A0A077ZMR4_TRITR Loading...

NADH-ubiquinone oxidoreductase chain 1

AlphaFold DB , UniProt , Accession A0A077ZMR4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 178 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	43.2	Very low	42.1	Very low	200 Å²	200	137.9 Å²	137.9	99%	0.985	64%	0.637	S	S	*	*				0	-50.8	0	-162.9	165.5	169.8	0	0	112.2	L3 R4	M1-L3 PolarHBondContact O-N 3.11Å; M1-R4 PolarHBondContact O-N 3.05Å
2	I	32.5	Very low	43.3	Very low	141 Å²	141	133.8 Å²	133.8	72%	0.723	62%	0.623	S	S	*	*	H	α-helix	trans	-62.1	-38.2	176.6	-64.8	158.1	0	0	0	112.7	R4 I5	I2-R4 VanDerWaalsContact C-N 3.31Å; I2-R4 PolarHBondContact O-N 3.2Å; I2-I5 PolarHBondContact O-N 3.43Å
3	L	33.4	Very low	44.4	Very low	108 Å²	108	133.5 Å²	133.5	57%	0.565	62%	0.622	S	S	*	*	H	α-helix	trans	-64.1	-33	179.2	-145.5	76.8	0	0	0	112.9	M1 I5 L7	M1-L3 PolarHBondContact O-N 3.11Å; L3-I5 VanDerWaalsContact C-N 3.31Å; L3-I5 PolarHBondContact O-N 3.16Å; L3-L7 HydrophobicContact CD2-CD1 4.47Å; L3-L7 HydrophobicContact CG-CD1 4.22Å; L3-L7 WeakPolarHBondContact O-CD1 3.32Å; L3-L7 WeakPolarHBondContact O-CG 3.41Å; L3-L7 PolarHBondContact O-N 3.08Å
4	R	37	Very low	45.4	Very low	216 Å²	216	130.1 Å²	130.1	82%	0.815	62%	0.62	S	S	*	*	H	α-helix	trans	-75.5	-16.4	-178	-154.2	179.6	-171.3	-158.6	3.3	113.4	M1 I2 P8	M1-R4 PolarHBondContact O-N 3.05Å; I2-R4 VanDerWaalsContact C-N 3.31Å; I2-R4 PolarHBondContact O-N 3.2Å; R4-P8 WeakPolarHBondContact O-CD 3.49Å
5	I	40.3	Very low	46.2	Very low	123 Å²	123	130.9 Å²	130.9	63%	0.631	62%	0.615	S	S	*	*	H	α-helix	trans	-88.2	-27.8	-179.8	-65	167.5	0	0	0	111.3	I2 L3	I2-I5 PolarHBondContact O-N 3.43Å; L3-I5 VanDerWaalsContact C-N 3.31Å; L3-I5 PolarHBondContact O-N 3.16Å
6	L	40	Very low	47.1	Very low	114 Å²	114	125.6 Å²	125.6	60%	0.597	59%	0.59	S	S	*	*	H	α-helix	trans	-82.1	-32.3	175.9	-80.6	158.1	0	0	0	112.9
7	L	50.6	Low	48	Very low	51 Å²	51	122.9 Å²	122.9	27%	0.267	58%	0.579	S	S	.	*	G	3₁₀ helix	trans	-66.1	-36.2	-172	-75.5	165.4	0	0	0	116.9	L3 R9 L141 V148	L3-L7 HydrophobicContact CD2-CD1 4.47Å; L3-L7 HydrophobicContact CG-CD1 4.22Å; L3-L7 WeakPolarHBondContact O-CD1 3.32Å; L3-L7 WeakPolarHBondContact O-CG 3.41Å; L3-L7 PolarHBondContact O-N 3.08Å; L7-R9 PolarHBondContact O-N 3.35Å; L7-L141 HydrophobicContact CD2-CD2 3.29Å; L7-V148 HydrophobicContact CD1-CG2 4.35Å; L7-V148 HydrophobicContact CD2-CG2 3.85Å
8	P	45.8	Very low	48.8	Very low	86 Å²	86	118.6 Å²	118.6	56%	0.558	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-81	-10.3	-176	28.6	-31.9	0	0	0	114.2	R4 F10	R4-P8 WeakPolarHBondContact O-CD 3.49Å; P8-F10 VanDerWaalsContact C-N 3.32Å; P8-F10 PolarHBondContact O-N 3.27Å
9	R	41	Very low	49.6	Very low	206 Å²	206	116.4 Å²	116.4	78%	0.777	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-79.9	-10.6	178.2	-88.9	-175.4	168.1	167.4	-2.1	114.4	L7 W11	L7-R9 PolarHBondContact O-N 3.35Å; R9-W11 VanDerWaalsContact C-N 3.34Å
10	F	49.3	Very low	50.4	Low	87 Å²	87	111.1 Å²	111.1	38%	0.382	53%	0.53	S	S	.	.	G	3₁₀ helix	trans	-91.3	9.5	178.7	-82.2	-83.7	0	0	0	113.8	P8 N12 Q16 F19	P8-F10 VanDerWaalsContact C-N 3.32Å; P8-F10 PolarHBondContact O-N 3.27Å; F10-N12 PolarHBondContact O-N 3.46Å; F10-Q16 VanDerWaalsContact O-CG 3.25Å; F10-Q16 WeakPolarHBondContact O-CG 3Å; F10-Q16 PolarHBondContact O-NE2 3.43Å; F10-F19 HydrophobicContact CE1-CD2 4.48Å; F10-F19 HydrophobicContact CE1-CG 4.38Å
11	W	50.3	Low	51.1	Low	185 Å²	185	108.6 Å²	108.6	70%	0.701	52%	0.523	S	S	*	.			trans	-85.1	23.6	-178.3	-104.4	58	0	0	0	115	R9	R9-W11 VanDerWaalsContact C-N 3.34Å
12	N	55.7	Low	52.3	Low	88 Å²	88	103.9 Å²	103.9	47%	0.471	50%	0.501	S	S	.	.			trans	-98.9	117.5	161.7	-82.2	-0.6	0	0	0	107.9	F10 S14 R15 Q16	F10-N12 PolarHBondContact O-N 3.46Å; N12-S14 PolarHBondContact O-N 3.34Å; N12-S14 VanDerWaalsContact O-N 3.08Å; N12-R15 HydrophobicContact CB-CB 4.35Å; N12-R15 HydrophobicContact CB-CG 4.12Å; N12-R15 WeakPolarHBondContact O-CA 3.39Å; N12-R15 WeakPolarHBondContact O-CB 3.43Å; N12-R15 PolarHBondContact O-N 3.38Å; N12-Q16 PolarHBondContact O-N 3.44Å
13	Q	58.2	Low	53.9	Low	130 Å²	130	98.5 Å²	98.5	61%	0.607	47%	0.473	S	S	*	.	H	α-helix	trans	-49.5	-36.7	179.8	-65.1	178.9	-26.2	0	0	112.2	R15 Q16 I17 F68	Q13-R15 PolarHBondContact O-N 3.09Å; Q13-Q16 PolarHBondContact O-N 3.18Å; Q13-I17 WeakPolarHBondContact O-CG1 3.35Å; Q13-I17 PolarHBondContact O-N 2.96Å; Q13-F68 HydrophobicContact CB-CD1 4.12Å; Q13-F68 HydrophobicContact CB-CE1 3.67Å; Q13-F68 HydrophobicContact CG-CD1 4.04Å; Q13-F68 HydrophobicContact CG-CE1 3.77Å
14	S	59	Low	55.4	Low	86 Å²	86	94.4 Å²	94.4	60%	0.601	45%	0.451	S	S	*	.	H	α-helix	trans	-65.4	-34	175.7	56.2	0	0	0	0	114.4	N12 A18	N12-S14 PolarHBondContact O-N 3.34Å; N12-S14 VanDerWaalsContact O-N 3.08Å; S14-A18 WeakPolarHBondContact O-CB 3.27Å; S14-A18 PolarHBondContact O-N 3.18Å; S14-A18 VanDerWaalsContact O-N 3.13Å
15	R	56.7	Low	56.6	Low	143 Å²	143	93.1 Å²	93.1	54%	0.54	45%	0.446	S	S	.	.	H	α-helix	trans	-76.4	-29.3	177.7	-68.9	-175.4	177.3	168.1	-1.1	112.2	N12 Q13 F19	N12-R15 HydrophobicContact CB-CB 4.35Å; N12-R15 HydrophobicContact CB-CG 4.12Å; N12-R15 WeakPolarHBondContact O-CA 3.39Å; N12-R15 WeakPolarHBondContact O-CB 3.43Å; N12-R15 PolarHBondContact O-N 3.38Å; Q13-R15 PolarHBondContact O-N 3.09Å; R15-F19 VanDerWaalsContact O-CB 3.3Å; R15-F19 WeakPolarHBondContact O-CB 3.18Å; R15-F19 PolarHBondContact O-N 3.37Å
16	Q	60.7	Low	57.9	Low	46 Å²	46	90.9 Å²	90.9	22%	0.215	44%	0.438	C	S	.	.	H	α-helix	trans	-67.7	-46.6	175.4	-67.4	178.8	-12.4	0	0	110.7	F10 N12 Q13 A18 F19 I20 F68	F10-Q16 VanDerWaalsContact O-CG 3.25Å; F10-Q16 WeakPolarHBondContact O-CG 3Å; F10-Q16 PolarHBondContact O-NE2 3.43Å; N12-Q16 PolarHBondContact O-N 3.44Å; Q13-Q16 PolarHBondContact O-N 3.18Å; Q16-A18 PolarHBondContact O-N 2.93Å; Q16-F19 PolarHBondContact O-N 3.19Å; Q16-I20 WeakPolarHBondContact O-CD1 3.48Å; Q16-I20 VanDerWaalsContact O-CG1 3.25Å; Q16-I20 WeakPolarHBondContact O-CG1 3.25Å; Q16-I20 PolarHBondContact O-N 2.98Å; Q16-F68 HydrophobicContact CB-CZ 3.93Å
17	I	62.4	Low	59.3	Low	79 Å²	79	86.6 Å²	86.6	41%	0.405	41%	0.414	S	S	.	.	H	α-helix	trans	-62.4	-43.5	175.8	-60.7	165.5	0	0	0	110.7	Q13 F19 I20 T21 F68	Q13-I17 WeakPolarHBondContact O-CG1 3.35Å; Q13-I17 PolarHBondContact O-N 2.96Å; I17-F19 VanDerWaalsContact C-N 3.32Å; I17-F19 PolarHBondContact O-N 3.47Å; I17-I20 PolarHBondContact O-N 2.98Å; I17-T21 HydrophobicContact CG2-CG2 4.47Å; I17-T21 WeakPolarHBondContact O-CG2 3.5Å; I17-T21 PolarHBondContact O-N 3.04Å; I17-T21 PolarHBondContact O-OG1 2.93Å; I17-F68 HydrophobicContact CD1-CD2 4.19Å; I17-F68 HydrophobicContact CD1-CE2 3.93Å; I17-F68 HydrophobicContact CD1-CZ 4.27Å; I17-F68 HydrophobicContact CG1-CD2 4.14Å; I17-F68 HydrophobicContact CG1-CE2 3.44Å; I17-F68 VanDerWaalsContact CG1-CE2 3.44Å; I17-F68 HydrophobicContact CG1-CZ 3.82Å
18	A	62	Low	60.2	Low	46 Å²	46	86.1 Å²	86.1	38%	0.38	41%	0.412	S	S	.	.	H	α-helix	trans	-63.2	-36.4	176	0	0	0	0	0	112.8	S14 Q16 T21 L22	S14-A18 WeakPolarHBondContact O-CB 3.27Å; S14-A18 PolarHBondContact O-N 3.18Å; S14-A18 VanDerWaalsContact O-N 3.13Å; Q16-A18 PolarHBondContact O-N 2.93Å; A18-T21 WeakPolarHBondContact CA-OG1 3.43Å; A18-T21 PolarHBondContact O-OG1 3.47Å; A18-L22 WeakPolarHBondContact O-CB 3.46Å; A18-L22 VanDerWaalsContact O-CG 3.22Å; A18-L22 WeakPolarHBondContact O-CG 3.38Å; A18-L22 PolarHBondContact O-N 3.13Å; A18-L22 VanDerWaalsContact O-N 3.14Å
19	F	64.5	Low	61.3	Low	76 Å²	76	83.1 Å²	83.1	33%	0.333	40%	0.396	S	S	.	.	H	α-helix	trans	-70.6	-39.5	177.8	-169.9	-122.6	0	0	0	111.7	F10 R15 Q16 I17 L22 L23 L138	F10-F19 HydrophobicContact CE1-CD2 4.48Å; F10-F19 HydrophobicContact CE1-CG 4.38Å; R15-F19 VanDerWaalsContact O-CB 3.3Å; R15-F19 WeakPolarHBondContact O-CB 3.18Å; R15-F19 PolarHBondContact O-N 3.37Å; Q16-F19 PolarHBondContact O-N 3.19Å; I17-F19 VanDerWaalsContact C-N 3.32Å; I17-F19 PolarHBondContact O-N 3.47Å; F19-L22 PolarHBondContact O-N 3.34Å; F19-L23 HydrophobicContact CD1-CD1 3.67Å; F19-L23 HydrophobicContact CD2-CD1 4.17Å; F19-L23 HydrophobicContact CE1-CD1 3.5Å; F19-L23 VanDerWaalsContact CE1-CD1 3.5Å; F19-L23 HydrophobicContact CE2-CD1 3.98Å; F19-L23 HydrophobicContact CG-CD1 4.02Å; F19-L23 HydrophobicContact CZ-CD1 3.64Å; F19-L23 VanDerWaalsContact O-CD1 3.29Å; F19-L23 WeakPolarHBondContact O-CD1 3.41Å; F19-L23 WeakPolarHBondContact O-CG 3.3Å; F19-L23 PolarHBondContact O-N 2.83Å; F19-L138 HydrophobicContact CD1-CD2 3.39Å; F19-L138 HydrophobicContact CE1-CD2 3.27Å; F19-L138 HydrophobicContact CZ-CD2 4.45Å
20	I	65.6	Low	62.6	Low	10 Å²	10	74 Å²	74	5%	0.051	36%	0.364	C	S	.	.	H	α-helix	trans	-67.5	-46.5	178.6	-62.1	161.6	0	0	0	110.7	Q16 I17 L22 L23 E24 I64 I142	Q16-I20 WeakPolarHBondContact O-CD1 3.48Å; Q16-I20 VanDerWaalsContact O-CG1 3.25Å; Q16-I20 WeakPolarHBondContact O-CG1 3.25Å; Q16-I20 PolarHBondContact O-N 2.98Å; I17-I20 PolarHBondContact O-N 2.98Å; I20-L22 VanDerWaalsContact C-N 3.27Å; I20-L22 PolarHBondContact O-N 3.41Å; I20-L23 PolarHBondContact O-N 3.06Å; I20-E24 VanDerWaalsContact CG2-OE1 3.31Å; I20-E24 WeakPolarHBondContact CG2-OE1 3.26Å; I20-E24 WeakPolarHBondContact O-CG 3.27Å; I20-E24 PolarHBondContact O-N 2.98Å; I20-I64 HydrophobicContact CB-CD1 4.28Å; I20-I64 HydrophobicContact CD1-CD1 3.84Å; I20-I64 HydrophobicContact CD1-CG1 4.19Å; I20-I64 HydrophobicContact CD1-CG2 4.04Å; I20-I64 HydrophobicContact CG1-CD1 4.49Å; I20-I64 HydrophobicContact CG2-CD1 3.36Å; I20-I142 HydrophobicContact CD1-CD1 3.81Å
21	T	66.1	Low	63.5	Low	60 Å²	60	70 Å²	70	37%	0.368	35%	0.347	S	S	.	.	H	α-helix	trans	-61.8	-29.8	175.7	52.7	0	0	0	0	113.9	I17 A18 E24 R25	I17-T21 HydrophobicContact CG2-CG2 4.47Å; I17-T21 WeakPolarHBondContact O-CG2 3.5Å; I17-T21 PolarHBondContact O-N 3.04Å; I17-T21 PolarHBondContact O-OG1 2.93Å; A18-T21 WeakPolarHBondContact CA-OG1 3.43Å; A18-T21 PolarHBondContact O-OG1 3.47Å; T21-E24 WeakPolarHBondContact CA-OE2 3.37Å; T21-R25 WeakPolarHBondContact O-CG 3.44Å; T21-R25 PolarHBondContact O-N 3.01Å
22	L	67.2	Low	64.1	Low	100 Å²	100	66.5 Å²	66.5	52%	0.524	34%	0.338	S	S	.	.	H	α-helix	trans	-71.3	-32	172.8	-76.8	172.8	0	0	0	112.6	A18 F19 I20 R25 V26	A18-L22 WeakPolarHBondContact O-CB 3.46Å; A18-L22 VanDerWaalsContact O-CG 3.22Å; A18-L22 WeakPolarHBondContact O-CG 3.38Å; A18-L22 PolarHBondContact O-N 3.13Å; A18-L22 VanDerWaalsContact O-N 3.14Å; F19-L22 PolarHBondContact O-N 3.34Å; I20-L22 VanDerWaalsContact C-N 3.27Å; I20-L22 PolarHBondContact O-N 3.41Å; L22-R25 PolarHBondContact O-N 2.84Å; L22-V26 WeakPolarHBondContact O-CG2 3.29Å; L22-V26 PolarHBondContact O-N 3.24Å
23	L	66.1	Low	64.3	Low	28 Å²	28	71.6 Å²	71.6	15%	0.147	35%	0.35	C	S	.	.	H	α-helix	trans	-81.2	-31.3	-178.4	-65.6	164.6	0	0	0	111.4	F19 I20 R25 V26 Y27 L134 L138	F19-L23 HydrophobicContact CD1-CD1 3.67Å; F19-L23 HydrophobicContact CD2-CD1 4.17Å; F19-L23 HydrophobicContact CE1-CD1 3.5Å; F19-L23 VanDerWaalsContact CE1-CD1 3.5Å; F19-L23 HydrophobicContact CE2-CD1 3.98Å; F19-L23 HydrophobicContact CG-CD1 4.02Å; F19-L23 HydrophobicContact CZ-CD1 3.64Å; F19-L23 VanDerWaalsContact O-CD1 3.29Å; F19-L23 WeakPolarHBondContact O-CD1 3.41Å; F19-L23 WeakPolarHBondContact O-CG 3.3Å; F19-L23 PolarHBondContact O-N 2.83Å; I20-L23 PolarHBondContact O-N 3.06Å; L23-R25 VanDerWaalsContact C-N 3.31Å; L23-R25 PolarHBondContact O-N 3.26Å; L23-V26 WeakPolarHBondContact O-CB 3.47Å; L23-V26 PolarHBondContact O-N 3.49Å; L23-V26 VanDerWaalsContact O-N 3.09Å; L23-Y27 PolarHBondContact O-N 2.99Å; L23-L134 HydrophobicContact CB-CD2 4.08Å; L23-L134 HydrophobicContact CD1-CD2 3.82Å; L23-L134 HydrophobicContact CD1-CG 4.44Å; L23-L134 HydrophobicContact CD2-CD1 3.54Å; L23-L134 HydrophobicContact CD2-CD2 3.79Å; L23-L134 HydrophobicContact CD2-CG 4.2Å; L23-L134 HydrophobicContact CG-CD2 4.04Å; L23-L138 HydrophobicContact CB-CD1 4.23Å; L23-L138 HydrophobicContact CD1-CD1 3.4Å; L23-L138 VanDerWaalsContact CD1-CD1 3.4Å; L23-L138 HydrophobicContact CD1-CD2 3.63Å; L23-L138 HydrophobicContact CD1-CG 3.91Å; L23-L138 HydrophobicContact CG-CD1 4.4Å
24	E	65.9	Low	64.7	Low	22 Å²	22	65.8 Å²	65.8	10%	0.103	32%	0.323	C	S	.	.	H	α-helix	trans	-58	-43.5	167.1	-70.3	164.6	-174.8	0	0	111	I20 T21 V26 Y27 I28 L60	I20-E24 VanDerWaalsContact CG2-OE1 3.31Å; I20-E24 WeakPolarHBondContact CG2-OE1 3.26Å; I20-E24 WeakPolarHBondContact O-CG 3.27Å; I20-E24 PolarHBondContact O-N 2.98Å; T21-E24 WeakPolarHBondContact CA-OE2 3.37Å; E24-V26 VanDerWaalsContact C-N 3.28Å; E24-V26 PolarHBondContact O-N 2.98Å; E24-Y27 PolarHBondContact O-N 3.21Å; E24-Y27 VanDerWaalsContact O-N 3.16Å; E24-I28 WeakPolarHBondContact O-CG1 3.29Å; E24-I28 PolarHBondContact O-N 2.93Å; E24-L60 HydrophobicContact CG-CD2 4.22Å
25	R	62.1	Low	64.9	Low	189 Å²	189	68 Å²	68	71%	0.713	32%	0.318	S	S	*	.	H	α-helix	trans	-62.2	-33.2	173.7	-70.9	178.6	-177.3	-153.2	-0.1	113.2	T21 L22 L23 G29	T21-R25 WeakPolarHBondContact O-CG 3.44Å; T21-R25 PolarHBondContact O-N 3.01Å; L22-R25 PolarHBondContact O-N 2.84Å; L23-R25 VanDerWaalsContact C-N 3.31Å; L23-R25 PolarHBondContact O-N 3.26Å; R25-G29 PolarHBondContact O-N 3.06Å
26	V	67.9	Low	64.9	Low	77 Å²	77	63.8 Å²	63.8	47%	0.467	31%	0.314	S	S	.	.	H	α-helix	trans	-67.8	-42.6	175.5	174.4	0	0	0	0	110.3	L22 L23 E24 G29 V30	L22-V26 WeakPolarHBondContact O-CG2 3.29Å; L22-V26 PolarHBondContact O-N 3.24Å; L23-V26 WeakPolarHBondContact O-CB 3.47Å; L23-V26 PolarHBondContact O-N 3.49Å; L23-V26 VanDerWaalsContact O-N 3.09Å; E24-V26 VanDerWaalsContact C-N 3.28Å; E24-V26 PolarHBondContact O-N 2.98Å; V26-G29 PolarHBondContact O-N 3.37Å; V26-V30 WeakPolarHBondContact O-CG2 3.11Å; V26-V30 PolarHBondContact O-N 3.03Å
