A0A077ZHZ2_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 A0A077ZHZ2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 373 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.9	Very low	33.4	Very low	186 Å²	186	126.6 Å²	126.6	92%	0.916	64%	0.637	S	S	*	*				0	-13.4	0	-82.5	-59.5	-163.8	0	0	113.5	I3	M1-I3 PolarHBondContact O-N 3.33Å
2	S	25	Very low	33.7	Very low	95 Å²	95	133.6 Å²	133.6	66%	0.664	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-16.6	-179.2	38.6	0	0	0	0	116.5
3	I	31.5	Very low	33.7	Very low	130 Å²	130	135.2 Å²	135.2	67%	0.667	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	-7.7	-179.2	-65.5	159.7	0	0	0	112.8	M1	M1-I3 PolarHBondContact O-N 3.33Å
4	F	33.9	Very low	33.9	Very low	117 Å²	117	130.9 Å²	130.9	51%	0.513	65%	0.653	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93	-21.7	-175.5	-138	-113.9	0	0	0	114.4	K31	F4-K31 HydrophobicContact CD2-CD 4.46Å
5	I	34.7	Very low	34.4	Very low	131 Å²	131	130.2 Å²	130.2	67%	0.672	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	-29.6	-174.6	-65.5	170.6	0	0	0	111.3
6	I	33.5	Very low	35.3	Very low	112 Å²	112	128 Å²	128	57%	0.574	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-23.9	-178.9	-62.3	169.7	0	0	0	112.2	S9	I6-S9 PolarHBondContact O-OG 3.18Å
7	Y	34.6	Very low	36.5	Very low	151 Å²	151	127.6 Å²	127.6	59%	0.592	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-23.2	177.4	-127.2	-90.2	0	0	0	113.4	S9 F11	Y7-S9 VanDerWaalsContact C-N 3.32Å; Y7-F11 HydrophobicContact CD1-CD2 4.32Å; Y7-F11 AromaticContact CE1-CD2 3.82Å; Y7-F11 HydrophobicContact CE1-CD2 3.82Å; Y7-F11 HydrophobicContact CE1-CE2 4.1Å
8	F	37.3	Very low	37.5	Very low	168 Å²	168	125.2 Å²	125.2	74%	0.737	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-19.6	-178.6	-154.3	-95.9	0	0	0	112.6
9	S	31.1	Very low	38.5	Very low	94 Å²	94	123.8 Å²	123.8	66%	0.657	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	-9.2	-179.7	52.8	0	0	0	0	115	I6 Y7	I6-S9 PolarHBondContact O-OG 3.18Å; Y7-S9 VanDerWaalsContact C-N 3.32Å
10	I	33.1	Very low	39.4	Very low	126 Å²	126	120.2 Å²	120.2	65%	0.646	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.3	-9.9	-173.8	-68.5	171.9	0	0	0	113.5
11	F	40.9	Very low	40.1	Very low	83 Å²	83	119.2 Å²	119.2	36%	0.364	61%	0.611	S	S	.	*			trans	-117.9	29.8	-167.5	-118.8	-64.6	0	0	0	116.2	Y7 I13 S14 H20	Y7-F11 HydrophobicContact CD1-CD2 4.32Å; Y7-F11 AromaticContact CE1-CD2 3.82Å; Y7-F11 HydrophobicContact CE1-CD2 3.82Å; Y7-F11 HydrophobicContact CE1-CE2 4.1Å; F11-I13 VanDerWaalsContact C-N 3.26Å; F11-I13 PolarHBondContact O-N 3.36Å; F11-S14 WeakPolarHBondContact CE1-OG 3.15Å; F11-H20 AromaticContact CD1-CD2 3.98Å; F11-H20 AromaticContact CD1-CE1 3.14Å; F11-H20 WeakPolarHBondContact CD1-CE1 3.39Å; F11-H20 AromaticContact CD1-NE2 2.89Å; F11-H20 WeakPolarHBondContact CD1-NE2 3.41Å; F11-H20 AromaticContact CE1-CE1 3Å; F11-H20 WeakPolarHBondContact CE1-CE1 3.38Å; F11-H20 AromaticContact CE1-ND1 3.85Å; F11-H20 AromaticContact CE1-NE2 3.3Å; F11-H20 VanDerWaalsContact CE1-NE2 3.3Å; F11-H20 WeakPolarHBondContact CE1-NE2 3.45Å; F11-H20 AromaticContact CG-NE2 3.74Å
12	Y	37	Very low	41.2	Very low	210 Å²	210	115.9 Å²	115.9	82%	0.824	59%	0.592	S	S	*	*	S	Bend	trans	-84.4	7.4	173.1	-117.4	-84.7	0	0	0	114.3
13	I	33.9	Very low	42.7	Very low	155 Å²	155	114 Å²	114	80%	0.795	58%	0.577	S	S	*	*	S	Bend	trans	-136.3	90.2	-179.1	-71.7	152.6	0	0	0	109	F11	F11-I13 VanDerWaalsContact C-N 3.26Å; F11-I13 PolarHBondContact O-N 3.36Å
14	S	35.5	Very low	44.2	Very low	75 Å²	75	109.9 Å²	109.9	52%	0.524	56%	0.557	S	S	.	*			trans	173.7	138.5	143.8	42.5	0	0	0	0	112.1	F11 D16	F11-S14 WeakPolarHBondContact CE1-OG 3.15Å; S14-D16 PolarHBondContact O-N 3.2Å
15	S	42.2	Very low	45.2	Very low	120 Å²	120	104.5 Å²	104.5	84%	0.839	54%	0.535	S	S	*	.			trans	-89.9	47.8	-166.2	52.2	0	0	0	0	114
16	D	48.5	Very low	46.1	Very low	95 Å²	95	102.7 Å²	102.7	51%	0.508	53%	0.525	S	S	.	.			trans	-129	90.5	171.5	-85.1	-35.1	0	0	0	111.6	S14 S18 I19 H20	S14-D16 PolarHBondContact O-N 3.2Å; D16-S18 VanDerWaalsContact C-N 3.27Å; D16-S18 PolarHBondContact O-N 3.28Å; D16-I19 HydrophobicContact CB-CD1 4.21Å; D16-H20 PolarHBondContact O-N 3.45Å; D16-H20 PolarHBondContact O-ND1 3.12Å
17	L	56.5	Low	47.2	Very low	122 Å²	122	100.1 Å²	100.1	64%	0.639	52%	0.521	S	S	*	.	H	α-helix	trans	-67.2	-21.4	-174.5	-120.8	135.2	0	0	0	113.5	R21	L17-R21 VanDerWaalsContact CD2-NH2 3.32Å; L17-R21 WeakPolarHBondContact O-CD 3.19Å; L17-R21 WeakPolarHBondContact O-CG 3.38Å; L17-R21 PolarHBondContact O-N 3.23Å
18	S	54.4	Low	48.2	Very low	83 Å²	83	93.5 Å²	93.5	58%	0.58	50%	0.496	S	S	*	.	H	α-helix	trans	-81.1	-46.1	-179.4	54.8	0	0	0	0	112.4	D16 R21 F22	D16-S18 VanDerWaalsContact C-N 3.27Å; D16-S18 PolarHBondContact O-N 3.28Å; S18-R21 PolarHBondContact O-N 3.08Å; S18-F22 PolarHBondContact O-N 3.48Å
19	I	55.1	Low	48.8	Very low	100 Å²	100	88.8 Å²	88.8	51%	0.513	48%	0.478	S	S	.	.	H	α-helix	trans	-66.3	-40.9	178.9	-60.1	170.1	0	0	0	110	D16 R21 F22 T23	D16-I19 HydrophobicContact CB-CD1 4.21Å; I19-R21 PolarHBondContact O-N 3.46Å; I19-F22 PolarHBondContact O-N 3.04Å; I19-F22 VanDerWaalsContact O-N 3.15Å; I19-T23 HydrophobicContact CG2-CG2 4.29Å; I19-T23 WeakPolarHBondContact O-CG2 3.17Å; I19-T23 PolarHBondContact O-N 3.46Å; I19-T23 PolarHBondContact O-OG1 2.85Å
20	H	57.1	Low	49.5	Very low	51 Å²	51	86.9 Å²	86.9	24%	0.236	47%	0.468	C	S	.	.	H	α-helix	trans	-57.1	-46.7	173.3	-92.8	73.9	0	0	0	113.3	F11 D16 F22 T23 V24	F11-H20 AromaticContact CD1-CD2 3.98Å; F11-H20 AromaticContact CD1-CE1 3.14Å; F11-H20 WeakPolarHBondContact CD1-CE1 3.39Å; F11-H20 AromaticContact CD1-NE2 2.89Å; F11-H20 WeakPolarHBondContact CD1-NE2 3.41Å; F11-H20 AromaticContact CE1-CE1 3Å; F11-H20 WeakPolarHBondContact CE1-CE1 3.38Å; F11-H20 AromaticContact CE1-ND1 3.85Å; F11-H20 AromaticContact CE1-NE2 3.3Å; F11-H20 VanDerWaalsContact CE1-NE2 3.3Å; F11-H20 WeakPolarHBondContact CE1-NE2 3.45Å; F11-H20 AromaticContact CG-NE2 3.74Å; D16-H20 PolarHBondContact O-N 3.45Å; D16-H20 PolarHBondContact O-ND1 3.12Å; H20-F22 VanDerWaalsContact C-N 3.29Å; H20-F22 PolarHBondContact O-N 3.02Å; H20-T23 PolarHBondContact O-OG1 3.4Å; H20-T23 VanDerWaalsContact O-OG1 3.05Å; H20-V24 WeakPolarHBondContact O-CB 3.14Å; H20-V24 WeakPolarHBondContact O-CG2 3.14Å; H20-V24 PolarHBondContact O-N 3.35Å
21	R	54.6	Low	50.4	Low	99 Å²	99	83.9 Å²	83.9	37%	0.374	45%	0.45	S	S	.	.	H	α-helix	trans	-61.1	-45.8	177.1	-76.1	174.8	-176.9	-178.8	3.6	109	L17 S18 I19 V24 G25 L64 L66	L17-R21 VanDerWaalsContact CD2-NH2 3.32Å; L17-R21 WeakPolarHBondContact O-CD 3.19Å; L17-R21 WeakPolarHBondContact O-CG 3.38Å; L17-R21 PolarHBondContact O-N 3.23Å; S18-R21 PolarHBondContact O-N 3.08Å; I19-R21 PolarHBondContact O-N 3.46Å; R21-V24 PolarHBondContact O-N 3.13Å; R21-G25 PolarHBondContact O-N 2.95Å; R21-L64 WeakPolarHBondContact CD-O 3.43Å; R21-L64 PolarHBondContact NE-O 3.33Å; R21-L66 VanDerWaalsContact C-CD2 3.42Å; R21-L66 HydrophobicContact CB-CD1 4.47Å; R21-L66 HydrophobicContact CB-CD2 3.78Å; R21-L66 HydrophobicContact CB-CG 3.92Å; R21-L66 WeakPolarHBondContact O-CD1 3.35Å; R21-L66 WeakPolarHBondContact O-CD2 3.24Å
22	F	54.7	Low	50.5	Low	117 Å²	117	81.8 Å²	81.8	51%	0.513	44%	0.44	S	S	.	.	H	α-helix	trans	-62.9	-45.1	-178.3	-159.3	-99	0	0	0	113	S18 I19 H20 G25 I26	S18-F22 PolarHBondContact O-N 3.48Å; I19-F22 PolarHBondContact O-N 3.04Å; I19-F22 VanDerWaalsContact O-N 3.15Å; H20-F22 VanDerWaalsContact C-N 3.29Å; H20-F22 PolarHBondContact O-N 3.02Å; F22-G25 PolarHBondContact O-N 3.2Å; F22-I26 HydrophobicContact CD1-CD1 3.75Å; F22-I26 HydrophobicContact CE1-CD1 3.74Å; F22-I26 HydrophobicContact CE1-CG1 4.47Å; F22-I26 WeakPolarHBondContact O-CG1 3.3Å; F22-I26 PolarHBondContact O-N 3.03Å
23	T	57.3	Low	50.4	Low	56 Å²	56	74.6 Å²	74.6	34%	0.344	42%	0.424	S	S	.	.	H	α-helix	trans	-66.3	-39.3	177.9	55.2	0	0	0	0	112.2	I19 H20 G25 I26 A27	I19-T23 HydrophobicContact CG2-CG2 4.29Å; I19-T23 WeakPolarHBondContact O-CG2 3.17Å; I19-T23 PolarHBondContact O-N 3.46Å; I19-T23 PolarHBondContact O-OG1 2.85Å; H20-T23 PolarHBondContact O-OG1 3.4Å; H20-T23 VanDerWaalsContact O-OG1 3.05Å; T23-G25 VanDerWaalsContact C-N 3.32Å; T23-G25 PolarHBondContact O-N 3.39Å; T23-I26 PolarHBondContact O-N 2.91Å; T23-A27 PolarHBondContact O-N 3.15Å
24	V	61.8	Low	50.5	Low	43 Å²	43	74 Å²	74	26%	0.261	42%	0.418	S	S	.	.	H	α-helix	trans	-67.6	-35.2	174.1	179.7	0	0	0	0	111.2	H20 R21 I26 A27 V28 L60 L64	H20-V24 WeakPolarHBondContact O-CB 3.14Å; H20-V24 WeakPolarHBondContact O-CG2 3.14Å; H20-V24 PolarHBondContact O-N 3.35Å; R21-V24 PolarHBondContact O-N 3.13Å; V24-I26 VanDerWaalsContact C-N 3.35Å; V24-I26 PolarHBondContact O-N 2.88Å; V24-A27 PolarHBondContact O-N 3.31Å; V24-V28 HydrophobicContact CG1-CG2 4.34Å; V24-V28 WeakPolarHBondContact O-CG2 3.39Å; V24-V28 PolarHBondContact O-N 3.18Å; V24-L60 HydrophobicContact CG1-CD2 3.4Å; V24-L64 HydrophobicContact CB-CD1 3.88Å; V24-L64 HydrophobicContact CG1-CD1 3.2Å
25	G	54.6	Low	50.3	Low	4 Å²	4	76.4 Å²	76.4	4%	0.041	42%	0.424	C	S	.	.	H	α-helix	trans	-56.8	-47.1	170.9	0	0	0	0	0	112.2	R21 F22 T23 V28 L29	R21-G25 PolarHBondContact O-N 2.95Å; F22-G25 PolarHBondContact O-N 3.2Å; T23-G25 VanDerWaalsContact C-N 3.32Å; T23-G25 PolarHBondContact O-N 3.39Å; G25-V28 PolarHBondContact O-N 3.45Å; G25-L29 VanDerWaalsContact O-CG 3.29Å; G25-L29 WeakPolarHBondContact O-CG 3Å; G25-L29 PolarHBondContact O-N 3.42Å
26	I	55	Low	49.8	Very low	92 Å²	92	75.1 Å²	75.1	47%	0.472	41%	0.413	S	S	.	.	H	α-helix	trans	-63.7	-42.3	175.4	-64.1	162.9	0	0	0	111.1	F22 T23 V24 V28 L29 A30	F22-I26 HydrophobicContact CD1-CD1 3.75Å; F22-I26 HydrophobicContact CE1-CD1 3.74Å; F22-I26 HydrophobicContact CE1-CG1 4.47Å; F22-I26 WeakPolarHBondContact O-CG1 3.3Å; F22-I26 PolarHBondContact O-N 3.03Å; T23-I26 PolarHBondContact O-N 2.91Å; V24-I26 VanDerWaalsContact C-N 3.35Å; V24-I26 PolarHBondContact O-N 2.88Å; I26-V28 VanDerWaalsContact C-N 3.33Å; I26-V28 PolarHBondContact O-N 3.05Å; I26-L29 PolarHBondContact O-N 3Å; I26-A30 WeakPolarHBondContact O-CB 3.37Å; I26-A30 PolarHBondContact O-N 3.2Å
27	A	56.3	Low	49	Very low	58 Å²	58	75 Å²	75	48%	0.479	41%	0.412	S	S	.	.	H	α-helix	trans	-63	-38.6	178.2	0	0	0	0	0	112.4	T23 V24 K31	T23-A27 PolarHBondContact O-N 3.15Å; V24-A27 PolarHBondContact O-N 3.31Å; A27-K31 PolarHBondContact O-N 3.43Å
28	V	55.8	Low	48.3	Very low	12 Å²	12	74.2 Å²	74.2	7%	0.073	40%	0.404	C	S	.	.	H	α-helix	trans	-68.9	-37.7	174.7	174.5	0	0	0	0	111.4	V24 G25 I26 R32 L60 C61	V24-V28 HydrophobicContact CG1-CG2 4.34Å; V24-V28 WeakPolarHBondContact O-CG2 3.39Å; V24-V28 PolarHBondContact O-N 3.18Å; G25-V28 PolarHBondContact O-N 3.45Å; I26-V28 VanDerWaalsContact C-N 3.33Å; I26-V28 PolarHBondContact O-N 3.05Å; V28-R32 VanDerWaalsContact O-CG 3.31Å; V28-R32 WeakPolarHBondContact O-CG 2.89Å; V28-L60 HydrophobicContact CG2-CB 4.5Å; V28-L60 HydrophobicContact CG2-CD2 3.52Å; V28-C61 VanDerWaalsContact CG1-SG 3.57Å
29	L	49.8	Very low	47.7	Very low	69 Å²	69	76.4 Å²	76.4	36%	0.361	41%	0.414	S	S	.	.	H	α-helix	trans	-66.6	-44.9	175.5	-72	166.9	0	0	0	111.7	G25 I26 K31 R32 L70	G25-L29 VanDerWaalsContact O-CG 3.29Å; G25-L29 WeakPolarHBondContact O-CG 3Å; G25-L29 PolarHBondContact O-N 3.42Å; I26-L29 PolarHBondContact O-N 3Å; L29-K31 VanDerWaalsContact C-N 3.32Å; L29-K31 PolarHBondContact O-N 3.45Å; L29-R32 PolarHBondContact O-N 3.1Å; L29-R32 VanDerWaalsContact O-N 3.12Å; L29-L70 HydrophobicContact CD1-CD2 4.31Å; L29-L70 HydrophobicContact CD2-CD2 4.44Å; L29-L70 HydrophobicContact CG-CD2 4.41Å
30	A	45.2	Very low	47.3	Very low	54 Å²	54	72.1 Å²	72.1	45%	0.446	39%	0.394	S	S	.	.	H	α-helix	trans	-62.1	-38.1	179.9	0	0	0	0	0	112.4	I26 R32 A33	I26-A30 WeakPolarHBondContact O-CB 3.37Å; I26-A30 PolarHBondContact O-N 3.2Å; A30-R32 PolarHBondContact O-N 3.4Å; A30-A33 PolarHBondContact O-N 2.95Å
31	K	52.3	Low	46.9	Very low	63 Å²	63	73.6 Å²	73.6	27%	0.274	41%	0.408	S	S	.	.	H	α-helix	trans	-71	-14.7	179.1	-139	163.7	179.6	174.8	0	113.7	F4 A27 L29 L53	F4-K31 HydrophobicContact CD2-CD 4.46Å; A27-K31 PolarHBondContact O-N 3.43Å; L29-K31 VanDerWaalsContact C-N 3.32Å; L29-K31 PolarHBondContact O-N 3.45Å; K31-L53 HydrophobicContact CG-CD2 4.33Å
32	R	43.5	Very low	47.3	Very low	40 Å²	40	69.9 Å²	69.9	15%	0.151	40%	0.396	C	S	.	.	H	α-helix	trans	-92.9	-13.9	-179.8	-70.1	176.7	-165.6	-136.1	13.7	113.9	V28 L29 A30 G57 T58 I107	V28-R32 VanDerWaalsContact O-CG 3.31Å; V28-R32 WeakPolarHBondContact O-CG 2.89Å; L29-R32 PolarHBondContact O-N 3.1Å; L29-R32 VanDerWaalsContact O-N 3.12Å; A30-R32 PolarHBondContact O-N 3.4Å; R32-G57 PolarHBondContact NH2-O 3.3Å; R32-G57 VanDerWaalsContact NH2-O 3.12Å; R32-T58 VanDerWaalsContact NH2-CA 3.27Å; R32-T58 VanDerWaalsContact NH2-CG2 3.29Å; R32-I107 VanDerWaalsContact NH1-CG1 3.33Å
33	A	35.5	Very low	46.8	Very low	59 Å²	59	68 Å²	68	49%	0.488	40%	0.396	S	S	.	.	H	α-helix	trans	-112.3	-0.9	-171.5	0	0	0	0	0	115.3	A30 I35	A30-A33 PolarHBondContact O-N 2.95Å; A33-I35 PolarHBondContact O-N 3.23Å
34	Q	35.4	Very low	46.7	Very low	141 Å²	141	68.6 Å²	68.6	66%	0.659	40%	0.4	S	S	*	.			trans	-76.5	87.4	179.8	-82.1	171.6	-26.1	0	0	112.2
35	I	30.4	Very low	46.5	Very low	126 Å²	126	67.2 Å²	67.2	65%	0.646	39%	0.392	S	S	*	.			trans	-50.4	115.3	138.7	-57.3	158.1	0	0	0	105	A33	A33-I35 PolarHBondContact O-N 3.23Å
36	P	31.8	Very low	46.6	Very low	94 Å²	94	67.5 Å²	67.5	61%	0.61	39%	0.393	S	S	*	.				-147.3	92.7	56.4	35.9	-12.5	0	0	0	112.8
37	L	33	Very low	46.7	Very low	93 Å²	93	67.8 Å²	67.8	49%	0.487	40%	0.395	S	S	.	.			trans	-99.2	42.5	154.3	-74.4	174.2	0	0	0	110.1	T39 A40 V48	L37-T39 PolarHBondContact O-N 2.95Å; L37-A40 HydrophobicContact CB-CB 4.3Å; L37-A40 HydrophobicContact CD2-CB 4.46Å; L37-A40 PolarHBondContact O-N 2.73Å; L37-V48 HydrophobicContact CD1-CG1 4.2Å
38	H	40.6	Very low	46.6	Very low	105 Å²	105	66.8 Å²	66.8	49%	0.486	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-11.8	176.5	-115	-56	0	0	0	113.2	K93	H38-K93 WeakPolarHBondContact CE1-CE 3.46Å; H38-K93 VanDerWaalsContact CE1-CG 3.41Å; H38-K93 WeakPolarHBondContact CE1-CG 3.39Å; H38-K93 WeakPolarHBondContact NE2-CE 3.29Å
39	T	42.9	Very low	46.5	Very low	128 Å²	128	69.1 Å²	69.1	79%	0.785	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.6	10.1	-172	53.9	0	0	0	0	113.6	L37	L37-T39 PolarHBondContact O-N 2.95Å
40	A	45.9	Very low	46.6	Very low	11 Å²	11	66.2 Å²	66.2	9%	0.091	38%	0.378	C	S	.	.	S	Bend	trans	-73	136.4	175	0	0	0	0	0	110.5	L37 V44	L37-A40 HydrophobicContact CB-CB 4.3Å; L37-A40 HydrophobicContact CD2-CB 4.46Å; L37-A40 PolarHBondContact O-N 2.73Å; A40-V44 HydrophobicContact CB-CB 4.45Å; A40-V44 HydrophobicContact CB-CG1 4.33Å
41	P	48.6	Very low	47.2	Very low	81 Å²	81	65.9 Å²	65.9	53%	0.526	37%	0.373	S	S	.	.			trans	-57.8	145	173.8	21.5	-29.1	0	0	0	109.6	P43 V44 S45	P41-P43 VanDerWaalsContact C-N 3.32Å; P41-P43 VanDerWaalsContact O-N 3.11Å; P41-V44 HydrophobicContact CG-CB 4.01Å; P41-V44 HydrophobicContact CG-CG2 3.71Å; P41-V44 WeakPolarHBondContact O-CA 3.14Å; P41-V44 PolarHBondContact O-N 3.34Å; P41-S45 PolarHBondContact O-N 2.96Å
42	T	62.6	Low	47.7	Very low	21 Å²	21	66.3 Å²	66.3	13%	0.129	38%	0.381	C	S	.	.	H	α-helix	trans	-43.4	-44.2	-174.9	36.8	0	0	0	0	115.1	S45 S46 K92 I140	T42-S45 WeakPolarHBondContact CA-OG 3.43Å; T42-S45 PolarHBondContact O-N 3.26Å; T42-S45 PolarHBondContact O-OG 3.12Å; T42-S46 PolarHBondContact O-N 2.92Å; T42-K92 HydrophobicContact CG2-CD 4.27Å; T42-I140 HydrophobicContact CG2-CD1 4.42Å
43	P	45.5	Very low	48.3	Very low	78 Å²	78	67.5 Å²	67.5	51%	0.506	39%	0.39	S	S	.	.	H	α-helix	trans	-71.9	-29.4	177	27.7	-36.5	0	0	0	114.1	P41 S46 L47	P41-P43 VanDerWaalsContact C-N 3.32Å; P41-P43 VanDerWaalsContact O-N 3.11Å; P43-S46 WeakPolarHBondContact CA-OG 3.27Å; P43-S46 PolarHBondContact O-OG 2.82Å; P43-L47 WeakPolarHBondContact O-CB 3.46Å; P43-L47 PolarHBondContact O-N 3.2Å; P43-L47 VanDerWaalsContact O-N 3.1Å
