581	45%	0.449	S	S	*	.			trans	-85.5	114.6	166.5	-60.8	-169	-175.2	172.2	-2.8	109	T23 R160 L161 N163	T23-R25 PolarHBondContact O-N 3.32Å; R25-R160 PolarHBondContact O-NH1 3.3Å; R25-L161 HydrophobicContact CB-CB 4.04Å; R25-L161 PolarHBondContact O-N 2.97Å; R25-N163 WeakPolarHBondContact CD-OD1 3.38Å; R25-N163 PolarHBondContact NE-OD1 3.22Å; R25-N163 PolarHBondContact NH1-OD1 3.45Å
26	L	86.6	Confident	85.2	Confident	100 Å²	100	87.6 Å²	87.6	52%	0.524	44%	0.443	S	S	.	.	B	Isolated β-bridge	trans	-111.6	137.3	172.9	-61.7	171.4	0	0	0	107.9	C159 R160	L26-C159 CarbonylContact C-O 3.41Å; L26-C159 WeakPolarHBondContact CA-O 3.34Å; L26-C159 HydrophobicContact CB-CB 4.41Å; L26-C159 HydrophobicContact CD2-CB 3.98Å; L26-R160 HydrophobicContact CD2-CB 4.18Å
27	D	86.3	Confident	85.2	Confident	86 Å²	86	83.2 Å²	83.2	46%	0.46	42%	0.42	S	S	.	.			trans	-140.3	162.6	175.2	-172.9	20.8	0	0	0	109.1	C159 L161	D27-C159 PolarHBondContact N-O 2.98Å; D27-C159 WeakPolarHBondContact O-CA 3.42Å; D27-C159 WeakPolarHBondContact O-CB 3.23Å; D27-L161 HydrophobicContact CB-CD1 3.33Å; D27-L161 HydrophobicContact CB-CD2 4.14Å; D27-L161 HydrophobicContact CB-CG 3.6Å
28	W	86.3	Confident	85.2	Confident	193 Å²	193	84.5 Å²	84.5	73%	0.731	43%	0.426	S	S	*	.			trans	-63.4	138.8	179.1	-133.1	-118.4	0	0	0	110.5	R40	W28-R40 PolarHBondContact O-NH1 2.91Å
29	P	87	Confident	85.2	Confident	6 Å²	6	85.1 Å²	85.1	4%	0.039	43%	0.429	C	S	.	.			trans	-65.5	137.9	176.4	22.9	-31.6	0	0	0	110.9	Y31 L37	P29-Y31 VanDerWaalsContact C-N 3.28Å; P29-Y31 HydrophobicContact CB-CE1 4.25Å; P29-Y31 HydrophobicContact CB-CE2 4.37Å; P29-Y31 HydrophobicContact CG-CD2 4.19Å; P29-Y31 HydrophobicContact CG-CE1 3.91Å; P29-Y31 HydrophobicContact CG-CE2 3.47Å; P29-Y31 VanDerWaalsContact CG-CE2 3.47Å; P29-Y31 VanDerWaalsContact CG-OH 3.28Å; P29-Y31 WeakPolarHBondContact CG-OH 3.5Å; P29-Y31 PolarHBondContact O-N 2.95Å; P29-L37 HydrophobicContact CB-CD1 3.56Å
30	P	84.4	Confident	85.1	Confident	26 Å²	26	85.7 Å²	85.7	17%	0.169	43%	0.431	C	S	.	.			trans	-78	75.9	-179.6	32.3	-36	0	0	0	110.2	N32 D33 R36 L37	P30-N32 PolarHBondContact O-N 2.93Å; P30-N32 VanDerWaalsContact O-N 3.09Å; P30-D33 CarbonylContact O-C 3.51Å; P30-D33 PolarHBondContact O-N 2.92Å; P30-D33 VanDerWaalsContact O-O 3.1Å; P30-R36 HydrophobicContact CG-CB 4.26Å; P30-R36 HydrophobicContact CG-CG 3.95Å; P30-L37 HydrophobicContact CG-CB 4.32Å
31	Y	85.8	Confident	85.2	Confident	133 Å²	133	83.1 Å²	83.1	52%	0.522	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-23	-178.1	-66.9	-63.9	0	0	0	114.1	P29 D33 L37	P29-Y31 VanDerWaalsContact C-N 3.28Å; P29-Y31 HydrophobicContact CB-CE1 4.25Å; P29-Y31 HydrophobicContact CB-CE2 4.37Å; P29-Y31 HydrophobicContact CG-CD2 4.19Å; P29-Y31 HydrophobicContact CG-CE1 3.91Å; P29-Y31 HydrophobicContact CG-CE2 3.47Å; P29-Y31 VanDerWaalsContact CG-CE2 3.47Å; P29-Y31 VanDerWaalsContact CG-OH 3.28Å; P29-Y31 WeakPolarHBondContact CG-OH 3.5Å; P29-Y31 PolarHBondContact O-N 2.95Å; Y31-D33 VanDerWaalsContact C-N 3.25Å; Y31-D33 PolarHBondContact O-N 3.03Å; Y31-L37 HydrophobicContact CD1-CD2 3.94Å; Y31-L37 HydrophobicContact CE1-CD2 4.27Å
32	N	88.5	Confident	85.2	Confident	173 Å²	173	78.6 Å²	78.6	93%	0.925	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-16.7	176.6	-61	-19.1	0	0	0	113	P30	P30-N32 PolarHBondContact O-N 2.93Å; P30-N32 VanDerWaalsContact O-N 3.09Å
33	D	89	Confident	85.6	Confident	74 Å²	74	75.9 Å²	75.9	40%	0.396	36%	0.363	S	S	.	.			trans	-128	87.2	178.8	-174.4	-16.2	0	0	0	109.3	P30 Y31 Q35 R36 L37	P30-D33 CarbonylContact O-C 3.51Å; P30-D33 PolarHBondContact O-N 2.92Å; P30-D33 VanDerWaalsContact O-O 3.1Å; Y31-D33 VanDerWaalsContact C-N 3.25Å; Y31-D33 PolarHBondContact O-N 3.03Å; D33-Q35 PolarHBondContact O-N 2.95Å; D33-Q35 PolarHBondContact OD1-N 2.91Å; D33-R36 HydrophobicContact CB-CB 3.9Å; D33-R36 PolarHBondContact O-N 3.04Å; D33-R36 WeakPolarHBondContact OD1-CB 3.2Å; D33-R36 PolarHBondContact OD1-N 3.33Å; D33-R36 WeakPolarHBondContact OD2-CB 3.44Å; D33-L37 WeakPolarHBondContact O-CB 3.43Å; D33-L37 PolarHBondContact O-N 3.35Å
34	L	88.8	Confident	86.1	Confident	126 Å²	126	72.9 Å²	72.9	66%	0.66	35%	0.345	S	S	*	.	H	α-helix	trans	-61.3	-32.8	-178.2	-67.1	-179.3	0	0	0	112.5	L37 L38	L34-L37 HydrophobicContact CD2-CD2 4.45Å; L34-L37 PolarHBondContact O-N 2.85Å; L34-L38 VanDerWaalsContact O-CB 3.23Å; L34-L38 WeakPolarHBondContact O-CB 3.43Å; L34-L38 PolarHBondContact O-N 3.38Å
35	Q	87.2	Confident	86.4	Confident	115 Å²	115	73.3 Å²	73.3	54%	0.537	34%	0.344	S	S	.	.	H	α-helix	trans	-68	-45.9	178.1	-176.4	174.1	-2.7	0	0	110.1	D33 L37 L38 N39 E194	D33-Q35 PolarHBondContact O-N 2.95Å; D33-Q35 PolarHBondContact OD1-N 2.91Å; Q35-L37 VanDerWaalsContact C-N 3.35Å; Q35-L37 PolarHBondContact O-N 2.94Å; Q35-L38 PolarHBondContact O-N 3.35Å; Q35-N39 WeakPolarHBondContact O-CB 3.37Å; Q35-N39 VanDerWaalsContact O-CG 3.3Å; Q35-N39 PolarHBondContact O-N 2.88Å; Q35-N39 PolarHBondContact O-ND2 3.21Å; Q35-E194 PolarHBondContact NE2-OE2 2.81Å
36	R	85.1	Confident	86.4	Confident	100 Å²	100	67.1 Å²	67.1	38%	0.377	32%	0.322	S	S	.	.	H	α-helix	trans	-62.4	-41.7	174.7	-174.7	179.9	-178	-177.6	4.1	112.1	P30 D33 R40 E199	P30-R36 HydrophobicContact CG-CB 4.26Å; P30-R36 HydrophobicContact CG-CG 3.95Å; D33-R36 HydrophobicContact CB-CB 3.9Å; D33-R36 PolarHBondContact O-N 3.04Å; D33-R36 WeakPolarHBondContact OD1-CB 3.2Å; D33-R36 PolarHBondContact OD1-N 3.33Å; D33-R36 WeakPolarHBondContact OD2-CB 3.44Å; R36-R40 WeakPolarHBondContact O-CB 3.47Å; R36-R40 PolarHBondContact O-N 3.48Å; R36-E199 IonicContact CZ-OE1 3.17Å; R36-E199 IonicContact NE-OE1 2.71Å; R36-E199 PolarHBondContact NE-OE1 3.24Å; R36-E199 IonicContact NH2-OE1 2.81Å; R36-E199 PolarHBondContact NH2-OE1 3.45Å
37	L	87.7	Confident	86.3	Confident	19 Å²	19	62.9 Å²	62.9	10%	0.099	30%	0.299	C	S	.	.	H	α-helix	trans	-61.8	-48.7	175.8	176.5	58.5	0	0	0	111.7	P29 P30 Y31 D33 L34 Q35 R40 I41	P29-L37 HydrophobicContact CB-CD1 3.56Å; P30-L37 HydrophobicContact CG-CB 4.32Å; Y31-L37 HydrophobicContact CD1-CD2 3.94Å; Y31-L37 HydrophobicContact CE1-CD2 4.27Å; D33-L37 WeakPolarHBondContact O-CB 3.43Å; D33-L37 PolarHBondContact O-N 3.35Å; L34-L37 HydrophobicContact CD2-CD2 4.45Å; L34-L37 PolarHBondContact O-N 2.85Å; Q35-L37 VanDerWaalsContact C-N 3.35Å; Q35-L37 PolarHBondContact O-N 2.94Å; L37-R40 WeakPolarHBondContact O-CB 3.42Å; L37-R40 PolarHBondContact O-N 3.42Å; L37-I41 HydrophobicContact CD1-CD1 3.9Å; L37-I41 HydrophobicContact CD1-CG1 4.22Å; L37-I41 HydrophobicContact CG-CD1 3.93Å; L37-I41 WeakPolarHBondContact O-CG1 3.3Å; L37-I41 PolarHBondContact O-N 3.29Å
38	L	86.8	Confident	86.3	Confident	96 Å²	96	58.8 Å²	58.8	50%	0.503	28%	0.278	S	S	.	.	H	α-helix	trans	-60.6	-47.9	178.5	-175.7	114.5	0	0	0	110.7	L34 Q35 R40 I41 L42	L34-L38 VanDerWaalsContact O-CB 3.23Å; L34-L38 WeakPolarHBondContact O-CB 3.43Å; L34-L38 PolarHBondContact O-N 3.38Å; Q35-L38 PolarHBondContact O-N 3.35Å; L38-R40 VanDerWaalsContact C-N 3.28Å; L38-R40 PolarHBondContact O-N 3.45Å; L38-I41 PolarHBondContact O-N 3.46Å; L38-L42 HydrophobicContact CD2-CD1 3.58Å; L38-L42 HydrophobicContact CD2-CG 4.46Å; L38-L42 HydrophobicContact CG-CD1 3.9Å; L38-L42 HydrophobicContact CG-CG 4.26Å; L38-L42 WeakPolarHBondContact O-CB 3.45Å; L38-L42 VanDerWaalsContact O-CG 3.28Å; L38-L42 WeakPolarHBondContact O-CG 3.33Å; L38-L42 PolarHBondContact O-N 2.8Å
39	N	84.4	Confident	86.4	Confident	32 Å²	32	49.6 Å²	49.6	17%	0.171	24%	0.243	C	C	.	.	H	α-helix	trans	-57.7	-42.5	175.2	-76.8	-17.9	0	0	0	111.4	Q35 N43	Q35-N39 WeakPolarHBondContact O-CB 3.37Å; Q35-N39 VanDerWaalsContact O-CG 3.3Å; Q35-N39 PolarHBondContact O-N 2.88Å; Q35-N39 PolarHBondContact O-ND2 3.21Å; N39-N43 VanDerWaalsContact O-CB 3.26Å; N39-N43 WeakPolarHBondContact O-CB 3.31Å; N39-N43 VanDerWaalsContact O-CG 3.29Å; N39-N43 PolarHBondContact O-N 2.73Å; N39-N43 PolarHBondContact O-ND2 2.79Å
40	R	85.9	Confident	86.5	Confident	18 Å²	18	50.4 Å²	50.4	7%	0.068	25%	0.247	C	C	.	.	H	α-helix	trans	-60.3	-49.2	175.6	-174.9	-176.5	-69.2	-172.4	-0.5	111.3	W28 R36 L37 L38 N44 S158 L161	W28-R40 PolarHBondContact O-NH1 2.91Å; R36-R40 WeakPolarHBondContact O-CB 3.47Å; R36-R40 PolarHBondContact O-N 3.48Å; L37-R40 WeakPolarHBondContact O-CB 3.42Å; L37-R40 PolarHBondContact O-N 3.42Å; L38-R40 VanDerWaalsContact C-N 3.28Å; L38-R40 PolarHBondContact O-N 3.45Å; R40-N44 WeakPolarHBondContact O-CB 3.23Å; R40-N44 VanDerWaalsContact O-CG 3.28Å; R40-N44 PolarHBondContact O-N 3.29Å; R40-N44 PolarHBondContact O-ND2 3.34Å; R40-N44 VanDerWaalsContact O-ND2 3.11Å; R40-S158 WeakPolarHBondContact CD-O 3.46Å; R40-S158 PolarHBondContact NH1-O 3.29Å; R40-L161 VanDerWaalsContact CZ-CD2 3.46Å
41	I	88.2	Confident	86.9	Confident	29 Å²	29	49.5 Å²	49.5	15%	0.149	24%	0.241	C	C	.	.	H	α-helix	trans	-60.5	-53	179.8	-68.1	165.9	0	0	0	110.7	L37 L38 N43 N44 L45 F154 A157	L37-I41 HydrophobicContact CD1-CD1 3.9Å; L37-I41 HydrophobicContact CD1-CG1 4.22Å; L37-I41 HydrophobicContact CG-CD1 3.93Å; L37-I41 WeakPolarHBondContact O-CG1 3.3Å; L37-I41 PolarHBondContact O-N 3.29Å; L38-I41 PolarHBondContact O-N 3.46Å; I41-N43 VanDerWaalsContact C-N 3.33Å; I41-N43 PolarHBondContact O-N 3.41Å; I41-N44 PolarHBondContact O-N 3.36Å; I41-L45 HydrophobicContact CG2-CD1 3.83Å; I41-L45 HydrophobicContact CG2-CG 4.25Å; I41-L45 WeakPolarHBondContact O-CB 3.45Å; I41-L45 WeakPolarHBondContact O-CG 3.23Å; I41-L45 PolarHBondContact O-N 2.69Å; I41-F154 HydrophobicContact CG2-CD1 4.32Å; I41-F154 HydrophobicContact CG2-CE1 4.34Å; I41-A157 HydrophobicContact CG2-CB 4.24Å
42	L	85.1	Confident	87.1	Confident	15 Å²	15	43.4 Å²	43.4	8%	0.079	22%	0.217	C	C	.	.	H	α-helix	trans	-59.1	-45.4	-177	-67.8	174.4	0	0	0	111.6	L38 N44 L45 L46 F186 I191	L38-L42 HydrophobicContact CD2-CD1 3.58Å; L38-L42 HydrophobicContact CD2-CG 4.46Å; L38-L42 HydrophobicContact CG-CD1 3.9Å; L38-L42 HydrophobicContact CG-CG 4.26Å; L38-L42 WeakPolarHBondContact O-CB 3.45Å; L38-L42 VanDerWaalsContact O-CG 3.28Å; L38-L42 WeakPolarHBondContact O-CG 3.33Å; L38-L42 PolarHBondContact O-N 2.8Å; L42-N44 PolarHBondContact O-N 3.46Å; L42-L45 PolarHBondContact O-N 2.94Å; L42-L46 WeakPolarHBondContact O-CB 3.3Å; L42-L46 PolarHBondContact O-N 2.9Å; L42-F186 HydrophobicContact CB-CE2 4Å; L42-F186 HydrophobicContact CB-CZ 4.29Å; L42-F186 HydrophobicContact CD2-CD1 4.44Å; L42-F186 HydrophobicContact CD2-CD2 4.47Å; L42-F186 HydrophobicContact CD2-CE1 3.72Å; L42-F186 HydrophobicContact CD2-CE2 3.76Å; L42-F186 HydrophobicContact CD2-CZ 3.34Å; L42-F186 HydrophobicContact CG-CE2 4.46Å; L42-F186 HydrophobicContact CG-CZ 4.41Å; L42-I191 HydrophobicContact CD1-CG2 3.52Å; L42-I191 HydrophobicContact CD2-CG2 4.09Å; L42-I191 HydrophobicContact CG-CG2 4.46Å
43	N	82.8	Confident	87.2	Confident	12 Å²	12	39.2 Å²	39.2	6%	0.064	19%	0.191	C	C	.	.	H	α-helix	trans	-68.3	-36	179.9	-76	-58	0	0	0	112.8	N39 I41 Y47 C193 F196	N39-N43 VanDerWaalsContact O-CB 3.26Å; N39-N43 WeakPolarHBondContact O-CB 3.31Å; N39-N43 VanDerWaalsContact O-CG 3.29Å; N39-N43 PolarHBondContact O-N 2.73Å; N39-N43 PolarHBondContact O-ND2 2.79Å; I41-N43 VanDerWaalsContact C-N 3.33Å; I41-N43 PolarHBondContact O-N 3.41Å; N43-Y47 WeakPolarHBondContact O-CB 3.42Å; N43-Y47 PolarHBondContact O-N 3.46Å; N43-C193 PolarHBondContact OD1-SG 2.96Å; N43-C193 VanDerWaalsContact OD1-SG 3.33Å; N43-F196 HydrophobicContact CB-CE1 4.44Å; N43-F196 HydrophobicContact CB-CE2 3.53Å; N43-F196 HydrophobicContact CB-CZ 3.29Å; N43-F196 WeakPolarHBondContact ND2-CE2 3.28Å; N43-F196 WeakPolarHBondContact ND2-CZ 3.48Å; N43-F196 WeakPolarHBondContact OD1-CE2 3.33Å
44	N	88.4	Confident	87.3	Confident	4 Å²	4	39 Å²	39	2%	0.021	19%	0.192	C	C	.	.	H	α-helix	trans	-68.5	-42.9	174.5	-76.1	-33.9	0	0	0	111.4	R40 I41 L42 L46 Y47 Y48 Y52 A157 R160	R40-N44 WeakPolarHBondContact O-CB 3.23Å; R40-N44 VanDerWaalsContact O-CG 3.28Å; R40-N44 PolarHBondContact O-N 3.29Å; R40-N44 PolarHBondContact O-ND2 3.34Å; R40-N44 VanDerWaalsContact O-ND2 3.11Å; I41-N44 PolarHBondContact O-N 3.36Å; L42-N44 PolarHBondContact O-N 3.46Å; N44-L46 VanDerWaalsContact C-N 3.29Å; N44-L46 PolarHBondContact O-N 2.89Å; N44-Y47 PolarHBondContact O-N 3.43Å; N44-Y48 HydrophobicContact CB-CD2 4.47Å; N44-Y48 WeakPolarHBondContact O-CB 3.26Å; N44-Y48 PolarHBondContact O-N 3.3Å; N44-Y52 WeakPolarHBondContact O-CE2 3.42Å; N44-A157 HydrophobicContact CB-CB 4.27Å; N44-A157 PolarHBondContact ND2-O 3.2Å; N44-R160 PolarHBondContact ND2-O 2.92Å
45	L	87.3	Confident	87.4	Confident	28 Å²	28	34.7 Å²	34.7	15%	0.147	17%	0.169	C	C	.	.	H	α-helix	trans	-57	-43.5	174	-74.8	175.2	0	0	0	111.5	I41 L42 Q49 Y52 I153 A157 F186	I41-L45 HydrophobicContact CG2-CD1 3.83Å; I41-L45 HydrophobicContact CG2-CG 4.25Å; I41-L45 WeakPolarHBondContact O-CB 3.45Å; I41-L45 WeakPolarHBondContact O-CG 3.23Å; I41-L45 PolarHBondContact O-N 2.69Å; L42-L45 PolarHBondContact O-N 2.94Å; L45-Q49 WeakPolarHBondContact O-CA 3.22Å; L45-Q49 WeakPolarHBondContact O-CB 3.37Å; L45-Q49 PolarHBondContact O-N 2.88Å; L45-Y52 HydrophobicContact CD2-CD2 3.99Å; L45-Y52 HydrophobicContact CD2-CE2 3.93Å; L45-I153 HydrophobicContact CD2-CG2 4.29Å; L45-A157 HydrophobicContact CD2-CB 4.48Å; L45-A157 HydrophobicContact CG-CB 4.47Å; L45-F186 HydrophobicContact CB-CZ 4.39Å; L45-F186 HydrophobicContact CD1-CZ 4.42Å