27	Y	68.3	Low	64.8	Low	24 Å²	24	62 Å²	62	9%	0.094	31%	0.306	C	S	.	.	H	α-helix	trans	-64.7	-48.2	178.7	-177.4	-108	0	0	0	112.5	L23 E24 G29 V30 S31 S53 E93 I131	L23-Y27 PolarHBondContact O-N 2.99Å; E24-Y27 PolarHBondContact O-N 3.21Å; E24-Y27 VanDerWaalsContact O-N 3.16Å; Y27-G29 PolarHBondContact O-N 3.43Å; Y27-V30 PolarHBondContact O-N 3.06Å; Y27-S31 PolarHBondContact O-N 3.4Å; Y27-S53 VanDerWaalsContact CE1-CB 3.43Å; Y27-E93 WeakPolarHBondContact CE1-O 3.34Å; Y27-E93 WeakPolarHBondContact CE2-O 3.4Å; Y27-E93 PolarHBondContact OH-O 3.02Å; Y27-I131 HydrophobicContact CD2-CD1 3.77Å; Y27-I131 HydrophobicContact CD2-CG2 3.99Å; Y27-I131 HydrophobicContact CE2-CD1 4.45Å
28	I	69.6	Low	65	Low	40 Å²	40	66.5 Å²	66.5	21%	0.205	33%	0.331	C	S	.	.	H	α-helix	trans	-57	-40.8	173.8	-64.2	168.9	0	0	0	109.9	E24 V30 S31 Q32	E24-I28 WeakPolarHBondContact O-CG1 3.29Å; E24-I28 PolarHBondContact O-N 2.93Å; I28-V30 PolarHBondContact O-N 3.47Å; I28-S31 PolarHBondContact O-N 3.48Å; I28-Q32 HydrophobicContact CG2-CG 4.26Å; I28-Q32 WeakPolarHBondContact O-CB 3.21Å; I28-Q32 VanDerWaalsContact O-CG 3.25Å; I28-Q32 WeakPolarHBondContact O-CG 3.43Å; I28-Q32 PolarHBondContact O-N 2.95Å
29	G	68.2	Low	65.3	Low	23 Å²	23	67.4 Å²	67.4	24%	0.237	33%	0.33	C	S	.	.	H	α-helix	trans	-60.8	-39.2	175.1	0	0	0	0	0	113.7	R25 V26 Y27 Q32 R33	R25-G29 PolarHBondContact O-N 3.06Å; V26-G29 PolarHBondContact O-N 3.37Å; Y27-G29 PolarHBondContact O-N 3.43Å; G29-Q32 PolarHBondContact O-N 3.41Å; G29-R33 WeakPolarHBondContact O-CG 3.39Å; G29-R33 PolarHBondContact O-N 3.47Å; G29-R33 VanDerWaalsContact O-N 3.14Å
30	V	70.2	Confident	65.8	Low	15 Å²	15	71.7 Å²	71.7	9%	0.091	35%	0.348	C	S	.	.	H	α-helix	trans	-69	-41.8	175.3	173.7	0	0	0	0	111	V26 Y27 I28 Q32 R33 A127 E128 I131	V26-V30 WeakPolarHBondContact O-CG2 3.11Å; V26-V30 PolarHBondContact O-N 3.03Å; Y27-V30 PolarHBondContact O-N 3.06Å; I28-V30 PolarHBondContact O-N 3.47Å; V30-Q32 VanDerWaalsContact C-N 3.34Å; V30-Q32 PolarHBondContact O-N 2.85Å; V30-R33 PolarHBondContact O-N 3.3Å; V30-A127 HydrophobicContact CG1-CB 4.14Å; V30-A127 HydrophobicContact CG2-CB 4.07Å; V30-E128 HydrophobicContact CG1-CG 4.27Å; V30-I131 HydrophobicContact CB-CD1 3.96Å; V30-I131 HydrophobicContact CG1-CD1 4.08Å; V30-I131 HydrophobicContact CG2-CD1 3.74Å
31	S	66.2	Low	66.2	Low	4 Å²	4	76.6 Å²	76.6	3%	0.028	37%	0.369	C	S	.	.	H	α-helix	trans	-62.3	-40	174.5	-168.5	0	0	0	0	111.7	Y27 I28 R33 R34 T49	Y27-S31 PolarHBondContact O-N 3.4Å; I28-S31 PolarHBondContact O-N 3.48Å; S31-R33 VanDerWaalsContact C-N 3.31Å; S31-R33 PolarHBondContact O-N 3.48Å; S31-R34 VanDerWaalsContact O-CB 3.22Å; S31-R34 WeakPolarHBondContact O-CB 3.42Å; S31-R34 WeakPolarHBondContact O-CG 3.31Å; S31-R34 PolarHBondContact O-N 3.25Å; S31-T49 PolarHBondContact OG-OG1 3.39Å
32	Q	63.1	Low	66.5	Low	110 Å²	110	74.2 Å²	74.2	51%	0.514	36%	0.356	S	S	.	.	H	α-helix	trans	-67.8	-27.4	176.8	-75.1	178.7	9.3	0	0	113.6	I28 G29 V30 R34 R46	I28-Q32 HydrophobicContact CG2-CG 4.26Å; I28-Q32 WeakPolarHBondContact O-CB 3.21Å; I28-Q32 VanDerWaalsContact O-CG 3.25Å; I28-Q32 WeakPolarHBondContact O-CG 3.43Å; I28-Q32 PolarHBondContact O-N 2.95Å; G29-Q32 PolarHBondContact O-N 3.41Å; V30-Q32 VanDerWaalsContact C-N 3.34Å; V30-Q32 PolarHBondContact O-N 2.85Å; Q32-R34 PolarHBondContact O-N 3.5Å; Q32-R46 PolarHBondContact O-NH2 3.14Å
33	R	61.4	Low	66.9	Low	195 Å²	195	73 Å²	73	74%	0.736	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-12.1	176.7	-78	175.4	-175.5	-164.7	1.8	113.4	G29 V30 S31 R35 Y116	G29-R33 WeakPolarHBondContact O-CG 3.39Å; G29-R33 PolarHBondContact O-N 3.47Å; G29-R33 VanDerWaalsContact O-N 3.14Å; V30-R33 PolarHBondContact O-N 3.3Å; S31-R33 VanDerWaalsContact C-N 3.31Å; S31-R33 PolarHBondContact O-N 3.48Å; R33-R35 PolarHBondContact O-N 3.48Å; R33-Y116 VanDerWaalsContact C-OH 3.31Å; R33-Y116 PolarHBondContact O-OH 2.9Å
34	R	66.7	Low	67.4	Low	9 Å²	9	77.6 Å²	77.6	3%	0.034	37%	0.368	C	S	.	.	S	Bend	trans	-52.3	104.8	166.4	-67.5	178.6	-179.1	-116.2	8.1	108.6	S31 Q32 A36 R46 L102 Y116 L124 E128	S31-R34 VanDerWaalsContact O-CB 3.22Å; S31-R34 WeakPolarHBondContact O-CB 3.42Å; S31-R34 WeakPolarHBondContact O-CG 3.31Å; S31-R34 PolarHBondContact O-N 3.25Å; Q32-R34 PolarHBondContact O-N 3.5Å; R34-A36 PolarHBondContact O-N 3.1Å; R34-R46 HydrophobicContact CB-CG 4.19Å; R34-R46 VanDerWaalsContact O-CD 3.24Å; R34-R46 WeakPolarHBondContact O-CD 3.16Å; R34-R46 PolarHBondContact O-NE 2.95Å; R34-L102 VanDerWaalsContact NH1-CG 3.31Å; R34-Y116 WeakPolarHBondContact CA-OH 3.2Å; R34-Y116 PolarHBondContact N-OH 3.24Å; R34-L124 HydrophobicContact CG-CD1 4.38Å; R34-E128 IonicContact CZ-OE1 3.55Å; R34-E128 IonicContact NH2-OE1 3.78Å; R34-E128 PolarHBondContact NH2-OE1 3.46Å
35	R	62.4	Low	67.7	Low	133 Å²	133	76.9 Å²	76.9	50%	0.502	37%	0.367	S	S	.	.			trans	-54.4	127.3	-169.6	-175.1	172.8	-178.5	133.1	-1.2	108.6	R33 S37 Y116 E120	R33-R35 PolarHBondContact O-N 3.48Å; R35-S37 VanDerWaalsContact C-N 3.3Å; R35-S37 PolarHBondContact O-N 3.08Å; R35-Y116 HydrophobicContact CB-CE1 3.92Å; R35-Y116 PolarHBondContact N-OH 3.12Å; R35-E120 IonicContact NH1-OE1 3.51Å
36	A	56.8	Low	68.3	Low	53 Å²	53	70.8 Å²	70.8	44%	0.438	34%	0.344	S	S	.	.			trans	-70.2	96	173.8	0	0	0	0	0	107.2	R34	R34-A36 PolarHBondContact O-N 3.1Å
37	S	57.7	Low	68.8	Low	9 Å²	9	71.3 Å²	71.3	6%	0.063	34%	0.344	C	S	.	.			trans	-62.5	140.6	176.2	54.3	0	0	0	0	112.1	R35 N39 A42 L43 E115	R35-S37 VanDerWaalsContact C-N 3.3Å; R35-S37 PolarHBondContact O-N 3.08Å; S37-N39 PolarHBondContact O-N 3.02Å; S37-N39 VanDerWaalsContact O-N 3.11Å; S37-N39 PolarHBondContact OG-O 2.9Å; S37-A42 VanDerWaalsContact CB-CB 3.44Å; S37-A42 WeakPolarHBondContact OG-CA 3.46Å; S37-A42 WeakPolarHBondContact OG-CB 3.22Å; S37-L43 PolarHBondContact OG-N 2.97Å; S37-L43 VanDerWaalsContact OG-N 3.11Å; S37-E115 VanDerWaalsContact CA-CD 3.48Å; S37-E115 WeakPolarHBondContact CA-OE1 3.41Å; S37-E115 WeakPolarHBondContact CA-OE2 3.47Å; S37-E115 WeakPolarHBondContact CB-OE1 3.25Å; S37-E115 WeakPolarHBondContact CB-OE2 3.31Å
38	N	67.5	Low	69.3	Low	174 Å²	174	73 Å²	73	93%	0.93	35%	0.35	S	S	*	.	S	Bend	trans	-68.3	-2.1	165	-80	-15	0	0	0	112.2
39	N	69	Low	69.5	Low	64 Å²	64	71.4 Å²	71.4	34%	0.342	34%	0.342	S	S	.	.	S	Bend	trans	-85.2	127	169	-169.5	-5.9	0	0	0	111.4	S37 F41 A42 L43	S37-N39 PolarHBondContact O-N 3.02Å; S37-N39 VanDerWaalsContact O-N 3.11Å; S37-N39 PolarHBondContact OG-O 2.9Å; N39-F41 PolarHBondContact O-N 3.36Å; N39-F41 WeakPolarHBondContact OD1-CD2 3.35Å; N39-F41 PolarHBondContact OD1-N 2.97Å; N39-A42 PolarHBondContact O-N 3.25Å; N39-L43 PolarHBondContact O-N 3.14Å
40	K	74.5	Confident	70	Confident	167 Å²	167	72.4 Å²	72.4	73%	0.726	34%	0.341	S	S	*	.	H	α-helix	trans	-53	-38.6	176.5	-63.6	-179.7	-178.4	179.1	0	111.9	L43 F44	K40-L43 PolarHBondContact O-N 3.39Å; K40-F44 WeakPolarHBondContact O-CD2 3.21Å; K40-F44 PolarHBondContact O-N 3.21Å
41	F	72.5	Confident	70.4	Confident	113 Å²	113	74.4 Å²	74.4	50%	0.496	35%	0.353	S	S	.	.	H	α-helix	trans	-69.6	-41.6	-176.7	-68.9	-66.9	0	0	0	113.4	N39 L43 F44 G45 L108	N39-F41 PolarHBondContact O-N 3.36Å; N39-F41 WeakPolarHBondContact OD1-CD2 3.35Å; N39-F41 PolarHBondContact OD1-N 2.97Å; F41-L43 VanDerWaalsContact C-N 3.33Å; F41-F44 PolarHBondContact O-N 3.4Å; F41-G45 PolarHBondContact O-N 3.03Å; F41-L108 HydrophobicContact CB-CD2 3.62Å; F41-L108 HydrophobicContact CD1-CD2 3.61Å; F41-L108 HydrophobicContact CG-CD2 4.05Å
42	A	72.7	Confident	70.9	Confident	10 Å²	10	74.5 Å²	74.5	8%	0.083	35%	0.353	C	S	.	.	H	α-helix	trans	-75.8	-23.9	179.3	0	0	0	0	0	112.2	S37 N39 G45 R46 G111	S37-A42 VanDerWaalsContact CB-CB 3.44Å; S37-A42 WeakPolarHBondContact OG-CA 3.46Å; S37-A42 WeakPolarHBondContact OG-CB 3.22Å; N39-A42 PolarHBondContact O-N 3.25Å; A42-G45 PolarHBondContact O-N 3.29Å; A42-R46 PolarHBondContact O-N 3.31Å; A42-G111 WeakPolarHBondContact CB-O 3.47Å
43	L	75.2	Confident	71.5	Confident	74 Å²	74	69.4 Å²	69.4	39%	0.387	33%	0.33	S	S	.	.	H	α-helix	trans	-63.3	-46.8	166.4	-177.6	67.2	0	0	0	111.8	S37 N39 K40 F41 G45 R46 L47	S37-L43 PolarHBondContact OG-N 2.97Å; S37-L43 VanDerWaalsContact OG-N 3.11Å; N39-L43 PolarHBondContact O-N 3.14Å; K40-L43 PolarHBondContact O-N 3.39Å; F41-L43 VanDerWaalsContact C-N 3.33Å; L43-G45 VanDerWaalsContact C-N 3.31Å; L43-G45 PolarHBondContact O-N 3.33Å; L43-R46 PolarHBondContact O-N 3.18Å; L43-L47 HydrophobicContact CG-CD1 4.48Å; L43-L47 WeakPolarHBondContact O-CG 3.1Å; L43-L47 PolarHBondContact O-N 3.37Å
44	F	76.8	Confident	72.3	Confident	124 Å²	124	64 Å²	64	54%	0.544	32%	0.315	S	S	.	.	H	α-helix	trans	-62.7	-39.1	175.3	-73.6	-61.9	0	0	0	112.2	K40 F41 L47 R48	K40-F44 WeakPolarHBondContact O-CD2 3.21Å; K40-F44 PolarHBondContact O-N 3.21Å; F41-F44 PolarHBondContact O-N 3.4Å; F44-L47 PolarHBondContact O-N 3.31Å; F44-R48 WeakPolarHBondContact O-CG 3.29Å; F44-R48 PolarHBondContact O-N 3.2Å
45	G	73.8	Confident	72.9	Confident	7 Å²	7	65.3 Å²	65.3	7%	0.072	33%	0.325	C	S	.	.	H	α-helix	trans	-54.9	-52.4	171.6	0	0	0	0	0	111.7	F41 A42 L43 L47 R48 T49	F41-G45 PolarHBondContact O-N 3.03Å; A42-G45 PolarHBondContact O-N 3.29Å; L43-G45 VanDerWaalsContact C-N 3.31Å; L43-G45 PolarHBondContact O-N 3.33Å; G45-L47 PolarHBondContact O-N 2.78Å; G45-R48 PolarHBondContact O-N 3.46Å; G45-T49 WeakPolarHBondContact O-CG2 3.14Å; G45-T49 PolarHBondContact O-N 3.46Å
46	R	74.8	Confident	73.5	Confident	62 Å²	62	59.8 Å²	59.8	23%	0.234	31%	0.305	C	S	.	.	H	α-helix	trans	-58.5	-40.6	177.6	-174.6	-175.9	-179.2	-153.7	4.5	113.2	Q32 R34 A42 L43 R48 T49 I50	Q32-R46 PolarHBondContact O-NH2 3.14Å; R34-R46 HydrophobicContact CB-CG 4.19Å; R34-R46 VanDerWaalsContact O-CD 3.24Å; R34-R46 WeakPolarHBondContact O-CD 3.16Å; R34-R46 PolarHBondContact O-NE 2.95Å; A42-R46 PolarHBondContact O-N 3.31Å; L43-R46 PolarHBondContact O-N 3.18Å; R46-R48 VanDerWaalsContact C-N 3.34Å; R46-R48 PolarHBondContact O-N 3.36Å; R46-T49 WeakPolarHBondContact O-CG2 3.26Å; R46-T49 PolarHBondContact O-N 2.96Å; R46-T49 PolarHBondContact O-OG1 2.95Å; R46-I50 HydrophobicContact CG-CD1 4.03Å; R46-I50 WeakPolarHBondContact O-CG1 3.39Å; R46-I50 PolarHBondContact O-N 3.49Å
47	L	78.4	Confident	74.3	Confident	88 Å²	88	60.1 Å²	60.1	46%	0.461	30%	0.297	S	S	.	.	H	α-helix	trans	-65.3	-38.2	179.9	-70.5	172.6	0	0	0	112	L43 F44 G45 T49 I50 T51	L43-L47 HydrophobicContact CG-CD1 4.48Å; L43-L47 WeakPolarHBondContact O-CG 3.1Å; L43-L47 PolarHBondContact O-N 3.37Å; F44-L47 PolarHBondContact O-N 3.31Å; G45-L47 PolarHBondContact O-N 2.78Å; L47-T49 VanDerWaalsContact C-N 3.31Å; L47-T49 PolarHBondContact O-N 3.25Å; L47-I50 PolarHBondContact O-N 2.89Å; L47-T51 WeakPolarHBondContact O-CG2 3.27Å; L47-T51 PolarHBondContact O-N 3.19Å; L47-T51 PolarHBondContact O-OG1 3.16Å
48	R	78.2	Confident	75.2	Confident	60 Å²	60	64.8 Å²	64.8	23%	0.226	32%	0.321	C	S	.	.	H	α-helix	trans	-60.5	-41.5	177.2	-67.9	161.6	74.5	86.4	-10.3	111.9	F44 G45 R46 I50 T51 Q52 E105 Y171	F44-R48 WeakPolarHBondContact O-CG 3.29Å; F44-R48 PolarHBondContact O-N 3.2Å; G45-R48 PolarHBondContact O-N 3.46Å; R46-R48 VanDerWaalsContact C-N 3.34Å; R46-R48 PolarHBondContact O-N 3.36Å; R48-I50 VanDerWaalsContact C-N 3.33Å; R48-I50 PolarHBondContact O-N 3.3Å; R48-T51 WeakPolarHBondContact CA-OG1 3.42Å; R48-T51 PolarHBondContact O-N 3.46Å; R48-T51 PolarHBondContact O-OG1 3.32Å; R48-Q52 WeakPolarHBondContact O-CB 3.4Å; R48-Q52 PolarHBondContact O-N 2.94Å; R48-E105 IonicContact CZ-OE1 3.21Å; R48-E105 IonicContact CZ-OE2 3Å; R48-E105 IonicContact NE-OE1 3.03Å; R48-E105 IonicContact NE-OE2 3.7Å; R48-E105 IonicContact NH2-OE1 2.71Å; R48-E105 PolarHBondContact NH2-OE1 2.71Å; R48-E105 IonicContact NH2-OE2 3.56Å; R48-E105 PolarHBondContact NH2-OE2 3.49Å; R48-Y171 HydrophobicContact CB-CE2 4.41Å; R48-Y171 HydrophobicContact CG-CE1 4.46Å
49	T	74.2	Confident	75.6	Confident	6 Å²	6	58.8 Å²	58.8	4%	0.037	29%	0.29	C	S	.	.	H	α-helix	trans	-62.6	-42.7	179	88.4	0	0	0	0	111.8	S31 G45 R46 L47 Q52 S53 L102	S31-T49 PolarHBondContact OG-OG1 3.39Å; G45-T49 WeakPolarHBondContact O-CG2 3.14Å; G45-T49 PolarHBondContact O-N 3.46Å; R46-T49 WeakPolarHBondContact O-CG2 3.26Å; R46-T49 PolarHBondContact O-N 2.96Å; R46-T49 PolarHBondContact O-OG1 2.95Å; L47-T49 VanDerWaalsContact C-N 3.31Å; L47-T49 PolarHBondContact O-N 3.25Å; T49-Q52 PolarHBondContact O-N 3.1Å; T49-S53 WeakPolarHBondContact O-CB 3.49Å; T49-S53 PolarHBondContact O-N 3.49Å; T49-S53 PolarHBondContact O-OG 3.11Å; T49-L102 HydrophobicContact CG2-CD1 2.98Å; T49-L102 HydrophobicContact CG2-CD2 2.99Å; T49-L102 HydrophobicContact CG2-CG 3.24Å
50	I	77.8	Confident	75.7	Confident	43 Å²	43	56 Å²	56	22%	0.221	28%	0.275	C	S	.	.	H	α-helix	trans	-66.4	-44.4	-179.7	-66.4	167.8	0	0	0	109.1	R46 L47 R48 Q52 S53 I54	R46-I50 HydrophobicContact CG-CD1 4.03Å; R46-I50 WeakPolarHBondContact O-CG1 3.39Å; R46-I50 PolarHBondContact O-N 3.49Å; L47-I50 PolarHBondContact O-N 2.89Å; R48-I50 VanDerWaalsContact C-N 3.33Å; R48-I50 PolarHBondContact O-N 3.3Å; I50-Q52 VanDerWaalsContact C-N 3.3Å; I50-Q52 PolarHBondContact O-N 3.35Å; I50-S53 WeakPolarHBondContact CA-OG 3.34Å; I50-S53 PolarHBondContact O-N 3.34Å; I50-S53 PolarHBondContact O-OG 3.04Å; I50-I54 HydrophobicContact CG2-CD1 3.64Å; I50-I54 HydrophobicContact CG2-CG1 4.4Å; I50-I54 WeakPolarHBondContact O-CD1 3.43Å; I50-I54 VanDerWaalsContact O-CG1 3.23Å; I50-I54 WeakPolarHBondContact O-CG1 3.21Å; I50-I54 PolarHBondContact O-N 3.31Å
51	T	79.5	Confident	75.6	Confident	57 Å²	57	50.4 Å²	50.4	35%	0.35	26%	0.26	S	S	.	.	H	α-helix	trans	-62.1	-38.8	176.5	58.7	0	0	0	0	112.4	L47 R48 S55 Y171	L47-T51 WeakPolarHBondContact O-CG2 3.27Å; L47-T51 PolarHBondContact O-N 3.19Å; L47-T51 PolarHBondContact O-OG1 3.16Å; R48-T51 WeakPolarHBondContact CA-OG1 3.42Å; R48-T51 PolarHBondContact O-N 3.46Å; R48-T51 PolarHBondContact O-OG1 3.32Å; T51-S55 PolarHBondContact O-N 3.08Å; T51-S55 PolarHBondContact O-OG 3.01Å; T51-Y171 PolarHBondContact OG1-OH 3.01Å
