A0A077ZK16_TRITR Loading...

NADH:ubiquinone reductase (H(+)-translocating)

Core subunit of the mitochondrial membrane respiratory chain NADH dehydrogenase (Complex I) that is believed to belong to the minimal assembly required for catalysis. Complex I functions in the transfer of electrons from NADH to the respiratory chain. The immediate electron acceptor for the enzyme is believed to be ubiquinone.

AlphaFold DB , UniProt , Accession A0A077ZK16, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 196 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	30.2	Very low	35.7	Very low	156 Å²	156	102.3 Å²	102.3	77%	0.768	51%	0.505	S	S	*	.				0	-57.5	0	-156.2	178.9	-158.6	0	0	110.7	I3 R4 Y5 V61	M1-I3 PolarHBondContact O-N 3.46Å; M1-R4 WeakPolarHBondContact O-CB 3.19Å; M1-R4 PolarHBondContact O-N 3.2Å; M1-Y5 HydrophobicContact CE-CE2 4.08Å; M1-Y5 HydrophobicContact CG-CD2 3.95Å; M1-Y5 HydrophobicContact CG-CE2 3.79Å; M1-Y5 WeakPolarHBondContact O-CD2 3.43Å; M1-Y5 PolarHBondContact O-N 3.14Å; M1-Y5 HydrophobicContact SD-CE2 4.44Å; M1-V61 HydrophobicContact CE-CG1 4.47Å; M1-V61 HydrophobicContact CE-CG2 4.07Å
2	I	28.7	Very low	37.1	Very low	104 Å²	104	97.2 Å²	97.2	53%	0.533	48%	0.481	S	S	.	.	H	α-helix	trans	-49.8	-55	178.2	-62.4	170.7	0	0	0	111.9	R4 Y5 T6	I2-R4 PolarHBondContact O-N 3.07Å; I2-R4 VanDerWaalsContact O-N 3.14Å; I2-Y5 CarbonylContact O-C 3.6Å; I2-Y5 WeakPolarHBondContact O-CA 3.41Å; I2-Y5 WeakPolarHBondContact O-CB 3.42Å; I2-Y5 PolarHBondContact O-N 3.21Å; I2-T6 PolarHBondContact O-N 3.3Å; I2-T6 PolarHBondContact O-OG1 2.91Å
3	I	30.1	Very low	37.8	Very low	129 Å²	129	90.8 Å²	90.8	66%	0.662	45%	0.45	S	S	*	.	H	α-helix	trans	-56.4	-34.6	179.5	-60.4	171.8	0	0	0	113.2	M1 T6 L7	M1-I3 PolarHBondContact O-N 3.46Å; I3-T6 WeakPolarHBondContact CA-OG1 3.38Å; I3-T6 WeakPolarHBondContact O-CB 3.37Å; I3-T6 PolarHBondContact O-N 3.35Å; I3-L7 HydrophobicContact CG2-CD1 4.13Å; I3-L7 WeakPolarHBondContact O-CG 3.25Å; I3-L7 PolarHBondContact O-N 2.98Å
4	R	30.8	Very low	38.4	Very low	215 Å²	215	88.9 Å²	88.9	81%	0.811	45%	0.447	S	S	*	.	H	α-helix	trans	-76	-34.6	179.3	-141.1	176.4	-177.8	-175.8	0.2	111.5	M1 I2 C8	M1-R4 WeakPolarHBondContact O-CB 3.19Å; M1-R4 PolarHBondContact O-N 3.2Å; I2-R4 PolarHBondContact O-N 3.07Å; I2-R4 VanDerWaalsContact O-N 3.14Å; R4-C8 WeakPolarHBondContact O-CB 3.34Å; R4-C8 PolarHBondContact O-N 2.95Å; R4-C8 VanDerWaalsContact O-N 3.1Å
5	Y	31.8	Very low	38.5	Very low	88 Å²	88	90 Å²	90	35%	0.345	47%	0.466	S	S	.	.	H	α-helix	trans	-66.3	-39.5	168.2	-89.5	-88.9	0	0	0	111.3	M1 I2 C8 F9	M1-Y5 HydrophobicContact CE-CE2 4.08Å; M1-Y5 HydrophobicContact CG-CD2 3.95Å; M1-Y5 HydrophobicContact CG-CE2 3.79Å; M1-Y5 WeakPolarHBondContact O-CD2 3.43Å; M1-Y5 PolarHBondContact O-N 3.14Å; M1-Y5 HydrophobicContact SD-CE2 4.44Å; I2-Y5 CarbonylContact O-C 3.6Å; I2-Y5 WeakPolarHBondContact O-CA 3.41Å; I2-Y5 WeakPolarHBondContact O-CB 3.42Å; I2-Y5 PolarHBondContact O-N 3.21Å; Y5-C8 PolarHBondContact O-N 3.15Å; Y5-F9 VanDerWaalsContact O-CB 3.26Å; Y5-F9 WeakPolarHBondContact O-CB 3.42Å; Y5-F9 PolarHBondContact O-N 2.99Å
6	T	36	Very low	38.5	Very low	40 Å²	40	96.6 Å²	96.6	25%	0.245	49%	0.494	C	S	.	.	H	α-helix	trans	-62.5	-49.3	177.3	-34.2	0	0	0	0	112.1	I2 I3 C8 F9 T10 L132	I2-T6 PolarHBondContact O-N 3.3Å; I2-T6 PolarHBondContact O-OG1 2.91Å; I3-T6 WeakPolarHBondContact CA-OG1 3.38Å; I3-T6 WeakPolarHBondContact O-CB 3.37Å; I3-T6 PolarHBondContact O-N 3.35Å; T6-C8 VanDerWaalsContact C-N 3.34Å; T6-C8 PolarHBondContact O-N 3.43Å; T6-F9 PolarHBondContact O-N 3.04Å; T6-T10 WeakPolarHBondContact O-CG2 3.43Å; T6-T10 PolarHBondContact O-N 3.1Å; T6-T10 PolarHBondContact O-OG1 2.72Å; T6-L132 HydrophobicContact CG2-CD1 3.11Å; T6-L132 HydrophobicContact CG2-CD2 4.32Å; T6-L132 HydrophobicContact CG2-CG 4.33Å
7	L	34.8	Very low	38.4	Very low	101 Å²	101	95.9 Å²	95.9	53%	0.529	50%	0.501	S	S	.	.	H	α-helix	trans	-65.7	-36.5	178.8	-76.5	166.8	0	0	0	112.5	I3 T10 N11	I3-L7 HydrophobicContact CG2-CD1 4.13Å; I3-L7 WeakPolarHBondContact O-CG 3.25Å; I3-L7 PolarHBondContact O-N 2.98Å; L7-T10 WeakPolarHBondContact CA-OG1 3.18Å; L7-T10 PolarHBondContact O-OG1 3.15Å; L7-N11 WeakPolarHBondContact O-CB 3.37Å; L7-N11 VanDerWaalsContact O-CG 3.25Å; L7-N11 PolarHBondContact O-N 3.16Å; L7-N11 PolarHBondContact O-ND2 3.39Å
8	C	37.6	Very low	38.1	Very low	67 Å²	67	97.4 Å²	97.4	45%	0.453	52%	0.515	S	S	.	.	H	α-helix	trans	-63.4	-46.2	172.8	-162.1	0	0	0	0	110.3	R4 Y5 T6 N11 I12	R4-C8 WeakPolarHBondContact O-CB 3.34Å; R4-C8 PolarHBondContact O-N 2.95Å; R4-C8 VanDerWaalsContact O-N 3.1Å; Y5-C8 PolarHBondContact O-N 3.15Å; T6-C8 VanDerWaalsContact C-N 3.34Å; T6-C8 PolarHBondContact O-N 3.43Å; C8-N11 PolarHBondContact O-N 2.92Å; C8-I12 VanDerWaalsContact O-CD1 3.24Å; C8-I12 WeakPolarHBondContact O-CD1 3.31Å; C8-I12 WeakPolarHBondContact O-CG1 2.85Å; C8-I12 PolarHBondContact O-N 3.11Å; C8-I12 VanDerWaalsContact O-N 3.13Å
9	F	43.2	Very low	38.1	Very low	34 Å²	34	99.2 Å²	99.2	15%	0.149	52%	0.524	C	S	.	.	H	α-helix	trans	-66.8	-37.7	-179.2	-165	-90.2	0	0	0	113.3	Y5 T6 N11 I12 L13 L68 V119 I123 I131 I135	Y5-F9 VanDerWaalsContact O-CB 3.26Å; Y5-F9 WeakPolarHBondContact O-CB 3.42Å; Y5-F9 PolarHBondContact O-N 2.99Å; T6-F9 PolarHBondContact O-N 3.04Å; F9-N11 VanDerWaalsContact C-N 3.29Å; F9-N11 PolarHBondContact O-N 2.96Å; F9-I12 PolarHBondContact O-N 3.44Å; F9-L13 HydrophobicContact CE1-CD1 4.47Å; F9-L68 HydrophobicContact CD2-CD1 3.85Å; F9-L68 HydrophobicContact CE2-CD1 4.02Å; F9-V119 HydrophobicContact CZ-CG1 4.31Å; F9-I123 HydrophobicContact CE2-CD1 4.11Å; F9-I123 HydrophobicContact CZ-CD1 3.65Å; F9-I123 HydrophobicContact CZ-CG1 3.83Å; F9-I131 HydrophobicContact CD1-CG2 4.47Å; F9-I131 HydrophobicContact CE1-CB 4.47Å; F9-I131 HydrophobicContact CE1-CG2 3.46Å; F9-I131 VanDerWaalsContact CE1-CG2 3.46Å; F9-I131 HydrophobicContact CZ-CG2 3.83Å; F9-I135 HydrophobicContact CE1-CD1 4.3Å; F9-I135 HydrophobicContact CZ-CD1 4.3Å
10	T	42.4	Very low	37.7	Very low	52 Å²	52	101.7 Å²	101.7	32%	0.319	54%	0.538	S	S	.	.	H	α-helix	trans	-66.8	-31	175.3	50.8	0	0	0	0	112.9	T6 L7	T6-T10 WeakPolarHBondContact O-CG2 3.43Å; T6-T10 PolarHBondContact O-N 3.1Å; T6-T10 PolarHBondContact O-OG1 2.72Å; L7-T10 WeakPolarHBondContact CA-OG1 3.18Å; L7-T10 PolarHBondContact O-OG1 3.15Å
11	N	47.1	Very low	37.7	Very low	139 Å²	139	103.2 Å²	103.2	74%	0.743	56%	0.556	S	S	*	*	H	α-helix	trans	-80.9	-18.4	177.6	-72	-5.3	0	0	0	113.4	L7 C8 F9	L7-N11 WeakPolarHBondContact O-CB 3.37Å; L7-N11 VanDerWaalsContact O-CG 3.25Å; L7-N11 PolarHBondContact O-N 3.16Å; L7-N11 PolarHBondContact O-ND2 3.39Å; C8-N11 PolarHBondContact O-N 2.92Å; F9-N11 VanDerWaalsContact C-N 3.29Å; F9-N11 PolarHBondContact O-N 2.96Å
12	I	52.7	Low	38.3	Very low	41 Å²	41	101.2 Å²	101.2	21%	0.21	55%	0.552	C	S	.	*	H	α-helix	trans	-82.8	-19.1	178.2	-73.8	160.7	0	0	0	112	C8 F9 P14 I72	C8-I12 VanDerWaalsContact O-CD1 3.24Å; C8-I12 WeakPolarHBondContact O-CD1 3.31Å; C8-I12 WeakPolarHBondContact O-CG1 2.85Å; C8-I12 PolarHBondContact O-N 3.11Å; C8-I12 VanDerWaalsContact O-N 3.13Å; F9-I12 PolarHBondContact O-N 3.44Å; I12-P14 WeakPolarHBondContact O-CD 3.45Å; I12-I72 HydrophobicContact CD1-CD1 3.86Å; I12-I72 HydrophobicContact CD1-CG1 4.4Å; I12-I72 HydrophobicContact CG1-CD1 4.43Å; I12-I72 HydrophobicContact CG2-CD1 4.35Å; I12-I72 HydrophobicContact CG2-CG1 3.72Å
13	L	45.5	Very low	38.8	Very low	15 Å²	15	100.6 Å²	100.6	8%	0.079	56%	0.562	C	S	.	*	S	Bend	trans	-69.5	118.8	-178.2	-73.6	161.4	0	0	0	110.1	F9 S15 I123 K128	F9-L13 HydrophobicContact CE1-CD1 4.47Å; L13-S15 PolarHBondContact O-N 3.46Å; L13-I123 HydrophobicContact CD2-CG2 4.42Å; L13-K128 HydrophobicContact CB-CD 4.28Å; L13-K128 HydrophobicContact CD1-CB 3.99Å; L13-K128 HydrophobicContact CD1-CD 3.49Å; L13-K128 VanDerWaalsContact CD1-CD 3.49Å; L13-K128 HydrophobicContact CD1-CG 3.62Å; L13-K128 HydrophobicContact CG-CD 4.5Å
14	P	46.3	Very low	39.6	Very low	63 Å²	63	103.4 Å²	103.4	41%	0.409	57%	0.573	S	S	.	*	P	Polyproline II helix	trans	-62.9	127.2	-171.9	28.3	-35.9	0	0	0	109.6	I12 I75	I12-P14 WeakPolarHBondContact O-CD 3.45Å; P14-I75 HydrophobicContact CB-CG2 4.11Å; P14-I75 HydrophobicContact CG-CG2 3.63Å
15	S	40.6	Very low	40.3	Very low	106 Å²	106	98.9 Å²	98.9	74%	0.741	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-66.3	132.3	158.5	48.7	0	0	0	0	108	L13 S17	L13-S15 PolarHBondContact O-N 3.46Å; S15-S17 PolarHBondContact O-N 3.1Å; S15-S17 VanDerWaalsContact O-N 3.14Å
16	E	37.6	Very low	41.6	Very low	195 Å²	195	98.4 Å²	98.4	91%	0.911	57%	0.573	S	S	*	*			trans	-40.1	115.2	178.7	-68.4	170.7	147	0	0	112.8
17	S	36.9	Very low	42.6	Very low	86 Å²	86	103.2 Å²	103.2	60%	0.601	60%	0.597	S	S	*	*			trans	-149.5	91.8	152.7	61.9	0	0	0	0	108.5	S15 D19	S15-S17 PolarHBondContact O-N 3.1Å; S15-S17 VanDerWaalsContact O-N 3.14Å; S17-D19 PolarHBondContact O-N 3.45Å; S17-D19 VanDerWaalsContact O-N 3.1Å
18	T	33.1	Very low	43.7	Very low	123 Å²	123	102 Å²	102	76%	0.755	60%	0.597	S	S	*	*			trans	-68.2	88	169	48.1	0	0	0	0	109.6
19	D	37.8	Very low	44.8	Very low	130 Å²	130	101.4 Å²	101.4	70%	0.695	59%	0.587	S	S	*	*			trans	-109.4	109	167.4	-74.7	-21.8	0	0	0	110.6	S17 C21	S17-D19 PolarHBondContact O-N 3.45Å; S17-D19 VanDerWaalsContact O-N 3.1Å; D19-C21 PolarHBondContact O-N 3.49Å; D19-C21 VanDerWaalsContact O-N 3.11Å
20	N	31.8	Very low	45.6	Very low	150 Å²	150	102.5 Å²	102.5	80%	0.802	59%	0.594	S	S	*	*			trans	-55.4	102	171.9	-67.6	-43.1	0	0	0	110.5
21	C	37.6	Very low	46.5	Very low	134 Å²	134	102.7 Å²	102.7	91%	0.905	60%	0.598	S	S	*	*			trans	-125.4	95.6	153.7	-135.2	0	0	0	0	109	D19	D19-C21 PolarHBondContact O-N 3.49Å; D19-C21 VanDerWaalsContact O-N 3.11Å
22	T	41.2	Very low	47.3	Very low	113 Å²	113	102.6 Å²	102.6	69%	0.693	59%	0.59	S	S	*	*			trans	-74.3	132.5	-168.8	43.7	0	0	0	0	113.4	E24	T22-E24 PolarHBondContact O-N 3.27Å
23	A	40.6	Very low	47.8	Very low	91 Å²	91	101.2 Å²	101.2	75%	0.752	58%	0.584	S	S	*	*	S	Bend		79.6	-7.5	128.9	0	0	0	0	0	123
24	E	46.8	Very low	48.8	Very low	189 Å²	189	104.8 Å²	104.8	88%	0.883	60%	0.602	S	S	*	*	S	Bend	trans	-108.6	10.8	-179.9	-69.6	-159	153.6	0	0	117	T22	T22-E24 PolarHBondContact O-N 3.27Å
25	L	45.4	Very low	49.7	Very low	120 Å²	120	105.8 Å²	105.8	63%	0.628	61%	0.607	S	S	*	*	S	Bend	trans	-120.2	18.2	-177.8	-108.4	101	0	0	0	116.1	Q29	L25-Q29 HydrophobicContact CD2-CG 4.27Å; L25-Q29 WeakPolarHBondContact O-CB 3.47Å; L25-Q29 WeakPolarHBondContact O-CG 3.26Å; L25-Q29 PolarHBondContact O-OE1 3.21Å; L25-Q29 VanDerWaalsContact O-OE1 3.14Å
26	S	57.9	Low	50.9	Low	77 Å²	77	103.3 Å²	103.3	54%	0.538	58%	0.582	S	S	.	*	H	α-helix	trans	-76.5	-42.8	-162	59	0	0	0	0	115.9	L30	S26-L30 WeakPolarHBondContact O-CB 3.24Å; S26-L30 PolarHBondContact O-N 3.43Å
27	L	57.3	Low	52.2	Low	141 Å²	141	94.8 Å²	94.8	74%	0.738	54%	0.542	S	S	*	.	H	α-helix	trans	-73.7	-41.4	-167.7	-101.5	162.3	0	0	0	115	S31	L27-S31 VanDerWaalsContact O-CB 3.29Å; L27-S31 WeakPolarHBondContact O-CB 3.42Å; L27-S31 PolarHBondContact O-N 3.27Å; L27-S31 PolarHBondContact O-OG 3.31Å
28	C	57.3	Low	53.5	Low	77 Å²	77	93 Å²	93	52%	0.52	53%	0.529	S	S	.	.	H	α-helix	trans	-74.5	-34	179.6	-175.8	0	0	0	0	111.9	S31 K32	C28-S31 WeakPolarHBondContact CA-OG 3.45Å; C28-S31 PolarHBondContact O-OG 2.92Å; C28-K32 WeakPolarHBondContact O-CB 3.18Å; C28-K32 VanDerWaalsContact O-CG 3.22Å; C28-K32 WeakPolarHBondContact O-CG 3.28Å; C28-K32 PolarHBondContact O-N 3.13Å
29	Q	61.2	Low	55	Low	54 Å²	54	90.9 Å²	90.9	25%	0.252	51%	0.513	S	S	.	.	H	α-helix	trans	-73.1	-41.3	175	-67.4	-177.2	-30.6	0	0	111.2	L25 K32 L33	L25-Q29 HydrophobicContact CD2-CG 4.27Å; L25-Q29 WeakPolarHBondContact O-CB 3.47Å; L25-Q29 WeakPolarHBondContact O-CG 3.26Å; L25-Q29 PolarHBondContact O-OE1 3.21Å; L25-Q29 VanDerWaalsContact O-OE1 3.14Å; Q29-K32 PolarHBondContact O-N 3Å; Q29-L33 WeakPolarHBondContact O-CB 3.44Å; Q29-L33 PolarHBondContact O-N 2.87Å
30	L	59.5	Low	56.4	Low	57 Å²	57	85.2 Å²	85.2	30%	0.298	48%	0.482	S	S	.	.	H	α-helix	trans	-65.8	-38.8	174.1	-167.9	115.2	0	0	0	111.4	S26 L33 I34	S26-L30 WeakPolarHBondContact O-CB 3.24Å; S26-L30 PolarHBondContact O-N 3.43Å; L30-L33 WeakPolarHBondContact O-CB 3.28Å; L30-L33 PolarHBondContact O-N 2.99Å; L30-I34 HydrophobicContact CD2-CD1 3.5Å; L30-I34 HydrophobicContact CG-CD1 3.86Å; L30-I34 WeakPolarHBondContact O-CB 3.25Å; L30-I34 WeakPolarHBondContact O-CD1 3.48Å; L30-I34 WeakPolarHBondContact O-CG1 3.18Å; L30-I34 PolarHBondContact O-N 3.48Å
31	S	61.5	Low	58	Low	56 Å²	56	79 Å²	79	39%	0.392	45%	0.449	S	S	.	.	H	α-helix	trans	-66.1	-43.6	174.5	73.2	0	0	0	0	111.7	L27 C28 L33 I34 T35	L27-S31 VanDerWaalsContact O-CB 3.29Å; L27-S31 WeakPolarHBondContact O-CB 3.42Å; L27-S31 PolarHBondContact O-N 3.27Å; L27-S31 PolarHBondContact O-OG 3.31Å; C28-S31 WeakPolarHBondContact CA-OG 3.45Å; C28-S31 PolarHBondContact O-OG 2.92Å; S31-L33 VanDerWaalsContact C-N 3.33Å; S31-L33 PolarHBondContact O-N 3.35Å; S31-I34 PolarHBondContact O-N 3.34Å; S31-T35 WeakPolarHBondContact O-CB 3.29Å; S31-T35 VanDerWaalsContact O-CG2 3.3Å; S31-T35 WeakPolarHBondContact O-CG2 3.31Å; S31-T35 PolarHBondContact O-N 3.38Å; S31-T35 PolarHBondContact O-OG1 3.38Å; S31-T35 VanDerWaalsContact O-OG1 3.14Å
32	K	64.1	Low	59.3	Low	136 Å²	136	78.1 Å²	78.1	59%	0.591	44%	0.435	S	S	*	.	H	α-helix	trans	-59.5	-44.2	172.9	-76	173.7	-177.7	-179.9	0	111.6	C28 Q29 T35 Y36	C28-K32 WeakPolarHBondContact O-CB 3.18Å; C28-K32 VanDerWaalsContact O-CG 3.22Å; C28-K32 WeakPolarHBondContact O-CG 3.28Å; C28-K32 PolarHBondContact O-N 3.13Å; Q29-K32 PolarHBondContact O-N 3Å; K32-T35 VanDerWaalsContact CA-OG1 3.29Å; K32-T35 WeakPolarHBondContact CA-OG1 3.39Å; K32-T35 PolarHBondContact O-N 3.34Å; K32-T35 PolarHBondContact O-OG1 2.98Å; K32-Y36 WeakPolarHBondContact O-CB 3.38Å; K32-Y36 PolarHBondContact O-N 3.26Å
33	L	64.3	Low	60.6	Low	13 Å²	13	77.1 Å²	77.1	7%	0.068	42%	0.424	C	S	.	.	H	α-helix	trans	-60.1	-48.4	176	-171.8	68.8	0	0	0	111.4	Q29 L30 S31 Y36 F37 C74 L83 I86	Q29-L33 WeakPolarHBondContact O-CB 3.44Å; Q29-L33 PolarHBondContact O-N 2.87Å; L30-L33 WeakPolarHBondContact O-CB 3.28Å; L30-L33 PolarHBondContact O-N 2.99Å; S31-L33 VanDerWaalsContact C-N 3.33Å; S31-L33 PolarHBondContact O-N 3.35Å; L33-Y36 WeakPolarHBondContact O-CB 3.41Å; L33-Y36 PolarHBondContact O-N 3.12Å; L33-F37 HydrophobicContact CD1-CD2 3.92Å; L33-F37 HydrophobicContact CD1-CE2 3.38Å; L33-F37 HydrophobicContact CD1-CZ 4.33Å; L33-F37 HydrophobicContact CD2-CE2 4.13Å; L33-F37 HydrophobicContact CG-CD2 3.72Å; L33-F37 HydrophobicContact CG-CE2 3.51Å; L33-F37 WeakPolarHBondContact O-CD2 3.4Å; L33-F37 PolarHBondContact O-N 3.11Å; L33-C74 WeakPolarHBondContact CD1-SG 3.44Å; L33-L83 HydrophobicContact CD1-CD2 4.22Å; L33-L83 HydrophobicContact CD2-CD2 4.36Å; L33-I86 HydrophobicContact CD2-CD1 3.72Å; L33-I86 HydrophobicContact CG-CD1 4.49Å