46	L	83.9	Confident	87.4	Confident	24 Å²	24	30.8 Å²	30.8	13%	0.126	16%	0.155	C	C	.	.	H	α-helix	trans	-69.3	-44.4	-179.9	-169.5	64.7	0	0	0	112.2	L42 N44 Q49 I177 I182 F186	L42-L46 WeakPolarHBondContact O-CB 3.3Å; L42-L46 PolarHBondContact O-N 2.9Å; N44-L46 VanDerWaalsContact C-N 3.29Å; N44-L46 PolarHBondContact O-N 2.89Å; L46-Q49 WeakPolarHBondContact O-CB 3.22Å; L46-I177 HydrophobicContact CD1-CG2 3.6Å; L46-I177 HydrophobicContact CD2-CG2 3.45Å; L46-I177 VanDerWaalsContact CD2-CG2 3.45Å; L46-I177 HydrophobicContact CG-CG2 3.39Å; L46-I182 HydrophobicContact CD1-CB 4.41Å; L46-I182 HydrophobicContact CD1-CG2 4.38Å; L46-F186 HydrophobicContact CB-CE2 4.49Å
47	Y	82.8	Confident	87.6	Confident	11 Å²	11	30.8 Å²	30.8	4%	0.043	16%	0.161	C	C	.	.	H	α-helix	trans	-73.3	-44.3	-176.7	-175.5	-112.3	0	0	0	113.5	R14 N43 N44 Q49 N170	R14-Y47 HydrophobicContact CG-CE1 4.28Å; R14-Y47 VanDerWaalsContact NH2-CE2 3.31Å; N43-Y47 WeakPolarHBondContact O-CB 3.42Å; N43-Y47 PolarHBondContact O-N 3.46Å; N44-Y47 PolarHBondContact O-N 3.43Å; Y47-Q49 VanDerWaalsContact C-N 3.3Å; Y47-N170 WeakPolarHBondContact CD2-OD1 3.47Å
48	Y	86.9	Confident	87.6	Confident	1 Å²	1	32.2 Å²	32.2	0%	0.004	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	20.7	178.6	-60.7	-70.6	0	0	0	112.3	R14 D18 F19 N44 T50 N51 Y52 R160	R14-Y48 HydrophobicContact CB-CD1 4.18Å; R14-Y48 HydrophobicContact CB-CE1 4.3Å; R14-Y48 HydrophobicContact CG-CD1 4.1Å; R14-Y48 HydrophobicContact CG-CE1 4.32Å; D18-Y48 WeakPolarHBondContact OD2-CE1 3.38Å; D18-Y48 PolarHBondContact OD2-OH 2.68Å; F19-Y48 AromaticContact CD2-CD1 3.54Å; F19-Y48 HydrophobicContact CD2-CD1 3.54Å; F19-Y48 HydrophobicContact CD2-CD2 4.37Å; F19-Y48 HydrophobicContact CD2-CE1 4.12Å; F19-Y48 AromaticContact CD2-CG 3.68Å; F19-Y48 HydrophobicContact CD2-CG 3.68Å; F19-Y48 HydrophobicContact CE2-CD1 4.25Å; F19-Y48 AromaticContact CE2-CG 3.94Å; F19-Y48 HydrophobicContact CE2-CG 3.94Å; F19-Y48 HydrophobicContact CG-CD1 4.43Å; N44-Y48 HydrophobicContact CB-CD2 4.47Å; N44-Y48 WeakPolarHBondContact O-CB 3.26Å; N44-Y48 PolarHBondContact O-N 3.3Å; Y48-T50 VanDerWaalsContact C-N 3.29Å; Y48-T50 PolarHBondContact O-N 3.17Å; Y48-N51 WeakPolarHBondContact O-CA 3.28Å; Y48-N51 WeakPolarHBondContact O-CB 3.23Å; Y48-N51 PolarHBondContact O-N 3.39Å; Y48-Y52 VanDerWaalsContact O-CD2 3.22Å; Y48-Y52 WeakPolarHBondContact O-CD2 3.47Å; Y48-Y52 PolarHBondContact O-N 3.45Å; Y48-R160 HydrophobicContact CE2-CG 3.75Å; Y48-R160 PolarHBondContact OH-NE 3.46Å; Y48-R160 PolarHBondContact OH-NH2 2.86Å
49	Q	88	Confident	87.4	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-46	-52.6	-176.5	172.5	-177.7	-64.8	0	0	112.3	L45 L46 Y47 N51 Y52 F53 T180 P181 I182	L45-Q49 WeakPolarHBondContact O-CA 3.22Å; L45-Q49 WeakPolarHBondContact O-CB 3.37Å; L45-Q49 PolarHBondContact O-N 2.88Å; L46-Q49 WeakPolarHBondContact O-CB 3.22Å; Y47-Q49 VanDerWaalsContact C-N 3.3Å; Q49-N51 VanDerWaalsContact C-N 3.32Å; Q49-N51 PolarHBondContact O-N 3.35Å; Q49-Y52 PolarHBondContact O-N 3.35Å; Q49-F53 HydrophobicContact CG-CD2 3.98Å; Q49-F53 HydrophobicContact CG-CE1 4.32Å; Q49-F53 HydrophobicContact CG-CE2 3.44Å; Q49-F53 VanDerWaalsContact CG-CE2 3.44Å; Q49-F53 HydrophobicContact CG-CZ 3.64Å; Q49-F53 WeakPolarHBondContact O-CG 3.44Å; Q49-F53 PolarHBondContact O-N 2.85Å; Q49-T180 PolarHBondContact OE1-OG1 3.46Å; Q49-P181 VanDerWaalsContact NE2-CD 3.31Å; Q49-I182 HydrophobicContact CB-CD1 3.93Å; Q49-I182 HydrophobicContact CG-CB 4.42Å; Q49-I182 HydrophobicContact CG-CD1 3.53Å; Q49-I182 HydrophobicContact CG-CG1 3.79Å
50	T	89.8	Confident	87.4	Confident	22 Å²	22	30.6 Å²	30.6	14%	0.135	16%	0.161	C	C	.	.	H	α-helix	trans	-68.6	-33.9	-176.2	-54.1	0	0	0	0	111.5	S11 L13 Y48 F53 V54	S11-T50 WeakPolarHBondContact O-CB 3.36Å; S11-T50 PolarHBondContact O-OG1 2.98Å; L13-T50 HydrophobicContact CB-CG2 4.04Å; L13-T50 HydrophobicContact CD1-CG2 3.92Å; Y48-T50 VanDerWaalsContact C-N 3.29Å; Y48-T50 PolarHBondContact O-N 3.17Å; T50-F53 PolarHBondContact O-N 2.93Å; T50-V54 WeakPolarHBondContact O-CG2 3.43Å; T50-V54 PolarHBondContact O-N 3.38Å
51	N	91.7	Very high	87.4	Confident	7 Å²	7	34.4 Å²	34.4	4%	0.037	18%	0.182	C	C	.	.	H	α-helix	trans	-65.1	-42.4	172.7	-66.4	60.5	0	0	0	111.3	L13 R14 F19 Y48 Q49 F53 V54 L55	L13-N51 HydrophobicContact CD1-CB 4.49Å; R14-N51 PolarHBondContact N-OD1 3.08Å; R14-N51 PolarHBondContact O-ND2 2.89Å; F19-N51 HydrophobicContact CD1-CB 3.99Å; F19-N51 HydrophobicContact CD2-CB 3.87Å; F19-N51 HydrophobicContact CE1-CB 3.97Å; F19-N51 HydrophobicContact CE2-CB 3.8Å; F19-N51 HydrophobicContact CG-CB 3.98Å; F19-N51 HydrophobicContact CZ-CB 3.88Å; Y48-N51 WeakPolarHBondContact O-CA 3.28Å; Y48-N51 WeakPolarHBondContact O-CB 3.23Å; Y48-N51 PolarHBondContact O-N 3.39Å; Q49-N51 VanDerWaalsContact C-N 3.32Å; Q49-N51 PolarHBondContact O-N 3.35Å; N51-F53 VanDerWaalsContact C-N 3.34Å; N51-V54 PolarHBondContact O-N 3.37Å; N51-L55 WeakPolarHBondContact O-CB 3.32Å; N51-L55 PolarHBondContact O-N 2.93Å
52	Y	91.4	Very high	87.3	Confident	6 Å²	6	38.1 Å²	38.1	2%	0.024	20%	0.202	C	C	.	.	H	α-helix	trans	-64.1	-38.8	174.1	-69.1	-57.1	0	0	0	112	F19 N44 L45 Y48 Q49 L55 C56 I153 H156 A157	F19-Y52 HydrophobicContact CE2-CD1 4.28Å; F19-Y52 AromaticContact CE2-CE1 3.89Å; F19-Y52 HydrophobicContact CE2-CE1 3.89Å; F19-Y52 AromaticContact CZ-CD1 3.91Å; F19-Y52 HydrophobicContact CZ-CD1 3.91Å; F19-Y52 AromaticContact CZ-CE1 3.77Å; F19-Y52 HydrophobicContact CZ-CE1 3.77Å; N44-Y52 WeakPolarHBondContact O-CE2 3.42Å; L45-Y52 HydrophobicContact CD2-CD2 3.99Å; L45-Y52 HydrophobicContact CD2-CE2 3.93Å; Y48-Y52 VanDerWaalsContact O-CD2 3.22Å; Y48-Y52 WeakPolarHBondContact O-CD2 3.47Å; Y48-Y52 PolarHBondContact O-N 3.45Å; Q49-Y52 PolarHBondContact O-N 3.35Å; Y52-L55 WeakPolarHBondContact O-CB 3.5Å; Y52-L55 PolarHBondContact O-N 3.49Å; Y52-C56 WeakPolarHBondContact O-CB 3.3Å; Y52-C56 PolarHBondContact O-N 2.7Å; Y52-C56 PolarHBondContact O-SG 2.84Å; Y52-I153 HydrophobicContact CD1-CG1 4.34Å; Y52-I153 HydrophobicContact CD1-CG2 3.77Å; Y52-I153 HydrophobicContact CE1-CG2 3.91Å; Y52-I153 HydrophobicContact CG-CG2 4.41Å; Y52-H156 AromaticContact CE1-ND1 3.5Å; Y52-H156 AromaticContact CZ-ND1 3.53Å; Y52-H156 PolarHBondContact OH-ND1 3.4Å; Y52-A157 WeakPolarHBondContact OH-CA 3.2Å; Y52-A157 WeakPolarHBondContact OH-CB 3.32Å; Y52-A157 PolarHBondContact OH-N 3.5Å
53	F	90.7	Very high	87	Confident	85 Å²	85	38.2 Å²	38.2	37%	0.373	20%	0.203	S	C	.	.	H	α-helix	trans	-63.5	-43.7	174	-67.5	-20.9	0	0	0	112.6	L10 Q49 T50 N51 L55 C56 L57 P181 I182	L10-F53 HydrophobicContact CD2-CD2 4.34Å; L10-F53 HydrophobicContact CD2-CE2 4.17Å; Q49-F53 HydrophobicContact CG-CD2 3.98Å; Q49-F53 HydrophobicContact CG-CE1 4.32Å; Q49-F53 HydrophobicContact CG-CE2 3.44Å; Q49-F53 VanDerWaalsContact CG-CE2 3.44Å; Q49-F53 HydrophobicContact CG-CZ 3.64Å; Q49-F53 WeakPolarHBondContact O-CG 3.44Å; Q49-F53 PolarHBondContact O-N 2.85Å; T50-F53 PolarHBondContact O-N 2.93Å; N51-F53 VanDerWaalsContact C-N 3.34Å; F53-L55 VanDerWaalsContact C-N 3.29Å; F53-L55 PolarHBondContact O-N 3.3Å; F53-C56 PolarHBondContact O-N 2.85Å; F53-L57 WeakPolarHBondContact O-CB 3.41Å; F53-L57 PolarHBondContact O-N 3.47Å; F53-P181 HydrophobicContact CE2-CB 4.38Å; F53-P181 HydrophobicContact CE2-CG 4.35Å; F53-P181 HydrophobicContact CZ-CB 4.26Å; F53-I182 HydrophobicContact CE1-CD1 4.34Å; F53-I182 HydrophobicContact CE1-CG1 4.49Å; F53-I182 HydrophobicContact CZ-CD1 4.32Å; F53-I182 HydrophobicContact CZ-CG1 4.11Å
54	V	91.6	Very high	87	Confident	68 Å²	68	37.9 Å²	37.9	41%	0.412	20%	0.202	S	C	.	.	H	α-helix	trans	-61.4	-41.8	174.1	169.6	0	0	0	0	110.6	L13 T50 N51 L57 S58	L13-V54 HydrophobicContact CD1-CG2 3.86Å; T50-V54 WeakPolarHBondContact O-CG2 3.43Å; T50-V54 PolarHBondContact O-N 3.38Å; N51-V54 PolarHBondContact O-N 3.37Å; V54-L57 PolarHBondContact O-N 3.46Å; V54-S58 WeakPolarHBondContact O-CB 3.36Å; V54-S58 PolarHBondContact O-N 2.9Å; V54-S58 PolarHBondContact O-OG 2.85Å
55	L	89.5	Confident	86.8	Confident	36 Å²	36	44 Å²	44	19%	0.188	23%	0.234	C	C	.	.	H	α-helix	trans	-62.6	-48.1	177.1	-170.4	70.2	0	0	0	110.8	N51 Y52 F53 L57 S58 F59 F149 I153	N51-L55 WeakPolarHBondContact O-CB 3.32Å; N51-L55 PolarHBondContact O-N 2.93Å; Y52-L55 WeakPolarHBondContact O-CB 3.5Å; Y52-L55 PolarHBondContact O-N 3.49Å; F53-L55 VanDerWaalsContact C-N 3.29Å; F53-L55 PolarHBondContact O-N 3.3Å; L55-L57 VanDerWaalsContact C-N 3.35Å; L55-L57 PolarHBondContact O-N 3.44Å; L55-S58 PolarHBondContact O-N 3.27Å; L55-F59 HydrophobicContact CD1-CD2 4.05Å; L55-F59 HydrophobicContact CD1-CE2 3.79Å; L55-F59 HydrophobicContact CG-CD2 4.15Å; L55-F59 HydrophobicContact CG-CE2 4.21Å; L55-F59 WeakPolarHBondContact O-CD2 3.34Å; L55-F59 PolarHBondContact O-N 3.36Å; L55-F149 HydrophobicContact CD2-CE2 3.89Å; L55-F149 HydrophobicContact CD2-CZ 4.23Å; L55-F149 HydrophobicContact CG-CE2 3.71Å; L55-F149 HydrophobicContact CG-CZ 3.92Å; L55-I153 HydrophobicContact CD2-CG1 4.05Å
56	C	87.6	Confident	86.6	Confident	34 Å²	34	47.6 Å²	47.6	23%	0.23	25%	0.254	C	S	.	.	H	α-helix	trans	-57.2	-46.7	175	-70.2	0	0	0	0	111.8	Y52 F53 F59 F60 F149 I153	Y52-C56 WeakPolarHBondContact O-CB 3.3Å; Y52-C56 PolarHBondContact O-N 2.7Å; Y52-C56 PolarHBondContact O-SG 2.84Å; F53-C56 PolarHBondContact O-N 2.85Å; C56-F59 PolarHBondContact O-N 3.15Å; C56-F60 VanDerWaalsContact O-CB 3.26Å; C56-F60 WeakPolarHBondContact O-CB 3.31Å; C56-F60 PolarHBondContact O-N 2.84Å; C56-F149 HydrophobicContact CB-CE1 4.25Å; C56-F149 HydrophobicContact CB-CZ 4.38Å; C56-I153 VanDerWaalsContact SG-CD1 3.51Å
57	L	88.7	Confident	86.6	Confident	99 Å²	99	52.3 Å²	52.3	52%	0.518	27%	0.27	S	S	.	.	H	α-helix	trans	-63.3	-43.5	178.3	-179.3	61.4	0	0	0	111.5	F53 V54 L55 F59 F60 L61	F53-L57 WeakPolarHBondContact O-CB 3.41Å; F53-L57 PolarHBondContact O-N 3.47Å; V54-L57 PolarHBondContact O-N 3.46Å; L55-L57 VanDerWaalsContact C-N 3.35Å; L55-L57 PolarHBondContact O-N 3.44Å; L57-F59 VanDerWaalsContact C-N 3.34Å; L57-F59 PolarHBondContact O-N 3Å; L57-F60 PolarHBondContact O-N 3.26Å; L57-L61 HydrophobicContact CD1-CD1 4.3Å; L57-L61 HydrophobicContact CD1-CG 4.26Å; L57-L61 HydrophobicContact CG-CD1 4.18Å; L57-L61 WeakPolarHBondContact O-CB 3.33Å; L57-L61 VanDerWaalsContact O-CG 3.27Å; L57-L61 WeakPolarHBondContact O-CG 3.48Å; L57-L61 PolarHBondContact O-N 2.68Å
58	S	88	Confident	87	Confident	50 Å²	50	55.3 Å²	55.3	35%	0.35	29%	0.291	S	S	.	.	H	α-helix	trans	-59.9	-46.3	178	-56.5	0	0	0	0	110.8	V54 L55 L61 L62	V54-S58 WeakPolarHBondContact O-CB 3.36Å; V54-S58 PolarHBondContact O-N 2.9Å; V54-S58 PolarHBondContact O-OG 2.85Å; L55-S58 PolarHBondContact O-N 3.27Å; S58-L61 PolarHBondContact O-N 2.88Å; S58-L62 WeakPolarHBondContact O-CB 3.23Å; S58-L62 VanDerWaalsContact O-CG 3.23Å; S58-L62 WeakPolarHBondContact O-CG 3.29Å; S58-L62 PolarHBondContact O-N 2.86Å
59	F	83.5	Confident	87.2	Confident	63 Å²	63	61.1 Å²	61.1	28%	0.276	32%	0.322	S	S	.	.	H	α-helix	trans	-67	-42	176.7	-90.9	-92.6	0	0	0	112.9	L55 C56 L57 L61 L62 V63 F149	L55-F59 HydrophobicContact CD1-CD2 4.05Å; L55-F59 HydrophobicContact CD1-CE2 3.79Å; L55-F59 HydrophobicContact CG-CD2 4.15Å; L55-F59 HydrophobicContact CG-CE2 4.21Å; L55-F59 WeakPolarHBondContact O-CD2 3.34Å; L55-F59 PolarHBondContact O-N 3.36Å; C56-F59 PolarHBondContact O-N 3.15Å; L57-F59 VanDerWaalsContact C-N 3.34Å; L57-F59 PolarHBondContact O-N 3Å; F59-L61 VanDerWaalsContact C-N 3.29Å; F59-L61 PolarHBondContact O-N 3.45Å; F59-L62 PolarHBondContact O-N 3.47Å; F59-V63 WeakPolarHBondContact O-CB 3.34Å; F59-V63 WeakPolarHBondContact O-CG2 3.33Å; F59-V63 PolarHBondContact O-N 3.45Å; F59-F149 HydrophobicContact CB-CD1 4.25Å; F59-F149 HydrophobicContact CB-CD2 4Å; F59-F149 HydrophobicContact CB-CE1 4.07Å; F59-F149 HydrophobicContact CB-CE2 3.87Å; F59-F149 HydrophobicContact CB-CG 4.2Å; F59-F149 HydrophobicContact CB-CZ 3.87Å; F59-F149 HydrophobicContact CD1-CB 4.31Å; F59-F149 AromaticContact CD1-CD2 3.46Å; F59-F149 HydrophobicContact CD1-CD2 3.46Å; F59-F149 VanDerWaalsContact CD1-CD2 3.46Å; F59-F149 AromaticContact CD1-CE2 3.99Å; F59-F149 HydrophobicContact CD1-CE2 3.99Å; F59-F149 AromaticContact CD1-CG 3.92Å; F59-F149 HydrophobicContact CD1-CG 3.92Å; F59-F149 AromaticContact CD2-CD2 3.37Å; F59-F149 HydrophobicContact CD2-CD2 3.37Å; F59-F149 AromaticContact CD2-CE2 2.98Å; F59-F149 HydrophobicContact CD2-CE2 2.98Å; F59-F149 HydrophobicContact CD2-CG 4.36Å; F59-F149 AromaticContact CD2-CZ 3.69Å; F59-F149 HydrophobicContact CD2-CZ 3.69Å; F59-F149 AromaticContact CE1-CD2 3.63Å; F59-F149 HydrophobicContact CE1-CD2 3.63Å; F59-F149 HydrophobicContact CE1-CE2 4.27Å; F59-F149 HydrophobicContact CE1-CG 4.35Å; F59-F149 AromaticContact CE2-CD2 3.52Å; F59-F149 HydrophobicContact CE2-CD2 3.52Å; F59-F149 AromaticContact CE2-CE2 3.33Å; F59-F149 HydrophobicContact CE2-CE2 3.33Å; F59-F149 HydrophobicContact CE2-CZ 4.41Å; F59-F149 HydrophobicContact CG-CD1 4.41Å; F59-F149 AromaticContact CG-CD2 3.3Å; F59-F149 HydrophobicContact CG-CD2 3.3Å; F59-F149 HydrophobicContact CG-CE1 4.38Å; F59-F149 AromaticContact CG-CE2 3.33Å; F59-F149 HydrophobicContact CG-CE2 3.33Å; F59-F149 AromaticContact CG-CG 3.9Å; F59-F149 HydrophobicContact CG-CG 3.9Å; F59-F149 AromaticContact CG-CZ 3.87Å; F59-F149 HydrophobicContact CG-CZ 3.87Å; F59-F149 AromaticContact CZ-CD2 3.65Å; F59-F149 HydrophobicContact CZ-CD2 3.65Å; F59-F149 AromaticContact CZ-CE2 3.97Å; F59-F149 HydrophobicContact CZ-CE2 3.97Å