52	Q	76	Confident	75.5	Confident	6 Å²	6	49.7 Å²	49.7	3%	0.028	26%	0.261	C	S	.	.	H	α-helix	trans	-65.9	-47.8	177	-174.8	-175.6	-27.8	0	0	111.1	R48 T49 I50 I54 S55 Y56 F99 L174	R48-Q52 WeakPolarHBondContact O-CB 3.4Å; R48-Q52 PolarHBondContact O-N 2.94Å; T49-Q52 PolarHBondContact O-N 3.1Å; I50-Q52 VanDerWaalsContact C-N 3.3Å; I50-Q52 PolarHBondContact O-N 3.35Å; Q52-I54 PolarHBondContact O-N 3.38Å; Q52-S55 PolarHBondContact O-N 3.23Å; Q52-Y56 HydrophobicContact CG-CD2 3.81Å; Q52-Y56 HydrophobicContact CG-CE2 3.57Å; Q52-Y56 WeakPolarHBondContact O-CD2 2.94Å; Q52-Y56 PolarHBondContact O-N 3.1Å; Q52-F99 PolarHBondContact NE2-O 3.41Å; Q52-L174 HydrophobicContact CG-CD1 4.39Å
53	S	74.7	Confident	75.3	Confident	4 Å²	4	51 Å²	51	3%	0.028	27%	0.266	C	S	.	.	H	α-helix	trans	-62.5	-42.5	-178.8	58.8	0	0	0	0	112.6	Y27 T49 I50 S55 E57	Y27-S53 VanDerWaalsContact CE1-CB 3.43Å; T49-S53 WeakPolarHBondContact O-CB 3.49Å; T49-S53 PolarHBondContact O-N 3.49Å; T49-S53 PolarHBondContact O-OG 3.11Å; I50-S53 WeakPolarHBondContact CA-OG 3.34Å; I50-S53 PolarHBondContact O-N 3.34Å; I50-S53 PolarHBondContact O-OG 3.04Å; S53-S55 PolarHBondContact O-N 3.16Å; S53-E57 PolarHBondContact O-N 3.04Å
54	I	78.1	Confident	75	Confident	81 Å²	81	48.1 Å²	48.1	42%	0.415	25%	0.251	S	S	.	.	H	α-helix	trans	-63.6	-33.7	-179.1	-70.2	166.8	0	0	0	111.5	I50 Q52 E57	I50-I54 HydrophobicContact CG2-CD1 3.64Å; I50-I54 HydrophobicContact CG2-CG1 4.4Å; I50-I54 WeakPolarHBondContact O-CD1 3.43Å; I50-I54 VanDerWaalsContact O-CG1 3.23Å; I50-I54 WeakPolarHBondContact O-CG1 3.21Å; I50-I54 PolarHBondContact O-N 3.31Å; Q52-I54 PolarHBondContact O-N 3.38Å; I54-E57 WeakPolarHBondContact O-CB 3.4Å
55	S	79.6	Confident	74.5	Confident	36 Å²	36	47.7 Å²	47.7	25%	0.252	25%	0.254	S	S	.	.	H	α-helix	trans	-80.9	-36.3	-174.1	-55.2	0	0	0	0	112.2	T51 Q52 S53 E57 I58 T59 M178	T51-S55 PolarHBondContact O-N 3.08Å; T51-S55 PolarHBondContact O-OG 3.01Å; Q52-S55 PolarHBondContact O-N 3.23Å; S53-S55 PolarHBondContact O-N 3.16Å; S55-E57 VanDerWaalsContact C-N 3.25Å; S55-E57 PolarHBondContact O-N 2.85Å; S55-I58 PolarHBondContact O-N 3.36Å; S55-T59 PolarHBondContact O-N 3.22Å; S55-M178 WeakPolarHBondContact OG-CE 3.46Å
56	Y	75.9	Confident	74.1	Confident	17 Å²	17	52.8 Å²	52.8	7%	0.067	28%	0.279	C	S	.	.	H	α-helix	trans	-68.7	-27.8	173.4	-71.2	-62.1	0	0	0	112.1	Q52 I58 T59 L60 A92 E93 F99 L174	Q52-Y56 HydrophobicContact CG-CD2 3.81Å; Q52-Y56 HydrophobicContact CG-CE2 3.57Å; Q52-Y56 WeakPolarHBondContact O-CD2 2.94Å; Q52-Y56 PolarHBondContact O-N 3.1Å; Y56-I58 VanDerWaalsContact C-N 3.28Å; Y56-I58 PolarHBondContact O-N 2.67Å; Y56-T59 WeakPolarHBondContact CA-OG1 3.44Å; Y56-T59 PolarHBondContact O-N 3.08Å; Y56-T59 PolarHBondContact O-OG1 3.47Å; Y56-L60 WeakPolarHBondContact O-CB 3.45Å; Y56-L60 PolarHBondContact O-N 3.49Å; Y56-A92 HydrophobicContact CD1-CB 3.51Å; Y56-A92 HydrophobicContact CD2-CB 3.92Å; Y56-A92 HydrophobicContact CE1-CB 3.43Å; Y56-A92 VanDerWaalsContact CE1-CB 3.43Å; Y56-A92 HydrophobicContact CE2-CB 3.83Å; Y56-A92 HydrophobicContact CG-CB 3.78Å; Y56-E93 WeakPolarHBondContact CB-OE1 3.35Å; Y56-F99 WeakPolarHBondContact OH-CE1 3.09Å; Y56-L174 HydrophobicContact CE2-CD2 3.92Å; Y56-L174 WeakPolarHBondContact OH-CD2 3.4Å
57	E	73.5	Confident	73.6	Confident	61 Å²	61	51.3 Å²	51.3	29%	0.285	28%	0.275	S	S	.	.	H	α-helix	trans	-55.7	-43.5	173.6	-172.1	-178.3	177.7	0	0	111.5	S53 I54 S55 L60 A61 E93	S53-E57 PolarHBondContact O-N 3.04Å; I54-E57 WeakPolarHBondContact O-CB 3.4Å; S55-E57 VanDerWaalsContact C-N 3.25Å; S55-E57 PolarHBondContact O-N 2.85Å; E57-L60 PolarHBondContact O-N 3.09Å; E57-A61 WeakPolarHBondContact O-CB 3.2Å; E57-A61 PolarHBondContact O-N 3.32Å; E57-E93 WeakPolarHBondContact CA-OE1 3.12Å; E57-E93 PolarHBondContact N-OE1 3.32Å; E57-E93 VanDerWaalsContact N-OE1 3.08Å
58	I	75.9	Confident	72.8	Confident	107 Å²	107	49.5 Å²	49.5	55%	0.549	26%	0.263	S	S	.	.	H	α-helix	trans	-65.7	-43.6	177.8	-59.7	172	0	0	0	110.6	S55 Y56 L60 A61 L62	S55-I58 PolarHBondContact O-N 3.36Å; Y56-I58 VanDerWaalsContact C-N 3.28Å; Y56-I58 PolarHBondContact O-N 2.67Å; I58-L60 VanDerWaalsContact C-N 3.33Å; I58-L60 PolarHBondContact O-N 3.28Å; I58-A61 PolarHBondContact O-N 3.08Å; I58-L62 HydrophobicContact CG2-CD1 4.35Å; I58-L62 WeakPolarHBondContact O-CG 3.45Å; I58-L62 PolarHBondContact O-N 3.34Å
59	T	75.6	Confident	71.7	Confident	47 Å²	47	52 Å²	52	29%	0.288	29%	0.289	S	S	.	.	H	α-helix	trans	-64.5	-39.5	179.1	66.1	0	0	0	0	111.9	S55 Y56 L62 I63	S55-T59 PolarHBondContact O-N 3.22Å; Y56-T59 WeakPolarHBondContact CA-OG1 3.44Å; Y56-T59 PolarHBondContact O-N 3.08Å; Y56-T59 PolarHBondContact O-OG1 3.47Å; T59-L62 PolarHBondContact O-N 3.01Å; T59-I63 VanDerWaalsContact O-CD1 3.29Å; T59-I63 WeakPolarHBondContact O-CD1 3.49Å; T59-I63 VanDerWaalsContact O-CG1 3.27Å; T59-I63 WeakPolarHBondContact O-CG1 3.41Å; T59-I63 PolarHBondContact O-N 3.34Å; T59-I63 VanDerWaalsContact O-N 3.09Å
60	L	72.1	Confident	70.7	Confident	5 Å²	5	54.3 Å²	54.3	3%	0.026	31%	0.314	C	S	.	.	H	α-helix	trans	-64.2	-47.1	176.7	-177	65.9	0	0	0	110.7	E24 Y56 E57 I58 L62 I63 I64 I89 E93 F139	E24-L60 HydrophobicContact CG-CD2 4.22Å; Y56-L60 WeakPolarHBondContact O-CB 3.45Å; Y56-L60 PolarHBondContact O-N 3.49Å; E57-L60 PolarHBondContact O-N 3.09Å; I58-L60 VanDerWaalsContact C-N 3.33Å; I58-L60 PolarHBondContact O-N 3.28Å; L60-L62 VanDerWaalsContact C-N 3.31Å; L60-L62 PolarHBondContact O-N 3.05Å; L60-I63 PolarHBondContact O-N 3.31Å; L60-I64 HydrophobicContact CD1-CD1 4.18Å; L60-I64 HydrophobicContact CD2-CD1 4.48Å; L60-I64 HydrophobicContact CG-CD1 3.79Å; L60-I64 WeakPolarHBondContact O-CD1 3.23Å; L60-I64 VanDerWaalsContact O-CG1 3.29Å; L60-I64 WeakPolarHBondContact O-CG1 3.3Å; L60-I64 PolarHBondContact O-N 3.43Å; L60-I89 HydrophobicContact CD1-CG2 4.28Å; L60-E93 HydrophobicContact CD2-CG 4.29Å; L60-F139 HydrophobicContact CD1-CE1 3.82Å; L60-F139 HydrophobicContact CD1-CZ 3.46Å; L60-F139 VanDerWaalsContact CD1-CZ 3.46Å
61	A	72.5	Confident	69.2	Low	50 Å²	50	59.6 Å²	59.6	41%	0.413	34%	0.336	S	S	.	.	H	α-helix	trans	-58.2	-41.8	177.3	0	0	0	0	0	112.2	E57 I58 I64 L65	E57-A61 WeakPolarHBondContact O-CB 3.2Å; E57-A61 PolarHBondContact O-N 3.32Å; I58-A61 PolarHBondContact O-N 3.08Å; A61-I64 PolarHBondContact O-N 2.69Å; A61-L65 WeakPolarHBondContact O-CB 3.45Å; A61-L65 PolarHBondContact O-N 3.24Å
62	L	69.8	Low	67.9	Low	98 Å²	98	64.9 Å²	64.9	51%	0.513	36%	0.356	S	S	.	.	H	α-helix	trans	-64.1	-42.1	176.1	-74.5	172.9	0	0	0	112.4	I58 T59 L60 L65 L66	I58-L62 HydrophobicContact CG2-CD1 4.35Å; I58-L62 WeakPolarHBondContact O-CG 3.45Å; I58-L62 PolarHBondContact O-N 3.34Å; T59-L62 PolarHBondContact O-N 3.01Å; L60-L62 VanDerWaalsContact C-N 3.31Å; L60-L62 PolarHBondContact O-N 3.05Å; L62-L65 WeakPolarHBondContact O-CB 3.4Å; L62-L65 PolarHBondContact O-N 2.93Å; L62-L66 VanDerWaalsContact O-CG 3.32Å; L62-L66 WeakPolarHBondContact O-CG 3.04Å; L62-L66 PolarHBondContact O-N 3.4Å
63	I	69.4	Low	66.8	Low	39 Å²	39	66.3 Å²	66.3	20%	0.2	36%	0.364	C	S	.	.	H	α-helix	trans	-65.2	-43.8	178.7	-67.1	156.8	0	0	0	110.6	T59 L60 L65 L66 M67 I89	T59-I63 VanDerWaalsContact O-CD1 3.29Å; T59-I63 WeakPolarHBondContact O-CD1 3.49Å; T59-I63 VanDerWaalsContact O-CG1 3.27Å; T59-I63 WeakPolarHBondContact O-CG1 3.41Å; T59-I63 PolarHBondContact O-N 3.34Å; T59-I63 VanDerWaalsContact O-N 3.09Å; L60-I63 PolarHBondContact O-N 3.31Å; I63-L65 VanDerWaalsContact C-N 3.31Å; I63-L65 PolarHBondContact O-N 3.33Å; I63-L66 PolarHBondContact O-N 3.25Å; I63-M67 HydrophobicContact CG2-CG 4.45Å; I63-M67 HydrophobicContact CG2-SD 4.08Å; I63-M67 VanDerWaalsContact O-CG 3.27Å; I63-M67 WeakPolarHBondContact O-CG 3.39Å; I63-M67 PolarHBondContact O-N 3.1Å; I63-I89 HydrophobicContact CD1-CB 4.29Å; I63-I89 HydrophobicContact CD1-CD1 3.26Å; I63-I89 HydrophobicContact CD1-CG1 3.8Å; I63-I89 HydrophobicContact CD1-CG2 3.94Å; I63-I89 HydrophobicContact CG1-CD1 4.48Å
64	I	67.9	Low	65.9	Low	13 Å²	13	70.6 Å²	70.6	7%	0.067	39%	0.39	C	S	.	.	H	α-helix	trans	-61.3	-43.6	177.6	-66.9	159.6	0	0	0	110.1	I20 L60 A61 L66 M67 F68	I20-I64 HydrophobicContact CB-CD1 4.28Å; I20-I64 HydrophobicContact CD1-CD1 3.84Å; I20-I64 HydrophobicContact CD1-CG1 4.19Å; I20-I64 HydrophobicContact CD1-CG2 4.04Å; I20-I64 HydrophobicContact CG1-CD1 4.49Å; I20-I64 HydrophobicContact CG2-CD1 3.36Å; L60-I64 HydrophobicContact CD1-CD1 4.18Å; L60-I64 HydrophobicContact CD2-CD1 4.48Å; L60-I64 HydrophobicContact CG-CD1 3.79Å; L60-I64 WeakPolarHBondContact O-CD1 3.23Å; L60-I64 VanDerWaalsContact O-CG1 3.29Å; L60-I64 WeakPolarHBondContact O-CG1 3.3Å; L60-I64 PolarHBondContact O-N 3.43Å; A61-I64 PolarHBondContact O-N 2.69Å; I64-L66 VanDerWaalsContact C-N 3.34Å; I64-L66 PolarHBondContact O-N 2.89Å; I64-M67 PolarHBondContact O-N 2.93Å; I64-F68 HydrophobicContact CG2-CD2 3.72Å; I64-F68 HydrophobicContact CG2-CE2 3.46Å; I64-F68 VanDerWaalsContact CG2-CE2 3.46Å; I64-F68 WeakPolarHBondContact O-CD2 3.4Å; I64-F68 PolarHBondContact O-N 2.96Å
65	L	66.8	Low	64.7	Low	115 Å²	115	75.3 Å²	75.3	60%	0.602	41%	0.41	S	S	*	.	H	α-helix	trans	-58.7	-44.7	175.3	-175.7	70.2	0	0	0	111.8	A61 L62 I63 M67 F68 C69	A61-L65 WeakPolarHBondContact O-CB 3.45Å; A61-L65 PolarHBondContact O-N 3.24Å; L62-L65 WeakPolarHBondContact O-CB 3.4Å; L62-L65 PolarHBondContact O-N 2.93Å; I63-L65 VanDerWaalsContact C-N 3.31Å; I63-L65 PolarHBondContact O-N 3.33Å; L65-M67 VanDerWaalsContact C-N 3.31Å; L65-M67 PolarHBondContact O-N 3.33Å; L65-F68 PolarHBondContact O-N 2.99Å; L65-C69 PolarHBondContact O-N 3.4Å; L65-C69 VanDerWaalsContact O-N 3.16Å
66	L	66.3	Low	63.4	Low	114 Å²	114	78 Å²	78	60%	0.597	42%	0.42	S	S	*	.	H	α-helix	trans	-62.9	-36.5	176.8	-71.8	169.7	0	0	0	112.3	L62 I63 I64 C69	L62-L66 VanDerWaalsContact O-CG 3.32Å; L62-L66 WeakPolarHBondContact O-CG 3.04Å; L62-L66 PolarHBondContact O-N 3.4Å; I63-L66 PolarHBondContact O-N 3.25Å; I64-L66 VanDerWaalsContact C-N 3.34Å; I64-L66 PolarHBondContact O-N 2.89Å; L66-C69 PolarHBondContact O-N 3.04Å
67	M	63.2	Low	62.2	Low	30 Å²	30	77.7 Å²	77.7	15%	0.148	42%	0.42	C	S	.	.	H	α-helix	trans	-68.5	-32.9	175.8	-65.7	177.3	90.8	0	0	112.2	I63 I64 L65 I73 I142 I143	I63-M67 HydrophobicContact CG2-CG 4.45Å; I63-M67 HydrophobicContact CG2-SD 4.08Å; I63-M67 VanDerWaalsContact O-CG 3.27Å; I63-M67 WeakPolarHBondContact O-CG 3.39Å; I63-M67 PolarHBondContact O-N 3.1Å; I64-M67 PolarHBondContact O-N 2.93Å; L65-M67 VanDerWaalsContact C-N 3.31Å; L65-M67 PolarHBondContact O-N 3.33Å; M67-I73 HydrophobicContact CB-CD1 4.26Å; M67-I73 HydrophobicContact CE-CD1 3.29Å; M67-I73 HydrophobicContact CG-CD1 3.84Å; M67-I73 HydrophobicContact SD-CD1 4.43Å; M67-I142 HydrophobicContact CB-CG2 4.39Å; M67-I142 HydrophobicContact CE-CB 4.11Å; M67-I142 HydrophobicContact CE-CG2 3.29Å; M67-I142 HydrophobicContact SD-CG2 3.66Å; M67-I143 HydrophobicContact CE-CG1 4.12Å
68	F	61.2	Low	61.2	Low	50 Å²	50	84 Å²	84	22%	0.219	45%	0.447	C	S	.	.	H	α-helix	trans	-74.9	-23.4	175.2	-81.1	-67.3	0	0	0	114	Q13 Q16 I17 I64 L65 G70	Q13-F68 HydrophobicContact CB-CD1 4.12Å; Q13-F68 HydrophobicContact CB-CE1 3.67Å; Q13-F68 HydrophobicContact CG-CD1 4.04Å; Q13-F68 HydrophobicContact CG-CE1 3.77Å; Q16-F68 HydrophobicContact CB-CZ 3.93Å; I17-F68 HydrophobicContact CD1-CD2 4.19Å; I17-F68 HydrophobicContact CD1-CE2 3.93Å; I17-F68 HydrophobicContact CD1-CZ 4.27Å; I17-F68 HydrophobicContact CG1-CD2 4.14Å; I17-F68 HydrophobicContact CG1-CE2 3.44Å; I17-F68 VanDerWaalsContact CG1-CE2 3.44Å; I17-F68 HydrophobicContact CG1-CZ 3.82Å; I64-F68 HydrophobicContact CG2-CD2 3.72Å; I64-F68 HydrophobicContact CG2-CE2 3.46Å; I64-F68 VanDerWaalsContact CG2-CE2 3.46Å; I64-F68 WeakPolarHBondContact O-CD2 3.4Å; I64-F68 PolarHBondContact O-N 2.96Å; L65-F68 PolarHBondContact O-N 2.99Å; F68-G70 PolarHBondContact O-N 3.36Å
69	C	56.1	Low	60.2	Low	112 Å²	112	81.2 Å²	81.2	76%	0.757	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	10.4	-176	-149.3	0	0	0	0	114.6	L65 L66	L65-C69 PolarHBondContact O-N 3.4Å; L65-C69 VanDerWaalsContact O-N 3.16Å; L66-C69 PolarHBondContact O-N 3.04Å
70	G	52	Low	59.2	Low	56 Å²	56	87.8 Å²	87.8	58%	0.577	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	108.7	14.5	162	0	0	0	0	0	116.5	F68 H72	F68-G70 PolarHBondContact O-N 3.36Å; G70-H72 PolarHBondContact O-N 2.7Å; G70-H72 VanDerWaalsContact O-N 3.11Å
71	F	47.2	Very low	58.5	Low	154 Å²	154	96 Å²	96	68%	0.675	49%	0.492	S	S	*	.			trans	-73.7	103.5	163.1	-73.3	-76.4	0	0	0	108.6	I73	F71-I73 HydrophobicContact CB-CG1 4.18Å; F71-I73 WeakPolarHBondContact O-CG1 3.49Å; F71-I73 PolarHBondContact O-N 3.47Å
72	H	52.9	Low	58	Low	168 Å²	168	98.9 Å²	98.9	78%	0.778	50%	0.496	S	S	*	.			trans	-64.9	87	162.4	-81.2	-71.2	0	0	0	108.2	G70 T74	G70-H72 PolarHBondContact O-N 2.7Å; G70-H72 VanDerWaalsContact O-N 3.11Å; H72-T74 PolarHBondContact O-N 3.31Å
73	I	52.9	Low	57.6	Low	36 Å²	36	96.1 Å²	96.1	19%	0.185	48%	0.481	C	S	.	.	G	3₁₀ helix	trans	-72.5	-2.1	-171.5	-27.3	-179.1	0	0	0	112.3	M67 F71 E75 I76 L77	M67-I73 HydrophobicContact CB-CD1 4.26Å; M67-I73 HydrophobicContact CE-CD1 3.29Å; M67-I73 HydrophobicContact CG-CD1 3.84Å; M67-I73 HydrophobicContact SD-CD1 4.43Å; F71-I73 HydrophobicContact CB-CG1 4.18Å; F71-I73 WeakPolarHBondContact O-CG1 3.49Å; F71-I73 PolarHBondContact O-N 3.47Å; I73-E75 PolarHBondContact O-N 3.45Å; I73-I76 PolarHBondContact O-N 2.95Å; I73-L77 HydrophobicContact CB-CD1 3.52Å; I73-L77 HydrophobicContact CB-CG 4.02Å; I73-L77 HydrophobicContact CG2-CD1 3.4Å; I73-L77 VanDerWaalsContact CG2-CD1 3.4Å; I73-L77 HydrophobicContact CG2-CD2 3.73Å; I73-L77 HydrophobicContact CG2-CG 3.32Å; I73-L77 WeakPolarHBondContact O-CD1 3.48Å; I73-L77 VanDerWaalsContact O-CG 3.26Å; I73-L77 WeakPolarHBondContact O-CG 3.45Å; I73-L77 PolarHBondContact O-N 3.11Å
74	T	55.1	Low	57.4	Low	93 Å²	93	96.8 Å²	96.8	57%	0.571	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-59	-19.8	-172.9	47.8	0	0	0	0	114.5	H72	H72-T74 PolarHBondContact O-N 3.31Å
75	E	52.6	Low	57.4	Low	180 Å²	180	99.1 Å²	99.1	84%	0.841	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-110.9	-15.9	-179.6	-57.5	-151.8	167.4	0	0	115.1	I73	I73-E75 PolarHBondContact O-N 3.45Å