34	I	65.7	Low	61.9	Low	89 Å²	89	73.3 Å²	73.3	46%	0.456	39%	0.392	S	S	.	.	H	α-helix	trans	-64.8	-41	177.2	-68.4	162.2	0	0	0	111	L30 S31 Y36 F37 S38	L30-I34 HydrophobicContact CD2-CD1 3.5Å; L30-I34 HydrophobicContact CG-CD1 3.86Å; L30-I34 WeakPolarHBondContact O-CB 3.25Å; L30-I34 WeakPolarHBondContact O-CD1 3.48Å; L30-I34 WeakPolarHBondContact O-CG1 3.18Å; L30-I34 PolarHBondContact O-N 3.48Å; S31-I34 PolarHBondContact O-N 3.34Å; I34-Y36 VanDerWaalsContact C-N 3.28Å; I34-Y36 PolarHBondContact O-N 3.48Å; I34-F37 PolarHBondContact O-N 3.02Å; I34-S38 VanDerWaalsContact O-CB 3.25Å; I34-S38 WeakPolarHBondContact O-CB 3.03Å; I34-S38 PolarHBondContact O-N 2.82Å; I34-S38 PolarHBondContact O-OG 2.93Å
35	T	65	Low	62.7	Low	84 Å²	84	64.4 Å²	64.4	52%	0.515	35%	0.35	S	S	.	.	H	α-helix	trans	-64.5	-36.6	174.8	55.9	0	0	0	0	111.4	S31 K32 S38 L39	S31-T35 WeakPolarHBondContact O-CB 3.29Å; S31-T35 VanDerWaalsContact O-CG2 3.3Å; S31-T35 WeakPolarHBondContact O-CG2 3.31Å; S31-T35 PolarHBondContact O-N 3.38Å; S31-T35 PolarHBondContact O-OG1 3.38Å; S31-T35 VanDerWaalsContact O-OG1 3.14Å; K32-T35 VanDerWaalsContact CA-OG1 3.29Å; K32-T35 WeakPolarHBondContact CA-OG1 3.39Å; K32-T35 PolarHBondContact O-N 3.34Å; K32-T35 PolarHBondContact O-OG1 2.98Å; T35-S38 VanDerWaalsContact CA-OG 3.25Å; T35-S38 WeakPolarHBondContact CA-OG 3.27Å; T35-S38 PolarHBondContact O-OG 3.1Å; T35-S38 VanDerWaalsContact O-OG 3.04Å; T35-L39 WeakPolarHBondContact O-CB 3.14Å; T35-L39 PolarHBondContact O-N 3.07Å
36	Y	66.1	Low	63.7	Low	55 Å²	55	62.6 Å²	62.6	22%	0.216	34%	0.344	C	S	.	.	H	α-helix	trans	-70.6	-44.8	179.1	-176.3	-94.6	0	0	0	111.9	K32 L33 I34 L39 I40 L66 G70	K32-Y36 WeakPolarHBondContact O-CB 3.38Å; K32-Y36 PolarHBondContact O-N 3.26Å; L33-Y36 WeakPolarHBondContact O-CB 3.41Å; L33-Y36 PolarHBondContact O-N 3.12Å; I34-Y36 VanDerWaalsContact C-N 3.28Å; I34-Y36 PolarHBondContact O-N 3.48Å; Y36-L39 PolarHBondContact O-N 3.5Å; Y36-I40 HydrophobicContact CD1-CD1 3.7Å; Y36-I40 HydrophobicContact CE1-CD1 3.13Å; Y36-I40 HydrophobicContact CE1-CG1 4.23Å; Y36-I40 WeakPolarHBondContact O-CG1 3.36Å; Y36-I40 PolarHBondContact O-N 3.32Å; Y36-L66 HydrophobicContact CE2-CD1 4.39Å; Y36-L66 HydrophobicContact CE2-CG 4.23Å; Y36-L66 PolarHBondContact OH-O 3.18Å; Y36-G70 VanDerWaalsContact CZ-CA 3.47Å; Y36-G70 WeakPolarHBondContact OH-CA 3.34Å; Y36-G70 PolarHBondContact OH-N 2.87Å
37	F	64.6	Low	64.1	Low	16 Å²	16	62.5 Å²	62.5	7%	0.07	33%	0.334	C	S	.	.	H	α-helix	trans	-65.7	-43.3	173.6	-80.5	-67.2	0	0	0	112.3	L33 I34 L39 I40 V41 L83 I86 I120	L33-F37 HydrophobicContact CD1-CD2 3.92Å; L33-F37 HydrophobicContact CD1-CE2 3.38Å; L33-F37 HydrophobicContact CD1-CZ 4.33Å; L33-F37 HydrophobicContact CD2-CE2 4.13Å; L33-F37 HydrophobicContact CG-CD2 3.72Å; L33-F37 HydrophobicContact CG-CE2 3.51Å; L33-F37 WeakPolarHBondContact O-CD2 3.4Å; L33-F37 PolarHBondContact O-N 3.11Å; I34-F37 PolarHBondContact O-N 3.02Å; F37-L39 VanDerWaalsContact C-N 3.28Å; F37-L39 PolarHBondContact O-N 3.08Å; F37-I40 PolarHBondContact O-N 2.52Å; F37-V41 WeakPolarHBondContact O-CG2 3.33Å; F37-V41 PolarHBondContact O-N 2.88Å; F37-L83 HydrophobicContact CE2-CD2 4.13Å; F37-L83 HydrophobicContact CZ-CD2 4.01Å; F37-I86 HydrophobicContact CD1-CG2 4Å; F37-I86 HydrophobicContact CD2-CG2 3.48Å; F37-I86 VanDerWaalsContact CD2-CG2 3.48Å; F37-I86 HydrophobicContact CE1-CG2 4.01Å; F37-I86 HydrophobicContact CE2-CB 4.33Å; F37-I86 HydrophobicContact CE2-CD1 4.37Å; F37-I86 HydrophobicContact CE2-CG2 3.48Å; F37-I86 VanDerWaalsContact CE2-CG2 3.48Å; F37-I86 HydrophobicContact CG-CG2 3.76Å; F37-I86 HydrophobicContact CZ-CG2 3.78Å; F37-I120 HydrophobicContact CE1-CD1 4.07Å
38	S	63.9	Low	64.4	Low	49 Å²	49	56.6 Å²	56.6	34%	0.343	30%	0.303	S	S	.	.	H	α-helix	trans	-64.8	-33.5	175.7	54.8	0	0	0	0	111.8	I34 T35 V41 I42	I34-S38 VanDerWaalsContact O-CB 3.25Å; I34-S38 WeakPolarHBondContact O-CB 3.03Å; I34-S38 PolarHBondContact O-N 2.82Å; I34-S38 PolarHBondContact O-OG 2.93Å; T35-S38 VanDerWaalsContact CA-OG 3.25Å; T35-S38 WeakPolarHBondContact CA-OG 3.27Å; T35-S38 PolarHBondContact O-OG 3.1Å; T35-S38 VanDerWaalsContact O-OG 3.04Å; S38-V41 PolarHBondContact O-N 3.46Å; S38-I42 VanDerWaalsContact O-CB 3.23Å; S38-I42 WeakPolarHBondContact O-CB 3.29Å; S38-I42 VanDerWaalsContact O-CG1 3.27Å; S38-I42 WeakPolarHBondContact O-CG1 3.32Å; S38-I42 PolarHBondContact O-N 3.22Å
39	L	66.3	Low	64.7	Low	78 Å²	78	55.3 Å²	55.3	41%	0.408	29%	0.293	S	S	.	.	H	α-helix	trans	-67.7	-39.8	171.9	-166	139.2	0	0	0	112.1	T35 Y36 F37 L43 L44 L66	T35-L39 WeakPolarHBondContact O-CB 3.14Å; T35-L39 PolarHBondContact O-N 3.07Å; Y36-L39 PolarHBondContact O-N 3.5Å; F37-L39 VanDerWaalsContact C-N 3.28Å; F37-L39 PolarHBondContact O-N 3.08Å; L39-L43 HydrophobicContact CD1-CD1 4.31Å; L39-L43 HydrophobicContact CD2-CB 4.36Å; L39-L43 HydrophobicContact CG-CB 3.95Å; L39-L43 HydrophobicContact CG-CD1 4.16Å; L39-L43 HydrophobicContact CG-CG 4.48Å; L39-L43 VanDerWaalsContact O-CA 3.28Å; L39-L43 WeakPolarHBondContact O-CA 3.35Å; L39-L43 WeakPolarHBondContact O-CB 3.45Å; L39-L43 PolarHBondContact O-N 2.92Å; L39-L44 PolarHBondContact O-N 3.05Å; L39-L66 HydrophobicContact CD2-CD2 4.15Å
40	I	67.2	Low	64.8	Low	10 Å²	10	60.2 Å²	60.2	5%	0.051	32%	0.315	C	S	.	.	H	α-helix	trans	-65.4	-38.3	173.2	-73.1	166.8	0	0	0	111.9	Y36 F37 L44 L66 V67 I113	Y36-I40 HydrophobicContact CD1-CD1 3.7Å; Y36-I40 HydrophobicContact CE1-CD1 3.13Å; Y36-I40 HydrophobicContact CE1-CG1 4.23Å; Y36-I40 WeakPolarHBondContact O-CG1 3.36Å; Y36-I40 PolarHBondContact O-N 3.32Å; F37-I40 PolarHBondContact O-N 2.52Å; I40-L44 HydrophobicContact CG2-CD2 4.32Å; I40-L44 WeakPolarHBondContact O-CB 2.84Å; I40-L66 HydrophobicContact CG1-CD2 4.3Å; I40-V67 HydrophobicContact CD1-CB 4.46Å; I40-V67 HydrophobicContact CD1-CG2 3.9Å; I40-V67 HydrophobicContact CG1-CG2 4.13Å; I40-V67 HydrophobicContact CG2-CG2 4.01Å; I40-I113 HydrophobicContact CG2-CG2 4.37Å
41	V	63.6	Low	64.8	Low	19 Å²	19	62 Å²	62	12%	0.115	32%	0.321	C	S	.	.	H	α-helix	trans	-78.2	-40	-177.2	176.5	0	0	0	0	112	F37 S38 P45 T90 I97	F37-V41 WeakPolarHBondContact O-CG2 3.33Å; F37-V41 PolarHBondContact O-N 2.88Å; S38-V41 PolarHBondContact O-N 3.46Å; V41-P45 VanDerWaalsContact O-CD 3.22Å; V41-P45 WeakPolarHBondContact O-CD 3.33Å; V41-P45 WeakPolarHBondContact O-CG 3.49Å; V41-T90 HydrophobicContact CG2-CG2 3.45Å; V41-T90 VanDerWaalsContact CG2-CG2 3.45Å; V41-I97 HydrophobicContact CG1-CD1 4.37Å
42	I	65.7	Low	64.5	Low	116 Å²	116	60.2 Å²	60.2	60%	0.595	31%	0.308	S	S	*	.	H	α-helix	trans	-94.3	-40.8	-172	-59.4	169	0	0	0	111.4	S38 T46	S38-I42 VanDerWaalsContact O-CB 3.23Å; S38-I42 WeakPolarHBondContact O-CB 3.29Å; S38-I42 VanDerWaalsContact O-CG1 3.27Å; S38-I42 WeakPolarHBondContact O-CG1 3.32Å; S38-I42 PolarHBondContact O-N 3.22Å; I42-T46 PolarHBondContact O-OG1 3.03Å
43	L	68.1	Low	64.2	Low	92 Å²	92	61.3 Å²	61.3	48%	0.482	32%	0.32	S	S	.	.	H	α-helix	trans	-92.3	-26.5	-170.2	-143.6	133.7	0	0	0	112.5	L39 T46 F47	L39-L43 HydrophobicContact CD1-CD1 4.31Å; L39-L43 HydrophobicContact CD2-CB 4.36Å; L39-L43 HydrophobicContact CG-CB 3.95Å; L39-L43 HydrophobicContact CG-CD1 4.16Å; L39-L43 HydrophobicContact CG-CG 4.48Å; L39-L43 VanDerWaalsContact O-CA 3.28Å; L39-L43 WeakPolarHBondContact O-CA 3.35Å; L39-L43 WeakPolarHBondContact O-CB 3.45Å; L39-L43 PolarHBondContact O-N 2.92Å; L43-T46 VanDerWaalsContact CA-OG1 3.3Å; L43-T46 WeakPolarHBondContact CA-OG1 3.44Å; L43-T46 PolarHBondContact O-OG1 3.45Å; L43-F47 WeakPolarHBondContact O-CB 3.33Å; L43-F47 PolarHBondContact O-N 3.03Å
44	L	67.9	Low	63.7	Low	12 Å²	12	68.4 Å²	68.4	6%	0.063	35%	0.351	C	S	.	.	H	α-helix	trans	-69	-45.8	179.7	-148.4	81.4	0	0	0	113.5	L39 I40 T46 F47 I48 L66 V67 I113	L39-L44 PolarHBondContact O-N 3.05Å; I40-L44 HydrophobicContact CG2-CD2 4.32Å; I40-L44 WeakPolarHBondContact O-CB 2.84Å; L44-T46 VanDerWaalsContact C-N 3.32Å; L44-T46 PolarHBondContact O-N 3.08Å; L44-F47 PolarHBondContact O-N 3.43Å; L44-I48 HydrophobicContact CD2-CD1 4.47Å; L44-I48 HydrophobicContact CG-CD1 4.25Å; L44-I48 WeakPolarHBondContact O-CB 3.42Å; L44-I48 WeakPolarHBondContact O-CD1 3.44Å; L44-I48 WeakPolarHBondContact O-CG1 3.32Å; L44-I48 PolarHBondContact O-N 3.1Å; L44-L66 HydrophobicContact CD1-CD2 4.38Å; L44-V67 HydrophobicContact CD2-CG2 4.44Å; L44-I113 HydrophobicContact CB-CD1 4Å; L44-I113 HydrophobicContact CD2-CD1 3.93Å; L44-I113 HydrophobicContact CD2-CG1 3.61Å
45	P	63.6	Low	63.2	Low	2 Å²	2	70.7 Å²	70.7	1%	0.013	35%	0.354	C	S	.	.	H	α-helix	trans	-63.1	-39.6	175.4	-11.7	21.9	0	0	0	111.7	V41 I48 V49 A109 Y110 I113	V41-P45 VanDerWaalsContact O-CD 3.22Å; V41-P45 WeakPolarHBondContact O-CD 3.33Å; V41-P45 WeakPolarHBondContact O-CG 3.49Å; P45-I48 PolarHBondContact O-N 3.14Å; P45-V49 WeakPolarHBondContact O-CB 3.46Å; P45-V49 WeakPolarHBondContact O-CG2 3.25Å; P45-V49 PolarHBondContact O-N 3.44Å; P45-A109 HydrophobicContact CB-CB 4.36Å; P45-Y110 HydrophobicContact CB-CD1 4.47Å; P45-Y110 HydrophobicContact CB-CD2 4.39Å; P45-Y110 HydrophobicContact CB-CE1 4Å; P45-Y110 HydrophobicContact CB-CE2 3.88Å; P45-Y110 HydrophobicContact CG-CD1 3.84Å; P45-Y110 HydrophobicContact CG-CE1 3.3Å; P45-Y110 HydrophobicContact CG-CE2 4.13Å; P45-Y110 HydrophobicContact CG-CG 4.45Å; P45-Y110 VanDerWaalsContact CG-CZ 3.48Å; P45-I113 HydrophobicContact CB-CD1 4.43Å; P45-I113 HydrophobicContact CG-CD1 3.51Å
46	T	67.5	Low	63	Low	82 Å²	82	69.4 Å²	69.4	50%	0.503	35%	0.346	S	S	.	.	H	α-helix	trans	-66.4	-40.4	177.7	50.5	0	0	0	0	111.4	I42 L43 L44 V49 H50	I42-T46 PolarHBondContact O-OG1 3.03Å; L43-T46 VanDerWaalsContact CA-OG1 3.3Å; L43-T46 WeakPolarHBondContact CA-OG1 3.44Å; L43-T46 PolarHBondContact O-OG1 3.45Å; L44-T46 VanDerWaalsContact C-N 3.32Å; L44-T46 PolarHBondContact O-N 3.08Å; T46-V49 PolarHBondContact O-N 3.45Å; T46-H50 WeakPolarHBondContact O-CB 3.11Å; T46-H50 PolarHBondContact O-N 2.94Å
47	F	65.6	Low	62.7	Low	74 Å²	74	73.3 Å²	73.3	33%	0.325	37%	0.37	S	S	.	.	H	α-helix	trans	-63.7	-43	172.9	-171.2	-96	0	0	0	112.6	L43 L44 V49 H50 F51	L43-F47 WeakPolarHBondContact O-CB 3.33Å; L43-F47 PolarHBondContact O-N 3.03Å; L44-F47 PolarHBondContact O-N 3.43Å; F47-V49 VanDerWaalsContact C-N 3.33Å; F47-V49 PolarHBondContact O-N 3.1Å; F47-H50 PolarHBondContact O-N 3.21Å; F47-F51 HydrophobicContact CZ-CD2 4.5Å; F47-F51 WeakPolarHBondContact O-CB 3.26Å; F47-F51 PolarHBondContact O-N 3.32Å
48	I	64.3	Low	62.1	Low	18 Å²	18	75.7 Å²	75.7	9%	0.092	39%	0.388	C	S	.	.	H	α-helix	trans	-61.6	-42	176.3	-69.6	162.7	0	0	0	110.7	L44 P45 S52 S59 A109	L44-I48 HydrophobicContact CD2-CD1 4.47Å; L44-I48 HydrophobicContact CG-CD1 4.25Å; L44-I48 WeakPolarHBondContact O-CB 3.42Å; L44-I48 WeakPolarHBondContact O-CD1 3.44Å; L44-I48 WeakPolarHBondContact O-CG1 3.32Å; L44-I48 PolarHBondContact O-N 3.1Å; P45-I48 PolarHBondContact O-N 3.14Å; I48-S52 WeakPolarHBondContact O-CB 3.3Å; I48-S52 PolarHBondContact O-N 3.21Å; I48-S52 VanDerWaalsContact O-N 3.11Å; I48-S52 PolarHBondContact O-OG 3.28Å; I48-S59 WeakPolarHBondContact CA-OG 3.39Å; I48-A109 HydrophobicContact CB-CB 4.23Å; I48-A109 HydrophobicContact CD1-CB 3.86Å; I48-A109 HydrophobicContact CG2-CB 3.94Å
49	V	63.7	Low	61.9	Low	49 Å²	49	73.4 Å²	73.4	30%	0.297	37%	0.372	S	S	.	.	H	α-helix	trans	-69.9	-43	179.6	174.7	0	0	0	0	111.8	P45 T46 F47 F51 S52 K106	P45-V49 WeakPolarHBondContact O-CB 3.46Å; P45-V49 WeakPolarHBondContact O-CG2 3.25Å; P45-V49 PolarHBondContact O-N 3.44Å; T46-V49 PolarHBondContact O-N 3.45Å; F47-V49 VanDerWaalsContact C-N 3.33Å; F47-V49 PolarHBondContact O-N 3.1Å; V49-F51 VanDerWaalsContact C-N 3.35Å; V49-F51 PolarHBondContact O-N 3.38Å; V49-S52 WeakPolarHBondContact CA-OG 3.39Å; V49-S52 PolarHBondContact O-OG 3.14Å; V49-K106 HydrophobicContact CG2-CB 4.47Å; V49-K106 HydrophobicContact CG2-CD 4.15Å; V49-K106 HydrophobicContact CG2-CG 3.28Å
50	H	63.7	Low	61.5	Low	158 Å²	158	72.4 Å²	72.4	73%	0.731	37%	0.367	S	S	*	.	H	α-helix	trans	-69.6	-33.2	-178	-166.3	-89.3	0	0	0	112.3	T46 F47	T46-H50 WeakPolarHBondContact O-CB 3.11Å; T46-H50 PolarHBondContact O-N 2.94Å; F47-H50 PolarHBondContact O-N 3.21Å
51	F	57.9	Low	61.3	Low	94 Å²	94	74 Å²	74	41%	0.412	38%	0.378	S	S	.	.	H	α-helix	trans	-93.6	-8.6	-177.6	-136.3	-93.1	0	0	0	114.5	F47 V49 L53	F47-F51 HydrophobicContact CZ-CD2 4.5Å; F47-F51 WeakPolarHBondContact O-CB 3.26Å; F47-F51 PolarHBondContact O-N 3.32Å; V49-F51 VanDerWaalsContact C-N 3.35Å; V49-F51 PolarHBondContact O-N 3.38Å; F51-L53 PolarHBondContact O-N 3.49Å; F51-L53 VanDerWaalsContact O-N 3.11Å
52	S	56.7	Low	61.2	Low	18 Å²	18	78.4 Å²	78.4	13%	0.126	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	14.9	-178.1	45.4	0	0	0	0	114.7	I48 V49 F54	I48-S52 WeakPolarHBondContact O-CB 3.3Å; I48-S52 PolarHBondContact O-N 3.21Å; I48-S52 VanDerWaalsContact O-N 3.11Å; I48-S52 PolarHBondContact O-OG 3.28Å; V49-S52 WeakPolarHBondContact CA-OG 3.39Å; V49-S52 PolarHBondContact O-OG 3.14Å; S52-F54 VanDerWaalsContact C-N 3.27Å
53	L	55.9	Low	61.1	Low	159 Å²	159	73.1 Å²	73.1	83%	0.832	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-16.2	169.6	-104.2	150.1	0	0	0	113.1	F51	F51-L53 PolarHBondContact O-N 3.49Å; F51-L53 VanDerWaalsContact O-N 3.11Å
54	F	54.6	Low	61	Low	163 Å²	163	69.7 Å²	69.7	72%	0.715	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-154	-19	177.1	-148	-100.5	0	0	0	116.7	S52	S52-F54 VanDerWaalsContact C-N 3.27Å
55	Y	56.5	Low	61.3	Low	136 Å²	136	71.9 Å²	71.9	53%	0.533	37%	0.368	S	S	.	.			trans	-142.1	67.8	-176	-57.4	-75	0	0	0	114.4	I57 S58 S59	Y55-I57 PolarHBondContact O-N 3.14Å; Y55-I57 VanDerWaalsContact O-N 3.1Å; Y55-S58 PolarHBondContact O-N 3.37Å; Y55-S59 PolarHBondContact O-N 2.83Å
56	T	59.1	Low	61.3	Low	57 Å²	57	74.7 Å²	74.7	35%	0.35	38%	0.382	S	S	.	.	H	α-helix	trans	-49.7	-37.9	175.2	-51.7	0	0	0	0	112.5	L60 F146	T56-L60 WeakPolarHBondContact O-CB 3.39Å; T56-L60 PolarHBondContact O-N 3Å; T56-L60 VanDerWaalsContact O-N 3.12Å; T56-F146 HydrophobicContact CG2-CD1 4.22Å; T56-F146 HydrophobicContact CG2-CE1 3.61Å; T56-F146 HydrophobicContact CG2-CZ 4.25Å
57	I	59.8	Low	61.2	Low	137 Å²	137	71.2 Å²	71.2	70%	0.703	36%	0.361	S	S	*	.	H	α-helix	trans	-68.1	-42.2	-179.7	-56.6	172.8	0	0	0	111.2	Y55 L60 V61	Y55-I57 PolarHBondContact O-N 3.14Å; Y55-I57 VanDerWaalsContact O-N 3.1Å; I57-L60 PolarHBondContact O-N 3.04Å; I57-V61 WeakPolarHBondContact O-CG2 3.42Å; I57-V61 PolarHBondContact O-N 3.01Å