44	V	54.8	Low	49.3	Very low	69 Å²	69	65.2 Å²	65.2	42%	0.418	37%	0.37	S	S	.	.	H	α-helix	trans	-74.6	-39.4	175.1	178.4	0	0	0	0	109.6	A40 P41 S46 L47 V48	A40-V44 HydrophobicContact CB-CB 4.45Å; A40-V44 HydrophobicContact CB-CG1 4.33Å; P41-V44 HydrophobicContact CG-CB 4.01Å; P41-V44 HydrophobicContact CG-CG2 3.71Å; P41-V44 WeakPolarHBondContact O-CA 3.14Å; P41-V44 PolarHBondContact O-N 3.34Å; V44-S46 VanDerWaalsContact C-N 3.3Å; V44-S46 PolarHBondContact O-N 2.99Å; V44-L47 PolarHBondContact O-N 3.42Å; V44-V48 HydrophobicContact CG1-CG2 3.91Å; V44-V48 WeakPolarHBondContact O-CB 3.46Å; V44-V48 VanDerWaalsContact O-CG2 3.28Å; V44-V48 WeakPolarHBondContact O-CG2 3.32Å; V44-V48 PolarHBondContact O-N 3.42Å
45	S	57.8	Low	50.4	Low	14 Å²	14	60 Å²	60	10%	0.098	35%	0.347	C	S	.	.	H	α-helix	trans	-62.3	-38.4	173.6	70.5	0	0	0	0	111.9	P41 T42 H49	P41-S45 PolarHBondContact O-N 2.96Å; T42-S45 WeakPolarHBondContact CA-OG 3.43Å; T42-S45 PolarHBondContact O-N 3.26Å; T42-S45 PolarHBondContact O-OG 3.12Å; S45-H49 WeakPolarHBondContact O-CB 3.41Å; S45-H49 PolarHBondContact O-N 3.45Å; S45-H49 VanDerWaalsContact O-N 3.12Å
46	S	55.7	Low	51.9	Low	10 Å²	10	56.8 Å²	56.8	7%	0.07	34%	0.34	C	S	.	.	H	α-helix	trans	-61.4	-52	173.9	69.7	0	0	0	0	110.2	T42 P43 V44 V48 S50 F133	T42-S46 PolarHBondContact O-N 2.92Å; P43-S46 WeakPolarHBondContact CA-OG 3.27Å; P43-S46 PolarHBondContact O-OG 2.82Å; V44-S46 VanDerWaalsContact C-N 3.3Å; V44-S46 PolarHBondContact O-N 2.99Å; S46-V48 PolarHBondContact O-N 3.41Å; S46-S50 WeakPolarHBondContact O-CA 3.3Å; S46-S50 WeakPolarHBondContact O-CB 3.27Å; S46-S50 PolarHBondContact O-N 3.3Å; S46-S50 PolarHBondContact O-OG 3.48Å; S46-F133 VanDerWaalsContact CB-CB 3.41Å
47	L	58.2	Low	53.4	Low	97 Å²	97	53 Å²	53	51%	0.508	32%	0.317	S	S	.	.	H	α-helix	trans	-68.3	-39.9	-173.8	-166	145.7	0	0	0	113.7	P43 V44 S51 T52	P43-L47 WeakPolarHBondContact O-CB 3.46Å; P43-L47 PolarHBondContact O-N 3.2Å; P43-L47 VanDerWaalsContact O-N 3.1Å; V44-L47 PolarHBondContact O-N 3.42Å; L47-S51 PolarHBondContact O-N 3.29Å; L47-S51 PolarHBondContact O-OG 2.82Å; L47-T52 HydrophobicContact CD2-CG2 3.93Å; L47-T52 PolarHBondContact O-N 3.03Å; L47-T52 PolarHBondContact O-OG1 2.73Å; L47-T52 VanDerWaalsContact O-OG1 3.04Å
48	V	53.5	Low	54.7	Low	38 Å²	38	48.7 Å²	48.7	23%	0.23	30%	0.295	C	S	.	.	I	π-helix	trans	-76.9	-43.5	-176.3	179.4	0	0	0	0	111.4	L37 V44 S46	L37-V48 HydrophobicContact CD1-CG1 4.2Å; V44-V48 HydrophobicContact CG1-CG2 3.91Å; V44-V48 WeakPolarHBondContact O-CB 3.46Å; V44-V48 VanDerWaalsContact O-CG2 3.28Å; V44-V48 WeakPolarHBondContact O-CG2 3.32Å; V44-V48 PolarHBondContact O-N 3.42Å; S46-V48 PolarHBondContact O-N 3.41Å
49	H	54.2	Low	56	Low	61 Å²	61	46.8 Å²	46.8	28%	0.282	29%	0.288	S	S	.	.	I	π-helix	trans	-87.3	-22.4	-177.8	-87.3	-81.2	0	0	0	114.3	S45	S45-H49 WeakPolarHBondContact O-CB 3.41Å; S45-H49 PolarHBondContact O-N 3.45Å; S45-H49 VanDerWaalsContact O-N 3.12Å
50	S	52.1	Low	57	Low	7 Å²	7	43.3 Å²	43.3	5%	0.049	26%	0.264	C	S	.	.	I	π-helix	trans	-96.5	-35.2	-176.8	89.7	0	0	0	0	114.6	S46 A126	S46-S50 WeakPolarHBondContact O-CA 3.3Å; S46-S50 WeakPolarHBondContact O-CB 3.27Å; S46-S50 PolarHBondContact O-N 3.3Å; S46-S50 PolarHBondContact O-OG 3.48Å; S50-A126 WeakPolarHBondContact O-CB 3.29Å
51	S	56.8	Low	57.8	Low	48 Å²	48	43 Å²	43	34%	0.336	26%	0.261	S	S	.	.	I	π-helix	trans	-123.7	-37.2	-165.3	59.8	0	0	0	0	116.2	L47 V55	L47-S51 PolarHBondContact O-N 3.29Å; L47-S51 PolarHBondContact O-OG 2.82Å; S51-V55 WeakPolarHBondContact O-CB 3.47Å; S51-V55 WeakPolarHBondContact O-CG2 3.36Å
52	T	62.5	Low	58.5	Low	72 Å²	72	40 Å²	40	44%	0.442	24%	0.241	S	C	.	.	I	π-helix	trans	-102.1	-64.4	-164.1	51.5	0	0	0	0	114.3	L47 V54 A56	L47-T52 HydrophobicContact CD2-CG2 3.93Å; L47-T52 PolarHBondContact O-N 3.03Å; L47-T52 PolarHBondContact O-OG1 2.73Å; L47-T52 VanDerWaalsContact O-OG1 3.04Å; T52-V54 VanDerWaalsContact C-N 3.29Å; T52-V54 PolarHBondContact O-N 2.99Å; T52-A56 WeakPolarHBondContact O-CB 3.34Å; T52-A56 PolarHBondContact O-N 2.95Å
53	L	57	Low	58.6	Low	64 Å²	64	47.3 Å²	47.3	34%	0.335	27%	0.271	S	S	.	.	H	α-helix	trans	-67.9	-36.2	-169	-167.4	147.3	0	0	0	111.5	K31 G57	K31-L53 HydrophobicContact CG-CD2 4.33Å; L53-G57 PolarHBondContact O-N 3.46Å
54	V	55.1	Low	59.4	Low	12 Å²	12	45.8 Å²	45.8	7%	0.073	26%	0.258	C	S	.	.	H	α-helix	trans	-81	-38.5	-172	-171.2	0	0	0	0	112.7	T52 A56 G57 T58 I103	T52-V54 VanDerWaalsContact C-N 3.29Å; T52-V54 PolarHBondContact O-N 2.99Å; V54-A56 VanDerWaalsContact C-N 3.33Å; V54-G57 PolarHBondContact O-N 2.9Å; V54-T58 PolarHBondContact O-N 3.16Å; V54-T58 PolarHBondContact O-OG1 3.37Å; V54-I103 HydrophobicContact CB-CD1 3.74Å; V54-I103 HydrophobicContact CB-CG1 4.25Å; V54-I103 HydrophobicContact CG1-CB 3.82Å; V54-I103 HydrophobicContact CG1-CD1 3.22Å; V54-I103 HydrophobicContact CG1-CG1 3.32Å; V54-I103 HydrophobicContact CG1-CG2 3.16Å; V54-I103 HydrophobicContact CG2-CD1 3.68Å
55	V	59.5	Low	59.8	Low	30 Å²	30	45.9 Å²	45.9	18%	0.182	26%	0.256	C	S	.	.	H	α-helix	trans	-65.7	-40	176.5	179.5	0	0	0	0	110.8	S51 G57 T58 I59 I122	S51-V55 WeakPolarHBondContact O-CB 3.47Å; S51-V55 WeakPolarHBondContact O-CG2 3.36Å; V55-G57 VanDerWaalsContact C-N 3.3Å; V55-G57 PolarHBondContact O-N 3.11Å; V55-T58 WeakPolarHBondContact CA-OG1 3.43Å; V55-T58 PolarHBondContact O-N 3.29Å; V55-T58 PolarHBondContact O-OG1 3.19Å; V55-I59 HydrophobicContact CG1-CD1 3.65Å; V55-I59 HydrophobicContact CG1-CG1 4.25Å; V55-I59 WeakPolarHBondContact O-CB 3.36Å; V55-I59 VanDerWaalsContact O-CG1 3.25Å; V55-I59 WeakPolarHBondContact O-CG1 3.25Å; V55-I59 PolarHBondContact O-N 3Å; V55-I122 HydrophobicContact CB-CG2 4.13Å; V55-I122 HydrophobicContact CG1-CG2 3.76Å; V55-I122 HydrophobicContact CG2-CG2 3.37Å
56	A	62.2	Low	59.9	Low	60 Å²	60	46.3 Å²	46.3	50%	0.496	26%	0.257	S	S	.	.	H	α-helix	trans	-59.4	-42.6	174.2	0	0	0	0	0	111.6	T52 V54 I59 L60	T52-A56 WeakPolarHBondContact O-CB 3.34Å; T52-A56 PolarHBondContact O-N 2.95Å; V54-A56 VanDerWaalsContact C-N 3.33Å; A56-I59 PolarHBondContact O-N 3.42Å; A56-L60 WeakPolarHBondContact O-CB 3.37Å; A56-L60 PolarHBondContact O-N 3.37Å
57	G	62.3	Low	60	Low	13 Å²	13	48 Å²	48	13%	0.134	27%	0.265	C	S	.	.	H	α-helix	trans	-62.5	-40.7	175.7	0	0	0	0	0	113.2	R32 L53 V54 V55 C61	R32-G57 PolarHBondContact NH2-O 3.3Å; R32-G57 VanDerWaalsContact NH2-O 3.12Å; L53-G57 PolarHBondContact O-N 3.46Å; V54-G57 PolarHBondContact O-N 2.9Å; V55-G57 VanDerWaalsContact C-N 3.3Å; V55-G57 PolarHBondContact O-N 3.11Å; G57-C61 PolarHBondContact O-N 3.29Å
58	T	61.9	Low	59.9	Low	3 Å²	3	53.2 Å²	53.2	2%	0.018	28%	0.28	C	S	.	.	H	α-helix	trans	-69.9	-41.6	178.2	46.3	0	0	0	0	111.2	R32 V54 V55 L60 C61 I62 V106 I110 I122	R32-T58 VanDerWaalsContact NH2-CA 3.27Å; R32-T58 VanDerWaalsContact NH2-CG2 3.29Å; V54-T58 PolarHBondContact O-N 3.16Å; V54-T58 PolarHBondContact O-OG1 3.37Å; V55-T58 WeakPolarHBondContact CA-OG1 3.43Å; V55-T58 PolarHBondContact O-N 3.29Å; V55-T58 PolarHBondContact O-OG1 3.19Å; T58-L60 VanDerWaalsContact C-N 3.27Å; T58-L60 PolarHBondContact O-N 2.83Å; T58-C61 WeakPolarHBondContact O-CB 3.4Å; T58-C61 PolarHBondContact O-N 3.12Å; T58-I62 WeakPolarHBondContact O-CD1 3.43Å; T58-I62 VanDerWaalsContact O-CG1 3.27Å; T58-I62 WeakPolarHBondContact O-CG1 3.41Å; T58-I62 PolarHBondContact O-N 3.24Å; T58-I62 VanDerWaalsContact O-N 3.08Å; T58-V106 HydrophobicContact CG2-CB 4.34Å; T58-V106 HydrophobicContact CG2-CG1 3.58Å; T58-I110 HydrophobicContact CG2-CD1 4.27Å; T58-I110 WeakPolarHBondContact O-CD1 3.27Å; T58-I122 WeakPolarHBondContact OG1-CD1 3.45Å
59	I	66	Low	60	Low	65 Å²	65	59.2 Å²	59.2	33%	0.333	30%	0.303	S	S	.	.	H	α-helix	trans	-60	-39.8	176.3	-67	168.6	0	0	0	111.3	V55 A56 I62 K63	V55-I59 HydrophobicContact CG1-CD1 3.65Å; V55-I59 HydrophobicContact CG1-CG1 4.25Å; V55-I59 WeakPolarHBondContact O-CB 3.36Å; V55-I59 VanDerWaalsContact O-CG1 3.25Å; V55-I59 WeakPolarHBondContact O-CG1 3.25Å; V55-I59 PolarHBondContact O-N 3Å; A56-I59 PolarHBondContact O-N 3.42Å; I59-I62 PolarHBondContact O-N 3.41Å; I59-K63 PolarHBondContact O-N 3.48Å; I59-K63 VanDerWaalsContact O-N 3.14Å
60	L	64.7	Low	60.5	Low	55 Å²	55	57.1 Å²	57.1	29%	0.288	29%	0.294	S	S	.	.	H	α-helix	trans	-63.7	-45.2	176.4	-157.7	100.3	0	0	0	112	V24 V28 A56 T58 I62 K63 L64	V24-L60 HydrophobicContact CG1-CD2 3.4Å; V28-L60 HydrophobicContact CG2-CB 4.5Å; V28-L60 HydrophobicContact CG2-CD2 3.52Å; A56-L60 WeakPolarHBondContact O-CB 3.37Å; A56-L60 PolarHBondContact O-N 3.37Å; T58-L60 VanDerWaalsContact C-N 3.27Å; T58-L60 PolarHBondContact O-N 2.83Å; L60-I62 VanDerWaalsContact C-N 3.28Å; L60-I62 PolarHBondContact O-N 3.49Å; L60-K63 PolarHBondContact O-N 2.89Å; L60-K63 VanDerWaalsContact O-N 3.14Å; L60-L64 HydrophobicContact CD2-CD1 3.77Å; L60-L64 HydrophobicContact CG-CD1 3.96Å; L60-L64 WeakPolarHBondContact O-CG 3.29Å; L60-L64 PolarHBondContact O-N 3.48Å; L60-L64 VanDerWaalsContact O-N 3.09Å
61	C	63.1	Low	61.2	Low	5 Å²	5	57.7 Å²	57.7	3%	0.034	30%	0.297	C	S	.	.	H	α-helix	trans	-58.1	-40.4	176.3	-74.6	0	0	0	0	112.2	V28 G57 T58 K63 L64 N65 I110	V28-C61 VanDerWaalsContact CG1-SG 3.57Å; G57-C61 PolarHBondContact O-N 3.29Å; T58-C61 WeakPolarHBondContact O-CB 3.4Å; T58-C61 PolarHBondContact O-N 3.12Å; C61-K63 VanDerWaalsContact C-N 3.31Å; C61-K63 PolarHBondContact O-N 3.27Å; C61-L64 PolarHBondContact O-N 3.5Å; C61-N65 PolarHBondContact O-N 2.89Å; C61-I110 HydrophobicContact CB-CD1 3.97Å
62	I	62.8	Low	61.8	Low	18 Å²	18	63.2 Å²	63.2	9%	0.092	31%	0.312	C	S	.	.	H	α-helix	trans	-63.9	-37.6	177.8	-64.2	160.1	0	0	0	112	T58 I59 L60 L64 N65 I110 K115 M118	T58-I62 WeakPolarHBondContact O-CD1 3.43Å; T58-I62 VanDerWaalsContact O-CG1 3.27Å; T58-I62 WeakPolarHBondContact O-CG1 3.41Å; T58-I62 PolarHBondContact O-N 3.24Å; T58-I62 VanDerWaalsContact O-N 3.08Å; I59-I62 PolarHBondContact O-N 3.41Å; L60-I62 VanDerWaalsContact C-N 3.28Å; L60-I62 PolarHBondContact O-N 3.49Å; I62-L64 VanDerWaalsContact C-N 3.32Å; I62-N65 PolarHBondContact O-OD1 3.42Å; I62-I110 HydrophobicContact CD1-CD1 4.35Å; I62-I110 HydrophobicContact CD1-CG1 4.27Å; I62-I110 HydrophobicContact CG1-CB 4.38Å; I62-I110 HydrophobicContact CG1-CD1 3.79Å; I62-I110 HydrophobicContact CG1-CG1 3.65Å; I62-I110 HydrophobicContact CG1-CG2 3.83Å; I62-K115 HydrophobicContact CG2-CB 4.39Å; I62-K115 HydrophobicContact CG2-CD 3.4Å; I62-K115 HydrophobicContact CG2-CG 3.72Å; I62-K115 PolarHBondContact O-NZ 3.45Å; I62-M118 HydrophobicContact CD1-CE 2.98Å; I62-M118 HydrophobicContact CD1-SD 3.77Å; I62-M118 HydrophobicContact CG1-CE 4.01Å
63	K	64.3	Low	62.1	Low	174 Å²	174	61.8 Å²	61.8	76%	0.757	31%	0.307	S	S	*	.	H	α-helix	trans	-71	-30.7	177.9	-75.9	-170.4	174.2	-171.9	0	112	I59 L60 C61	I59-K63 PolarHBondContact O-N 3.48Å; I59-K63 VanDerWaalsContact O-N 3.14Å; L60-K63 PolarHBondContact O-N 2.89Å; L60-K63 VanDerWaalsContact O-N 3.14Å; C61-K63 VanDerWaalsContact C-N 3.31Å; C61-K63 PolarHBondContact O-N 3.27Å
64	L	64.1	Low	62.9	Low	46 Å²	46	58.8 Å²	58.8	24%	0.241	29%	0.292	C	S	.	.	H	α-helix	trans	-90.7	-2.9	-174.4	-67.1	168.9	0	0	0	114.5	R21 V24 L60 C61 I62 L66	R21-L64 WeakPolarHBondContact CD-O 3.43Å; R21-L64 PolarHBondContact NE-O 3.33Å; V24-L64 HydrophobicContact CB-CD1 3.88Å; V24-L64 HydrophobicContact CG1-CD1 3.2Å; L60-L64 HydrophobicContact CD2-CD1 3.77Å; L60-L64 HydrophobicContact CG-CD1 3.96Å; L60-L64 WeakPolarHBondContact O-CG 3.29Å; L60-L64 PolarHBondContact O-N 3.48Å; L60-L64 VanDerWaalsContact O-N 3.09Å; C61-L64 PolarHBondContact O-N 3.5Å; I62-L64 VanDerWaalsContact C-N 3.32Å; L64-L66 HydrophobicContact CB-CD1 3.8Å; L64-L66 HydrophobicContact CB-CG 4.24Å; L64-L66 HydrophobicContact CD1-CD1 4.22Å; L64-L66 PolarHBondContact O-N 3.38Å; L64-L66 VanDerWaalsContact O-N 3.11Å
65	N	62.8	Low	63.9	Low	71 Å²	71	58.9 Å²	58.9	38%	0.38	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.1	45.6	-179.9	-84.4	9.3	0	0	0	112.4	C61 I62 L67 K115	C61-N65 PolarHBondContact O-N 2.89Å; I62-N65 PolarHBondContact O-OD1 3.42Å; N65-L67 VanDerWaalsContact C-N 3.35Å; N65-L67 HydrophobicContact CB-CD1 3.9Å; N65-L67 PolarHBondContact O-N 2.88Å; N65-K115 PolarHBondContact OD1-NZ 3.46Å; N65-K115 VanDerWaalsContact OD1-NZ 3.16Å
66	L	59.8	Low	64.7	Low	23 Å²	23	62.9 Å²	62.9	12%	0.12	31%	0.311	C	S	.	.			trans	-79.3	84.5	177.8	-92.5	156.4	0	0	0	109	R21 L64 L70	R21-L66 VanDerWaalsContact C-CD2 3.42Å; R21-L66 HydrophobicContact CB-CD1 4.47Å; R21-L66 HydrophobicContact CB-CD2 3.78Å; R21-L66 HydrophobicContact CB-CG 3.92Å; R21-L66 WeakPolarHBondContact O-CD1 3.35Å; R21-L66 WeakPolarHBondContact O-CD2 3.24Å; L64-L66 HydrophobicContact CB-CD1 3.8Å; L64-L66 HydrophobicContact CB-CG 4.24Å; L64-L66 HydrophobicContact CD1-CD1 4.22Å; L64-L66 PolarHBondContact O-N 3.38Å; L64-L66 VanDerWaalsContact O-N 3.11Å; L66-L70 HydrophobicContact CB-CD1 3.54Å; L66-L70 HydrophobicContact CD2-CD1 4.09Å; L66-L70 HydrophobicContact CG-CD1 4.38Å; L66-L70 VanDerWaalsContact O-CD1 3.24Å; L66-L70 WeakPolarHBondContact O-CD1 3.38Å
67	L	57.9	Low	65.5	Low	46 Å²	46	62.7 Å²	62.7	24%	0.241	30%	0.303	C	S	.	.			trans	-99.3	-28.7	-160.1	-77.9	152.8	0	0	0	115.3	N65 C111	N65-L67 VanDerWaalsContact C-N 3.35Å; N65-L67 HydrophobicContact CB-CD1 3.9Å; N65-L67 PolarHBondContact O-N 2.88Å; L67-C111 HydrophobicContact CD2-CB 4.5Å
68	Y	55.3	Low	66.4	Low	207 Å²	207	62.1 Å²	62.1	81%	0.812	30%	0.297	S	S	*	.	S	Bend	trans	-90.7	-35	-160.1	-66.8	-73.8	0	0	0	116.3
69	F	55.5	Low	67.5	Low	164 Å²	164	63.5 Å²	63.5	72%	0.719	30%	0.304	S	S	*	.	S	Bend	trans	-110.8	-15.9	-175.2	-85.3	-81.6	0	0	0	115.5
70	L	64.4	Low	68.3	Low	16 Å²	16	67.6 Å²	67.6	8%	0.084	32%	0.316	C	S	.	.	H	α-helix	trans	-73.3	-25.5	-176.3	-74.5	114.1	0	0	0	117	L29 L66 A73 G74 I107	L29-L70 HydrophobicContact CD1-CD2 4.31Å; L29-L70 HydrophobicContact CD2-CD2 4.44Å; L29-L70 HydrophobicContact CG-CD2 4.41Å; L66-L70 HydrophobicContact CB-CD1 3.54Å; L66-L70 HydrophobicContact CD2-CD1 4.09Å; L66-L70 HydrophobicContact CG-CD1 4.38Å; L66-L70 VanDerWaalsContact O-CD1 3.24Å; L66-L70 WeakPolarHBondContact O-CD1 3.38Å; L70-A73 PolarHBondContact O-N 3.01Å; L70-G74 PolarHBondContact O-N 2.84Å; L70-I107 HydrophobicContact CB-CG2 4Å; L70-I107 HydrophobicContact CD2-CG2 4Å
71	P	66.5	Low	69.1	Low	19 Å²	19	65 Å²	65	12%	0.123	30%	0.303	C	S	.	.	H	α-helix	trans	-68.3	-45.8	-173.2	22	-26.9	0	0	0	111.3	A73 G74 Y75 F108 C111	P71-A73 PolarHBondContact O-N 3.24Å; P71-G74 PolarHBondContact O-N 3.41Å; P71-Y75 WeakPolarHBondContact O-CB 3.39Å; P71-Y75 PolarHBondContact O-N 3.27Å; P71-F108 HydrophobicContact CB-CD2 3.66Å; P71-F108 HydrophobicContact CB-CE2 4.05Å; P71-F108 WeakPolarHBondContact O-CD2 3.25Å; P71-C111 HydrophobicContact CB-CB 4.22Å; P71-C111 HydrophobicContact CG-CB 4.37Å
72	Y	69.8	Low	70.3	Confident	165 Å²	165	64.8 Å²	64.8	65%	0.647	30%	0.301	S	S	*	.	H	α-helix	trans	-62.7	-40.8	178.7	-67.1	-74.9	0	0	0	112.7	Y75 L76	Y72-Y75 PolarHBondContact O-N 2.96Å; Y72-L76 WeakPolarHBondContact O-CG 3.39Å; Y72-L76 PolarHBondContact O-N 3.06Å
73	A	70	Confident	71.6	Confident	41 Å²	41	67.5 Å²	67.5	34%	0.339	32%	0.316	S	S	.	.	H	α-helix	trans	-64.8	-42.6	174.8	0	0	0	0	0	111.8	L70 P71 Y75 T77	L70-A73 PolarHBondContact O-N 3.01Å; P71-A73 PolarHBondContact O-N 3.24Å; A73-Y75 VanDerWaalsContact C-N 3.32Å; A73-Y75 PolarHBondContact O-N 3.04Å; A73-T77 WeakPolarHBondContact O-CB 3.43Å; A73-T77 VanDerWaalsContact O-CG2 3.25Å; A73-T77 WeakPolarHBondContact O-CG2 3.27Å; A73-T77 PolarHBondContact O-N 2.96Å; A73-T77 PolarHBondContact O-OG1 3.46Å
74	G	72.9	Confident	72.8	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-60.8	-41.3	173.9	0	0	0	0	0	112.1	L70 P71 T77 S78 A104	L70-G74 PolarHBondContact O-N 2.84Å; P71-G74 PolarHBondContact O-N 3.41Å; G74-T77 WeakPolarHBondContact CA-OG1 3.46Å; G74-T77 PolarHBondContact O-OG1 3.27Å; G74-S78 WeakPolarHBondContact O-CB 3.32Å; G74-S78 PolarHBondContact O-N 3.03Å; G74-A104 WeakPolarHBondContact O-CB 3.33Å