76	I	51.7	Low	57.5	Low	92 Å²	92	94.8 Å²	94.8	47%	0.472	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-12.4	-175.7	-62.7	172.5	0	0	0	112.2	I73 F78 S79 F82	I73-I76 PolarHBondContact O-N 2.95Å; I76-F78 PolarHBondContact O-N 3Å; I76-S79 PolarHBondContact O-OG 3.08Å; I76-F82 HydrophobicContact CG2-CD2 3.71Å; I76-F82 HydrophobicContact CG2-CE2 3.57Å; I76-F82 HydrophobicContact CG2-CG 4.28Å; I76-F82 HydrophobicContact CG2-CZ 4.04Å
77	L	52.5	Low	57.6	Low	11 Å²	11	89.5 Å²	89.5	6%	0.058	46%	0.459	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-5.3	-171.4	-74.9	165	0	0	0	116.9	I73 S79 F82 I143	I73-L77 HydrophobicContact CB-CD1 3.52Å; I73-L77 HydrophobicContact CB-CG 4.02Å; I73-L77 HydrophobicContact CG2-CD1 3.4Å; I73-L77 VanDerWaalsContact CG2-CD1 3.4Å; I73-L77 HydrophobicContact CG2-CD2 3.73Å; I73-L77 HydrophobicContact CG2-CG 3.32Å; I73-L77 WeakPolarHBondContact O-CD1 3.48Å; I73-L77 VanDerWaalsContact O-CG 3.26Å; I73-L77 WeakPolarHBondContact O-CG 3.45Å; I73-L77 PolarHBondContact O-N 3.11Å; L77-S79 PolarHBondContact O-N 3.31Å; L77-F82 HydrophobicContact CD2-CB 4.29Å; L77-I143 HydrophobicContact CB-CG2 4.35Å; L77-I143 HydrophobicContact CD1-CB 3.97Å; L77-I143 HydrophobicContact CD1-CG1 4.4Å; L77-I143 HydrophobicContact CD1-CG2 3.26Å; L77-I143 WeakPolarHBondContact CD1-O 3.45Å; L77-I143 HydrophobicContact CD2-CG2 4.04Å; L77-I143 HydrophobicContact CG-CG2 4.06Å
78	F	51.3	Low	58	Low	194 Å²	194	91.2 Å²	91.2	85%	0.851	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-9.8	173.5	-102.4	-83.9	0	0	0	113.4	I76	I76-F78 PolarHBondContact O-N 3Å
79	S	54.7	Low	58.4	Low	49 Å²	49	90.3 Å²	90.3	34%	0.343	46%	0.462	S	S	.	.	S	Bend	trans	-80.1	128.1	173	69.7	0	0	0	0	110.2	I76 L77 F81 F82	I76-S79 PolarHBondContact O-OG 3.08Å; L77-S79 PolarHBondContact O-N 3.31Å; S79-F81 PolarHBondContact O-N 3Å; S79-F82 PolarHBondContact O-N 2.82Å; S79-F82 WeakPolarHBondContact OG-CD2 3.2Å
80	W	55.3	Low	59	Low	184 Å²	184	85 Å²	85	70%	0.697	43%	0.426	S	S	*	.	H	α-helix	trans	-54.8	-21.9	179.9	-73.1	44.7	0	0	0	112.8	R158	W80-R158 VanDerWaalsContact CD2-NH2 3.27Å
81	F	58.1	Low	59.8	Low	177 Å²	177	82.4 Å²	82.4	78%	0.776	40%	0.4	S	S	*	.	H	α-helix	trans	-70.2	-35.4	-178.8	-83.7	-85.9	0	0	0	114.1	S79 P85	S79-F81 PolarHBondContact O-N 3Å; F81-P85 VanDerWaalsContact O-CD 3.27Å; F81-P85 WeakPolarHBondContact O-CD 3.48Å
82	F	60.2	Low	60.9	Low	112 Å²	112	75.2 Å²	75.2	49%	0.491	37%	0.368	S	S	.	.	H	α-helix	trans	-84.5	-19.1	-177.8	-84	-84.4	0	0	0	114.1	I76 L77 S79 A84 P85	I76-F82 HydrophobicContact CG2-CD2 3.71Å; I76-F82 HydrophobicContact CG2-CE2 3.57Å; I76-F82 HydrophobicContact CG2-CG 4.28Å; I76-F82 HydrophobicContact CG2-CZ 4.04Å; L77-F82 HydrophobicContact CD2-CB 4.29Å; S79-F82 PolarHBondContact O-N 2.82Å; S79-F82 WeakPolarHBondContact OG-CD2 3.2Å; F82-A84 VanDerWaalsContact C-N 3.35Å; F82-P85 WeakPolarHBondContact O-CD 3.12Å; F82-P85 WeakPolarHBondContact O-CG 3.46Å
83	L	62.5	Low	61.5	Low	39 Å²	39	67.8 Å²	67.8	20%	0.204	33%	0.334	C	S	.	.	H	α-helix	trans	-77.7	-21.6	173.5	-70.2	168.4	0	0	0	112.8	S87 I143	L83-S87 WeakPolarHBondContact O-CB 3.15Å; L83-S87 PolarHBondContact O-N 3.39Å; L83-S87 VanDerWaalsContact O-N 3.07Å; L83-S87 PolarHBondContact O-OG 3.36Å; L83-I143 HydrophobicContact CD2-CD1 4.32Å
84	A	64.7	Low	62.3	Low	53 Å²	53	66.4 Å²	66.4	44%	0.438	33%	0.328	S	S	.	.	H	α-helix	trans	-61.4	-51	179	0	0	0	0	0	113.7	F82 I86 S87 F88	F82-A84 VanDerWaalsContact C-N 3.35Å; A84-I86 PolarHBondContact O-N 3.28Å; A84-S87 PolarHBondContact O-OG 3.11Å; A84-F88 WeakPolarHBondContact O-CB 3.42Å; A84-F88 PolarHBondContact O-N 2.91Å; A84-F88 VanDerWaalsContact O-N 3.08Å
85	P	68.8	Low	62.8	Low	63 Å²	63	62.2 Å²	62.2	41%	0.409	30%	0.303	S	S	.	.	H	α-helix	trans	-65	-42.7	179.3	23.8	-33.9	0	0	0	112	F81 F82 S87 F88 I89	F81-P85 VanDerWaalsContact O-CD 3.27Å; F81-P85 WeakPolarHBondContact O-CD 3.48Å; F82-P85 WeakPolarHBondContact O-CD 3.12Å; F82-P85 WeakPolarHBondContact O-CG 3.46Å; P85-S87 VanDerWaalsContact C-N 3.34Å; P85-S87 PolarHBondContact O-N 3.02Å; P85-F88 WeakPolarHBondContact O-CB 3.13Å; P85-F88 PolarHBondContact O-N 3.07Å; P85-F88 VanDerWaalsContact O-N 3.11Å; P85-I89 HydrophobicContact CB-CD1 4.48Å; P85-I89 WeakPolarHBondContact O-CD1 3.38Å; P85-I89 PolarHBondContact O-N 3.02Å
86	I	68.4	Low	63.6	Low	23 Å²	23	54 Å²	54	12%	0.118	26%	0.264	C	S	.	.	H	α-helix	trans	-64.7	-40.8	-177.4	-56.4	171.7	0	0	0	111.2	A84 F88 I89 A90 F139 I143	A84-I86 PolarHBondContact O-N 3.28Å; I86-F88 VanDerWaalsContact C-N 3.32Å; I86-F88 PolarHBondContact O-N 3.28Å; I86-I89 PolarHBondContact O-N 3.21Å; I86-A90 WeakPolarHBondContact O-CB 3.43Å; I86-A90 PolarHBondContact O-N 2.9Å; I86-F139 HydrophobicContact CG2-CB 4.17Å; I86-F139 HydrophobicContact CG2-CD1 3.47Å; I86-F139 VanDerWaalsContact CG2-CD1 3.47Å; I86-F139 HydrophobicContact CG2-CD2 4.22Å; I86-F139 HydrophobicContact CG2-CE1 3.8Å; I86-F139 HydrophobicContact CG2-CE2 4.47Å; I86-F139 HydrophobicContact CG2-CG 3.71Å; I86-F139 HydrophobicContact CG2-CZ 4.28Å; I86-I143 HydrophobicContact CD1-CD1 3.65Å; I86-I143 HydrophobicContact CD1-CG1 4.07Å; I86-I143 HydrophobicContact CG2-CD1 4.15Å
87	S	68.2	Low	64.2	Low	4 Å²	4	50.1 Å²	50.1	3%	0.028	25%	0.245	C	C	.	.	H	α-helix	trans	-67.8	-31.6	175.1	56.8	0	0	0	0	113	L83 A84 P85 L91 L162	L83-S87 WeakPolarHBondContact O-CB 3.15Å; L83-S87 PolarHBondContact O-N 3.39Å; L83-S87 VanDerWaalsContact O-N 3.07Å; L83-S87 PolarHBondContact O-OG 3.36Å; A84-S87 PolarHBondContact O-OG 3.11Å; P85-S87 VanDerWaalsContact C-N 3.34Å; P85-S87 PolarHBondContact O-N 3.02Å; S87-L91 WeakPolarHBondContact O-CD1 3.43Å; S87-L91 WeakPolarHBondContact O-CG 3.48Å; S87-L91 PolarHBondContact O-N 3.45Å; S87-L162 WeakPolarHBondContact OG-CD1 3.45Å
88	F	71.1	Confident	64.5	Low	66 Å²	66	49.7 Å²	49.7	29%	0.289	24%	0.242	S	C	.	.	H	α-helix	trans	-69.7	-40.5	175.2	-168.8	-103.2	0	0	0	112.7	A84 P85 I86 L91 A92 P98 F99 L166	A84-F88 WeakPolarHBondContact O-CB 3.42Å; A84-F88 PolarHBondContact O-N 2.91Å; A84-F88 VanDerWaalsContact O-N 3.08Å; P85-F88 WeakPolarHBondContact O-CB 3.13Å; P85-F88 PolarHBondContact O-N 3.07Å; P85-F88 VanDerWaalsContact O-N 3.11Å; I86-F88 VanDerWaalsContact C-N 3.32Å; I86-F88 PolarHBondContact O-N 3.28Å; F88-L91 WeakPolarHBondContact O-CB 3.49Å; F88-L91 PolarHBondContact O-N 3.22Å; F88-A92 PolarHBondContact O-N 3.33Å; F88-P98 HydrophobicContact CE2-CG 4.44Å; F88-F99 HydrophobicContact CD1-CE2 4.37Å; F88-F99 HydrophobicContact CD1-CZ 4.32Å; F88-F99 HydrophobicContact CD2-CE2 4.37Å; F88-F99 AromaticContact CE1-CE2 3.93Å; F88-F99 HydrophobicContact CE1-CE2 3.93Å; F88-F99 AromaticContact CE1-CZ 3.49Å; F88-F99 HydrophobicContact CE1-CZ 3.49Å; F88-F99 VanDerWaalsContact CE1-CZ 3.49Å; F88-F99 AromaticContact CE2-CE2 3.92Å; F88-F99 HydrophobicContact CE2-CE2 3.92Å; F88-F99 AromaticContact CE2-CZ 3.95Å; F88-F99 HydrophobicContact CE2-CZ 3.95Å; F88-F99 HydrophobicContact CZ-CE1 4.33Å; F88-F99 AromaticContact CZ-CE2 3.69Å; F88-F99 HydrophobicContact CZ-CE2 3.69Å; F88-F99 AromaticContact CZ-CZ 3.27Å; F88-F99 HydrophobicContact CZ-CZ 3.27Å; F88-L166 HydrophobicContact CD2-CD1 4.29Å; F88-L166 HydrophobicContact CE2-CD1 3.96Å
89	I	71.1	Confident	65.2	Low	30 Å²	30	40.4 Å²	40.4	15%	0.154	20%	0.202	C	C	.	.	H	α-helix	trans	-68.2	-40.1	174	-70.3	131.1	0	0	0	110.8	L60 I63 P85 I86 L91 A92 E93	L60-I89 HydrophobicContact CD1-CG2 4.28Å; I63-I89 HydrophobicContact CD1-CB 4.29Å; I63-I89 HydrophobicContact CD1-CD1 3.26Å; I63-I89 HydrophobicContact CD1-CG1 3.8Å; I63-I89 HydrophobicContact CD1-CG2 3.94Å; I63-I89 HydrophobicContact CG1-CD1 4.48Å; P85-I89 HydrophobicContact CB-CD1 4.48Å; P85-I89 WeakPolarHBondContact O-CD1 3.38Å; P85-I89 PolarHBondContact O-N 3.02Å; I86-I89 PolarHBondContact O-N 3.21Å; I89-L91 VanDerWaalsContact C-N 3.26Å; I89-L91 PolarHBondContact O-N 3.16Å; I89-A92 WeakPolarHBondContact O-CB 3.43Å; I89-A92 PolarHBondContact O-N 3.12Å; I89-A92 VanDerWaalsContact O-N 3.11Å; I89-E93 PolarHBondContact O-N 2.9Å
90	A	67.9	Low	65.9	Low	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59.3	-37.7	173.2	0	0	0	0	0	112.6	I86 C94 L135 F139 I159	I86-A90 WeakPolarHBondContact O-CB 3.43Å; I86-A90 PolarHBondContact O-N 2.9Å; A90-C94 WeakPolarHBondContact O-CB 3.44Å; A90-C94 PolarHBondContact O-N 2.84Å; A90-C94 VanDerWaalsContact O-N 3.11Å; A90-C94 PolarHBondContact O-SG 2.94Å; A90-L135 HydrophobicContact CB-CD2 3.93Å; A90-L135 HydrophobicContact CB-CG 4.37Å; A90-F139 HydrophobicContact CB-CD2 3.93Å; A90-F139 HydrophobicContact CB-CE2 3.52Å; A90-I159 HydrophobicContact CB-CD1 4.23Å
91	L	68.8	Low	66.1	Low	3 Å²	3	30.4 Å²	30.4	2%	0.016	16%	0.158	C	C	.	.	H	α-helix	trans	-66.2	-40.4	173.7	-82.1	159.9	0	0	0	112.6	S87 F88 I89 C94 G95 F99 I159 L162	S87-L91 WeakPolarHBondContact O-CD1 3.43Å; S87-L91 WeakPolarHBondContact O-CG 3.48Å; S87-L91 PolarHBondContact O-N 3.45Å; F88-L91 WeakPolarHBondContact O-CB 3.49Å; F88-L91 PolarHBondContact O-N 3.22Å; I89-L91 VanDerWaalsContact C-N 3.26Å; I89-L91 PolarHBondContact O-N 3.16Å; L91-C94 PolarHBondContact O-N 3.46Å; L91-G95 PolarHBondContact O-N 3.34Å; L91-F99 HydrophobicContact CB-CD2 4.49Å; L91-I159 HydrophobicContact CD2-CB 4.28Å; L91-I159 HydrophobicContact CD2-CG2 3.52Å; L91-I159 HydrophobicContact CG-CB 4.42Å; L91-I159 HydrophobicContact CG-CG1 4.22Å; L91-I159 HydrophobicContact CG-CG2 4.09Å; L91-L162 HydrophobicContact CD1-CB 3.5Å; L91-L162 HydrophobicContact CD1-CD1 3.49Å; L91-L162 VanDerWaalsContact CD1-CD1 3.49Å; L91-L162 HydrophobicContact CD1-CG 4.14Å
92	A	69.8	Low	66	Low	2 Å²	2	23.3 Å²	23.3	2%	0.017	13%	0.128	C	C	.	.	H	α-helix	trans	-65.2	-45.9	179.8	0	0	0	0	0	112	Y56 F88 I89 C94 G95 F99	Y56-A92 HydrophobicContact CD1-CB 3.51Å; Y56-A92 HydrophobicContact CD2-CB 3.92Å; Y56-A92 HydrophobicContact CE1-CB 3.43Å; Y56-A92 VanDerWaalsContact CE1-CB 3.43Å; Y56-A92 HydrophobicContact CE2-CB 3.83Å; Y56-A92 HydrophobicContact CG-CB 3.78Å; F88-A92 PolarHBondContact O-N 3.33Å; I89-A92 WeakPolarHBondContact O-CB 3.43Å; I89-A92 PolarHBondContact O-N 3.12Å; I89-A92 VanDerWaalsContact O-N 3.11Å; A92-C94 VanDerWaalsContact C-N 3.32Å; A92-C94 PolarHBondContact O-N 3.49Å; A92-G95 PolarHBondContact O-N 3.2Å; A92-G95 VanDerWaalsContact O-N 3.16Å; A92-F99 VanDerWaalsContact CA-CD2 3.42Å; A92-F99 HydrophobicContact CB-CD2 3.77Å; A92-F99 HydrophobicContact CB-CE2 3.6Å; A92-F99 HydrophobicContact CB-CG 4.44Å; A92-F99 HydrophobicContact CB-CZ 4.15Å
93	E	66.8	Low	66.1	Low	12 Å²	12	21.5 Å²	21.5	6%	0.056	12%	0.121	C	C	.	.	H	α-helix	trans	-60.6	-38.9	172.8	-82.3	-67	162.3	0	0	112.2	Y27 Y56 E57 L60 I89 G95 L135	Y27-E93 WeakPolarHBondContact CE1-O 3.34Å; Y27-E93 WeakPolarHBondContact CE2-O 3.4Å; Y27-E93 PolarHBondContact OH-O 3.02Å; Y56-E93 WeakPolarHBondContact CB-OE1 3.35Å; E57-E93 WeakPolarHBondContact CA-OE1 3.12Å; E57-E93 PolarHBondContact N-OE1 3.32Å; E57-E93 VanDerWaalsContact N-OE1 3.08Å; L60-E93 HydrophobicContact CD2-CG 4.29Å; I89-E93 PolarHBondContact O-N 2.9Å; E93-G95 PolarHBondContact O-N 3.47Å; E93-L135 HydrophobicContact CB-CD2 3.82Å
94	C	68.4	Low	65.7	Low	8 Å²	8	21.4 Å²	21.4	5%	0.054	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-7.2	-179.9	-66.2	0	0	0	0	113.3	A90 L91 A92 R96 I132	A90-C94 WeakPolarHBondContact O-CB 3.44Å; A90-C94 PolarHBondContact O-N 2.84Å; A90-C94 VanDerWaalsContact O-N 3.11Å; A90-C94 PolarHBondContact O-SG 2.94Å; L91-C94 PolarHBondContact O-N 3.46Å; A92-C94 VanDerWaalsContact C-N 3.32Å; A92-C94 PolarHBondContact O-N 3.49Å; C94-R96 HydrophobicContact CB-CG 4.41Å; C94-R96 PolarHBondContact O-N 2.92Å; C94-I132 HydrophobicContact CB-CD1 4.49Å; C94-I132 HydrophobicContact CB-CG1 3.77Å; C94-I132 VanDerWaalsContact SG-CG1 3.52Å
95	G	65.5	Low	65.2	Low	5 Å²	5	20.6 Å²	20.6	5%	0.052	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	32.1	179.9	0	0	0	0	0	113.3	L91 A92 E93 F99	L91-G95 PolarHBondContact O-N 3.34Å; A92-G95 PolarHBondContact O-N 3.2Å; A92-G95 VanDerWaalsContact O-N 3.16Å; E93-G95 PolarHBondContact O-N 3.47Å; G95-F99 CarbonylContact C-O 3.22Å
96	R	70.6	Confident	64	Low	8 Å²	8	29.2 Å²	29.2	3%	0.03	14%	0.137	C	C	.	.			trans	-109.8	160.1	-178.7	-68.6	-57.4	-168.4	148.5	3.4	111.8	C94 P98 F99 E103 E128 I132	C94-R96 HydrophobicContact CB-CG 4.41Å; C94-R96 PolarHBondContact O-N 2.92Å; R96-P98 VanDerWaalsContact O-N 3.15Å; R96-F99 CarbonylContact O-C 3.58Å; R96-F99 WeakPolarHBondContact O-CA 3.5Å; R96-F99 PolarHBondContact O-N 3.02Å; R96-E103 IonicContact NH1-OE2 2.66Å; R96-E128 IonicContact CZ-OE2 2.61Å; R96-E128 IonicContact NE-OE2 3.65Å; R96-E128 PolarHBondContact NE-OE2 3.41Å; R96-E128 IonicContact NH1-OE2 3.45Å; R96-E128 IonicContact NH2-OE2 3.34Å; R96-E128 PolarHBondContact NH2-OE2 2.99Å; R96-I132 HydrophobicContact CG-CD1 4.21Å
97	T	63.5	Low	62.9	Low	9 Å²	9	35.5 Å²	35.5	6%	0.055	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.6	120.7	-179.6	44.7	0	0	0	0	109.7	D100 R163 R168	T97-D100 HydrophobicContact CG2-CB 3.72Å; T97-R163 WeakPolarHBondContact OG1-CD 3.43Å; T97-R163 WeakPolarHBondContact OG1-CG 3.28Å; T97-R163 PolarHBondContact OG1-NE 3.28Å; T97-R168 HydrophobicContact CG2-CG 4.05Å; T97-R168 VanDerWaalsContact CG2-NE 3.33Å
98	P	58.2	Low	62.1	Low	2 Å²	2	36.7 Å²	36.7	1%	0.013	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	cis	-83.2	-7.3	22.6	33.2	-37.9	0	0	0	117.5	F88 R96 L166 P167 L169	F88-P98 HydrophobicContact CE2-CG 4.44Å; R96-P98 VanDerWaalsContact O-N 3.15Å; P98-L166 HydrophobicContact CB-CB 4.12Å; P98-L166 HydrophobicContact CG-CB 4.28Å; P98-L166 HydrophobicContact CG-CD1 4.05Å; P98-P167 WeakPolarHBondContact CB-O 3.44Å; P98-L169 HydrophobicContact CB-CG 4.48Å; P98-L169 PolarHBondContact O-N 2.99Å; P98-L169 VanDerWaalsContact O-N 3.11Å