58	S	53.6	Low	61.3	Low	66 Å²	66	69.6 Å²	69.6	46%	0.462	36%	0.355	S	S	.	.	H	α-helix	trans	-69.1	-40.2	-178.1	-170.7	0	0	0	0	112	Y55 L60 V61 H62	Y55-S58 PolarHBondContact O-N 3.37Å; S58-L60 VanDerWaalsContact C-N 3.3Å; S58-L60 PolarHBondContact O-N 2.74Å; S58-V61 PolarHBondContact O-N 3.09Å; S58-H62 PolarHBondContact O-N 3.41Å
59	S	58.2	Low	61.5	Low	2 Å²	2	71.5 Å²	71.5	1%	0.014	37%	0.374	C	S	.	.	H	α-helix	trans	-63.4	-39.5	175.2	-174.3	0	0	0	0	111.2	I48 Y55 H62 S63	I48-S59 WeakPolarHBondContact CA-OG 3.39Å; Y55-S59 PolarHBondContact O-N 2.83Å; S59-H62 PolarHBondContact O-N 3.25Å; S59-S63 WeakPolarHBondContact O-CB 3.49Å; S59-S63 PolarHBondContact O-N 2.67Å; S59-S63 PolarHBondContact O-OG 3.4Å
60	L	57.8	Low	61.7	Low	57 Å²	57	69.4 Å²	69.4	30%	0.298	36%	0.362	S	S	.	.	H	α-helix	trans	-65.3	-40.6	176.1	-166.1	70.1	0	0	0	112.5	T56 I57 S58 S63 S64	T56-L60 WeakPolarHBondContact O-CB 3.39Å; T56-L60 PolarHBondContact O-N 3Å; T56-L60 VanDerWaalsContact O-N 3.12Å; I57-L60 PolarHBondContact O-N 3.04Å; S58-L60 VanDerWaalsContact C-N 3.3Å; S58-L60 PolarHBondContact O-N 2.74Å; L60-S63 VanDerWaalsContact C-OG 3.3Å; L60-S63 VanDerWaalsContact CA-OG 3.23Å; L60-S63 WeakPolarHBondContact CA-OG 3.42Å; L60-S63 PolarHBondContact O-OG 3.48Å; L60-S64 VanDerWaalsContact O-CB 3.3Å; L60-S64 WeakPolarHBondContact O-CB 3.17Å; L60-S64 PolarHBondContact O-N 2.98Å; L60-S64 PolarHBondContact O-OG 3.05Å
61	V	63.7	Low	61.8	Low	44 Å²	44	62.5 Å²	62.5	27%	0.267	33%	0.331	S	S	.	.	H	α-helix	trans	-65.1	-48.6	176.9	171.7	0	0	0	0	110.3	M1 I57 S58 S63 S64 T65	M1-V61 HydrophobicContact CE-CG1 4.47Å; M1-V61 HydrophobicContact CE-CG2 4.07Å; I57-V61 WeakPolarHBondContact O-CG2 3.42Å; I57-V61 PolarHBondContact O-N 3.01Å; S58-V61 PolarHBondContact O-N 3.09Å; V61-S63 PolarHBondContact O-N 3.29Å; V61-S64 PolarHBondContact O-N 3.47Å; V61-S64 PolarHBondContact O-OG 3.22Å; V61-T65 WeakPolarHBondContact O-CG2 3.36Å; V61-T65 PolarHBondContact O-N 3.04Å; V61-T65 PolarHBondContact O-OG1 3.46Å
62	H	61.5	Low	62.3	Low	110 Å²	110	60.1 Å²	60.1	51%	0.509	32%	0.322	S	S	.	.	H	α-helix	trans	-62.9	-44.2	-178.2	-169	58	0	0	0	112.2	S58 S59 S64 T65 L66	S58-H62 PolarHBondContact O-N 3.41Å; S59-H62 PolarHBondContact O-N 3.25Å; H62-S64 PolarHBondContact O-N 2.92Å; H62-T65 WeakPolarHBondContact CA-OG1 3.46Å; H62-T65 PolarHBondContact O-N 3.47Å; H62-T65 PolarHBondContact O-OG1 3.19Å; H62-L66 PolarHBondContact O-N 3.44Å; H62-L66 VanDerWaalsContact O-N 3.08Å
63	S	63.7	Low	62.8	Low	6 Å²	6	63.9 Å²	63.9	4%	0.042	34%	0.34	C	S	.	.	H	α-helix	trans	-60.1	-43.6	173.9	48.3	0	0	0	0	112.5	S59 L60 V61 T65 L66 V67	S59-S63 WeakPolarHBondContact O-CB 3.49Å; S59-S63 PolarHBondContact O-N 2.67Å; S59-S63 PolarHBondContact O-OG 3.4Å; L60-S63 VanDerWaalsContact C-OG 3.3Å; L60-S63 VanDerWaalsContact CA-OG 3.23Å; L60-S63 WeakPolarHBondContact CA-OG 3.42Å; L60-S63 PolarHBondContact O-OG 3.48Å; V61-S63 PolarHBondContact O-N 3.29Å; S63-T65 VanDerWaalsContact C-N 3.34Å; S63-T65 PolarHBondContact O-N 2.97Å; S63-L66 PolarHBondContact O-N 3.15Å; S63-V67 WeakPolarHBondContact O-CG2 3.4Å; S63-V67 PolarHBondContact O-N 3.48Å
64	S	66.8	Low	63.3	Low	20 Å²	20	56.5 Å²	56.5	14%	0.14	30%	0.302	C	S	.	.	H	α-helix	trans	-63.5	-36.9	177	72.9	0	0	0	0	113.1	L60 V61 H62 L68	L60-S64 VanDerWaalsContact O-CB 3.3Å; L60-S64 WeakPolarHBondContact O-CB 3.17Å; L60-S64 PolarHBondContact O-N 2.98Å; L60-S64 PolarHBondContact O-OG 3.05Å; V61-S64 PolarHBondContact O-N 3.47Å; V61-S64 PolarHBondContact O-OG 3.22Å; H62-S64 PolarHBondContact O-N 2.92Å; S64-L68 WeakPolarHBondContact O-CB 3.44Å; S64-L68 PolarHBondContact O-N 3.38Å
65	T	72.6	Confident	63.9	Low	58 Å²	58	49.7 Å²	49.7	36%	0.356	27%	0.272	S	S	.	.	H	α-helix	trans	-68.6	-38.6	177.6	51.7	0	0	0	0	112.4	V61 H62 S63 A69	V61-T65 WeakPolarHBondContact O-CG2 3.36Å; V61-T65 PolarHBondContact O-N 3.04Å; V61-T65 PolarHBondContact O-OG1 3.46Å; H62-T65 WeakPolarHBondContact CA-OG1 3.46Å; H62-T65 PolarHBondContact O-N 3.47Å; H62-T65 PolarHBondContact O-OG1 3.19Å; S63-T65 VanDerWaalsContact C-N 3.34Å; S63-T65 PolarHBondContact O-N 2.97Å; T65-A69 WeakPolarHBondContact O-CB 3.44Å; T65-A69 PolarHBondContact O-N 3.11Å
66	L	64.8	Low	64.5	Low	61 Å²	61	49.9 Å²	49.9	32%	0.319	28%	0.278	S	S	.	.	H	α-helix	trans	-58.9	-62.9	173.2	-170.7	81.6	0	0	0	107.7	Y36 L39 I40 L44 H62 S63 L68 A69 G70	Y36-L66 HydrophobicContact CE2-CD1 4.39Å; Y36-L66 HydrophobicContact CE2-CG 4.23Å; Y36-L66 PolarHBondContact OH-O 3.18Å; L39-L66 HydrophobicContact CD2-CD2 4.15Å; I40-L66 HydrophobicContact CG1-CD2 4.3Å; L44-L66 HydrophobicContact CD1-CD2 4.38Å; H62-L66 PolarHBondContact O-N 3.44Å; H62-L66 VanDerWaalsContact O-N 3.08Å; S63-L66 PolarHBondContact O-N 3.15Å; L66-L68 VanDerWaalsContact C-N 3.26Å; L66-L68 PolarHBondContact O-N 2.93Å; L66-L68 VanDerWaalsContact O-N 3.09Å; L66-A69 WeakPolarHBondContact O-CA 3.4Å; L66-A69 WeakPolarHBondContact O-CB 3.42Å; L66-A69 PolarHBondContact O-N 3.31Å; L66-G70 PolarHBondContact O-N 3.11Å
67	V	65.7	Low	64.8	Low	9 Å²	9	50.3 Å²	50.3	6%	0.055	28%	0.278	C	S	.	.	H	α-helix	trans	-49	-46.7	-177.4	177	0	0	0	0	112	I40 L44 S63 G70 T71 F116 I120	I40-V67 HydrophobicContact CD1-CB 4.46Å; I40-V67 HydrophobicContact CD1-CG2 3.9Å; I40-V67 HydrophobicContact CG1-CG2 4.13Å; I40-V67 HydrophobicContact CG2-CG2 4.01Å; L44-V67 HydrophobicContact CD2-CG2 4.44Å; S63-V67 WeakPolarHBondContact O-CG2 3.4Å; S63-V67 PolarHBondContact O-N 3.48Å; V67-G70 PolarHBondContact O-N 2.72Å; V67-T71 WeakPolarHBondContact O-CG2 3.4Å; V67-T71 PolarHBondContact O-N 3.33Å; V67-F116 HydrophobicContact CG1-CB 4.37Å; V67-F116 HydrophobicContact CG1-CD1 4.46Å; V67-I120 HydrophobicContact CG1-CD1 4.44Å
68	L	66.8	Low	65.2	Low	39 Å²	39	48.3 Å²	48.3	20%	0.204	27%	0.269	C	S	.	.	H	α-helix	trans	-60.3	-46.9	177.3	-174.3	67.2	0	0	0	112.9	F9 S64 L66 G70 T71 I72	F9-L68 HydrophobicContact CD2-CD1 3.85Å; F9-L68 HydrophobicContact CE2-CD1 4.02Å; S64-L68 WeakPolarHBondContact O-CB 3.44Å; S64-L68 PolarHBondContact O-N 3.38Å; L66-L68 VanDerWaalsContact C-N 3.26Å; L66-L68 PolarHBondContact O-N 2.93Å; L66-L68 VanDerWaalsContact O-N 3.09Å; L68-G70 PolarHBondContact O-N 3.37Å; L68-T71 WeakPolarHBondContact CA-OG1 3.27Å; L68-T71 PolarHBondContact O-N 2.91Å; L68-T71 PolarHBondContact O-OG1 3.49Å; L68-I72 HydrophobicContact CG-CD1 4.04Å; L68-I72 WeakPolarHBondContact O-CG1 3.49Å; L68-I72 PolarHBondContact O-N 3.24Å
69	A	68	Low	65.8	Low	59 Å²	59	47.1 Å²	47.1	49%	0.488	26%	0.257	S	S	.	.	H	α-helix	trans	-58	-38.8	176.6	0	0	0	0	0	111.9	T65 L66 I72 L73	T65-A69 WeakPolarHBondContact O-CB 3.44Å; T65-A69 PolarHBondContact O-N 3.11Å; L66-A69 WeakPolarHBondContact O-CA 3.4Å; L66-A69 WeakPolarHBondContact O-CB 3.42Å; L66-A69 PolarHBondContact O-N 3.31Å; A69-I72 PolarHBondContact O-N 3.35Å; A69-L73 PolarHBondContact O-N 2.91Å; A69-L73 VanDerWaalsContact O-N 3.11Å
70	G	68	Low	66.3	Low	4 Å²	4	49.1 Å²	49.1	4%	0.041	27%	0.268	C	S	.	.	H	α-helix	trans	-60.2	-48.7	171.6	0	0	0	0	0	113.1	Y36 L66 V67 L68 I72 L73 C74	Y36-G70 VanDerWaalsContact CZ-CA 3.47Å; Y36-G70 WeakPolarHBondContact OH-CA 3.34Å; Y36-G70 PolarHBondContact OH-N 2.87Å; L66-G70 PolarHBondContact O-N 3.11Å; V67-G70 PolarHBondContact O-N 2.72Å; L68-G70 PolarHBondContact O-N 3.37Å; G70-I72 VanDerWaalsContact C-N 3.32Å; G70-I72 PolarHBondContact O-N 3.25Å; G70-L73 PolarHBondContact O-N 3.38Å; G70-C74 PolarHBondContact O-N 2.87Å; G70-C74 VanDerWaalsContact O-N 3.15Å; G70-C74 PolarHBondContact O-SG 3.15Å
71	T	66.6	Low	66.9	Low	13 Å²	13	54.7 Å²	54.7	8%	0.08	29%	0.286	C	S	.	.	H	α-helix	trans	-61.3	-40.2	179.3	58.9	0	0	0	0	112.6	V67 L68 C74 I75 I120	V67-T71 WeakPolarHBondContact O-CG2 3.4Å; V67-T71 PolarHBondContact O-N 3.33Å; L68-T71 WeakPolarHBondContact CA-OG1 3.27Å; L68-T71 PolarHBondContact O-N 2.91Å; L68-T71 PolarHBondContact O-OG1 3.49Å; T71-C74 PolarHBondContact O-N 3.44Å; T71-I75 VanDerWaalsContact O-CG1 3.31Å; T71-I75 WeakPolarHBondContact O-CG1 3.28Å; T71-I75 PolarHBondContact O-N 3.11Å; T71-I120 HydrophobicContact CG2-CD1 3.52Å; T71-I120 HydrophobicContact CG2-CG1 3.46Å; T71-I120 VanDerWaalsContact CG2-CG1 3.46Å
72	I	68.4	Low	67.2	Low	45 Å²	45	58.2 Å²	58.2	23%	0.231	30%	0.298	C	S	.	.	H	α-helix	trans	-61.4	-48.9	177.4	-65.5	165.6	0	0	0	110.3	I12 L68 A69 G70 C74 I75 E76	I12-I72 HydrophobicContact CD1-CD1 3.86Å; I12-I72 HydrophobicContact CD1-CG1 4.4Å; I12-I72 HydrophobicContact CG1-CD1 4.43Å; I12-I72 HydrophobicContact CG2-CD1 4.35Å; I12-I72 HydrophobicContact CG2-CG1 3.72Å; L68-I72 HydrophobicContact CG-CD1 4.04Å; L68-I72 WeakPolarHBondContact O-CG1 3.49Å; L68-I72 PolarHBondContact O-N 3.24Å; A69-I72 PolarHBondContact O-N 3.35Å; G70-I72 VanDerWaalsContact C-N 3.32Å; G70-I72 PolarHBondContact O-N 3.25Å; I72-C74 PolarHBondContact O-N 3.33Å; I72-I75 WeakPolarHBondContact O-CB 3.4Å; I72-I75 PolarHBondContact O-N 3.45Å; I72-I75 VanDerWaalsContact O-N 3.11Å; I72-E76 HydrophobicContact CG2-CG 4.47Å; I72-E76 WeakPolarHBondContact O-CG 3.19Å; I72-E76 PolarHBondContact O-N 3.34Å
73	L	66.6	Low	67.7	Low	97 Å²	97	53.5 Å²	53.5	51%	0.508	28%	0.276	S	S	.	.	H	α-helix	trans	-55.6	-38.5	177.4	-175.8	73.7	0	0	0	111.8	A69 G70 E76 L77	A69-L73 PolarHBondContact O-N 2.91Å; A69-L73 VanDerWaalsContact O-N 3.11Å; G70-L73 PolarHBondContact O-N 3.38Å; L73-E76 PolarHBondContact O-N 3.01Å; L73-L77 HydrophobicContact CG-CD1 4.22Å; L73-L77 VanDerWaalsContact O-CG 3.25Å; L73-L77 WeakPolarHBondContact O-CG 3.33Å; L73-L77 PolarHBondContact O-N 2.93Å
74	C	65.8	Low	68.3	Low	3 Å²	3	54.7 Å²	54.7	2%	0.02	28%	0.281	C	S	.	.	H	α-helix	trans	-74.4	-33	-178.2	-56.4	0	0	0	0	113.2	L33 G70 T71 I72 L77 L79 L83	L33-C74 WeakPolarHBondContact CD1-SG 3.44Å; G70-C74 PolarHBondContact O-N 2.87Å; G70-C74 VanDerWaalsContact O-N 3.15Å; G70-C74 PolarHBondContact O-SG 3.15Å; T71-C74 PolarHBondContact O-N 3.44Å; I72-C74 PolarHBondContact O-N 3.33Å; C74-L77 PolarHBondContact O-N 3.5Å; C74-L79 PolarHBondContact O-N 3.49Å; C74-L83 HydrophobicContact CB-CD1 3.23Å; C74-L83 HydrophobicContact CB-CD2 3.33Å; C74-L83 HydrophobicContact CB-CG 3.79Å; C74-L83 VanDerWaalsContact SG-CD2 3.52Å
75	I	67.2	Low	68.9	Low	20 Å²	20	61.2 Å²	61.2	10%	0.103	30%	0.304	C	S	.	.	H	α-helix	trans	-64.4	-46.2	172	-69	165.1	0	0	0	109.5	P14 T71 I72 L77 N78 I123	P14-I75 HydrophobicContact CB-CG2 4.11Å; P14-I75 HydrophobicContact CG-CG2 3.63Å; T71-I75 VanDerWaalsContact O-CG1 3.31Å; T71-I75 WeakPolarHBondContact O-CG1 3.28Å; T71-I75 PolarHBondContact O-N 3.11Å; I72-I75 WeakPolarHBondContact O-CB 3.4Å; I72-I75 PolarHBondContact O-N 3.45Å; I72-I75 VanDerWaalsContact O-N 3.11Å; I75-L77 PolarHBondContact O-N 3.45Å; I75-N78 PolarHBondContact O-N 2.91Å; I75-N78 VanDerWaalsContact O-N 3.12Å; I75-I123 HydrophobicContact CD1-CG2 4.13Å
76	E	68.9	Low	69.1	Low	141 Å²	141	60.1 Å²	60.1	66%	0.659	30%	0.295	S	S	*	.	H	α-helix	trans	-61.5	-29.8	178.6	-71.4	176.6	174.9	0	0	113.2	I72 L73 N78	I72-E76 HydrophobicContact CG2-CG 4.47Å; I72-E76 WeakPolarHBondContact O-CG 3.19Å; I72-E76 PolarHBondContact O-N 3.34Å; L73-E76 PolarHBondContact O-N 3.01Å; E76-N78 VanDerWaalsContact C-N 3.31Å; E76-N78 PolarHBondContact O-N 3.37Å
77	L	66.1	Low	69.8	Low	65 Å²	65	57.2 Å²	57.2	34%	0.34	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	3.7	179.2	-67.5	174.2	0	0	0	114	L73 C74 I75 L79	L73-L77 HydrophobicContact CG-CD1 4.22Å; L73-L77 VanDerWaalsContact O-CG 3.25Å; L73-L77 WeakPolarHBondContact O-CG 3.33Å; L73-L77 PolarHBondContact O-N 2.93Å; C74-L77 PolarHBondContact O-N 3.5Å; I75-L77 PolarHBondContact O-N 3.45Å; L77-L79 HydrophobicContact CB-CD1 3.91Å; L77-L79 HydrophobicContact CB-CG 4Å; L77-L79 HydrophobicContact CD1-CD1 4.21Å; L77-L79 PolarHBondContact O-N 3.14Å
78	N	67.6	Low	70.6	Confident	96 Å²	96	61 Å²	61	51%	0.513	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	24.4	-176.2	-79.7	-16.6	0	0	0	114.2	I75 E76 L80	I75-N78 PolarHBondContact O-N 2.91Å; I75-N78 VanDerWaalsContact O-N 3.12Å; E76-N78 VanDerWaalsContact C-N 3.31Å; E76-N78 PolarHBondContact O-N 3.37Å; N78-L80 PolarHBondContact O-N 2.95Å
79	L	66.9	Low	71.4	Confident	41 Å²	41	63.2 Å²	63.2	22%	0.215	31%	0.306	C	S	.	.			trans	-83.6	29.6	-179.4	-69.1	171.5	0	0	0	112.6	C74 L77 Y81 F82 L83	C74-L79 PolarHBondContact O-N 3.49Å; L77-L79 HydrophobicContact CB-CD1 3.91Å; L77-L79 HydrophobicContact CB-CG 4Å; L77-L79 HydrophobicContact CD1-CD1 4.21Å; L77-L79 PolarHBondContact O-N 3.14Å; L79-Y81 VanDerWaalsContact C-N 3.3Å; L79-Y81 PolarHBondContact O-N 2.96Å; L79-F82 HydrophobicContact CD2-CD2 4.29Å; L79-F82 PolarHBondContact O-N 3.1Å; L79-F82 VanDerWaalsContact O-N 3.1Å; L79-L83 WeakPolarHBondContact O-CG 3.39Å; L79-L83 PolarHBondContact O-N 3.45Å; L79-L83 VanDerWaalsContact O-N 3.14Å
80	L	68.2	Low	72.1	Confident	44 Å²	44	61.2 Å²	61.2	23%	0.23	29%	0.287	C	S	.	.	H	α-helix	trans	-55.8	-40.7	-169.8	-68.5	175.5	0	0	0	113	N78 F82 L83 H84 W124	N78-L80 PolarHBondContact O-N 2.95Å; L80-F82 PolarHBondContact O-N 3.18Å; L80-L83 HydrophobicContact CD2-CD1 4.35Å; L80-L83 PolarHBondContact O-N 3.19Å; L80-H84 PolarHBondContact O-N 2.97Å; L80-W124 VanDerWaalsContact O-CD1 3.28Å
81	Y	70.1	Confident	72.9	Confident	174 Å²	174	61.1 Å²	61.1	68%	0.682	29%	0.286	S	S	*	.	H	α-helix	trans	-63.7	-41	179	-72.3	-74.2	0	0	0	113.3	L79 Y85 W124	L79-Y81 VanDerWaalsContact C-N 3.3Å; L79-Y81 PolarHBondContact O-N 2.96Å; Y81-Y85 WeakPolarHBondContact O-CD2 3.18Å; Y81-W124 HydrophobicContact CE1-CZ2 4.49Å
82	F	71.4	Confident	73.7	Confident	117 Å²	117	63.6 Å²	63.6	51%	0.513	30%	0.299	S	S	.	.	H	α-helix	trans	-72.5	-35.4	178.9	-74.6	-76.5	0	0	0	111.7	L79 L80 H84 Y85 I86	L79-F82 HydrophobicContact CD2-CD2 4.29Å; L79-F82 PolarHBondContact O-N 3.1Å; L79-F82 VanDerWaalsContact O-N 3.1Å; L80-F82 PolarHBondContact O-N 3.18Å; F82-H84 VanDerWaalsContact C-N 3.3Å; F82-H84 PolarHBondContact O-N 3.35Å; F82-Y85 PolarHBondContact O-N 3.38Å; F82-I86 HydrophobicContact CB-CD1 4.26Å; F82-I86 WeakPolarHBondContact O-CB 3.3Å; F82-I86 WeakPolarHBondContact O-CD1 3.39Å; F82-I86 WeakPolarHBondContact O-CG1 3.48Å; F82-I86 PolarHBondContact O-N 3.43Å
83	L	71.6	Confident	74.5	Confident	11 Å²	11	67.4 Å²	67.4	6%	0.058	31%	0.313	C	S	.	.	H	α-helix	trans	-63.1	-36.3	-179.2	-67.3	166.9	0	0	0	113.2	L33 F37 C74 L79 L80 I86 G87	L33-L83 HydrophobicContact CD1-CD2 4.22Å; L33-L83 HydrophobicContact CD2-CD2 4.36Å; F37-L83 HydrophobicContact CE2-CD2 4.13Å; F37-L83 HydrophobicContact CZ-CD2 4.01Å; C74-L83 HydrophobicContact CB-CD1 3.23Å; C74-L83 HydrophobicContact CB-CD2 3.33Å; C74-L83 HydrophobicContact CB-CG 3.79Å; C74-L83 VanDerWaalsContact SG-CD2 3.52Å; L79-L83 WeakPolarHBondContact O-CG 3.39Å; L79-L83 PolarHBondContact O-N 3.45Å; L79-L83 VanDerWaalsContact O-N 3.14Å; L80-L83 HydrophobicContact CD2-CD1 4.35Å; L80-L83 PolarHBondContact O-N 3.19Å; L83-I86 PolarHBondContact O-N 2.99Å; L83-G87 PolarHBondContact O-N 3.14Å