60	F	84.3	Confident	87.2	Confident	30 Å²	30	62.9 Å²	62.9	13%	0.132	33%	0.33	C	S	.	.	H	α-helix	trans	-57.1	-45	175.5	178.6	-97.3	0	0	0	111.2	C56 L57 G64 I71 A130	C56-F60 VanDerWaalsContact O-CB 3.26Å; C56-F60 WeakPolarHBondContact O-CB 3.31Å; C56-F60 PolarHBondContact O-N 2.84Å; L57-F60 PolarHBondContact O-N 3.26Å; F60-G64 WeakPolarHBondContact O-CA 3.28Å; F60-G64 PolarHBondContact O-N 3.02Å; F60-I71 HydrophobicContact CD2-CD1 4.31Å; F60-I71 HydrophobicContact CE1-CD1 4.38Å; F60-I71 HydrophobicContact CE1-CG2 3.72Å; F60-I71 HydrophobicContact CE2-CD1 3.59Å; F60-I71 HydrophobicContact CZ-CD1 3.64Å; F60-I71 HydrophobicContact CZ-CG2 3.71Å; F60-A130 HydrophobicContact CD2-CB 4.02Å; F60-A130 HydrophobicContact CE2-CB 4.22Å
61	L	86.3	Confident	87.2	Confident	99 Å²	99	62.7 Å²	62.7	52%	0.518	33%	0.328	S	S	.	.	H	α-helix	trans	-65.6	-48.2	175.4	-67.6	174.2	0	0	0	111.4	L57 S58 F59 V63 G64 L65	L57-L61 HydrophobicContact CD1-CD1 4.3Å; L57-L61 HydrophobicContact CD1-CG 4.26Å; L57-L61 HydrophobicContact CG-CD1 4.18Å; L57-L61 WeakPolarHBondContact O-CB 3.33Å; L57-L61 VanDerWaalsContact O-CG 3.27Å; L57-L61 WeakPolarHBondContact O-CG 3.48Å; L57-L61 PolarHBondContact O-N 2.68Å; S58-L61 PolarHBondContact O-N 2.88Å; F59-L61 VanDerWaalsContact C-N 3.29Å; F59-L61 PolarHBondContact O-N 3.45Å; L61-V63 PolarHBondContact O-N 2.84Å; L61-G64 CarbonylContact O-C 3.5Å; L61-G64 WeakPolarHBondContact O-CA 3.23Å; L61-G64 PolarHBondContact O-N 3.39Å; L61-G64 VanDerWaalsContact O-N 3.08Å; L61-L65 WeakPolarHBondContact O-CG 3.46Å; L61-L65 PolarHBondContact O-N 3.26Å
62	L	84.6	Confident	87.2	Confident	106 Å²	106	68 Å²	68	56%	0.555	36%	0.356	S	S	*	.	H	α-helix	trans	-59.3	-46.8	179.9	-75.2	170.8	0	0	0	112.8	S58 F59 G64	S58-L62 WeakPolarHBondContact O-CB 3.23Å; S58-L62 VanDerWaalsContact O-CG 3.23Å; S58-L62 WeakPolarHBondContact O-CG 3.29Å; S58-L62 PolarHBondContact O-N 2.86Å; F59-L62 PolarHBondContact O-N 3.47Å; L62-G64 VanDerWaalsContact C-N 3.28Å
63	V	80.3	Confident	87.4	Confident	18 Å²	18	71.9 Å²	71.9	11%	0.109	38%	0.377	C	S	.	.	H	α-helix	trans	-64.9	-39.7	174.7	173.8	0	0	0	0	109.9	F59 L61 L65 N66 F126 A130	F59-V63 WeakPolarHBondContact O-CB 3.34Å; F59-V63 WeakPolarHBondContact O-CG2 3.33Å; F59-V63 PolarHBondContact O-N 3.45Å; L61-V63 PolarHBondContact O-N 2.84Å; V63-L65 VanDerWaalsContact C-N 3.33Å; V63-L65 PolarHBondContact O-N 2.61Å; V63-N66 WeakPolarHBondContact O-CB 3.17Å; V63-N66 PolarHBondContact O-N 2.84Å; V63-N66 VanDerWaalsContact O-N 3.16Å; V63-N66 PolarHBondContact O-ND2 3.37Å; V63-F126 HydrophobicContact CG1-CZ 4.17Å; V63-A130 HydrophobicContact CG1-CB 4.48Å
64	G	81.7	Confident	87.5	Confident	5 Å²	5	67.9 Å²	67.9	5%	0.052	36%	0.359	C	S	.	.	H	α-helix	trans	-67.1	-26.9	-178.7	0	0	0	0	0	115.6	F60 L61 L62 N66 R67 P68	F60-G64 WeakPolarHBondContact O-CA 3.28Å; F60-G64 PolarHBondContact O-N 3.02Å; L61-G64 CarbonylContact O-C 3.5Å; L61-G64 WeakPolarHBondContact O-CA 3.23Å; L61-G64 PolarHBondContact O-N 3.39Å; L61-G64 VanDerWaalsContact O-N 3.08Å; L62-G64 VanDerWaalsContact C-N 3.28Å; G64-N66 PolarHBondContact O-N 2.96Å; G64-N66 VanDerWaalsContact O-N 3.15Å; G64-R67 CarbonylContact O-C 3.37Å; G64-R67 PolarHBondContact O-N 3.01Å; G64-P68 WeakPolarHBondContact O-CA 3.42Å; G64-P68 VanDerWaalsContact O-N 3.08Å
65	L	84.8	Confident	87.5	Confident	132 Å²	132	66.6 Å²	66.6	69%	0.691	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-24.5	172.2	-71.1	175.3	0	0	0	112.6	L61 V63	L61-L65 WeakPolarHBondContact O-CG 3.46Å; L61-L65 PolarHBondContact O-N 3.26Å; V63-L65 VanDerWaalsContact C-N 3.33Å; V63-L65 PolarHBondContact O-N 2.61Å
66	N	82.8	Confident	87.8	Confident	103 Å²	103	68 Å²	68	55%	0.551	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-23.4	175.7	-62.2	-56.5	0	0	0	113.4	V63 G64	V63-N66 WeakPolarHBondContact O-CB 3.17Å; V63-N66 PolarHBondContact O-N 2.84Å; V63-N66 VanDerWaalsContact O-N 3.16Å; V63-N66 PolarHBondContact O-ND2 3.37Å; G64-N66 PolarHBondContact O-N 2.96Å; G64-N66 VanDerWaalsContact O-N 3.15Å
67	R	84.7	Confident	88.2	Confident	123 Å²	123	66.6 Å²	66.6	46%	0.464	35%	0.352	S	S	.	.	S	Bend	trans	-145	60.5	-172.1	-67.1	-64.3	179.2	170.5	-3.7	109.9	G64 N69 E70 I71 F126	G64-R67 CarbonylContact O-C 3.37Å; G64-R67 PolarHBondContact O-N 3.01Å; R67-N69 VanDerWaalsContact C-N 3.33Å; R67-N69 PolarHBondContact O-N 2.65Å; R67-E70 VanDerWaalsContact CA-OE2 3.23Å; R67-E70 WeakPolarHBondContact CA-OE2 3.22Å; R67-E70 HydrophobicContact CB-CB 4.15Å; R67-E70 HydrophobicContact CB-CG 4.34Å; R67-E70 VanDerWaalsContact CB-OE2 3.29Å; R67-E70 WeakPolarHBondContact CB-OE2 3.33Å; R67-E70 WeakPolarHBondContact CD-OE1 3.38Å; R67-E70 IonicContact NH1-OE1 3.12Å; R67-E70 PolarHBondContact NH1-OE1 3.41Å; R67-E70 PolarHBondContact O-N 3.16Å; R67-I71 PolarHBondContact O-N 2.92Å; R67-F126 HydrophobicContact CB-CD1 4.37Å; R67-F126 HydrophobicContact CB-CE1 3.69Å; R67-F126 HydrophobicContact CB-CE2 4.15Å; R67-F126 HydrophobicContact CB-CZ 3.56Å; R67-F126 HydrophobicContact CG-CE1 4.31Å; R67-F126 HydrophobicContact CG-CE2 3.87Å; R67-F126 HydrophobicContact CG-CZ 3.68Å
68	P	89.2	Confident	88.4	Confident	75 Å²	75	64.1 Å²	64.1	49%	0.487	34%	0.339	S	S	.	.	H	α-helix	trans	-66.6	-35.8	-168.2	25.7	-34.7	0	0	0	112.1	G64 I71 L72	G64-P68 WeakPolarHBondContact O-CA 3.42Å; G64-P68 VanDerWaalsContact O-N 3.08Å; P68-I71 PolarHBondContact O-N 3.32Å; P68-L72 VanDerWaalsContact O-CB 3.22Å; P68-L72 WeakPolarHBondContact O-CB 3.28Å; P68-L72 PolarHBondContact O-N 3.32Å
69	N	91.5	Very high	88.8	Confident	123 Å²	123	67 Å²	67	66%	0.658	35%	0.35	S	S	*	.	H	α-helix	trans	-65	-42.4	178	-67.6	-25.9	0	0	0	110.9	R67 L72 L73	R67-N69 VanDerWaalsContact C-N 3.33Å; R67-N69 PolarHBondContact O-N 2.65Å; N69-L72 PolarHBondContact O-N 3.38Å; N69-L73 VanDerWaalsContact O-CB 3.22Å; N69-L73 WeakPolarHBondContact O-CB 3.37Å; N69-L73 PolarHBondContact O-N 3.09Å
70	E	89.1	Confident	89.4	Confident	37 Å²	37	67.6 Å²	67.6	17%	0.173	36%	0.355	C	S	.	.	H	α-helix	trans	-69.1	-37.5	-179.9	-60.6	85.5	159.4	0	0	111.5	R67 G74 S123 F126	R67-E70 VanDerWaalsContact CA-OE2 3.23Å; R67-E70 WeakPolarHBondContact CA-OE2 3.22Å; R67-E70 HydrophobicContact CB-CB 4.15Å; R67-E70 HydrophobicContact CB-CG 4.34Å; R67-E70 VanDerWaalsContact CB-OE2 3.29Å; R67-E70 WeakPolarHBondContact CB-OE2 3.33Å; R67-E70 WeakPolarHBondContact CD-OE1 3.38Å; R67-E70 IonicContact NH1-OE1 3.12Å; R67-E70 PolarHBondContact NH1-OE1 3.41Å; R67-E70 PolarHBondContact O-N 3.16Å; E70-G74 WeakPolarHBondContact O-CA 3.25Å; E70-G74 PolarHBondContact O-N 2.82Å; E70-S123 PolarHBondContact O-OG 3.15Å; E70-F126 HydrophobicContact CB-CB 4.35Å; E70-F126 HydrophobicContact CB-CD1 4.04Å; E70-F126 HydrophobicContact CB-CG 4.21Å
71	I	89	Confident	90	Very high	18 Å²	18	67.2 Å²	67.2	9%	0.092	36%	0.356	C	S	.	.	H	α-helix	trans	-70.5	-45	173.1	-73.8	-71	0	0	0	111.6	F60 R67 P68 G74 T75 F126 C127 A130	F60-I71 HydrophobicContact CD2-CD1 4.31Å; F60-I71 HydrophobicContact CE1-CD1 4.38Å; F60-I71 HydrophobicContact CE1-CG2 3.72Å; F60-I71 HydrophobicContact CE2-CD1 3.59Å; F60-I71 HydrophobicContact CZ-CD1 3.64Å; F60-I71 HydrophobicContact CZ-CG2 3.71Å; R67-I71 PolarHBondContact O-N 2.92Å; P68-I71 PolarHBondContact O-N 3.32Å; I71-G74 PolarHBondContact O-N 2.91Å; I71-T75 WeakPolarHBondContact O-CB 3.24Å; I71-T75 PolarHBondContact O-N 2.86Å; I71-T75 PolarHBondContact O-OG1 2.65Å; I71-F126 HydrophobicContact CD1-CD1 3.74Å; I71-F126 HydrophobicContact CD1-CE1 3.72Å; I71-F126 HydrophobicContact CG1-CD1 3.91Å; I71-F126 HydrophobicContact CG1-CE1 3.67Å; I71-C127 HydrophobicContact CD1-CB 4.42Å; I71-A130 HydrophobicContact CD1-CB 4.15Å
72	L	92.8	Very high	90.4	Very high	119 Å²	119	67.1 Å²	67.1	62%	0.623	36%	0.355	S	S	*	.	H	α-helix	trans	-62.8	-49.8	-178.9	-177.8	63.8	0	0	0	111	P68 N69 T76	P68-L72 VanDerWaalsContact O-CB 3.22Å; P68-L72 WeakPolarHBondContact O-CB 3.28Å; P68-L72 PolarHBondContact O-N 3.32Å; N69-L72 PolarHBondContact O-N 3.38Å; L72-T76 VanDerWaalsContact O-CB 3.28Å; L72-T76 WeakPolarHBondContact O-CB 3.37Å; L72-T76 PolarHBondContact O-N 3.37Å; L72-T76 PolarHBondContact O-OG1 2.92Å
73	L	94.7	Very high	90.9	Very high	87 Å²	87	64 Å²	64	46%	0.455	35%	0.349	S	S	.	.	H	α-helix	trans	-64.4	-43.7	177.8	178.1	64	0	0	0	111.1	N69 T76 V77 S123	N69-L73 VanDerWaalsContact O-CB 3.22Å; N69-L73 WeakPolarHBondContact O-CB 3.37Å; N69-L73 PolarHBondContact O-N 3.09Å; L73-T76 PolarHBondContact O-N 3.45Å; L73-V77 HydrophobicContact CD1-CG2 4.02Å; L73-V77 HydrophobicContact CG-CG2 4.44Å; L73-V77 WeakPolarHBondContact O-CB 3.44Å; L73-V77 VanDerWaalsContact O-CG2 3.23Å; L73-V77 WeakPolarHBondContact O-CG2 3.27Å; L73-V77 PolarHBondContact O-N 3.05Å; L73-S123 WeakPolarHBondContact CB-OG 3.45Å
74	G	92.8	Very high	91.7	Very high	0 Å²	0	64 Å²	64	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-66.5	-42.8	-177.1	0	0	0	0	0	111.5	E70 I71 L78 S123	E70-G74 WeakPolarHBondContact O-CA 3.25Å; E70-G74 PolarHBondContact O-N 2.82Å; I71-G74 PolarHBondContact O-N 2.91Å; G74-L78 VanDerWaalsContact O-CB 3.25Å; G74-L78 WeakPolarHBondContact O-CB 3.47Å; G74-L78 PolarHBondContact O-N 3.08Å; G74-S123 VanDerWaalsContact CA-OG 3.28Å; G74-S123 WeakPolarHBondContact CA-OG 3.06Å; G74-S123 PolarHBondContact N-OG 3.32Å
75	T	92	Very high	92.3	Very high	42 Å²	42	68.6 Å²	68.6	26%	0.258	37%	0.371	S	S	.	.	H	α-helix	trans	-63.3	-46.2	174.1	-54	0	0	0	0	110.8	I71 V77 L78 L79	I71-T75 WeakPolarHBondContact O-CB 3.24Å; I71-T75 PolarHBondContact O-N 2.86Å; I71-T75 PolarHBondContact O-OG1 2.65Å; T75-V77 PolarHBondContact O-N 3.15Å; T75-L78 PolarHBondContact O-N 2.98Å; T75-L79 HydrophobicContact CG2-CD1 4.09Å; T75-L79 HydrophobicContact CG2-CG 4.41Å; T75-L79 WeakPolarHBondContact O-CB 3.41Å; T75-L79 WeakPolarHBondContact O-CG 3.22Å; T75-L79 PolarHBondContact O-N 3.08Å
76	T	95.2	Very high	92.8	Very high	65 Å²	65	65.2 Å²	65.2	40%	0.399	36%	0.362	S	S	.	.	H	α-helix	trans	-59.9	-48.2	179.8	-60.3	0	0	0	0	110.9	L72 L73 L79 L80	L72-T76 VanDerWaalsContact O-CB 3.28Å; L72-T76 WeakPolarHBondContact O-CB 3.37Å; L72-T76 PolarHBondContact O-N 3.37Å; L72-T76 PolarHBondContact O-OG1 2.92Å; L73-T76 PolarHBondContact O-N 3.45Å; T76-L79 PolarHBondContact O-N 2.88Å; T76-L80 HydrophobicContact CG2-CD1 4.07Å; T76-L80 WeakPolarHBondContact O-CB 3.45Å; T76-L80 VanDerWaalsContact O-CG 3.31Å; T76-L80 WeakPolarHBondContact O-CG 3.33Å; T76-L80 PolarHBondContact O-N 2.9Å
77	V	95.6	Very high	93.4	Very high	5 Å²	5	63.1 Å²	63.1	3%	0.03	35%	0.347	C	S	.	.	H	α-helix	trans	-65.1	-41.9	179.3	169.5	0	0	0	0	111	L73 T75 L79 L80 T81 L117 S120	L73-V77 HydrophobicContact CD1-CG2 4.02Å; L73-V77 HydrophobicContact CG-CG2 4.44Å; L73-V77 WeakPolarHBondContact O-CB 3.44Å; L73-V77 VanDerWaalsContact O-CG2 3.23Å; L73-V77 WeakPolarHBondContact O-CG2 3.27Å; L73-V77 PolarHBondContact O-N 3.05Å; T75-V77 PolarHBondContact O-N 3.15Å; V77-L79 PolarHBondContact O-N 3.46Å; V77-L80 PolarHBondContact O-N 3.43Å; V77-T81 VanDerWaalsContact O-CB 3.3Å; V77-T81 WeakPolarHBondContact O-CB 3.21Å; V77-T81 PolarHBondContact O-N 3.16Å; V77-T81 PolarHBondContact O-OG1 2.91Å; V77-L117 HydrophobicContact CG1-CB 4.29Å; V77-L117 HydrophobicContact CG1-CD1 3.79Å; V77-S120 WeakPolarHBondContact CG1-OG 3.34Å; V77-S120 WeakPolarHBondContact CG2-OG 3.25Å
78	L	94	Very high	93.8	Very high	46 Å²	46	61 Å²	61	24%	0.241	35%	0.348	C	S	.	.	H	α-helix	trans	-58.8	-48.2	176.4	-179.9	61.5	0	0	0	111.1	G74 T75 T81 L82 L124 L128	G74-L78 VanDerWaalsContact O-CB 3.25Å; G74-L78 WeakPolarHBondContact O-CB 3.47Å; G74-L78 PolarHBondContact O-N 3.08Å; T75-L78 PolarHBondContact O-N 2.98Å; L78-T81 PolarHBondContact O-N 2.87Å; L78-L82 HydrophobicContact CD1-CD1 4.29Å; L78-L82 HydrophobicContact CD1-CG 4.34Å; L78-L82 HydrophobicContact CG-CD1 4.23Å; L78-L82 WeakPolarHBondContact O-CG 3.03Å; L78-L82 PolarHBondContact O-N 3.41Å; L78-L124 HydrophobicContact CB-CD1 3.98Å; L78-L124 HydrophobicContact CD1-CD1 4.33Å; L78-L128 HydrophobicContact CD1-CD2 4.2Å; L78-L128 HydrophobicContact CD2-CD2 4.13Å
79	L	95.8	Very high	94	Very high	112 Å²	112	61 Å²	61	59%	0.586	36%	0.355	S	S	*	.	H	α-helix	trans	-63.4	-43.9	178.3	-69.8	176	0	0	0	112.3	T75 T76 V77 T81 L82 G83	T75-L79 HydrophobicContact CG2-CD1 4.09Å; T75-L79 HydrophobicContact CG2-CG 4.41Å; T75-L79 WeakPolarHBondContact O-CB 3.41Å; T75-L79 WeakPolarHBondContact O-CG 3.22Å; T75-L79 PolarHBondContact O-N 3.08Å; T76-L79 PolarHBondContact O-N 2.88Å; V77-L79 PolarHBondContact O-N 3.46Å; L79-T81 VanDerWaalsContact C-N 3.3Å; L79-T81 PolarHBondContact O-N 2.97Å; L79-L82 PolarHBondContact O-N 3.42Å; L79-G83 PolarHBondContact O-N 3.38Å
80	L	96.7	Very high	94.1	Very high	74 Å²	74	56.8 Å²	56.8	39%	0.387	34%	0.335	S	S	.	.	H	α-helix	trans	-61.6	-40.1	175.2	-73.1	174.7	0	0	0	111.7	T76 V77 G83 C84 I113	T76-L80 HydrophobicContact CG2-CD1 4.07Å; T76-L80 WeakPolarHBondContact O-CB 3.45Å; T76-L80 VanDerWaalsContact O-CG 3.31Å; T76-L80 WeakPolarHBondContact O-CG 3.33Å; T76-L80 PolarHBondContact O-N 2.9Å; V77-L80 PolarHBondContact O-N 3.43Å; L80-G83 PolarHBondContact O-N 3.25Å; L80-C84 VanDerWaalsContact O-CB 3.23Å; L80-C84 WeakPolarHBondContact O-CB 3.26Å; L80-C84 PolarHBondContact O-N 3.21Å; L80-I113 HydrophobicContact CB-CG2 4.26Å
81	T	95.5	Very high	94.3	Very high	23 Å²	23	61.2 Å²	61.2	14%	0.141	36%	0.364	C	S	.	.	H	α-helix	trans	-67.5	-46.7	179.5	-56.9	0	0	0	0	111.1	V77 L78 L79 G83 C84 I85 L117	V77-T81 VanDerWaalsContact O-CB 3.3Å; V77-T81 WeakPolarHBondContact O-CB 3.21Å; V77-T81 PolarHBondContact O-N 3.16Å; V77-T81 PolarHBondContact O-OG1 2.91Å; L78-T81 PolarHBondContact O-N 2.87Å; L79-T81 VanDerWaalsContact C-N 3.3Å; L79-T81 PolarHBondContact O-N 2.97Å; T81-G83 VanDerWaalsContact C-N 3.33Å; T81-G83 PolarHBondContact O-N 2.82Å; T81-C84 WeakPolarHBondContact O-CB 3.37Å; T81-C84 PolarHBondContact O-N 2.84Å; T81-I85 HydrophobicContact CG2-CD1 4.14Å; T81-I85 VanDerWaalsContact O-CG1 3.31Å; T81-I85 WeakPolarHBondContact O-CG1 3.43Å; T81-I85 PolarHBondContact O-N 3.4Å; T81-L117 HydrophobicContact CG2-CD1 4.25Å; T81-L117 HydrophobicContact CG2-CD2 4.11Å