99	F	65.8	Low	60.8	Low	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.187	C	C	.	.	S	Bend	trans	-102.6	29.7	-174.7	-59.2	-67	0	0	0	114.5	Q52 Y56 F88 L91 A92 G95 R96 L101 L169 L174	Q52-F99 PolarHBondContact NE2-O 3.41Å; Y56-F99 WeakPolarHBondContact OH-CE1 3.09Å; F88-F99 HydrophobicContact CD1-CE2 4.37Å; F88-F99 HydrophobicContact CD1-CZ 4.32Å; F88-F99 HydrophobicContact CD2-CE2 4.37Å; F88-F99 AromaticContact CE1-CE2 3.93Å; F88-F99 HydrophobicContact CE1-CE2 3.93Å; F88-F99 AromaticContact CE1-CZ 3.49Å; F88-F99 HydrophobicContact CE1-CZ 3.49Å; F88-F99 VanDerWaalsContact CE1-CZ 3.49Å; F88-F99 AromaticContact CE2-CE2 3.92Å; F88-F99 HydrophobicContact CE2-CE2 3.92Å; F88-F99 AromaticContact CE2-CZ 3.95Å; F88-F99 HydrophobicContact CE2-CZ 3.95Å; F88-F99 HydrophobicContact CZ-CE1 4.33Å; F88-F99 AromaticContact CZ-CE2 3.69Å; F88-F99 HydrophobicContact CZ-CE2 3.69Å; F88-F99 AromaticContact CZ-CZ 3.27Å; F88-F99 HydrophobicContact CZ-CZ 3.27Å; L91-F99 HydrophobicContact CB-CD2 4.49Å; A92-F99 VanDerWaalsContact CA-CD2 3.42Å; A92-F99 HydrophobicContact CB-CD2 3.77Å; A92-F99 HydrophobicContact CB-CE2 3.6Å; A92-F99 HydrophobicContact CB-CG 4.44Å; A92-F99 HydrophobicContact CB-CZ 4.15Å; G95-F99 CarbonylContact C-O 3.22Å; R96-F99 CarbonylContact O-C 3.58Å; R96-F99 WeakPolarHBondContact O-CA 3.5Å; R96-F99 PolarHBondContact O-N 3.02Å; F99-L101 PolarHBondContact O-N 3.28Å; F99-L169 HydrophobicContact CE1-CD1 4Å; F99-L174 HydrophobicContact CB-CD1 4.46Å; F99-L174 HydrophobicContact CD1-CD1 3.52Å; F99-L174 HydrophobicContact CD1-CG 3.86Å; F99-L174 HydrophobicContact CE1-CD1 4.2Å; F99-L174 HydrophobicContact CE1-CG 4.03Å; F99-L174 HydrophobicContact CG-CD1 4.46Å
100	D	69.3	Low	59.6	Low	9 Å²	9	46.4 Å²	46.4	5%	0.048	22%	0.216	C	C	.	.			trans	-101.2	80.8	-177.7	-179.6	12.8	0	0	0	110.6	T97 L102 E103 A104	T97-D100 HydrophobicContact CG2-CB 3.72Å; D100-L102 VanDerWaalsContact C-N 3.31Å; D100-E103 VanDerWaalsContact OD1-CB 3.28Å; D100-E103 WeakPolarHBondContact OD1-CB 3.14Å; D100-E103 PolarHBondContact OD1-N 3.39Å; D100-A104 VanDerWaalsContact O-CB 3.25Å; D100-A104 WeakPolarHBondContact O-CB 3.26Å
101	L	61.3	Low	59	Low	14 Å²	14	47 Å²	47	7%	0.073	22%	0.223	C	C	.	.	H	α-helix	trans	-82.1	-15.3	-179.3	-65.6	169.2	0	0	0	112.9	F99 L169 Y171 L174	F99-L101 PolarHBondContact O-N 3.28Å; L101-L169 WeakPolarHBondContact CD2-O 3.31Å; L101-Y171 HydrophobicContact CD1-CD2 3.34Å; L101-Y171 HydrophobicContact CD1-CE2 4.31Å; L101-Y171 HydrophobicContact CD1-CG 3.96Å; L101-L174 HydrophobicContact CD1-CD1 3.84Å
102	L	55.3	Low	58.5	Low	28 Å²	28	47.7 Å²	47.7	15%	0.147	23%	0.225	C	C	.	.	H	α-helix	trans	-85.8	-38.9	-171.2	-82.4	147	0	0	0	113.6	R34 T49 D100 Y112	R34-L102 VanDerWaalsContact NH1-CG 3.31Å; T49-L102 HydrophobicContact CG2-CD1 2.98Å; T49-L102 HydrophobicContact CG2-CD2 2.99Å; T49-L102 HydrophobicContact CG2-CG 3.24Å; D100-L102 VanDerWaalsContact C-N 3.31Å; L102-Y112 HydrophobicContact CB-CE1 3.89Å; L102-Y112 HydrophobicContact CD2-CD1 4.39Å; L102-Y112 HydrophobicContact CD2-CE1 4.35Å; L102-Y112 WeakPolarHBondContact O-CE1 3.24Å
103	E	61.4	Low	58.3	Low	73 Å²	73	50 Å²	50	34%	0.341	24%	0.237	S	C	.	.	H	α-helix	trans	-88.8	-19.4	-178.4	-156.9	150.1	-143.2	0	0	111.2	R96 D100 F125	R96-E103 IonicContact NH1-OE2 2.66Å; D100-E103 VanDerWaalsContact OD1-CB 3.28Å; D100-E103 WeakPolarHBondContact OD1-CB 3.14Å; D100-E103 PolarHBondContact OD1-N 3.39Å; E103-F125 WeakPolarHBondContact OE1-CZ 3.49Å
104	A	55.2	Low	58.2	Low	37 Å²	37	53.9 Å²	53.9	31%	0.306	26%	0.261	S	S	.	.	H	α-helix	trans	-100.2	-18.1	-166.4	0	0	0	0	0	115.7	D100 R106	D100-A104 VanDerWaalsContact O-CB 3.25Å; D100-A104 WeakPolarHBondContact O-CB 3.26Å; A104-R106 PolarHBondContact O-N 3.25Å
105	E	54.1	Low	58.2	Low	37 Å²	37	56.3 Å²	56.3	17%	0.173	27%	0.272	C	S	.	.			trans	-81.2	87.3	178.3	-72.4	179.2	-167.9	0	0	109.8	R48 E107 L108	R48-E105 IonicContact CZ-OE1 3.21Å; R48-E105 IonicContact CZ-OE2 3Å; R48-E105 IonicContact NE-OE1 3.03Å; R48-E105 IonicContact NE-OE2 3.7Å; R48-E105 IonicContact NH2-OE1 2.71Å; R48-E105 PolarHBondContact NH2-OE1 2.71Å; R48-E105 IonicContact NH2-OE2 3.56Å; R48-E105 PolarHBondContact NH2-OE2 3.49Å; E105-E107 HydrophobicContact CB-CG 4.07Å; E105-E107 PolarHBondContact O-N 2.8Å; E105-L108 PolarHBondContact O-N 3.15Å
106	R	43.6	Very low	58.6	Low	243 Å²	243	57.4 Å²	57.4	92%	0.917	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-19.1	175	-68.1	-177	175.2	-177.9	-1.2	113.4	A104	A104-R106 PolarHBondContact O-N 3.25Å
107	E	45.4	Very low	59.1	Low	155 Å²	155	59.7 Å²	59.7	72%	0.724	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-22	178.9	50.3	-157.2	148.5	0	0	114.1	E105 V109	E105-E107 HydrophobicContact CB-CG 4.07Å; E105-E107 PolarHBondContact O-N 2.8Å; E107-V109 PolarHBondContact O-N 2.66Å
108	L	51.1	Low	60	Low	29 Å²	29	64.1 Å²	64.1	15%	0.152	32%	0.323	C	S	.	.	S	Bend	trans	-95.9	69.6	166.1	-56.3	175.8	0	0	0	108.3	F41 E105 R110 G111	F41-L108 HydrophobicContact CB-CD2 3.62Å; F41-L108 HydrophobicContact CD1-CD2 3.61Å; F41-L108 HydrophobicContact CG-CD2 4.05Å; E105-L108 PolarHBondContact O-N 3.15Å; L108-R110 CarbonylContact O-C 3.5Å; L108-R110 PolarHBondContact O-N 3.06Å; L108-G111 VanDerWaalsContact O-CA 3.31Å; L108-G111 WeakPolarHBondContact O-CA 3.38Å; L108-G111 PolarHBondContact O-N 3.45Å
109	V	43.1	Very low	61.3	Low	99 Å²	99	68.1 Å²	68.1	60%	0.6	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-1	80	171.4	-172.4	0	0	0	0	114.1	E107 G111 V114	E107-V109 PolarHBondContact O-N 2.66Å; V109-G111 PolarHBondContact O-N 2.99Å; V109-V114 WeakPolarHBondContact O-CG2 3.29Å
110	R	46.6	Very low	62.1	Low	201 Å²	201	71.6 Å²	71.6	76%	0.758	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	44	40.6	-179.4	-73.2	-177.1	178.8	-169.5	0.4	113.8	L108 Y112 N113 V114	L108-R110 CarbonylContact O-C 3.5Å; L108-R110 PolarHBondContact O-N 3.06Å; R110-Y112 PolarHBondContact O-N 3.46Å; R110-Y112 VanDerWaalsContact O-N 3.11Å; R110-N113 HydrophobicContact CB-CB 4.35Å; R110-N113 CarbonylContact O-C 3.57Å; R110-N113 WeakPolarHBondContact O-CA 3.39Å; R110-N113 WeakPolarHBondContact O-CB 3.25Å; R110-N113 PolarHBondContact O-N 3.28Å; R110-V114 HydrophobicContact CB-CG2 3.38Å; R110-V114 WeakPolarHBondContact O-CG2 3.48Å; R110-V114 PolarHBondContact O-N 3.45Å
111	G	55.6	Low	62.5	Low	14 Å²	14	74.7 Å²	74.7	14%	0.144	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-27.3	-71	-156.5	0	0	0	0	0	117	A42 L108 V109	A42-G111 WeakPolarHBondContact CB-O 3.47Å; L108-G111 VanDerWaalsContact O-CA 3.31Å; L108-G111 WeakPolarHBondContact O-CA 3.38Å; L108-G111 PolarHBondContact O-N 3.45Å; V109-G111 PolarHBondContact O-N 2.99Å
112	Y	57.8	Low	63.7	Low	17 Å²	17	76.1 Å²	76.1	7%	0.067	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-25.2	179.4	61.7	-86.6	0	0	0	113	L102 R110 V114 E115 Y116 L124	L102-Y112 HydrophobicContact CB-CE1 3.89Å; L102-Y112 HydrophobicContact CD2-CD1 4.39Å; L102-Y112 HydrophobicContact CD2-CE1 4.35Å; L102-Y112 WeakPolarHBondContact O-CE1 3.24Å; R110-Y112 PolarHBondContact O-N 3.46Å; R110-Y112 VanDerWaalsContact O-N 3.11Å; Y112-V114 VanDerWaalsContact C-N 3.26Å; Y112-V114 PolarHBondContact O-N 3.33Å; Y112-E115 PolarHBondContact O-N 2.95Å; Y112-Y116 AromaticContact CD2-CD2 3.77Å; Y112-Y116 HydrophobicContact CD2-CD2 3.77Å; Y112-Y116 AromaticContact CD2-CE2 3.68Å; Y112-Y116 HydrophobicContact CD2-CE2 3.68Å; Y112-Y116 HydrophobicContact CG-CD2 4.37Å; Y112-Y116 HydrophobicContact CG-CE2 4.13Å; Y112-Y116 WeakPolarHBondContact O-CD2 3.28Å; Y112-Y116 PolarHBondContact O-N 3.46Å; Y112-L124 HydrophobicContact CD2-CD1 4.36Å; Y112-L124 HydrophobicContact CE2-CD1 4.4Å; Y112-L124 HydrophobicContact CE2-CD2 4.31Å
113	N	66.4	Low	65.1	Low	50 Å²	50	81.2 Å²	81.2	27%	0.267	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-22.8	179.4	-70	-9.7	0	0	0	113.8	R110 E115 F121	R110-N113 HydrophobicContact CB-CB 4.35Å; R110-N113 CarbonylContact O-C 3.57Å; R110-N113 WeakPolarHBondContact O-CA 3.39Å; R110-N113 WeakPolarHBondContact O-CB 3.25Å; R110-N113 PolarHBondContact O-N 3.28Å; N113-E115 VanDerWaalsContact C-N 3.34Å; N113-F121 HydrophobicContact CB-CE2 4.43Å; N113-F121 VanDerWaalsContact OD1-CE2 3.22Å; N113-F121 WeakPolarHBondContact OD1-CE2 3.44Å
114	V	64.2	Low	65.9	Low	93 Å²	93	78.4 Å²	78.4	56%	0.564	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-29.8	175.3	-177.3	0	0	0	0	111.9	V109 R110 Y112	V109-V114 WeakPolarHBondContact O-CG2 3.29Å; R110-V114 HydrophobicContact CB-CG2 3.38Å; R110-V114 WeakPolarHBondContact O-CG2 3.48Å; R110-V114 PolarHBondContact O-N 3.45Å; Y112-V114 VanDerWaalsContact C-N 3.26Å; Y112-V114 PolarHBondContact O-N 3.33Å
115	E	68.8	Low	67.1	Low	59 Å²	59	78.2 Å²	78.2	28%	0.276	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103	-15.6	-169.9	-61	-165.6	165.2	0	0	114.2	S37 Y112 N113	S37-E115 VanDerWaalsContact CA-CD 3.48Å; S37-E115 WeakPolarHBondContact CA-OE1 3.41Å; S37-E115 WeakPolarHBondContact CA-OE2 3.47Å; S37-E115 WeakPolarHBondContact CB-OE1 3.25Å; S37-E115 WeakPolarHBondContact CB-OE2 3.31Å; Y112-E115 PolarHBondContact O-N 2.95Å; N113-E115 VanDerWaalsContact C-N 3.34Å
116	Y	73.8	Confident	68.6	Low	29 Å²	29	82 Å²	82	11%	0.114	41%	0.411	C	S	.	.			trans	-77.9	131.8	175.6	-80.7	-60.7	0	0	0	111.8	R33 R34 R35 Y112 E120 L124	R33-Y116 VanDerWaalsContact C-OH 3.31Å; R33-Y116 PolarHBondContact O-OH 2.9Å; R34-Y116 WeakPolarHBondContact CA-OH 3.2Å; R34-Y116 PolarHBondContact N-OH 3.24Å; R35-Y116 HydrophobicContact CB-CE1 3.92Å; R35-Y116 PolarHBondContact N-OH 3.12Å; Y112-Y116 AromaticContact CD2-CD2 3.77Å; Y112-Y116 HydrophobicContact CD2-CD2 3.77Å; Y112-Y116 AromaticContact CD2-CE2 3.68Å; Y112-Y116 HydrophobicContact CD2-CE2 3.68Å; Y112-Y116 HydrophobicContact CG-CD2 4.37Å; Y112-Y116 HydrophobicContact CG-CE2 4.13Å; Y112-Y116 WeakPolarHBondContact O-CD2 3.28Å; Y112-Y116 PolarHBondContact O-N 3.46Å; Y116-E120 HydrophobicContact CD1-CB 3.38Å; Y116-E120 HydrophobicContact CD1-CG 4.28Å; Y116-E120 HydrophobicContact CE1-CB 3.95Å; Y116-E120 HydrophobicContact CG-CB 4.29Å; Y116-L124 HydrophobicContact CE2-CD1 3.81Å
117	S	79.9	Confident	70.5	Confident	56 Å²	56	71.9 Å²	71.9	39%	0.392	38%	0.38	S	S	.	.			trans	-63.2	156.4	161.3	63	0	0	0	0	110.2	V119 E120 F121	S117-V119 PolarHBondContact O-N 3.44Å; S117-V119 VanDerWaalsContact O-N 3.11Å; S117-E120 PolarHBondContact N-OE2 2.8Å; S117-E120 VanDerWaalsContact N-OE2 3.12Å; S117-E120 PolarHBondContact O-N 2.94Å; S117-E120 VanDerWaalsContact O-N 3.17Å; S117-E120 VanDerWaalsContact OG-CD 3.27Å; S117-E120 VanDerWaalsContact OG-CG 3.28Å; S117-E120 WeakPolarHBondContact OG-CG 3.43Å; S117-E120 PolarHBondContact OG-OE2 2.93Å; S117-F121 WeakPolarHBondContact O-CB 3.25Å; S117-F121 PolarHBondContact O-N 3.14Å
118	S	83.3	Confident	72	Confident	102 Å²	102	65 Å²	65	71%	0.713	35%	0.348	S	S	*	.	H	α-helix	trans	-52.7	-35.7	-179.8	52.9	0	0	0	0	113.3	A122	S118-A122 WeakPolarHBondContact O-CB 3.4Å; S118-A122 PolarHBondContact O-N 2.71Å; S118-A122 VanDerWaalsContact O-N 3.09Å
119	V	86.4	Confident	73.5	Confident	86 Å²	86	68.5 Å²	68.5	52%	0.521	36%	0.36	S	S	.	.	H	α-helix	trans	-72.5	-48.1	-179.9	178.6	0	0	0	0	111.4	S117 F121 A122 F123	S117-V119 PolarHBondContact O-N 3.44Å; S117-V119 VanDerWaalsContact O-N 3.11Å; V119-F121 VanDerWaalsContact C-N 3.31Å; V119-F121 PolarHBondContact O-N 3.04Å; V119-A122 PolarHBondContact O-N 3.21Å; V119-F123 HydrophobicContact CG1-CD2 3.75Å; V119-F123 HydrophobicContact CG1-CE2 3.49Å; V119-F123 VanDerWaalsContact CG1-CE2 3.49Å; V119-F123 WeakPolarHBondContact O-CD2 3.29Å; V119-F123 PolarHBondContact O-N 2.66Å
120	E	81.3	Confident	75.5	Confident	72 Å²	72	65.5 Å²	65.5	34%	0.336	35%	0.349	S	S	.	.	H	α-helix	trans	-64	-39.1	178.7	-67.7	167.6	137.7	0	0	111.6	R35 Y116 S117 F123 L124	R35-E120 IonicContact NH1-OE1 3.51Å; Y116-E120 HydrophobicContact CD1-CB 3.38Å; Y116-E120 HydrophobicContact CD1-CG 4.28Å; Y116-E120 HydrophobicContact CE1-CB 3.95Å; Y116-E120 HydrophobicContact CG-CB 4.29Å; S117-E120 PolarHBondContact N-OE2 2.8Å; S117-E120 VanDerWaalsContact N-OE2 3.12Å; S117-E120 PolarHBondContact O-N 2.94Å; S117-E120 VanDerWaalsContact O-N 3.17Å; S117-E120 VanDerWaalsContact OG-CD 3.27Å; S117-E120 VanDerWaalsContact OG-CG 3.28Å; S117-E120 WeakPolarHBondContact OG-CG 3.43Å; S117-E120 PolarHBondContact OG-OE2 2.93Å; E120-F123 PolarHBondContact O-N 3.23Å; E120-L124 PolarHBondContact O-N 3.45Å
121	F	78.1	Confident	77.1	Confident	75 Å²	75	56.9 Å²	56.9	33%	0.329	32%	0.318	S	S	.	.	H	α-helix	trans	-58.7	-48.6	172.7	179.3	-91.9	0	0	0	110.9	N113 S117 V119 F123 L124 F125	N113-F121 HydrophobicContact CB-CE2 4.43Å; N113-F121 VanDerWaalsContact OD1-CE2 3.22Å; N113-F121 WeakPolarHBondContact OD1-CE2 3.44Å; S117-F121 WeakPolarHBondContact O-CB 3.25Å; S117-F121 PolarHBondContact O-N 3.14Å; V119-F121 VanDerWaalsContact C-N 3.31Å; V119-F121 PolarHBondContact O-N 3.04Å; F121-F123 PolarHBondContact O-N 3Å; F121-L124 WeakPolarHBondContact O-CB 3.39Å; F121-L124 PolarHBondContact O-N 3.11Å; F121-L124 VanDerWaalsContact O-N 3.15Å; F121-F125 AromaticContact CD1-CD2 3.89Å; F121-F125 HydrophobicContact CD1-CD2 3.89Å; F121-F125 AromaticContact CD1-CE2 3.68Å; F121-F125 HydrophobicContact CD1-CE2 3.68Å; F121-F125 HydrophobicContact CD2-CD2 4.49Å; F121-F125 AromaticContact CD2-CE2 3.63Å; F121-F125 HydrophobicContact CD2-CE2 3.63Å; F121-F125 HydrophobicContact CD2-CZ 4.46Å; F121-F125 AromaticContact CE1-CD2 3.68Å; F121-F125 HydrophobicContact CE1-CD2 3.68Å; F121-F125 AromaticContact CE1-CE2 3.27Å; F121-F125 HydrophobicContact CE1-CE2 3.27Å; F121-F125 HydrophobicContact CE1-CZ 4.15Å; F121-F125 HydrophobicContact CE2-CD2 4.32Å; F121-F125 AromaticContact CE2-CE2 3.22Å; F121-F125 HydrophobicContact CE2-CE2 3.22Å; F121-F125 AromaticContact CE2-CZ 3.72Å; F121-F125 HydrophobicContact CE2-CZ 3.72Å; F121-F125 HydrophobicContact CG-CD2 4.3Å; F121-F125 AromaticContact CG-CE2 3.85Å; F121-F125 HydrophobicContact CG-CE2 3.85Å; F121-F125 AromaticContact CZ-CD2 3.93Å; F121-F125 HydrophobicContact CZ-CD2 3.93Å; F121-F125 AromaticContact CZ-CE2 3.03Å; F121-F125 HydrophobicContact CZ-CE2 3.03Å; F121-F125 AromaticContact CZ-CZ 3.54Å; F121-F125 HydrophobicContact CZ-CZ 3.54Å; F121-F125 WeakPolarHBondContact O-CD2 3.32Å; F121-F125 PolarHBondContact O-N 3.33Å