75	Y	75.2	Confident	73.9	Confident	15 Å²	15	58.6 Å²	58.6	6%	0.059	28%	0.276	C	S	.	.	H	α-helix	trans	-63.2	-53.7	176.9	-179.8	-93.8	0	0	0	112.2	P71 Y72 A73 T77 S78 L79 L200 I204	P71-Y75 WeakPolarHBondContact O-CB 3.39Å; P71-Y75 PolarHBondContact O-N 3.27Å; Y72-Y75 PolarHBondContact O-N 2.96Å; A73-Y75 VanDerWaalsContact C-N 3.32Å; A73-Y75 PolarHBondContact O-N 3.04Å; Y75-T77 PolarHBondContact O-N 3.38Å; Y75-S78 WeakPolarHBondContact O-CB 3.38Å; Y75-S78 PolarHBondContact O-N 3.06Å; Y75-S78 VanDerWaalsContact O-N 3.12Å; Y75-L79 HydrophobicContact CD1-CD1 4.1Å; Y75-L79 HydrophobicContact CE1-CD1 3.24Å; Y75-L79 HydrophobicContact CE1-CG 3.95Å; Y75-L79 PolarHBondContact O-N 3.43Å; Y75-L79 WeakPolarHBondContact OH-CD1 3.35Å; Y75-L200 HydrophobicContact CE1-CB 4.29Å; Y75-L200 HydrophobicContact CE1-CD2 3.73Å; Y75-L200 HydrophobicContact CE1-CG 4.4Å; Y75-L200 HydrophobicContact CE2-CB 3.67Å; Y75-L200 VanDerWaalsContact CE2-O 3.3Å; Y75-L200 WeakPolarHBondContact CE2-O 3.39Å; Y75-L200 VanDerWaalsContact OH-C 3.27Å; Y75-L200 VanDerWaalsContact OH-CA 3.27Å; Y75-L200 WeakPolarHBondContact OH-CA 3.25Å; Y75-L200 VanDerWaalsContact OH-CB 3.29Å; Y75-L200 WeakPolarHBondContact OH-CB 3.25Å; Y75-L200 WeakPolarHBondContact OH-CD2 3.42Å; Y75-L200 PolarHBondContact OH-O 3.47Å; Y75-I204 HydrophobicContact CD2-CD1 3.25Å; Y75-I204 HydrophobicContact CD2-CG1 4.23Å; Y75-I204 HydrophobicContact CE2-CD1 3.13Å; Y75-I204 HydrophobicContact CE2-CG1 3.61Å; Y75-I204 HydrophobicContact CG-CD1 4.17Å
76	L	78.1	Confident	75.2	Confident	114 Å²	114	57.1 Å²	57.1	60%	0.597	27%	0.268	S	S	*	.	H	α-helix	trans	-61.7	-42.4	-178.7	-71.4	171.4	0	0	0	112.1	Y72 S78 L79 Y80	Y72-L76 WeakPolarHBondContact O-CG 3.39Å; Y72-L76 PolarHBondContact O-N 3.06Å; L76-S78 VanDerWaalsContact C-N 3.31Å; L76-S78 PolarHBondContact O-N 3.25Å; L76-L79 PolarHBondContact O-N 3.12Å; L76-Y80 WeakPolarHBondContact O-CB 3.33Å; L76-Y80 PolarHBondContact O-N 3.36Å
77	T	78.4	Confident	76.7	Confident	56 Å²	56	65.1 Å²	65.1	34%	0.344	30%	0.298	S	S	.	.	H	α-helix	trans	-66.1	-34.9	176.3	52.4	0	0	0	0	112	A73 G74 Y75 S81 A104	A73-T77 WeakPolarHBondContact O-CB 3.43Å; A73-T77 VanDerWaalsContact O-CG2 3.25Å; A73-T77 WeakPolarHBondContact O-CG2 3.27Å; A73-T77 PolarHBondContact O-N 2.96Å; A73-T77 PolarHBondContact O-OG1 3.46Å; G74-T77 WeakPolarHBondContact CA-OG1 3.46Å; G74-T77 PolarHBondContact O-OG1 3.27Å; Y75-T77 PolarHBondContact O-N 3.38Å; T77-S81 WeakPolarHBondContact O-CB 3.47Å; T77-S81 PolarHBondContact O-N 3.43Å; T77-S81 PolarHBondContact O-OG 3.35Å; T77-A104 WeakPolarHBondContact OG1-CB 3.29Å
78	S	82.1	Confident	78.2	Confident	0 Å²	0	65 Å²	65	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-65.9	-41.7	175.1	-163.1	0	0	0	0	112	G74 Y75 L76 S81 R82 S101	G74-S78 WeakPolarHBondContact O-CB 3.32Å; G74-S78 PolarHBondContact O-N 3.03Å; Y75-S78 WeakPolarHBondContact O-CB 3.38Å; Y75-S78 PolarHBondContact O-N 3.06Å; Y75-S78 VanDerWaalsContact O-N 3.12Å; L76-S78 VanDerWaalsContact C-N 3.31Å; L76-S78 PolarHBondContact O-N 3.25Å; S78-S81 PolarHBondContact O-OG 3.05Å; S78-S81 VanDerWaalsContact O-OG 3.07Å; S78-R82 WeakPolarHBondContact O-CG 3.39Å; S78-R82 PolarHBondContact O-N 2.7Å; S78-R82 PolarHBondContact O-NH1 3.3Å; S78-R82 VanDerWaalsContact OG-CZ 3.24Å; S78-R82 PolarHBondContact OG-NH1 3.05Å; S78-R82 PolarHBondContact OG-NH2 3Å; S78-R82 VanDerWaalsContact OG-NH2 3.1Å; S78-S101 PolarHBondContact OG-O 3.06Å
79	L	83.8	Confident	79.8	Confident	32 Å²	32	59.7 Å²	59.7	17%	0.168	28%	0.277	C	S	.	.	H	α-helix	trans	-65.8	-50.7	173.8	-81.4	-179.8	0	0	0	112.2	Y75 L76 S81 R82 L83 I203 I204	Y75-L79 HydrophobicContact CD1-CD1 4.1Å; Y75-L79 HydrophobicContact CE1-CD1 3.24Å; Y75-L79 HydrophobicContact CE1-CG 3.95Å; Y75-L79 PolarHBondContact O-N 3.43Å; Y75-L79 WeakPolarHBondContact OH-CD1 3.35Å; L76-L79 PolarHBondContact O-N 3.12Å; L79-S81 VanDerWaalsContact C-N 3.32Å; L79-S81 PolarHBondContact O-N 2.74Å; L79-R82 PolarHBondContact O-N 3.47Å; L79-R82 VanDerWaalsContact O-N 3.12Å; L79-L83 PolarHBondContact O-N 2.7Å; L79-I203 HydrophobicContact CD2-CG2 4.01Å; L79-I204 HydrophobicContact CD2-CG1 3.59Å; L79-I204 HydrophobicContact CG-CD1 4.37Å; L79-I204 HydrophobicContact CG-CG1 3.89Å
80	Y	83.9	Confident	81.4	Confident	151 Å²	151	53.8 Å²	53.8	59%	0.592	25%	0.254	S	S	*	.	H	α-helix	trans	-57.6	-45.1	-177	178.9	-110.4	0	0	0	112.1	L76 R82 L83 I84	L76-Y80 WeakPolarHBondContact O-CB 3.33Å; L76-Y80 PolarHBondContact O-N 3.36Å; Y80-R82 PolarHBondContact O-N 3.07Å; Y80-L83 PolarHBondContact O-N 3.1Å; Y80-I84 HydrophobicContact CD1-CD1 3.68Å; Y80-I84 HydrophobicContact CD2-CD1 4.37Å; Y80-I84 HydrophobicContact CE1-CD1 3.2Å; Y80-I84 HydrophobicContact CE1-CG1 4.38Å; Y80-I84 HydrophobicContact CE2-CD1 3.96Å; Y80-I84 HydrophobicContact CE2-CG1 4.37Å; Y80-I84 HydrophobicContact CG-CD1 4.25Å; Y80-I84 WeakPolarHBondContact O-CG1 3.12Å; Y80-I84 PolarHBondContact O-N 3.17Å
81	S	81.5	Confident	82.4	Confident	0 Å²	0	53 Å²	53	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-64.2	-36.2	177.5	51	0	0	0	0	113.2	T77 S78 L79 A85 S101	T77-S81 WeakPolarHBondContact O-CB 3.47Å; T77-S81 PolarHBondContact O-N 3.43Å; T77-S81 PolarHBondContact O-OG 3.35Å; S78-S81 PolarHBondContact O-OG 3.05Å; S78-S81 VanDerWaalsContact O-OG 3.07Å; L79-S81 VanDerWaalsContact C-N 3.32Å; L79-S81 PolarHBondContact O-N 2.74Å; S81-A85 WeakPolarHBondContact O-CB 3.07Å; S81-A85 PolarHBondContact O-N 2.98Å; S81-S101 WeakPolarHBondContact OG-CA 3.44Å; S81-S101 WeakPolarHBondContact OG-CB 3.45Å; S81-S101 PolarHBondContact OG-N 3.18Å
82	R	88.3	Confident	83.2	Confident	1 Å²	1	54.1 Å²	54.1	0%	0.004	25%	0.252	C	S	.	.	H	α-helix	trans	-69.2	-38.7	174.8	-70	-172.1	-170.3	92.9	2.9	112.6	S78 L79 Y80 I84 A85 L86 M207 Y211	S78-R82 WeakPolarHBondContact O-CG 3.39Å; S78-R82 PolarHBondContact O-N 2.7Å; S78-R82 PolarHBondContact O-NH1 3.3Å; S78-R82 VanDerWaalsContact OG-CZ 3.24Å; S78-R82 PolarHBondContact OG-NH1 3.05Å; S78-R82 PolarHBondContact OG-NH2 3Å; S78-R82 VanDerWaalsContact OG-NH2 3.1Å; L79-R82 PolarHBondContact O-N 3.47Å; L79-R82 VanDerWaalsContact O-N 3.12Å; Y80-R82 PolarHBondContact O-N 3.07Å; R82-I84 VanDerWaalsContact C-N 3.35Å; R82-A85 PolarHBondContact O-N 3.2Å; R82-L86 PolarHBondContact O-N 2.72Å; R82-M207 HydrophobicContact CB-CB 4.07Å; R82-Y211 HydrophobicContact CG-CD1 4.24Å; R82-Y211 HydrophobicContact CG-CE1 4.39Å
83	L	89.1	Confident	83.8	Confident	75 Å²	75	48.4 Å²	48.4	39%	0.393	23%	0.231	S	C	.	.	H	α-helix	trans	-60.1	-46	174.9	-73	171.5	0	0	0	110.9	L79 Y80 A85 L86 Y87 M207	L79-L83 PolarHBondContact O-N 2.7Å; Y80-L83 PolarHBondContact O-N 3.1Å; L83-A85 VanDerWaalsContact C-N 3.34Å; L83-A85 PolarHBondContact O-N 2.91Å; L83-L86 PolarHBondContact O-N 2.97Å; L83-Y87 WeakPolarHBondContact O-CD2 3.16Å; L83-M207 HydrophobicContact CD2-CE 3.5Å; L83-M207 HydrophobicContact CD2-SD 4.36Å; L83-M207 HydrophobicContact CG-CE 4.46Å
84	I	88.6	Confident	84.7	Confident	34 Å²	34	46.5 Å²	46.5	17%	0.174	22%	0.215	C	C	.	.	H	α-helix	trans	-63.1	-41.5	176.3	-63.5	163.2	0	0	0	111.4	Y80 R82 L86 Y87 E88 Y97	Y80-I84 HydrophobicContact CD1-CD1 3.68Å; Y80-I84 HydrophobicContact CD2-CD1 4.37Å; Y80-I84 HydrophobicContact CE1-CD1 3.2Å; Y80-I84 HydrophobicContact CE1-CG1 4.38Å; Y80-I84 HydrophobicContact CE2-CD1 3.96Å; Y80-I84 HydrophobicContact CE2-CG1 4.37Å; Y80-I84 HydrophobicContact CG-CD1 4.25Å; Y80-I84 WeakPolarHBondContact O-CG1 3.12Å; Y80-I84 PolarHBondContact O-N 3.17Å; R82-I84 VanDerWaalsContact C-N 3.35Å; I84-L86 PolarHBondContact O-N 3.47Å; I84-Y87 PolarHBondContact O-N 3.14Å; I84-E88 HydrophobicContact CG2-CG 3.8Å; I84-E88 PolarHBondContact O-N 3.44Å; I84-Y97 HydrophobicContact CB-CD1 4.31Å; I84-Y97 HydrophobicContact CB-CE1 4.3Å; I84-Y97 HydrophobicContact CB-CG 4.46Å; I84-Y97 HydrophobicContact CD1-CD1 4.49Å; I84-Y97 HydrophobicContact CD1-CE1 3.98Å; I84-Y97 HydrophobicContact CG2-CD1 4.17Å; I84-Y97 HydrophobicContact CG2-CD2 3.81Å; I84-Y97 HydrophobicContact CG2-CE1 3.88Å; I84-Y97 HydrophobicContact CG2-CE2 3.51Å; I84-Y97 HydrophobicContact CG2-CG 4.14Å
85	A	88.1	Confident	85.4	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-59.9	-28.3	179.7	0	0	0	0	0	113.5	S81 R82 L83	S81-A85 WeakPolarHBondContact O-CB 3.07Å; S81-A85 PolarHBondContact O-N 2.98Å; R82-A85 PolarHBondContact O-N 3.2Å; L83-A85 VanDerWaalsContact C-N 3.34Å; L83-A85 PolarHBondContact O-N 2.91Å
86	L	90.9	Very high	85.8	Confident	39 Å²	39	47.4 Å²	47.4	20%	0.204	23%	0.225	C	C	.	.	H	α-helix	trans	-71	-29.5	176.1	-74.5	165.1	0	0	0	113.1	R82 L83 I84 M207 A210 R214	R82-L86 PolarHBondContact O-N 2.72Å; L83-L86 PolarHBondContact O-N 2.97Å; I84-L86 PolarHBondContact O-N 3.47Å; L86-M207 HydrophobicContact CD1-SD 3.88Å; L86-A210 HydrophobicContact CD2-CB 4.06Å; L86-R214 WeakPolarHBondContact O-CD 3.28Å; L86-R214 PolarHBondContact O-NE 2.82Å
87	Y	90.7	Very high	86.1	Confident	191 Å²	191	44.2 Å²	44.2	75%	0.749	21%	0.205	S	C	*	.	H	α-helix	trans	-97.8	-23.1	-179.1	-68.6	-72.2	0	0	0	113.4	L83 I84	L83-Y87 WeakPolarHBondContact O-CD2 3.16Å; I84-Y87 PolarHBondContact O-N 3.14Å
88	E	89.8	Confident	86.5	Confident	43 Å²	43	41.6 Å²	41.6	20%	0.201	19%	0.189	C	C	.	.			trans	-64.5	138.8	-177.9	-93.2	-66.1	-177.5	0	0	113.3	I84 K93 I94 Y97 R214	I84-E88 HydrophobicContact CG2-CG 3.8Å; I84-E88 PolarHBondContact O-N 3.44Å; E88-K93 HydrophobicContact CB-CB 4.47Å; E88-K93 HydrophobicContact CG-CB 4.27Å; E88-K93 HydrophobicContact CG-CD 4.49Å; E88-K93 WeakPolarHBondContact OE1-CD 3.32Å; E88-K93 IonicContact OE1-NZ 3.91Å; E88-K93 WeakPolarHBondContact OE2-CD 3.46Å; E88-I94 HydrophobicContact CB-CG1 3.93Å; E88-I94 VanDerWaalsContact O-CD1 3.27Å; E88-I94 WeakPolarHBondContact O-CD1 3.17Å; E88-I94 WeakPolarHBondContact O-CG1 3.5Å; E88-Y97 HydrophobicContact CG-CD2 4.04Å; E88-Y97 HydrophobicContact CG-CE2 3.8Å; E88-R214 PolarHBondContact O-NH2 2.63Å
89	K	87.9	Confident	86.5	Confident	96 Å²	96	41.6 Å²	41.6	42%	0.417	19%	0.19	S	C	.	.			trans	-104.7	-26.2	-173.6	-66.8	173	178.5	173.4	0	112.8	L91 S149	K89-L91 PolarHBondContact O-N 3.43Å; K89-S149 WeakPolarHBondContact O-CB 3.21Å; K89-S149 PolarHBondContact O-N 3.17Å; K89-S149 PolarHBondContact O-OG 3.28Å
90	D	88.3	Confident	86.3	Confident	41 Å²	41	43.1 Å²	43.1	22%	0.219	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-76.2	123.8	177.1	-68.7	-35.7	0	0	0	110.1	K92 K93 I94	D90-K92 VanDerWaalsContact C-N 3.31Å; D90-K92 PolarHBondContact O-N 3.47Å; D90-K93 HydrophobicContact CB-CB 4Å; D90-K93 HydrophobicContact CB-CD 3.89Å; D90-K93 HydrophobicContact CB-CG 3.84Å; D90-K93 WeakPolarHBondContact O-CB 3.37Å; D90-K93 PolarHBondContact O-N 3.26Å; D90-K93 WeakPolarHBondContact OD2-CD 3.33Å; D90-K93 WeakPolarHBondContact OD2-CE 3.35Å; D90-K93 IonicContact OD2-NZ 2.74Å; D90-K93 PolarHBondContact OD2-NZ 3.12Å; D90-I94 WeakPolarHBondContact O-CG1 3.5Å; D90-I94 PolarHBondContact O-N 3.24Å
91	L	85.8	Confident	86.2	Confident	0 Å²	0	36 Å²	36	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-52.3	-48.9	-179.1	-75.8	178.8	0	0	0	111.7	K89 K93 I94 L95 I136 F139 Q147 L152 L215 L219	K89-L91 PolarHBondContact O-N 3.43Å; L91-K93 VanDerWaalsContact C-N 3.3Å; L91-K93 PolarHBondContact O-N 3.3Å; L91-I94 PolarHBondContact O-N 3.19Å; L91-L95 WeakPolarHBondContact O-CG 3.38Å; L91-L95 PolarHBondContact O-N 2.88Å; L91-L95 VanDerWaalsContact O-N 3.11Å; L91-I136 HydrophobicContact CB-CG2 4.21Å; L91-I136 HydrophobicContact CD1-CG2 4.21Å; L91-F139 HydrophobicContact CD1-CD1 4.09Å; L91-F139 HydrophobicContact CD1-CE1 4Å; L91-Q147 PolarHBondContact N-O 3.05Å; L91-L152 HydrophobicContact CD1-CD1 3.6Å; L91-L152 HydrophobicContact CD1-CD2 4.14Å; L91-L152 HydrophobicContact CD1-CG 4.44Å; L91-L152 HydrophobicContact CD2-CD1 4.2Å; L91-L152 HydrophobicContact CG-CD1 4.06Å; L91-L215 HydrophobicContact CD2-CD1 3.73Å; L91-L219 HydrophobicContact CD1-CD2 4.48Å; L91-L219 HydrophobicContact CD2-CD2 4.22Å
92	K	83.6	Confident	86.4	Confident	41 Å²	41	36 Å²	36	18%	0.178	17%	0.169	C	C	.	.	H	α-helix	trans	-61.2	-37.1	-179.7	-66.1	-170.8	-168.1	178.5	0	112.9	T42 D90 L95 A96 I140	T42-K92 HydrophobicContact CG2-CD 4.27Å; D90-K92 VanDerWaalsContact C-N 3.31Å; D90-K92 PolarHBondContact O-N 3.47Å; K92-L95 PolarHBondContact O-N 3.34Å; K92-A96 PolarHBondContact O-N 3.24Å; K92-I140 HydrophobicContact CD-CD1 4.31Å; K92-I140 HydrophobicContact CG-CD1 3.69Å
93	K	83.2	Confident	85.8	Confident	46 Å²	46	37 Å²	37	20%	0.2	17%	0.174	C	C	.	.	H	α-helix	trans	-67.1	-45.3	178.1	-72.7	-176	-172.9	155	0	111	H38 E88 D90 L91 L95 A96 Y97	H38-K93 WeakPolarHBondContact CE1-CE 3.46Å; H38-K93 VanDerWaalsContact CE1-CG 3.41Å; H38-K93 WeakPolarHBondContact CE1-CG 3.39Å; H38-K93 WeakPolarHBondContact NE2-CE 3.29Å; E88-K93 HydrophobicContact CB-CB 4.47Å; E88-K93 HydrophobicContact CG-CB 4.27Å; E88-K93 HydrophobicContact CG-CD 4.49Å; E88-K93 WeakPolarHBondContact OE1-CD 3.32Å; E88-K93 IonicContact OE1-NZ 3.91Å; E88-K93 WeakPolarHBondContact OE2-CD 3.46Å; D90-K93 HydrophobicContact CB-CB 4Å; D90-K93 HydrophobicContact CB-CD 3.89Å; D90-K93 HydrophobicContact CB-CG 3.84Å; D90-K93 WeakPolarHBondContact O-CB 3.37Å; D90-K93 PolarHBondContact O-N 3.26Å; D90-K93 WeakPolarHBondContact OD2-CD 3.33Å; D90-K93 WeakPolarHBondContact OD2-CE 3.35Å; D90-K93 IonicContact OD2-NZ 2.74Å; D90-K93 PolarHBondContact OD2-NZ 3.12Å; L91-K93 VanDerWaalsContact C-N 3.3Å; L91-K93 PolarHBondContact O-N 3.3Å; K93-L95 PolarHBondContact O-N 2.92Å; K93-A96 PolarHBondContact O-N 3.06Å; K93-Y97 HydrophobicContact CB-CD2 4.33Å; K93-Y97 HydrophobicContact CB-CE2 4.25Å; K93-Y97 WeakPolarHBondContact O-CD2 3.5Å; K93-Y97 PolarHBondContact O-N 3.35Å
94	I	89.1	Confident	85.2	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-55	-43.7	175.8	-58.7	165.5	0	0	0	109.6	E88 D90 L91 S98 L215 L218	E88-I94 HydrophobicContact CB-CG1 3.93Å; E88-I94 VanDerWaalsContact O-CD1 3.27Å; E88-I94 WeakPolarHBondContact O-CD1 3.17Å; E88-I94 WeakPolarHBondContact O-CG1 3.5Å; D90-I94 WeakPolarHBondContact O-CG1 3.5Å; D90-I94 PolarHBondContact O-N 3.24Å; L91-I94 PolarHBondContact O-N 3.19Å; I94-S98 WeakPolarHBondContact O-CB 3.31Å; I94-S98 PolarHBondContact O-N 3.08Å; I94-S98 PolarHBondContact O-OG 3.35Å; I94-L215 HydrophobicContact CD1-CD1 4.16Å; I94-L215 HydrophobicContact CG2-CD1 4.11Å; I94-L218 HydrophobicContact CD1-CD1 4.19Å
95	L	87.2	Confident	84.7	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-64.9	-43	176.6	-58.6	-173	0	0	0	113.1	L91 K92 K93 S98 T99 L132 F133 I136 L215	L91-L95 WeakPolarHBondContact O-CG 3.38Å; L91-L95 PolarHBondContact O-N 2.88Å; L91-L95 VanDerWaalsContact O-N 3.11Å; K92-L95 PolarHBondContact O-N 3.34Å; K93-L95 PolarHBondContact O-N 2.92Å; L95-S98 WeakPolarHBondContact CA-OG 3.27Å; L95-S98 PolarHBondContact O-N 3.19Å; L95-S98 PolarHBondContact O-OG 3.42Å; L95-T99 PolarHBondContact O-N 3.26Å; L95-L132 HydrophobicContact CD1-CD2 3.78Å; L95-L132 HydrophobicContact CD2-CD2 3.19Å; L95-L132 HydrophobicContact CG-CD2 4.02Å; L95-F133 HydrophobicContact CB-CD1 4.14Å; L95-F133 HydrophobicContact CB-CE1 3.41Å; L95-F133 VanDerWaalsContact CB-CE1 3.41Å; L95-F133 HydrophobicContact CB-CE2 4.1Å; L95-F133 HydrophobicContact CB-CZ 3.39Å; L95-F133 HydrophobicContact CD1-CD1 3.6Å; L95-F133 HydrophobicContact CD1-CE1 3.75Å; L95-F133 HydrophobicContact CD1-CG 4.09Å; L95-F133 HydrophobicContact CD1-CZ 4.33Å; L95-F133 HydrophobicContact CG-CE1 4.26Å; L95-I136 HydrophobicContact CD1-CB 4Å; L95-I136 HydrophobicContact CD1-CD1 3.57Å; L95-I136 HydrophobicContact CD1-CG1 4.36Å; L95-I136 HydrophobicContact CD1-CG2 3.94Å; L95-I136 HydrophobicContact CD2-CD1 3.75Å; L95-I136 HydrophobicContact CG-CD1 4.07Å; L95-L215 HydrophobicContact CD2-CD2 3.66Å
96	A	82.8	Confident	84.2	Confident	34 Å²	34	32.4 Å²	32.4	28%	0.281	15%	0.151	S	C	.	.	H	α-helix	trans	-63.7	-44.2	178	0	0	0	0	0	112.1	K92 K93 S98 T99 M100	K92-A96 PolarHBondContact O-N 3.24Å; K93-A96 PolarHBondContact O-N 3.06Å; A96-S98 VanDerWaalsContact C-N 3.28Å; A96-S98 PolarHBondContact O-N 3.03Å; A96-T99 PolarHBondContact O-N 3.19Å; A96-T99 PolarHBondContact O-OG1 3.45Å; A96-M100 PolarHBondContact O-N 3.09Å
97	Y	84.3	Confident	83.3	Confident	46 Å²	46	31 Å²	31	18%	0.18	14%	0.143	C	C	.	.	H	α-helix	trans	-64.7	-35.4	175.4	-74.7	-63.8	0	0	0	112	I84 E88 K93 T99 M100 S101	I84-Y97 HydrophobicContact CB-CD1 4.31Å; I84-Y97 HydrophobicContact CB-CE1 4.3Å; I84-Y97 HydrophobicContact CB-CG 4.46Å; I84-Y97 HydrophobicContact CD1-CD1 4.49Å; I84-Y97 HydrophobicContact CD1-CE1 3.98Å; I84-Y97 HydrophobicContact CG2-CD1 4.17Å; I84-Y97 HydrophobicContact CG2-CD2 3.81Å; I84-Y97 HydrophobicContact CG2-CE1 3.88Å; I84-Y97 HydrophobicContact CG2-CE2 3.51Å; I84-Y97 HydrophobicContact CG2-CG 4.14Å; E88-Y97 HydrophobicContact CG-CD2 4.04Å; E88-Y97 HydrophobicContact CG-CE2 3.8Å; K93-Y97 HydrophobicContact CB-CD2 4.33Å; K93-Y97 HydrophobicContact CB-CE2 4.25Å; K93-Y97 WeakPolarHBondContact O-CD2 3.5Å; K93-Y97 PolarHBondContact O-N 3.35Å; Y97-T99 PolarHBondContact O-N 3.21Å; Y97-M100 HydrophobicContact CD1-SD 4.39Å; Y97-M100 PolarHBondContact O-N 3.14Å; Y97-S101 WeakPolarHBondContact O-CB 3.48Å; Y97-S101 PolarHBondContact O-N 3.46Å