82	L	95.2	Very high	94.6	Very high	97 Å²	97	64 Å²	64	51%	0.508	38%	0.379	S	S	.	.	H	α-helix	trans	-61.7	-42.2	174.4	-69.2	175.6	0	0	0	111.4	L78 L79 C84 I85 A86	L78-L82 HydrophobicContact CD1-CD1 4.29Å; L78-L82 HydrophobicContact CD1-CG 4.34Å; L78-L82 HydrophobicContact CG-CD1 4.23Å; L78-L82 WeakPolarHBondContact O-CG 3.03Å; L78-L82 PolarHBondContact O-N 3.41Å; L79-L82 PolarHBondContact O-N 3.42Å; L82-C84 VanDerWaalsContact C-N 3.34Å; L82-C84 PolarHBondContact O-N 3.49Å; L82-I85 PolarHBondContact O-N 2.78Å; L82-A86 WeakPolarHBondContact O-CB 3.41Å; L82-A86 PolarHBondContact O-N 3.26Å
83	G	96.2	Very high	94.6	Very high	41 Å²	41	63.3 Å²	63.3	42%	0.423	38%	0.382	S	S	.	.	H	α-helix	trans	-61.4	-40	173.8	0	0	0	0	0	112.7	L79 L80 T81 A86 Y87	L79-G83 PolarHBondContact O-N 3.38Å; L80-G83 PolarHBondContact O-N 3.25Å; T81-G83 VanDerWaalsContact C-N 3.33Å; T81-G83 PolarHBondContact O-N 2.82Å; G83-A86 PolarHBondContact O-N 3.44Å; G83-Y87 VanDerWaalsContact O-CB 3.23Å; G83-Y87 WeakPolarHBondContact O-CB 3.39Å; G83-Y87 PolarHBondContact O-N 2.82Å
84	C	95.8	Very high	94.6	Very high	16 Å²	16	67 Å²	67	11%	0.108	39%	0.394	C	S	.	.	H	α-helix	trans	-66.9	-42.5	176.3	-172.7	0	0	0	0	112	L80 T81 L82 Y87 T88 I113	L80-C84 VanDerWaalsContact O-CB 3.23Å; L80-C84 WeakPolarHBondContact O-CB 3.26Å; L80-C84 PolarHBondContact O-N 3.21Å; T81-C84 WeakPolarHBondContact O-CB 3.37Å; T81-C84 PolarHBondContact O-N 2.84Å; L82-C84 VanDerWaalsContact C-N 3.34Å; L82-C84 PolarHBondContact O-N 3.49Å; C84-Y87 PolarHBondContact O-N 2.86Å; C84-T88 VanDerWaalsContact O-CB 3.3Å; C84-T88 WeakPolarHBondContact O-CB 3.47Å; C84-T88 PolarHBondContact O-N 3.38Å; C84-T88 PolarHBondContact O-OG1 3.46Å; C84-I113 HydrophobicContact CB-CB 4.43Å; C84-I113 HydrophobicContact CB-CD1 3.76Å; C84-I113 HydrophobicContact CB-CG2 3.93Å
85	I	95.4	Very high	94.6	Very high	102 Å²	102	68.8 Å²	68.8	52%	0.523	41%	0.405	S	S	.	.	H	α-helix	trans	-61.3	-48.8	173.6	-68.7	165.7	0	0	0	109.5	T81 L82 Y87 T88 A89	T81-I85 HydrophobicContact CG2-CD1 4.14Å; T81-I85 VanDerWaalsContact O-CG1 3.31Å; T81-I85 WeakPolarHBondContact O-CG1 3.43Å; T81-I85 PolarHBondContact O-N 3.4Å; L82-I85 PolarHBondContact O-N 2.78Å; I85-Y87 PolarHBondContact O-N 3.43Å; I85-T88 PolarHBondContact O-N 3.4Å; I85-A89 VanDerWaalsContact O-CB 3.23Å; I85-A89 WeakPolarHBondContact O-CB 3.36Å; I85-A89 PolarHBondContact O-N 2.82Å
86	A	94.9	Very high	94.8	Very high	61 Å²	61	68.7 Å²	68.7	50%	0.504	41%	0.405	S	S	.	.	H	α-helix	trans	-61.1	-43.3	178.3	0	0	0	0	0	112.2	L82 G83 S90	L82-A86 WeakPolarHBondContact O-CB 3.41Å; L82-A86 PolarHBondContact O-N 3.26Å; G83-A86 PolarHBondContact O-N 3.44Å; A86-S90 WeakPolarHBondContact O-CA 3.29Å; A86-S90 VanDerWaalsContact O-CB 3.26Å; A86-S90 WeakPolarHBondContact O-CB 3.27Å; A86-S90 PolarHBondContact O-N 2.93Å
87	Y	94.4	Very high	94.8	Very high	60 Å²	60	68.4 Å²	68.4	24%	0.235	41%	0.405	C	S	.	.	H	α-helix	trans	-59.5	-47.9	175	171.9	-104.4	0	0	0	112	G83 C84 I85 S90 V95 K99 S106	G83-Y87 VanDerWaalsContact O-CB 3.23Å; G83-Y87 WeakPolarHBondContact O-CB 3.39Å; G83-Y87 PolarHBondContact O-N 2.82Å; C84-Y87 PolarHBondContact O-N 2.86Å; I85-Y87 PolarHBondContact O-N 3.43Å; Y87-S90 WeakPolarHBondContact O-CB 3.36Å; Y87-S90 PolarHBondContact O-N 3.45Å; Y87-V95 HydrophobicContact CD2-CG1 3.58Å; Y87-V95 HydrophobicContact CE2-CG1 3.68Å; Y87-K99 HydrophobicContact CE1-CD 4.12Å; Y87-K99 HydrophobicContact CE1-CG 3.95Å; Y87-K99 HydrophobicContact CE2-CG 4.13Å; Y87-K99 PolarHBondContact O-NZ 3.3Å; Y87-K99 WeakPolarHBondContact OH-CG 3.24Å; Y87-S106 PolarHBondContact OH-OG 3.32Å
88	T	93.6	Very high	94.7	Very high	78 Å²	78	71.4 Å²	71.4	48%	0.479	42%	0.423	S	S	.	.	H	α-helix	trans	-67.4	-45.2	-177.4	-54.5	0	0	0	0	110.6	C84 I85 S90 K99	C84-T88 VanDerWaalsContact O-CB 3.3Å; C84-T88 WeakPolarHBondContact O-CB 3.47Å; C84-T88 PolarHBondContact O-N 3.38Å; C84-T88 PolarHBondContact O-OG1 3.46Å; I85-T88 PolarHBondContact O-N 3.4Å; T88-S90 VanDerWaalsContact C-N 3.3Å; T88-S90 PolarHBondContact O-N 2.58Å; T88-K99 PolarHBondContact O-NZ 3.05Å
89	A	94.6	Very high	94.7	Very high	76 Å²	76	71.5 Å²	71.5	63%	0.628	42%	0.422	S	S	*	.	H	α-helix	trans	-76.4	-10.9	178.3	0	0	0	0	0	114.2	I85 T91	I85-A89 VanDerWaalsContact O-CB 3.23Å; I85-A89 WeakPolarHBondContact O-CB 3.36Å; I85-A89 PolarHBondContact O-N 2.82Å; A89-T91 PolarHBondContact O-N 3.34Å
90	S	93.3	Very high	94.7	Very high	33 Å²	33	75.9 Å²	75.9	23%	0.231	43%	0.43	C	S	.	.			trans	-64.5	127.6	-177.3	-169.3	0	0	0	0	112.2	A86 Y87 T88 N92 K99	A86-S90 WeakPolarHBondContact O-CA 3.29Å; A86-S90 VanDerWaalsContact O-CB 3.26Å; A86-S90 WeakPolarHBondContact O-CB 3.27Å; A86-S90 PolarHBondContact O-N 2.93Å; Y87-S90 WeakPolarHBondContact O-CB 3.36Å; Y87-S90 PolarHBondContact O-N 3.45Å; T88-S90 VanDerWaalsContact C-N 3.3Å; T88-S90 PolarHBondContact O-N 2.58Å; S90-N92 WeakPolarHBondContact OG-CB 3.42Å; S90-N92 PolarHBondContact OG-N 2.99Å; S90-K99 PolarHBondContact O-NZ 2.68Å
91	T	93.6	Very high	94.7	Very high	130 Å²	130	76.5 Å²	76.5	80%	0.798	44%	0.438	S	S	*	.			trans	-95.1	1.8	170.6	55.6	0	0	0	0	112.7	A89	A89-T91 PolarHBondContact O-N 3.34Å
92	N	93.6	Very high	94.8	Very high	77 Å²	77	81.8 Å²	81.8	41%	0.412	46%	0.456	S	S	.	.			trans	-61.7	126.8	179.6	-174.9	-52.7	0	0	0	109.9	S90 K94 V95 V96	S90-N92 WeakPolarHBondContact OG-CB 3.42Å; S90-N92 PolarHBondContact OG-N 2.99Å; N92-K94 PolarHBondContact O-N 3.33Å; N92-K94 VanDerWaalsContact O-N 3.08Å; N92-K94 WeakPolarHBondContact OD1-CB 3.44Å; N92-K94 PolarHBondContact OD1-N 3.13Å; N92-V95 HydrophobicContact CB-CB 4.34Å; N92-V95 HydrophobicContact CB-CG2 4.04Å; N92-V95 PolarHBondContact O-N 2.81Å; N92-V96 WeakPolarHBondContact O-CG2 3.27Å; N92-V96 PolarHBondContact O-N 2.95Å
93	P	93.7	Very high	94.8	Very high	104 Å²	104	80.8 Å²	80.8	68%	0.675	46%	0.455	S	S	*	.	H	α-helix	trans	-53.4	-35	-176.5	-28.2	34.6	0	0	0	114.1	S97	P93-S97 WeakPolarHBondContact O-CB 3.42Å; P93-S97 PolarHBondContact O-N 2.99Å; P93-S97 PolarHBondContact O-OG 3.34Å
94	K	94.4	Very high	94.9	Very high	165 Å²	165	83.5 Å²	83.5	72%	0.717	46%	0.464	S	S	*	.	H	α-helix	trans	-68.5	-38.6	177.8	-62.5	-177.9	178.6	-179.2	0	112.3	N92 S97 V98	N92-K94 PolarHBondContact O-N 3.33Å; N92-K94 VanDerWaalsContact O-N 3.08Å; N92-K94 WeakPolarHBondContact OD1-CB 3.44Å; N92-K94 PolarHBondContact OD1-N 3.13Å; K94-S97 WeakPolarHBondContact CA-OG 3.39Å; K94-S97 PolarHBondContact O-OG 2.73Å; K94-V98 VanDerWaalsContact O-CG2 3.3Å; K94-V98 WeakPolarHBondContact O-CG2 3.26Å; K94-V98 PolarHBondContact O-N 3.29Å
95	V	94	Very high	94.9	Very high	37 Å²	37	87.6 Å²	87.6	22%	0.224	48%	0.483	C	S	.	.	H	α-helix	trans	-73.8	-40.2	177.6	-177.9	0	0	0	0	109.9	Y87 N92 V98 K99	Y87-V95 HydrophobicContact CD2-CG1 3.58Å; Y87-V95 HydrophobicContact CE2-CG1 3.68Å; N92-V95 HydrophobicContact CB-CB 4.34Å; N92-V95 HydrophobicContact CB-CG2 4.04Å; N92-V95 PolarHBondContact O-N 2.81Å; V95-V98 PolarHBondContact O-N 2.85Å; V95-K99 WeakPolarHBondContact O-CG 3.23Å; V95-K99 PolarHBondContact O-N 3.39Å
96	V	94.9	Very high	94.8	Very high	41 Å²	41	83.4 Å²	83.4	25%	0.248	46%	0.463	C	S	.	.	H	α-helix	trans	-63.5	-41.1	175.8	175.6	0	0	0	0	111.2	N92 K99 R100	N92-V96 WeakPolarHBondContact O-CG2 3.27Å; N92-V96 PolarHBondContact O-N 2.95Å; V96-K99 PolarHBondContact O-N 3.46Å; V96-R100 WeakPolarHBondContact O-CG 3.41Å; V96-R100 PolarHBondContact O-N 2.86Å
97	S	95.6	Very high	94.8	Very high	59 Å²	59	85.8 Å²	85.8	41%	0.413	47%	0.467	S	S	.	.	H	α-helix	trans	-62.7	-44.6	175.8	64.3	0	0	0	0	111.2	P93 K94 K99 R100 T101	P93-S97 WeakPolarHBondContact O-CB 3.42Å; P93-S97 PolarHBondContact O-N 2.99Å; P93-S97 PolarHBondContact O-OG 3.34Å; K94-S97 WeakPolarHBondContact CA-OG 3.39Å; K94-S97 PolarHBondContact O-OG 2.73Å; S97-K99 PolarHBondContact O-N 2.95Å; S97-R100 PolarHBondContact O-N 3.28Å; S97-R100 VanDerWaalsContact O-N 3.12Å; S97-T101 WeakPolarHBondContact O-CB 3.44Å; S97-T101 PolarHBondContact O-N 3.46Å; S97-T101 PolarHBondContact O-OG1 2.82Å
98	V	94.1	Very high	95	Very high	67 Å²	67	87.7 Å²	87.7	41%	0.406	48%	0.48	S	S	.	.	H	α-helix	trans	-58.7	-46.1	175.8	170.7	0	0	0	0	111.6	K94 V95 R100 T101 Y102	K94-V98 VanDerWaalsContact O-CG2 3.3Å; K94-V98 WeakPolarHBondContact O-CG2 3.26Å; K94-V98 PolarHBondContact O-N 3.29Å; V95-V98 PolarHBondContact O-N 2.85Å; V98-R100 VanDerWaalsContact C-N 3.25Å; V98-R100 PolarHBondContact O-N 2.83Å; V98-T101 PolarHBondContact O-N 3.31Å; V98-Y102 PolarHBondContact O-N 3.34Å
99	K	94.4	Very high	95.1	Very high	49 Å²	49	87 Å²	87	21%	0.213	48%	0.476	C	S	.	.	H	α-helix	trans	-57.4	-37.4	176.1	-74.6	-176.7	-67.1	-160.4	0	112.6	Y87 T88 S90 V95 V96 S97 P103	Y87-K99 HydrophobicContact CE1-CD 4.12Å; Y87-K99 HydrophobicContact CE1-CG 3.95Å; Y87-K99 HydrophobicContact CE2-CG 4.13Å; Y87-K99 PolarHBondContact O-NZ 3.3Å; Y87-K99 WeakPolarHBondContact OH-CG 3.24Å; T88-K99 PolarHBondContact O-NZ 3.05Å; S90-K99 PolarHBondContact O-NZ 2.68Å; V95-K99 WeakPolarHBondContact O-CG 3.23Å; V95-K99 PolarHBondContact O-N 3.39Å; V96-K99 PolarHBondContact O-N 3.46Å; S97-K99 PolarHBondContact O-N 2.95Å; K99-P103 WeakPolarHBondContact O-CA 3.34Å
100	R	95	Very high	95.1	Very high	203 Å²	203	85.6 Å²	85.6	77%	0.766	46%	0.459	S	S	*	.	H	α-helix	trans	-80.3	-37.1	179.8	-72.5	-177.1	176.9	-174.8	-0.5	113.3	V96 S97 V98	V96-R100 WeakPolarHBondContact O-CG 3.41Å; V96-R100 PolarHBondContact O-N 2.86Å; S97-R100 PolarHBondContact O-N 3.28Å; S97-R100 VanDerWaalsContact O-N 3.12Å; V98-R100 VanDerWaalsContact C-N 3.25Å; V98-R100 PolarHBondContact O-N 2.83Å
101	T	97.4	Very high	95.3	Very high	88 Å²	88	88 Å²	88	54%	0.54	47%	0.472	S	S	.	.	H	α-helix	trans	-72.7	-38.6	178.9	-55.5	0	0	0	0	111.4	S97 V98 P103	S97-T101 WeakPolarHBondContact O-CB 3.44Å; S97-T101 PolarHBondContact O-N 3.46Å; S97-T101 PolarHBondContact O-OG1 2.82Å; V98-T101 PolarHBondContact O-N 3.31Å; T101-P103 VanDerWaalsContact C-CD 3.44Å; T101-P103 WeakPolarHBondContact O-CD 3.37Å
102	Y	96.1	Very high	95.5	Very high	133 Å²	133	84.4 Å²	84.4	52%	0.522	45%	0.453	S	S	.	.	S	Bend	trans	-125.9	65.6	-177.7	-54.8	-73.2	0	0	0	112	V98 I105 S106	V98-Y102 PolarHBondContact O-N 3.34Å; Y102-I105 HydrophobicContact CD1-CD1 4.02Å; Y102-I105 HydrophobicContact CG-CD1 4.29Å; Y102-I105 PolarHBondContact O-N 2.87Å; Y102-S106 WeakPolarHBondContact O-CB 3.38Å; Y102-S106 PolarHBondContact O-N 2.89Å; Y102-S106 PolarHBondContact O-OG 3.44Å
103	P	96.4	Very high	95.6	Very high	76 Å²	76	82 Å²	82	49%	0.494	44%	0.439	S	S	.	.	H	α-helix	trans	-67.1	-40.7	-173.5	25.8	-33.5	0	0	0	112.4	K99 T101 S106 L107	K99-P103 WeakPolarHBondContact O-CA 3.34Å; T101-P103 VanDerWaalsContact C-CD 3.44Å; T101-P103 WeakPolarHBondContact O-CD 3.37Å; P103-S106 WeakPolarHBondContact O-CB 3.05Å; P103-S106 PolarHBondContact O-N 3.22Å; P103-L107 WeakPolarHBondContact O-CB 3.34Å; P103-L107 PolarHBondContact O-N 2.99Å
104	V	97.1	Very high	95.7	Very high	99 Å²	99	81.8 Å²	81.8	60%	0.6	43%	0.432	S	S	*	.	H	α-helix	trans	-66.5	-43	179.9	179.2	0	0	0	0	111.2	S106 L107 I108	V104-S106 VanDerWaalsContact C-N 3.32Å; V104-S106 PolarHBondContact O-N 2.88Å; V104-L107 PolarHBondContact O-N 3.09Å; V104-I108 HydrophobicContact CG1-CD1 3.86Å; V104-I108 HydrophobicContact CG1-CG1 4.4Å; V104-I108 VanDerWaalsContact O-CG1 3.31Å; V104-I108 WeakPolarHBondContact O-CG1 3.49Å; V104-I108 PolarHBondContact O-N 2.91Å
105	I	95.5	Very high	95.8	Very high	102 Å²	102	80.5 Å²	80.5	52%	0.523	42%	0.424	S	S	.	.	H	α-helix	trans	-63.2	-41.8	176.5	-58.4	179.9	0	0	0	110.3	Y102 L107 I108 T109	Y102-I105 HydrophobicContact CD1-CD1 4.02Å; Y102-I105 HydrophobicContact CG-CD1 4.29Å; Y102-I105 PolarHBondContact O-N 2.87Å; I105-L107 VanDerWaalsContact C-N 3.34Å; I105-L107 PolarHBondContact O-N 3.33Å; I105-I108 PolarHBondContact O-N 2.92Å; I105-T109 WeakPolarHBondContact O-CB 3.03Å; I105-T109 PolarHBondContact O-N 3.05Å; I105-T109 PolarHBondContact O-OG1 3.22Å
106	S	94.2	Very high	95.8	Very high	14 Å²	14	82.4 Å²	82.4	10%	0.098	43%	0.432	C	S	.	.	H	α-helix	trans	-59.2	-46.4	175.4	-62.5	0	0	0	0	111.4	Y87 Y102 P103 V104 T109 V110	Y87-S106 PolarHBondContact OH-OG 3.32Å; Y102-S106 WeakPolarHBondContact O-CB 3.38Å; Y102-S106 PolarHBondContact O-N 2.89Å; Y102-S106 PolarHBondContact O-OG 3.44Å; P103-S106 WeakPolarHBondContact O-CB 3.05Å; P103-S106 PolarHBondContact O-N 3.22Å; V104-S106 VanDerWaalsContact C-N 3.32Å; V104-S106 PolarHBondContact O-N 2.88Å; S106-T109 PolarHBondContact O-N 2.8Å; S106-V110 WeakPolarHBondContact O-CG2 3.32Å; S106-V110 PolarHBondContact O-N 3.37Å
107	L	95.8	Very high	95.7	Very high	111 Å²	111	82.5 Å²	82.5	58%	0.581	43%	0.431	S	S	*	.	H	α-helix	trans	-62.9	-48.3	177.6	-178.9	62.9	0	0	0	111.7	P103 V104 I105 T109 V110 V111	P103-L107 WeakPolarHBondContact O-CB 3.34Å; P103-L107 PolarHBondContact O-N 2.99Å; V104-L107 PolarHBondContact O-N 3.09Å; I105-L107 VanDerWaalsContact C-N 3.34Å; I105-L107 PolarHBondContact O-N 3.33Å; L107-T109 PolarHBondContact O-N 3.03Å; L107-V110 PolarHBondContact O-N 2.85Å; L107-V111 HydrophobicContact CD1-CG2 4.08Å; L107-V111 HydrophobicContact CG-CG2 4.34Å; L107-V111 WeakPolarHBondContact O-CB 3.46Å; L107-V111 VanDerWaalsContact O-CG2 3.3Å; L107-V111 WeakPolarHBondContact O-CG2 3.45Å; L107-V111 PolarHBondContact O-N 3.25Å