122	A	86.7	Confident	78.3	Confident	44 Å²	44	57.2 Å²	57.2	36%	0.364	32%	0.316	S	S	.	.	H	α-helix	trans	-59.4	-44.4	178.5	0	0	0	0	0	112.5	S118 V119 L124 F125 I126	S118-A122 WeakPolarHBondContact O-CB 3.4Å; S118-A122 PolarHBondContact O-N 2.71Å; S118-A122 VanDerWaalsContact O-N 3.09Å; V119-A122 PolarHBondContact O-N 3.21Å; A122-L124 VanDerWaalsContact C-N 3.29Å; A122-L124 PolarHBondContact O-N 3.44Å; A122-F125 PolarHBondContact O-N 3.2Å; A122-I126 VanDerWaalsContact O-CG1 3.28Å; A122-I126 WeakPolarHBondContact O-CG1 3.34Å; A122-I126 PolarHBondContact O-N 3.49Å
123	F	85	Confident	79.6	Confident	134 Å²	134	61 Å²	61	59%	0.588	34%	0.336	S	S	*	.	H	α-helix	trans	-63.5	-33.7	176.9	-80.2	-64.4	0	0	0	113.1	V119 E120 F121 I126 A127	V119-F123 HydrophobicContact CG1-CD2 3.75Å; V119-F123 HydrophobicContact CG1-CE2 3.49Å; V119-F123 VanDerWaalsContact CG1-CE2 3.49Å; V119-F123 WeakPolarHBondContact O-CD2 3.29Å; V119-F123 PolarHBondContact O-N 2.66Å; E120-F123 PolarHBondContact O-N 3.23Å; F121-F123 PolarHBondContact O-N 3Å; F123-I126 PolarHBondContact O-N 2.76Å; F123-A127 VanDerWaalsContact O-CB 3.25Å; F123-A127 WeakPolarHBondContact O-CB 3.43Å; F123-A127 PolarHBondContact O-N 2.84Å
124	L	78.6	Confident	80.4	Confident	14 Å²	14	61.7 Å²	61.7	7%	0.073	34%	0.34	C	S	.	.	H	α-helix	trans	-63.3	-46.7	176.6	-172.7	149	0	0	0	111.3	R34 Y112 Y116 E120 F121 A122 A127 E128	R34-L124 HydrophobicContact CG-CD1 4.38Å; Y112-L124 HydrophobicContact CD2-CD1 4.36Å; Y112-L124 HydrophobicContact CE2-CD1 4.4Å; Y112-L124 HydrophobicContact CE2-CD2 4.31Å; Y116-L124 HydrophobicContact CE2-CD1 3.81Å; E120-L124 PolarHBondContact O-N 3.45Å; F121-L124 WeakPolarHBondContact O-CB 3.39Å; F121-L124 PolarHBondContact O-N 3.11Å; F121-L124 VanDerWaalsContact O-N 3.15Å; A122-L124 VanDerWaalsContact C-N 3.29Å; A122-L124 PolarHBondContact O-N 3.44Å; L124-A127 PolarHBondContact O-N 3.05Å; L124-E128 HydrophobicContact CD2-CG 4.42Å; L124-E128 WeakPolarHBondContact O-CG 3.47Å; L124-E128 PolarHBondContact O-N 3.4Å
125	F	79.5	Confident	81	Confident	34 Å²	34	58 Å²	58	15%	0.149	32%	0.317	C	S	.	.	H	α-helix	trans	-66.2	-42.7	176.2	-71.8	-77.9	0	0	0	112.3	E103 F121 A122 A127 E128 Y129	E103-F125 WeakPolarHBondContact OE1-CZ 3.49Å; F121-F125 AromaticContact CD1-CD2 3.89Å; F121-F125 HydrophobicContact CD1-CD2 3.89Å; F121-F125 AromaticContact CD1-CE2 3.68Å; F121-F125 HydrophobicContact CD1-CE2 3.68Å; F121-F125 HydrophobicContact CD2-CD2 4.49Å; F121-F125 AromaticContact CD2-CE2 3.63Å; F121-F125 HydrophobicContact CD2-CE2 3.63Å; F121-F125 HydrophobicContact CD2-CZ 4.46Å; F121-F125 AromaticContact CE1-CD2 3.68Å; F121-F125 HydrophobicContact CE1-CD2 3.68Å; F121-F125 AromaticContact CE1-CE2 3.27Å; F121-F125 HydrophobicContact CE1-CE2 3.27Å; F121-F125 HydrophobicContact CE1-CZ 4.15Å; F121-F125 HydrophobicContact CE2-CD2 4.32Å; F121-F125 AromaticContact CE2-CE2 3.22Å; F121-F125 HydrophobicContact CE2-CE2 3.22Å; F121-F125 AromaticContact CE2-CZ 3.72Å; F121-F125 HydrophobicContact CE2-CZ 3.72Å; F121-F125 HydrophobicContact CG-CD2 4.3Å; F121-F125 AromaticContact CG-CE2 3.85Å; F121-F125 HydrophobicContact CG-CE2 3.85Å; F121-F125 AromaticContact CZ-CD2 3.93Å; F121-F125 HydrophobicContact CZ-CD2 3.93Å; F121-F125 AromaticContact CZ-CE2 3.03Å; F121-F125 HydrophobicContact CZ-CE2 3.03Å; F121-F125 AromaticContact CZ-CZ 3.54Å; F121-F125 HydrophobicContact CZ-CZ 3.54Å; F121-F125 WeakPolarHBondContact O-CD2 3.32Å; F121-F125 PolarHBondContact O-N 3.33Å; A122-F125 PolarHBondContact O-N 3.2Å; F125-A127 VanDerWaalsContact C-N 3.27Å; F125-A127 PolarHBondContact O-N 3.42Å; F125-E128 PolarHBondContact O-N 3.26Å; F125-Y129 HydrophobicContact CB-CD2 4.19Å; F125-Y129 HydrophobicContact CB-CE2 4.18Å; F125-Y129 HydrophobicContact CD1-CE2 4.12Å; F125-Y129 WeakPolarHBondContact O-CB 3.4Å; F125-Y129 WeakPolarHBondContact O-CD2 3.03Å; F125-Y129 PolarHBondContact O-N 3.31Å
126	I	86.4	Confident	81.5	Confident	115 Å²	115	55.2 Å²	55.2	59%	0.59	30%	0.304	S	S	*	.	H	α-helix	trans	-59.6	-42.5	177.9	-67.2	165.7	0	0	0	110.2	A122 F123 G130	A122-I126 VanDerWaalsContact O-CG1 3.28Å; A122-I126 WeakPolarHBondContact O-CG1 3.34Å; A122-I126 PolarHBondContact O-N 3.49Å; F123-I126 PolarHBondContact O-N 2.76Å; I126-G130 PolarHBondContact O-N 3.2Å
127	A	83	Confident	81.9	Confident	32 Å²	32	56.4 Å²	56.4	26%	0.264	31%	0.314	S	S	.	.	H	α-helix	trans	-64	-47.8	177.4	0	0	0	0	0	112	V30 F123 L124 F125 G130 I131	V30-A127 HydrophobicContact CG1-CB 4.14Å; V30-A127 HydrophobicContact CG2-CB 4.07Å; F123-A127 VanDerWaalsContact O-CB 3.25Å; F123-A127 WeakPolarHBondContact O-CB 3.43Å; F123-A127 PolarHBondContact O-N 2.84Å; L124-A127 PolarHBondContact O-N 3.05Å; F125-A127 VanDerWaalsContact C-N 3.27Å; F125-A127 PolarHBondContact O-N 3.42Å; A127-G130 PolarHBondContact O-N 3.19Å; A127-I131 WeakPolarHBondContact O-CD1 3.4Å; A127-I131 WeakPolarHBondContact O-CG1 3.39Å; A127-I131 PolarHBondContact O-N 3.01Å
128	E	76.2	Confident	81.6	Confident	9 Å²	9	54.4 Å²	54.4	4%	0.042	30%	0.298	C	S	.	.	H	α-helix	trans	-64.8	-41.8	-179.9	-72.1	-180	167.3	0	0	112.4	V30 R34 R96 L124 F125 G130 I131 I132	V30-E128 HydrophobicContact CG1-CG 4.27Å; R34-E128 IonicContact CZ-OE1 3.55Å; R34-E128 IonicContact NH2-OE1 3.78Å; R34-E128 PolarHBondContact NH2-OE1 3.46Å; R96-E128 IonicContact CZ-OE2 2.61Å; R96-E128 IonicContact NE-OE2 3.65Å; R96-E128 PolarHBondContact NE-OE2 3.41Å; R96-E128 IonicContact NH1-OE2 3.45Å; R96-E128 IonicContact NH2-OE2 3.34Å; R96-E128 PolarHBondContact NH2-OE2 2.99Å; L124-E128 HydrophobicContact CD2-CG 4.42Å; L124-E128 WeakPolarHBondContact O-CG 3.47Å; L124-E128 PolarHBondContact O-N 3.4Å; F125-E128 PolarHBondContact O-N 3.26Å; E128-G130 VanDerWaalsContact C-N 3.34Å; E128-I131 PolarHBondContact O-N 2.96Å; E128-I132 WeakPolarHBondContact O-CG1 3.32Å; E128-I132 PolarHBondContact O-N 3.48Å; E128-I132 VanDerWaalsContact O-N 3.17Å
129	Y	83.5	Confident	81.2	Confident	104 Å²	104	49.7 Å²	49.7	41%	0.408	27%	0.265	S	S	.	.	H	α-helix	trans	-68.1	-34.9	173.8	-73.9	-63.3	0	0	0	112.2	F125 I131 I132 I133	F125-Y129 HydrophobicContact CB-CD2 4.19Å; F125-Y129 HydrophobicContact CB-CE2 4.18Å; F125-Y129 HydrophobicContact CD1-CE2 4.12Å; F125-Y129 WeakPolarHBondContact O-CB 3.4Å; F125-Y129 WeakPolarHBondContact O-CD2 3.03Å; F125-Y129 PolarHBondContact O-N 3.31Å; Y129-I131 VanDerWaalsContact C-N 3.33Å; Y129-I131 PolarHBondContact O-N 3.04Å; Y129-I132 HydrophobicContact CD1-CD1 4.01Å; Y129-I132 HydrophobicContact CE1-CD1 4.45Å; Y129-I132 PolarHBondContact O-N 3.26Å; Y129-I133 WeakPolarHBondContact O-CG1 3.42Å; Y129-I133 PolarHBondContact O-N 3.29Å
130	G	84.9	Confident	80.7	Confident	35 Å²	35	45.6 Å²	45.6	36%	0.361	24%	0.24	S	C	.	.	H	α-helix	trans	-60.1	-41.6	172	0	0	0	0	0	112.5	I126 A127 E128 I133 L134	I126-G130 PolarHBondContact O-N 3.2Å; A127-G130 PolarHBondContact O-N 3.19Å; E128-G130 VanDerWaalsContact C-N 3.34Å; G130-I133 PolarHBondContact O-N 3.5Å; G130-L134 VanDerWaalsContact O-CB 3.29Å; G130-L134 WeakPolarHBondContact O-CB 3.41Å; G130-L134 PolarHBondContact O-N 2.97Å
131	I	80.5	Confident	80.4	Confident	21 Å²	21	44.4 Å²	44.4	11%	0.108	24%	0.236	C	C	.	.	H	α-helix	trans	-64.5	-42.4	176.6	-69.5	154.4	0	0	0	111.3	Y27 V30 A127 E128 Y129 I133 L134 L135	Y27-I131 HydrophobicContact CD2-CD1 3.77Å; Y27-I131 HydrophobicContact CD2-CG2 3.99Å; Y27-I131 HydrophobicContact CE2-CD1 4.45Å; V30-I131 HydrophobicContact CB-CD1 3.96Å; V30-I131 HydrophobicContact CG1-CD1 4.08Å; V30-I131 HydrophobicContact CG2-CD1 3.74Å; A127-I131 WeakPolarHBondContact O-CD1 3.4Å; A127-I131 WeakPolarHBondContact O-CG1 3.39Å; A127-I131 PolarHBondContact O-N 3.01Å; E128-I131 PolarHBondContact O-N 2.96Å; Y129-I131 VanDerWaalsContact C-N 3.33Å; Y129-I131 PolarHBondContact O-N 3.04Å; I131-I133 VanDerWaalsContact C-N 3.31Å; I131-I133 PolarHBondContact O-N 2.88Å; I131-L134 PolarHBondContact O-N 3.39Å; I131-L135 VanDerWaalsContact O-CB 3.25Å; I131-L135 WeakPolarHBondContact O-CB 3.11Å; I131-L135 PolarHBondContact O-N 3.43Å
132	I	81.2	Confident	80	Confident	20 Å²	20	42.9 Å²	42.9	10%	0.103	23%	0.231	C	C	.	.	H	α-helix	trans	-57.7	-46.9	177	-66.9	165.5	0	0	0	110.8	C94 R96 E128 Y129 S136 I159	C94-I132 HydrophobicContact CB-CD1 4.49Å; C94-I132 HydrophobicContact CB-CG1 3.77Å; C94-I132 VanDerWaalsContact SG-CG1 3.52Å; R96-I132 HydrophobicContact CG-CD1 4.21Å; E128-I132 WeakPolarHBondContact O-CG1 3.32Å; E128-I132 PolarHBondContact O-N 3.48Å; E128-I132 VanDerWaalsContact O-N 3.17Å; Y129-I132 HydrophobicContact CD1-CD1 4.01Å; Y129-I132 HydrophobicContact CE1-CD1 4.45Å; Y129-I132 PolarHBondContact O-N 3.26Å; I132-S136 WeakPolarHBondContact O-CB 3.49Å; I132-S136 PolarHBondContact O-N 3.21Å; I132-S136 PolarHBondContact O-OG 2.94Å; I132-I159 HydrophobicContact CG2-CD1 4.25Å; I132-I159 HydrophobicContact CG2-CG2 4.33Å
133	I	84.5	Confident	79.2	Confident	96 Å²	96	41 Å²	41	49%	0.492	22%	0.215	S	C	.	.	H	α-helix	trans	-63.7	-48.3	179	-65.1	168	0	0	0	109.7	Y129 G130 I131 L135 S136 V137	Y129-I133 WeakPolarHBondContact O-CG1 3.42Å; Y129-I133 PolarHBondContact O-N 3.29Å; G130-I133 PolarHBondContact O-N 3.5Å; I131-I133 VanDerWaalsContact C-N 3.31Å; I131-I133 PolarHBondContact O-N 2.88Å; I133-L135 PolarHBondContact O-N 3.26Å; I133-S136 PolarHBondContact O-N 2.99Å; I133-S136 PolarHBondContact O-OG 3.45Å; I133-V137 WeakPolarHBondContact O-CG2 3.4Å; I133-V137 PolarHBondContact O-N 2.88Å
134	L	82.3	Confident	78.5	Confident	66 Å²	66	36.2 Å²	36.2	35%	0.346	20%	0.196	S	C	.	.	H	α-helix	trans	-60.3	-46.3	-179	177.1	148.2	0	0	0	111.9	L23 G130 I131 S136 V137 L138	L23-L134 HydrophobicContact CB-CD2 4.08Å; L23-L134 HydrophobicContact CD1-CD2 3.82Å; L23-L134 HydrophobicContact CD1-CG 4.44Å; L23-L134 HydrophobicContact CD2-CD1 3.54Å; L23-L134 HydrophobicContact CD2-CD2 3.79Å; L23-L134 HydrophobicContact CD2-CG 4.2Å; L23-L134 HydrophobicContact CG-CD2 4.04Å; G130-L134 VanDerWaalsContact O-CB 3.29Å; G130-L134 WeakPolarHBondContact O-CB 3.41Å; G130-L134 PolarHBondContact O-N 2.97Å; I131-L134 PolarHBondContact O-N 3.39Å; L134-S136 VanDerWaalsContact C-N 3.34Å; L134-S136 PolarHBondContact O-N 3.46Å; L134-V137 PolarHBondContact O-N 2.91Å; L134-V137 VanDerWaalsContact O-N 3.15Å; L134-L138 HydrophobicContact CD2-CD1 3.8Å; L134-L138 HydrophobicContact CD2-CG 4.27Å; L134-L138 WeakPolarHBondContact O-CG 3.36Å; L134-L138 PolarHBondContact O-N 2.85Å
135	L	77.7	Confident	78.1	Confident	16 Å²	16	37.4 Å²	37.4	8%	0.084	21%	0.205	C	C	.	.	H	α-helix	trans	-65.5	-38	179.5	-173	60.5	0	0	0	111.4	A90 E93 I131 I133 V137 L138 F139	A90-L135 HydrophobicContact CB-CD2 3.93Å; A90-L135 HydrophobicContact CB-CG 4.37Å; E93-L135 HydrophobicContact CB-CD2 3.82Å; I131-L135 VanDerWaalsContact O-CB 3.25Å; I131-L135 WeakPolarHBondContact O-CB 3.11Å; I131-L135 PolarHBondContact O-N 3.43Å; I133-L135 PolarHBondContact O-N 3.26Å; L135-V137 VanDerWaalsContact C-N 3.28Å; L135-V137 PolarHBondContact O-N 2.87Å; L135-L138 HydrophobicContact CD1-CD1 4.24Å; L135-L138 WeakPolarHBondContact O-CB 3.43Å; L135-L138 PolarHBondContact O-N 3.4Å; L135-F139 HydrophobicContact CD1-CD2 3.87Å; L135-F139 HydrophobicContact CD1-CE2 3.38Å; L135-F139 HydrophobicContact CD1-CZ 4.01Å; L135-F139 HydrophobicContact CD2-CE2 3.86Å; L135-F139 HydrophobicContact CG-CD2 3.71Å; L135-F139 HydrophobicContact CG-CE2 3.38Å; L135-F139 HydrophobicContact CG-CZ 4.42Å; L135-F139 WeakPolarHBondContact O-CD2 3.25Å; L135-F139 PolarHBondContact O-N 3.24Å
136	S	79.9	Confident	77.8	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.9	-34.1	173.8	76.3	0	0	0	0	113	I132 I133 L134 S140 I156	I132-S136 WeakPolarHBondContact O-CB 3.49Å; I132-S136 PolarHBondContact O-N 3.21Å; I132-S136 PolarHBondContact O-OG 2.94Å; I133-S136 PolarHBondContact O-N 2.99Å; I133-S136 PolarHBondContact O-OG 3.45Å; L134-S136 VanDerWaalsContact C-N 3.34Å; L134-S136 PolarHBondContact O-N 3.46Å; S136-S140 WeakPolarHBondContact O-CB 3.44Å; S136-S140 PolarHBondContact O-N 3.39Å; S136-S140 VanDerWaalsContact O-N 3.1Å; S136-S140 PolarHBondContact O-OG 2.69Å; S136-I156 WeakPolarHBondContact OG-CG1 3.43Å
137	V	80.7	Confident	77.3	Confident	54 Å²	54	41 Å²	41	33%	0.327	23%	0.226	S	C	.	.	H	α-helix	trans	-74.4	-36.4	175.5	173.7	0	0	0	0	111.2	I133 L134 L135 S140 L141 V148	I133-V137 WeakPolarHBondContact O-CG2 3.4Å; I133-V137 PolarHBondContact O-N 2.88Å; L134-V137 PolarHBondContact O-N 2.91Å; L134-V137 VanDerWaalsContact O-N 3.15Å; L135-V137 VanDerWaalsContact C-N 3.28Å; L135-V137 PolarHBondContact O-N 2.87Å; V137-S140 VanDerWaalsContact CA-OG 3.3Å; V137-S140 WeakPolarHBondContact CA-OG 3.28Å; V137-S140 PolarHBondContact O-OG 3.17Å; V137-L141 HydrophobicContact CG1-CD1 4.18Å; V137-L141 WeakPolarHBondContact O-CD1 3.22Å; V137-L141 WeakPolarHBondContact O-CG 3.33Å; V137-L141 PolarHBondContact O-N 3.33Å; V137-V148 HydrophobicContact CG1-CG1 4.14Å
138	L	75.2	Confident	77.1	Confident	13 Å²	13	40.1 Å²	40.1	7%	0.068	22%	0.217	C	C	.	.	H	α-helix	trans	-63.1	-51.9	173.9	-72	177.5	0	0	0	111.7	F19 L23 L134 L135 S140 L141 I142	F19-L138 HydrophobicContact CD1-CD2 3.39Å; F19-L138 HydrophobicContact CE1-CD2 3.27Å; F19-L138 HydrophobicContact CZ-CD2 4.45Å; L23-L138 HydrophobicContact CB-CD1 4.23Å; L23-L138 HydrophobicContact CD1-CD1 3.4Å; L23-L138 VanDerWaalsContact CD1-CD1 3.4Å; L23-L138 HydrophobicContact CD1-CD2 3.63Å; L23-L138 HydrophobicContact CD1-CG 3.91Å; L23-L138 HydrophobicContact CG-CD1 4.4Å; L134-L138 HydrophobicContact CD2-CD1 3.8Å; L134-L138 HydrophobicContact CD2-CG 4.27Å; L134-L138 WeakPolarHBondContact O-CG 3.36Å; L134-L138 PolarHBondContact O-N 2.85Å; L135-L138 HydrophobicContact CD1-CD1 4.24Å; L135-L138 WeakPolarHBondContact O-CB 3.43Å; L135-L138 PolarHBondContact O-N 3.4Å; L138-S140 VanDerWaalsContact C-N 3.27Å; L138-S140 PolarHBondContact O-N 3.05Å; L138-L141 WeakPolarHBondContact O-CB 3.03Å; L138-L141 PolarHBondContact O-N 3.26Å; L138-L141 VanDerWaalsContact O-N 3.1Å; L138-I142 WeakPolarHBondContact O-CG1 3.02Å; L138-I142 PolarHBondContact O-N 3.19Å; L138-I142 VanDerWaalsContact O-N 3.1Å