98	S	87	Confident	82.5	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.007	11%	0.112	C	C	.	.	H	α-helix	trans	-66.2	-35.8	175.6	74.7	0	0	0	0	112.8	I94 L95 A96 S101 Q102 K129	I94-S98 WeakPolarHBondContact O-CB 3.31Å; I94-S98 PolarHBondContact O-N 3.08Å; I94-S98 PolarHBondContact O-OG 3.35Å; L95-S98 WeakPolarHBondContact CA-OG 3.27Å; L95-S98 PolarHBondContact O-N 3.19Å; L95-S98 PolarHBondContact O-OG 3.42Å; A96-S98 VanDerWaalsContact C-N 3.28Å; A96-S98 PolarHBondContact O-N 3.03Å; S98-S101 PolarHBondContact O-OG 3.48Å; S98-Q102 WeakPolarHBondContact O-CG 3.44Å; S98-Q102 PolarHBondContact O-N 2.87Å; S98-K129 PolarHBondContact OG-NZ 3.24Å
99	T	81.7	Confident	81.7	Confident	1 Å²	1	20.7 Å²	20.7	1%	0.006	10%	0.102	C	C	.	.	H	α-helix	trans	-69.1	-47.4	172.8	56.4	0	0	0	0	110.6	L95 A96 Y97 S101 Q102 I103 K129 F133	L95-T99 PolarHBondContact O-N 3.26Å; A96-T99 PolarHBondContact O-N 3.19Å; A96-T99 PolarHBondContact O-OG1 3.45Å; Y97-T99 PolarHBondContact O-N 3.21Å; T99-S101 PolarHBondContact O-N 3Å; T99-Q102 PolarHBondContact O-N 3.1Å; T99-Q102 VanDerWaalsContact O-N 3.09Å; T99-I103 WeakPolarHBondContact O-CB 3.45Å; T99-I103 WeakPolarHBondContact O-CD1 3.49Å; T99-I103 WeakPolarHBondContact O-CG1 3.15Å; T99-I103 PolarHBondContact O-N 3.04Å; T99-K129 HydrophobicContact CG2-CB 4.42Å; T99-K129 HydrophobicContact CG2-CD 3.75Å; T99-K129 HydrophobicContact CG2-CG 3.96Å; T99-F133 HydrophobicContact CG2-CE2 3.67Å; T99-F133 HydrophobicContact CG2-CZ 4.23Å
100	M	79.5	Confident	80.9	Confident	64 Å²	64	17.1 Å²	17.1	32%	0.315	9%	0.087	S	C	.	.	H	α-helix	trans	-51.3	-43.6	176.8	-172.9	-179.9	-178.3	0	0	111.5	A96 Y97 I103 A104	A96-M100 PolarHBondContact O-N 3.09Å; Y97-M100 HydrophobicContact CD1-SD 4.39Å; Y97-M100 PolarHBondContact O-N 3.14Å; M100-I103 PolarHBondContact O-N 3.14Å; M100-A104 WeakPolarHBondContact O-CB 3.3Å; M100-A104 PolarHBondContact O-N 3.26Å
101	S	83.8	Confident	79.8	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-63.9	-42.5	178.9	75.9	0	0	0	0	114	S78 S81 Y97 S98 T99 A104 L105	S78-S101 PolarHBondContact OG-O 3.06Å; S81-S101 WeakPolarHBondContact OG-CA 3.44Å; S81-S101 WeakPolarHBondContact OG-CB 3.45Å; S81-S101 PolarHBondContact OG-N 3.18Å; Y97-S101 WeakPolarHBondContact O-CB 3.48Å; Y97-S101 PolarHBondContact O-N 3.46Å; S98-S101 PolarHBondContact O-OG 3.48Å; T99-S101 PolarHBondContact O-N 3Å; S101-A104 PolarHBondContact O-N 3.46Å; S101-L105 WeakPolarHBondContact O-CB 3.44Å; S101-L105 PolarHBondContact O-N 2.88Å
102	Q	83.8	Confident	78.9	Confident	1 Å²	1	17.5 Å²	17.5	1%	0.005	9%	0.092	C	C	.	.	H	α-helix	trans	-73.5	-34.3	-178.4	-64.4	-63.5	-8.4	0	0	111.2	S98 T99 L105 V106 H125	S98-Q102 WeakPolarHBondContact O-CG 3.44Å; S98-Q102 PolarHBondContact O-N 2.87Å; T99-Q102 PolarHBondContact O-N 3.1Å; T99-Q102 VanDerWaalsContact O-N 3.09Å; Q102-L105 WeakPolarHBondContact O-CB 3.34Å; Q102-L105 PolarHBondContact O-N 2.66Å; Q102-V106 WeakPolarHBondContact O-CG2 3.46Å; Q102-V106 PolarHBondContact O-N 3.18Å; Q102-H125 VanDerWaalsContact CB-NE2 3.33Å; Q102-H125 WeakPolarHBondContact CB-NE2 3.47Å; Q102-H125 VanDerWaalsContact CG-NE2 3.3Å; Q102-H125 WeakPolarHBondContact CG-NE2 3.4Å
103	I	75.7	Confident	78.2	Confident	21 Å²	21	20.6 Å²	20.6	11%	0.108	11%	0.111	C	C	.	.	H	α-helix	trans	-66	-43.1	175	-71.6	159.7	0	0	0	111	V54 T99 M100 L105 V106 I107	V54-I103 HydrophobicContact CB-CD1 3.74Å; V54-I103 HydrophobicContact CB-CG1 4.25Å; V54-I103 HydrophobicContact CG1-CB 3.82Å; V54-I103 HydrophobicContact CG1-CD1 3.22Å; V54-I103 HydrophobicContact CG1-CG1 3.32Å; V54-I103 HydrophobicContact CG1-CG2 3.16Å; V54-I103 HydrophobicContact CG2-CD1 3.68Å; T99-I103 WeakPolarHBondContact O-CB 3.45Å; T99-I103 WeakPolarHBondContact O-CD1 3.49Å; T99-I103 WeakPolarHBondContact O-CG1 3.15Å; T99-I103 PolarHBondContact O-N 3.04Å; M100-I103 PolarHBondContact O-N 3.14Å; I103-L105 VanDerWaalsContact C-N 3.26Å; I103-L105 PolarHBondContact O-N 3.02Å; I103-V106 WeakPolarHBondContact O-CB 2.96Å; I103-V106 PolarHBondContact O-N 3.29Å; I103-I107 PolarHBondContact O-N 3.22Å
104	A	77.5	Confident	77.8	Confident	5 Å²	5	20.4 Å²	20.4	4%	0.041	11%	0.111	C	C	.	.	H	α-helix	trans	-62.2	-37.5	174.7	0	0	0	0	0	111.3	G74 T77 M100 S101 I107 F108	G74-A104 WeakPolarHBondContact O-CB 3.33Å; T77-A104 WeakPolarHBondContact OG1-CB 3.29Å; M100-A104 WeakPolarHBondContact O-CB 3.3Å; M100-A104 PolarHBondContact O-N 3.26Å; S101-A104 PolarHBondContact O-N 3.46Å; A104-I107 WeakPolarHBondContact O-CB 3.44Å; A104-I107 PolarHBondContact O-N 3.18Å; A104-F108 PolarHBondContact O-N 3.28Å; A104-F108 VanDerWaalsContact O-N 3.14Å
105	L	78.4	Confident	77	Confident	3 Å²	3	24.4 Å²	24.4	2%	0.016	13%	0.129	C	C	.	.	H	α-helix	trans	-65.3	-38.8	172.7	-168	148.9	0	0	0	112	S101 Q102 I103 I107 F108 I109 L188 I204	S101-L105 WeakPolarHBondContact O-CB 3.44Å; S101-L105 PolarHBondContact O-N 2.88Å; Q102-L105 WeakPolarHBondContact O-CB 3.34Å; Q102-L105 PolarHBondContact O-N 2.66Å; I103-L105 VanDerWaalsContact C-N 3.26Å; I103-L105 PolarHBondContact O-N 3.02Å; L105-I107 VanDerWaalsContact C-N 3.31Å; L105-I107 PolarHBondContact O-N 2.68Å; L105-F108 WeakPolarHBondContact O-CB 3.47Å; L105-F108 PolarHBondContact O-N 2.86Å; L105-I109 HydrophobicContact CD2-CD1 3.33Å; L105-I109 HydrophobicContact CD2-CG1 4.07Å; L105-I109 WeakPolarHBondContact O-CG1 3.39Å; L105-I109 PolarHBondContact O-N 3.04Å; L105-L188 HydrophobicContact CD1-CD1 4.24Å; L105-L188 HydrophobicContact CD1-CD2 4.48Å; L105-L188 HydrophobicContact CD2-CD1 4.19Å; L105-L188 HydrophobicContact CD2-CD2 4.13Å; L105-L188 HydrophobicContact CD2-CG 4.34Å; L105-L188 HydrophobicContact CG-CD2 4.26Å; L105-I204 HydrophobicContact CD1-CG2 3.46Å; L105-I204 VanDerWaalsContact CD1-CG2 3.46Å
106	V	77.2	Confident	76.5	Confident	6 Å²	6	31 Å²	31	4%	0.036	16%	0.159	C	C	.	.	H	α-helix	trans	-62.4	-38.6	173.2	170.1	0	0	0	0	111.5	T58 Q102 I103 F108 I109 I110 M118 I122	T58-V106 HydrophobicContact CG2-CB 4.34Å; T58-V106 HydrophobicContact CG2-CG1 3.58Å; Q102-V106 WeakPolarHBondContact O-CG2 3.46Å; Q102-V106 PolarHBondContact O-N 3.18Å; I103-V106 WeakPolarHBondContact O-CB 2.96Å; I103-V106 PolarHBondContact O-N 3.29Å; V106-F108 VanDerWaalsContact C-N 3.29Å; V106-F108 PolarHBondContact O-N 3.35Å; V106-I109 PolarHBondContact O-N 3.38Å; V106-I110 HydrophobicContact CG1-CD1 4.3Å; V106-I110 HydrophobicContact CG1-CG1 4.47Å; V106-I110 VanDerWaalsContact O-CG1 3.29Å; V106-I110 WeakPolarHBondContact O-CG1 3.29Å; V106-I110 PolarHBondContact O-N 3.47Å; V106-M118 HydrophobicContact CG1-CG 3.93Å; V106-M118 HydrophobicContact CG1-SD 3.71Å; V106-I122 HydrophobicContact CG1-CD1 3.84Å; V106-I122 HydrophobicContact CG1-CG1 3.9Å; V106-I122 HydrophobicContact CG2-CG1 4.07Å
107	I	71.5	Confident	76.1	Confident	8 Å²	8	30 Å²	30	4%	0.041	15%	0.149	C	C	.	.	H	α-helix	trans	-60.9	-41.5	174.3	-65.7	160.8	0	0	0	111.1	R32 L70 I103 A104 L105 I110	R32-I107 VanDerWaalsContact NH1-CG1 3.33Å; L70-I107 HydrophobicContact CB-CG2 4Å; L70-I107 HydrophobicContact CD2-CG2 4Å; I103-I107 PolarHBondContact O-N 3.22Å; A104-I107 WeakPolarHBondContact O-CB 3.44Å; A104-I107 PolarHBondContact O-N 3.18Å; L105-I107 VanDerWaalsContact C-N 3.31Å; L105-I107 PolarHBondContact O-N 2.68Å; I107-I110 PolarHBondContact O-N 3.01Å
108	F	73.5	Confident	75.7	Confident	18 Å²	18	27.9 Å²	27.9	8%	0.079	14%	0.141	C	C	.	.	H	α-helix	trans	-59.9	-45.7	174.4	176.5	-101.7	0	0	0	111.6	P71 A104 L105 V106 I110 C111 L188 L192 V197 I201	P71-F108 HydrophobicContact CB-CD2 3.66Å; P71-F108 HydrophobicContact CB-CE2 4.05Å; P71-F108 WeakPolarHBondContact O-CD2 3.25Å; A104-F108 PolarHBondContact O-N 3.28Å; A104-F108 VanDerWaalsContact O-N 3.14Å; L105-F108 WeakPolarHBondContact O-CB 3.47Å; L105-F108 PolarHBondContact O-N 2.86Å; V106-F108 VanDerWaalsContact C-N 3.29Å; V106-F108 PolarHBondContact O-N 3.35Å; F108-I110 VanDerWaalsContact C-N 3.35Å; F108-I110 PolarHBondContact O-N 3.36Å; F108-C111 WeakPolarHBondContact O-CB 3.38Å; F108-C111 PolarHBondContact O-N 3.29Å; F108-L188 HydrophobicContact CD1-CD2 3.98Å; F108-L188 HydrophobicContact CE1-CD2 3.98Å; F108-L192 HydrophobicContact CE1-CD1 3.44Å; F108-L192 VanDerWaalsContact CE1-CD1 3.44Å; F108-L192 HydrophobicContact CE2-CD1 4.46Å; F108-L192 HydrophobicContact CZ-CD1 3.32Å; F108-V197 HydrophobicContact CZ-CG1 3.86Å; F108-I201 HydrophobicContact CE1-CD1 3.92Å; F108-I201 HydrophobicContact CE1-CG1 4.1Å; F108-I201 HydrophobicContact CZ-CD1 4.24Å; F108-I201 HydrophobicContact CZ-CG1 4.4Å
109	I	74.5	Confident	75.3	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-65.1	-32.9	177.3	-63.1	162.6	0	0	0	112.5	L105 V106 C111 T112 M118 N187 L188	L105-I109 HydrophobicContact CD2-CD1 3.33Å; L105-I109 HydrophobicContact CD2-CG1 4.07Å; L105-I109 WeakPolarHBondContact O-CG1 3.39Å; L105-I109 PolarHBondContact O-N 3.04Å; V106-I109 PolarHBondContact O-N 3.38Å; I109-C111 PolarHBondContact O-N 2.89Å; I109-T112 WeakPolarHBondContact O-CB 3.36Å; I109-T112 PolarHBondContact O-N 2.8Å; I109-T112 PolarHBondContact O-OG1 3.09Å; I109-M118 HydrophobicContact CB-CG 4.48Å; I109-M118 HydrophobicContact CG2-CB 3.84Å; I109-M118 HydrophobicContact CG2-CG 3.97Å; I109-N187 HydrophobicContact CB-CB 4.35Å; I109-N187 HydrophobicContact CD1-CB 3.44Å; I109-N187 VanDerWaalsContact CD1-CB 3.44Å; I109-N187 HydrophobicContact CG1-CB 3.78Å; I109-N187 HydrophobicContact CG2-CB 3.59Å; I109-L188 HydrophobicContact CG1-CD2 4.39Å
110	I	71.1	Confident	75	Confident	20 Å²	20	33.2 Å²	33.2	10%	0.103	17%	0.169	C	C	.	.	H	α-helix	trans	-55.8	-26.6	-179.9	-72.1	165.9	0	0	0	111.6	T58 C61 I62 V106 I107 F108 T112 M118	T58-I110 HydrophobicContact CG2-CD1 4.27Å; T58-I110 WeakPolarHBondContact O-CD1 3.27Å; C61-I110 HydrophobicContact CB-CD1 3.97Å; I62-I110 HydrophobicContact CD1-CD1 4.35Å; I62-I110 HydrophobicContact CD1-CG1 4.27Å; I62-I110 HydrophobicContact CG1-CB 4.38Å; I62-I110 HydrophobicContact CG1-CD1 3.79Å; I62-I110 HydrophobicContact CG1-CG1 3.65Å; I62-I110 HydrophobicContact CG1-CG2 3.83Å; V106-I110 HydrophobicContact CG1-CD1 4.3Å; V106-I110 HydrophobicContact CG1-CG1 4.47Å; V106-I110 VanDerWaalsContact O-CG1 3.29Å; V106-I110 WeakPolarHBondContact O-CG1 3.29Å; V106-I110 PolarHBondContact O-N 3.47Å; I107-I110 PolarHBondContact O-N 3.01Å; F108-I110 VanDerWaalsContact C-N 3.35Å; F108-I110 PolarHBondContact O-N 3.36Å; I110-T112 PolarHBondContact O-N 3.36Å; I110-M118 HydrophobicContact CG1-CG 4.27Å; I110-M118 HydrophobicContact CG1-SD 4.29Å
111	C	65.8	Low	75.1	Confident	28 Å²	28	30.2 Å²	30.2	19%	0.189	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-15	177.8	-56.4	0	0	0	0	113.6	L67 P71 F108 I109 N113	L67-C111 HydrophobicContact CD2-CB 4.5Å; P71-C111 HydrophobicContact CB-CB 4.22Å; P71-C111 HydrophobicContact CG-CB 4.37Å; F108-C111 WeakPolarHBondContact O-CB 3.38Å; F108-C111 PolarHBondContact O-N 3.29Å; I109-C111 PolarHBondContact O-N 2.89Å; C111-N113 VanDerWaalsContact C-N 3.32Å; C111-N113 PolarHBondContact O-N 2.81Å
112	T	65.8	Low	74.8	Confident	22 Å²	22	30.8 Å²	30.8	14%	0.135	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	9	-172.1	72.2	0	0	0	0	113.9	I109 I110 L114 P191	I109-T112 WeakPolarHBondContact O-CB 3.36Å; I109-T112 PolarHBondContact O-N 2.8Å; I109-T112 PolarHBondContact O-OG1 3.09Å; I110-T112 PolarHBondContact O-N 3.36Å; T112-L114 PolarHBondContact O-N 3.42Å; T112-P191 HydrophobicContact CG2-CB 3.54Å; T112-P191 HydrophobicContact CG2-CG 3.15Å
113	N	68.8	Low	74.6	Confident	106 Å²	106	35.1 Å²	35.1	57%	0.567	18%	0.179	S	C	*	.	S	Bend	trans	57.2	2.5	178.5	-69.5	-24.8	0	0	0	116.5	C111 K115	C111-N113 VanDerWaalsContact C-N 3.32Å; C111-N113 PolarHBondContact O-N 2.81Å; N113-K115 VanDerWaalsContact C-N 3.33Å; N113-K115 PolarHBondContact O-N 3.13Å
114	L	74.3	Confident	74.7	Confident	41 Å²	41	35 Å²	35	22%	0.215	18%	0.179	C	C	.	.			trans	-85.6	69	175.7	-64.7	173	0	0	0	111.8	T112 E116 L117 M118 Y190	T112-L114 PolarHBondContact O-N 3.42Å; L114-E116 VanDerWaalsContact C-N 3.34Å; L114-E116 PolarHBondContact O-N 2.87Å; L114-L117 HydrophobicContact CB-CB 4.47Å; L114-L117 HydrophobicContact CB-CD1 4.23Å; L114-L117 HydrophobicContact CD1-CD1 3.99Å; L114-L117 HydrophobicContact CD2-CD1 4.27Å; L114-L117 HydrophobicContact CG-CD1 4.4Å; L114-M118 WeakPolarHBondContact O-CB 3.49Å; L114-M118 PolarHBondContact O-N 3.07Å; L114-Y190 HydrophobicContact CD1-CD1 3.69Å; L114-Y190 HydrophobicContact CD1-CG 3.95Å; L114-Y190 HydrophobicContact CD2-CD1 4.33Å; L114-Y190 HydrophobicContact CD2-CE1 4.39Å; L114-Y190 HydrophobicContact CG-CD1 4.45Å
115	K	73.5	Confident	74.8	Confident	85 Å²	85	35.6 Å²	35.6	37%	0.37	18%	0.181	S	C	.	.	H	α-helix	trans	-62.5	-36.3	-173.8	-62.7	-178.4	-180	-163	0	113.2	I62 N65 N113 M118 L119	I62-K115 HydrophobicContact CG2-CB 4.39Å; I62-K115 HydrophobicContact CG2-CD 3.4Å; I62-K115 HydrophobicContact CG2-CG 3.72Å; I62-K115 PolarHBondContact O-NZ 3.45Å; N65-K115 PolarHBondContact OD1-NZ 3.46Å; N65-K115 VanDerWaalsContact OD1-NZ 3.16Å; N113-K115 VanDerWaalsContact C-N 3.33Å; N113-K115 PolarHBondContact O-N 3.13Å; K115-M118 VanDerWaalsContact O-CE 3.23Å; K115-M118 WeakPolarHBondContact O-CE 3.3Å; K115-L119 PolarHBondContact O-N 2.74Å; K115-L119 VanDerWaalsContact O-N 3.16Å
116	E	75.8	Confident	74.8	Confident	139 Å²	139	36.1 Å²	36.1	65%	0.65	19%	0.186	S	C	*	.	H	α-helix	trans	-68.6	-50.3	-178	-63.7	-177.4	173.9	0	0	112.4	L114 M118 L119 I120	L114-E116 VanDerWaalsContact C-N 3.34Å; L114-E116 PolarHBondContact O-N 2.87Å; E116-M118 VanDerWaalsContact C-N 3.27Å; E116-M118 PolarHBondContact O-N 3.26Å; E116-L119 WeakPolarHBondContact O-CB 3.33Å; E116-L119 PolarHBondContact O-N 2.93Å; E116-L119 VanDerWaalsContact O-N 3.15Å; E116-I120 WeakPolarHBondContact O-CG1 3.03Å; E116-I120 PolarHBondContact O-N 3.2Å; E116-I120 VanDerWaalsContact O-N 3.12Å
117	L	74.1	Confident	74.9	Confident	13 Å²	13	40.3 Å²	40.3	7%	0.068	21%	0.207	C	C	.	.	H	α-helix	trans	-64.8	-33.6	-179.8	-69.6	163.6	0	0	0	112	L114 H121 Y186 N187 Y258	L114-L117 HydrophobicContact CB-CB 4.47Å; L114-L117 HydrophobicContact CB-CD1 4.23Å; L114-L117 HydrophobicContact CD1-CD1 3.99Å; L114-L117 HydrophobicContact CD2-CD1 4.27Å; L114-L117 HydrophobicContact CG-CD1 4.4Å; L117-H121 WeakPolarHBondContact O-CB 3.11Å; L117-H121 PolarHBondContact O-N 2.99Å; L117-Y186 HydrophobicContact CD1-CD1 4.2Å; L117-Y186 HydrophobicContact CD1-CG 4.44Å; L117-N187 WeakPolarHBondContact CB-OD1 3.4Å; L117-N187 PolarHBondContact O-ND2 3.08Å; L117-N187 VanDerWaalsContact O-ND2 3.13Å; L117-Y258 HydrophobicContact CD2-CD1 4.05Å; L117-Y258 HydrophobicContact CD2-CD2 4.46Å; L117-Y258 HydrophobicContact CD2-CE1 3.99Å; L117-Y258 HydrophobicContact CD2-CE2 4.4Å; L117-Y258 HydrophobicContact CD2-CG 4.29Å
118	M	77.4	Confident	75.3	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.01	21%	0.208	C	C	.	.	H	α-helix	trans	-68.6	-38.4	175.2	176.4	-71.8	-38.3	0	0	111.7	I62 V106 I109 I110 L114 K115 E116 H121 I122 N187	I62-M118 HydrophobicContact CD1-CE 2.98Å; I62-M118 HydrophobicContact CD1-SD 3.77Å; I62-M118 HydrophobicContact CG1-CE 4.01Å; V106-M118 HydrophobicContact CG1-CG 3.93Å; V106-M118 HydrophobicContact CG1-SD 3.71Å; I109-M118 HydrophobicContact CB-CG 4.48Å; I109-M118 HydrophobicContact CG2-CB 3.84Å; I109-M118 HydrophobicContact CG2-CG 3.97Å; I110-M118 HydrophobicContact CG1-CG 4.27Å; I110-M118 HydrophobicContact CG1-SD 4.29Å; L114-M118 WeakPolarHBondContact O-CB 3.49Å; L114-M118 PolarHBondContact O-N 3.07Å; K115-M118 VanDerWaalsContact O-CE 3.23Å; K115-M118 WeakPolarHBondContact O-CE 3.3Å; E116-M118 VanDerWaalsContact C-N 3.27Å; E116-M118 PolarHBondContact O-N 3.26Å; M118-H121 WeakPolarHBondContact O-CB 3.47Å; M118-H121 PolarHBondContact O-N 3.48Å; M118-I122 HydrophobicContact CE-CD1 4.41Å; M118-I122 WeakPolarHBondContact O-CG1 3.33Å; M118-I122 PolarHBondContact O-N 2.95Å; M118-I122 HydrophobicContact SD-CD1 3.26Å; M118-I122 WeakPolarHBondContact SD-CD1 3.38Å; M118-I122 HydrophobicContact SD-CG1 3.96Å; M118-N187 PolarHBondContact N-OD1 2.99Å