108	I	97.5	Very high	95.6	Very high	99 Å²	99	84.3 Å²	84.3	51%	0.508	44%	0.439	S	S	.	.	H	α-helix	trans	-57.3	-41.7	177.2	-70.3	168.6	0	0	0	110.6	V104 I105 S112	V104-I108 HydrophobicContact CG1-CD1 3.86Å; V104-I108 HydrophobicContact CG1-CG1 4.4Å; V104-I108 VanDerWaalsContact O-CG1 3.31Å; V104-I108 WeakPolarHBondContact O-CG1 3.49Å; V104-I108 PolarHBondContact O-N 2.91Å; I105-I108 PolarHBondContact O-N 2.92Å; I108-S112 VanDerWaalsContact O-CB 3.23Å; I108-S112 WeakPolarHBondContact O-CB 3.46Å; I108-S112 PolarHBondContact O-N 3.19Å; I108-S112 PolarHBondContact O-OG 3.45Å
109	T	95.4	Very high	95.5	Very high	65 Å²	65	90.1 Å²	90.1	40%	0.399	45%	0.454	S	S	.	.	H	α-helix	trans	-62.3	-49.7	178.1	-56.5	0	0	0	0	111.2	I105 S106 L107 V111 S112 I113	I105-T109 WeakPolarHBondContact O-CB 3.03Å; I105-T109 PolarHBondContact O-N 3.05Å; I105-T109 PolarHBondContact O-OG1 3.22Å; S106-T109 PolarHBondContact O-N 2.8Å; L107-T109 PolarHBondContact O-N 3.03Å; T109-V111 PolarHBondContact O-N 3.21Å; T109-S112 PolarHBondContact O-N 3.03Å; T109-I113 HydrophobicContact CG2-CD1 4.04Å; T109-I113 WeakPolarHBondContact O-CG1 3.37Å; T109-I113 PolarHBondContact O-N 3.28Å
110	V	96.2	Very high	95.4	Very high	46 Å²	46	88.2 Å²	88.2	28%	0.279	45%	0.447	S	S	.	.	H	α-helix	trans	-61.3	-46.6	178.7	173.1	0	0	0	0	111.1	S106 L107 S112 I113 L114	S106-V110 WeakPolarHBondContact O-CG2 3.32Å; S106-V110 PolarHBondContact O-N 3.37Å; L107-V110 PolarHBondContact O-N 2.85Å; V110-S112 VanDerWaalsContact C-N 3.33Å; V110-S112 PolarHBondContact O-N 3.34Å; V110-I113 PolarHBondContact O-N 2.71Å; V110-L114 WeakPolarHBondContact O-CB 3.38Å; V110-L114 PolarHBondContact O-N 2.75Å
111	V	97.1	Very high	95.1	Very high	82 Å²	82	83.2 Å²	83.2	50%	0.497	44%	0.435	S	S	.	.	H	α-helix	trans	-62.6	-40.6	178.2	171.8	0	0	0	0	111.2	L107 T109 L114 Y115	L107-V111 HydrophobicContact CD1-CG2 4.08Å; L107-V111 HydrophobicContact CG-CG2 4.34Å; L107-V111 WeakPolarHBondContact O-CB 3.46Å; L107-V111 VanDerWaalsContact O-CG2 3.3Å; L107-V111 WeakPolarHBondContact O-CG2 3.45Å; L107-V111 PolarHBondContact O-N 3.25Å; T109-V111 PolarHBondContact O-N 3.21Å; V111-L114 PolarHBondContact O-N 3.38Å; V111-Y115 WeakPolarHBondContact O-CB 3.35Å; V111-Y115 PolarHBondContact O-N 2.95Å
112	S	96.8	Very high	94.5	Very high	56 Å²	56	85.8 Å²	85.8	39%	0.392	44%	0.44	S	S	.	.	H	α-helix	trans	-64.7	-43.4	178.1	-60.5	0	0	0	0	111.8	I108 T109 V110 Y115 L116	I108-S112 VanDerWaalsContact O-CB 3.23Å; I108-S112 WeakPolarHBondContact O-CB 3.46Å; I108-S112 PolarHBondContact O-N 3.19Å; I108-S112 PolarHBondContact O-OG 3.45Å; T109-S112 PolarHBondContact O-N 3.03Å; V110-S112 VanDerWaalsContact C-N 3.33Å; V110-S112 PolarHBondContact O-N 3.34Å; S112-Y115 PolarHBondContact O-N 2.96Å; S112-L116 WeakPolarHBondContact O-CG 3.22Å; S112-L116 PolarHBondContact O-N 2.83Å
113	I	96.6	Very high	94.1	Very high	25 Å²	25	79.8 Å²	79.8	13%	0.128	42%	0.418	C	S	.	.	H	α-helix	trans	-66.3	-41.1	177.1	-66.6	170.9	0	0	0	110.6	L80 C84 T109 V110 L116 L117	L80-I113 HydrophobicContact CB-CG2 4.26Å; C84-I113 HydrophobicContact CB-CB 4.43Å; C84-I113 HydrophobicContact CB-CD1 3.76Å; C84-I113 HydrophobicContact CB-CG2 3.93Å; T109-I113 HydrophobicContact CG2-CD1 4.04Å; T109-I113 WeakPolarHBondContact O-CG1 3.37Å; T109-I113 PolarHBondContact O-N 3.28Å; V110-I113 PolarHBondContact O-N 2.71Å; I113-L116 PolarHBondContact O-N 3.05Å; I113-L117 WeakPolarHBondContact O-CB 3.21Å; I113-L117 PolarHBondContact O-N 3.16Å
114	L	95.3	Very high	93.6	Very high	100 Å²	100	77 Å²	77	52%	0.524	40%	0.399	S	S	.	.	H	α-helix	trans	-63.5	-40.7	175.4	-177.8	60.5	0	0	0	111.9	V110 V111 L117 V118	V110-L114 WeakPolarHBondContact O-CB 3.38Å; V110-L114 PolarHBondContact O-N 2.75Å; V111-L114 PolarHBondContact O-N 3.38Å; L114-L117 HydrophobicContact CD1-CD2 4.15Å; L114-L117 WeakPolarHBondContact O-CB 3.49Å; L114-L117 PolarHBondContact O-N 3.42Å; L114-V118 WeakPolarHBondContact O-CG2 3.31Å; L114-V118 PolarHBondContact O-N 3.48Å; L114-V118 VanDerWaalsContact O-N 3.08Å
115	Y	95.9	Very high	92.9	Very high	138 Å²	138	75.7 Å²	75.7	54%	0.541	39%	0.387	S	S	.	.	H	α-helix	trans	-62.1	-46.7	174.3	173.8	-98.6	0	0	0	111.7	V111 S112 L117 V118 R119	V111-Y115 WeakPolarHBondContact O-CB 3.35Å; V111-Y115 PolarHBondContact O-N 2.95Å; S112-Y115 PolarHBondContact O-N 2.96Å; Y115-L117 VanDerWaalsContact C-N 3.32Å; Y115-L117 PolarHBondContact O-N 3.3Å; Y115-V118 PolarHBondContact O-N 2.9Å; Y115-R119 WeakPolarHBondContact O-CB 3.48Å; Y115-R119 PolarHBondContact O-N 3.47Å; Y115-R119 WeakPolarHBondContact OH-CD 3.13Å
116	L	94.5	Very high	92.2	Very high	78 Å²	78	72.4 Å²	72.4	41%	0.408	37%	0.369	S	S	.	.	H	α-helix	trans	-58.4	-45.7	175.1	-72.4	175.6	0	0	0	110.9	S112 I113 V118 R119 S120	S112-L116 WeakPolarHBondContact O-CG 3.22Å; S112-L116 PolarHBondContact O-N 2.83Å; I113-L116 PolarHBondContact O-N 3.05Å; L116-V118 PolarHBondContact O-N 2.92Å; L116-R119 PolarHBondContact O-N 3.28Å; L116-S120 WeakPolarHBondContact O-CB 3.39Å; L116-S120 PolarHBondContact O-N 2.6Å; L116-S120 PolarHBondContact O-OG 3.22Å
117	L	93.5	Very high	91.7	Very high	42 Å²	42	72 Å²	72	22%	0.22	37%	0.366	C	S	.	.	H	α-helix	trans	-53.8	-49.3	177.7	178.8	70	0	0	0	112.3	V77 T81 I113 L114 Y115 S120 L121 L124	V77-L117 HydrophobicContact CG1-CB 4.29Å; V77-L117 HydrophobicContact CG1-CD1 3.79Å; T81-L117 HydrophobicContact CG2-CD1 4.25Å; T81-L117 HydrophobicContact CG2-CD2 4.11Å; I113-L117 WeakPolarHBondContact O-CB 3.21Å; I113-L117 PolarHBondContact O-N 3.16Å; L114-L117 HydrophobicContact CD1-CD2 4.15Å; L114-L117 WeakPolarHBondContact O-CB 3.49Å; L114-L117 PolarHBondContact O-N 3.42Å; Y115-L117 VanDerWaalsContact C-N 3.32Å; Y115-L117 PolarHBondContact O-N 3.3Å; L117-S120 PolarHBondContact O-OG 3.24Å; L117-L121 PolarHBondContact O-N 2.99Å; L117-L124 HydrophobicContact CD1-CD2 3.42Å; L117-L124 VanDerWaalsContact CD1-CD2 3.42Å
118	V	92.9	Very high	90.9	Very high	97 Å²	97	69.7 Å²	69.7	59%	0.588	35%	0.354	S	S	*	.	H	α-helix	trans	-66.3	-42.3	179	174.6	0	0	0	0	111	L114 Y115 L116 S120 L121	L114-V118 WeakPolarHBondContact O-CG2 3.31Å; L114-V118 PolarHBondContact O-N 3.48Å; L114-V118 VanDerWaalsContact O-N 3.08Å; Y115-V118 PolarHBondContact O-N 2.9Å; L116-V118 PolarHBondContact O-N 2.92Å; V118-S120 VanDerWaalsContact C-N 3.34Å; V118-S120 PolarHBondContact O-N 3.08Å; V118-L121 WeakPolarHBondContact O-CB 3.44Å; V118-L121 PolarHBondContact O-N 3.39Å
119	R	92.1	Very high	89.7	Confident	189 Å²	189	67.6 Å²	67.6	71%	0.713	34%	0.341	S	S	*	.	H	α-helix	trans	-71.1	-28.6	-177.1	-176.6	161.6	154.5	104.6	-6.2	113.3	Y115 L116	Y115-R119 WeakPolarHBondContact O-CB 3.48Å; Y115-R119 PolarHBondContact O-N 3.47Å; Y115-R119 WeakPolarHBondContact OH-CD 3.13Å; L116-R119 PolarHBondContact O-N 3.28Å
120	S	91.3	Very high	88.6	Confident	10 Å²	10	65 Å²	65	7%	0.07	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	16.9	178	65.1	0	0	0	0	113.3	V77 L116 L117 V118 H122 S123 L124	V77-S120 WeakPolarHBondContact CG1-OG 3.34Å; V77-S120 WeakPolarHBondContact CG2-OG 3.25Å; L116-S120 WeakPolarHBondContact O-CB 3.39Å; L116-S120 PolarHBondContact O-N 2.6Å; L116-S120 PolarHBondContact O-OG 3.22Å; L117-S120 PolarHBondContact O-OG 3.24Å; V118-S120 VanDerWaalsContact C-N 3.34Å; V118-S120 PolarHBondContact O-N 3.08Å; S120-H122 PolarHBondContact O-N 3.41Å; S120-H122 VanDerWaalsContact O-N 3.16Å; S120-S123 PolarHBondContact O-N 3.23Å; S120-L124 PolarHBondContact O-N 3.06Å
121	L	89.3	Confident	87.3	Confident	97 Å²	97	67.5 Å²	67.5	51%	0.508	34%	0.338	S	S	.	.	H	α-helix	trans	-53.5	-42.2	-173.3	-166.8	154.7	0	0	0	111.7	L117 V118 S123 L124 M125	L117-L121 PolarHBondContact O-N 2.99Å; V118-L121 WeakPolarHBondContact O-CB 3.44Å; V118-L121 PolarHBondContact O-N 3.39Å; L121-S123 PolarHBondContact O-N 3.21Å; L121-L124 PolarHBondContact O-N 3.04Å; L121-M125 HydrophobicContact CD2-CG 3.59Å; L121-M125 HydrophobicContact CD2-SD 4.36Å; L121-M125 HydrophobicContact CG-CG 4.41Å; L121-M125 WeakPolarHBondContact O-CB 3.49Å; L121-M125 WeakPolarHBondContact O-CG 3.44Å; L121-M125 PolarHBondContact O-N 3.39Å
122	H	84.7	Confident	85.7	Confident	142 Å²	142	66 Å²	66	66%	0.657	33%	0.334	S	S	*	.	H	α-helix	trans	-55.9	-48.4	176.7	179	73.3	0	0	0	113.2	S120 M125 F126	S120-H122 PolarHBondContact O-N 3.41Å; S120-H122 VanDerWaalsContact O-N 3.16Å; H122-M125 PolarHBondContact O-N 3.31Å; H122-F126 PolarHBondContact O-N 3.2Å
123	S	87.6	Confident	83.6	Confident	7 Å²	7	67.8 Å²	67.8	5%	0.049	34%	0.339	C	S	.	.	H	α-helix	trans	-72.3	-37	-178.6	156.8	0	0	0	0	111.7	E70 L73 G74 S120 L121 F126 C127	E70-S123 PolarHBondContact O-OG 3.15Å; L73-S123 WeakPolarHBondContact CB-OG 3.45Å; G74-S123 VanDerWaalsContact CA-OG 3.28Å; G74-S123 WeakPolarHBondContact CA-OG 3.06Å; G74-S123 PolarHBondContact N-OG 3.32Å; S120-S123 PolarHBondContact O-N 3.23Å; L121-S123 PolarHBondContact O-N 3.21Å; S123-F126 PolarHBondContact O-N 2.89Å; S123-C127 WeakPolarHBondContact O-CB 3.46Å; S123-C127 PolarHBondContact O-N 3.31Å
124	L	86.5	Confident	80.9	Confident	19 Å²	19	68.9 Å²	68.9	10%	0.099	35%	0.347	C	S	.	.	H	α-helix	trans	-60.8	-46.7	170.9	-178.1	68.3	0	0	0	111.3	L78 L117 S120 L121 F126 C127 L128	L78-L124 HydrophobicContact CB-CD1 3.98Å; L78-L124 HydrophobicContact CD1-CD1 4.33Å; L117-L124 HydrophobicContact CD1-CD2 3.42Å; L117-L124 VanDerWaalsContact CD1-CD2 3.42Å; S120-L124 PolarHBondContact O-N 3.06Å; L121-L124 PolarHBondContact O-N 3.04Å; L124-F126 VanDerWaalsContact C-N 3.32Å; L124-F126 PolarHBondContact O-N 3.31Å; L124-C127 PolarHBondContact O-N 2.95Å; L124-L128 HydrophobicContact CD1-CD1 4.18Å; L124-L128 HydrophobicContact CD1-CG 4.22Å; L124-L128 HydrophobicContact CD2-CD1 4.36Å; L124-L128 HydrophobicContact CG-CD1 3.87Å; L124-L128 HydrophobicContact CG-CG 4.26Å; L124-L128 WeakPolarHBondContact O-CB 3.33Å; L124-L128 WeakPolarHBondContact O-CG 3.34Å; L124-L128 PolarHBondContact O-N 3.31Å
125	M	81.2	Confident	78.6	Confident	71 Å²	71	69.9 Å²	69.9	35%	0.35	36%	0.358	S	S	.	.	H	α-helix	trans	-61.8	-43	177	-67.1	-49.2	-65.4	0	0	110.3	L121 H122 C127 L128 F129	L121-M125 HydrophobicContact CD2-CG 3.59Å; L121-M125 HydrophobicContact CD2-SD 4.36Å; L121-M125 HydrophobicContact CG-CG 4.41Å; L121-M125 WeakPolarHBondContact O-CB 3.49Å; L121-M125 WeakPolarHBondContact O-CG 3.44Å; L121-M125 PolarHBondContact O-N 3.39Å; H122-M125 PolarHBondContact O-N 3.31Å; M125-C127 VanDerWaalsContact C-N 3.34Å; M125-C127 PolarHBondContact O-N 3.37Å; M125-L128 PolarHBondContact O-N 3.34Å; M125-F129 HydrophobicContact CB-CD2 3.99Å; M125-F129 HydrophobicContact CB-CE2 4.03Å; M125-F129 HydrophobicContact CE-CD2 4.02Å; M125-F129 HydrophobicContact CE-CE2 3.18Å; M125-F129 HydrophobicContact CE-CZ 3.5Å; M125-F129 WeakPolarHBondContact O-CB 3.26Å; M125-F129 WeakPolarHBondContact O-CD2 3.45Å; M125-F129 WeakPolarHBondContact O-CG 3.19Å; M125-F129 PolarHBondContact O-N 2.91Å
126	F	81.5	Confident	76	Confident	33 Å²	33	69.8 Å²	69.8	15%	0.145	37%	0.366	C	S	.	.	H	α-helix	trans	-57.2	-47.8	174.2	-172.9	-88.9	0	0	0	111.6	V63 R67 E70 I71 H122 S123 L124 F129 A130 Q142	V63-F126 HydrophobicContact CG1-CZ 4.17Å; R67-F126 HydrophobicContact CB-CD1 4.37Å; R67-F126 HydrophobicContact CB-CE1 3.69Å; R67-F126 HydrophobicContact CB-CE2 4.15Å; R67-F126 HydrophobicContact CB-CZ 3.56Å; R67-F126 HydrophobicContact CG-CE1 4.31Å; R67-F126 HydrophobicContact CG-CE2 3.87Å; R67-F126 HydrophobicContact CG-CZ 3.68Å; E70-F126 HydrophobicContact CB-CB 4.35Å; E70-F126 HydrophobicContact CB-CD1 4.04Å; E70-F126 HydrophobicContact CB-CG 4.21Å; I71-F126 HydrophobicContact CD1-CD1 3.74Å; I71-F126 HydrophobicContact CD1-CE1 3.72Å; I71-F126 HydrophobicContact CG1-CD1 3.91Å; I71-F126 HydrophobicContact CG1-CE1 3.67Å; H122-F126 PolarHBondContact O-N 3.2Å; S123-F126 PolarHBondContact O-N 2.89Å; L124-F126 VanDerWaalsContact C-N 3.32Å; L124-F126 PolarHBondContact O-N 3.31Å; F126-F129 PolarHBondContact O-N 3.47Å; F126-A130 VanDerWaalsContact O-CB 3.24Å; F126-A130 WeakPolarHBondContact O-CB 3.43Å; F126-A130 PolarHBondContact O-N 2.66Å; F126-Q142 HydrophobicContact CE2-CG 4.25Å
127	C	83.1	Confident	74.1	Confident	5 Å²	5	72 Å²	72	3%	0.034	39%	0.385	C	S	.	.	H	α-helix	trans	-62.5	-44.8	178.5	-176	0	0	0	0	113	I71 S123 L124 M125 L131	I71-C127 HydrophobicContact CD1-CB 4.42Å; S123-C127 WeakPolarHBondContact O-CB 3.46Å; S123-C127 PolarHBondContact O-N 3.31Å; L124-C127 PolarHBondContact O-N 2.95Å; M125-C127 VanDerWaalsContact C-N 3.34Å; M125-C127 PolarHBondContact O-N 3.37Å; C127-L131 PolarHBondContact O-N 3.05Å
128	L	80.1	Confident	72.2	Confident	63 Å²	63	79.2 Å²	79.2	33%	0.33	41%	0.414	S	S	.	.	H	α-helix	trans	-69.8	-41.4	178.6	-69.6	176.1	0	0	0	111.7	L78 L124 M125 L131 A132	L78-L128 HydrophobicContact CD1-CD2 4.2Å; L78-L128 HydrophobicContact CD2-CD2 4.13Å; L124-L128 HydrophobicContact CD1-CD1 4.18Å; L124-L128 HydrophobicContact CD1-CG 4.22Å; L124-L128 HydrophobicContact CD2-CD1 4.36Å; L124-L128 HydrophobicContact CG-CD1 3.87Å; L124-L128 HydrophobicContact CG-CG 4.26Å; L124-L128 WeakPolarHBondContact O-CB 3.33Å; L124-L128 WeakPolarHBondContact O-CG 3.34Å; L124-L128 PolarHBondContact O-N 3.31Å; M125-L128 PolarHBondContact O-N 3.34Å; L128-L131 WeakPolarHBondContact O-CB 3.13Å; L128-L131 PolarHBondContact O-N 3.13Å; L128-L131 VanDerWaalsContact O-N 3.09Å; L128-A132 WeakPolarHBondContact O-CB 3.39Å; L128-A132 PolarHBondContact O-N 2.85Å