84	H	75.7	Confident	75.2	Confident	32 Å²	32	62.8 Å²	62.8	15%	0.148	29%	0.289	C	S	.	.	H	α-helix	trans	-58.6	-53.9	177	178.5	85.9	0	0	0	111.2	L80 F82 I86 G87 Y88 F121 W124	L80-H84 PolarHBondContact O-N 2.97Å; F82-H84 VanDerWaalsContact C-N 3.3Å; F82-H84 PolarHBondContact O-N 3.35Å; H84-I86 PolarHBondContact O-N 2.79Å; H84-G87 PolarHBondContact O-N 3.1Å; H84-Y88 PolarHBondContact O-N 2.97Å; H84-F121 AromaticContact CD2-CE2 3.85Å; H84-F121 AromaticContact CE1-CD2 3.33Å; H84-F121 WeakPolarHBondContact CE1-CD2 3.36Å; H84-F121 AromaticContact CE1-CE2 2.84Å; H84-F121 WeakPolarHBondContact CE1-CE2 3.47Å; H84-F121 AromaticContact CE1-CZ 3.27Å; H84-F121 WeakPolarHBondContact CE1-CZ 3.27Å; H84-F121 AromaticContact CG-CD2 3.85Å; H84-F121 AromaticContact CG-CE2 3.98Å; H84-F121 AromaticContact ND1-CD2 3.29Å; H84-F121 VanDerWaalsContact ND1-CD2 3.29Å; H84-F121 WeakPolarHBondContact ND1-CD2 3.11Å; H84-F121 AromaticContact ND1-CE2 3.36Å; H84-F121 WeakPolarHBondContact ND1-CE2 3.34Å; H84-F121 AromaticContact NE2-CD2 3.82Å; H84-F121 AromaticContact NE2-CE2 3.14Å; H84-F121 WeakPolarHBondContact NE2-CE2 3.49Å; H84-F121 AromaticContact NE2-CZ 3.79Å; H84-W124 HydrophobicContact CB-CB 4.18Å; H84-W124 HydrophobicContact CB-CD2 4.17Å; H84-W124 HydrophobicContact CB-CG 3.88Å; H84-W124 AromaticContact CE1-CE3 3.55Å; H84-W124 AromaticContact CE1-CZ3 3.84Å; H84-W124 AromaticContact ND1-CD2 3.63Å; H84-W124 AromaticContact ND1-CE3 3.34Å; H84-W124 VanDerWaalsContact ND1-CE3 3.34Å; H84-W124 AromaticContact ND1-CG 3.91Å
85	Y	79.4	Confident	76.1	Confident	156 Å²	156	67.2 Å²	67.2	61%	0.612	31%	0.306	S	S	*	.	H	α-helix	trans	-62.9	-42.3	178.3	-71.1	-71	0	0	0	112.3	Y81 F82 Y88 L89	Y81-Y85 WeakPolarHBondContact O-CD2 3.18Å; F82-Y85 PolarHBondContact O-N 3.38Å; Y85-Y88 PolarHBondContact O-N 3.39Å; Y85-L89 WeakPolarHBondContact O-CB 3.3Å; Y85-L89 VanDerWaalsContact O-CG 3.28Å; Y85-L89 WeakPolarHBondContact O-CG 3.41Å; Y85-L89 PolarHBondContact O-N 3.46Å
86	I	78	Confident	76.9	Confident	35 Å²	35	71.4 Å²	71.4	18%	0.179	33%	0.328	C	S	.	.	H	α-helix	trans	-65.6	-42.5	179.4	-64.6	163.6	0	0	0	110.8	L33 F37 F82 L83 H84 T90	L33-I86 HydrophobicContact CD2-CD1 3.72Å; L33-I86 HydrophobicContact CG-CD1 4.49Å; F37-I86 HydrophobicContact CD1-CG2 4Å; F37-I86 HydrophobicContact CD2-CG2 3.48Å; F37-I86 VanDerWaalsContact CD2-CG2 3.48Å; F37-I86 HydrophobicContact CE1-CG2 4.01Å; F37-I86 HydrophobicContact CE2-CB 4.33Å; F37-I86 HydrophobicContact CE2-CD1 4.37Å; F37-I86 HydrophobicContact CE2-CG2 3.48Å; F37-I86 VanDerWaalsContact CE2-CG2 3.48Å; F37-I86 HydrophobicContact CG-CG2 3.76Å; F37-I86 HydrophobicContact CZ-CG2 3.78Å; F82-I86 HydrophobicContact CB-CD1 4.26Å; F82-I86 WeakPolarHBondContact O-CB 3.3Å; F82-I86 WeakPolarHBondContact O-CD1 3.39Å; F82-I86 WeakPolarHBondContact O-CG1 3.48Å; F82-I86 PolarHBondContact O-N 3.43Å; L83-I86 PolarHBondContact O-N 2.99Å; H84-I86 PolarHBondContact O-N 2.79Å; I86-T90 WeakPolarHBondContact O-CB 3.26Å; I86-T90 PolarHBondContact O-N 3.44Å; I86-T90 PolarHBondContact O-OG1 3.37Å
87	G	79	Confident	77.5	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-62.1	-45.1	177.3	0	0	0	0	0	112.1	L83 H84 T90 S91 A117	L83-G87 PolarHBondContact O-N 3.14Å; H84-G87 PolarHBondContact O-N 3.1Å; G87-T90 PolarHBondContact O-N 2.69Å; G87-S91 PolarHBondContact O-N 3.47Å; G87-A117 WeakPolarHBondContact O-CB 3.44Å
88	Y	82.9	Confident	78.2	Confident	88 Å²	88	64.9 Å²	64.9	35%	0.345	30%	0.299	S	S	.	.	H	α-helix	trans	-62.2	-51.1	176.3	-176.5	-109.8	0	0	0	112.5	H84 Y85 T90 S91 L92 F121	H84-Y88 PolarHBondContact O-N 2.97Å; Y85-Y88 PolarHBondContact O-N 3.39Å; Y88-T90 VanDerWaalsContact C-N 3.31Å; Y88-T90 PolarHBondContact O-N 3.07Å; Y88-S91 WeakPolarHBondContact O-CB 3.49Å; Y88-S91 PolarHBondContact O-N 3.19Å; Y88-L92 HydrophobicContact CD1-CD1 4.05Å; Y88-L92 HydrophobicContact CE1-CD1 3.44Å; Y88-L92 VanDerWaalsContact CE1-CD1 3.44Å; Y88-L92 HydrophobicContact CE1-CG 4.27Å; Y88-L92 HydrophobicContact CE2-CD1 4.44Å; Y88-L92 PolarHBondContact O-N 3.01Å; Y88-L92 VanDerWaalsContact O-N 3.07Å; Y88-F121 HydrophobicContact CD2-CD2 4.37Å; Y88-F121 HydrophobicContact CD2-CE2 4.06Å; Y88-F121 HydrophobicContact CG-CD2 4.44Å; Y88-F121 HydrophobicContact CG-CE2 4.25Å
89	L	84.2	Confident	78.8	Confident	87 Å²	87	68.6 Å²	68.6	46%	0.455	31%	0.31	S	S	.	.	H	α-helix	trans	-60.3	-43	178.7	-71.8	174.8	0	0	0	111.3	Y85 S91 L92 F93	Y85-L89 WeakPolarHBondContact O-CB 3.3Å; Y85-L89 VanDerWaalsContact O-CG 3.28Å; Y85-L89 WeakPolarHBondContact O-CG 3.41Å; Y85-L89 PolarHBondContact O-N 3.46Å; L89-S91 VanDerWaalsContact C-N 3.31Å; L89-S91 PolarHBondContact O-N 2.7Å; L89-L92 PolarHBondContact O-N 3.07Å; L89-F93 HydrophobicContact CB-CD2 4.37Å; L89-F93 HydrophobicContact CB-CE2 4.32Å; L89-F93 WeakPolarHBondContact O-CD2 3.35Å; L89-F93 PolarHBondContact O-N 3.39Å
90	T	82	Confident	79.6	Confident	16 Å²	16	71.7 Å²	71.7	10%	0.098	34%	0.335	C	S	.	.	H	α-helix	trans	-61.2	-39.8	177.8	-60.2	0	0	0	0	111.8	V41 I86 G87 Y88 S94 A117	V41-T90 HydrophobicContact CG2-CG2 3.45Å; V41-T90 VanDerWaalsContact CG2-CG2 3.45Å; I86-T90 WeakPolarHBondContact O-CB 3.26Å; I86-T90 PolarHBondContact O-N 3.44Å; I86-T90 PolarHBondContact O-OG1 3.37Å; G87-T90 PolarHBondContact O-N 2.69Å; Y88-T90 VanDerWaalsContact C-N 3.31Å; Y88-T90 PolarHBondContact O-N 3.07Å; T90-S94 WeakPolarHBondContact O-CB 3.28Å; T90-S94 PolarHBondContact O-N 3Å; T90-S94 PolarHBondContact O-OG 2.98Å; T90-A117 HydrophobicContact CG2-CB 3.8Å
91	S	83.6	Confident	80.2	Confident	2 Å²	2	72.3 Å²	72.3	1%	0.014	34%	0.336	C	S	.	.	H	α-helix	trans	-63.1	-43.9	175.2	-179.1	0	0	0	0	112.1	G87 Y88 L89 S94 R95 S114 L118	G87-S91 PolarHBondContact O-N 3.47Å; Y88-S91 WeakPolarHBondContact O-CB 3.49Å; Y88-S91 PolarHBondContact O-N 3.19Å; L89-S91 VanDerWaalsContact C-N 3.31Å; L89-S91 PolarHBondContact O-N 2.7Å; S91-S94 PolarHBondContact O-OG 2.9Å; S91-R95 WeakPolarHBondContact O-CB 3.45Å; S91-R95 VanDerWaalsContact O-CG 3.27Å; S91-R95 WeakPolarHBondContact O-CG 3.28Å; S91-R95 PolarHBondContact O-N 3.28Å; S91-R95 VanDerWaalsContact O-N 3.1Å; S91-S114 PolarHBondContact OG-O 2.98Å; S91-L118 WeakPolarHBondContact OG-CG 3.39Å
92	L	84.9	Confident	80.5	Confident	66 Å²	66	73.7 Å²	73.7	35%	0.346	35%	0.346	S	S	.	.	H	α-helix	trans	-64.9	-49.2	177.5	-70.6	180	0	0	0	112.1	Y88 L89 S94 R95 L96	Y88-L92 HydrophobicContact CD1-CD1 4.05Å; Y88-L92 HydrophobicContact CE1-CD1 3.44Å; Y88-L92 VanDerWaalsContact CE1-CD1 3.44Å; Y88-L92 HydrophobicContact CE1-CG 4.27Å; Y88-L92 HydrophobicContact CE2-CD1 4.44Å; Y88-L92 PolarHBondContact O-N 3.01Å; Y88-L92 VanDerWaalsContact O-N 3.07Å; L89-L92 PolarHBondContact O-N 3.07Å; L92-S94 PolarHBondContact O-N 3.41Å; L92-R95 PolarHBondContact O-N 3.25Å; L92-L96 WeakPolarHBondContact O-CG 3.48Å; L92-L96 PolarHBondContact O-N 3.4Å
93	F	84.9	Confident	80.7	Confident	124 Å²	124	72 Å²	72	54%	0.544	34%	0.342	S	S	.	.	H	α-helix	trans	-61.4	-45	-179.7	-78.6	-63.5	0	0	0	112.3	L89 R95 L96 I97	L89-F93 HydrophobicContact CB-CD2 4.37Å; L89-F93 HydrophobicContact CB-CE2 4.32Å; L89-F93 WeakPolarHBondContact O-CD2 3.35Å; L89-F93 PolarHBondContact O-N 3.39Å; F93-R95 VanDerWaalsContact C-N 3.33Å; F93-R95 PolarHBondContact O-N 3.09Å; F93-L96 PolarHBondContact O-N 3.08Å; F93-I97 VanDerWaalsContact O-CG1 3.29Å; F93-I97 WeakPolarHBondContact O-CG1 3.5Å; F93-I97 PolarHBondContact O-N 2.99Å
94	S	81.6	Confident	80.7	Confident	0 Å²	0	76 Å²	76	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-63.5	-37.4	177.5	53.3	0	0	0	0	112.5	T90 S91 L92 I97 A98 S114	T90-S94 WeakPolarHBondContact O-CB 3.28Å; T90-S94 PolarHBondContact O-N 3Å; T90-S94 PolarHBondContact O-OG 2.98Å; S91-S94 PolarHBondContact O-OG 2.9Å; L92-S94 PolarHBondContact O-N 3.41Å; S94-I97 PolarHBondContact O-N 3.21Å; S94-A98 WeakPolarHBondContact O-CB 3.21Å; S94-A98 PolarHBondContact O-N 3.06Å; S94-S114 VanDerWaalsContact OG-CA 3.22Å; S94-S114 WeakPolarHBondContact OG-CA 3.25Å; S94-S114 WeakPolarHBondContact OG-CB 3.5Å
95	R	83.3	Confident	80.5	Confident	96 Å²	96	79.6 Å²	79.6	36%	0.362	38%	0.378	S	S	.	.	H	α-helix	trans	-64.3	-43.1	172.9	-75	169.7	69.1	151.6	0.5	112.2	S91 L92 F93 A98 F99 S189	S91-R95 WeakPolarHBondContact O-CB 3.45Å; S91-R95 VanDerWaalsContact O-CG 3.27Å; S91-R95 WeakPolarHBondContact O-CG 3.28Å; S91-R95 PolarHBondContact O-N 3.28Å; S91-R95 VanDerWaalsContact O-N 3.1Å; L92-R95 PolarHBondContact O-N 3.25Å; F93-R95 VanDerWaalsContact C-N 3.33Å; F93-R95 PolarHBondContact O-N 3.09Å; R95-A98 WeakPolarHBondContact O-CB 3.47Å; R95-A98 PolarHBondContact O-N 2.91Å; R95-F99 WeakPolarHBondContact O-CD2 3Å; R95-F99 PolarHBondContact O-N 3Å; R95-S189 PolarHBondContact NH1-OG 3.17Å
96	L	83.8	Confident	80.2	Confident	109 Å²	109	75 Å²	75	57%	0.571	36%	0.361	S	S	*	.	H	α-helix	trans	-62.5	-44.3	177.2	-70.2	172.7	0	0	0	111.5	L92 F93 A98 F99 C100	L92-L96 WeakPolarHBondContact O-CG 3.48Å; L92-L96 PolarHBondContact O-N 3.4Å; F93-L96 PolarHBondContact O-N 3.08Å; L96-A98 VanDerWaalsContact C-N 3.32Å; L96-A98 PolarHBondContact O-N 3.06Å; L96-F99 PolarHBondContact O-N 3.3Å; L96-C100 PolarHBondContact O-N 3Å
97	I	82.9	Confident	80.3	Confident	57 Å²	57	75.4 Å²	75.4	29%	0.292	37%	0.367	S	S	.	.	H	α-helix	trans	-62.2	-41.8	175.6	-62.5	162.4	0	0	0	110.3	V41 F93 S94 F99 C100 E101 Y110	V41-I97 HydrophobicContact CG1-CD1 4.37Å; F93-I97 VanDerWaalsContact O-CG1 3.29Å; F93-I97 WeakPolarHBondContact O-CG1 3.5Å; F93-I97 PolarHBondContact O-N 2.99Å; S94-I97 PolarHBondContact O-N 3.21Å; I97-F99 PolarHBondContact O-N 3.22Å; I97-C100 PolarHBondContact O-N 2.55Å; I97-E101 HydrophobicContact CG2-CG 4.08Å; I97-E101 WeakPolarHBondContact O-CG 3.21Å; I97-E101 PolarHBondContact O-N 3.07Å; I97-E101 VanDerWaalsContact O-N 3.12Å; I97-Y110 HydrophobicContact CB-CD1 4.23Å; I97-Y110 HydrophobicContact CB-CE1 4.1Å; I97-Y110 HydrophobicContact CD1-CE1 4.26Å; I97-Y110 HydrophobicContact CG2-CD1 4.01Å; I97-Y110 HydrophobicContact CG2-CD2 4.07Å; I97-Y110 HydrophobicContact CG2-CE1 3.54Å; I97-Y110 HydrophobicContact CG2-CE2 3.63Å; I97-Y110 HydrophobicContact CG2-CG 4.26Å
98	A	80.8	Confident	80.3	Confident	11 Å²	11	76 Å²	76	9%	0.091	37%	0.37	C	S	.	.	H	α-helix	trans	-57.1	-32	178.2	0	0	0	0	0	113.9	S94 R95 L96 C107	S94-A98 WeakPolarHBondContact O-CB 3.21Å; S94-A98 PolarHBondContact O-N 3.06Å; R95-A98 WeakPolarHBondContact O-CB 3.47Å; R95-A98 PolarHBondContact O-N 2.91Å; L96-A98 VanDerWaalsContact C-N 3.32Å; L96-A98 PolarHBondContact O-N 3.06Å; A98-C107 PolarHBondContact O-SG 3.21Å
99	F	80.5	Confident	80	Confident	174 Å²	174	72.1 Å²	72.1	76%	0.763	36%	0.356	S	S	*	.	H	α-helix	trans	-73.4	-29.7	175.8	-80.1	-68.6	0	0	0	113.4	R95 L96 I97	R95-F99 WeakPolarHBondContact O-CD2 3Å; R95-F99 PolarHBondContact O-N 3Å; L96-F99 PolarHBondContact O-N 3.3Å; I97-F99 PolarHBondContact O-N 3.22Å
100	C	82.4	Confident	79.8	Confident	107 Å²	107	69 Å²	69	72%	0.723	34%	0.339	S	S	*	.	H	α-helix	trans	-83.9	-18.7	179.2	-66	0	0	0	0	112.9	L96 I97	L96-C100 PolarHBondContact O-N 3Å; I97-C100 PolarHBondContact O-N 2.55Å
101	E	81.5	Confident	79.8	Confident	57 Å²	57	69.5 Å²	69.5	27%	0.266	34%	0.343	S	S	.	.			trans	-75.2	127.6	-178	-73.4	-71.9	176.8	0	0	112.3	I97 K106 Y110	I97-E101 HydrophobicContact CG2-CG 4.08Å; I97-E101 WeakPolarHBondContact O-CG 3.21Å; I97-E101 PolarHBondContact O-N 3.07Å; I97-E101 VanDerWaalsContact O-N 3.12Å; E101-K106 HydrophobicContact CB-CB 4.29Å; E101-K106 HydrophobicContact CG-CB 4.27Å; E101-K106 VanDerWaalsContact OE2-CD 3.26Å; E101-K106 WeakPolarHBondContact OE2-CD 3.47Å; E101-Y110 HydrophobicContact CG-CD2 3.8Å; E101-Y110 HydrophobicContact CG-CE2 3.56Å; E101-Y110 WeakPolarHBondContact OE1-CE2 3.43Å
102	K	76.3	Confident	79.6	Confident	202 Å²	202	69.7 Å²	69.7	88%	0.878	34%	0.344	S	S	*	.			trans	-84	-26.1	179	-64.1	-179.4	-178.8	176.5	0	112.9
103	D	75.9	Confident	79.4	Confident	81 Å²	81	66.8 Å²	66.8	43%	0.433	33%	0.328	S	S	.	.			trans	-82.6	119.7	-179	-65.1	-37.5	0	0	0	110.4	K105 K106 C107	D103-K105 PolarHBondContact O-N 2.92Å; D103-K105 VanDerWaalsContact O-N 3.15Å; D103-K106 HydrophobicContact CB-CB 4.04Å; D103-K106 HydrophobicContact CB-CD 3.97Å; D103-K106 HydrophobicContact CB-CG 4Å; D103-K106 PolarHBondContact O-N 2.96Å; D103-K106 WeakPolarHBondContact OD2-CD 3.17Å; D103-K106 VanDerWaalsContact OD2-CE 3.27Å; D103-K106 WeakPolarHBondContact OD2-CE 3.33Å; D103-K106 IonicContact OD2-NZ 2.75Å; D103-K106 PolarHBondContact OD2-NZ 3.02Å; D103-C107 PolarHBondContact O-N 3.09Å
104	L	71.2	Confident	79.4	Confident	97 Å²	97	61 Å²	61	51%	0.508	30%	0.303	S	S	.	.	H	α-helix	trans	-54.2	-37.2	178.2	-71.4	172.8	0	0	0	112.7	L108 F152	L104-L108 WeakPolarHBondContact O-CB 3.19Å; L104-L108 PolarHBondContact O-N 3.4Å; L104-F152 HydrophobicContact CD1-CD1 4.24Å; L104-F152 HydrophobicContact CD1-CE1 3.86Å
105	K	72	Confident	79.4	Confident	107 Å²	107	61.2 Å²	61.2	47%	0.465	30%	0.304	S	S	.	.	H	α-helix	trans	-66.3	-40	177.8	-64.8	-175.4	-179	-177.1	0	112.3	D103 L108 A109	D103-K105 PolarHBondContact O-N 2.92Å; D103-K105 VanDerWaalsContact O-N 3.15Å; K105-L108 PolarHBondContact O-N 3.47Å; K105-A109 PolarHBondContact O-N 2.73Å
106	K	72.9	Confident	79.3	Confident	58 Å²	58	59.8 Å²	59.8	25%	0.252	30%	0.301	S	S	.	.	H	α-helix	trans	-68.6	-46.7	176.3	-75.2	178.1	-171.5	155.6	0	111.1	V49 E101 D103 L108 A109 Y110	V49-K106 HydrophobicContact CG2-CB 4.47Å; V49-K106 HydrophobicContact CG2-CD 4.15Å; V49-K106 HydrophobicContact CG2-CG 3.28Å; E101-K106 HydrophobicContact CB-CB 4.29Å; E101-K106 HydrophobicContact CG-CB 4.27Å; E101-K106 VanDerWaalsContact OE2-CD 3.26Å; E101-K106 WeakPolarHBondContact OE2-CD 3.47Å; D103-K106 HydrophobicContact CB-CB 4.04Å; D103-K106 HydrophobicContact CB-CD 3.97Å; D103-K106 HydrophobicContact CB-CG 4Å; D103-K106 PolarHBondContact O-N 2.96Å; D103-K106 WeakPolarHBondContact OD2-CD 3.17Å; D103-K106 VanDerWaalsContact OD2-CE 3.27Å; D103-K106 WeakPolarHBondContact OD2-CE 3.33Å; D103-K106 IonicContact OD2-NZ 2.75Å; D103-K106 PolarHBondContact OD2-NZ 3.02Å; K106-L108 PolarHBondContact O-N 2.97Å; K106-A109 WeakPolarHBondContact O-CA 3.34Å; K106-A109 WeakPolarHBondContact O-CB 3.22Å; K106-A109 PolarHBondContact O-N 2.94Å; K106-Y110 HydrophobicContact CB-CD2 4.45Å; K106-Y110 HydrophobicContact CB-CE2 4.37Å; K106-Y110 WeakPolarHBondContact O-CD2 3.43Å; K106-Y110 PolarHBondContact O-N 2.82Å