119	L	77.1	Confident	75.6	Confident	75 Å²	75	39.4 Å²	39.4	39%	0.393	20%	0.204	S	C	.	.	H	α-helix	trans	-65.2	-45.1	178.4	-105.8	161.9	0	0	0	110.9	K115 E116 H121 I122 I123	K115-L119 PolarHBondContact O-N 2.74Å; K115-L119 VanDerWaalsContact O-N 3.16Å; E116-L119 WeakPolarHBondContact O-CB 3.33Å; E116-L119 PolarHBondContact O-N 2.93Å; E116-L119 VanDerWaalsContact O-N 3.15Å; L119-H121 VanDerWaalsContact C-N 3.3Å; L119-H121 PolarHBondContact O-N 3.24Å; L119-I122 PolarHBondContact O-N 3.21Å; L119-I123 WeakPolarHBondContact O-CG1 3.47Å; L119-I123 PolarHBondContact O-N 3.36Å
120	I	75.9	Confident	75.9	Confident	39 Å²	39	40.6 Å²	40.6	20%	0.2	21%	0.214	C	C	.	.	H	α-helix	trans	-56.3	-46.2	172.8	-75.2	168	0	0	0	111.1	E116 I122 I123 N124 F254	E116-I120 WeakPolarHBondContact O-CG1 3.03Å; E116-I120 PolarHBondContact O-N 3.2Å; E116-I120 VanDerWaalsContact O-N 3.12Å; I120-I122 VanDerWaalsContact C-N 3.35Å; I120-I122 PolarHBondContact O-N 3.36Å; I120-I123 PolarHBondContact O-N 2.81Å; I120-N124 PolarHBondContact O-N 3.38Å; I120-N124 PolarHBondContact O-ND2 3.21Å; I120-F254 HydrophobicContact CB-CE1 4.37Å; I120-F254 HydrophobicContact CB-CZ 4.08Å; I120-F254 HydrophobicContact CD1-CE1 3.63Å; I120-F254 HydrophobicContact CD1-CZ 3.75Å; I120-F254 HydrophobicContact CG1-CE1 4.35Å; I120-F254 HydrophobicContact CG1-CZ 4.05Å; I120-F254 HydrophobicContact CG2-CE1 3.43Å; I120-F254 VanDerWaalsContact CG2-CE1 3.43Å; I120-F254 HydrophobicContact CG2-CE2 3.75Å; I120-F254 HydrophobicContact CG2-CZ 3.01Å
121	H	80.9	Confident	76.3	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.009	22%	0.217	C	C	.	.	H	α-helix	trans	-60.4	-45.9	178.7	-175.7	63.3	0	0	0	111.6	L117 M118 L119 I123 N124 H125 S183 K184 N187	L117-H121 WeakPolarHBondContact O-CB 3.11Å; L117-H121 PolarHBondContact O-N 2.99Å; M118-H121 WeakPolarHBondContact O-CB 3.47Å; M118-H121 PolarHBondContact O-N 3.48Å; L119-H121 VanDerWaalsContact C-N 3.3Å; L119-H121 PolarHBondContact O-N 3.24Å; H121-I123 VanDerWaalsContact C-N 3.32Å; H121-I123 PolarHBondContact O-N 3.05Å; H121-N124 PolarHBondContact O-N 3.39Å; H121-H125 VanDerWaalsContact O-CB 3.25Å; H121-H125 WeakPolarHBondContact O-CB 3.49Å; H121-H125 PolarHBondContact O-N 3.28Å; H121-S183 PolarHBondContact ND1-OG 2.83Å; H121-K184 VanDerWaalsContact CE1-CG 3.47Å; H121-K184 WeakPolarHBondContact CE1-CG 3.37Å; H121-N187 WeakPolarHBondContact CB-ND2 3.17Å
122	I	78.9	Confident	77.1	Confident	11 Å²	11	39.8 Å²	39.8	6%	0.056	21%	0.208	C	C	.	.	H	α-helix	trans	-57.1	-47.4	176.5	-70.6	172.1	0	0	0	110.7	V55 T58 V106 M118 L119 I120 H125 A126	V55-I122 HydrophobicContact CB-CG2 4.13Å; V55-I122 HydrophobicContact CG1-CG2 3.76Å; V55-I122 HydrophobicContact CG2-CG2 3.37Å; T58-I122 WeakPolarHBondContact OG1-CD1 3.45Å; V106-I122 HydrophobicContact CG1-CD1 3.84Å; V106-I122 HydrophobicContact CG1-CG1 3.9Å; V106-I122 HydrophobicContact CG2-CG1 4.07Å; M118-I122 HydrophobicContact CE-CD1 4.41Å; M118-I122 WeakPolarHBondContact O-CG1 3.33Å; M118-I122 PolarHBondContact O-N 2.95Å; M118-I122 HydrophobicContact SD-CD1 3.26Å; M118-I122 WeakPolarHBondContact SD-CD1 3.38Å; M118-I122 HydrophobicContact SD-CG1 3.96Å; L119-I122 PolarHBondContact O-N 3.21Å; I120-I122 VanDerWaalsContact C-N 3.35Å; I120-I122 PolarHBondContact O-N 3.36Å; I122-H125 PolarHBondContact O-N 3.36Å; I122-A126 WeakPolarHBondContact O-CB 3.47Å; I122-A126 PolarHBondContact O-N 3.16Å
123	I	79.1	Confident	77.9	Confident	92 Å²	92	39.2 Å²	39.2	47%	0.472	20%	0.204	S	C	.	.	H	α-helix	trans	-62.6	-49.3	-177.6	-67.4	164.9	0	0	0	110.4	L119 I120 H121 H125 A126 L127	L119-I123 WeakPolarHBondContact O-CG1 3.47Å; L119-I123 PolarHBondContact O-N 3.36Å; I120-I123 PolarHBondContact O-N 2.81Å; H121-I123 VanDerWaalsContact C-N 3.32Å; H121-I123 PolarHBondContact O-N 3.05Å; I123-H125 VanDerWaalsContact C-N 3.34Å; I123-H125 PolarHBondContact O-N 3.23Å; I123-A126 PolarHBondContact O-N 3.44Å; I123-L127 HydrophobicContact CG2-CD1 3.97Å; I123-L127 WeakPolarHBondContact O-CG 3.41Å; I123-L127 PolarHBondContact O-N 2.91Å
124	N	77.7	Confident	78.4	Confident	18 Å²	18	38 Å²	38	10%	0.096	20%	0.197	C	C	.	.	H	α-helix	trans	-59.7	-44.7	178.5	-75.3	-28	0	0	0	111.7	I120 H121 A128	I120-N124 PolarHBondContact O-N 3.38Å; I120-N124 PolarHBondContact O-ND2 3.21Å; H121-N124 PolarHBondContact O-N 3.39Å; N124-A128 WeakPolarHBondContact O-CB 3.18Å; N124-A128 PolarHBondContact O-N 3.05Å; N124-A128 VanDerWaalsContact O-N 3.09Å
125	H	79.4	Confident	78.6	Confident	18 Å²	18	37 Å²	37	8%	0.083	19%	0.19	C	C	.	.	H	α-helix	trans	-65.8	-42.9	177.8	177.5	-98	0	0	0	112.2	Q102 H121 I122 I123 A128 K129	Q102-H125 VanDerWaalsContact CB-NE2 3.33Å; Q102-H125 WeakPolarHBondContact CB-NE2 3.47Å; Q102-H125 VanDerWaalsContact CG-NE2 3.3Å; Q102-H125 WeakPolarHBondContact CG-NE2 3.4Å; H121-H125 VanDerWaalsContact O-CB 3.25Å; H121-H125 WeakPolarHBondContact O-CB 3.49Å; H121-H125 PolarHBondContact O-N 3.28Å; I122-H125 PolarHBondContact O-N 3.36Å; I123-H125 VanDerWaalsContact C-N 3.34Å; I123-H125 PolarHBondContact O-N 3.23Å; H125-A128 PolarHBondContact O-N 3.34Å; H125-K129 VanDerWaalsContact CE1-CG 3.48Å; H125-K129 WeakPolarHBondContact CE1-CG 3.38Å; H125-K129 WeakPolarHBondContact NE2-CE 3.26Å; H125-K129 VanDerWaalsContact NE2-CG 3.33Å; H125-K129 WeakPolarHBondContact NE2-CG 3.23Å; H125-K129 VanDerWaalsContact O-CB 3.29Å; H125-K129 WeakPolarHBondContact O-CB 3.38Å; H125-K129 WeakPolarHBondContact O-CG 3.19Å; H125-K129 PolarHBondContact O-N 3.39Å
126	A	79.5	Confident	79	Confident	15 Å²	15	33.1 Å²	33.1	12%	0.124	17%	0.173	C	C	.	.	H	α-helix	trans	-62.9	-43.1	179.8	0	0	0	0	0	111.6	S50 I122 I123 A130	S50-A126 WeakPolarHBondContact O-CB 3.29Å; I122-A126 WeakPolarHBondContact O-CB 3.47Å; I122-A126 PolarHBondContact O-N 3.16Å; I123-A126 PolarHBondContact O-N 3.44Å; A126-A130 VanDerWaalsContact O-CB 3.25Å; A126-A130 WeakPolarHBondContact O-CB 3.13Å; A126-A130 PolarHBondContact O-N 3.02Å
127	L	78.4	Confident	79.2	Confident	94 Å²	94	26.6 Å²	26.6	49%	0.492	14%	0.144	S	C	.	.	H	α-helix	trans	-62.7	-52.7	176.1	-73.2	168.5	0	0	0	111.4	I123 K129 A130 L131	I123-L127 HydrophobicContact CG2-CD1 3.97Å; I123-L127 WeakPolarHBondContact O-CG 3.41Å; I123-L127 PolarHBondContact O-N 2.91Å; L127-K129 VanDerWaalsContact C-N 3.32Å; L127-K129 PolarHBondContact O-N 3.25Å; L127-A130 PolarHBondContact O-N 3.27Å; L127-L131 WeakPolarHBondContact O-CD1 3.35Å; L127-L131 PolarHBondContact O-N 3.16Å
128	A	78.8	Confident	79.2	Confident	6 Å²	6	28.4 Å²	28.4	5%	0.05	16%	0.155	C	C	.	.	H	α-helix	trans	-62.5	-39.3	-178.9	0	0	0	0	0	112.1	N124 H125 L132 I171 I172	N124-A128 WeakPolarHBondContact O-CB 3.18Å; N124-A128 PolarHBondContact O-N 3.05Å; N124-A128 VanDerWaalsContact O-N 3.09Å; H125-A128 PolarHBondContact O-N 3.34Å; A128-L132 VanDerWaalsContact O-CB 3.3Å; A128-L132 WeakPolarHBondContact O-CB 3.34Å; A128-L132 PolarHBondContact O-N 3.28Å; A128-L132 VanDerWaalsContact O-N 3.12Å; A128-I171 HydrophobicContact CB-CG2 4.22Å; A128-I172 HydrophobicContact CB-CD1 4.1Å; A128-I172 HydrophobicContact CB-CG1 3.67Å
129	K	81.6	Confident	79.3	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-68.9	-42.9	175.5	-76.1	-68.2	-176.1	-166.2	0	112.9	S98 T99 H125 L127 L131 L132 F133 I172	S98-K129 PolarHBondContact OG-NZ 3.24Å; T99-K129 HydrophobicContact CG2-CB 4.42Å; T99-K129 HydrophobicContact CG2-CD 3.75Å; T99-K129 HydrophobicContact CG2-CG 3.96Å; H125-K129 VanDerWaalsContact CE1-CG 3.48Å; H125-K129 WeakPolarHBondContact CE1-CG 3.38Å; H125-K129 WeakPolarHBondContact NE2-CE 3.26Å; H125-K129 VanDerWaalsContact NE2-CG 3.33Å; H125-K129 WeakPolarHBondContact NE2-CG 3.23Å; H125-K129 VanDerWaalsContact O-CB 3.29Å; H125-K129 WeakPolarHBondContact O-CB 3.38Å; H125-K129 WeakPolarHBondContact O-CG 3.19Å; H125-K129 PolarHBondContact O-N 3.39Å; L127-K129 VanDerWaalsContact C-N 3.32Å; L127-K129 PolarHBondContact O-N 3.25Å; K129-L131 VanDerWaalsContact C-N 3.29Å; K129-L131 PolarHBondContact O-N 3.01Å; K129-L132 PolarHBondContact O-N 3.36Å; K129-F133 HydrophobicContact CB-CD2 4.49Å; K129-F133 VanDerWaalsContact O-CD2 3.27Å; K129-F133 WeakPolarHBondContact O-CD2 3.48Å; K129-F133 PolarHBondContact O-N 3.1Å; K129-I172 HydrophobicContact CD-CD1 3.8Å; K129-I172 HydrophobicContact CG-CD1 4.22Å
130	A	79.2	Confident	79.4	Confident	27 Å²	27	25.3 Å²	25.3	22%	0.223	14%	0.138	C	C	.	.	H	α-helix	trans	-56.7	-47	179.5	0	0	0	0	0	110.9	A126 L127 F133 I134	A126-A130 VanDerWaalsContact O-CB 3.25Å; A126-A130 WeakPolarHBondContact O-CB 3.13Å; A126-A130 PolarHBondContact O-N 3.02Å; L127-A130 PolarHBondContact O-N 3.27Å; A130-F133 PolarHBondContact O-N 2.87Å; A130-I134 WeakPolarHBondContact O-CD1 3.35Å; A130-I134 VanDerWaalsContact O-CG1 3.26Å; A130-I134 WeakPolarHBondContact O-CG1 3.38Å; A130-I134 PolarHBondContact O-N 3.42Å
131	L	79.3	Confident	79.3	Confident	30 Å²	30	28.9 Å²	28.9	16%	0.157	16%	0.157	C	C	.	.	H	α-helix	trans	-60.9	-47.9	175.6	-75.5	148.8	0	0	0	112.3	L127 K129 F133 I134 R135 F243	L127-L131 WeakPolarHBondContact O-CD1 3.35Å; L127-L131 PolarHBondContact O-N 3.16Å; K129-L131 VanDerWaalsContact C-N 3.29Å; K129-L131 PolarHBondContact O-N 3.01Å; L131-F133 VanDerWaalsContact C-N 3.31Å; L131-F133 PolarHBondContact O-N 2.99Å; L131-I134 PolarHBondContact O-N 3.15Å; L131-I134 VanDerWaalsContact O-N 3.11Å; L131-R135 WeakPolarHBondContact O-CG 2.98Å; L131-R135 PolarHBondContact O-N 3.34Å; L131-F243 HydrophobicContact CD1-CD1 3.6Å; L131-F243 HydrophobicContact CD1-CD2 3.92Å; L131-F243 HydrophobicContact CD1-CE1 3.16Å; L131-F243 HydrophobicContact CD1-CE2 3.51Å; L131-F243 HydrophobicContact CD1-CG 3.97Å; L131-F243 HydrophobicContact CD1-CZ 3.14Å; L131-F243 HydrophobicContact CD2-CD2 4.11Å; L131-F243 HydrophobicContact CD2-CE2 3.76Å; L131-F243 HydrophobicContact CD2-CZ 4.21Å; L131-F243 HydrophobicContact CG-CE2 4.24Å; L131-F243 HydrophobicContact CG-CZ 4.2Å
132	L	83.5	Confident	78.9	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61.7	-40.7	-177.9	-173.4	144.5	0	0	0	111.8	L95 A128 K129 R135 I136 C168 L169 I172	L95-L132 HydrophobicContact CD1-CD2 3.78Å; L95-L132 HydrophobicContact CD2-CD2 3.19Å; L95-L132 HydrophobicContact CG-CD2 4.02Å; A128-L132 VanDerWaalsContact O-CB 3.3Å; A128-L132 WeakPolarHBondContact O-CB 3.34Å; A128-L132 PolarHBondContact O-N 3.28Å; A128-L132 VanDerWaalsContact O-N 3.12Å; K129-L132 PolarHBondContact O-N 3.36Å; L132-R135 PolarHBondContact O-N 2.79Å; L132-I136 HydrophobicContact CD2-CD1 3.66Å; L132-I136 HydrophobicContact CG-CD1 4.09Å; L132-I136 WeakPolarHBondContact O-CB 3.33Å; L132-I136 WeakPolarHBondContact O-CG1 3.2Å; L132-I136 PolarHBondContact O-N 2.86Å; L132-C168 HydrophobicContact CB-CB 3.97Å; L132-C168 HydrophobicContact CD1-CB 3.84Å; L132-C168 HydrophobicContact CG-CB 4.36Å; L132-L169 HydrophobicContact CD1-CD2 3.66Å; L132-L169 HydrophobicContact CD1-CG 3.64Å; L132-I172 HydrophobicContact CD1-CD1 3.91Å
133	F	82.9	Confident	78.6	Confident	10 Å²	10	31.6 Å²	31.6	4%	0.044	17%	0.169	C	C	.	.	H	α-helix	trans	-65.7	-39	172.9	-87.5	-79	0	0	0	112.9	S46 L95 T99 K129 A130 L131 G137	S46-F133 VanDerWaalsContact CB-CB 3.41Å; L95-F133 HydrophobicContact CB-CD1 4.14Å; L95-F133 HydrophobicContact CB-CE1 3.41Å; L95-F133 VanDerWaalsContact CB-CE1 3.41Å; L95-F133 HydrophobicContact CB-CE2 4.1Å; L95-F133 HydrophobicContact CB-CZ 3.39Å; L95-F133 HydrophobicContact CD1-CD1 3.6Å; L95-F133 HydrophobicContact CD1-CE1 3.75Å; L95-F133 HydrophobicContact CD1-CG 4.09Å; L95-F133 HydrophobicContact CD1-CZ 4.33Å; L95-F133 HydrophobicContact CG-CE1 4.26Å; T99-F133 HydrophobicContact CG2-CE2 3.67Å; T99-F133 HydrophobicContact CG2-CZ 4.23Å; K129-F133 HydrophobicContact CB-CD2 4.49Å; K129-F133 VanDerWaalsContact O-CD2 3.27Å; K129-F133 WeakPolarHBondContact O-CD2 3.48Å; K129-F133 PolarHBondContact O-N 3.1Å; A130-F133 PolarHBondContact O-N 2.87Å; L131-F133 VanDerWaalsContact C-N 3.31Å; L131-F133 PolarHBondContact O-N 2.99Å; F133-G137 WeakPolarHBondContact O-CA 3.25Å; F133-G137 PolarHBondContact O-N 3.3Å
134	I	79.7	Confident	78.4	Confident	81 Å²	81	35.9 Å²	35.9	42%	0.415	18%	0.184	S	C	.	.	H	α-helix	trans	-65	-46.1	177.1	-69.7	163.5	0	0	0	110	A130 L131 G137 V138	A130-I134 WeakPolarHBondContact O-CD1 3.35Å; A130-I134 VanDerWaalsContact O-CG1 3.26Å; A130-I134 WeakPolarHBondContact O-CG1 3.38Å; A130-I134 PolarHBondContact O-N 3.42Å; L131-I134 PolarHBondContact O-N 3.15Å; L131-I134 VanDerWaalsContact O-N 3.11Å; I134-G137 WeakPolarHBondContact O-CA 3.47Å; I134-G137 PolarHBondContact O-N 3.48Å; I134-G137 VanDerWaalsContact O-N 3.12Å; I134-V138 WeakPolarHBondContact O-CG2 3.42Å; I134-V138 PolarHBondContact O-N 3.44Å
135	R	78.6	Confident	78.3	Confident	20 Å²	20	36.9 Å²	36.9	8%	0.075	20%	0.199	C	C	.	.	H	α-helix	trans	-63.5	-47.1	-179.7	-66.1	-62.4	175.1	-164.4	-0.3	112	L131 L132 G137 V138 F139 M161 S236 N240	L131-R135 WeakPolarHBondContact O-CG 2.98Å; L131-R135 PolarHBondContact O-N 3.34Å; L132-R135 PolarHBondContact O-N 2.79Å; R135-G137 PolarHBondContact O-N 3.32Å; R135-V138 PolarHBondContact O-N 2.92Å; R135-F139 WeakPolarHBondContact O-CB 3.38Å; R135-F139 PolarHBondContact O-N 2.94Å; R135-M161 WeakPolarHBondContact O-CE 3.43Å; R135-S236 PolarHBondContact NH1-OG 3.04Å; R135-N240 VanDerWaalsContact CZ-CG 3.47Å; R135-N240 PolarHBondContact NE-OD1 3.03Å; R135-N240 PolarHBondContact NH2-OD1 3.2Å
136	I	81.1	Confident	78.2	Confident	3 Å²	3	39.9 Å²	39.9	2%	0.015	22%	0.216	C	C	.	.	H	α-helix	trans	-66.9	-30.6	174.5	-69.7	169.9	0	0	0	110.9	L91 L95 L132 F139 I140 L215	L91-I136 HydrophobicContact CB-CG2 4.21Å; L91-I136 HydrophobicContact CD1-CG2 4.21Å; L95-I136 HydrophobicContact CD1-CB 4Å; L95-I136 HydrophobicContact CD1-CD1 3.57Å; L95-I136 HydrophobicContact CD1-CG1 4.36Å; L95-I136 HydrophobicContact CD1-CG2 3.94Å; L95-I136 HydrophobicContact CD2-CD1 3.75Å; L95-I136 HydrophobicContact CG-CD1 4.07Å; L132-I136 HydrophobicContact CD2-CD1 3.66Å; L132-I136 HydrophobicContact CG-CD1 4.09Å; L132-I136 WeakPolarHBondContact O-CB 3.33Å; L132-I136 WeakPolarHBondContact O-CG1 3.2Å; L132-I136 PolarHBondContact O-N 2.86Å; I136-F139 WeakPolarHBondContact O-CB 3.29Å; I136-F139 PolarHBondContact O-N 3.05Å; I136-I140 HydrophobicContact CG2-CD1 3.81Å; I136-I140 HydrophobicContact CG2-CG1 4.33Å; I136-I140 WeakPolarHBondContact O-CD1 3.26Å; I136-I140 WeakPolarHBondContact O-CG1 3.33Å; I136-I140 PolarHBondContact O-N 2.83Å; I136-L215 HydrophobicContact CD1-CD2 4.47Å
137	G	79.3	Confident	78.4	Confident	3 Å²	3	42 Å²	42	3%	0.031	22%	0.224	C	C	.	.	H	α-helix	trans	-64.4	-48.7	175.4	0	0	0	0	0	112.9	F133 I134 R135 F139 I140 I141	F133-G137 WeakPolarHBondContact O-CA 3.25Å; F133-G137 PolarHBondContact O-N 3.3Å; I134-G137 WeakPolarHBondContact O-CA 3.47Å; I134-G137 PolarHBondContact O-N 3.48Å; I134-G137 VanDerWaalsContact O-N 3.12Å; R135-G137 PolarHBondContact O-N 3.32Å; G137-F139 VanDerWaalsContact C-N 3.25Å; G137-F139 PolarHBondContact O-N 2.94Å; G137-I140 PolarHBondContact O-N 3.32Å; G137-I141 WeakPolarHBondContact O-CG1 3.37Å; G137-I141 PolarHBondContact O-N 3.32Å
138	V	75.6	Confident	78.7	Confident	51 Å²	51	39.1 Å²	39.1	31%	0.309	21%	0.208	S	C	.	.	H	α-helix	trans	-63	-38.2	174.4	-179	0	0	0	0	109.9	I134 R135 I140 I141 F142 M161	I134-V138 WeakPolarHBondContact O-CG2 3.42Å; I134-V138 PolarHBondContact O-N 3.44Å; R135-V138 PolarHBondContact O-N 2.92Å; V138-I140 PolarHBondContact O-N 3.03Å; V138-I141 WeakPolarHBondContact O-CB 3.43Å; V138-I141 PolarHBondContact O-N 2.66Å; V138-I141 VanDerWaalsContact O-N 3.15Å; V138-F142 HydrophobicContact CG1-CD2 3.8Å; V138-F142 HydrophobicContact CG1-CE2 3.49Å; V138-F142 VanDerWaalsContact CG1-CE2 3.49Å; V138-F142 WeakPolarHBondContact O-CD2 3.31Å; V138-F142 PolarHBondContact O-N 3.27Å; V138-M161 HydrophobicContact CB-CE 3.45Å; V138-M161 VanDerWaalsContact CB-CE 3.45Å; V138-M161 HydrophobicContact CB-SD 4.3Å; V138-M161 HydrophobicContact CG1-CE 3.39Å; V138-M161 HydrophobicContact CG1-SD 3.68Å