129	F	72.4	Confident	70.3	Confident	54 Å²	54	79.9 Å²	79.9	24%	0.237	41%	0.414	C	S	.	.	H	α-helix	trans	-67	-39.9	176.4	-78.5	-59.1	0	0	0	111.3	M125 F126 L131 A132 L133 V146	M125-F129 HydrophobicContact CB-CD2 3.99Å; M125-F129 HydrophobicContact CB-CE2 4.03Å; M125-F129 HydrophobicContact CE-CD2 4.02Å; M125-F129 HydrophobicContact CE-CE2 3.18Å; M125-F129 HydrophobicContact CE-CZ 3.5Å; M125-F129 WeakPolarHBondContact O-CB 3.26Å; M125-F129 WeakPolarHBondContact O-CD2 3.45Å; M125-F129 WeakPolarHBondContact O-CG 3.19Å; M125-F129 PolarHBondContact O-N 2.91Å; F126-F129 PolarHBondContact O-N 3.47Å; F129-L131 PolarHBondContact O-N 3.3Å; F129-A132 PolarHBondContact O-N 3.28Å; F129-L133 HydrophobicContact CD1-CB 3.78Å; F129-L133 HydrophobicContact CD1-CD1 4.5Å; F129-L133 HydrophobicContact CE1-CB 3.82Å; F129-L133 HydrophobicContact CE1-CD1 4.03Å; F129-V146 WeakPolarHBondContact O-CG1 3.42Å; F129-V146 WeakPolarHBondContact O-CG2 3.33Å
130	A	72.3	Confident	68.7	Low	12 Å²	12	81.9 Å²	81.9	10%	0.099	42%	0.421	C	S	.	.	H	α-helix	trans	-55.6	-24.8	172.3	0	0	0	0	0	112.4	F60 V63 I71 F126	F60-A130 HydrophobicContact CD2-CB 4.02Å; F60-A130 HydrophobicContact CE2-CB 4.22Å; V63-A130 HydrophobicContact CG1-CB 4.48Å; I71-A130 HydrophobicContact CD1-CB 4.15Å; F126-A130 VanDerWaalsContact O-CB 3.24Å; F126-A130 WeakPolarHBondContact O-CB 3.43Å; F126-A130 PolarHBondContact O-N 2.66Å
131	L	68.1	Low	67.1	Low	98 Å²	98	87 Å²	87	51%	0.513	45%	0.447	S	S	.	.	H	α-helix	trans	-94.9	-35.1	179.4	-167.7	65.1	0	0	0	114.6	C127 L128 F129	C127-L131 PolarHBondContact O-N 3.05Å; L128-L131 WeakPolarHBondContact O-CB 3.13Å; L128-L131 PolarHBondContact O-N 3.13Å; L128-L131 VanDerWaalsContact O-N 3.09Å; F129-L131 PolarHBondContact O-N 3.3Å
132	A	63.3	Low	65.6	Low	50 Å²	50	85.5 Å²	85.5	41%	0.413	44%	0.438	S	S	.	.	H	α-helix	trans	-135	-25.8	-151.4	0	0	0	0	0	120.8	L128 F129 I150	L128-A132 WeakPolarHBondContact O-CB 3.39Å; L128-A132 PolarHBondContact O-N 2.85Å; F129-A132 PolarHBondContact O-N 3.28Å; A132-I150 WeakPolarHBondContact O-CD1 3.49Å
133	L	53.7	Low	64.3	Low	93 Å²	93	79.8 Å²	79.8	49%	0.487	41%	0.414	S	S	.	.			trans	-140.2	129.4	-160.5	-68.1	173.1	0	0	0	117.9	F129	F129-L133 HydrophobicContact CD1-CB 3.78Å; F129-L133 HydrophobicContact CD1-CD1 4.5Å; F129-L133 HydrophobicContact CE1-CB 3.82Å; F129-L133 HydrophobicContact CE1-CD1 4.03Å
134	P	40.6	Very low	63.2	Low	48 Å²	48	88.1 Å²	88.1	31%	0.312	45%	0.445	S	S	.	.			trans	-76.6	130.9	136.4	-0.4	19.7	0	0	0	108.9	I147 I150	P134-I147 HydrophobicContact CB-CB 4.33Å; P134-I147 HydrophobicContact CB-CD1 3.53Å; P134-I147 HydrophobicContact CB-CG1 3.36Å; P134-I147 HydrophobicContact CB-CG2 4.21Å; P134-I147 HydrophobicContact CG-CB 4.33Å; P134-I147 HydrophobicContact CG-CD1 4.42Å; P134-I147 HydrophobicContact CG-CG1 3.75Å; P134-I147 HydrophobicContact CG-CG2 4.15Å; P134-I150 HydrophobicContact CG-CD1 4.49Å
135	V	45.7	Very low	62.3	Low	122 Å²	122	91.3 Å²	91.3	74%	0.739	46%	0.461	S	S	*	.			trans	170.5	101	131.9	-179	0	0	0	0	103.4
136	L	42.2	Very low	61.6	Low	135 Å²	135	88.4 Å²	88.4	71%	0.707	45%	0.447	S	S	*	.			trans	162.8	117	145.9	-84.8	178.4	0	0	0	108.7	K138	L136-K138 PolarHBondContact O-N 3.5Å
137	P	53.3	Low	61.1	Low	124 Å²	124	89.9 Å²	89.9	81%	0.805	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-0.1	-171.2	22.9	-31.1	0	0	0	116
138	K	53.7	Low	60.7	Low	195 Å²	195	95.9 Å²	95.9	85%	0.848	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-7.1	-177.4	-80.2	-170.9	176.1	-179.3	0	116.1	L136 R140	L136-K138 PolarHBondContact O-N 3.5Å; K138-R140 PolarHBondContact O-N 3.12Å
139	L	54	Low	60.5	Low	111 Å²	111	93.5 Å²	93.5	58%	0.581	47%	0.469	S	S	*	.	S	Bend	trans	-97	80.8	172	-106.9	68	0	0	0	111	L141 S143	L139-L141 VanDerWaalsContact C-N 3.33Å; L139-L141 PolarHBondContact O-N 3.29Å; L139-S143 WeakPolarHBondContact CB-OG 3.44Å; L139-S143 PolarHBondContact O-OG 3.29Å
140	R	57.7	Low	60.8	Low	230 Å²	230	92.8 Å²	92.8	87%	0.868	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	41	-157.4	-144.7	-177	-155.7	172.1	3.8	116	K138	K138-R140 PolarHBondContact O-N 3.12Å
141	L	58.8	Low	61.2	Low	117 Å²	117	95.4 Å²	95.4	61%	0.613	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-166.4	-45.8	158.1	-157.7	59.4	0	0	0	112.4	L139 R144	L139-L141 VanDerWaalsContact C-N 3.33Å; L139-L141 PolarHBondContact O-N 3.29Å; L141-R144 WeakPolarHBondContact O-CB 3.41Å; L141-R144 PolarHBondContact O-N 2.95Å
142	Q	56.8	Low	62	Low	66 Å²	66	93 Å²	93	31%	0.308	47%	0.474	S	S	.	.	H	α-helix	trans	-68.3	-38.1	-175.3	-67.3	-67.1	-25.1	0	0	112.4	F126 R144 L145	F126-Q142 HydrophobicContact CE2-CG 4.25Å; Q142-R144 PolarHBondContact O-N 2.93Å; Q142-L145 PolarHBondContact O-N 3.4Å
143	S	56.9	Low	63.1	Low	23 Å²	23	91.5 Å²	91.5	16%	0.161	46%	0.459	C	S	.	.	H	α-helix	trans	-62	-26.8	176.4	-50.5	0	0	0	0	112.7	L139 L145 I147	L139-S143 WeakPolarHBondContact CB-OG 3.44Å; L139-S143 PolarHBondContact O-OG 3.29Å; S143-L145 VanDerWaalsContact C-N 3.33Å; S143-L145 PolarHBondContact O-N 3.42Å; S143-I147 WeakPolarHBondContact O-CG1 3.16Å; S143-I147 PolarHBondContact O-N 2.97Å
144	R	64.8	Low	64.7	Low	182 Å²	182	92.1 Å²	92.1	69%	0.687	46%	0.458	S	S	*	.	H	α-helix	trans	-66.1	-35.6	-178.4	-65.5	-176.8	71.4	-165.7	1.8	112.4	L141 Q142 F148	L141-R144 WeakPolarHBondContact O-CB 3.41Å; L141-R144 PolarHBondContact O-N 2.95Å; Q142-R144 PolarHBondContact O-N 2.93Å; R144-F148 WeakPolarHBondContact O-CB 3.38Å; R144-F148 PolarHBondContact O-N 2.95Å; R144-F148 VanDerWaalsContact O-N 3.1Å
145	L	68.9	Low	67	Low	86 Å²	86	94.2 Å²	94.2	45%	0.45	47%	0.466	S	S	.	.	H	α-helix	trans	-71.1	-37.9	-177.5	-65.8	177.3	0	0	0	112.1	Q142 S143 F149	Q142-L145 PolarHBondContact O-N 3.4Å; S143-L145 VanDerWaalsContact C-N 3.33Å; S143-L145 PolarHBondContact O-N 3.42Å; L145-F149 VanDerWaalsContact O-CB 3.26Å; L145-F149 WeakPolarHBondContact O-CB 3.27Å; L145-F149 PolarHBondContact O-N 2.85Å
146	V	66.6	Low	69.1	Low	9 Å²	9	89.4 Å²	89.4	6%	0.055	44%	0.435	C	S	.	.	H	α-helix	trans	-67.9	-46.7	180	176.9	0	0	0	0	111	F129 F148 F149 I150	F129-V146 WeakPolarHBondContact O-CG1 3.42Å; F129-V146 WeakPolarHBondContact O-CG2 3.33Å; V146-F148 VanDerWaalsContact C-N 3.34Å; V146-F149 WeakPolarHBondContact O-CB 3.5Å; V146-F149 PolarHBondContact O-N 3.49Å; V146-F149 VanDerWaalsContact O-N 3.15Å; V146-I150 HydrophobicContact CG1-CD1 3.97Å; V146-I150 WeakPolarHBondContact O-CG1 3.47Å; V146-I150 PolarHBondContact O-N 2.73Å
147	I	70.4	Confident	71.3	Confident	65 Å²	65	83 Å²	83	33%	0.333	40%	0.401	S	S	.	.	H	α-helix	trans	-61.8	-48.5	178.5	-57.6	175.6	0	0	0	109.6	P134 S143 F149 I150 S151	P134-I147 HydrophobicContact CB-CB 4.33Å; P134-I147 HydrophobicContact CB-CD1 3.53Å; P134-I147 HydrophobicContact CB-CG1 3.36Å; P134-I147 HydrophobicContact CB-CG2 4.21Å; P134-I147 HydrophobicContact CG-CB 4.33Å; P134-I147 HydrophobicContact CG-CD1 4.42Å; P134-I147 HydrophobicContact CG-CG1 3.75Å; P134-I147 HydrophobicContact CG-CG2 4.15Å; S143-I147 WeakPolarHBondContact O-CG1 3.16Å; S143-I147 PolarHBondContact O-N 2.97Å; I147-F149 PolarHBondContact O-N 3.26Å; I147-I150 PolarHBondContact O-N 2.93Å; I147-S151 WeakPolarHBondContact O-CB 3.33Å; I147-S151 PolarHBondContact O-N 2.96Å; I147-S151 PolarHBondContact O-OG 3.43Å
148	F	74	Confident	72.9	Confident	130 Å²	130	77.5 Å²	77.5	57%	0.57	37%	0.366	S	S	*	.	H	α-helix	trans	-54.5	-43.5	175.1	177.3	-102.4	0	0	0	111.1	R144 V146 S151 V152	R144-F148 WeakPolarHBondContact O-CB 3.38Å; R144-F148 PolarHBondContact O-N 2.95Å; R144-F148 VanDerWaalsContact O-N 3.1Å; V146-F148 VanDerWaalsContact C-N 3.34Å; F148-S151 WeakPolarHBondContact O-CB 3.44Å; F148-S151 PolarHBondContact O-N 3.36Å; F148-V152 HydrophobicContact CD1-CG2 4.36Å; F148-V152 HydrophobicContact CE1-CG2 3.99Å; F148-V152 HydrophobicContact CE2-CG2 4.4Å; F148-V152 HydrophobicContact CZ-CG2 4.01Å; F148-V152 WeakPolarHBondContact O-CG2 3.4Å; F148-V152 PolarHBondContact O-N 3.18Å
149	F	76.6	Confident	74.5	Confident	14 Å²	14	69 Å²	69	6%	0.061	33%	0.331	C	S	.	.	H	α-helix	trans	-65.7	-46.9	179.8	-179.6	-116.4	0	0	0	113.5	L55 C56 F59 L145 V146 I147 S151 V152 I153	L55-F149 HydrophobicContact CD2-CE2 3.89Å; L55-F149 HydrophobicContact CD2-CZ 4.23Å; L55-F149 HydrophobicContact CG-CE2 3.71Å; L55-F149 HydrophobicContact CG-CZ 3.92Å; C56-F149 HydrophobicContact CB-CE1 4.25Å; C56-F149 HydrophobicContact CB-CZ 4.38Å; F59-F149 HydrophobicContact CB-CD1 4.25Å; F59-F149 HydrophobicContact CB-CD2 4Å; F59-F149 HydrophobicContact CB-CE1 4.07Å; F59-F149 HydrophobicContact CB-CE2 3.87Å; F59-F149 HydrophobicContact CB-CG 4.2Å; F59-F149 HydrophobicContact CB-CZ 3.87Å; F59-F149 HydrophobicContact CD1-CB 4.31Å; F59-F149 AromaticContact CD1-CD2 3.46Å; F59-F149 HydrophobicContact CD1-CD2 3.46Å; F59-F149 VanDerWaalsContact CD1-CD2 3.46Å; F59-F149 AromaticContact CD1-CE2 3.99Å; F59-F149 HydrophobicContact CD1-CE2 3.99Å; F59-F149 AromaticContact CD1-CG 3.92Å; F59-F149 HydrophobicContact CD1-CG 3.92Å; F59-F149 AromaticContact CD2-CD2 3.37Å; F59-F149 HydrophobicContact CD2-CD2 3.37Å; F59-F149 AromaticContact CD2-CE2 2.98Å; F59-F149 HydrophobicContact CD2-CE2 2.98Å; F59-F149 HydrophobicContact CD2-CG 4.36Å; F59-F149 AromaticContact CD2-CZ 3.69Å; F59-F149 HydrophobicContact CD2-CZ 3.69Å; F59-F149 AromaticContact CE1-CD2 3.63Å; F59-F149 HydrophobicContact CE1-CD2 3.63Å; F59-F149 HydrophobicContact CE1-CE2 4.27Å; F59-F149 HydrophobicContact CE1-CG 4.35Å; F59-F149 AromaticContact CE2-CD2 3.52Å; F59-F149 HydrophobicContact CE2-CD2 3.52Å; F59-F149 AromaticContact CE2-CE2 3.33Å; F59-F149 HydrophobicContact CE2-CE2 3.33Å; F59-F149 HydrophobicContact CE2-CZ 4.41Å; F59-F149 HydrophobicContact CG-CD1 4.41Å; F59-F149 AromaticContact CG-CD2 3.3Å; F59-F149 HydrophobicContact CG-CD2 3.3Å; F59-F149 HydrophobicContact CG-CE1 4.38Å; F59-F149 AromaticContact CG-CE2 3.33Å; F59-F149 HydrophobicContact CG-CE2 3.33Å; F59-F149 AromaticContact CG-CG 3.9Å; F59-F149 HydrophobicContact CG-CG 3.9Å; F59-F149 AromaticContact CG-CZ 3.87Å; F59-F149 HydrophobicContact CG-CZ 3.87Å; F59-F149 AromaticContact CZ-CD2 3.65Å; F59-F149 HydrophobicContact CZ-CD2 3.65Å; F59-F149 AromaticContact CZ-CE2 3.97Å; F59-F149 HydrophobicContact CZ-CE2 3.97Å; L145-F149 VanDerWaalsContact O-CB 3.26Å; L145-F149 WeakPolarHBondContact O-CB 3.27Å; L145-F149 PolarHBondContact O-N 2.85Å; V146-F149 WeakPolarHBondContact O-CB 3.5Å; V146-F149 PolarHBondContact O-N 3.49Å; V146-F149 VanDerWaalsContact O-N 3.15Å; I147-F149 PolarHBondContact O-N 3.26Å; F149-S151 VanDerWaalsContact C-N 3.26Å; F149-S151 PolarHBondContact O-N 3.45Å; F149-V152 WeakPolarHBondContact O-CB 3.34Å; F149-V152 PolarHBondContact O-N 2.56Å; F149-I153 HydrophobicContact CD1-CD1 4.25Å; F149-I153 HydrophobicContact CE1-CD1 3.52Å; F149-I153 HydrophobicContact CE1-CG1 4.39Å; F149-I153 HydrophobicContact CE2-CD1 4.16Å; F149-I153 HydrophobicContact CE2-CG1 4.18Å; F149-I153 HydrophobicContact CZ-CD1 3.48Å; F149-I153 VanDerWaalsContact CZ-CD1 3.48Å; F149-I153 HydrophobicContact CZ-CG1 3.99Å; F149-I153 PolarHBondContact O-N 3.13Å
150	I	78.2	Confident	76.1	Confident	39 Å²	39	63.7 Å²	63.7	20%	0.2	30%	0.303	C	S	.	.	H	α-helix	trans	-59.8	-42.5	174.9	-66.7	165.5	0	0	0	109.8	A132 P134 V146 I147 V152 I153 F154	A132-I150 WeakPolarHBondContact O-CD1 3.49Å; P134-I150 HydrophobicContact CG-CD1 4.49Å; V146-I150 HydrophobicContact CG1-CD1 3.97Å; V146-I150 WeakPolarHBondContact O-CG1 3.47Å; V146-I150 PolarHBondContact O-N 2.73Å; I147-I150 PolarHBondContact O-N 2.93Å; I150-V152 VanDerWaalsContact C-N 3.31Å; I150-V152 PolarHBondContact O-N 3.31Å; I150-I153 PolarHBondContact O-N 2.81Å; I150-F154 HydrophobicContact CG2-CD2 3.73Å; I150-F154 HydrophobicContact CG2-CE2 3.92Å; I150-F154 WeakPolarHBondContact O-CD2 3.2Å; I150-F154 PolarHBondContact O-N 3.17Å
151	S	82	Confident	77.2	Confident	66 Å²	66	55.1 Å²	55.1	46%	0.462	27%	0.274	S	S	.	.	H	α-helix	trans	-59.9	-39.4	174.3	-62.5	0	0	0	0	112.1	I147 F148 F149 F154 L155	I147-S151 WeakPolarHBondContact O-CB 3.33Å; I147-S151 PolarHBondContact O-N 2.96Å; I147-S151 PolarHBondContact O-OG 3.43Å; F148-S151 WeakPolarHBondContact O-CB 3.44Å; F148-S151 PolarHBondContact O-N 3.36Å; F149-S151 VanDerWaalsContact C-N 3.26Å; F149-S151 PolarHBondContact O-N 3.45Å; S151-F154 PolarHBondContact O-N 3.04Å; S151-L155 WeakPolarHBondContact O-CA 3.37Å; S151-L155 WeakPolarHBondContact O-CB 3.34Å; S151-L155 PolarHBondContact O-N 3.33Å
152	V	84.5	Confident	77.7	Confident	49 Å²	49	51 Å²	51	30%	0.297	25%	0.251	S	S	.	.	H	α-helix	trans	-63.7	-43.4	176	168.7	0	0	0	0	111.4	F148 F149 I150 H156	F148-V152 HydrophobicContact CD1-CG2 4.36Å; F148-V152 HydrophobicContact CE1-CG2 3.99Å; F148-V152 HydrophobicContact CE2-CG2 4.4Å; F148-V152 HydrophobicContact CZ-CG2 4.01Å; F148-V152 WeakPolarHBondContact O-CG2 3.4Å; F148-V152 PolarHBondContact O-N 3.18Å; F149-V152 WeakPolarHBondContact O-CB 3.34Å; F149-V152 PolarHBondContact O-N 2.56Å; I150-V152 VanDerWaalsContact C-N 3.31Å; I150-V152 PolarHBondContact O-N 3.31Å; V152-H156 WeakPolarHBondContact O-CB 3.33Å; V152-H156 PolarHBondContact O-N 3.29Å
153	I	86.3	Confident	78	Confident	18 Å²	18	49.5 Å²	49.5	9%	0.092	25%	0.245	C	C	.	.	H	α-helix	trans	-61.7	-51.7	176.8	-69	173.3	0	0	0	110.7	L45 Y52 L55 C56 F149 I150 H156 A157	L45-I153 HydrophobicContact CD2-CG2 4.29Å; Y52-I153 HydrophobicContact CD1-CG1 4.34Å; Y52-I153 HydrophobicContact CD1-CG2 3.77Å; Y52-I153 HydrophobicContact CE1-CG2 3.91Å; Y52-I153 HydrophobicContact CG-CG2 4.41Å; L55-I153 HydrophobicContact CD2-CG1 4.05Å; C56-I153 VanDerWaalsContact SG-CD1 3.51Å; F149-I153 HydrophobicContact CD1-CD1 4.25Å; F149-I153 HydrophobicContact CE1-CD1 3.52Å; F149-I153 HydrophobicContact CE1-CG1 4.39Å; F149-I153 HydrophobicContact CE2-CD1 4.16Å; F149-I153 HydrophobicContact CE2-CG1 4.18Å; F149-I153 HydrophobicContact CZ-CD1 3.48Å; F149-I153 VanDerWaalsContact CZ-CD1 3.48Å; F149-I153 HydrophobicContact CZ-CG1 3.99Å; F149-I153 PolarHBondContact O-N 3.13Å; I150-I153 PolarHBondContact O-N 2.81Å; I153-H156 PolarHBondContact O-N 3.42Å; I153-A157 WeakPolarHBondContact O-CB 3.44Å; I153-A157 PolarHBondContact O-N 3.33Å