107	C	79.7	Confident	79.2	Confident	45 Å²	45	54.9 Å²	54.9	30%	0.304	28%	0.276	S	S	.	.	H	α-helix	trans	-54.7	-43.4	175.4	-173.8	0	0	0	0	111.1	A98 D103 Y110 S111	A98-C107 PolarHBondContact O-SG 3.21Å; D103-C107 PolarHBondContact O-N 3.09Å; C107-Y110 PolarHBondContact O-N 2.72Å; C107-S111 WeakPolarHBondContact O-CB 3.17Å; C107-S111 PolarHBondContact O-N 2.89Å; C107-S111 PolarHBondContact O-OG 3.24Å
108	L	78.8	Confident	79.1	Confident	13 Å²	13	52.8 Å²	52.8	7%	0.068	27%	0.265	C	S	.	.	H	α-helix	trans	-65.4	-39.4	175.7	-168.2	64.4	0	0	0	112.6	L104 K105 K106 S111 T112 L145 F146 I149	L104-L108 WeakPolarHBondContact O-CB 3.19Å; L104-L108 PolarHBondContact O-N 3.4Å; K105-L108 PolarHBondContact O-N 3.47Å; K106-L108 PolarHBondContact O-N 2.97Å; L108-S111 WeakPolarHBondContact CA-OG 3.47Å; L108-S111 PolarHBondContact O-N 3.38Å; L108-S111 PolarHBondContact O-OG 3.14Å; L108-T112 PolarHBondContact O-N 3.47Å; L108-L145 HydrophobicContact CD1-CB 4.26Å; L108-L145 HydrophobicContact CD1-CD1 4.43Å; L108-F146 HydrophobicContact CD2-CD1 3.44Å; L108-F146 VanDerWaalsContact CD2-CD1 3.44Å; L108-F146 HydrophobicContact CD2-CD2 4.32Å; L108-F146 HydrophobicContact CD2-CE1 3.16Å; L108-F146 HydrophobicContact CD2-CE2 4.07Å; L108-F146 HydrophobicContact CD2-CG 4.02Å; L108-F146 HydrophobicContact CD2-CZ 3.5Å; L108-F146 VanDerWaalsContact CD2-CZ 3.5Å; L108-F146 HydrophobicContact CG-CE1 4.09Å; L108-F146 HydrophobicContact CG-CE2 4.39Å; L108-F146 HydrophobicContact CG-CZ 3.94Å; L108-I149 HydrophobicContact CD1-CD1 4.1Å; L108-I149 HydrophobicContact CD2-CD1 3.8Å; L108-I149 HydrophobicContact CG-CD1 4.41Å
109	A	77.6	Confident	79	Confident	5 Å²	5	52.8 Å²	52.8	4%	0.041	26%	0.264	C	S	.	.	H	α-helix	trans	-61.9	-50.3	174.1	0	0	0	0	0	111.8	P45 I48 K105 K106 S111 T112 I113	P45-A109 HydrophobicContact CB-CB 4.36Å; I48-A109 HydrophobicContact CB-CB 4.23Å; I48-A109 HydrophobicContact CD1-CB 3.86Å; I48-A109 HydrophobicContact CG2-CB 3.94Å; K105-A109 PolarHBondContact O-N 2.73Å; K106-A109 WeakPolarHBondContact O-CA 3.34Å; K106-A109 WeakPolarHBondContact O-CB 3.22Å; K106-A109 PolarHBondContact O-N 2.94Å; A109-S111 VanDerWaalsContact C-N 3.28Å; A109-S111 PolarHBondContact O-N 3.49Å; A109-T112 PolarHBondContact O-N 2.9Å; A109-T112 PolarHBondContact O-OG1 3.31Å; A109-I113 PolarHBondContact O-N 3.33Å; A109-I113 VanDerWaalsContact O-N 3.11Å
110	Y	79.4	Confident	78.8	Confident	23 Å²	23	45.2 Å²	45.2	9%	0.09	23%	0.232	C	C	.	.	H	α-helix	trans	-60.8	-36.9	177.9	-76.3	-70.4	0	0	0	112.7	P45 I97 E101 K106 C107 T112 I113 S114	P45-Y110 HydrophobicContact CB-CD1 4.47Å; P45-Y110 HydrophobicContact CB-CD2 4.39Å; P45-Y110 HydrophobicContact CB-CE1 4Å; P45-Y110 HydrophobicContact CB-CE2 3.88Å; P45-Y110 HydrophobicContact CG-CD1 3.84Å; P45-Y110 HydrophobicContact CG-CE1 3.3Å; P45-Y110 HydrophobicContact CG-CE2 4.13Å; P45-Y110 HydrophobicContact CG-CG 4.45Å; P45-Y110 VanDerWaalsContact CG-CZ 3.48Å; I97-Y110 HydrophobicContact CB-CD1 4.23Å; I97-Y110 HydrophobicContact CB-CE1 4.1Å; I97-Y110 HydrophobicContact CD1-CE1 4.26Å; I97-Y110 HydrophobicContact CG2-CD1 4.01Å; I97-Y110 HydrophobicContact CG2-CD2 4.07Å; I97-Y110 HydrophobicContact CG2-CE1 3.54Å; I97-Y110 HydrophobicContact CG2-CE2 3.63Å; I97-Y110 HydrophobicContact CG2-CG 4.26Å; E101-Y110 HydrophobicContact CG-CD2 3.8Å; E101-Y110 HydrophobicContact CG-CE2 3.56Å; E101-Y110 WeakPolarHBondContact OE1-CE2 3.43Å; K106-Y110 HydrophobicContact CB-CD2 4.45Å; K106-Y110 HydrophobicContact CB-CE2 4.37Å; K106-Y110 WeakPolarHBondContact O-CD2 3.43Å; K106-Y110 PolarHBondContact O-N 2.82Å; C107-Y110 PolarHBondContact O-N 2.72Å; Y110-T112 VanDerWaalsContact C-N 3.25Å; Y110-T112 PolarHBondContact O-N 3.33Å; Y110-I113 PolarHBondContact O-N 3.29Å; Y110-S114 PolarHBondContact O-N 2.9Å
111	S	82	Confident	78.7	Confident	26 Å²	26	41.5 Å²	41.5	18%	0.182	20%	0.203	C	C	.	.	H	α-helix	trans	-70.9	-16.6	175.3	67.4	0	0	0	0	114	C107 L108 A109 S114 Q115 K142	C107-S111 WeakPolarHBondContact O-CB 3.17Å; C107-S111 PolarHBondContact O-N 2.89Å; C107-S111 PolarHBondContact O-OG 3.24Å; L108-S111 WeakPolarHBondContact CA-OG 3.47Å; L108-S111 PolarHBondContact O-N 3.38Å; L108-S111 PolarHBondContact O-OG 3.14Å; A109-S111 VanDerWaalsContact C-N 3.28Å; A109-S111 PolarHBondContact O-N 3.49Å; S111-S114 WeakPolarHBondContact CA-OG 3.14Å; S111-S114 PolarHBondContact O-OG 3.41Å; S111-Q115 VanDerWaalsContact O-CG 3.25Å; S111-Q115 WeakPolarHBondContact O-CG 3.22Å; S111-K142 VanDerWaalsContact CB-NZ 3.27Å; S111-K142 WeakPolarHBondContact O-CE 3.3Å; S111-K142 PolarHBondContact O-NZ 3.34Å; S111-K142 PolarHBondContact OG-NZ 3.02Å
112	T	79.8	Confident	78.5	Confident	6 Å²	6	38.8 Å²	38.8	4%	0.037	19%	0.19	C	C	.	.	H	α-helix	trans	-81.2	-41.8	168.6	60.3	0	0	0	0	110.9	L108 A109 Y110 S114 Q115 F116 K142	L108-T112 PolarHBondContact O-N 3.47Å; A109-T112 PolarHBondContact O-N 2.9Å; A109-T112 PolarHBondContact O-OG1 3.31Å; Y110-T112 VanDerWaalsContact C-N 3.25Å; Y110-T112 PolarHBondContact O-N 3.33Å; T112-S114 VanDerWaalsContact C-N 3.3Å; T112-S114 PolarHBondContact O-N 3.46Å; T112-Q115 PolarHBondContact O-N 3.38Å; T112-F116 WeakPolarHBondContact O-CD2 3.4Å; T112-F116 PolarHBondContact O-N 2.96Å; T112-K142 HydrophobicContact CG2-CD 3.85Å; T112-K142 HydrophobicContact CG2-CG 4.41Å
113	I	80.9	Confident	78.5	Confident	4 Å²	4	29.6 Å²	29.6	2%	0.021	15%	0.151	C	C	.	.	H	α-helix	trans	-60.5	-41.8	177.9	-66.5	163.3	0	0	0	110.7	I40 L44 P45 A109 Y110 Q115 F116 A117	I40-I113 HydrophobicContact CG2-CG2 4.37Å; L44-I113 HydrophobicContact CB-CD1 4Å; L44-I113 HydrophobicContact CD2-CD1 3.93Å; L44-I113 HydrophobicContact CD2-CG1 3.61Å; P45-I113 HydrophobicContact CB-CD1 4.43Å; P45-I113 HydrophobicContact CG-CD1 3.51Å; A109-I113 PolarHBondContact O-N 3.33Å; A109-I113 VanDerWaalsContact O-N 3.11Å; Y110-I113 PolarHBondContact O-N 3.29Å; I113-Q115 VanDerWaalsContact C-N 3.33Å; I113-Q115 PolarHBondContact O-N 3.16Å; I113-F116 PolarHBondContact O-N 3.21Å; I113-A117 WeakPolarHBondContact O-CB 3.49Å; I113-A117 PolarHBondContact O-N 2.88Å
114	S	83.6	Confident	78.5	Confident	3 Å²	3	30 Å²	30	2%	0.021	15%	0.146	C	C	.	.	H	α-helix	trans	-62.2	-39	177.9	65.4	0	0	0	0	113.2	S91 S94 Y110 S111 T112 A117 L118	S91-S114 PolarHBondContact OG-O 2.98Å; S94-S114 VanDerWaalsContact OG-CA 3.22Å; S94-S114 WeakPolarHBondContact OG-CA 3.25Å; S94-S114 WeakPolarHBondContact OG-CB 3.5Å; Y110-S114 PolarHBondContact O-N 2.9Å; S111-S114 WeakPolarHBondContact CA-OG 3.14Å; S111-S114 PolarHBondContact O-OG 3.41Å; T112-S114 VanDerWaalsContact C-N 3.3Å; T112-S114 PolarHBondContact O-N 3.46Å; S114-A117 PolarHBondContact O-N 3.39Å; S114-L118 WeakPolarHBondContact O-CG 3.45Å; S114-L118 PolarHBondContact O-N 2.83Å
115	Q	82.3	Confident	78.6	Confident	4 Å²	4	26.3 Å²	26.3	2%	0.019	13%	0.128	C	C	.	.	H	α-helix	trans	-75	-37.2	179.8	-64.8	-75.9	-22.2	0	0	111.2	S111 T112 I113 A117 L118 V119 H134 H138 V185 S188	S111-Q115 VanDerWaalsContact O-CG 3.25Å; S111-Q115 WeakPolarHBondContact O-CG 3.22Å; T112-Q115 PolarHBondContact O-N 3.38Å; I113-Q115 VanDerWaalsContact C-N 3.33Å; I113-Q115 PolarHBondContact O-N 3.16Å; Q115-A117 VanDerWaalsContact C-N 3.33Å; Q115-A117 PolarHBondContact O-N 3.38Å; Q115-L118 WeakPolarHBondContact O-CB 3.4Å; Q115-L118 PolarHBondContact O-N 2.89Å; Q115-V119 WeakPolarHBondContact O-CG2 2.98Å; Q115-V119 PolarHBondContact O-N 2.73Å; Q115-H134 PolarHBondContact OE1-CE1 3.44Å; Q115-H134 PolarHBondContact OE1-NE2 2.95Å; Q115-H138 WeakPolarHBondContact CB-CD2 3.29Å; Q115-H138 WeakPolarHBondContact CB-NE2 3.37Å; Q115-H138 VanDerWaalsContact CG-CD2 3.42Å; Q115-H138 WeakPolarHBondContact CG-CD2 3.22Å; Q115-H138 WeakPolarHBondContact CG-NE2 3.43Å; Q115-V185 HydrophobicContact CG-CG1 4.26Å; Q115-V185 VanDerWaalsContact NE2-CG1 3.28Å; Q115-V185 PolarHBondContact NE2-O 3.05Å; Q115-V185 VanDerWaalsContact NE2-O 3.14Å; Q115-S188 PolarHBondContact OE1-OG 2.94Å
116	F	80.3	Confident	78.7	Confident	66 Å²	66	25.7 Å²	25.7	29%	0.289	13%	0.13	S	C	.	.	H	α-helix	trans	-61.6	-41.6	168.9	-83.3	-69.5	0	0	0	111.9	V67 T112 I113 L118 V119 I120	V67-F116 HydrophobicContact CG1-CB 4.37Å; V67-F116 HydrophobicContact CG1-CD1 4.46Å; T112-F116 WeakPolarHBondContact O-CD2 3.4Å; T112-F116 PolarHBondContact O-N 2.96Å; I113-F116 PolarHBondContact O-N 3.21Å; F116-L118 VanDerWaalsContact C-N 3.3Å; F116-L118 PolarHBondContact O-N 2.96Å; F116-V119 WeakPolarHBondContact O-CB 3.18Å; F116-V119 PolarHBondContact O-N 2.91Å; F116-V119 VanDerWaalsContact O-N 3.15Å; F116-I120 WeakPolarHBondContact O-CG1 3.18Å; F116-I120 PolarHBondContact O-N 2.66Å; F116-I120 VanDerWaalsContact O-N 3.11Å
117	A	81.6	Confident	78.9	Confident	6 Å²	6	27 Å²	27	5%	0.05	14%	0.139	C	C	.	.	H	α-helix	trans	-64.3	-34.6	175.4	0	0	0	0	0	112.4	G87 T90 I113 S114 Q115 I120 F121	G87-A117 WeakPolarHBondContact O-CB 3.44Å; T90-A117 HydrophobicContact CG2-CB 3.8Å; I113-A117 WeakPolarHBondContact O-CB 3.49Å; I113-A117 PolarHBondContact O-N 2.88Å; S114-A117 PolarHBondContact O-N 3.39Å; Q115-A117 VanDerWaalsContact C-N 3.33Å; Q115-A117 PolarHBondContact O-N 3.38Å; A117-I120 WeakPolarHBondContact O-CB 3.27Å; A117-I120 PolarHBondContact O-N 3.4Å; A117-F121 PolarHBondContact O-N 2.88Å; A117-F121 VanDerWaalsContact O-N 3.1Å
118	L	81.8	Confident	78.8	Confident	14 Å²	14	29.7 Å²	29.7	7%	0.073	15%	0.146	C	C	.	.	H	α-helix	trans	-63.9	-44.2	169.4	-72	172.4	0	0	0	111.6	S91 S114 Q115 F116 I120 F121 I122	S91-L118 WeakPolarHBondContact OG-CG 3.39Å; S114-L118 WeakPolarHBondContact O-CG 3.45Å; S114-L118 PolarHBondContact O-N 2.83Å; Q115-L118 WeakPolarHBondContact O-CB 3.4Å; Q115-L118 PolarHBondContact O-N 2.89Å; F116-L118 VanDerWaalsContact C-N 3.3Å; F116-L118 PolarHBondContact O-N 2.96Å; L118-I120 PolarHBondContact O-N 3.02Å; L118-F121 CarbonylContact O-C 3.56Å; L118-F121 WeakPolarHBondContact O-CA 3.46Å; L118-F121 VanDerWaalsContact O-CB 3.27Å; L118-F121 WeakPolarHBondContact O-CB 3.11Å; L118-F121 PolarHBondContact O-N 3Å; L118-I122 WeakPolarHBondContact O-CD1 3.36Å; L118-I122 WeakPolarHBondContact O-CG1 3.23Å; L118-I122 PolarHBondContact O-N 2.96Å
119	V	79	Confident	78.8	Confident	11 Å²	11	37.1 Å²	37.1	7%	0.067	18%	0.18	C	C	.	.	H	α-helix	trans	-50.1	-46.3	173	175.2	0	0	0	0	110.8	F9 Q115 F116 F121 I122 I123 I131 I135	F9-V119 HydrophobicContact CZ-CG1 4.31Å; Q115-V119 WeakPolarHBondContact O-CG2 2.98Å; Q115-V119 PolarHBondContact O-N 2.73Å; F116-V119 WeakPolarHBondContact O-CB 3.18Å; F116-V119 PolarHBondContact O-N 2.91Å; F116-V119 VanDerWaalsContact O-N 3.15Å; V119-F121 PolarHBondContact O-N 3.21Å; V119-I122 PolarHBondContact O-N 3.1Å; V119-I123 HydrophobicContact CG1-CD1 4.18Å; V119-I123 HydrophobicContact CG1-CG1 4.42Å; V119-I123 VanDerWaalsContact O-CG1 3.28Å; V119-I123 WeakPolarHBondContact O-CG1 3.32Å; V119-I123 PolarHBondContact O-N 3.01Å; V119-I131 HydrophobicContact CG1-CG2 4.17Å; V119-I135 HydrophobicContact CG1-CD1 3.97Å; V119-I135 HydrophobicContact CG1-CG1 4.23Å; V119-I135 HydrophobicContact CG2-CD1 4.43Å; V119-I135 HydrophobicContact CG2-CG1 3.78Å
120	I	76.7	Confident	78.8	Confident	15 Å²	15	37.7 Å²	37.7	8%	0.077	18%	0.182	C	C	.	.	H	α-helix	trans	-61.3	-43	176.9	-59	175.9	0	0	0	111.9	F37 V67 T71 F116 A117 L118 I122 I123	F37-I120 HydrophobicContact CE1-CD1 4.07Å; V67-I120 HydrophobicContact CG1-CD1 4.44Å; T71-I120 HydrophobicContact CG2-CD1 3.52Å; T71-I120 HydrophobicContact CG2-CG1 3.46Å; T71-I120 VanDerWaalsContact CG2-CG1 3.46Å; F116-I120 WeakPolarHBondContact O-CG1 3.18Å; F116-I120 PolarHBondContact O-N 2.66Å; F116-I120 VanDerWaalsContact O-N 3.11Å; A117-I120 WeakPolarHBondContact O-CB 3.27Å; A117-I120 PolarHBondContact O-N 3.4Å; L118-I120 PolarHBondContact O-N 3.02Å; I120-I122 VanDerWaalsContact C-N 3.33Å; I120-I122 PolarHBondContact O-N 2.95Å; I120-I123 PolarHBondContact O-N 3.48Å
121	F	79.7	Confident	78.7	Confident	28 Å²	28	36.6 Å²	36.6	12%	0.123	18%	0.178	C	C	.	.	H	α-helix	trans	-60.4	-40.1	175.9	170.3	-92	0	0	0	112.4	H84 Y88 A117 L118 V119 W124	H84-F121 AromaticContact CD2-CE2 3.85Å; H84-F121 AromaticContact CE1-CD2 3.33Å; H84-F121 WeakPolarHBondContact CE1-CD2 3.36Å; H84-F121 AromaticContact CE1-CE2 2.84Å; H84-F121 WeakPolarHBondContact CE1-CE2 3.47Å; H84-F121 AromaticContact CE1-CZ 3.27Å; H84-F121 WeakPolarHBondContact CE1-CZ 3.27Å; H84-F121 AromaticContact CG-CD2 3.85Å; H84-F121 AromaticContact CG-CE2 3.98Å; H84-F121 AromaticContact ND1-CD2 3.29Å; H84-F121 VanDerWaalsContact ND1-CD2 3.29Å; H84-F121 WeakPolarHBondContact ND1-CD2 3.11Å; H84-F121 AromaticContact ND1-CE2 3.36Å; H84-F121 WeakPolarHBondContact ND1-CE2 3.34Å; H84-F121 AromaticContact NE2-CD2 3.82Å; H84-F121 AromaticContact NE2-CE2 3.14Å; H84-F121 WeakPolarHBondContact NE2-CE2 3.49Å; H84-F121 AromaticContact NE2-CZ 3.79Å; Y88-F121 HydrophobicContact CD2-CD2 4.37Å; Y88-F121 HydrophobicContact CD2-CE2 4.06Å; Y88-F121 HydrophobicContact CG-CD2 4.44Å; Y88-F121 HydrophobicContact CG-CE2 4.25Å; A117-F121 PolarHBondContact O-N 2.88Å; A117-F121 VanDerWaalsContact O-N 3.1Å; L118-F121 CarbonylContact O-C 3.56Å; L118-F121 WeakPolarHBondContact O-CA 3.46Å; L118-F121 VanDerWaalsContact O-CB 3.27Å; L118-F121 WeakPolarHBondContact O-CB 3.11Å; L118-F121 PolarHBondContact O-N 3Å; V119-F121 PolarHBondContact O-N 3.21Å; F121-W124 WeakPolarHBondContact O-CB 3.36Å
122	I	78	Confident	78.4	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-77.4	-29.8	178.2	-48	126	0	0	0	111.4	L118 V119 I120 W124 T125 L130 I131 Q192	L118-I122 WeakPolarHBondContact O-CD1 3.36Å; L118-I122 WeakPolarHBondContact O-CG1 3.23Å; L118-I122 PolarHBondContact O-N 2.96Å; V119-I122 PolarHBondContact O-N 3.1Å; I120-I122 VanDerWaalsContact C-N 3.33Å; I120-I122 PolarHBondContact O-N 2.95Å; I122-W124 PolarHBondContact O-N 3.44Å; I122-W124 VanDerWaalsContact O-N 3.1Å; I122-T125 VanDerWaalsContact O-CB 3.28Å; I122-T125 WeakPolarHBondContact O-CB 3.47Å; I122-T125 WeakPolarHBondContact O-CG2 3.37Å; I122-T125 PolarHBondContact O-N 3.35Å; I122-T125 PolarHBondContact O-OG1 3.32Å; I122-L130 HydrophobicContact CG2-CD2 3.75Å; I122-L130 HydrophobicContact CG2-CG 4.19Å; I122-I131 HydrophobicContact CB-CG1 4.03Å; I122-I131 HydrophobicContact CG2-CD1 4.47Å; I122-I131 HydrophobicContact CG2-CG1 3.54Å; I122-Q192 VanDerWaalsContact CD1-OE1 3.26Å
123	I	75.2	Confident	78.4	Confident	10 Å²	10	41.9 Å²	41.9	5%	0.051	20%	0.202	C	C	.	.	H	α-helix	trans	-53.1	-36.8	177.1	-72.4	165.9	0	0	0	111.2	F9 L13 I75 V119 I120 T125 N126 I131	F9-I123 HydrophobicContact CE2-CD1 4.11Å; F9-I123 HydrophobicContact CZ-CD1 3.65Å; F9-I123 HydrophobicContact CZ-CG1 3.83Å; L13-I123 HydrophobicContact CD2-CG2 4.42Å; I75-I123 HydrophobicContact CD1-CG2 4.13Å; V119-I123 HydrophobicContact CG1-CD1 4.18Å; V119-I123 HydrophobicContact CG1-CG1 4.42Å; V119-I123 VanDerWaalsContact O-CG1 3.28Å; V119-I123 WeakPolarHBondContact O-CG1 3.32Å; V119-I123 PolarHBondContact O-N 3.01Å; I120-I123 PolarHBondContact O-N 3.48Å; I123-T125 PolarHBondContact O-N 3.19Å; I123-T125 VanDerWaalsContact O-N 3.07Å; I123-N126 PolarHBondContact O-N 3.36Å; I123-N126 VanDerWaalsContact O-N 3.15Å; I123-I131 HydrophobicContact CB-CD1 4.48Å; I123-I131 HydrophobicContact CG1-CD1 4.11Å