139	F	77.8	Confident	78.8	Confident	4 Å²	4	39 Å²	39	2%	0.018	21%	0.207	C	C	.	.	H	α-helix	trans	-60.8	-44.7	177.1	-179.8	-98.5	0	0	0	112.5	L91 R135 I136 G137 I141 F142 M143 L152 T154 M161 L162 L219	L91-F139 HydrophobicContact CD1-CD1 4.09Å; L91-F139 HydrophobicContact CD1-CE1 4Å; R135-F139 WeakPolarHBondContact O-CB 3.38Å; R135-F139 PolarHBondContact O-N 2.94Å; I136-F139 WeakPolarHBondContact O-CB 3.29Å; I136-F139 PolarHBondContact O-N 3.05Å; G137-F139 VanDerWaalsContact C-N 3.25Å; G137-F139 PolarHBondContact O-N 2.94Å; F139-I141 VanDerWaalsContact C-N 3.27Å; F139-I141 PolarHBondContact O-N 3.34Å; F139-F142 PolarHBondContact O-N 2.95Å; F139-M143 HydrophobicContact CD1-CG 4.41Å; F139-M143 HydrophobicContact CE1-CG 4.14Å; F139-M143 HydrophobicContact CZ-CG 4.37Å; F139-M143 WeakPolarHBondContact O-CG 3.21Å; F139-M143 PolarHBondContact O-N 2.95Å; F139-L152 HydrophobicContact CD1-CD2 4.5Å; F139-L152 HydrophobicContact CE1-CD1 3.84Å; F139-L152 HydrophobicContact CE1-CD2 3.56Å; F139-L152 HydrophobicContact CE1-CG 4.16Å; F139-L152 HydrophobicContact CZ-CB 4.49Å; F139-L152 HydrophobicContact CZ-CD1 4.32Å; F139-L152 HydrophobicContact CZ-CD2 4.24Å; F139-T154 HydrophobicContact CD2-CG2 4.42Å; F139-T154 HydrophobicContact CE1-CG2 4.48Å; F139-T154 HydrophobicContact CE2-CG2 3.11Å; F139-T154 HydrophobicContact CZ-CG2 3.14Å; F139-M161 HydrophobicContact CB-CE 3.93Å; F139-M161 VanDerWaalsContact N-CE 3.25Å; F139-L162 HydrophobicContact CD2-CD2 4.07Å; F139-L162 HydrophobicContact CE2-CD2 3.61Å; F139-L162 HydrophobicContact CE2-CG 4.22Å; F139-L162 HydrophobicContact CZ-CD2 4.13Å; F139-L219 HydrophobicContact CE1-CD2 4.37Å
140	I	79.5	Confident	78.8	Confident	7 Å²	7	45.7 Å²	45.7	4%	0.036	23%	0.233	C	C	.	.	H	α-helix	trans	-62.7	-35.2	175.7	-69	161.5	0	0	0	111.3	T42 K92 I136 G137 V138 M143 F144 G145 Q147	T42-I140 HydrophobicContact CG2-CD1 4.42Å; K92-I140 HydrophobicContact CD-CD1 4.31Å; K92-I140 HydrophobicContact CG-CD1 3.69Å; I136-I140 HydrophobicContact CG2-CD1 3.81Å; I136-I140 HydrophobicContact CG2-CG1 4.33Å; I136-I140 WeakPolarHBondContact O-CD1 3.26Å; I136-I140 WeakPolarHBondContact O-CG1 3.33Å; I136-I140 PolarHBondContact O-N 2.83Å; G137-I140 PolarHBondContact O-N 3.32Å; V138-I140 PolarHBondContact O-N 3.03Å; I140-M143 CarbonylContact O-C 3.48Å; I140-M143 PolarHBondContact O-N 3.41Å; I140-F144 PolarHBondContact O-N 3.25Å; I140-G145 WeakPolarHBondContact O-CA 3.42Å; I140-G145 PolarHBondContact O-N 3.17Å; I140-Q147 HydrophobicContact CD1-CG 4.31Å; I140-Q147 HydrophobicContact CG2-CG 3.9Å
141	I	75.2	Confident	78.6	Confident	115 Å²	115	49.2 Å²	49.2	59%	0.59	25%	0.247	S	C	*	.	H	α-helix	trans	-64.5	-44.2	175.8	-66.3	166.3	0	0	0	110.4	G137 V138 F139 M143 F144	G137-I141 WeakPolarHBondContact O-CG1 3.37Å; G137-I141 PolarHBondContact O-N 3.32Å; V138-I141 WeakPolarHBondContact O-CB 3.43Å; V138-I141 PolarHBondContact O-N 2.66Å; V138-I141 VanDerWaalsContact O-N 3.15Å; F139-I141 VanDerWaalsContact C-N 3.27Å; F139-I141 PolarHBondContact O-N 3.34Å; I141-M143 PolarHBondContact O-N 2.83Å; I141-F144 PolarHBondContact O-N 3.03Å
142	F	72.3	Confident	78.3	Confident	48 Å²	48	47.9 Å²	47.9	21%	0.211	24%	0.24	C	C	.	.	H	α-helix	trans	-63.6	-29	175.2	-78.5	-67.8	0	0	0	113.1	V138 F139 F144 L158 M161 Y234	V138-F142 HydrophobicContact CG1-CD2 3.8Å; V138-F142 HydrophobicContact CG1-CE2 3.49Å; V138-F142 VanDerWaalsContact CG1-CE2 3.49Å; V138-F142 WeakPolarHBondContact O-CD2 3.31Å; V138-F142 PolarHBondContact O-N 3.27Å; F139-F142 PolarHBondContact O-N 2.95Å; F142-F144 PolarHBondContact O-N 3.43Å; F142-L158 HydrophobicContact CB-CD1 4.13Å; F142-L158 HydrophobicContact CB-CD2 3.79Å; F142-L158 HydrophobicContact CD1-CD2 4.28Å; F142-L158 HydrophobicContact CD2-CD2 3.3Å; F142-L158 HydrophobicContact CE2-CD2 3.83Å; F142-L158 HydrophobicContact CG-CD2 3.56Å; F142-M161 HydrophobicContact CD2-CE 4.12Å; F142-M161 HydrophobicContact CD2-SD 4.15Å; F142-M161 HydrophobicContact CE2-CE 4.27Å; F142-M161 HydrophobicContact CE2-SD 3.75Å; F142-Y234 HydrophobicContact CZ-CD2 4.35Å
143	M	72.7	Confident	77.6	Confident	22 Å²	22	49.3 Å²	49.3	11%	0.108	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	18.3	173.1	-65.1	-56.1	-52.6	0	0	113.6	F139 I140 I141 G145 N146 L152 C153	F139-M143 HydrophobicContact CD1-CG 4.41Å; F139-M143 HydrophobicContact CE1-CG 4.14Å; F139-M143 HydrophobicContact CZ-CG 4.37Å; F139-M143 WeakPolarHBondContact O-CG 3.21Å; F139-M143 PolarHBondContact O-N 2.95Å; I140-M143 CarbonylContact O-C 3.48Å; I140-M143 PolarHBondContact O-N 3.41Å; I141-M143 PolarHBondContact O-N 2.83Å; M143-G145 PolarHBondContact O-N 3.45Å; M143-G145 VanDerWaalsContact O-N 3.14Å; M143-N146 HydrophobicContact CB-CB 4.25Å; M143-N146 WeakPolarHBondContact O-CB 3.49Å; M143-N146 PolarHBondContact O-N 3.02Å; M143-L152 HydrophobicContact CG-CD2 4.03Å; M143-C153 HydrophobicContact CE-CB 4.26Å; M143-C153 VanDerWaalsContact CE-N 3.34Å; M143-C153 WeakPolarHBondContact CE-O 3.35Å
144	F	75	Confident	76.7	Confident	181 Å²	181	48.8 Å²	48.8	79%	0.794	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.4	32.7	-178.5	-61.8	-79.3	0	0	0	113.9	I140 I141 F142	I140-F144 PolarHBondContact O-N 3.25Å; I141-F144 PolarHBondContact O-N 3.03Å; F142-F144 PolarHBondContact O-N 3.43Å
145	G	74.5	Confident	75.9	Confident	40 Å²	40	45.6 Å²	45.6	41%	0.412	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.2	0.9	179.3	0	0	0	0	0	115.1	I140 M143 Q147	I140-G145 WeakPolarHBondContact O-CA 3.42Å; I140-G145 PolarHBondContact O-N 3.17Å; M143-G145 PolarHBondContact O-N 3.45Å; M143-G145 VanDerWaalsContact O-N 3.14Å; G145-Q147 PolarHBondContact O-N 3.35Å
146	N	77.1	Confident	75.1	Confident	81 Å²	81	52 Å²	52	43%	0.433	26%	0.262	S	S	.	.			trans	-67.2	120.8	173.6	-77.5	-16.4	0	0	0	110.8	M143	M143-N146 HydrophobicContact CB-CB 4.25Å; M143-N146 WeakPolarHBondContact O-CB 3.49Å; M143-N146 PolarHBondContact O-N 3.02Å
147	Q	84.1	Confident	74.3	Confident	60 Å²	60	53.9 Å²	53.9	28%	0.28	28%	0.275	S	S	.	.			trans	-106.4	-15.9	-177.3	-63.3	177	30.8	0	0	113.3	L91 I140 G145 S149	L91-Q147 PolarHBondContact N-O 3.05Å; I140-Q147 HydrophobicContact CD1-CG 4.31Å; I140-Q147 HydrophobicContact CG2-CG 3.9Å; G145-Q147 PolarHBondContact O-N 3.35Å; Q147-S149 PolarHBondContact O-N 2.69Å
148	D	84.2	Confident	73.9	Confident	32 Å²	32	54 Å²	54	17%	0.171	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-72.4	120.3	-177.9	-167.4	-18.3	0	0	0	109.6	R150 L151	D148-R150 PolarHBondContact O-N 3.07Å; D148-R150 VanDerWaalsContact O-N 3.08Å; D148-R150 IonicContact OD1-CZ 3.88Å; D148-R150 PolarHBondContact OD1-N 3.32Å; D148-R150 IonicContact OD1-NE 3.07Å; D148-R150 PolarHBondContact OD1-NE 3.08Å; D148-R150 VanDerWaalsContact OD1-NE 3.07Å; D148-R150 IonicContact OD1-NH2 3.8Å; D148-R150 IonicContact OD2-CZ 3.39Å; D148-R150 IonicContact OD2-NE 3.28Å; D148-R150 PolarHBondContact OD2-NE 2.69Å; D148-R150 IonicContact OD2-NH2 2.69Å; D148-R150 PolarHBondContact OD2-NH2 2.95Å; D148-L151 HydrophobicContact CB-CD1 4.36Å; D148-L151 PolarHBondContact O-N 3.37Å; D148-L151 VanDerWaalsContact O-N 3.16Å
149	S	82.2	Confident	73.6	Confident	4 Å²	4	55.1 Å²	55.1	3%	0.028	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-59.2	-23.3	-176.1	54.5	0	0	0	0	114.1	K89 Q147 L152	K89-S149 WeakPolarHBondContact O-CB 3.21Å; K89-S149 PolarHBondContact O-N 3.17Å; K89-S149 PolarHBondContact O-OG 3.28Å; Q147-S149 PolarHBondContact O-N 2.69Å; S149-L152 WeakPolarHBondContact O-CG 3.4Å
150	R	80.1	Confident	73.2	Confident	141 Å²	141	56.4 Å²	56.4	53%	0.532	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-77.7	-25.8	-177.8	-58.9	174.7	-67.3	171.1	0.6	113.5	D148	D148-R150 PolarHBondContact O-N 3.07Å; D148-R150 VanDerWaalsContact O-N 3.08Å; D148-R150 IonicContact OD1-CZ 3.88Å; D148-R150 PolarHBondContact OD1-N 3.32Å; D148-R150 IonicContact OD1-NE 3.07Å; D148-R150 PolarHBondContact OD1-NE 3.08Å; D148-R150 VanDerWaalsContact OD1-NE 3.07Å; D148-R150 IonicContact OD1-NH2 3.8Å; D148-R150 IonicContact OD2-CZ 3.39Å; D148-R150 IonicContact OD2-NE 3.28Å; D148-R150 PolarHBondContact OD2-NE 2.69Å; D148-R150 IonicContact OD2-NH2 2.69Å; D148-R150 PolarHBondContact OD2-NH2 2.95Å
151	L	75.8	Confident	72.9	Confident	101 Å²	101	56.9 Å²	56.9	53%	0.529	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-99.9	9.6	-175.7	-61	176.7	0	0	0	112.1	D148 C153	D148-L151 HydrophobicContact CB-CD1 4.36Å; D148-L151 PolarHBondContact O-N 3.37Å; D148-L151 VanDerWaalsContact O-N 3.16Å; L151-C153 PolarHBondContact O-N 3.47Å
152	L	73.8	Confident	73	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.005	26%	0.263	C	S	.	.			trans	-73.1	127	178.8	-61.6	175.3	0	0	0	109.3	L91 F139 M143 S149 S222	L91-L152 HydrophobicContact CD1-CD1 3.6Å; L91-L152 HydrophobicContact CD1-CD2 4.14Å; L91-L152 HydrophobicContact CD1-CG 4.44Å; L91-L152 HydrophobicContact CD2-CD1 4.2Å; L91-L152 HydrophobicContact CG-CD1 4.06Å; F139-L152 HydrophobicContact CD1-CD2 4.5Å; F139-L152 HydrophobicContact CE1-CD1 3.84Å; F139-L152 HydrophobicContact CE1-CD2 3.56Å; F139-L152 HydrophobicContact CE1-CG 4.16Å; F139-L152 HydrophobicContact CZ-CB 4.49Å; F139-L152 HydrophobicContact CZ-CD1 4.32Å; F139-L152 HydrophobicContact CZ-CD2 4.24Å; M143-L152 HydrophobicContact CG-CD2 4.03Å; S149-L152 WeakPolarHBondContact O-CG 3.4Å; L152-S222 VanDerWaalsContact O-CA 3.31Å; L152-S222 WeakPolarHBondContact O-CA 3.34Å; L152-S222 VanDerWaalsContact O-CB 3.28Å; L152-S222 WeakPolarHBondContact O-CB 3.38Å
153	C	67.3	Low	73.2	Confident	30 Å²	30	52 Å²	52	20%	0.203	27%	0.27	C	S	.	.			trans	-130.6	112.5	176	-69.1	0	0	0	0	106.5	M143 L151 S222 N225	M143-C153 HydrophobicContact CE-CB 4.26Å; M143-C153 VanDerWaalsContact CE-N 3.34Å; M143-C153 WeakPolarHBondContact CE-O 3.35Å; L151-C153 PolarHBondContact O-N 3.47Å; C153-S222 CarbonylContact C-O 3.58Å; C153-S222 WeakPolarHBondContact CA-O 3.43Å; C153-N225 HydrophobicContact CB-CB 4.03Å; C153-N225 VanDerWaalsContact CB-O 3.23Å; C153-N225 WeakPolarHBondContact CB-O 3.37Å; C153-N225 WeakPolarHBondContact SG-CB 3.38Å
154	T	64.9	Low	73.4	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.267	C	S	.	.			trans	-117	145	-172.1	60	0	0	0	0	111.1	F139 L162 S222 F223	F139-T154 HydrophobicContact CD2-CG2 4.42Å; F139-T154 HydrophobicContact CE1-CG2 4.48Å; F139-T154 HydrophobicContact CE2-CG2 3.11Å; F139-T154 HydrophobicContact CZ-CG2 3.14Å; T154-L162 HydrophobicContact CG2-CD1 4.23Å; T154-S222 WeakPolarHBondContact CG2-OG 3.49Å; T154-S222 PolarHBondContact N-O 3.16Å; T154-S222 VanDerWaalsContact OG1-C 3.25Å; T154-S222 PolarHBondContact OG1-O 3Å; T154-S222 PolarHBondContact OG1-OG 3.46Å; T154-F223 WeakPolarHBondContact OG1-CA 3.39Å; T154-F223 WeakPolarHBondContact OG1-CD2 3.38Å; T154-F223 PolarHBondContact OG1-N 2.87Å; T154-F223 VanDerWaalsContact OG1-N 3.14Å
155	N	62.2	Low	73.7	Confident	13 Å²	13	42.9 Å²	42.9	7%	0.07	23%	0.23	C	C	.	.			trans	-100.8	163.2	179	-86.4	44.6	0	0	0	112	S157 L158 L159 V228 N229	N155-S157 PolarHBondContact O-N 2.98Å; N155-L158 WeakPolarHBondContact O-CB 3.22Å; N155-L158 PolarHBondContact O-N 3.41Å; N155-L159 PolarHBondContact O-N 2.66Å; N155-V228 PolarHBondContact ND2-O 3.17Å; N155-V228 PolarHBondContact OD1-O 2.61Å; N155-N229 VanDerWaalsContact ND2-CA 3.28Å; N155-N229 WeakPolarHBondContact ND2-CA 3.39Å; N155-N229 PolarHBondContact ND2-N 3.14Å; N155-N229 PolarHBondContact ND2-OD1 3.04Å
156	E	63	Low	74.1	Confident	154 Å²	154	42.3 Å²	42.3	72%	0.72	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-51	-30.9	171.4	-66.4	-179	176.5	0	0	112.8	L158 L159 F223	E156-L158 VanDerWaalsContact C-N 3.25Å; E156-L158 PolarHBondContact O-N 2.98Å; E156-L159 WeakPolarHBondContact O-CB 3.48Å; E156-L159 PolarHBondContact O-N 3.21Å; E156-F223 HydrophobicContact CB-CZ 4.42Å; E156-F223 HydrophobicContact CG-CZ 3.88Å
157	S	64.2	Low	74.2	Confident	43 Å²	43	40 Å²	40	30%	0.301	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-66.8	-22.6	176.2	55.8	0	0	0	0	114.2	N155	N155-S157 PolarHBondContact O-N 2.98Å
158	L	70.3	Confident	74.1	Confident	5 Å²	5	37.4 Å²	37.4	3%	0.026	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-95.3	-9.7	179.3	-70.1	162.8	0	0	0	113.3	F142 N155 E156 P160 M161 L162	F142-L158 HydrophobicContact CB-CD1 4.13Å; F142-L158 HydrophobicContact CB-CD2 3.79Å; F142-L158 HydrophobicContact CD1-CD2 4.28Å; F142-L158 HydrophobicContact CD2-CD2 3.3Å; F142-L158 HydrophobicContact CE2-CD2 3.83Å; F142-L158 HydrophobicContact CG-CD2 3.56Å; N155-L158 WeakPolarHBondContact O-CB 3.22Å; N155-L158 PolarHBondContact O-N 3.41Å; E156-L158 VanDerWaalsContact C-N 3.25Å; E156-L158 PolarHBondContact O-N 2.98Å; L158-P160 VanDerWaalsContact C-CD 3.42Å; L158-P160 VanDerWaalsContact C-N 3.34Å; L158-M161 HydrophobicContact CD2-CE 4.35Å; L158-M161 HydrophobicContact CD2-SD 4.14Å; L158-M161 WeakPolarHBondContact O-CB 3.42Å; L158-M161 PolarHBondContact O-N 3.01Å; L158-L162 PolarHBondContact O-N 3.43Å; L158-L162 VanDerWaalsContact O-N 3.1Å
159	L	69.8	Low	74.2	Confident	76 Å²	76	36.2 Å²	36.2	40%	0.398	19%	0.186	S	C	.	.	H	α-helix	trans	-47.8	-45.2	178	-146.9	159.7	0	0	0	113.5	N155 E156 M161 L162 T163 F223	N155-L159 PolarHBondContact O-N 2.66Å; E156-L159 WeakPolarHBondContact O-CB 3.48Å; E156-L159 PolarHBondContact O-N 3.21Å; L159-M161 VanDerWaalsContact C-N 3.3Å; L159-M161 PolarHBondContact O-N 3.33Å; L159-L162 WeakPolarHBondContact O-CB 3.35Å; L159-L162 PolarHBondContact O-N 3.03Å; L159-L162 VanDerWaalsContact O-N 3.16Å; L159-T163 HydrophobicContact CD2-CG2 3.84Å; L159-T163 WeakPolarHBondContact O-CG2 3.33Å; L159-T163 PolarHBondContact O-N 2.8Å; L159-T163 PolarHBondContact O-OG1 3.39Å; L159-F223 HydrophobicContact CB-CE2 3.94Å; L159-F223 HydrophobicContact CD1-CE1 4.25Å; L159-F223 HydrophobicContact CD1-CE2 3.55Å; L159-F223 HydrophobicContact CD1-CZ 3.34Å; L159-F223 HydrophobicContact CG-CD2 4.48Å; L159-F223 HydrophobicContact CG-CE2 3.69Å; L159-F223 HydrophobicContact CG-CZ 4.04Å
160	P	69.1	Low	74.2	Confident	31 Å²	31	38.7 Å²	38.7	20%	0.201	20%	0.201	C	C	.	.	H	α-helix	trans	-69.3	-24.1	178.7	26.1	-35.5	0	0	0	114.8	L158 T163 T164 L237 N240	L158-P160 VanDerWaalsContact C-CD 3.42Å; L158-P160 VanDerWaalsContact C-N 3.34Å; P160-T163 WeakPolarHBondContact CA-OG1 3.48Å; P160-T163 PolarHBondContact O-OG1 2.9Å; P160-T163 VanDerWaalsContact O-OG1 3.09Å; P160-T164 WeakPolarHBondContact O-CG2 3.43Å; P160-T164 PolarHBondContact O-OG1 3.25Å; P160-L237 HydrophobicContact CB-CD2 3.22Å; P160-L237 HydrophobicContact CB-CG 4.14Å; P160-L237 HydrophobicContact CG-CD2 3.77Å; P160-L237 HydrophobicContact CG-CG 4.32Å; P160-N240 PolarHBondContact O-ND2 3.11Å
161	M	72.4	Confident	74.2	Confident	17 Å²	17	32.3 Å²	32.3	8%	0.084	18%	0.178	C	C	.	.	H	α-helix	trans	-76.2	-35.7	172.3	-76.2	175.2	44.5	0	0	111.4	R135 V138 F139 F142 L158 L159 T164 S165	R135-M161 WeakPolarHBondContact O-CE 3.43Å; V138-M161 HydrophobicContact CB-CE 3.45Å; V138-M161 VanDerWaalsContact CB-CE 3.45Å; V138-M161 HydrophobicContact CB-SD 4.3Å; V138-M161 HydrophobicContact CG1-CE 3.39Å; V138-M161 HydrophobicContact CG1-SD 3.68Å; F139-M161 HydrophobicContact CB-CE 3.93Å; F139-M161 VanDerWaalsContact N-CE 3.25Å; F142-M161 HydrophobicContact CD2-CE 4.12Å; F142-M161 HydrophobicContact CD2-SD 4.15Å; F142-M161 HydrophobicContact CE2-CE 4.27Å; F142-M161 HydrophobicContact CE2-SD 3.75Å; L158-M161 HydrophobicContact CD2-CE 4.35Å; L158-M161 HydrophobicContact CD2-SD 4.14Å; L158-M161 WeakPolarHBondContact O-CB 3.42Å; L158-M161 PolarHBondContact O-N 3.01Å; L159-M161 VanDerWaalsContact C-N 3.3Å; L159-M161 PolarHBondContact O-N 3.33Å; M161-T164 PolarHBondContact O-OG1 3.27Å; M161-S165 PolarHBondContact O-N 3.41Å
162	L	77.9	Confident	74.5	Confident	5 Å²	5	27.6 Å²	27.6	3%	0.026	15%	0.153	C	C	.	.	H	α-helix	trans	-65.5	-49.8	176	-68.2	171.2	0	0	0	110.8	F139 T154 L158 L159 T164 S165 I166 L219 F223	F139-L162 HydrophobicContact CD2-CD2 4.07Å; F139-L162 HydrophobicContact CE2-CD2 3.61Å; F139-L162 HydrophobicContact CE2-CG 4.22Å; F139-L162 HydrophobicContact CZ-CD2 4.13Å; T154-L162 HydrophobicContact CG2-CD1 4.23Å; L158-L162 PolarHBondContact O-N 3.43Å; L158-L162 VanDerWaalsContact O-N 3.1Å; L159-L162 WeakPolarHBondContact O-CB 3.35Å; L159-L162 PolarHBondContact O-N 3.03Å; L159-L162 VanDerWaalsContact O-N 3.16Å; L162-T164 PolarHBondContact O-N 2.95Å; L162-T164 VanDerWaalsContact O-N 3.16Å; L162-S165 PolarHBondContact O-N 3.05Å; L162-S165 VanDerWaalsContact O-N 3.1Å; L162-S165 PolarHBondContact O-OG 2.94Å; L162-I166 WeakPolarHBondContact O-CD1 3.34Å; L162-I166 WeakPolarHBondContact O-CG1 3.42Å; L162-I166 PolarHBondContact O-N 3.35Å; L162-L219 HydrophobicContact CD2-CB 4.03Å; L162-L219 HydrophobicContact CD2-CD2 4.03Å; L162-F223 HydrophobicContact CD1-CD2 4.05Å