154	F	86.8	Confident	77.8	Confident	105 Å²	105	55 Å²	55	46%	0.461	27%	0.271	S	S	.	.	H	α-helix	trans	-66.4	-39.7	-178.4	-88.7	-87.7	0	0	0	111.9	I41 I150 S151 A157 S158	I41-F154 HydrophobicContact CG2-CD1 4.32Å; I41-F154 HydrophobicContact CG2-CE1 4.34Å; I150-F154 HydrophobicContact CG2-CD2 3.73Å; I150-F154 HydrophobicContact CG2-CE2 3.92Å; I150-F154 WeakPolarHBondContact O-CD2 3.2Å; I150-F154 PolarHBondContact O-N 3.17Å; S151-F154 PolarHBondContact O-N 3.04Å; F154-A157 PolarHBondContact O-N 3.02Å; F154-S158 VanDerWaalsContact O-CB 3.22Å; F154-S158 WeakPolarHBondContact O-CB 3.18Å; F154-S158 PolarHBondContact O-N 3.33Å; F154-S158 PolarHBondContact O-OG 3.32Å
155	L	88	Confident	77.1	Confident	93 Å²	93	54.9 Å²	54.9	49%	0.487	28%	0.276	S	S	.	.	H	α-helix	trans	-62.7	-49.2	176.3	-175.7	65.2	0	0	0	110	S151 A157 S158 C159	S151-L155 WeakPolarHBondContact O-CA 3.37Å; S151-L155 WeakPolarHBondContact O-CB 3.34Å; S151-L155 PolarHBondContact O-N 3.33Å; L155-A157 PolarHBondContact O-N 2.89Å; L155-S158 WeakPolarHBondContact CA-OG 3.43Å; L155-S158 PolarHBondContact O-N 3.16Å; L155-S158 VanDerWaalsContact O-N 3.11Å; L155-S158 PolarHBondContact O-OG 3.3Å; L155-C159 WeakPolarHBondContact O-CB 3.3Å; L155-C159 PolarHBondContact O-N 3.41Å; L155-C159 PolarHBondContact O-SG 3.45Å; L155-C159 VanDerWaalsContact O-SG 3.35Å
156	H	90.1	Very high	76.6	Confident	20 Å²	20	52 Å²	52	9%	0.093	26%	0.261	C	S	.	.	H	α-helix	trans	-56.7	-48.8	174.9	177.8	-95.1	0	0	0	111.5	F19 Y52 V152 I153 S158 C159 R160	F19-H156 AromaticContact CD2-CE1 3.52Å; F19-H156 AromaticContact CE2-CE1 3.16Å; F19-H156 WeakPolarHBondContact CE2-CE1 3.44Å; F19-H156 AromaticContact CE2-ND1 3.61Å; F19-H156 AromaticContact CZ-CE1 3.77Å; F19-H156 AromaticContact CZ-ND1 3.9Å; F19-H156 PolarHBondContact O-NE2 2.77Å; Y52-H156 AromaticContact CE1-ND1 3.5Å; Y52-H156 AromaticContact CZ-ND1 3.53Å; Y52-H156 PolarHBondContact OH-ND1 3.4Å; V152-H156 WeakPolarHBondContact O-CB 3.33Å; V152-H156 PolarHBondContact O-N 3.29Å; I153-H156 PolarHBondContact O-N 3.42Å; H156-S158 VanDerWaalsContact C-N 3.26Å; H156-S158 PolarHBondContact O-N 3Å; H156-C159 PolarHBondContact O-N 3.1Å; H156-R160 VanDerWaalsContact O-CB 3.3Å; H156-R160 WeakPolarHBondContact O-CB 2.99Å; H156-R160 PolarHBondContact O-N 2.89Å
157	A	88.5	Confident	76	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-62.8	-31.1	177.4	0	0	0	0	0	113.1	I41 N44 L45 Y52 I153 F154 L155	I41-A157 HydrophobicContact CG2-CB 4.24Å; N44-A157 HydrophobicContact CB-CB 4.27Å; N44-A157 PolarHBondContact ND2-O 3.2Å; L45-A157 HydrophobicContact CD2-CB 4.48Å; L45-A157 HydrophobicContact CG-CB 4.47Å; Y52-A157 WeakPolarHBondContact OH-CA 3.2Å; Y52-A157 WeakPolarHBondContact OH-CB 3.32Å; Y52-A157 PolarHBondContact OH-N 3.5Å; I153-A157 WeakPolarHBondContact O-CB 3.44Å; I153-A157 PolarHBondContact O-N 3.33Å; F154-A157 PolarHBondContact O-N 3.02Å; L155-A157 PolarHBondContact O-N 2.89Å
158	S	88.1	Confident	75	Confident	9 Å²	9	58 Å²	58	6%	0.063	29%	0.29	C	S	.	.	H	α-helix	trans	-78.5	-32.5	177.9	75.2	0	0	0	0	113.1	R40 F154 L155 H156	R40-S158 WeakPolarHBondContact CD-O 3.46Å; R40-S158 PolarHBondContact NH1-O 3.29Å; F154-S158 VanDerWaalsContact O-CB 3.22Å; F154-S158 WeakPolarHBondContact O-CB 3.18Å; F154-S158 PolarHBondContact O-N 3.33Å; F154-S158 PolarHBondContact O-OG 3.32Å; L155-S158 WeakPolarHBondContact CA-OG 3.43Å; L155-S158 PolarHBondContact O-N 3.16Å; L155-S158 VanDerWaalsContact O-N 3.11Å; L155-S158 PolarHBondContact O-OG 3.3Å; H156-S158 VanDerWaalsContact C-N 3.26Å; H156-S158 PolarHBondContact O-N 3Å
159	C	87.5	Confident	74.1	Confident	16 Å²	16	53.6 Å²	53.6	11%	0.108	28%	0.276	C	S	.	.	H	α-helix	trans	-87.1	-28.8	-178.1	-67.7	0	0	0	0	112.8	L26 D27 L155 H156 L161	L26-C159 CarbonylContact C-O 3.41Å; L26-C159 WeakPolarHBondContact CA-O 3.34Å; L26-C159 HydrophobicContact CB-CB 4.41Å; L26-C159 HydrophobicContact CD2-CB 3.98Å; D27-C159 PolarHBondContact N-O 2.98Å; D27-C159 WeakPolarHBondContact O-CA 3.42Å; D27-C159 WeakPolarHBondContact O-CB 3.23Å; L155-C159 WeakPolarHBondContact O-CB 3.3Å; L155-C159 PolarHBondContact O-N 3.41Å; L155-C159 PolarHBondContact O-SG 3.45Å; L155-C159 VanDerWaalsContact O-SG 3.35Å; H156-C159 PolarHBondContact O-N 3.1Å; C159-L161 PolarHBondContact O-N 3.42Å
160	R	86.3	Confident	73	Confident	1 Å²	1	53.7 Å²	53.7	0%	0.004	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-66.4	121	-173.7	-168.8	74.6	-177.5	84.2	9.2	112	D18 R25 L26 N44 Y48 H156	D18-R160 VanDerWaalsContact O-CZ 3.32Å; D18-R160 PolarHBondContact O-NE 3Å; D18-R160 VanDerWaalsContact O-NE 3.14Å; D18-R160 PolarHBondContact O-NH2 3.03Å; D18-R160 IonicContact OD1-NH2 3.71Å; D18-R160 PolarHBondContact OD1-NH2 3.08Å; D18-R160 VanDerWaalsContact OD1-NH2 3.12Å; R25-R160 PolarHBondContact O-NH1 3.3Å; L26-R160 HydrophobicContact CD2-CB 4.18Å; N44-R160 PolarHBondContact ND2-O 2.92Å; Y48-R160 HydrophobicContact CE2-CG 3.75Å; Y48-R160 PolarHBondContact OH-NE 3.46Å; Y48-R160 PolarHBondContact OH-NH2 2.86Å; H156-R160 VanDerWaalsContact O-CB 3.3Å; H156-R160 WeakPolarHBondContact O-CB 2.99Å; H156-R160 PolarHBondContact O-N 2.89Å
161	L	80.3	Confident	71.8	Confident	49 Å²	49	55 Å²	55	26%	0.257	29%	0.293	S	S	.	.			trans	-92.9	153.1	171.3	-71	-176.2	0	0	0	111.5	R25 D27 R40 C159	R25-L161 HydrophobicContact CB-CB 4.04Å; R25-L161 PolarHBondContact O-N 2.97Å; D27-L161 HydrophobicContact CB-CD1 3.33Å; D27-L161 HydrophobicContact CB-CD2 4.14Å; D27-L161 HydrophobicContact CB-CG 3.6Å; R40-L161 VanDerWaalsContact CZ-CD2 3.46Å; C159-L161 PolarHBondContact O-N 3.42Å
162	R	70.6	Confident	70.4	Confident	32 Å²	32	55.4 Å²	55.4	12%	0.121	30%	0.3	C	S	.	.			trans	-108	128.1	-177.4	-164.8	171.3	-172.4	139	21.3	112.5	N166 K167 N170	R162-N166 HydrophobicContact CG-CB 3.87Å; R162-N166 PolarHBondContact NE-O 3.28Å; R162-N166 PolarHBondContact NH2-O 3.32Å; R162-K167 HydrophobicContact CG-CG 4.16Å; R162-N170 PolarHBondContact NE-ND2 3.14Å; R162-N170 VanDerWaalsContact NH1-CG 3.29Å; R162-N170 PolarHBondContact NH1-ND2 2.86Å; R162-N170 PolarHBondContact NH1-OD1 2.99Å; R162-N170 VanDerWaalsContact NH1-OD1 3.13Å; R162-N170 PolarHBondContact NH2-ND2 2.76Å; R162-N170 PolarHBondContact NH2-OD1 3.21Å
163	N	62.1	Low	69	Low	34 Å²	34	55.4 Å²	55.4	18%	0.182	30%	0.297	C	S	.	.			trans	-71.1	143.7	171.9	-74.8	-16.2	0	0	0	111.3	R25 K165 N166 K167	R25-N163 WeakPolarHBondContact CD-OD1 3.38Å; R25-N163 PolarHBondContact NE-OD1 3.22Å; R25-N163 PolarHBondContact NH1-OD1 3.45Å; N163-K165 PolarHBondContact O-N 2.86Å; N163-K165 VanDerWaalsContact O-N 3.17Å; N163-N166 CarbonylContact O-C 3.3Å; N163-N166 WeakPolarHBondContact O-CA 3.33Å; N163-N166 WeakPolarHBondContact O-CB 3.4Å; N163-N166 PolarHBondContact O-N 2.85Å; N163-K167 PolarHBondContact O-N 3.41Å
164	L	52.9	Low	67.5	Low	137 Å²	137	58 Å²	58	72%	0.717	31%	0.309	S	S	*	.	H	α-helix	trans	-53.7	-34.7	178.3	-74.3	160.6	0	0	0	112.9	N166 K167 L168	L164-N166 VanDerWaalsContact C-N 3.29Å; L164-N166 PolarHBondContact O-N 2.94Å; L164-K167 HydrophobicContact CD2-CD 4.09Å; L164-K167 WeakPolarHBondContact O-CA 3.17Å; L164-K167 WeakPolarHBondContact O-CB 3.22Å; L164-K167 PolarHBondContact O-N 2.86Å; L164-L168 PolarHBondContact O-N 3.36Å
165	K	51.5	Low	65.9	Low	181 Å²	181	60.2 Å²	60.2	79%	0.787	33%	0.325	S	S	*	.	H	α-helix	trans	-60.2	-39.5	173.4	-153.7	178.1	-175.5	-176.4	0	111.9	N163 S169	N163-K165 PolarHBondContact O-N 2.86Å; N163-K165 VanDerWaalsContact O-N 3.17Å; K165-S169 PolarHBondContact O-N 2.8Å
166	N	56.7	Low	64.4	Low	24 Å²	24	62.4 Å²	62.4	13%	0.128	33%	0.33	C	S	.	.	H	α-helix	trans	-75	-26.9	173.8	-59.8	8.2	0	0	0	110.6	D18 R162 N163 L164 N170	D18-N166 PolarHBondContact OD1-ND2 2.97Å; R162-N166 HydrophobicContact CG-CB 3.87Å; R162-N166 PolarHBondContact NE-O 3.28Å; R162-N166 PolarHBondContact NH2-O 3.32Å; N163-N166 CarbonylContact O-C 3.3Å; N163-N166 WeakPolarHBondContact O-CA 3.33Å; N163-N166 WeakPolarHBondContact O-CB 3.4Å; N163-N166 PolarHBondContact O-N 2.85Å; L164-N166 VanDerWaalsContact C-N 3.29Å; L164-N166 PolarHBondContact O-N 2.94Å; N166-N170 PolarHBondContact O-N 3.24Å; N166-N170 PolarHBondContact O-ND2 2.78Å; N166-N170 PolarHBondContact O-OD1 3.38Å
167	K	54.7	Low	62.7	Low	57 Å²	57	62.2 Å²	62.2	25%	0.248	33%	0.33	C	S	.	.	H	α-helix	trans	-66.5	-43.8	174.3	-67.1	-169.6	-180	-175.6	0	110.8	R162 N163 L164 N170 A171 E199	R162-K167 HydrophobicContact CG-CG 4.16Å; N163-K167 PolarHBondContact O-N 3.41Å; L164-K167 HydrophobicContact CD2-CD 4.09Å; L164-K167 WeakPolarHBondContact O-CA 3.17Å; L164-K167 WeakPolarHBondContact O-CB 3.22Å; L164-K167 PolarHBondContact O-N 2.86Å; K167-N170 WeakPolarHBondContact CA-ND2 3.34Å; K167-N170 WeakPolarHBondContact O-CB 3.34Å; K167-N170 PolarHBondContact O-N 2.83Å; K167-N170 PolarHBondContact O-ND2 3.11Å; K167-A171 PolarHBondContact O-N 3.04Å; K167-E199 IonicContact NZ-OE2 3.03Å
168	L	49.1	Very low	61.3	Low	144 Å²	144	68.2 Å²	68.2	75%	0.754	36%	0.356	S	S	*	.	H	α-helix	trans	-68.8	-39.8	-179	-133.9	113.5	0	0	0	112.9	L164 N170 A171	L164-L168 PolarHBondContact O-N 3.36Å; L168-N170 PolarHBondContact O-N 3.22Å; L168-A171 PolarHBondContact O-N 3.28Å
169	S	55	Low	60.5	Low	38 Å²	38	71.3 Å²	71.3	27%	0.266	37%	0.368	S	S	.	.	H	α-helix	trans	-64.2	-26.4	173.3	101.3	0	0	0	0	112.1	K165 E173	K165-S169 PolarHBondContact O-N 2.8Å; S169-E173 WeakPolarHBondContact O-CB 3.34Å; S169-E173 WeakPolarHBondContact O-CG 3.47Å; S169-E173 PolarHBondContact O-N 2.97Å
170	N	53.8	Low	60.2	Low	16 Å²	16	70.8 Å²	70.8	9%	0.086	36%	0.364	C	S	.	.	H	α-helix	trans	-72.2	-37.8	175.1	-55	-51.6	0	0	0	113.3	Y47 R162 N166 K167 L168 A172 E173 E174	Y47-N170 WeakPolarHBondContact CD2-OD1 3.47Å; R162-N170 PolarHBondContact NE-ND2 3.14Å; R162-N170 VanDerWaalsContact NH1-CG 3.29Å; R162-N170 PolarHBondContact NH1-ND2 2.86Å; R162-N170 PolarHBondContact NH1-OD1 2.99Å; R162-N170 VanDerWaalsContact NH1-OD1 3.13Å; R162-N170 PolarHBondContact NH2-ND2 2.76Å; R162-N170 PolarHBondContact NH2-OD1 3.21Å; N166-N170 PolarHBondContact O-N 3.24Å; N166-N170 PolarHBondContact O-ND2 2.78Å; N166-N170 PolarHBondContact O-OD1 3.38Å; K167-N170 WeakPolarHBondContact CA-ND2 3.34Å; K167-N170 WeakPolarHBondContact O-CB 3.34Å; K167-N170 PolarHBondContact O-N 2.83Å; K167-N170 PolarHBondContact O-ND2 3.11Å; L168-N170 PolarHBondContact O-N 3.22Å; N170-A172 PolarHBondContact O-N 2.86Å; N170-E173 CarbonylContact O-C 3.51Å; N170-E173 PolarHBondContact O-N 3.17Å; N170-E173 VanDerWaalsContact O-N 3.08Å; N170-E174 WeakPolarHBondContact O-CA 3.26Å; N170-E174 WeakPolarHBondContact O-CB 3.28Å; N170-E174 PolarHBondContact O-N 2.9Å
171	A	53.3	Low	60	Low	66 Å²	66	72.6 Å²	72.6	55%	0.545	38%	0.376	S	S	.	.	H	α-helix	trans	-59.6	-37.2	-176.8	0	0	0	0	0	110.1	K167 L168	K167-A171 PolarHBondContact O-N 3.04Å; L168-A171 PolarHBondContact O-N 3.28Å
172	A	52.8	Low	60.1	Low	74 Å²	74	71.3 Å²	71.3	61%	0.612	37%	0.369	S	S	*	.	H	α-helix	trans	-74.2	-37.7	173.3	0	0	0	0	0	113.3	N170	N170-A172 PolarHBondContact O-N 2.86Å
173	E	54.8	Low	60.4	Low	50 Å²	50	70 Å²	70	23%	0.234	37%	0.366	C	S	.	.	H	α-helix	trans	-78.9	-18.9	176	-74.6	-179	-172.8	0	0	113.4	R14 S169 N170 L175 K176 I177	R14-E173 IonicContact CZ-OE1 3.96Å; R14-E173 IonicContact NH1-OE1 2.65Å; R14-E173 VanDerWaalsContact NH2-CD 3.34Å; R14-E173 IonicContact NH2-OE1 2.8Å; R14-E173 PolarHBondContact NH2-OE1 2.79Å; R14-E173 IonicContact NH2-OE2 3.97Å; R14-E173 PolarHBondContact NH2-OE2 3.3Å; S169-E173 WeakPolarHBondContact O-CB 3.34Å; S169-E173 WeakPolarHBondContact O-CG 3.47Å; S169-E173 PolarHBondContact O-N 2.97Å; N170-E173 CarbonylContact O-C 3.51Å; N170-E173 PolarHBondContact O-N 3.17Å; N170-E173 VanDerWaalsContact O-N 3.08Å; E173-L175 PolarHBondContact O-N 2.74Å; E173-K176 CarbonylContact O-C 3.4Å; E173-K176 VanDerWaalsContact O-CA 3.24Å; E173-K176 WeakPolarHBondContact O-CA 3.43Å; E173-K176 WeakPolarHBondContact O-CB 3.15Å; E173-K176 PolarHBondContact O-N 3.35Å; E173-I177 HydrophobicContact CB-CD1 3.59Å; E173-I177 HydrophobicContact CB-CG1 3.97Å; E173-I177 VanDerWaalsContact O-CG1 3.25Å; E173-I177 WeakPolarHBondContact O-CG1 3.19Å; E173-I177 PolarHBondContact O-N 2.85Å
174	E	55.1	Low	61.3	Low	71 Å²	71	69.8 Å²	69.8	33%	0.332	37%	0.366	S	S	.	.	H	α-helix	trans	-64.8	-31.9	-172	-178.2	173.5	174.9	0	0	111	N170 K176 I177 T195	N170-E174 WeakPolarHBondContact O-CA 3.26Å; N170-E174 WeakPolarHBondContact O-CB 3.28Å; N170-E174 PolarHBondContact O-N 2.9Å; E174-K176 PolarHBondContact O-N 2.99Å; E174-I177 PolarHBondContact O-N 3.17Å; E174-T195 WeakPolarHBondContact OE1-CG2 3.35Å
175	L	52.7	Low	62.7	Low	153 Å²	153	67.8 Å²	67.8	80%	0.801	36%	0.355	S	S	*	.	H	α-helix	trans	-64.7	-24.8	169.8	-63.8	177.2	0	0	0	112.8	E173	E173-L175 PolarHBondContact O-N 2.74Å