139	F	73.9	Confident	77.3	Confident	4 Å²	4	42.5 Å²	42.5	2%	0.018	24%	0.238	C	C	.	.	H	α-helix	trans	-60.9	-39.8	179.3	-76.3	-58.1	0	0	0	111.2	L60 I86 A90 L135 L141 I142 I143 I155	L60-F139 HydrophobicContact CD1-CE1 3.82Å; L60-F139 HydrophobicContact CD1-CZ 3.46Å; L60-F139 VanDerWaalsContact CD1-CZ 3.46Å; I86-F139 HydrophobicContact CG2-CB 4.17Å; I86-F139 HydrophobicContact CG2-CD1 3.47Å; I86-F139 VanDerWaalsContact CG2-CD1 3.47Å; I86-F139 HydrophobicContact CG2-CD2 4.22Å; I86-F139 HydrophobicContact CG2-CE1 3.8Å; I86-F139 HydrophobicContact CG2-CE2 4.47Å; I86-F139 HydrophobicContact CG2-CG 3.71Å; I86-F139 HydrophobicContact CG2-CZ 4.28Å; A90-F139 HydrophobicContact CB-CD2 3.93Å; A90-F139 HydrophobicContact CB-CE2 3.52Å; L135-F139 HydrophobicContact CD1-CD2 3.87Å; L135-F139 HydrophobicContact CD1-CE2 3.38Å; L135-F139 HydrophobicContact CD1-CZ 4.01Å; L135-F139 HydrophobicContact CD2-CE2 3.86Å; L135-F139 HydrophobicContact CG-CD2 3.71Å; L135-F139 HydrophobicContact CG-CE2 3.38Å; L135-F139 HydrophobicContact CG-CZ 4.42Å; L135-F139 WeakPolarHBondContact O-CD2 3.25Å; L135-F139 PolarHBondContact O-N 3.24Å; F139-L141 VanDerWaalsContact C-N 3.32Å; F139-L141 PolarHBondContact O-N 3.39Å; F139-I142 PolarHBondContact O-N 3.29Å; F139-I143 HydrophobicContact CB-CD1 4.26Å; F139-I143 WeakPolarHBondContact O-CB 3.4Å; F139-I143 WeakPolarHBondContact O-CD1 3.44Å; F139-I143 WeakPolarHBondContact O-CG1 3.25Å; F139-I143 PolarHBondContact O-N 2.64Å; F139-I155 HydrophobicContact CB-CD1 3.97Å
140	S	76	Confident	77.1	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-63.1	-36.8	175.2	59.2	0	0	0	0	113.6	S136 V137 L138 I142 I143 V144 V148 T151	S136-S140 WeakPolarHBondContact O-CB 3.44Å; S136-S140 PolarHBondContact O-N 3.39Å; S136-S140 VanDerWaalsContact O-N 3.1Å; S136-S140 PolarHBondContact O-OG 2.69Å; V137-S140 VanDerWaalsContact CA-OG 3.3Å; V137-S140 WeakPolarHBondContact CA-OG 3.28Å; V137-S140 PolarHBondContact O-OG 3.17Å; L138-S140 VanDerWaalsContact C-N 3.27Å; L138-S140 PolarHBondContact O-N 3.05Å; S140-I142 VanDerWaalsContact C-N 3.34Å; S140-I142 PolarHBondContact O-N 3.43Å; S140-I143 PolarHBondContact O-N 2.96Å; S140-V144 CarbonylContact O-C 3.58Å; S140-V144 PolarHBondContact O-N 3.23Å; S140-V148 WeakPolarHBondContact OG-CG1 3.24Å; S140-V148 PolarHBondContact OG-O 3.35Å; S140-T151 WeakPolarHBondContact CB-OG1 3.39Å
141	L	74.3	Confident	76.8	Confident	47 Å²	47	40 Å²	40	25%	0.246	23%	0.229	C	C	.	.	H	α-helix	trans	-63.3	-38.9	175.2	-74.6	166.4	0	0	0	112.6	L7 V137 L138 F139 V148	L7-L141 HydrophobicContact CD2-CD2 3.29Å; V137-L141 HydrophobicContact CG1-CD1 4.18Å; V137-L141 WeakPolarHBondContact O-CD1 3.22Å; V137-L141 WeakPolarHBondContact O-CG 3.33Å; V137-L141 PolarHBondContact O-N 3.33Å; L138-L141 WeakPolarHBondContact O-CB 3.03Å; L138-L141 PolarHBondContact O-N 3.26Å; L138-L141 VanDerWaalsContact O-N 3.1Å; F139-L141 VanDerWaalsContact C-N 3.32Å; F139-L141 PolarHBondContact O-N 3.39Å; L141-V148 HydrophobicContact CD2-CG1 4.22Å; L141-V148 HydrophobicContact CD2-CG2 3.58Å; L141-V148 HydrophobicContact CG-CG1 4.26Å; L141-V148 HydrophobicContact CG-CG2 4.29Å
142	I	70.7	Confident	76.8	Confident	42 Å²	42	39.7 Å²	39.7	22%	0.215	23%	0.229	C	C	.	.	H	α-helix	trans	-75	-40.1	179.7	-54.6	165.8	0	0	0	110.4	I20 M67 L138 F139 S140	I20-I142 HydrophobicContact CD1-CD1 3.81Å; M67-I142 HydrophobicContact CB-CG2 4.39Å; M67-I142 HydrophobicContact CE-CB 4.11Å; M67-I142 HydrophobicContact CE-CG2 3.29Å; M67-I142 HydrophobicContact SD-CG2 3.66Å; L138-I142 WeakPolarHBondContact O-CG1 3.02Å; L138-I142 PolarHBondContact O-N 3.19Å; L138-I142 VanDerWaalsContact O-N 3.1Å; F139-I142 PolarHBondContact O-N 3.29Å; S140-I142 VanDerWaalsContact C-N 3.34Å; S140-I142 PolarHBondContact O-N 3.43Å
143	I	68.9	Low	77	Confident	6 Å²	6	44 Å²	44	3%	0.031	25%	0.252	C	S	.	.	H	α-helix	trans	-74.7	-59.5	-175.7	-70.9	171.8	0	0	0	111.6	M67 L77 L83 I86 F139 S140 I155	M67-I143 HydrophobicContact CE-CG1 4.12Å; L77-I143 HydrophobicContact CB-CG2 4.35Å; L77-I143 HydrophobicContact CD1-CB 3.97Å; L77-I143 HydrophobicContact CD1-CG1 4.4Å; L77-I143 HydrophobicContact CD1-CG2 3.26Å; L77-I143 WeakPolarHBondContact CD1-O 3.45Å; L77-I143 HydrophobicContact CD2-CG2 4.04Å; L77-I143 HydrophobicContact CG-CG2 4.06Å; L83-I143 HydrophobicContact CD2-CD1 4.32Å; I86-I143 HydrophobicContact CD1-CD1 3.65Å; I86-I143 HydrophobicContact CD1-CG1 4.07Å; I86-I143 HydrophobicContact CG2-CD1 4.15Å; F139-I143 HydrophobicContact CB-CD1 4.26Å; F139-I143 WeakPolarHBondContact O-CB 3.4Å; F139-I143 WeakPolarHBondContact O-CD1 3.44Å; F139-I143 WeakPolarHBondContact O-CG1 3.25Å; F139-I143 PolarHBondContact O-N 2.64Å; S140-I143 PolarHBondContact O-N 2.96Å; I143-I155 HydrophobicContact CD1-CD1 4.33Å
144	V	70.5	Confident	76.8	Confident	32 Å²	32	43.7 Å²	43.7	19%	0.194	25%	0.251	C	S	.	.			trans	-138.9	89.5	178.8	-171.3	0	0	0	0	109.7	S140 Q146 A147 T151	S140-V144 CarbonylContact O-C 3.58Å; S140-V144 PolarHBondContact O-N 3.23Å; V144-Q146 HydrophobicContact CG1-CB 4.29Å; V144-Q146 PolarHBondContact O-N 3.31Å; V144-A147 HydrophobicContact CB-CB 4.48Å; V144-A147 HydrophobicContact CG1-CB 3.84Å; V144-A147 PolarHBondContact O-N 2.99Å; V144-A147 VanDerWaalsContact O-N 3.08Å; V144-T151 HydrophobicContact CB-CG2 4.17Å; V144-T151 HydrophobicContact CG2-CG2 4.23Å
145	P	71	Confident	76.8	Confident	39 Å²	39	41 Å²	41	25%	0.253	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-18.4	-179	23.4	-33.5	0	0	0	113.4	V148	P145-V148 WeakPolarHBondContact O-CG2 3.31Å
146	Q	71.6	Confident	77.1	Confident	190 Å²	190	42.2 Å²	42.2	89%	0.888	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-24.6	179.1	-61.7	-177.2	1.1	0	0	113.4	V144	V144-Q146 HydrophobicContact CG1-CB 4.29Å; V144-Q146 PolarHBondContact O-N 3.31Å
147	A	77.5	Confident	77.2	Confident	35 Å²	35	45.9 Å²	45.9	29%	0.289	27%	0.265	S	S	.	.			trans	-129.9	42.8	-169.3	0	0	0	0	0	112.1	V144 A149 S150 T151	V144-A147 HydrophobicContact CB-CB 4.48Å; V144-A147 HydrophobicContact CG1-CB 3.84Å; V144-A147 PolarHBondContact O-N 2.99Å; V144-A147 VanDerWaalsContact O-N 3.08Å; A147-A149 VanDerWaalsContact C-N 3.29Å; A147-A149 PolarHBondContact O-N 2.92Å; A147-S150 PolarHBondContact O-N 3.22Å; A147-S150 PolarHBondContact O-OG 3.49Å; A147-S150 VanDerWaalsContact O-OG 3.08Å; A147-T151 HydrophobicContact CB-CG2 4.47Å; A147-T151 PolarHBondContact O-N 2.87Å; A147-T151 VanDerWaalsContact O-N 3.08Å; A147-T151 PolarHBondContact O-OG1 3.03Å
148	V	78.4	Confident	77	Confident	13 Å²	13	46.5 Å²	46.5	8%	0.079	26%	0.261	C	S	.	.	H	α-helix	trans	-54.7	-41.1	-172.5	-178.4	0	0	0	0	113	L7 V137 S140 L141 P145 T151 S152	L7-V148 HydrophobicContact CD1-CG2 4.35Å; L7-V148 HydrophobicContact CD2-CG2 3.85Å; V137-V148 HydrophobicContact CG1-CG1 4.14Å; S140-V148 WeakPolarHBondContact OG-CG1 3.24Å; S140-V148 PolarHBondContact OG-O 3.35Å; L141-V148 HydrophobicContact CD2-CG1 4.22Å; L141-V148 HydrophobicContact CD2-CG2 3.58Å; L141-V148 HydrophobicContact CG-CG1 4.26Å; L141-V148 HydrophobicContact CG-CG2 4.29Å; P145-V148 WeakPolarHBondContact O-CG2 3.31Å; V148-T151 PolarHBondContact O-OG1 3.28Å; V148-S152 VanDerWaalsContact O-CB 3.24Å; V148-S152 WeakPolarHBondContact O-CB 3.25Å; V148-S152 PolarHBondContact O-N 2.91Å; V148-S152 PolarHBondContact O-OG 3.34Å; V148-S152 VanDerWaalsContact O-OG 3.04Å
149	A	80.8	Confident	77.4	Confident	59 Å²	59	46.4 Å²	46.4	49%	0.488	26%	0.261	S	S	.	.	H	α-helix	trans	-73.8	-40.4	-175.1	0	0	0	0	0	113.2	A147 S152 L153	A147-A149 VanDerWaalsContact C-N 3.29Å; A147-A149 PolarHBondContact O-N 2.92Å; A149-S152 PolarHBondContact O-OG 2.9Å; A149-S152 VanDerWaalsContact O-OG 3.12Å; A149-L153 VanDerWaalsContact O-CG 3.31Å; A149-L153 WeakPolarHBondContact O-CG 3.4Å; A149-L153 PolarHBondContact O-N 3.06Å
150	S	78.8	Confident	77.8	Confident	66 Å²	66	49.8 Å²	49.8	46%	0.462	28%	0.279	S	S	.	.	H	α-helix	trans	-72.4	-41.6	178.3	53.7	0	0	0	0	110.8	A147 L153 L154	A147-S150 PolarHBondContact O-N 3.22Å; A147-S150 PolarHBondContact O-OG 3.49Å; A147-S150 VanDerWaalsContact O-OG 3.08Å; S150-L153 PolarHBondContact O-N 3.39Å; S150-L154 VanDerWaalsContact O-CG 3.29Å; S150-L154 WeakPolarHBondContact O-CG 3.43Å; S150-L154 PolarHBondContact O-N 3.16Å
151	T	77.8	Confident	78.2	Confident	21 Å²	21	55.5 Å²	55.5	13%	0.129	30%	0.304	C	S	.	.	H	α-helix	trans	-70.4	-36.3	179.5	50.3	0	0	0	0	112.6	S140 V144 A147 V148 L154 I155	S140-T151 WeakPolarHBondContact CB-OG1 3.39Å; V144-T151 HydrophobicContact CB-CG2 4.17Å; V144-T151 HydrophobicContact CG2-CG2 4.23Å; A147-T151 HydrophobicContact CB-CG2 4.47Å; A147-T151 PolarHBondContact O-N 2.87Å; A147-T151 VanDerWaalsContact O-N 3.08Å; A147-T151 PolarHBondContact O-OG1 3.03Å; V148-T151 PolarHBondContact O-OG1 3.28Å; T151-L154 PolarHBondContact O-N 3.28Å; T151-I155 VanDerWaalsContact O-CG1 3.26Å; T151-I155 WeakPolarHBondContact O-CG1 2.9Å; T151-I155 PolarHBondContact O-N 2.93Å
152	S	81.7	Confident	78.5	Confident	14 Å²	14	55 Å²	55	10%	0.098	30%	0.301	C	S	.	.	H	α-helix	trans	-64.3	-42.2	174	64.8	0	0	0	0	111.9	V148 A149 L154 I155 I156	V148-S152 VanDerWaalsContact O-CB 3.24Å; V148-S152 WeakPolarHBondContact O-CB 3.25Å; V148-S152 PolarHBondContact O-N 2.91Å; V148-S152 PolarHBondContact O-OG 3.34Å; V148-S152 VanDerWaalsContact O-OG 3.04Å; A149-S152 PolarHBondContact O-OG 2.9Å; A149-S152 VanDerWaalsContact O-OG 3.12Å; S152-L154 VanDerWaalsContact C-N 3.35Å; S152-L154 PolarHBondContact O-N 3.4Å; S152-I155 PolarHBondContact O-N 3.18Å; S152-I156 VanDerWaalsContact O-CG1 3.28Å; S152-I156 WeakPolarHBondContact O-CG1 3.2Å; S152-I156 PolarHBondContact O-N 3.22Å
153	L	84.7	Confident	79	Confident	110 Å²	110	56.4 Å²	56.4	58%	0.576	30%	0.304	S	S	*	.	H	α-helix	trans	-63.2	-40.2	175	-71.2	174.5	0	0	0	112.1	A149 S150 I156 T157	A149-L153 VanDerWaalsContact O-CG 3.31Å; A149-L153 WeakPolarHBondContact O-CG 3.4Å; A149-L153 PolarHBondContact O-N 3.06Å; S150-L153 PolarHBondContact O-N 3.39Å; L153-I156 PolarHBondContact O-N 3.48Å; L153-T157 WeakPolarHBondContact O-CB 3.41Å; L153-T157 VanDerWaalsContact O-CG2 3.28Å; L153-T157 WeakPolarHBondContact O-CG2 3.34Å; L153-T157 PolarHBondContact O-N 2.97Å; L153-T157 PolarHBondContact O-OG1 2.94Å
154	L	81.3	Confident	79.5	Confident	90 Å²	90	65 Å²	65	47%	0.471	34%	0.337	S	S	.	.	H	α-helix	trans	-62.2	-43.1	173	-71.1	171.9	0	0	0	111.4	S150 T151 S152 T157 R158	S150-L154 VanDerWaalsContact O-CG 3.29Å; S150-L154 WeakPolarHBondContact O-CG 3.43Å; S150-L154 PolarHBondContact O-N 3.16Å; T151-L154 PolarHBondContact O-N 3.28Å; S152-L154 VanDerWaalsContact C-N 3.35Å; S152-L154 PolarHBondContact O-N 3.4Å; L154-T157 WeakPolarHBondContact CA-OG1 3.36Å; L154-T157 PolarHBondContact O-OG1 3.29Å; L154-R158 WeakPolarHBondContact O-CB 2.9Å; L154-R158 WeakPolarHBondContact O-CG 3.49Å; L154-R158 PolarHBondContact O-N 3.27Å
155	I	80.4	Confident	80.1	Confident	9 Å²	9	66.8 Å²	66.8	5%	0.046	35%	0.348	C	S	.	.	H	α-helix	trans	-64.5	-45.9	177.6	-67.2	164.4	0	0	0	110.7	F139 I143 T151 S152 T157 R158 I159	F139-I155 HydrophobicContact CB-CD1 3.97Å; I143-I155 HydrophobicContact CD1-CD1 4.33Å; T151-I155 VanDerWaalsContact O-CG1 3.26Å; T151-I155 WeakPolarHBondContact O-CG1 2.9Å; T151-I155 PolarHBondContact O-N 2.93Å; S152-I155 PolarHBondContact O-N 3.18Å; I155-T157 PolarHBondContact O-N 3.22Å; I155-R158 WeakPolarHBondContact O-CB 3.39Å; I155-R158 PolarHBondContact O-N 3.11Å; I155-I159 HydrophobicContact CG2-CD1 3.75Å; I155-I159 HydrophobicContact CG2-CG1 4.29Å; I155-I159 VanDerWaalsContact O-CG1 3.25Å; I155-I159 WeakPolarHBondContact O-CG1 3.33Å; I155-I159 PolarHBondContact O-N 2.61Å
156	I	84.3	Confident	80.6	Confident	42 Å²	42	68 Å²	68	22%	0.215	35%	0.352	C	S	.	.	H	α-helix	trans	-61.2	-46.3	179	-67.4	165.1	0	0	0	111	S136 S152 L153 R158 I159 L160	S136-I156 WeakPolarHBondContact OG-CG1 3.43Å; S152-I156 VanDerWaalsContact O-CG1 3.28Å; S152-I156 WeakPolarHBondContact O-CG1 3.2Å; S152-I156 PolarHBondContact O-N 3.22Å; L153-I156 PolarHBondContact O-N 3.48Å; I156-R158 VanDerWaalsContact C-N 3.29Å; I156-R158 PolarHBondContact O-N 3.23Å; I156-I159 PolarHBondContact O-N 3.34Å; I156-L160 HydrophobicContact CG2-CD1 4.27Å; I156-L160 WeakPolarHBondContact O-CG 3.37Å; I156-L160 PolarHBondContact O-N 3.04Å
157	T	83.6	Confident	80.8	Confident	77 Å²	77	63.7 Å²	63.7	47%	0.472	34%	0.341	S	S	.	.	H	α-helix	trans	-63.5	-35.9	178	51.4	0	0	0	0	111.9	L153 L154 I155 L160 F161	L153-T157 WeakPolarHBondContact O-CB 3.41Å; L153-T157 VanDerWaalsContact O-CG2 3.28Å; L153-T157 WeakPolarHBondContact O-CG2 3.34Å; L153-T157 PolarHBondContact O-N 2.97Å; L153-T157 PolarHBondContact O-OG1 2.94Å; L154-T157 WeakPolarHBondContact CA-OG1 3.36Å; L154-T157 PolarHBondContact O-OG1 3.29Å; I155-T157 PolarHBondContact O-N 3.22Å; T157-L160 PolarHBondContact O-N 3.15Å; T157-F161 WeakPolarHBondContact O-CB 2.87Å; T157-F161 PolarHBondContact O-N 3.39Å
158	R	76.2	Confident	80.7	Confident	67 Å²	67	70 Å²	70	25%	0.253	36%	0.357	S	S	.	.	H	α-helix	trans	-66.6	-44.1	172.7	-68.2	-69.7	179.3	-171.6	-0.3	112.8	W80 L154 I155 I156 L160 F161 L162	W80-R158 VanDerWaalsContact CD2-NH2 3.27Å; L154-R158 WeakPolarHBondContact O-CB 2.9Å; L154-R158 WeakPolarHBondContact O-CG 3.49Å; L154-R158 PolarHBondContact O-N 3.27Å; I155-R158 WeakPolarHBondContact O-CB 3.39Å; I155-R158 PolarHBondContact O-N 3.11Å; I156-R158 VanDerWaalsContact C-N 3.29Å; I156-R158 PolarHBondContact O-N 3.23Å; R158-L160 VanDerWaalsContact C-N 3.3Å; R158-L160 PolarHBondContact O-N 3.11Å; R158-F161 PolarHBondContact O-N 2.92Å; R158-L162 WeakPolarHBondContact O-CB 3.08Å; R158-L162 VanDerWaalsContact O-CG 3.32Å; R158-L162 WeakPolarHBondContact O-CG 3.44Å; R158-L162 PolarHBondContact O-N 3.39Å