163	T	76.1	Confident	74.9	Confident	56 Å²	56	28.2 Å²	28.2	34%	0.344	16%	0.157	S	C	.	.	H	α-helix	trans	-56.7	-37.5	-179.1	54.7	0	0	0	0	112.4	L159 P160 I166 I167	L159-T163 HydrophobicContact CD2-CG2 3.84Å; L159-T163 WeakPolarHBondContact O-CG2 3.33Å; L159-T163 PolarHBondContact O-N 2.8Å; L159-T163 PolarHBondContact O-OG1 3.39Å; P160-T163 WeakPolarHBondContact CA-OG1 3.48Å; P160-T163 PolarHBondContact O-OG1 2.9Å; P160-T163 VanDerWaalsContact O-OG1 3.09Å; T163-I166 WeakPolarHBondContact O-CB 3.2Å; T163-I166 PolarHBondContact O-N 3.42Å; T163-I167 WeakPolarHBondContact O-CG1 3.47Å; T163-I167 PolarHBondContact O-N 3.01Å
164	T	76.8	Confident	75.4	Confident	7 Å²	7	27.5 Å²	27.5	4%	0.043	16%	0.155	C	C	.	.	H	α-helix	trans	-77.7	-31.3	-179.2	52.5	0	0	0	0	113.9	P160 M161 L162 I166 I167 C168 N240	P160-T164 WeakPolarHBondContact O-CG2 3.43Å; P160-T164 PolarHBondContact O-OG1 3.25Å; M161-T164 PolarHBondContact O-OG1 3.27Å; L162-T164 PolarHBondContact O-N 2.95Å; L162-T164 VanDerWaalsContact O-N 3.16Å; T164-I166 VanDerWaalsContact C-N 3.27Å; T164-I166 PolarHBondContact O-N 3.27Å; T164-I167 PolarHBondContact O-N 3.47Å; T164-C168 PolarHBondContact O-N 3.26Å; T164-C168 PolarHBondContact O-SG 3.12Å; T164-N240 WeakPolarHBondContact CB-OD1 3.39Å; T164-N240 HydrophobicContact CG2-CB 3.18Å; T164-N240 WeakPolarHBondContact CG2-ND2 3.46Å; T164-N240 WeakPolarHBondContact CG2-O 3.33Å; T164-N240 WeakPolarHBondContact CG2-OD1 3.35Å; T164-N240 PolarHBondContact OG1-ND2 3.34Å; T164-N240 PolarHBondContact OG1-OD1 3.33Å
165	S	81.2	Confident	75.9	Confident	3 Å²	3	30.6 Å²	30.6	2%	0.021	17%	0.174	C	C	.	.	H	α-helix	trans	-63	-37.4	168.1	73.2	0	0	0	0	111.7	M161 L162 C168 L169	M161-S165 PolarHBondContact O-N 3.41Å; L162-S165 PolarHBondContact O-N 3.05Å; L162-S165 VanDerWaalsContact O-N 3.1Å; L162-S165 PolarHBondContact O-OG 2.94Å; S165-C168 WeakPolarHBondContact O-CB 3.25Å; S165-C168 PolarHBondContact O-N 2.96Å; S165-L169 WeakPolarHBondContact O-CG 3.44Å; S165-L169 PolarHBondContact O-N 3.15Å
166	I	82.7	Confident	76.4	Confident	29 Å²	29	34.4 Å²	34.4	15%	0.149	19%	0.193	C	C	.	.	H	α-helix	trans	-68.8	-43	176.9	-65	152.9	0	0	0	111.1	L162 T163 T164 C168 L169 V170 F220	L162-I166 WeakPolarHBondContact O-CD1 3.34Å; L162-I166 WeakPolarHBondContact O-CG1 3.42Å; L162-I166 PolarHBondContact O-N 3.35Å; T163-I166 WeakPolarHBondContact O-CB 3.2Å; T163-I166 PolarHBondContact O-N 3.42Å; T164-I166 VanDerWaalsContact C-N 3.27Å; T164-I166 PolarHBondContact O-N 3.27Å; I166-C168 VanDerWaalsContact C-N 3.28Å; I166-C168 PolarHBondContact O-N 2.99Å; I166-L169 WeakPolarHBondContact O-CA 3.48Å; I166-L169 WeakPolarHBondContact O-CB 3.39Å; I166-L169 PolarHBondContact O-N 3.12Å; I166-V170 WeakPolarHBondContact O-CG2 3.43Å; I166-V170 PolarHBondContact O-N 2.89Å; I166-F220 HydrophobicContact CD1-CD1 4.43Å; I166-F220 HydrophobicContact CD1-CD2 4Å; I166-F220 HydrophobicContact CD1-CE1 3.76Å; I166-F220 HydrophobicContact CD1-CE2 3.26Å; I166-F220 HydrophobicContact CD1-CZ 3.13Å; I166-F220 HydrophobicContact CG1-CE2 4.1Å; I166-F220 HydrophobicContact CG1-CZ 4.36Å
167	I	79.6	Confident	76.8	Confident	31 Å²	31	28.7 Å²	28.7	16%	0.159	17%	0.166	C	C	.	.	H	α-helix	trans	-55	-46.1	172	-74	168.4	0	0	0	110.8	T163 T164 L169 V170 I171 L244	T163-I167 WeakPolarHBondContact O-CG1 3.47Å; T163-I167 PolarHBondContact O-N 3.01Å; T164-I167 PolarHBondContact O-N 3.47Å; I167-L169 VanDerWaalsContact C-N 3.29Å; I167-L169 PolarHBondContact O-N 3.47Å; I167-V170 PolarHBondContact O-N 3.41Å; I167-I171 HydrophobicContact CG2-CD1 3.99Å; I167-I171 WeakPolarHBondContact O-CG1 3.46Å; I167-I171 PolarHBondContact O-N 3.07Å; I167-L244 HydrophobicContact CB-CD1 4.34Å; I167-L244 HydrophobicContact CD1-CB 4.48Å; I167-L244 HydrophobicContact CD1-CD1 4.28Å; I167-L244 HydrophobicContact CG1-CD1 3.82Å; I167-L244 HydrophobicContact CG2-CB 3.76Å; I167-L244 HydrophobicContact CG2-CD1 3.86Å; I167-L244 HydrophobicContact CG2-CG 4.29Å
168	C	82.7	Confident	77.3	Confident	7 Å²	7	27 Å²	27	5%	0.047	15%	0.154	C	C	.	.	H	α-helix	trans	-63	-36.7	176.5	-66.8	0	0	0	0	111.9	L132 T164 S165 I166 I171 I172	L132-C168 HydrophobicContact CB-CB 3.97Å; L132-C168 HydrophobicContact CD1-CB 3.84Å; L132-C168 HydrophobicContact CG-CB 4.36Å; T164-C168 PolarHBondContact O-N 3.26Å; T164-C168 PolarHBondContact O-SG 3.12Å; S165-C168 WeakPolarHBondContact O-CB 3.25Å; S165-C168 PolarHBondContact O-N 2.96Å; I166-C168 VanDerWaalsContact C-N 3.28Å; I166-C168 PolarHBondContact O-N 2.99Å; C168-I171 PolarHBondContact O-N 3.04Å; C168-I172 WeakPolarHBondContact O-CD1 3.42Å; C168-I172 VanDerWaalsContact O-CG1 3.26Å; C168-I172 WeakPolarHBondContact O-CG1 3.28Å; C168-I172 PolarHBondContact O-N 3.11Å
169	L	85.3	Confident	77.5	Confident	6 Å²	6	27 Å²	27	3%	0.031	15%	0.154	C	C	.	.	H	α-helix	trans	-64.3	-43.3	174.9	-74.6	166.3	0	0	0	112.3	L132 S165 I166 I167 I171 I172 C173 L215 A216 L219	L132-L169 HydrophobicContact CD1-CD2 3.66Å; L132-L169 HydrophobicContact CD1-CG 3.64Å; S165-L169 WeakPolarHBondContact O-CG 3.44Å; S165-L169 PolarHBondContact O-N 3.15Å; I166-L169 WeakPolarHBondContact O-CA 3.48Å; I166-L169 WeakPolarHBondContact O-CB 3.39Å; I166-L169 PolarHBondContact O-N 3.12Å; I167-L169 VanDerWaalsContact C-N 3.29Å; I167-L169 PolarHBondContact O-N 3.47Å; L169-I171 VanDerWaalsContact C-N 3.32Å; L169-I171 PolarHBondContact O-N 3.4Å; L169-I172 PolarHBondContact O-N 3.02Å; L169-C173 WeakPolarHBondContact O-CB 3.47Å; L169-C173 PolarHBondContact O-N 3.11Å; L169-L215 HydrophobicContact CD1-CB 4.25Å; L169-L215 HydrophobicContact CD1-CD2 3.91Å; L169-L215 HydrophobicContact CD1-CG 4.1Å; L169-L215 HydrophobicContact CD2-CD2 3.69Å; L169-L215 HydrophobicContact CG-CD2 4.34Å; L169-A216 HydrophobicContact CD1-CB 4.2Å; L169-L219 HydrophobicContact CD1-CD1 4.42Å
170	V	82.2	Confident	78	Confident	56 Å²	56	23.5 Å²	23.5	34%	0.339	14%	0.136	S	C	.	.	H	α-helix	trans	-59.4	-44.5	175.9	169.3	0	0	0	0	110.8	I166 I167 C173 G174 V175	I166-V170 WeakPolarHBondContact O-CG2 3.43Å; I166-V170 PolarHBondContact O-N 2.89Å; I167-V170 PolarHBondContact O-N 3.41Å; V170-C173 PolarHBondContact O-N 3.4Å; V170-G174 PolarHBondContact O-N 3.37Å; V170-V175 HydrophobicContact CG1-CB 3.92Å; V170-V175 HydrophobicContact CG1-CG2 3.75Å; V170-V175 PolarHBondContact O-N 3.46Å
171	I	81.1	Confident	78.4	Confident	8 Å²	8	24 Å²	24	4%	0.041	13%	0.134	C	C	.	.	H	α-helix	trans	-60.5	-52.4	175.1	-63.8	162.5	0	0	0	110	A128 I167 C168 L169 C173 G174 T178 S180 A247	A128-I171 HydrophobicContact CB-CG2 4.22Å; I167-I171 HydrophobicContact CG2-CD1 3.99Å; I167-I171 WeakPolarHBondContact O-CG1 3.46Å; I167-I171 PolarHBondContact O-N 3.07Å; C168-I171 PolarHBondContact O-N 3.04Å; L169-I171 VanDerWaalsContact C-N 3.32Å; L169-I171 PolarHBondContact O-N 3.4Å; I171-C173 VanDerWaalsContact C-N 3.26Å; I171-C173 PolarHBondContact O-N 2.8Å; I171-G174 PolarHBondContact O-N 3.48Å; I171-T178 HydrophobicContact CG1-CG2 4.45Å; I171-S180 WeakPolarHBondContact O-CB 3.18Å; I171-S180 PolarHBondContact O-OG 2.98Å; I171-A247 HydrophobicContact CD1-CB 3.54Å; I171-A247 HydrophobicContact CG1-CB 3.82Å; I171-A247 HydrophobicContact CG2-CB 4.39Å
172	I	82.7	Confident	78.6	Confident	2 Å²	2	23.4 Å²	23.4	1%	0.01	13%	0.131	C	C	.	.	H	α-helix	trans	-63.1	-34	-177.9	-67.9	159.1	0	0	0	112.2	A128 K129 L132 C168 L169 G174 K184	A128-I172 HydrophobicContact CB-CD1 4.1Å; A128-I172 HydrophobicContact CB-CG1 3.67Å; K129-I172 HydrophobicContact CD-CD1 3.8Å; K129-I172 HydrophobicContact CG-CD1 4.22Å; L132-I172 HydrophobicContact CD1-CD1 3.91Å; C168-I172 WeakPolarHBondContact O-CD1 3.42Å; C168-I172 VanDerWaalsContact O-CG1 3.26Å; C168-I172 WeakPolarHBondContact O-CG1 3.28Å; C168-I172 PolarHBondContact O-N 3.11Å; L169-I172 PolarHBondContact O-N 3.02Å; I172-G174 PolarHBondContact O-N 3.32Å; I172-K184 PolarHBondContact O-NZ 3.4Å
173	C	82.3	Confident	78.6	Confident	14 Å²	14	23.1 Å²	23.1	10%	0.095	13%	0.13	C	C	.	.	H	α-helix	trans	-65	-24.7	178.1	-158.4	0	0	0	0	112.3	L169 V170 I171 F209 S212	L169-C173 WeakPolarHBondContact O-CB 3.47Å; L169-C173 PolarHBondContact O-N 3.11Å; V170-C173 PolarHBondContact O-N 3.4Å; I171-C173 VanDerWaalsContact C-N 3.26Å; I171-C173 PolarHBondContact O-N 2.8Å; C173-F209 VanDerWaalsContact SG-CA 3.55Å; C173-F209 WeakPolarHBondContact SG-CD2 3.35Å; C173-S212 PolarHBondContact SG-OG 3.17Å
174	G	77.7	Confident	78.7	Confident	14 Å²	14	21.1 Å²	21.1	14%	0.144	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.4	53.2	-176.8	0	0	0	0	0	111.2	V170 I171 I172 Y181	V170-G174 PolarHBondContact O-N 3.37Å; I171-G174 PolarHBondContact O-N 3.48Å; I172-G174 PolarHBondContact O-N 3.32Å; G174-Y181 WeakPolarHBondContact O-CD2 3.02Å
175	V	74.8	Confident	78.7	Confident	66 Å²	66	22.6 Å²	22.6	40%	0.4	12%	0.123	S	C	.	.			trans	-67.6	145.4	166.7	177.5	0	0	0	0	109.2	V170 F177 T178 Y181	V170-V175 HydrophobicContact CG1-CB 3.92Å; V170-V175 HydrophobicContact CG1-CG2 3.75Å; V170-V175 PolarHBondContact O-N 3.46Å; V175-F177 PolarHBondContact O-N 3.05Å; V175-T178 WeakPolarHBondContact O-CB 3.44Å; V175-T178 WeakPolarHBondContact O-CG2 3.39Å; V175-T178 PolarHBondContact O-N 3.47Å; V175-T178 PolarHBondContact O-OG1 2.67Å; V175-Y181 WeakPolarHBondContact O-CB 3.4Å
176	I	72.8	Confident	78.4	Confident	92 Å²	92	23 Å²	23	47%	0.472	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.5	138.2	-178.6	-56	163.9	0	0	0	109.6	T178 Y181	I176-T178 VanDerWaalsContact C-N 3.34Å; I176-T178 PolarHBondContact O-N 3.44Å; I176-Y181 HydrophobicContact CG1-CE2 4.37Å
177	F	70.4	Confident	78	Confident	35 Å²	35	21.7 Å²	21.7	15%	0.154	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.3	-8.3	-174	-49.4	-65.3	0	0	0	117.6	V175 Y182 L248 I255 V273 I276 P277	V175-F177 PolarHBondContact O-N 3.05Å; F177-Y182 WeakPolarHBondContact CD1-OH 3.37Å; F177-L248 HydrophobicContact CB-CD2 3.96Å; F177-I255 HydrophobicContact CD1-CD1 4.32Å; F177-V273 HydrophobicContact CE1-CG1 3.92Å; F177-I276 HydrophobicContact CD2-CG2 4.34Å; F177-I276 HydrophobicContact CE1-CB 4.3Å; F177-I276 HydrophobicContact CE1-CG2 4.31Å; F177-I276 HydrophobicContact CE2-CG2 3.72Å; F177-I276 HydrophobicContact CZ-CB 4.07Å; F177-I276 HydrophobicContact CZ-CD1 4.08Å; F177-I276 HydrophobicContact CZ-CG2 3.7Å; F177-P277 HydrophobicContact CB-CB 4.23Å; F177-P277 HydrophobicContact CD1-CB 4.35Å; F177-P277 HydrophobicContact CD1-CG 4.13Å; F177-P277 HydrophobicContact CG-CB 4.46Å
178	T	74.7	Confident	77.8	Confident	8 Å²	8	20.3 Å²	20.3	5%	0.049	11%	0.11	C	C	.	.	S	Bend	trans	-80.7	146.6	173.2	64.9	0	0	0	0	111.5	I171 V175 I176 S180 Y181 Y182	I171-T178 HydrophobicContact CG1-CG2 4.45Å; V175-T178 WeakPolarHBondContact O-CB 3.44Å; V175-T178 WeakPolarHBondContact O-CG2 3.39Å; V175-T178 PolarHBondContact O-N 3.47Å; V175-T178 PolarHBondContact O-OG1 2.67Å; I176-T178 VanDerWaalsContact C-N 3.34Å; I176-T178 PolarHBondContact O-N 3.44Å; T178-S180 PolarHBondContact O-N 3.37Å; T178-S180 VanDerWaalsContact O-N 3.08Å; T178-Y181 WeakPolarHBondContact O-CB 3.37Å; T178-Y181 PolarHBondContact O-N 3.28Å; T178-Y181 PolarHBondContact OG1-N 3.06Å; T178-Y182 VanDerWaalsContact O-CD2 3.28Å; T178-Y182 WeakPolarHBondContact O-CD2 3.28Å
179	S	75.8	Confident	77.2	Confident	4 Å²	4	22.3 Å²	22.3	3%	0.028	12%	0.12	C	C	.	.	H	α-helix	trans	-55	-29.5	176.1	63.9	0	0	0	0	114	S183 A247	S179-S183 WeakPolarHBondContact O-CB 3.35Å; S179-S183 PolarHBondContact O-N 2.98Å; S179-S183 PolarHBondContact O-OG 3.45Å; S179-A247 PolarHBondContact N-O 2.89Å
180	S	79.1	Confident	76.3	Confident	3 Å²	3	28.2 Å²	28.2	2%	0.021	14%	0.143	C	C	.	.	H	α-helix	trans	-74.3	-30.5	178.5	-69.2	0	0	0	0	113.2	I171 T178 S183 K184	I171-S180 WeakPolarHBondContact O-CB 3.18Å; I171-S180 PolarHBondContact O-OG 2.98Å; T178-S180 PolarHBondContact O-N 3.37Å; T178-S180 VanDerWaalsContact O-N 3.08Å; S180-S183 WeakPolarHBondContact CA-OG 3.41Å; S180-S183 PolarHBondContact O-OG 3.08Å; S180-K184 WeakPolarHBondContact O-CB 3.42Å; S180-K184 PolarHBondContact O-N 3.41Å
181	Y	78.9	Confident	75.4	Confident	41 Å²	41	27.7 Å²	27.7	16%	0.161	14%	0.14	C	C	.	.	H	α-helix	trans	-62.1	-56.4	172.8	172.8	-104.5	0	0	0	110.4	G174 V175 I176 T178 S183 K184 E185 L260	G174-Y181 WeakPolarHBondContact O-CD2 3.02Å; V175-Y181 WeakPolarHBondContact O-CB 3.4Å; I176-Y181 HydrophobicContact CG1-CE2 4.37Å; T178-Y181 WeakPolarHBondContact O-CB 3.37Å; T178-Y181 PolarHBondContact O-N 3.28Å; T178-Y181 PolarHBondContact OG1-N 3.06Å; Y181-S183 VanDerWaalsContact C-N 3.35Å; Y181-S183 PolarHBondContact O-N 2.89Å; Y181-K184 PolarHBondContact O-N 3.03Å; Y181-K184 VanDerWaalsContact O-N 3.17Å; Y181-E185 HydrophobicContact CD2-CG 3.98Å; Y181-E185 HydrophobicContact CE1-CG 4.47Å; Y181-E185 HydrophobicContact CE2-CG 3.64Å; Y181-E185 WeakPolarHBondContact CE2-OE1 3.46Å; Y181-E185 VanDerWaalsContact CZ-OE1 3.23Å; Y181-E185 VanDerWaalsContact CZ-OE2 3.29Å; Y181-E185 PolarHBondContact O-N 3.27Å; Y181-E185 PolarHBondContact OH-OE1 3.37Å; Y181-E185 PolarHBondContact OH-OE2 3.34Å; Y181-L260 HydrophobicContact CE1-CD1 4.38Å
182	Y	76	Confident	74.6	Confident	4 Å²	4	29 Å²	29	2%	0.016	15%	0.147	C	C	.	.	H	α-helix	trans	-57.9	-47.9	-179	-64	-67	0	0	0	111.7	F177 T178 K184 Y186 F254 I255 L260	F177-Y182 WeakPolarHBondContact CD1-OH 3.37Å; T178-Y182 VanDerWaalsContact O-CD2 3.28Å; T178-Y182 WeakPolarHBondContact O-CD2 3.28Å; Y182-K184 PolarHBondContact O-N 2.95Å; Y182-Y186 VanDerWaalsContact O-CB 3.29Å; Y182-Y186 WeakPolarHBondContact O-CB 2.99Å; Y182-Y186 WeakPolarHBondContact O-CD2 3.31Å; Y182-Y186 PolarHBondContact O-N 2.96Å; Y182-F254 HydrophobicContact CD2-CB 4.15Å; Y182-F254 HydrophobicContact CG-CB 4.11Å; Y182-I255 HydrophobicContact CD1-CG1 4.07Å; Y182-I255 HydrophobicContact CD2-CG1 4.18Å; Y182-I255 HydrophobicContact CE1-CD1 4.13Å; Y182-I255 HydrophobicContact CE1-CG1 3.4Å; Y182-I255 VanDerWaalsContact CE1-CG1 3.4Å; Y182-I255 HydrophobicContact CE2-CD1 3.69Å; Y182-I255 HydrophobicContact CE2-CG1 3.51Å; Y182-I255 HydrophobicContact CG-CG1 4.44Å; Y182-I255 WeakPolarHBondContact OH-CD1 3.01Å; Y182-I255 VanDerWaalsContact OH-CG1 3.31Å; Y182-I255 WeakPolarHBondContact OH-CG1 3.34Å; Y182-L260 HydrophobicContact CD1-CD1 3.74Å; Y182-L260 HydrophobicContact CD1-CG 4.27Å; Y182-L260 HydrophobicContact CE1-CD1 3.66Å
183	S	77.8	Confident	73.7	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65.3	-35.6	179.9	61.3	0	0	0	0	113.4	H121 S179 S180 Y181 N187	H121-S183 PolarHBondContact ND1-OG 2.83Å; S179-S183 WeakPolarHBondContact O-CB 3.35Å; S179-S183 PolarHBondContact O-N 2.98Å; S179-S183 PolarHBondContact O-OG 3.45Å; S180-S183 WeakPolarHBondContact CA-OG 3.41Å; S180-S183 PolarHBondContact O-OG 3.08Å; Y181-S183 VanDerWaalsContact C-N 3.35Å; Y181-S183 PolarHBondContact O-N 2.89Å; S183-N187 VanDerWaalsContact O-CB 3.25Å; S183-N187 WeakPolarHBondContact O-CB 3.28Å; S183-N187 PolarHBondContact O-N 3.47Å; S183-N187 PolarHBondContact O-ND2 3.26Å
184	K	79.1	Confident	73.3	Confident	13 Å²	13	43.3 Å²	43.3	6%	0.057	21%	0.21	C	C	.	.	H	α-helix	trans	-69.9	-51.7	174.7	-93.9	176.9	179.3	166.9	0	112	H121 I172 S180 Y181 Y182 Y186 N187 L188	H121-K184 VanDerWaalsContact CE1-CG 3.47Å; H121-K184 WeakPolarHBondContact CE1-CG 3.37Å; I172-K184 PolarHBondContact O-NZ 3.4Å; S180-K184 WeakPolarHBondContact O-CB 3.42Å; S180-K184 PolarHBondContact O-N 3.41Å; Y181-K184 PolarHBondContact O-N 3.03Å; Y181-K184 VanDerWaalsContact O-N 3.17Å; Y182-K184 PolarHBondContact O-N 2.95Å; K184-Y186 PolarHBondContact O-N 3.41Å; K184-N187 PolarHBondContact O-N 3.03Å; K184-L188 HydrophobicContact CB-CD1 4.38Å; K184-L188 WeakPolarHBondContact O-CB 3.48Å; K184-L188 WeakPolarHBondContact O-CD1 3.3Å; K184-L188 WeakPolarHBondContact O-CG 3.46Å; K184-L188 PolarHBondContact O-N 3.35Å