176	K	56.4	Low	64.2	Low	139 Å²	139	60.1 Å²	60.1	60%	0.604	32%	0.322	S	S	*	.	H	α-helix	trans	-97	-32	174.9	-60.8	-176.4	179.1	180	0	113	E173 E174 K178 K179	E173-K176 CarbonylContact O-C 3.4Å; E173-K176 VanDerWaalsContact O-CA 3.24Å; E173-K176 WeakPolarHBondContact O-CA 3.43Å; E173-K176 WeakPolarHBondContact O-CB 3.15Å; E173-K176 PolarHBondContact O-N 3.35Å; E174-K176 PolarHBondContact O-N 2.99Å; K176-K178 VanDerWaalsContact C-N 3.31Å; K176-K178 PolarHBondContact O-N 2.96Å; K176-K179 WeakPolarHBondContact O-CB 3.18Å; K176-K179 PolarHBondContact O-N 3.41Å; K176-K179 VanDerWaalsContact O-N 3.13Å
177	I	54.4	Low	65.4	Low	16 Å²	16	63.4 Å²	63.4	8%	0.082	34%	0.34	C	S	.	.	H	α-helix	trans	-67.7	-27.8	-173.1	-73	165.2	0	0	0	112.2	L46 E173 E174 K179 T180	L46-I177 HydrophobicContact CD1-CG2 3.6Å; L46-I177 HydrophobicContact CD2-CG2 3.45Å; L46-I177 VanDerWaalsContact CD2-CG2 3.45Å; L46-I177 HydrophobicContact CG-CG2 3.39Å; E173-I177 HydrophobicContact CB-CD1 3.59Å; E173-I177 HydrophobicContact CB-CG1 3.97Å; E173-I177 VanDerWaalsContact O-CG1 3.25Å; E173-I177 WeakPolarHBondContact O-CG1 3.19Å; E173-I177 PolarHBondContact O-N 2.85Å; E174-I177 PolarHBondContact O-N 3.17Å; I177-K179 PolarHBondContact O-N 2.96Å; I177-T180 HydrophobicContact CG2-CG2 4.47Å; I177-T180 WeakPolarHBondContact O-CB 3.44Å; I177-T180 VanDerWaalsContact O-CG2 3.27Å; I177-T180 WeakPolarHBondContact O-CG2 3.1Å; I177-T180 PolarHBondContact O-N 2.7Å; I177-T180 PolarHBondContact O-OG1 3.35Å
178	K	59.9	Low	66.6	Low	126 Å²	126	65.4 Å²	65.4	55%	0.548	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-14.4	173.5	-70	-170.9	179.3	-176.2	0	113.9	K176	K176-K178 VanDerWaalsContact C-N 3.31Å; K176-K178 PolarHBondContact O-N 2.96Å
179	K	70.9	Confident	68.2	Low	74 Å²	74	62.4 Å²	62.4	32%	0.322	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	5.5	176.8	-63	171.4	160.5	-163.8	0	113.4	D7 L8 Q9 K176 I177	D7-K179 HydrophobicContact CB-CD 3.8Å; D7-K179 HydrophobicContact CB-CG 4.25Å; D7-K179 WeakPolarHBondContact O-CB 3.45Å; D7-K179 VanDerWaalsContact OD2-CE 3.28Å; D7-K179 WeakPolarHBondContact OD2-CE 3.38Å; D7-K179 IonicContact OD2-NZ 3.45Å; D7-K179 PolarHBondContact OD2-NZ 2.88Å; L8-K179 CarbonylContact C-O 3.58Å; L8-K179 VanDerWaalsContact CA-O 3.22Å; L8-K179 WeakPolarHBondContact CA-O 3.31Å; Q9-K179 PolarHBondContact N-O 3.49Å; K176-K179 WeakPolarHBondContact O-CB 3.18Å; K176-K179 PolarHBondContact O-N 3.41Å; K176-K179 VanDerWaalsContact O-N 3.13Å; I177-K179 PolarHBondContact O-N 2.96Å
180	T	80.4	Confident	69.4	Low	4 Å²	4	63.5 Å²	63.5	3%	0.025	36%	0.36	C	S	.	.	S	Bend	trans	-85.2	152.3	179.8	63.8	0	0	0	0	111.7	Q9 S11 Q49 I177 I182 G183 V184	Q9-T180 VanDerWaalsContact O-CA 3.27Å; Q9-T180 WeakPolarHBondContact O-CA 3.41Å; Q9-T180 VanDerWaalsContact O-CG2 3.29Å; Q9-T180 WeakPolarHBondContact O-CG2 3.3Å; S11-T180 WeakPolarHBondContact OG-CG2 3.46Å; Q49-T180 PolarHBondContact OE1-OG1 3.46Å; I177-T180 HydrophobicContact CG2-CG2 4.47Å; I177-T180 WeakPolarHBondContact O-CB 3.44Å; I177-T180 VanDerWaalsContact O-CG2 3.27Å; I177-T180 WeakPolarHBondContact O-CG2 3.1Å; I177-T180 PolarHBondContact O-N 2.7Å; I177-T180 PolarHBondContact O-OG1 3.35Å; T180-I182 VanDerWaalsContact C-N 3.35Å; T180-I182 PolarHBondContact O-N 3.11Å; T180-G183 CarbonylContact O-C 3.11Å; T180-G183 WeakPolarHBondContact O-CA 3.48Å; T180-G183 PolarHBondContact O-N 2.85Å; T180-G183 PolarHBondContact OG1-N 3.23Å; T180-V184 WeakPolarHBondContact O-CG2 3.41Å; T180-V184 PolarHBondContact O-N 3.16Å
181	P	82.4	Confident	70.6	Confident	39 Å²	39	65.5 Å²	65.5	25%	0.253	37%	0.37	S	S	.	.	H	α-helix	trans	-47.5	-47.5	176	-29	24.4	0	0	0	115.7	L8 L10 Q49 F53 L185	L8-P181 HydrophobicContact CD1-CG 4.34Å; L8-P181 HydrophobicContact CD2-CG 4.08Å; L8-P181 HydrophobicContact CG-CG 4.34Å; L10-P181 HydrophobicContact CD2-CG 3.99Å; Q49-P181 VanDerWaalsContact NE2-CD 3.31Å; F53-P181 HydrophobicContact CE2-CB 4.38Å; F53-P181 HydrophobicContact CE2-CG 4.35Å; F53-P181 HydrophobicContact CZ-CB 4.26Å; P181-L185 WeakPolarHBondContact O-CB 3.18Å; P181-L185 PolarHBondContact O-N 2.88Å
182	I	81.7	Confident	71.3	Confident	22 Å²	22	70.6 Å²	70.6	11%	0.113	38%	0.38	C	S	.	.	H	α-helix	trans	-72.2	-36.6	178	-62.5	-178.2	0	0	0	110.3	L46 Q49 F53 T180 L185 F186	L46-I182 HydrophobicContact CD1-CB 4.41Å; L46-I182 HydrophobicContact CD1-CG2 4.38Å; Q49-I182 HydrophobicContact CB-CD1 3.93Å; Q49-I182 HydrophobicContact CG-CB 4.42Å; Q49-I182 HydrophobicContact CG-CD1 3.53Å; Q49-I182 HydrophobicContact CG-CG1 3.79Å; F53-I182 HydrophobicContact CE1-CD1 4.34Å; F53-I182 HydrophobicContact CE1-CG1 4.49Å; F53-I182 HydrophobicContact CZ-CD1 4.32Å; F53-I182 HydrophobicContact CZ-CG1 4.11Å; T180-I182 VanDerWaalsContact C-N 3.35Å; T180-I182 PolarHBondContact O-N 3.11Å; I182-L185 WeakPolarHBondContact O-CB 3.46Å; I182-L185 PolarHBondContact O-N 2.73Å; I182-F186 HydrophobicContact CG2-CD1 4.04Å; I182-F186 HydrophobicContact CG2-CD2 4.05Å; I182-F186 HydrophobicContact CG2-CE1 3.57Å; I182-F186 HydrophobicContact CG2-CE2 3.58Å; I182-F186 HydrophobicContact CG2-CG 4.27Å; I182-F186 HydrophobicContact CG2-CZ 3.31Å; I182-F186 WeakPolarHBondContact O-CB 3.02Å; I182-F186 VanDerWaalsContact O-CG 3.31Å; I182-F186 WeakPolarHBondContact O-CG 3.41Å; I182-F186 PolarHBondContact O-N 3.02Å
183	G	78.3	Confident	71.6	Confident	5 Å²	5	68.6 Å²	68.6	5%	0.052	36%	0.361	C	S	.	.	H	α-helix	trans	-58.6	-47.6	173.7	0	0	0	0	0	112.6	T180 L185 F186 D187	T180-G183 CarbonylContact O-C 3.11Å; T180-G183 WeakPolarHBondContact O-CA 3.48Å; T180-G183 PolarHBondContact O-N 2.85Å; T180-G183 PolarHBondContact OG1-N 3.23Å; G183-L185 VanDerWaalsContact C-N 3.34Å; G183-L185 PolarHBondContact O-N 3.44Å; G183-F186 PolarHBondContact O-N 3.02Å; G183-D187 PolarHBondContact O-N 3.49Å
184	V	81.1	Confident	71.7	Confident	29 Å²	29	71.1 Å²	71.1	18%	0.176	37%	0.373	C	S	.	.	H	α-helix	trans	-63.2	-41	175.5	174.2	0	0	0	0	110.9	Y5 L8 T180 D187 L188	Y5-V184 HydrophobicContact CE1-CG1 4.49Å; L8-V184 HydrophobicContact CD1-CG2 4.01Å; T180-V184 WeakPolarHBondContact O-CG2 3.41Å; T180-V184 PolarHBondContact O-N 3.16Å; V184-D187 PolarHBondContact O-N 3.47Å; V184-L188 HydrophobicContact CG1-CD1 4.04Å; V184-L188 HydrophobicContact CG1-CG 4.35Å; V184-L188 WeakPolarHBondContact O-CB 3.34Å; V184-L188 VanDerWaalsContact O-CG 3.26Å; V184-L188 WeakPolarHBondContact O-CG 3.34Å; V184-L188 PolarHBondContact O-N 2.87Å
185	L	82.3	Confident	71.6	Confident	95 Å²	95	71.3 Å²	71.3	50%	0.497	38%	0.379	S	S	.	.	H	α-helix	trans	-61	-45.9	175.7	179.5	63.9	0	0	0	111.6	P181 I182 G183 L188 C189	P181-L185 WeakPolarHBondContact O-CB 3.18Å; P181-L185 PolarHBondContact O-N 2.88Å; I182-L185 WeakPolarHBondContact O-CB 3.46Å; I182-L185 PolarHBondContact O-N 2.73Å; G183-L185 VanDerWaalsContact C-N 3.34Å; G183-L185 PolarHBondContact O-N 3.44Å; L185-L188 PolarHBondContact O-N 2.85Å; L185-C189 WeakPolarHBondContact O-CB 3.23Å; L185-C189 PolarHBondContact O-N 3.47Å; L185-C189 PolarHBondContact O-SG 3.44Å; L185-C189 VanDerWaalsContact O-SG 3.34Å
186	F	82.1	Confident	71.4	Confident	20 Å²	20	67 Å²	67	9%	0.088	35%	0.354	C	S	.	.	H	α-helix	trans	-61.8	-44.8	177	-70.9	-7.3	0	0	0	111.5	L42 L45 L46 I182 G183 L188 C189 G190 I191	L42-F186 HydrophobicContact CB-CE2 4Å; L42-F186 HydrophobicContact CB-CZ 4.29Å; L42-F186 HydrophobicContact CD2-CD1 4.44Å; L42-F186 HydrophobicContact CD2-CD2 4.47Å; L42-F186 HydrophobicContact CD2-CE1 3.72Å; L42-F186 HydrophobicContact CD2-CE2 3.76Å; L42-F186 HydrophobicContact CD2-CZ 3.34Å; L42-F186 HydrophobicContact CG-CE2 4.46Å; L42-F186 HydrophobicContact CG-CZ 4.41Å; L45-F186 HydrophobicContact CB-CZ 4.39Å; L45-F186 HydrophobicContact CD1-CZ 4.42Å; L46-F186 HydrophobicContact CB-CE2 4.49Å; I182-F186 HydrophobicContact CG2-CD1 4.04Å; I182-F186 HydrophobicContact CG2-CD2 4.05Å; I182-F186 HydrophobicContact CG2-CE1 3.57Å; I182-F186 HydrophobicContact CG2-CE2 3.58Å; I182-F186 HydrophobicContact CG2-CG 4.27Å; I182-F186 HydrophobicContact CG2-CZ 3.31Å; I182-F186 WeakPolarHBondContact O-CB 3.02Å; I182-F186 VanDerWaalsContact O-CG 3.31Å; I182-F186 WeakPolarHBondContact O-CG 3.41Å; I182-F186 PolarHBondContact O-N 3.02Å; G183-F186 PolarHBondContact O-N 3.02Å; F186-L188 VanDerWaalsContact C-N 3.34Å; F186-L188 PolarHBondContact O-N 3.19Å; F186-C189 CarbonylContact O-C 3.53Å; F186-C189 PolarHBondContact O-N 2.9Å; F186-C189 VanDerWaalsContact O-N 3.16Å; F186-G190 PolarHBondContact O-N 2.9Å; F186-I191 HydrophobicContact CB-CB 4.1Å; F186-I191 HydrophobicContact CB-CG2 4.46Å; F186-I191 HydrophobicContact CD1-CD1 4.29Å; F186-I191 HydrophobicContact CG-CB 4.43Å; F186-I191 HydrophobicContact CG-CG2 4.38Å; F186-I191 PolarHBondContact O-N 2.9Å
187	D	81.5	Confident	70.8	Confident	93 Å²	93	71.2 Å²	71.2	50%	0.497	37%	0.367	S	S	.	.	H	α-helix	trans	-60.1	-41.9	175.4	-80.3	-14.4	0	0	0	111.9	G183 V184 C189 G190	G183-D187 PolarHBondContact O-N 3.49Å; V184-D187 PolarHBondContact O-N 3.47Å; D187-C189 VanDerWaalsContact C-N 3.34Å; D187-G190 PolarHBondContact O-N 3.18Å; D187-G190 VanDerWaalsContact O-N 3.16Å
188	L	81.3	Confident	70.1	Confident	99 Å²	99	80 Å²	80	52%	0.518	40%	0.404	S	S	.	.	H	α-helix	trans	-65.8	-34.9	175.9	-72.9	173.2	0	0	0	112.6	V2 V184 L185 F186 G190	V2-L188 HydrophobicContact CG2-CD2 4.11Å; V184-L188 HydrophobicContact CG1-CD1 4.04Å; V184-L188 HydrophobicContact CG1-CG 4.35Å; V184-L188 WeakPolarHBondContact O-CB 3.34Å; V184-L188 VanDerWaalsContact O-CG 3.26Å; V184-L188 WeakPolarHBondContact O-CG 3.34Å; V184-L188 PolarHBondContact O-N 2.87Å; L185-L188 PolarHBondContact O-N 2.85Å; F186-L188 VanDerWaalsContact C-N 3.34Å; F186-L188 PolarHBondContact O-N 3.19Å; L188-G190 VanDerWaalsContact C-N 3.25Å; L188-G190 PolarHBondContact O-N 3.39Å
189	C	82	Confident	69.1	Low	81 Å²	81	81 Å²	81	55%	0.547	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-1.7	175.2	-67.3	0	0	0	0	113.3	L185 F186 D187 I191	L185-C189 WeakPolarHBondContact O-CB 3.23Å; L185-C189 PolarHBondContact O-N 3.47Å; L185-C189 PolarHBondContact O-SG 3.44Å; L185-C189 VanDerWaalsContact O-SG 3.34Å; F186-C189 CarbonylContact O-C 3.53Å; F186-C189 PolarHBondContact O-N 2.9Å; F186-C189 VanDerWaalsContact O-N 3.16Å; D187-C189 VanDerWaalsContact C-N 3.34Å; C189-I191 HydrophobicContact CB-CD1 3.66Å; C189-I191 HydrophobicContact CB-CG1 3.75Å; C189-I191 PolarHBondContact O-N 2.88Å
190	G	80.5	Confident	69.1	Low	61 Å²	61	81.4 Å²	81.4	63%	0.629	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.3	16.6	-174.5	0	0	0	0	0	113.9	F186 D187 L188 K192	F186-G190 PolarHBondContact O-N 2.9Å; D187-G190 PolarHBondContact O-N 3.18Å; D187-G190 VanDerWaalsContact O-N 3.16Å; L188-G190 VanDerWaalsContact C-N 3.25Å; L188-G190 PolarHBondContact O-N 3.39Å; G190-K192 PolarHBondContact O-N 3.24Å
191	I	77.8	Confident	68.5	Low	59 Å²	59	85.5 Å²	85.5	30%	0.303	44%	0.436	S	S	.	.			trans	-84	109.8	179.7	-59.6	171.4	0	0	0	107.7	L42 F186 C189	L42-I191 HydrophobicContact CD1-CG2 3.52Å; L42-I191 HydrophobicContact CD2-CG2 4.09Å; L42-I191 HydrophobicContact CG-CG2 4.46Å; F186-I191 HydrophobicContact CB-CB 4.1Å; F186-I191 HydrophobicContact CB-CG2 4.46Å; F186-I191 HydrophobicContact CD1-CD1 4.29Å; F186-I191 HydrophobicContact CG-CB 4.43Å; F186-I191 HydrophobicContact CG-CG2 4.38Å; F186-I191 PolarHBondContact O-N 2.9Å; C189-I191 HydrophobicContact CB-CD1 3.66Å; C189-I191 HydrophobicContact CB-CG1 3.75Å; C189-I191 PolarHBondContact O-N 2.88Å
192	K	68.2	Low	67.7	Low	172 Å²	172	88.1 Å²	88.1	75%	0.748	45%	0.446	S	S	*	.			trans	-91.8	125.1	171.9	-64.9	-177.5	-177.5	176.7	0	108.8	G190 E194	G190-K192 PolarHBondContact O-N 3.24Å; K192-E194 PolarHBondContact O-N 3.09Å; K192-E194 VanDerWaalsContact O-N 3.16Å
193	C	60.1	Low	66.9	Low	33 Å²	33	91.9 Å²	91.9	22%	0.223	47%	0.466	C	S	.	.			trans	-69.5	107.2	158.5	-90.7	0	0	0	0	107.1	N43 T195	N43-C193 PolarHBondContact OD1-SG 2.96Å; N43-C193 VanDerWaalsContact OD1-SG 3.33Å; C193-T195 PolarHBondContact O-N 3.31Å
194	E	57.4	Low	66.1	Low	102 Å²	102	97.4 Å²	97.4	48%	0.477	49%	0.492	S	S	.	.			trans	-63.7	125.1	167.3	-69.9	-171.6	156.5	0	0	108.2	Q35 K192 F196	Q35-E194 PolarHBondContact NE2-OE2 2.81Å; K192-E194 PolarHBondContact O-N 3.09Å; K192-E194 VanDerWaalsContact O-N 3.16Å; E194-F196 PolarHBondContact O-N 2.93Å
195	T	51.1	Low	65.1	Low	76 Å²	76	101.9 Å²	101.9	47%	0.466	51%	0.513	S	S	.	.			trans	-60.3	99.2	173.8	44.7	0	0	0	0	109.7	E174 C193 W197	E174-T195 WeakPolarHBondContact OE1-CG2 3.35Å; C193-T195 PolarHBondContact O-N 3.31Å; T195-W197 PolarHBondContact O-N 2.71Å
196	F	49.7	Very low	63.9	Low	62 Å²	62	102.4 Å²	102.4	27%	0.272	51%	0.514	S	S	.	.	S	Bend	trans	20.1	7.5	145.1	-81.2	-70.6	0	0	0	124	N43 E194	N43-F196 HydrophobicContact CB-CE1 4.44Å; N43-F196 HydrophobicContact CB-CE2 3.53Å; N43-F196 HydrophobicContact CB-CZ 3.29Å; N43-F196 WeakPolarHBondContact ND2-CE2 3.28Å; N43-F196 WeakPolarHBondContact ND2-CZ 3.48Å; N43-F196 WeakPolarHBondContact OD1-CE2 3.33Å; E194-F196 PolarHBondContact O-N 2.93Å
197	W	44.6	Very low	62.5	Low	228 Å²	228	108.8 Å²	108.8	86%	0.864	55%	0.547	S	S	*	.			trans	-95.8	10.1	-178.4	-65.9	109.6	0	0	0	114.4	T195	T195-W197 PolarHBondContact O-N 2.71Å
198	K	39	Very low	60.9	Low	200 Å²	200	110.1 Å²	110.1	87%	0.87	55%	0.551	S	S	*	*			trans	-112.5	16.1	-179.6	-94.3	-170.3	177.3	-178	0	115.3
199	E	39.6	Very low	59.1	Low	148 Å²	148	111.1 Å²	111.1	69%	0.692	55%	0.554	S	S	*	*			trans	-92.7	0	157.1	-68.5	-175.2	145.6	0	0	109.2	R36 K167	R36-E199 IonicContact CZ-OE1 3.17Å; R36-E199 IonicContact NE-OE1 2.71Å; R36-E199 PolarHBondContact NE-OE1 3.24Å; R36-E199 IonicContact NH2-OE1 2.81Å; R36-E199 PolarHBondContact NH2-OE1 3.45Å; K167-E199 IonicContact NZ-OE2 3.03Å

Retrieved 199 of 199 residues in 142.6 ms (Link to these results)

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