124	W	75.8	Confident	78.5	Confident	88 Å²	88	41.7 Å²	41.7	33%	0.333	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-30.5	175.7	176.6	73.5	0	0	0	114	L80 Y81 H84 F121 I122 N126	L80-W124 VanDerWaalsContact O-CD1 3.28Å; Y81-W124 HydrophobicContact CE1-CZ2 4.49Å; H84-W124 HydrophobicContact CB-CB 4.18Å; H84-W124 HydrophobicContact CB-CD2 4.17Å; H84-W124 HydrophobicContact CB-CG 3.88Å; H84-W124 AromaticContact CE1-CE3 3.55Å; H84-W124 AromaticContact CE1-CZ3 3.84Å; H84-W124 AromaticContact ND1-CD2 3.63Å; H84-W124 AromaticContact ND1-CE3 3.34Å; H84-W124 VanDerWaalsContact ND1-CE3 3.34Å; H84-W124 AromaticContact ND1-CG 3.91Å; F121-W124 WeakPolarHBondContact O-CB 3.36Å; I122-W124 PolarHBondContact O-N 3.44Å; I122-W124 VanDerWaalsContact O-N 3.1Å; W124-N126 VanDerWaalsContact C-N 3.28Å; W124-N126 PolarHBondContact O-N 2.96Å
125	T	74	Confident	78.2	Confident	20 Å²	20	44.3 Å²	44.3	12%	0.123	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-6	-171.3	73	0	0	0	0	113.2	I122 I123 L127 Y196	I122-T125 VanDerWaalsContact O-CB 3.28Å; I122-T125 WeakPolarHBondContact O-CB 3.47Å; I122-T125 WeakPolarHBondContact O-CG2 3.37Å; I122-T125 PolarHBondContact O-N 3.35Å; I122-T125 PolarHBondContact O-OG1 3.32Å; I123-T125 PolarHBondContact O-N 3.19Å; I123-T125 VanDerWaalsContact O-N 3.07Å; T125-L127 PolarHBondContact O-N 2.72Å; T125-Y196 VanDerWaalsContact CB-CE1 3.41Å; T125-Y196 WeakPolarHBondContact CB-OH 3.39Å; T125-Y196 HydrophobicContact CG2-CD1 3.94Å; T125-Y196 HydrophobicContact CG2-CD2 4.23Å; T125-Y196 HydrophobicContact CG2-CE1 3.19Å; T125-Y196 HydrophobicContact CG2-CE2 3.53Å; T125-Y196 HydrophobicContact CG2-CG 4.45Å; T125-Y196 VanDerWaalsContact CG2-OH 3.25Å; T125-Y196 WeakPolarHBondContact CG2-OH 3.35Å; T125-Y196 PolarHBondContact OG1-OH 3.34Å
126	N	73.9	Confident	78.1	Confident	95 Å²	95	48 Å²	48	51%	0.508	23%	0.234	S	C	.	.			trans	56.3	10.7	-179.6	-65.7	-37.4	0	0	0	115.7	I123 W124 K128	I123-N126 PolarHBondContact O-N 3.36Å; I123-N126 VanDerWaalsContact O-N 3.15Å; W124-N126 VanDerWaalsContact C-N 3.28Å; W124-N126 PolarHBondContact O-N 2.96Å; N126-K128 PolarHBondContact O-N 3.28Å
127	L	77.6	Confident	78.2	Confident	84 Å²	84	47.8 Å²	47.8	44%	0.44	24%	0.236	S	C	.	.			trans	-80.5	85.3	174.4	-63.6	-170.6	0	0	0	111.2	T125 E129 L130 I131 Y196	T125-L127 PolarHBondContact O-N 2.72Å; L127-E129 PolarHBondContact O-N 3.08Å; L127-L130 HydrophobicContact CB-CB 3.85Å; L127-L130 HydrophobicContact CD1-CD2 4.24Å; L127-L130 PolarHBondContact O-N 2.92Å; L127-L130 VanDerWaalsContact O-N 3.16Å; L127-I131 WeakPolarHBondContact O-CG1 3.35Å; L127-I131 PolarHBondContact O-N 3.37Å; L127-I131 VanDerWaalsContact O-N 3.15Å; L127-Y196 WeakPolarHBondContact CD1-OH 3.47Å
128	K	75.9	Confident	78	Confident	102 Å²	102	48.3 Å²	48.3	44%	0.443	24%	0.237	S	C	.	.	H	α-helix	trans	-53.6	-40.6	-177.7	-46.8	-157.1	167.6	-175.6	0	112.7	L13 N126 L132	L13-K128 HydrophobicContact CB-CD 4.28Å; L13-K128 HydrophobicContact CD1-CB 3.99Å; L13-K128 HydrophobicContact CD1-CD 3.49Å; L13-K128 VanDerWaalsContact CD1-CD 3.49Å; L13-K128 HydrophobicContact CD1-CG 3.62Å; L13-K128 HydrophobicContact CG-CD 4.5Å; N126-K128 PolarHBondContact O-N 3.28Å; K128-L132 WeakPolarHBondContact O-CB 3.38Å; K128-L132 PolarHBondContact O-N 3.43Å
129	E	78.8	Confident	77.8	Confident	170 Å²	170	49.5 Å²	49.5	79%	0.794	25%	0.249	S	C	*	.	H	α-helix	trans	-67.2	-42.3	-179.1	-62.7	-174.2	169.5	0	0	112.5	L127 L132 M133	L127-E129 PolarHBondContact O-N 3.08Å; E129-L132 PolarHBondContact O-N 3.47Å; E129-M133 WeakPolarHBondContact O-CB 3.46Å; E129-M133 PolarHBondContact O-N 2.88Å
130	L	78.6	Confident	77.9	Confident	17 Å²	17	54.3 Å²	54.3	9%	0.089	27%	0.274	C	S	.	.	H	α-helix	trans	-64.7	-42.7	178.6	-175.7	69.5	0	0	0	111.2	I122 L127 L132 M133 H134 Y195 Y196	I122-L130 HydrophobicContact CG2-CD2 3.75Å; I122-L130 HydrophobicContact CG2-CG 4.19Å; L127-L130 HydrophobicContact CB-CB 3.85Å; L127-L130 HydrophobicContact CD1-CD2 4.24Å; L127-L130 PolarHBondContact O-N 2.92Å; L127-L130 VanDerWaalsContact O-N 3.16Å; L130-L132 VanDerWaalsContact C-N 3.34Å; L130-M133 PolarHBondContact O-N 2.69Å; L130-H134 WeakPolarHBondContact O-CB 3.25Å; L130-H134 PolarHBondContact O-N 3.34Å; L130-Y195 HydrophobicContact CD1-CD2 3.99Å; L130-Y195 HydrophobicContact CD1-CE2 4.43Å; L130-Y195 HydrophobicContact CD1-CG 4.49Å; L130-Y196 HydrophobicContact CD2-CE2 3.96Å
131	I	77.4	Confident	78.1	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.5	-45.8	177.8	-60.4	160.5	0	0	0	110	F9 V119 I122 I123 L127 H134 I135	F9-I131 HydrophobicContact CD1-CG2 4.47Å; F9-I131 HydrophobicContact CE1-CB 4.47Å; F9-I131 HydrophobicContact CE1-CG2 3.46Å; F9-I131 VanDerWaalsContact CE1-CG2 3.46Å; F9-I131 HydrophobicContact CZ-CG2 3.83Å; V119-I131 HydrophobicContact CG1-CG2 4.17Å; I122-I131 HydrophobicContact CB-CG1 4.03Å; I122-I131 HydrophobicContact CG2-CD1 4.47Å; I122-I131 HydrophobicContact CG2-CG1 3.54Å; I123-I131 HydrophobicContact CB-CD1 4.48Å; I123-I131 HydrophobicContact CG1-CD1 4.11Å; L127-I131 WeakPolarHBondContact O-CG1 3.35Å; L127-I131 PolarHBondContact O-N 3.37Å; L127-I131 VanDerWaalsContact O-N 3.15Å; I131-H134 PolarHBondContact O-N 2.87Å; I131-I135 HydrophobicContact CG2-CD1 3.65Å; I131-I135 HydrophobicContact CG2-CG1 4.32Å; I131-I135 VanDerWaalsContact O-CG1 3.29Å; I131-I135 WeakPolarHBondContact O-CG1 3.35Å; I131-I135 PolarHBondContact O-N 3.1Å
132	L	75.9	Confident	78	Confident	74 Å²	74	53 Å²	53	39%	0.387	27%	0.268	S	S	.	.	H	α-helix	trans	-60.4	-50.3	178.2	175.5	56.6	0	0	0	112	T6 K128 E129 L130 H134 I135 L136	T6-L132 HydrophobicContact CG2-CD1 3.11Å; T6-L132 HydrophobicContact CG2-CD2 4.32Å; T6-L132 HydrophobicContact CG2-CG 4.33Å; K128-L132 WeakPolarHBondContact O-CB 3.38Å; K128-L132 PolarHBondContact O-N 3.43Å; E129-L132 PolarHBondContact O-N 3.47Å; L130-L132 VanDerWaalsContact C-N 3.34Å; L132-H134 VanDerWaalsContact C-N 3.28Å; L132-H134 PolarHBondContact O-N 2.95Å; L132-I135 PolarHBondContact O-N 3Å; L132-L136 WeakPolarHBondContact O-CB 3.43Å; L132-L136 PolarHBondContact O-N 2.97Å
133	M	80.3	Confident	78	Confident	69 Å²	69	55.4 Å²	55.4	34%	0.34	29%	0.288	S	S	.	.	H	α-helix	trans	-59	-42.7	179.7	-171.9	-141.9	68.3	0	0	111	E129 L130 L136 N137 I191	E129-M133 WeakPolarHBondContact O-CB 3.46Å; E129-M133 PolarHBondContact O-N 2.88Å; L130-M133 PolarHBondContact O-N 2.69Å; M133-L136 PolarHBondContact O-N 3.44Å; M133-N137 WeakPolarHBondContact O-CB 2.94Å; M133-N137 VanDerWaalsContact O-CG 3.3Å; M133-N137 PolarHBondContact O-N 3.19Å; M133-N137 PolarHBondContact O-ND2 3.3Å; M133-I191 HydrophobicContact CE-CG2 4.29Å
134	H	81.6	Confident	78.3	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-66.3	-47	177.9	178	89.3	0	0	0	113.1	Q115 L130 I131 L132 L136 N137 H138 S188 Q192	Q115-H134 PolarHBondContact OE1-CE1 3.44Å; Q115-H134 PolarHBondContact OE1-NE2 2.95Å; L130-H134 WeakPolarHBondContact O-CB 3.25Å; L130-H134 PolarHBondContact O-N 3.34Å; I131-H134 PolarHBondContact O-N 2.87Å; L132-H134 VanDerWaalsContact C-N 3.28Å; L132-H134 PolarHBondContact O-N 2.95Å; H134-L136 VanDerWaalsContact C-N 3.26Å; H134-L136 PolarHBondContact O-N 2.64Å; H134-N137 PolarHBondContact O-N 3.35Å; H134-H138 WeakPolarHBondContact O-CB 3.48Å; H134-H138 PolarHBondContact O-N 2.99Å; H134-S188 PolarHBondContact CE1-O 2.91Å; H134-S188 PolarHBondContact ND1-O 3.06Å; H134-S188 VanDerWaalsContact ND1-O 3.08Å; H134-Q192 PolarHBondContact CE1-OE1 3.41Å; H134-Q192 PolarHBondContact ND1-NE2 3.34Å; H134-Q192 PolarHBondContact ND1-OE1 2.87Å; H134-Q192 VanDerWaalsContact ND1-OE1 3.11Å
135	I	77.9	Confident	78.4	Confident	58 Å²	58	54.2 Å²	54.2	30%	0.297	29%	0.288	S	S	.	.	H	α-helix	trans	-59.4	-41.3	178.2	-69.8	169.5	0	0	0	110.4	F9 V119 I131 L132 A139	F9-I135 HydrophobicContact CE1-CD1 4.3Å; F9-I135 HydrophobicContact CZ-CD1 4.3Å; V119-I135 HydrophobicContact CG1-CD1 3.97Å; V119-I135 HydrophobicContact CG1-CG1 4.23Å; V119-I135 HydrophobicContact CG2-CD1 4.43Å; V119-I135 HydrophobicContact CG2-CG1 3.78Å; I131-I135 HydrophobicContact CG2-CD1 3.65Å; I131-I135 HydrophobicContact CG2-CG1 4.32Å; I131-I135 VanDerWaalsContact O-CG1 3.29Å; I131-I135 WeakPolarHBondContact O-CG1 3.35Å; I131-I135 PolarHBondContact O-N 3.1Å; L132-I135 PolarHBondContact O-N 3Å; I135-A139 VanDerWaalsContact O-CB 3.32Å; I135-A139 WeakPolarHBondContact O-CB 3.4Å; I135-A139 PolarHBondContact O-N 3.03Å
136	L	79.8	Confident	78.6	Confident	80 Å²	80	56.5 Å²	56.5	42%	0.419	30%	0.296	S	S	.	.	H	α-helix	trans	-65.3	-50	178.6	-174.4	67.4	0	0	0	111.7	L132 M133 H134 H138 A139 L140	L132-L136 WeakPolarHBondContact O-CB 3.43Å; L132-L136 PolarHBondContact O-N 2.97Å; M133-L136 PolarHBondContact O-N 3.44Å; H134-L136 VanDerWaalsContact C-N 3.26Å; H134-L136 PolarHBondContact O-N 2.64Å; L136-H138 VanDerWaalsContact C-N 3.33Å; L136-H138 PolarHBondContact O-N 2.97Å; L136-A139 PolarHBondContact O-N 3Å; L136-L140 HydrophobicContact CG-CD1 4.39Å; L136-L140 WeakPolarHBondContact O-CG 3.47Å; L136-L140 PolarHBondContact O-N 3.43Å
137	N	82	Confident	78.8	Confident	63 Å²	63	56.8 Å²	56.8	34%	0.337	30%	0.297	S	S	.	.	H	α-helix	trans	-61.7	-42.4	178.4	-74.8	-13.9	0	0	0	111.5	M133 H134 L140 A141	M133-N137 WeakPolarHBondContact O-CB 2.94Å; M133-N137 VanDerWaalsContact O-CG 3.3Å; M133-N137 PolarHBondContact O-N 3.19Å; M133-N137 PolarHBondContact O-ND2 3.3Å; H134-N137 PolarHBondContact O-N 3.35Å; N137-L140 PolarHBondContact O-N 2.79Å; N137-A141 VanDerWaalsContact O-CB 3.26Å; N137-A141 WeakPolarHBondContact O-CB 3.33Å; N137-A141 PolarHBondContact O-N 2.83Å
138	H	77.8	Confident	78.7	Confident	17 Å²	17	52.8 Å²	52.8	8%	0.079	28%	0.276	C	S	.	.	H	α-helix	trans	-61.4	-45.2	175.2	172.3	-109.2	0	0	0	111.9	Q115 H134 L136 L140 A141 K142	Q115-H138 WeakPolarHBondContact CB-CD2 3.29Å; Q115-H138 WeakPolarHBondContact CB-NE2 3.37Å; Q115-H138 VanDerWaalsContact CG-CD2 3.42Å; Q115-H138 WeakPolarHBondContact CG-CD2 3.22Å; Q115-H138 WeakPolarHBondContact CG-NE2 3.43Å; H134-H138 WeakPolarHBondContact O-CB 3.48Å; H134-H138 PolarHBondContact O-N 2.99Å; L136-H138 VanDerWaalsContact C-N 3.33Å; L136-H138 PolarHBondContact O-N 2.97Å; H138-L140 PolarHBondContact O-N 3.27Å; H138-A141 PolarHBondContact O-N 3.21Å; H138-K142 WeakPolarHBondContact NE2-CE 3.49Å; H138-K142 VanDerWaalsContact NE2-CG 3.28Å; H138-K142 WeakPolarHBondContact NE2-CG 3.35Å; H138-K142 WeakPolarHBondContact O-CB 3.44Å; H138-K142 VanDerWaalsContact O-CG 3.3Å; H138-K142 WeakPolarHBondContact O-CG 3.16Å; H138-K142 PolarHBondContact O-N 3.11Å
139	A	78.3	Confident	78.7	Confident	39 Å²	39	49.1 Å²	49.1	32%	0.322	26%	0.261	S	S	.	.	H	α-helix	trans	-62.4	-42	178.8	0	0	0	0	0	112.1	I135 L136 A143	I135-A139 VanDerWaalsContact O-CB 3.32Å; I135-A139 WeakPolarHBondContact O-CB 3.4Å; I135-A139 PolarHBondContact O-N 3.03Å; L136-A139 PolarHBondContact O-N 3Å; A139-A143 WeakPolarHBondContact O-CB 3.35Å; A139-A143 PolarHBondContact O-N 3.28Å
140	L	80.6	Confident	78.5	Confident	111 Å²	111	42.5 Å²	42.5	58%	0.581	24%	0.238	S	C	*	.	H	α-helix	trans	-64.8	-47	176	-70	171.5	0	0	0	111.7	L136 N137 H138 K142 A143 L144	L136-L140 HydrophobicContact CG-CD1 4.39Å; L136-L140 WeakPolarHBondContact O-CG 3.47Å; L136-L140 PolarHBondContact O-N 3.43Å; N137-L140 PolarHBondContact O-N 2.79Å; H138-L140 PolarHBondContact O-N 3.27Å; L140-K142 PolarHBondContact O-N 3.19Å; L140-A143 PolarHBondContact O-N 2.94Å; L140-L144 PolarHBondContact O-N 3.36Å; L140-L144 VanDerWaalsContact O-N 3.09Å
141	A	81.8	Confident	78.2	Confident	5 Å²	5	44.8 Å²	44.8	4%	0.041	25%	0.25	C	S	.	.	H	α-helix	trans	-61.1	-42.9	177.8	0	0	0	0	0	112.4	N137 H138 L144 L145 S184 V185	N137-A141 VanDerWaalsContact O-CB 3.26Å; N137-A141 WeakPolarHBondContact O-CB 3.33Å; N137-A141 PolarHBondContact O-N 2.83Å; H138-A141 PolarHBondContact O-N 3.21Å; A141-L144 WeakPolarHBondContact O-CB 3.49Å; A141-L144 PolarHBondContact O-N 3.3Å; A141-L145 PolarHBondContact O-N 3.44Å; A141-L145 VanDerWaalsContact O-N 3.09Å; A141-S184 WeakPolarHBondContact CB-OG 3.12Å; A141-V185 HydrophobicContact CB-CG2 3.68Å
142	K	77.5	Confident	78	Confident	12 Å²	12	47.7 Å²	47.7	5%	0.052	26%	0.263	C	S	.	.	H	α-helix	trans	-66.3	-41.3	176	-72.1	-63.5	-178.2	-174.1	0	112.1	S111 T112 H138 L140 L144 L145 F146	S111-K142 VanDerWaalsContact CB-NZ 3.27Å; S111-K142 WeakPolarHBondContact O-CE 3.3Å; S111-K142 PolarHBondContact O-NZ 3.34Å; S111-K142 PolarHBondContact OG-NZ 3.02Å; T112-K142 HydrophobicContact CG2-CD 3.85Å; T112-K142 HydrophobicContact CG2-CG 4.41Å; H138-K142 WeakPolarHBondContact NE2-CE 3.49Å; H138-K142 VanDerWaalsContact NE2-CG 3.28Å; H138-K142 WeakPolarHBondContact NE2-CG 3.35Å; H138-K142 WeakPolarHBondContact O-CB 3.44Å; H138-K142 VanDerWaalsContact O-CG 3.3Å; H138-K142 WeakPolarHBondContact O-CG 3.16Å; H138-K142 PolarHBondContact O-N 3.11Å; L140-K142 PolarHBondContact O-N 3.19Å; K142-L144 VanDerWaalsContact C-N 3.28Å; K142-L144 PolarHBondContact O-N 3.4Å; K142-L145 PolarHBondContact O-N 3.45Å; K142-F146 HydrophobicContact CB-CD2 4.42Å; K142-F146 WeakPolarHBondContact O-CD2 3.25Å; K142-F146 PolarHBondContact O-N 2.75Å
143	A	78.3	Confident	77.9	Confident	50 Å²	50	46.7 Å²	46.7	41%	0.413	26%	0.257	S	S	.	.	H	α-helix	trans	-58.2	-43.2	175.7	0	0	0	0	0	111.4	A139 L140 F146 I147	A139-A143 WeakPolarHBondContact O-CB 3.35Å; A139-A143 PolarHBondContact O-N 3.28Å; L140-A143 PolarHBondContact O-N 2.94Å; A143-F146 PolarHBondContact O-N 3.42Å; A143-I147 VanDerWaalsContact O-CG1 3.3Å; A143-I147 WeakPolarHBondContact O-CG1 3.13Å; A143-I147 PolarHBondContact O-N 3.4Å; A143-I147 VanDerWaalsContact O-N 3.08Å
144	L	81.1	Confident	77.5	Confident	55 Å²	55	48.7 Å²	48.7	29%	0.288	27%	0.268	S	S	.	.	H	α-helix	trans	-60.4	-46.8	176	-163.5	72.1	0	0	0	112.2	L140 A141 K142 I147 S148 L177 I180	L140-L144 PolarHBondContact O-N 3.36Å; L140-L144 VanDerWaalsContact O-N 3.09Å; A141-L144 WeakPolarHBondContact O-CB 3.49Å; A141-L144 PolarHBondContact O-N 3.3Å; K142-L144 VanDerWaalsContact C-N 3.28Å; K142-L144 PolarHBondContact O-N 3.4Å; L144-I147 PolarHBondContact O-N 2.91Å; L144-S148 PolarHBondContact O-N 3.22Å; L144-S148 PolarHBondContact O-OG 2.98Å; L144-L177 HydrophobicContact CD1-CD1 3.62Å; L144-L177 HydrophobicContact CD1-CG 4.15Å; L144-L177 HydrophobicContact CD2-CD1 4.19Å; L144-L177 HydrophobicContact CG-CD1 3.99Å; L144-L177 HydrophobicContact CG-CG 4.13Å; L144-I180 HydrophobicContact CD2-CG2 4.06Å