159	I	82.3	Confident	80.4	Confident	11 Å²	11	71.5 Å²	71.5	6%	0.056	36%	0.364	C	S	.	.	H	α-helix	trans	-56.7	-46.5	175.5	-72	171.3	0	0	0	110	A90 L91 I132 I155 I156 R163	A90-I159 HydrophobicContact CB-CD1 4.23Å; L91-I159 HydrophobicContact CD2-CB 4.28Å; L91-I159 HydrophobicContact CD2-CG2 3.52Å; L91-I159 HydrophobicContact CG-CB 4.42Å; L91-I159 HydrophobicContact CG-CG1 4.22Å; L91-I159 HydrophobicContact CG-CG2 4.09Å; I132-I159 HydrophobicContact CG2-CD1 4.25Å; I132-I159 HydrophobicContact CG2-CG2 4.33Å; I155-I159 HydrophobicContact CG2-CD1 3.75Å; I155-I159 HydrophobicContact CG2-CG1 4.29Å; I155-I159 VanDerWaalsContact O-CG1 3.25Å; I155-I159 WeakPolarHBondContact O-CG1 3.33Å; I155-I159 PolarHBondContact O-N 2.61Å; I156-I159 PolarHBondContact O-N 3.34Å; I159-R163 WeakPolarHBondContact O-CB 3.28Å; I159-R163 PolarHBondContact O-N 2.9Å
160	L	83.6	Confident	80.3	Confident	75 Å²	75	77.5 Å²	77.5	39%	0.393	37%	0.374	S	S	.	.	H	α-helix	trans	-63.9	-44.1	176.4	-67.8	175.3	0	0	0	111.8	I156 T157 R158 R163 Y164	I156-L160 HydrophobicContact CG2-CD1 4.27Å; I156-L160 WeakPolarHBondContact O-CG 3.37Å; I156-L160 PolarHBondContact O-N 3.04Å; T157-L160 PolarHBondContact O-N 3.15Å; R158-L160 VanDerWaalsContact C-N 3.3Å; R158-L160 PolarHBondContact O-N 3.11Å; L160-R163 WeakPolarHBondContact O-CB 3.47Å; L160-R163 PolarHBondContact O-N 3.36Å; L160-Y164 HydrophobicContact CB-CE2 4.42Å; L160-Y164 WeakPolarHBondContact O-CD2 2.91Å; L160-Y164 WeakPolarHBondContact O-CE2 2.89Å; L160-Y164 PolarHBondContact O-N 3.48Å
161	F	83.8	Confident	79.8	Confident	121 Å²	121	75.9 Å²	75.9	53%	0.531	36%	0.358	S	S	.	.	H	α-helix	trans	-62.5	-44.7	177.9	-177.4	-97.1	0	0	0	112.7	T157 R158 R163 Y164 T165	T157-F161 WeakPolarHBondContact O-CB 2.87Å; T157-F161 PolarHBondContact O-N 3.39Å; R158-F161 PolarHBondContact O-N 2.92Å; F161-R163 VanDerWaalsContact C-N 3.28Å; F161-R163 PolarHBondContact O-N 2.89Å; F161-Y164 PolarHBondContact O-N 3.05Å; F161-Y164 VanDerWaalsContact O-N 3.16Å; F161-T165 HydrophobicContact CD1-CG2 4.05Å; F161-T165 HydrophobicContact CD2-CG2 4.44Å; F161-T165 HydrophobicContact CE1-CG2 3.59Å; F161-T165 HydrophobicContact CE2-CG2 4.02Å; F161-T165 HydrophobicContact CG-CG2 4.46Å; F161-T165 HydrophobicContact CZ-CG2 3.58Å; F161-T165 WeakPolarHBondContact O-CG2 3.28Å; F161-T165 PolarHBondContact O-N 3.35Å; F161-T165 PolarHBondContact O-OG1 3.03Å
162	L	80.9	Confident	79.7	Confident	35 Å²	35	79 Å²	79	18%	0.183	38%	0.375	C	S	.	.	H	α-helix	trans	-62.4	-36.3	176.8	-73.2	173.3	0	0	0	111.9	S87 L91 R158 Y164 T165 L166	S87-L162 WeakPolarHBondContact OG-CD1 3.45Å; L91-L162 HydrophobicContact CD1-CB 3.5Å; L91-L162 HydrophobicContact CD1-CD1 3.49Å; L91-L162 VanDerWaalsContact CD1-CD1 3.49Å; L91-L162 HydrophobicContact CD1-CG 4.14Å; R158-L162 WeakPolarHBondContact O-CB 3.08Å; R158-L162 VanDerWaalsContact O-CG 3.32Å; R158-L162 WeakPolarHBondContact O-CG 3.44Å; R158-L162 PolarHBondContact O-N 3.39Å; L162-Y164 VanDerWaalsContact C-N 3.29Å; L162-Y164 PolarHBondContact O-N 3.38Å; L162-T165 VanDerWaalsContact CA-OG1 3.31Å; L162-T165 WeakPolarHBondContact CA-OG1 3.2Å; L162-T165 PolarHBondContact O-N 3.26Å; L162-T165 PolarHBondContact O-OG1 3.38Å; L162-L166 HydrophobicContact CD2-CD1 4.22Å; L162-L166 WeakPolarHBondContact O-CB 3.41Å; L162-L166 PolarHBondContact O-N 3.03Å
163	R	80.8	Confident	79.5	Confident	73 Å²	73	83.7 Å²	83.7	28%	0.275	39%	0.393	S	S	.	.	H	α-helix	trans	-60.2	-35.9	173.8	167.4	165.3	-160.4	-161.9	4.3	113.3	T97 I159 L160 F161	T97-R163 WeakPolarHBondContact OG1-CD 3.43Å; T97-R163 WeakPolarHBondContact OG1-CG 3.28Å; T97-R163 PolarHBondContact OG1-NE 3.28Å; I159-R163 WeakPolarHBondContact O-CB 3.28Å; I159-R163 PolarHBondContact O-N 2.9Å; L160-R163 WeakPolarHBondContact O-CB 3.47Å; L160-R163 PolarHBondContact O-N 3.36Å; F161-R163 VanDerWaalsContact C-N 3.28Å; F161-R163 PolarHBondContact O-N 2.89Å
164	Y	79.8	Confident	78.8	Confident	185 Å²	185	78.5 Å²	78.5	73%	0.725	37%	0.366	S	S	*	.	H	α-helix	trans	-85.1	-25.4	179.3	-65.5	-64.2	0	0	0	113.4	L160 F161 L162	L160-Y164 HydrophobicContact CB-CE2 4.42Å; L160-Y164 WeakPolarHBondContact O-CD2 2.91Å; L160-Y164 WeakPolarHBondContact O-CE2 2.89Å; L160-Y164 PolarHBondContact O-N 3.48Å; F161-Y164 PolarHBondContact O-N 3.05Å; F161-Y164 VanDerWaalsContact O-N 3.16Å; L162-Y164 VanDerWaalsContact C-N 3.29Å; L162-Y164 PolarHBondContact O-N 3.38Å
165	T	83.9	Confident	78.3	Confident	70 Å²	70	77.9 Å²	77.9	43%	0.429	36%	0.362	S	S	.	.	H	α-helix	trans	-90.9	-34.9	-174.3	48	0	0	0	0	113.5	F161 L162	F161-T165 HydrophobicContact CD1-CG2 4.05Å; F161-T165 HydrophobicContact CD2-CG2 4.44Å; F161-T165 HydrophobicContact CE1-CG2 3.59Å; F161-T165 HydrophobicContact CE2-CG2 4.02Å; F161-T165 HydrophobicContact CG-CG2 4.46Å; F161-T165 HydrophobicContact CZ-CG2 3.58Å; F161-T165 WeakPolarHBondContact O-CG2 3.28Å; F161-T165 PolarHBondContact O-N 3.35Å; F161-T165 PolarHBondContact O-OG1 3.03Å; L162-T165 VanDerWaalsContact CA-OG1 3.31Å; L162-T165 WeakPolarHBondContact CA-OG1 3.2Å; L162-T165 PolarHBondContact O-N 3.26Å; L162-T165 PolarHBondContact O-OG1 3.38Å
166	L	79.7	Confident	78.2	Confident	65 Å²	65	81.5 Å²	81.5	34%	0.34	39%	0.388	S	S	.	.	S	Bend	trans	-90.8	134	-174.7	-63	176.8	0	0	0	112.1	F88 P98 L162	F88-L166 HydrophobicContact CD2-CD1 4.29Å; F88-L166 HydrophobicContact CE2-CD1 3.96Å; P98-L166 HydrophobicContact CB-CB 4.12Å; P98-L166 HydrophobicContact CG-CB 4.28Å; P98-L166 HydrophobicContact CG-CD1 4.05Å; L162-L166 HydrophobicContact CD2-CD1 4.22Å; L162-L166 WeakPolarHBondContact O-CB 3.41Å; L162-L166 PolarHBondContact O-N 3.03Å
167	P	77.1	Confident	77.5	Confident	99 Å²	99	84.2 Å²	84.2	64%	0.643	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-65.6	153.7	170	30.1	-34.2	0	0	0	110	P98 L169	P98-P167 WeakPolarHBondContact CB-O 3.44Å; P167-L169 PolarHBondContact O-N 3Å
168	R	75.5	Confident	76.7	Confident	167 Å²	167	85.6 Å²	85.6	63%	0.63	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-63.9	133.3	172.8	-63.2	-172.1	179.8	101.3	-0.7	109.6	T97	T97-R168 HydrophobicContact CG2-CG 4.05Å; T97-R168 VanDerWaalsContact CG2-NE 3.33Å
169	L	72.4	Confident	76.7	Confident	45 Å²	45	86.5 Å²	86.5	24%	0.236	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-90.2	138.2	178.1	-64.4	174.7	0	0	0	110.1	P98 F99 L101 P167 F173	P98-L169 HydrophobicContact CB-CG 4.48Å; P98-L169 PolarHBondContact O-N 2.99Å; P98-L169 VanDerWaalsContact O-N 3.11Å; F99-L169 HydrophobicContact CE1-CD1 4Å; L101-L169 WeakPolarHBondContact CD2-O 3.31Å; P167-L169 PolarHBondContact O-N 3Å; L169-F173 HydrophobicContact CB-CD1 4.49Å; L169-F173 HydrophobicContact CD1-CD1 4.27Å; L169-F173 HydrophobicContact CD1-CE1 4.37Å; L169-F173 HydrophobicContact CD2-CD1 3.92Å; L169-F173 HydrophobicContact CD2-CE1 4.08Å; L169-F173 HydrophobicContact CG-CD1 4.46Å
170	R	77.2	Confident	76.4	Confident	185 Å²	185	90.5 Å²	90.5	70%	0.698	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-71.6	142.8	174.1	-176.3	173.9	171	161.5	-0.2	109.8	D172 F173 L174	R170-D172 VanDerWaalsContact C-N 3.26Å; R170-D172 IonicContact CZ-OD2 3.64Å; R170-D172 IonicContact NE-OD2 3.73Å; R170-D172 PolarHBondContact NE-OD2 2.82Å; R170-D172 IonicContact NH2-OD2 2.69Å; R170-D172 PolarHBondContact NH2-OD2 3.01Å; R170-D172 PolarHBondContact O-N 2.72Å; R170-F173 WeakPolarHBondContact O-CB 3.39Å; R170-F173 PolarHBondContact O-N 2.84Å; R170-L174 PolarHBondContact O-N 3.18Å; R170-L174 VanDerWaalsContact O-N 3.1Å
171	Y	69.7	Low	76	Confident	32 Å²	32	91.3 Å²	91.3	13%	0.125	43%	0.434	C	S	.	.	H	α-helix	trans	-54	-39.4	-178.3	-178.9	-115.6	0	0	0	113.8	R48 T51 L101 F173 L174 I175	R48-Y171 HydrophobicContact CB-CE2 4.41Å; R48-Y171 HydrophobicContact CG-CE1 4.46Å; T51-Y171 PolarHBondContact OG1-OH 3.01Å; L101-Y171 HydrophobicContact CD1-CD2 3.34Å; L101-Y171 HydrophobicContact CD1-CE2 4.31Å; L101-Y171 HydrophobicContact CD1-CG 3.96Å; Y171-F173 PolarHBondContact O-N 3.11Å; Y171-L174 WeakPolarHBondContact O-CB 3.45Å; Y171-L174 PolarHBondContact O-N 3.29Å; Y171-I175 HydrophobicContact CD1-CD1 3.44Å; Y171-I175 VanDerWaalsContact CD1-CD1 3.44Å; Y171-I175 HydrophobicContact CD1-CG1 4.23Å; Y171-I175 HydrophobicContact CD2-CD1 4.23Å; Y171-I175 HydrophobicContact CD2-CG1 4.17Å; Y171-I175 HydrophobicContact CE1-CD1 3.04Å; Y171-I175 HydrophobicContact CE1-CG1 3.95Å; Y171-I175 HydrophobicContact CE2-CD1 3.92Å; Y171-I175 HydrophobicContact CE2-CG1 3.89Å; Y171-I175 HydrophobicContact CG-CD1 4.06Å; Y171-I175 HydrophobicContact CG-CG1 4.38Å; Y171-I175 WeakPolarHBondContact O-CG1 3.47Å; Y171-I175 PolarHBondContact O-N 3.21Å
172	D	75.7	Confident	75.6	Confident	88 Å²	88	89.6 Å²	89.6	47%	0.471	43%	0.428	S	S	.	.	H	α-helix	trans	-58.8	-36.5	178.8	-53.5	-31.8	0	0	0	111.7	R170 S176	R170-D172 VanDerWaalsContact C-N 3.26Å; R170-D172 IonicContact CZ-OD2 3.64Å; R170-D172 IonicContact NE-OD2 3.73Å; R170-D172 PolarHBondContact NE-OD2 2.82Å; R170-D172 IonicContact NH2-OD2 2.69Å; R170-D172 PolarHBondContact NH2-OD2 3.01Å; R170-D172 PolarHBondContact O-N 2.72Å; D172-S176 PolarHBondContact O-N 3.17Å
173	F	75.8	Confident	75.3	Confident	112 Å²	112	93 Å²	93	49%	0.491	44%	0.443	S	S	.	.	H	α-helix	trans	-75.8	-37	176	-174.8	-98.3	0	0	0	111.8	L169 R170 Y171 S176 L177	L169-F173 HydrophobicContact CB-CD1 4.49Å; L169-F173 HydrophobicContact CD1-CD1 4.27Å; L169-F173 HydrophobicContact CD1-CE1 4.37Å; L169-F173 HydrophobicContact CD2-CD1 3.92Å; L169-F173 HydrophobicContact CD2-CE1 4.08Å; L169-F173 HydrophobicContact CG-CD1 4.46Å; R170-F173 WeakPolarHBondContact O-CB 3.39Å; R170-F173 PolarHBondContact O-N 2.84Å; Y171-F173 PolarHBondContact O-N 3.11Å; F173-S176 WeakPolarHBondContact CA-OG 3.39Å; F173-S176 PolarHBondContact O-N 3.11Å; F173-S176 PolarHBondContact O-OG 3.12Å; F173-L177 PolarHBondContact O-N 3.21Å
174	L	70.9	Confident	74.9	Confident	1 Å²	1	94.3 Å²	94.3	1%	0.005	46%	0.455	C	S	.	.	H	α-helix	trans	-62.8	-47.3	177.8	-161.8	174.4	0	0	0	110.4	Q52 Y56 F99 L101 R170 Y171 S176 L177 M178	Q52-L174 HydrophobicContact CG-CD1 4.39Å; Y56-L174 HydrophobicContact CE2-CD2 3.92Å; Y56-L174 WeakPolarHBondContact OH-CD2 3.4Å; F99-L174 HydrophobicContact CB-CD1 4.46Å; F99-L174 HydrophobicContact CD1-CD1 3.52Å; F99-L174 HydrophobicContact CD1-CG 3.86Å; F99-L174 HydrophobicContact CE1-CD1 4.2Å; F99-L174 HydrophobicContact CE1-CG 4.03Å; F99-L174 HydrophobicContact CG-CD1 4.46Å; L101-L174 HydrophobicContact CD1-CD1 3.84Å; R170-L174 PolarHBondContact O-N 3.18Å; R170-L174 VanDerWaalsContact O-N 3.1Å; Y171-L174 WeakPolarHBondContact O-CB 3.45Å; Y171-L174 PolarHBondContact O-N 3.29Å; L174-S176 VanDerWaalsContact C-N 3.26Å; L174-S176 PolarHBondContact O-N 2.96Å; L174-L177 WeakPolarHBondContact O-CB 3.03Å; L174-L177 PolarHBondContact O-N 3.09Å; L174-M178 HydrophobicContact CD2-CE 4.15Å; L174-M178 HydrophobicContact CD2-CG 3.88Å; L174-M178 HydrophobicContact CD2-SD 3.14Å; L174-M178 WeakPolarHBondContact CD2-SD 3.44Å; L174-M178 VanDerWaalsContact O-CG 3.26Å; L174-M178 WeakPolarHBondContact O-CG 3.22Å; L174-M178 PolarHBondContact O-N 3.45Å
175	I	71.6	Confident	74.5	Confident	76 Å²	76	87.9 Å²	87.9	39%	0.39	44%	0.435	S	S	.	.	H	α-helix	trans	-58.9	-38.6	174.6	-62.5	164.3	0	0	0	111.8	Y171 L177 M178	Y171-I175 HydrophobicContact CD1-CD1 3.44Å; Y171-I175 VanDerWaalsContact CD1-CD1 3.44Å; Y171-I175 HydrophobicContact CD1-CG1 4.23Å; Y171-I175 HydrophobicContact CD2-CD1 4.23Å; Y171-I175 HydrophobicContact CD2-CG1 4.17Å; Y171-I175 HydrophobicContact CE1-CD1 3.04Å; Y171-I175 HydrophobicContact CE1-CG1 3.95Å; Y171-I175 HydrophobicContact CE2-CD1 3.92Å; Y171-I175 HydrophobicContact CE2-CG1 3.89Å; Y171-I175 HydrophobicContact CG-CD1 4.06Å; Y171-I175 HydrophobicContact CG-CG1 4.38Å; Y171-I175 WeakPolarHBondContact O-CG1 3.47Å; Y171-I175 PolarHBondContact O-N 3.21Å; I175-L177 PolarHBondContact O-N 3.41Å; I175-M178 WeakPolarHBondContact CA-SD 3.2Å; I175-M178 HydrophobicContact CB-SD 4.45Å; I175-M178 HydrophobicContact CG1-SD 4.38Å; I175-M178 PolarHBondContact O-N 2.79Å
176	S	78.1	Confident	73.8	Confident	85 Å²	85	89.2 Å²	89.2	59%	0.594	44%	0.436	S	S	*	.	H	α-helix	trans	-69.2	-17.1	178.2	72.2	0	0	0	0	114.4	D172 F173 L174	D172-S176 PolarHBondContact O-N 3.17Å; F173-S176 WeakPolarHBondContact CA-OG 3.39Å; F173-S176 PolarHBondContact O-N 3.11Å; F173-S176 PolarHBondContact O-OG 3.12Å; L174-S176 VanDerWaalsContact C-N 3.26Å; L174-S176 PolarHBondContact O-N 2.96Å
177	L	70	Confident	73.3	Confident	99 Å²	99	91.3 Å²	91.3	52%	0.518	44%	0.444	S	S	.	.	H	α-helix	trans	-90.3	-19.2	178.5	-171.5	67.6	0	0	0	112.5	F173 L174 I175	F173-L177 PolarHBondContact O-N 3.21Å; L174-L177 WeakPolarHBondContact O-CB 3.03Å; L174-L177 PolarHBondContact O-N 3.09Å; I175-L177 PolarHBondContact O-N 3.41Å
178	M	66.1	Low	73	Confident	106 Å²	106	90.5 Å²	90.5	52%	0.522	43%	0.426	S	S	.	.			trans	-82.3	0	-179.3	-62.5	150.9	86.4	0	0	110.7	S55 L174 I175	S55-M178 WeakPolarHBondContact OG-CE 3.46Å; L174-M178 HydrophobicContact CD2-CE 4.15Å; L174-M178 HydrophobicContact CD2-CG 3.88Å; L174-M178 HydrophobicContact CD2-SD 3.14Å; L174-M178 WeakPolarHBondContact CD2-SD 3.44Å; L174-M178 VanDerWaalsContact O-CG 3.26Å; L174-M178 WeakPolarHBondContact O-CG 3.22Å; L174-M178 PolarHBondContact O-N 3.45Å; I175-M178 WeakPolarHBondContact CA-SD 3.2Å; I175-M178 HydrophobicContact CB-SD 4.45Å; I175-M178 HydrophobicContact CG1-SD 4.38Å; I175-M178 PolarHBondContact O-N 2.79Å

Retrieved 178 of 178 residues in 285.3 ms (Link to these results)

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