145	L	77.5	Confident	76.9	Confident	18 Å²	18	53.4 Å²	53.4	9%	0.094	29%	0.289	C	S	.	.	H	α-helix	trans	-64.7	-39.6	178.2	-77.1	172.2	0	0	0	113	L108 A141 K142 I147 S148 I149 V185	L108-L145 HydrophobicContact CD1-CB 4.26Å; L108-L145 HydrophobicContact CD1-CD1 4.43Å; A141-L145 PolarHBondContact O-N 3.44Å; A141-L145 VanDerWaalsContact O-N 3.09Å; K142-L145 PolarHBondContact O-N 3.45Å; L145-I147 VanDerWaalsContact C-N 3.35Å; L145-S148 WeakPolarHBondContact CA-OG 3.29Å; L145-S148 PolarHBondContact O-N 2.82Å; L145-S148 PolarHBondContact O-OG 2.85Å; L145-I149 WeakPolarHBondContact O-CB 3.4Å; L145-I149 WeakPolarHBondContact O-CD1 3.05Å; L145-I149 VanDerWaalsContact O-CG1 3.25Å; L145-I149 WeakPolarHBondContact O-CG1 3.43Å; L145-I149 PolarHBondContact O-N 2.79Å; L145-V185 HydrophobicContact CD1-CG2 3.72Å
146	F	78.7	Confident	76.4	Confident	67 Å²	67	55 Å²	55	29%	0.294	30%	0.297	S	S	.	.	H	α-helix	trans	-65.8	-39.1	177	-86.8	-70.9	0	0	0	111.7	T56 L108 K142 A143 G150	T56-F146 HydrophobicContact CG2-CD1 4.22Å; T56-F146 HydrophobicContact CG2-CE1 3.61Å; T56-F146 HydrophobicContact CG2-CZ 4.25Å; L108-F146 HydrophobicContact CD2-CD1 3.44Å; L108-F146 VanDerWaalsContact CD2-CD1 3.44Å; L108-F146 HydrophobicContact CD2-CD2 4.32Å; L108-F146 HydrophobicContact CD2-CE1 3.16Å; L108-F146 HydrophobicContact CD2-CE2 4.07Å; L108-F146 HydrophobicContact CD2-CG 4.02Å; L108-F146 HydrophobicContact CD2-CZ 3.5Å; L108-F146 VanDerWaalsContact CD2-CZ 3.5Å; L108-F146 HydrophobicContact CG-CE1 4.09Å; L108-F146 HydrophobicContact CG-CE2 4.39Å; L108-F146 HydrophobicContact CG-CZ 3.94Å; K142-F146 HydrophobicContact CB-CD2 4.42Å; K142-F146 WeakPolarHBondContact O-CD2 3.25Å; K142-F146 PolarHBondContact O-N 2.75Å; A143-F146 PolarHBondContact O-N 3.42Å; F146-G150 PolarHBondContact O-N 2.88Å
147	I	76.8	Confident	75.8	Confident	101 Å²	101	59.2 Å²	59.2	52%	0.518	31%	0.312	S	S	.	.	H	α-helix	trans	-66.5	-46	175.6	-67.3	166.1	0	0	0	110.2	A143 L144 L145 G150 L151	A143-I147 VanDerWaalsContact O-CG1 3.3Å; A143-I147 WeakPolarHBondContact O-CG1 3.13Å; A143-I147 PolarHBondContact O-N 3.4Å; A143-I147 VanDerWaalsContact O-N 3.08Å; L144-I147 PolarHBondContact O-N 2.91Å; L145-I147 VanDerWaalsContact C-N 3.35Å; I147-G150 PolarHBondContact O-N 3.41Å; I147-L151 HydrophobicContact CG2-CD1 3.85Å; I147-L151 HydrophobicContact CG2-CG 4.43Å; I147-L151 WeakPolarHBondContact O-CB 3.42Å; I147-L151 VanDerWaalsContact O-CG 3.27Å; I147-L151 WeakPolarHBondContact O-CG 3.27Å; I147-L151 PolarHBondContact O-N 3.41Å
148	S	76.9	Confident	74.8	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-64.3	-43.4	-178.7	72.6	0	0	0	0	112.4	L144 L145 F152 C178	L144-S148 PolarHBondContact O-N 3.22Å; L144-S148 PolarHBondContact O-OG 2.98Å; L145-S148 WeakPolarHBondContact CA-OG 3.29Å; L145-S148 PolarHBondContact O-N 2.82Å; L145-S148 PolarHBondContact O-OG 2.85Å; S148-F152 WeakPolarHBondContact O-CB 3.29Å; S148-F152 PolarHBondContact O-N 3.5Å; S148-C178 WeakPolarHBondContact CB-SG 3.21Å; S148-C178 PolarHBondContact OG-SG 2.68Å
149	I	74.9	Confident	73.5	Confident	26 Å²	26	60.7 Å²	60.7	13%	0.133	33%	0.334	C	S	.	.	H	α-helix	trans	-69.2	-40.1	176.1	-66.5	165.5	0	0	0	110.9	L108 L145 F152 I153	L108-I149 HydrophobicContact CD1-CD1 4.1Å; L108-I149 HydrophobicContact CD2-CD1 3.8Å; L108-I149 HydrophobicContact CG-CD1 4.41Å; L145-I149 WeakPolarHBondContact O-CB 3.4Å; L145-I149 WeakPolarHBondContact O-CD1 3.05Å; L145-I149 VanDerWaalsContact O-CG1 3.25Å; L145-I149 WeakPolarHBondContact O-CG1 3.43Å; L145-I149 PolarHBondContact O-N 2.79Å; I149-F152 WeakPolarHBondContact O-CB 3.38Å; I149-F152 PolarHBondContact O-N 3Å; I149-I153 HydrophobicContact CG2-CD1 3.79Å; I149-I153 HydrophobicContact CG2-CG1 4.31Å; I149-I153 VanDerWaalsContact O-CG1 3.27Å; I149-I153 WeakPolarHBondContact O-CG1 3.33Å; I149-I153 PolarHBondContact O-N 3Å
150	G	74.6	Confident	72.2	Confident	30 Å²	30	67.7 Å²	67.7	31%	0.309	36%	0.36	S	S	.	.	H	α-helix	trans	-59.6	-46.8	176.4	0	0	0	0	0	112	F146 I147 I153 I154	F146-G150 PolarHBondContact O-N 2.88Å; I147-G150 PolarHBondContact O-N 3.41Å; G150-I153 PolarHBondContact O-N 3.31Å; G150-I154 WeakPolarHBondContact O-CG1 3.47Å; G150-I154 PolarHBondContact O-N 2.82Å; G150-I154 VanDerWaalsContact O-N 3.11Å
151	L	73.2	Confident	70.7	Confident	66 Å²	66	67.7 Å²	67.7	35%	0.346	36%	0.36	S	S	.	.	H	α-helix	trans	-62.3	-45.9	173.9	-68.1	169.8	0	0	0	111.1	I147 I153 I154 F155 F174	I147-L151 HydrophobicContact CG2-CD1 3.85Å; I147-L151 HydrophobicContact CG2-CG 4.43Å; I147-L151 WeakPolarHBondContact O-CB 3.42Å; I147-L151 VanDerWaalsContact O-CG 3.27Å; I147-L151 WeakPolarHBondContact O-CG 3.27Å; I147-L151 PolarHBondContact O-N 3.41Å; L151-I153 VanDerWaalsContact C-N 3.33Å; L151-I153 PolarHBondContact O-N 3.45Å; L151-I154 PolarHBondContact O-N 2.86Å; L151-I154 VanDerWaalsContact O-N 3.12Å; L151-F155 HydrophobicContact CB-CD2 4.41Å; L151-F155 HydrophobicContact CB-CE2 4.26Å; L151-F155 WeakPolarHBondContact O-CD2 3.28Å; L151-F155 PolarHBondContact O-N 3.37Å; L151-F174 HydrophobicContact CB-CD1 4.09Å; L151-F174 HydrophobicContact CB-CE1 3.69Å; L151-F174 HydrophobicContact CD1-CD1 4.49Å; L151-F174 HydrophobicContact CD1-CE1 3.84Å; L151-F174 HydrophobicContact CG-CE1 4.3Å
152	F	72.5	Confident	69.4	Low	60 Å²	60	72.2 Å²	72.2	26%	0.263	39%	0.389	S	S	.	.	H	α-helix	trans	-56.4	-43.7	177.4	179.6	-104.3	0	0	0	113	L104 S148 I149 F155 I156	L104-F152 HydrophobicContact CD1-CD1 4.24Å; L104-F152 HydrophobicContact CD1-CE1 3.86Å; S148-F152 WeakPolarHBondContact O-CB 3.29Å; S148-F152 PolarHBondContact O-N 3.5Å; I149-F152 WeakPolarHBondContact O-CB 3.38Å; I149-F152 PolarHBondContact O-N 3Å; F152-F155 PolarHBondContact O-N 3.17Å; F152-I156 HydrophobicContact CD1-CD1 3.85Å; F152-I156 HydrophobicContact CD2-CD1 4.18Å; F152-I156 HydrophobicContact CE1-CD1 3.28Å; F152-I156 HydrophobicContact CE2-CD1 3.65Å; F152-I156 HydrophobicContact CE2-CG1 4.44Å; F152-I156 HydrophobicContact CG-CD1 4.28Å; F152-I156 HydrophobicContact CZ-CD1 3.19Å; F152-I156 HydrophobicContact CZ-CG1 4.38Å; F152-I156 WeakPolarHBondContact O-CG1 3.43Å; F152-I156 PolarHBondContact O-N 3.26Å
153	I	73.7	Confident	68.5	Low	53 Å²	53	74.8 Å²	74.8	27%	0.272	42%	0.419	S	S	.	.	H	α-helix	trans	-63.2	-44.6	176.3	-68.9	168.4	0	0	0	110.3	I149 G150 L151 F155 I156 F157	I149-I153 HydrophobicContact CG2-CD1 3.79Å; I149-I153 HydrophobicContact CG2-CG1 4.31Å; I149-I153 VanDerWaalsContact O-CG1 3.27Å; I149-I153 WeakPolarHBondContact O-CG1 3.33Å; I149-I153 PolarHBondContact O-N 3Å; G150-I153 PolarHBondContact O-N 3.31Å; L151-I153 VanDerWaalsContact C-N 3.33Å; L151-I153 PolarHBondContact O-N 3.45Å; I153-F155 VanDerWaalsContact C-N 3.34Å; I153-F155 PolarHBondContact O-N 3.26Å; I153-I156 PolarHBondContact O-N 2.95Å; I153-F157 HydrophobicContact CG2-CD2 3.69Å; I153-F157 HydrophobicContact CG2-CE2 4.14Å; I153-F157 WeakPolarHBondContact O-CB 3.19Å; I153-F157 WeakPolarHBondContact O-CD2 3.44Å; I153-F157 PolarHBondContact O-N 3.31Å
154	I	71.8	Confident	67.4	Low	112 Å²	112	74.8 Å²	74.8	57%	0.574	41%	0.414	S	S	*	.	H	α-helix	trans	-62	-41.9	177.4	-65.6	164.6	0	0	0	110.9	G150 L151 I156 G158	G150-I154 WeakPolarHBondContact O-CG1 3.47Å; G150-I154 PolarHBondContact O-N 2.82Å; G150-I154 VanDerWaalsContact O-N 3.11Å; L151-I154 PolarHBondContact O-N 2.86Å; L151-I154 VanDerWaalsContact O-N 3.12Å; I154-I156 PolarHBondContact O-N 3.28Å; I154-G158 VanDerWaalsContact O-CA 3.24Å; I154-G158 WeakPolarHBondContact O-CA 2.99Å; I154-G158 PolarHBondContact O-N 3.28Å
155	F	69.2	Low	66	Low	99 Å²	99	79.8 Å²	79.8	43%	0.434	43%	0.429	S	S	.	.	H	α-helix	trans	-66.6	-34.1	177.3	-77.9	-67.7	0	0	0	113.4	L151 F152 I153 N159 F174	L151-F155 HydrophobicContact CB-CD2 4.41Å; L151-F155 HydrophobicContact CB-CE2 4.26Å; L151-F155 WeakPolarHBondContact O-CD2 3.28Å; L151-F155 PolarHBondContact O-N 3.37Å; F152-F155 PolarHBondContact O-N 3.17Å; I153-F155 VanDerWaalsContact C-N 3.34Å; I153-F155 PolarHBondContact O-N 3.26Å; F155-N159 PolarHBondContact O-ND2 3.49Å; F155-F174 HydrophobicContact CD2-CE1 4.07Å; F155-F174 HydrophobicContact CD2-CE2 4.19Å; F155-F174 AromaticContact CD2-CZ 3.83Å; F155-F174 HydrophobicContact CD2-CZ 3.83Å; F155-F174 HydrophobicContact CE2-CD1 4.45Å; F155-F174 AromaticContact CE2-CE1 3.51Å; F155-F174 HydrophobicContact CE2-CE1 3.51Å; F155-F174 AromaticContact CE2-CE2 3.72Å; F155-F174 HydrophobicContact CE2-CE2 3.72Å; F155-F174 AromaticContact CE2-CZ 3.06Å; F155-F174 HydrophobicContact CE2-CZ 3.06Å; F155-F174 HydrophobicContact CZ-CE1 4.43Å; F155-F174 HydrophobicContact CZ-CE2 4.08Å; F155-F174 AromaticContact CZ-CZ 3.6Å; F155-F174 HydrophobicContact CZ-CZ 3.6Å
156	I	67.8	Low	64.6	Low	91 Å²	91	85.8 Å²	85.8	47%	0.467	46%	0.461	S	S	.	.	H	α-helix	trans	-77.1	-43.1	178.6	-71.9	179.9	0	0	0	111.9	F152 I153 I154	F152-I156 HydrophobicContact CD1-CD1 3.85Å; F152-I156 HydrophobicContact CD2-CD1 4.18Å; F152-I156 HydrophobicContact CE1-CD1 3.28Å; F152-I156 HydrophobicContact CE2-CD1 3.65Å; F152-I156 HydrophobicContact CE2-CG1 4.44Å; F152-I156 HydrophobicContact CG-CD1 4.28Å; F152-I156 HydrophobicContact CZ-CD1 3.19Å; F152-I156 HydrophobicContact CZ-CG1 4.38Å; F152-I156 WeakPolarHBondContact O-CG1 3.43Å; F152-I156 PolarHBondContact O-N 3.26Å; I153-I156 PolarHBondContact O-N 2.95Å; I154-I156 PolarHBondContact O-N 3.28Å
157	F	66.3	Low	63.5	Low	168 Å²	168	87.7 Å²	87.7	74%	0.737	47%	0.473	S	S	*	.	H	α-helix	trans	-93	-21.5	-174.5	-71.8	-78.5	0	0	0	114	I153	I153-F157 HydrophobicContact CG2-CD2 3.69Å; I153-F157 HydrophobicContact CG2-CE2 4.14Å; I153-F157 WeakPolarHBondContact O-CB 3.19Å; I153-F157 WeakPolarHBondContact O-CD2 3.44Å; I153-F157 PolarHBondContact O-N 3.31Å
158	G	60.7	Low	62.4	Low	55 Å²	55	86.4 Å²	86.4	57%	0.567	47%	0.467	S	S	*	.	S	Bend	trans	-84.8	-14.2	178.3	0	0	0	0	0	114.5	I154 Q160	I154-G158 VanDerWaalsContact O-CA 3.24Å; I154-G158 WeakPolarHBondContact O-CA 2.99Å; I154-G158 PolarHBondContact O-N 3.28Å; G158-Q160 PolarHBondContact O-N 3.45Å
159	N	50.4	Low	61.1	Low	56 Å²	56	93.1 Å²	93.1	30%	0.299	50%	0.503	S	S	.	.			trans	-86.8	84.8	175.8	-78.6	-32.4	0	0	0	110.4	F155 D161	F155-N159 PolarHBondContact O-ND2 3.49Å; N159-D161 PolarHBondContact O-N 2.95Å
160	Q	51.2	Low	59.9	Low	186 Å²	186	99.6 Å²	99.6	87%	0.869	53%	0.532	S	S	*	.			trans	-67.6	-11.8	167.6	-74.1	-172	-30.7	0	0	112.8	G158	G158-Q160 PolarHBondContact O-N 3.45Å
161	D	50.5	Low	59.1	Low	112 Å²	112	99.1 Å²	99.1	60%	0.599	52%	0.524	S	S	*	.			trans	-99.5	119.7	178.2	-70.5	-32.4	0	0	0	112.7	N159 G163 V164	N159-D161 PolarHBondContact O-N 2.95Å; D161-G163 PolarHBondContact O-N 3.25Å; D161-G163 VanDerWaalsContact O-N 3.11Å; D161-V164 HydrophobicContact CB-CG2 4.1Å; D161-V164 PolarHBondContact O-N 3.43Å
162	P	53.5	Low	58.5	Low	100 Å²	100	101.2 Å²	101.2	65%	0.649	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-13.4	178.8	24.1	-31.5	0	0	0	114.1	R165	P162-R165 WeakPolarHBondContact O-CB 3.3Å
163	G	58.8	Low	58.1	Low	66 Å²	66	104.4 Å²	104.4	68%	0.68	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-21.3	179.9	0	0	0	0	0	115.7	D161 R165	D161-G163 PolarHBondContact O-N 3.25Å; D161-G163 VanDerWaalsContact O-N 3.11Å; G163-R165 PolarHBondContact O-N 3.5Å
164	V	55.3	Low	57.7	Low	50 Å²	50	104.4 Å²	104.4	30%	0.303	55%	0.554	S	S	.	*	G	3₁₀ helix	trans	-80.6	-9.9	178.7	-164.8	0	0	0	0	111.5	D161 N166 I167	D161-V164 HydrophobicContact CB-CG2 4.1Å; D161-V164 PolarHBondContact O-N 3.43Å; V164-N166 PolarHBondContact O-N 3.45Å; V164-N166 VanDerWaalsContact O-N 3.13Å; V164-I167 HydrophobicContact CG1-CD1 3.81Å; V164-I167 HydrophobicContact CG1-CG1 4.44Å; V164-I167 PolarHBondContact O-N 3.24Å
165	R	50.7	Low	57.6	Low	160 Å²	160	104.8 Å²	104.8	60%	0.604	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-64.5	-16.3	-178.2	-151.5	175.1	-67	-122.1	-1.7	113.5	P162 G163 I168	P162-R165 WeakPolarHBondContact O-CB 3.3Å; G163-R165 PolarHBondContact O-N 3.5Å; R165-I168 HydrophobicContact CB-CD1 4.41Å; R165-I168 HydrophobicContact CG-CD1 3.68Å; R165-I168 WeakPolarHBondContact O-CB 3.13Å; R165-I168 WeakPolarHBondContact O-CD1 3.34Å; R165-I168 WeakPolarHBondContact O-CG1 3.3Å
166	N	49.4	Very low	57.6	Low	143 Å²	143	103.4 Å²	103.4	77%	0.765	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-90.2	-6.7	174.4	-100.1	-1.5	0	0	0	114.8	V164 I168	V164-N166 PolarHBondContact O-N 3.45Å; V164-N166 VanDerWaalsContact O-N 3.13Å; N166-I168 PolarHBondContact O-N 3.1Å
167	I	54.4	Low	57.8	Low	108 Å²	108	101.5 Å²	101.5	55%	0.554	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-76.1	-5.8	168.7	-55.4	177.1	0	0	0	110.7	V164 N169 H170 S171	V164-I167 HydrophobicContact CG1-CD1 3.81Å; V164-I167 HydrophobicContact CG1-CG1 4.44Å; V164-I167 PolarHBondContact O-N 3.24Å; I167-N169 PolarHBondContact O-N 3.18Å; I167-N169 VanDerWaalsContact O-N 3.14Å; I167-H170 HydrophobicContact CG2-CB 4.13Å; I167-H170 WeakPolarHBondContact O-CA 3.33Å; I167-H170 PolarHBondContact O-N 3.02Å; I167-S171 PolarHBondContact O-N 3.49Å
168	I	54.2	Low	58	Low	74 Å²	74	95.2 Å²	95.2	38%	0.379	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-60.9	-22.2	175	-61.2	178	0	0	0	111.5	R165 N166 S171	R165-I168 HydrophobicContact CB-CD1 4.41Å; R165-I168 HydrophobicContact CG-CD1 3.68Å; R165-I168 WeakPolarHBondContact O-CB 3.13Å; R165-I168 WeakPolarHBondContact O-CD1 3.34Å; R165-I168 WeakPolarHBondContact O-CG1 3.3Å; N166-I168 PolarHBondContact O-N 3.1Å; I168-S171 WeakPolarHBondContact O-CB 3.39Å; I168-S171 PolarHBondContact O-N 3.11Å; I168-S171 PolarHBondContact O-OG 3.12Å
169	N	49.3	Very low	58.8	Low	141 Å²	141	96.2 Å²	96.2	75%	0.754	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-80.4	-16.3	170.4	-76.5	-10.2	0	0	0	114.4	I167 S171	I167-N169 PolarHBondContact O-N 3.18Å; I167-N169 VanDerWaalsContact O-N 3.14Å; N169-S171 VanDerWaalsContact C-N 3.32Å
170	H	50.9	Low	60.1	Low	162 Å²	162	98.1 Å²	98.1	75%	0.75	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-91.2	-0.4	171	-134.2	-56.4	0	0	0	112.5	I167 N172	I167-H170 HydrophobicContact CG2-CB 4.13Å; I167-H170 WeakPolarHBondContact O-CA 3.33Å; I167-H170 PolarHBondContact O-N 3.02Å; H170-N172 PolarHBondContact O-N 2.9Å
171	S	57.8	Low	61.3	Low	20 Å²	20	89.2 Å²	89.2	14%	0.14	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	19.1	178.4	84.2	0	0	0	0	113.5	I167 I168 N169 N173 F174 Y175	I167-S171 PolarHBondContact O-N 3.49Å; I168-S171 WeakPolarHBondContact O-CB 3.39Å; I168-S171 PolarHBondContact O-N 3.11Å; I168-S171 PolarHBondContact O-OG 3.12Å; N169-S171 VanDerWaalsContact C-N 3.32Å; S171-N173 PolarHBondContact O-N 3.27Å; S171-F174 PolarHBondContact O-N 3.37Å; S171-Y175 PolarHBondContact O-N 3.43Å; S171-Y175 VanDerWaalsContact OG-CE2 3.3Å; S171-Y175 WeakPolarHBondContact OG-CE2 3.14Å
172	N	59	Low	62.4	Low	110 Å²	110	86.9 Å²	86.9	59%	0.588	47%	0.47	S	S	*	.	H	α-helix	trans	-48.7	-32.6	174.1	-92.1	-6.8	0	0	0	112.5	H170 F174 T176	H170-N172 PolarHBondContact O-N 2.9Å; N172-F174 VanDerWaalsContact C-N 3.35Å; N172-F174 PolarHBondContact O-N 3.34Å; N172-T176 WeakPolarHBondContact O-CB 3.22Å; N172-T176 WeakPolarHBondContact O-CG2 3.21Å; N172-T176 PolarHBondContact O-N 3.36Å; N172-T176 PolarHBondContact O-OG1 2.9Å
173	N	64.6	Low	63.7	Low	127 Å²	127	86.8 Å²	86.8	68%	0.679	46%	0.463	S	S	*	.	H	α-helix	trans	-66.5	-31.7	177.6	-67.9	-4.3	0	0	0	113.2	S171 T176 L177	S171-N173 PolarHBondContact O-N 3.27Å; N173-T176 VanDerWaalsContact CA-OG1 3.26Å; N173-T176 WeakPolarHBondContact CA-OG1 3.27Å; N173-T176 PolarHBondContact O-OG1 3.48Å; N173-L177 VanDerWaalsContact O-CB 3.28Å; N173-L177 WeakPolarHBondContact O-CB 3.33Å; N173-L177 PolarHBondContact O-N 2.87Å
174	F	66.6	Low	64.7	Low	53 Å²	53	85.6 Å²	85.6	23%	0.232	45%	0.445	C	S	.	.	H	α-helix	trans	-76.2	-44.7	178.4	-66.6	-76.2	0	0	0	111.8	L151 F155 S171 N172 L177 C178	L151-F174 HydrophobicContact CB-CD1 4.09Å; L151-F174 HydrophobicContact CB-CE1 3.69Å; L151-F174 HydrophobicContact CD1-CD1 4.49Å; L151-F174 HydrophobicContact CD1-CE1 3.84Å; L151-F174 HydrophobicContact CG-CE1 4.3Å; F155-F174 HydrophobicContact CD2-CE1 4.07Å; F155-F174 HydrophobicContact CD2-CE2 4.19Å; F155-F174 AromaticContact CD2-CZ 3.83Å; F155-F174 HydrophobicContact CD2-CZ 3.83Å; F155-F174 HydrophobicContact CE2-CD1 4.45Å; F155-F174 AromaticContact CE2-CE1 3.51Å; F155-F174 HydrophobicContact CE2-CE1 3.51Å; F155-F174 AromaticContact CE2-CE2 3.72Å; F155-F174 HydrophobicContact CE2-CE2 3.72Å; F155-F174 AromaticContact CE2-CZ 3.06Å; F155-F174 HydrophobicContact CE2-CZ 3.06Å; F155-F174 HydrophobicContact CZ-CE1 4.43Å; F155-F174 HydrophobicContact CZ-CE2 4.08Å; F155-F174 AromaticContact CZ-CZ 3.6Å; F155-F174 HydrophobicContact CZ-CZ 3.6Å; S171-F174 PolarHBondContact O-N 3.37Å; N172-F174 VanDerWaalsContact C-N 3.35Å; N172-F174 PolarHBondContact O-N 3.34Å; F174-L177 PolarHBondContact O-N 2.83Å; F174-C178 PolarHBondContact O-N 3.14Å; F174-C178 PolarHBondContact O-SG 3.45Å; F174-C178 VanDerWaalsContact O-SG 3.4Å
175	Y	68	Low	65.7	Low	119 Å²	119	84 Å²	84	47%	0.467	44%	0.435	S	S	.	.	H	α-helix	trans	-64.2	-42.6	176.4	-70.9	-74.2	0	0	0	111.4	S171 L177 C178 V179	S171-Y175 PolarHBondContact O-N 3.43Å; S171-Y175 VanDerWaalsContact OG-CE2 3.3Å; S171-Y175 WeakPolarHBondContact OG-CE2 3.14Å; Y175-L177 PolarHBondContact O-N 3.34Å; Y175-C178 PolarHBondContact O-N 3.37Å; Y175-V179 WeakPolarHBondContact O-CB 3.23Å; Y175-V179 VanDerWaalsContact O-CG2 3.22Å; Y175-V179 WeakPolarHBondContact O-CG2 3.25Å; Y175-V179 PolarHBondContact O-N 2.88Å
176	T	70	Confident	66.9	Low	71 Å²	71	78.8 Å²	78.8	44%	0.436	42%	0.423	S	S	.	.	H	α-helix	trans	-62.5	-41.8	174.6	50.8	0	0	0	0	111.9	N172 N173 C178 V179 I180	N172-T176 WeakPolarHBondContact O-CB 3.22Å; N172-T176 WeakPolarHBondContact O-CG2 3.21Å; N172-T176 PolarHBondContact O-N 3.36Å; N172-T176 PolarHBondContact O-OG1 2.9Å; N173-T176 VanDerWaalsContact CA-OG1 3.26Å; N173-T176 WeakPolarHBondContact CA-OG1 3.27Å; N173-T176 PolarHBondContact O-OG1 3.48Å; T176-C178 PolarHBondContact O-N 2.86Å; T176-V179 PolarHBondContact O-N 2.86Å; T176-I180 WeakPolarHBondContact O-CB 3.39Å; T176-I180 WeakPolarHBondContact O-CD1 3.33Å; T176-I180 WeakPolarHBondContact O-CG1 3.21Å; T176-I180 PolarHBondContact O-N 3.14Å
177	L	71.9	Confident	68.2	Low	50 Å²	50	73.8 Å²	73.8	26%	0.262	40%	0.401	S	S	.	.	H	α-helix	trans	-62.2	-42.6	176.1	-163.6	72.1	0	0	0	112.3	L144 N173 F174 Y175 G181	L144-L177 HydrophobicContact CD1-CD1 3.62Å; L144-L177 HydrophobicContact CD1-CG 4.15Å; L144-L177 HydrophobicContact CD2-CD1 4.19Å; L144-L177 HydrophobicContact CG-CD1 3.99Å; L144-L177 HydrophobicContact CG-CG 4.13Å; N173-L177 VanDerWaalsContact O-CB 3.28Å; N173-L177 WeakPolarHBondContact O-CB 3.33Å; N173-L177 PolarHBondContact O-N 2.87Å; F174-L177 PolarHBondContact O-N 2.83Å; Y175-L177 PolarHBondContact O-N 3.34Å; L177-G181 PolarHBondContact O-N 2.57Å
178	C	71.4	Confident	69	Low	36 Å²	36	68.9 Å²	68.9	24%	0.243	38%	0.377	C	S	.	.	H	α-helix	trans	-63.2	-41.6	174.4	-74.1	0	0	0	0	112.2	S148 F174 Y175 T176 G181 S182	S148-C178 WeakPolarHBondContact CB-SG 3.21Å; S148-C178 PolarHBondContact OG-SG 2.68Å; F174-C178 PolarHBondContact O-N 3.14Å; F174-C178 PolarHBondContact O-SG 3.45Å; F174-C178 VanDerWaalsContact O-SG 3.4Å; Y175-C178 PolarHBondContact O-N 3.37Å; T176-C178 PolarHBondContact O-N 2.86Å; C178-G181 PolarHBondContact O-N 2.91Å; C178-S182 PolarHBondContact O-N 2.98Å; C178-S182 PolarHBondContact O-OG 3.29Å
179	V	76.2	Confident	69.8	Low	76 Å²	76	65.8 Å²	65.8	46%	0.461	36%	0.361	S	S	.	.	H	α-helix	trans	-68	-42.5	178.4	170	0	0	0	0	111.2	Y175 T176 G181 S182 I183	Y175-V179 WeakPolarHBondContact O-CB 3.23Å; Y175-V179 VanDerWaalsContact O-CG2 3.22Å; Y175-V179 WeakPolarHBondContact O-CG2 3.25Å; Y175-V179 PolarHBondContact O-N 2.88Å; T176-V179 PolarHBondContact O-N 2.86Å; V179-G181 VanDerWaalsContact C-N 3.31Å; V179-G181 PolarHBondContact O-N 2.89Å; V179-S182 WeakPolarHBondContact CA-OG 3.24Å; V179-S182 PolarHBondContact O-N 2.96Å; V179-S182 PolarHBondContact O-OG 3Å; V179-I183 HydrophobicContact CG1-CD1 3.56Å; V179-I183 HydrophobicContact CG1-CG1 4.3Å; V179-I183 WeakPolarHBondContact O-CB 3.12Å; V179-I183 WeakPolarHBondContact O-CD1 3.09Å; V179-I183 WeakPolarHBondContact O-CG1 3.44Å; V179-I183 PolarHBondContact O-N 3.11Å
180	I	77.9	Confident	70.8	Confident	96 Å²	96	63.9 Å²	63.9	49%	0.492	35%	0.351	S	S	.	.	H	α-helix	trans	-61.1	-44.2	173.7	-67.3	161.2	0	0	0	109.9	L144 T176 S182 I183 S184	L144-I180 HydrophobicContact CD2-CG2 4.06Å; T176-I180 WeakPolarHBondContact O-CB 3.39Å; T176-I180 WeakPolarHBondContact O-CD1 3.33Å; T176-I180 WeakPolarHBondContact O-CG1 3.21Å; T176-I180 PolarHBondContact O-N 3.14Å; I180-S182 PolarHBondContact O-N 3.15Å; I180-I183 PolarHBondContact O-N 2.76Å; I180-S184 WeakPolarHBondContact O-CB 3.48Å; I180-S184 PolarHBondContact O-N 3.11Å; I180-S184 PolarHBondContact O-OG 3.05Å
181	G	76	Confident	71.5	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-58.4	-47	175.2	0	0	0	0	0	112.5	L177 C178 V179 S184 V185	L177-G181 PolarHBondContact O-N 2.57Å; C178-G181 PolarHBondContact O-N 2.91Å; V179-G181 VanDerWaalsContact C-N 3.31Å; V179-G181 PolarHBondContact O-N 2.89Å; G181-S184 PolarHBondContact O-N 3.48Å; G181-S184 PolarHBondContact O-OG 3.44Å; G181-V185 WeakPolarHBondContact O-CG2 3.48Å; G181-V185 PolarHBondContact O-N 3.45Å
182	S	74.8	Confident	71.9	Confident	62 Å²	62	58.3 Å²	58.3	43%	0.434	32%	0.324	S	S	.	.	H	α-helix	trans	-69.9	-38.2	-179.9	61	0	0	0	0	113	C178 V179 I180 S184 V185 S186	C178-S182 PolarHBondContact O-N 2.98Å; C178-S182 PolarHBondContact O-OG 3.29Å; V179-S182 WeakPolarHBondContact CA-OG 3.24Å; V179-S182 PolarHBondContact O-N 2.96Å; V179-S182 PolarHBondContact O-OG 3Å; I180-S182 PolarHBondContact O-N 3.15Å; S182-S184 VanDerWaalsContact C-N 3.34Å; S182-V185 PolarHBondContact O-N 3.04Å; S182-S186 PolarHBondContact O-N 3.12Å; S182-S186 PolarHBondContact O-OG 2.99Å
183	I	79.4	Confident	72	Confident	99 Å²	99	58.5 Å²	58.5	51%	0.508	32%	0.321	S	S	.	.	H	α-helix	trans	-63.3	-40.9	173.9	-67.3	165.2	0	0	0	110.7	V179 I180 V185 S186 A187	V179-I183 HydrophobicContact CG1-CD1 3.56Å; V179-I183 HydrophobicContact CG1-CG1 4.3Å; V179-I183 WeakPolarHBondContact O-CB 3.12Å; V179-I183 WeakPolarHBondContact O-CD1 3.09Å; V179-I183 WeakPolarHBondContact O-CG1 3.44Å; V179-I183 PolarHBondContact O-N 3.11Å; I180-I183 PolarHBondContact O-N 2.76Å; I183-V185 VanDerWaalsContact C-N 3.34Å; I183-V185 PolarHBondContact O-N 3.47Å; I183-S186 WeakPolarHBondContact CA-OG 3.44Å; I183-S186 PolarHBondContact O-N 3.12Å; I183-S186 PolarHBondContact O-OG 3.04Å; I183-A187 VanDerWaalsContact O-CB 3.25Å; I183-A187 WeakPolarHBondContact O-CB 3.09Å; I183-A187 PolarHBondContact O-N 2.65Å
184	S	80	Confident	71.8	Confident	41 Å²	41	60.4 Å²	60.4	29%	0.287	33%	0.326	S	S	.	.	H	α-helix	trans	-65	-37.8	178.6	69.4	0	0	0	0	112.6	A141 I180 G181 S182 S188	A141-S184 WeakPolarHBondContact CB-OG 3.12Å; I180-S184 WeakPolarHBondContact O-CB 3.48Å; I180-S184 PolarHBondContact O-N 3.11Å; I180-S184 PolarHBondContact O-OG 3.05Å; G181-S184 PolarHBondContact O-N 3.48Å; G181-S184 PolarHBondContact O-OG 3.44Å; S182-S184 VanDerWaalsContact C-N 3.34Å; S184-S188 PolarHBondContact O-N 3.45Å; S184-S188 VanDerWaalsContact O-N 3.08Å
185	V	77.3	Confident	71.4	Confident	15 Å²	15	65 Å²	65	9%	0.091	34%	0.343	C	S	.	.	H	α-helix	trans	-70.9	-35.2	176.1	175.5	0	0	0	0	112.1	Q115 A141 L145 G181 S182 I183 S188	Q115-V185 HydrophobicContact CG-CG1 4.26Å; Q115-V185 VanDerWaalsContact NE2-CG1 3.28Å; Q115-V185 PolarHBondContact NE2-O 3.05Å; Q115-V185 VanDerWaalsContact NE2-O 3.14Å; A141-V185 HydrophobicContact CB-CG2 3.68Å; L145-V185 HydrophobicContact CD1-CG2 3.72Å; G181-V185 WeakPolarHBondContact O-CG2 3.48Å; G181-V185 PolarHBondContact O-N 3.45Å; S182-V185 PolarHBondContact O-N 3.04Å; I183-V185 VanDerWaalsContact C-N 3.34Å; I183-V185 PolarHBondContact O-N 3.47Å; V185-S188 PolarHBondContact O-OG 3.38Å
186	S	75.4	Confident	70.5	Confident	52 Å²	52	65.6 Å²	65.6	36%	0.364	35%	0.346	S	S	.	.	H	α-helix	trans	-72.7	-41.4	175.6	61.5	0	0	0	0	111.3	S182 I183 S188 S189 L190	S182-S186 PolarHBondContact O-N 3.12Å; S182-S186 PolarHBondContact O-OG 2.99Å; I183-S186 WeakPolarHBondContact CA-OG 3.44Å; I183-S186 PolarHBondContact O-N 3.12Å; I183-S186 PolarHBondContact O-OG 3.04Å; S186-S188 VanDerWaalsContact C-N 3.35Å; S186-S188 PolarHBondContact O-N 3.34Å; S186-S189 PolarHBondContact O-N 2.95Å; S186-S189 VanDerWaalsContact O-N 3.14Å; S186-S189 PolarHBondContact O-OG 3.13Å; S186-L190 PolarHBondContact O-N 3.42Å; S186-L190 VanDerWaalsContact O-N 3.14Å
187	A	77.1	Confident	70.6	Confident	37 Å²	37	65.3 Å²	65.3	31%	0.306	34%	0.341	S	S	.	.	H	α-helix	trans	-60.1	-41.9	176.4	0	0	0	0	0	112.1	I183 S189 L190 I191	I183-A187 VanDerWaalsContact O-CB 3.25Å; I183-A187 WeakPolarHBondContact O-CB 3.09Å; I183-A187 PolarHBondContact O-N 2.65Å; A187-S189 PolarHBondContact O-N 2.82Å; A187-L190 PolarHBondContact O-N 3.27Å; A187-L190 VanDerWaalsContact O-N 3.1Å; A187-I191 WeakPolarHBondContact O-CG1 3.27Å; A187-I191 PolarHBondContact O-N 3.01Å
188	S	71.8	Confident	70.5	Confident	5 Å²	5	66.1 Å²	66.1	4%	0.035	35%	0.345	C	S	.	.	H	α-helix	trans	-62.1	-27.4	177.8	68.4	0	0	0	0	113.4	Q115 H134 S184 V185 S186	Q115-S188 PolarHBondContact OE1-OG 2.94Å; H134-S188 PolarHBondContact CE1-O 2.91Å; H134-S188 PolarHBondContact ND1-O 3.06Å; H134-S188 VanDerWaalsContact ND1-O 3.08Å; S184-S188 PolarHBondContact O-N 3.45Å; S184-S188 VanDerWaalsContact O-N 3.08Å; V185-S188 PolarHBondContact O-OG 3.38Å; S186-S188 VanDerWaalsContact C-N 3.35Å; S186-S188 PolarHBondContact O-N 3.34Å
189	S	70.7	Confident	70.4	Confident	9 Å²	9	67.8 Å²	67.8	6%	0.063	35%	0.351	C	S	.	.	H	α-helix	trans	-81.7	-30.5	174.7	68.5	0	0	0	0	113.6	R95 S186 A187	R95-S189 PolarHBondContact NH1-OG 3.17Å; S186-S189 PolarHBondContact O-N 2.95Å; S186-S189 VanDerWaalsContact O-N 3.14Å; S186-S189 PolarHBondContact O-OG 3.13Å; A187-S189 PolarHBondContact O-N 2.82Å
190	L	69.9	Low	70.1	Confident	101 Å²	101	67.3 Å²	67.3	53%	0.529	34%	0.344	S	S	.	.	H	α-helix	trans	-76	-42.3	179.2	-76.8	172.2	0	0	0	112.4	S186 A187 Q192 Q193	S186-L190 PolarHBondContact O-N 3.42Å; S186-L190 VanDerWaalsContact O-N 3.14Å; A187-L190 PolarHBondContact O-N 3.27Å; A187-L190 VanDerWaalsContact O-N 3.1Å; L190-Q192 PolarHBondContact O-N 3.2Å; L190-Q193 PolarHBondContact O-N 3.11Å
191	I	65.5	Low	69.6	Low	62 Å²	62	65.5 Å²	65.5	32%	0.318	34%	0.335	S	S	.	.	H	α-helix	trans	-53.3	-32.1	-179.9	-69.6	164.4	0	0	0	110.8	M133 A187 E194 Y195	M133-I191 HydrophobicContact CE-CG2 4.29Å; A187-I191 WeakPolarHBondContact O-CG1 3.27Å; A187-I191 PolarHBondContact O-N 3.01Å; I191-E194 PolarHBondContact O-N 2.75Å; I191-Y195 HydrophobicContact CG2-CD2 4.2Å; I191-Y195 HydrophobicContact CG2-CE2 3.89Å; I191-Y195 WeakPolarHBondContact O-CD2 3.48Å
192	Q	66.1	Low	69.2	Low	4 Å²	4	69.9 Å²	69.9	2%	0.019	36%	0.357	C	S	.	.	H	α-helix	trans	-81	-19.2	-177.3	-61.3	-176.6	-46.8	0	0	114.2	I122 H134 L190 E194 Y196	I122-Q192 VanDerWaalsContact CD1-OE1 3.26Å; H134-Q192 PolarHBondContact CE1-OE1 3.41Å; H134-Q192 PolarHBondContact ND1-NE2 3.34Å; H134-Q192 PolarHBondContact ND1-OE1 2.87Å; H134-Q192 VanDerWaalsContact ND1-OE1 3.11Å; L190-Q192 PolarHBondContact O-N 3.2Å; Q192-E194 VanDerWaalsContact C-N 3.31Å; Q192-Y196 VanDerWaalsContact O-CD2 3.31Å; Q192-Y196 WeakPolarHBondContact O-CD2 3.26Å
193	Q	61.4	Low	68.8	Low	113 Å²	113	70.4 Å²	70.4	53%	0.528	35%	0.352	S	S	.	.	H	α-helix	trans	-79.4	-16.7	173.4	-65.5	-174.1	-43.3	0	0	112	L190 Y196	L190-Q193 PolarHBondContact O-N 3.11Å; Q193-Y196 VanDerWaalsContact O-OXT 3.06Å
194	E	60.5	Low	68	Low	167 Å²	167	68.2 Å²	68.2	78%	0.78	34%	0.34	S	S	*	.	H	α-helix	trans	-86.9	-17.2	176.5	-69.7	-173.5	159.8	0	0	113.1	I191 Q192	I191-E194 PolarHBondContact O-N 2.75Å; Q192-E194 VanDerWaalsContact C-N 3.31Å
195	Y	58.2	Low	67	Low	151 Å²	151	70.5 Å²	70.5	59%	0.592	35%	0.345	S	S	*	.			trans	-92.4	4.3	177.4	-74.5	-75.5	0	0	0	113.6	L130 I191	L130-Y195 HydrophobicContact CD1-CD2 3.99Å; L130-Y195 HydrophobicContact CD1-CE2 4.43Å; L130-Y195 HydrophobicContact CD1-CG 4.49Å; I191-Y195 HydrophobicContact CG2-CD2 4.2Å; I191-Y195 HydrophobicContact CG2-CE2 3.89Å; I191-Y195 WeakPolarHBondContact O-CD2 3.48Å
196	Y	49.5	Very low	66	Low	130 Å²	130	75.5 Å²	75.5	51%	0.51	37%	0.368	S	S	.	.			trans	-135	0	173.7	-66.4	-66.6	0	0	0	111.7	T125 L127 L130 Q192 Q193	T125-Y196 VanDerWaalsContact CB-CE1 3.41Å; T125-Y196 WeakPolarHBondContact CB-OH 3.39Å; T125-Y196 HydrophobicContact CG2-CD1 3.94Å; T125-Y196 HydrophobicContact CG2-CD2 4.23Å; T125-Y196 HydrophobicContact CG2-CE1 3.19Å; T125-Y196 HydrophobicContact CG2-CE2 3.53Å; T125-Y196 HydrophobicContact CG2-CG 4.45Å; T125-Y196 VanDerWaalsContact CG2-OH 3.25Å; T125-Y196 WeakPolarHBondContact CG2-OH 3.35Å; T125-Y196 PolarHBondContact OG1-OH 3.34Å; L127-Y196 WeakPolarHBondContact CD1-OH 3.47Å; L130-Y196 HydrophobicContact CD2-CE2 3.96Å; Q192-Y196 VanDerWaalsContact O-CD2 3.31Å; Q192-Y196 WeakPolarHBondContact O-CD2 3.26Å; Q193-Y196 VanDerWaalsContact O-OXT 3.06Å

Retrieved 196 of 196 residues in 220.3 ms (Link to these results)

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