185	E	76.8	Confident	73.1	Confident	39 Å²	39	50.8 Å²	50.8	18%	0.182	24%	0.241	C	C	.	.	H	α-helix	trans	-61.8	-46.1	-175.2	-75.7	-142.1	165	0	0	111.3	Y181 N187 L188 L189 L260	Y181-E185 HydrophobicContact CD2-CG 3.98Å; Y181-E185 HydrophobicContact CE1-CG 4.47Å; Y181-E185 HydrophobicContact CE2-CG 3.64Å; Y181-E185 WeakPolarHBondContact CE2-OE1 3.46Å; Y181-E185 VanDerWaalsContact CZ-OE1 3.23Å; Y181-E185 VanDerWaalsContact CZ-OE2 3.29Å; Y181-E185 PolarHBondContact O-N 3.27Å; Y181-E185 PolarHBondContact OH-OE1 3.37Å; Y181-E185 PolarHBondContact OH-OE2 3.34Å; E185-N187 VanDerWaalsContact C-N 3.32Å; E185-N187 PolarHBondContact O-N 3.43Å; E185-L188 PolarHBondContact O-N 3.04Å; E185-L189 HydrophobicContact CB-CD1 3.91Å; E185-L189 HydrophobicContact CG-CD1 4.07Å; E185-L189 VanDerWaalsContact O-CB 3.29Å; E185-L189 WeakPolarHBondContact O-CB 3.37Å; E185-L189 PolarHBondContact O-N 3.43Å; E185-L260 HydrophobicContact CB-CD2 4.28Å
186	Y	74	Confident	73.1	Confident	12 Å²	12	51.2 Å²	51.2	5%	0.047	25%	0.247	C	C	.	.	H	α-helix	trans	-57.1	-47.3	176.4	-99.9	-73.3	0	0	0	113.4	L117 Y182 K184 L188 Y190 Y258 S259 L260	L117-Y186 HydrophobicContact CD1-CD1 4.2Å; L117-Y186 HydrophobicContact CD1-CG 4.44Å; Y182-Y186 VanDerWaalsContact O-CB 3.29Å; Y182-Y186 WeakPolarHBondContact O-CB 2.99Å; Y182-Y186 WeakPolarHBondContact O-CD2 3.31Å; Y182-Y186 PolarHBondContact O-N 2.96Å; K184-Y186 PolarHBondContact O-N 3.41Å; Y186-L188 VanDerWaalsContact C-N 3.26Å; Y186-L188 PolarHBondContact O-N 2.85Å; Y186-Y190 HydrophobicContact CD1-CD2 4.44Å; Y186-Y190 HydrophobicContact CE1-CD2 4.48Å; Y186-Y190 WeakPolarHBondContact O-CB 3.26Å; Y186-Y190 PolarHBondContact O-N 3.15Å; Y186-Y258 WeakPolarHBondContact OH-CA 3.43Å; Y186-Y258 VanDerWaalsContact OH-CB 3.26Å; Y186-Y258 WeakPolarHBondContact OH-CB 3.49Å; Y186-Y258 PolarHBondContact OH-O 3.41Å; Y186-Y258 VanDerWaalsContact OH-O 3.05Å; Y186-S259 WeakPolarHBondContact OH-CA 3.45Å; Y186-S259 PolarHBondContact OH-N 3.09Å; Y186-S259 PolarHBondContact OH-O 2.96Å; Y186-L260 HydrophobicContact CD2-CD2 3.58Å; Y186-L260 HydrophobicContact CD2-CG 4.25Å; Y186-L260 HydrophobicContact CE2-CB 4.42Å; Y186-L260 HydrophobicContact CE2-CD2 3.5Å; Y186-L260 VanDerWaalsContact CE2-CD2 3.5Å; Y186-L260 HydrophobicContact CE2-CG 3.68Å; Y186-L260 HydrophobicContact CG-CD2 4.27Å; Y186-L260 VanDerWaalsContact OH-CA 3.29Å; Y186-L260 WeakPolarHBondContact OH-CA 3.42Å; Y186-L260 PolarHBondContact OH-N 3.16Å
187	N	74.7	Confident	73.2	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-69	-28.3	-175.4	-79.4	-28.4	0	0	0	113	I109 L117 M118 H121 S183 K184 E185 P191	I109-N187 HydrophobicContact CB-CB 4.35Å; I109-N187 HydrophobicContact CD1-CB 3.44Å; I109-N187 VanDerWaalsContact CD1-CB 3.44Å; I109-N187 HydrophobicContact CG1-CB 3.78Å; I109-N187 HydrophobicContact CG2-CB 3.59Å; L117-N187 WeakPolarHBondContact CB-OD1 3.4Å; L117-N187 PolarHBondContact O-ND2 3.08Å; L117-N187 VanDerWaalsContact O-ND2 3.13Å; M118-N187 PolarHBondContact N-OD1 2.99Å; H121-N187 WeakPolarHBondContact CB-ND2 3.17Å; S183-N187 VanDerWaalsContact O-CB 3.25Å; S183-N187 WeakPolarHBondContact O-CB 3.28Å; S183-N187 PolarHBondContact O-N 3.47Å; S183-N187 PolarHBondContact O-ND2 3.26Å; K184-N187 PolarHBondContact O-N 3.03Å; E185-N187 VanDerWaalsContact C-N 3.32Å; E185-N187 PolarHBondContact O-N 3.43Å; N187-P191 WeakPolarHBondContact O-CG 3.45Å
188	L	75.5	Confident	73.5	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-94.5	-40.1	-175.5	-73.3	164.9	0	0	0	113	L105 F108 I109 K184 E185 Y186 I201 I205	L105-L188 HydrophobicContact CD1-CD1 4.24Å; L105-L188 HydrophobicContact CD1-CD2 4.48Å; L105-L188 HydrophobicContact CD2-CD1 4.19Å; L105-L188 HydrophobicContact CD2-CD2 4.13Å; L105-L188 HydrophobicContact CD2-CG 4.34Å; L105-L188 HydrophobicContact CG-CD2 4.26Å; F108-L188 HydrophobicContact CD1-CD2 3.98Å; F108-L188 HydrophobicContact CE1-CD2 3.98Å; I109-L188 HydrophobicContact CG1-CD2 4.39Å; K184-L188 HydrophobicContact CB-CD1 4.38Å; K184-L188 WeakPolarHBondContact O-CB 3.48Å; K184-L188 WeakPolarHBondContact O-CD1 3.3Å; K184-L188 WeakPolarHBondContact O-CG 3.46Å; K184-L188 PolarHBondContact O-N 3.35Å; E185-L188 PolarHBondContact O-N 3.04Å; Y186-L188 VanDerWaalsContact C-N 3.26Å; Y186-L188 PolarHBondContact O-N 2.85Å; L188-I201 HydrophobicContact CB-CD1 4.3Å; L188-I201 HydrophobicContact CB-CG2 3.86Å; L188-I201 HydrophobicContact CD1-CG2 4.04Å; L188-I201 HydrophobicContact CD2-CD1 4.12Å; L188-I201 HydrophobicContact CD2-CG1 4.09Å; L188-I201 HydrophobicContact CD2-CG2 4.01Å; L188-I201 HydrophobicContact CG-CG2 4.18Å; L188-I201 WeakPolarHBondContact O-CD1 3.46Å; L188-I205 HydrophobicContact CD1-CD1 4.22Å; L188-I205 HydrophobicContact CD1-CG1 4.36Å
189	L	68.5	Low	73.8	Confident	50 Å²	50	53.3 Å²	53.3	26%	0.262	26%	0.26	S	S	.	.	H	α-helix	trans	-91.8	-32.7	-173	-74.8	143.3	0	0	0	113.7	E185 I262	E185-L189 HydrophobicContact CB-CD1 3.91Å; E185-L189 HydrophobicContact CG-CD1 4.07Å; E185-L189 VanDerWaalsContact O-CB 3.29Å; E185-L189 WeakPolarHBondContact O-CB 3.37Å; E185-L189 PolarHBondContact O-N 3.43Å; L189-I262 HydrophobicContact CB-CD1 4.4Å; L189-I262 HydrophobicContact CD1-CD1 3.88Å
190	Y	67.3	Low	74	Confident	130 Å²	130	56.2 Å²	56.2	51%	0.51	27%	0.274	S	S	.	.	S	Bend	trans	-58.9	-42.1	-179	-166.1	-86.2	0	0	0	114.7	L114 Y186 P261	L114-Y190 HydrophobicContact CD1-CD1 3.69Å; L114-Y190 HydrophobicContact CD1-CG 3.95Å; L114-Y190 HydrophobicContact CD2-CD1 4.33Å; L114-Y190 HydrophobicContact CD2-CE1 4.39Å; L114-Y190 HydrophobicContact CG-CD1 4.45Å; Y186-Y190 HydrophobicContact CD1-CD2 4.44Å; Y186-Y190 HydrophobicContact CE1-CD2 4.48Å; Y186-Y190 WeakPolarHBondContact O-CB 3.26Å; Y186-Y190 PolarHBondContact O-N 3.15Å; Y190-P261 HydrophobicContact CD2-CB 4.33Å; Y190-P261 HydrophobicContact CD2-CG 4Å
191	P	62.6	Low	74	Confident	44 Å²	44	56.2 Å²	56.2	29%	0.286	27%	0.274	S	S	.	.	S	Bend	trans	-95.5	-14.7	-169.1	32.6	-27.4	0	0	0	114.5	T112 N187	T112-P191 HydrophobicContact CG2-CB 3.54Å; T112-P191 HydrophobicContact CG2-CG 3.15Å; N187-P191 WeakPolarHBondContact O-CG 3.45Å
192	L	65	Low	74.2	Confident	36 Å²	36	58.2 Å²	58.2	19%	0.188	29%	0.288	C	S	.	.			trans	-118.5	89.8	-168	-68.6	161	0	0	0	108.9	F108 E194 V197 I198 I201	F108-L192 HydrophobicContact CE1-CD1 3.44Å; F108-L192 VanDerWaalsContact CE1-CD1 3.44Å; F108-L192 HydrophobicContact CE2-CD1 4.46Å; F108-L192 HydrophobicContact CZ-CD1 3.32Å; L192-E194 VanDerWaalsContact C-N 3.31Å; L192-V197 HydrophobicContact CB-CB 4.48Å; L192-V197 HydrophobicContact CB-CG1 4.29Å; L192-V197 HydrophobicContact CD1-CG1 3.75Å; L192-V197 HydrophobicContact CD2-CB 4.39Å; L192-V197 HydrophobicContact CD2-CG1 3.94Å; L192-V197 HydrophobicContact CG-CG1 4.2Å; L192-I198 WeakPolarHBondContact O-CD1 3.29Å; L192-I198 VanDerWaalsContact O-CG1 3.32Å; L192-I198 WeakPolarHBondContact O-CG1 3.27Å; L192-I201 HydrophobicContact CB-CD1 4.46Å; L192-I201 HydrophobicContact CD1-CD1 3.62Å
193	K	64.7	Low	74.7	Confident	191 Å²	191	61.3 Å²	61.3	83%	0.83	30%	0.304	S	S	*	.			trans	-82.6	-10.4	176.1	-65.3	-174.1	178.4	-178.3	0	112.9	E195	K193-E195 PolarHBondContact O-N 3.07Å
194	E	72.6	Confident	75	Confident	126 Å²	126	61.6 Å²	61.6	59%	0.589	31%	0.305	S	S	*	.			trans	-73.6	124.4	178.5	-67.8	-171.6	178.7	0	0	111.2	L192 S196 V197 I198	L192-E194 VanDerWaalsContact C-N 3.31Å; E194-S196 VanDerWaalsContact C-N 3.26Å; E194-S196 PolarHBondContact O-N 3.46Å; E194-V197 HydrophobicContact CB-CG2 4.11Å; E194-V197 PolarHBondContact O-N 2.89Å; E194-V197 VanDerWaalsContact O-N 3.12Å; E194-I198 WeakPolarHBondContact O-CG1 3.39Å; E194-I198 PolarHBondContact O-N 3.08Å; E194-I198 VanDerWaalsContact O-N 3.13Å
195	E	73.6	Confident	75.2	Confident	171 Å²	171	63.3 Å²	63.3	80%	0.799	32%	0.315	S	S	*	.	H	α-helix	trans	-56.4	-38.2	-176.2	-63.6	-176.4	163.5	0	0	113	K193 V197 I198 L199	K193-E195 PolarHBondContact O-N 3.07Å; E195-V197 VanDerWaalsContact C-N 3.34Å; E195-V197 PolarHBondContact O-N 3.39Å; E195-I198 PolarHBondContact O-N 3.16Å; E195-L199 PolarHBondContact O-N 3.09Å; E195-L199 VanDerWaalsContact O-N 3.08Å
196	S	74.8	Confident	75.7	Confident	74 Å²	74	68.1 Å²	68.1	52%	0.517	34%	0.335	S	S	.	.	H	α-helix	trans	-62.7	-40.8	179.7	57.2	0	0	0	0	112	E194 L200	E194-S196 VanDerWaalsContact C-N 3.26Å; E194-S196 PolarHBondContact O-N 3.46Å; S196-L200 WeakPolarHBondContact O-CG 3.42Å; S196-L200 PolarHBondContact O-N 3.3Å
197	V	75.6	Confident	76.4	Confident	17 Å²	17	69.5 Å²	69.5	10%	0.103	34%	0.342	C	S	.	.	H	α-helix	trans	-75.7	-34.4	-179.5	-168.5	0	0	0	0	110.9	F108 L192 E194 E195 L200 I201	F108-V197 HydrophobicContact CZ-CG1 3.86Å; L192-V197 HydrophobicContact CB-CB 4.48Å; L192-V197 HydrophobicContact CB-CG1 4.29Å; L192-V197 HydrophobicContact CD1-CG1 3.75Å; L192-V197 HydrophobicContact CD2-CB 4.39Å; L192-V197 HydrophobicContact CD2-CG1 3.94Å; L192-V197 HydrophobicContact CG-CG1 4.2Å; E194-V197 HydrophobicContact CB-CG2 4.11Å; E194-V197 PolarHBondContact O-N 2.89Å; E194-V197 VanDerWaalsContact O-N 3.12Å; E195-V197 VanDerWaalsContact C-N 3.34Å; E195-V197 PolarHBondContact O-N 3.39Å; V197-L200 WeakPolarHBondContact O-CB 3.22Å; V197-L200 PolarHBondContact O-N 3.38Å; V197-I201 HydrophobicContact CG1-CD1 4.14Å; V197-I201 VanDerWaalsContact O-CG1 3.27Å; V197-I201 WeakPolarHBondContact O-CG1 3.42Å; V197-I201 PolarHBondContact O-N 3.44Å
198	I	77.1	Confident	77	Confident	50 Å²	50	69.6 Å²	69.6	26%	0.256	34%	0.343	S	S	.	.	H	α-helix	trans	-61.8	-44.6	174.9	-64.7	165	0	0	0	110.7	L192 E194 E195 L200 I201 N202	L192-I198 WeakPolarHBondContact O-CD1 3.29Å; L192-I198 VanDerWaalsContact O-CG1 3.32Å; L192-I198 WeakPolarHBondContact O-CG1 3.27Å; E194-I198 WeakPolarHBondContact O-CG1 3.39Å; E194-I198 PolarHBondContact O-N 3.08Å; E194-I198 VanDerWaalsContact O-N 3.13Å; E195-I198 PolarHBondContact O-N 3.16Å; I198-L200 VanDerWaalsContact C-N 3.33Å; I198-L200 PolarHBondContact O-N 3.12Å; I198-I201 PolarHBondContact O-N 3.19Å; I198-N202 PolarHBondContact O-N 3.38Å; I198-N202 PolarHBondContact O-ND2 2.75Å
199	L	80.6	Confident	77.6	Confident	113 Å²	113	74.3 Å²	74.3	59%	0.592	36%	0.364	S	S	*	.	H	α-helix	trans	-59.1	-46	176.3	-172.7	111.8	0	0	0	111.5	E195 I201 N202 I203	E195-L199 PolarHBondContact O-N 3.09Å; E195-L199 VanDerWaalsContact O-N 3.08Å; L199-I201 VanDerWaalsContact C-N 3.31Å; L199-I201 PolarHBondContact O-N 2.89Å; L199-N202 PolarHBondContact O-N 3.28Å; L199-I203 HydrophobicContact CD2-CD1 4.17Å; L199-I203 WeakPolarHBondContact O-CG1 3.38Å; L199-I203 PolarHBondContact O-N 2.9Å; L199-I203 VanDerWaalsContact O-N 3.1Å
200	L	79.4	Confident	78.6	Confident	64 Å²	64	73.3 Å²	73.3	34%	0.335	36%	0.363	S	S	.	.	H	α-helix	trans	-59.4	-41.7	177.3	-77	171.3	0	0	0	112.1	Y75 S196 V197 I198 I203 I204	Y75-L200 HydrophobicContact CE1-CB 4.29Å; Y75-L200 HydrophobicContact CE1-CD2 3.73Å; Y75-L200 HydrophobicContact CE1-CG 4.4Å; Y75-L200 HydrophobicContact CE2-CB 3.67Å; Y75-L200 VanDerWaalsContact CE2-O 3.3Å; Y75-L200 WeakPolarHBondContact CE2-O 3.39Å; Y75-L200 VanDerWaalsContact OH-C 3.27Å; Y75-L200 VanDerWaalsContact OH-CA 3.27Å; Y75-L200 WeakPolarHBondContact OH-CA 3.25Å; Y75-L200 VanDerWaalsContact OH-CB 3.29Å; Y75-L200 WeakPolarHBondContact OH-CB 3.25Å; Y75-L200 WeakPolarHBondContact OH-CD2 3.42Å; Y75-L200 PolarHBondContact OH-O 3.47Å; S196-L200 WeakPolarHBondContact O-CG 3.42Å; S196-L200 PolarHBondContact O-N 3.3Å; V197-L200 WeakPolarHBondContact O-CB 3.22Å; V197-L200 PolarHBondContact O-N 3.38Å; I198-L200 VanDerWaalsContact C-N 3.33Å; I198-L200 PolarHBondContact O-N 3.12Å; L200-I203 PolarHBondContact O-N 3.48Å; L200-I204 PolarHBondContact O-N 3Å
201	I	80.2	Confident	79.7	Confident	4 Å²	4	67.2 Å²	67.2	2%	0.021	34%	0.339	C	S	.	.	H	α-helix	trans	-64.4	-42.7	176.1	-73	168.6	0	0	0	111.3	F108 L188 L192 V197 I198 L199 I203 I204 I205	F108-I201 HydrophobicContact CE1-CD1 3.92Å; F108-I201 HydrophobicContact CE1-CG1 4.1Å; F108-I201 HydrophobicContact CZ-CD1 4.24Å; F108-I201 HydrophobicContact CZ-CG1 4.4Å; L188-I201 HydrophobicContact CB-CD1 4.3Å; L188-I201 HydrophobicContact CB-CG2 3.86Å; L188-I201 HydrophobicContact CD1-CG2 4.04Å; L188-I201 HydrophobicContact CD2-CD1 4.12Å; L188-I201 HydrophobicContact CD2-CG1 4.09Å; L188-I201 HydrophobicContact CD2-CG2 4.01Å; L188-I201 HydrophobicContact CG-CG2 4.18Å; L188-I201 WeakPolarHBondContact O-CD1 3.46Å; L192-I201 HydrophobicContact CB-CD1 4.46Å; L192-I201 HydrophobicContact CD1-CD1 3.62Å; V197-I201 HydrophobicContact CG1-CD1 4.14Å; V197-I201 VanDerWaalsContact O-CG1 3.27Å; V197-I201 WeakPolarHBondContact O-CG1 3.42Å; V197-I201 PolarHBondContact O-N 3.44Å; I198-I201 PolarHBondContact O-N 3.19Å; L199-I201 VanDerWaalsContact C-N 3.31Å; L199-I201 PolarHBondContact O-N 2.89Å; I201-I203 VanDerWaalsContact C-N 3.3Å; I201-I203 PolarHBondContact O-N 2.75Å; I201-I204 WeakPolarHBondContact O-CA 3.43Å; I201-I204 VanDerWaalsContact O-CB 3.27Å; I201-I204 WeakPolarHBondContact O-CB 3.03Å; I201-I204 PolarHBondContact O-N 3.29Å; I201-I205 HydrophobicContact CG2-CD1 3.82Å; I201-I205 HydrophobicContact CG2-CG1 4.39Å; I201-I205 WeakPolarHBondContact O-CG1 3.46Å; I201-I205 PolarHBondContact O-N 3.42Å
202	N	82	Confident	80.9	Confident	83 Å²	83	65.5 Å²	65.5	44%	0.444	33%	0.328	S	S	.	.	H	α-helix	trans	-62	-39	179.3	-74.1	-21.1	0	0	0	111.8	I198 L199 I204 I205 F206	I198-N202 PolarHBondContact O-N 3.38Å; I198-N202 PolarHBondContact O-ND2 2.75Å; L199-N202 PolarHBondContact O-N 3.28Å; N202-I204 VanDerWaalsContact C-N 3.3Å; N202-I204 PolarHBondContact O-N 2.73Å; N202-I205 PolarHBondContact O-N 3.44Å; N202-F206 WeakPolarHBondContact O-CB 3.41Å; N202-F206 PolarHBondContact O-N 2.98Å
203	I	86.6	Confident	81.9	Confident	69 Å²	69	67.9 Å²	67.9	35%	0.354	34%	0.34	S	S	.	.	H	α-helix	trans	-60	-42.6	173.3	-65.1	166.2	0	0	0	110.7	L79 L199 L200 I201 F206 M207	L79-I203 HydrophobicContact CD2-CG2 4.01Å; L199-I203 HydrophobicContact CD2-CD1 4.17Å; L199-I203 WeakPolarHBondContact O-CG1 3.38Å; L199-I203 PolarHBondContact O-N 2.9Å; L199-I203 VanDerWaalsContact O-N 3.1Å; L200-I203 PolarHBondContact O-N 3.48Å; I201-I203 VanDerWaalsContact C-N 3.3Å; I201-I203 PolarHBondContact O-N 2.75Å; I203-F206 PolarHBondContact O-N 3.43Å; I203-M207 HydrophobicContact CG2-CG 4.39Å; I203-M207 WeakPolarHBondContact O-CB 3.34Å; I203-M207 VanDerWaalsContact O-CG 3.25Å; I203-M207 WeakPolarHBondContact O-CG 3Å; I203-M207 PolarHBondContact O-N 3.1Å
204	I	84.6	Confident	83.1	Confident	5 Å²	5	62 Å²	62	3%	0.026	31%	0.313	C	S	.	.	H	α-helix	trans	-61.4	-44.4	176.9	-89.7	-170.9	0	0	0	111.9	Y75 L79 L105 L200 I201 N202 M207 S208	Y75-I204 HydrophobicContact CD2-CD1 3.25Å; Y75-I204 HydrophobicContact CD2-CG1 4.23Å; Y75-I204 HydrophobicContact CE2-CD1 3.13Å; Y75-I204 HydrophobicContact CE2-CG1 3.61Å; Y75-I204 HydrophobicContact CG-CD1 4.17Å; L79-I204 HydrophobicContact CD2-CG1 3.59Å; L79-I204 HydrophobicContact CG-CD1 4.37Å; L79-I204 HydrophobicContact CG-CG1 3.89Å; L105-I204 HydrophobicContact CD1-CG2 3.46Å; L105-I204 VanDerWaalsContact CD1-CG2 3.46Å; L200-I204 PolarHBondContact O-N 3Å; I201-I204 WeakPolarHBondContact O-CA 3.43Å; I201-I204 VanDerWaalsContact O-CB 3.27Å; I201-I204 WeakPolarHBondContact O-CB 3.03Å; I201-I204 PolarHBondContact O-N 3.29Å; N202-I204 VanDerWaalsContact C-N 3.3Å; N202-I204 PolarHBondContact O-N 2.73Å; I204-M207 PolarHBondContact O-N 2.94Å; I204-S208 PolarHBondContact O-N 2.93Å
205	I	83.5	Confident	83.9	Confident	50 Å²	50	56.1 Å²	56.1	26%	0.256	29%	0.285	S	S	.	.	H	α-helix	trans	-65.8	-46.2	179.8	-65.3	168.7	0	0	0	109.2	L188 I201 N202 M207 S208 F209	L188-I205 HydrophobicContact CD1-CD1 4.22Å; L188-I205 HydrophobicContact CD1-CG1 4.36Å; I201-I205 HydrophobicContact CG2-CD1 3.82Å; I201-I205 HydrophobicContact CG2-CG1 4.39Å; I201-I205 WeakPolarHBondContact O-CG1 3.46Å; I201-I205 PolarHBondContact O-N 3.42Å; N202-I205 PolarHBondContact O-N 3.44Å; I205-M207 PolarHBondContact O-N 3.16Å; I205-S208 WeakPolarHBondContact O-CA 3.34Å; I205-S208 WeakPolarHBondContact O-CB 3.33Å; I205-S208 PolarHBondContact O-N 2.85Å; I205-S208 PolarHBondContact O-OG 2.89Å; I205-F209 PolarHBondContact O-N 2.79Å
206	F	87.9	Confident	84.5	Confident	139 Å²	139	48.8 Å²	48.8	61%	0.61	25%	0.254	S	S	*	.	H	α-helix	trans	-58.6	-47	176.6	179.8	-99.7	0	0	0	112.2	N202 I203 S208 F209 A210	N202-F206 WeakPolarHBondContact O-CB 3.41Å; N202-F206 PolarHBondContact O-N 2.98Å; I203-F206 PolarHBondContact O-N 3.43Å; F206-S208 PolarHBondContact O-N 3.28Å; F206-F209 WeakPolarHBondContact O-CB 3.22Å; F206-F209 PolarHBondContact O-N 3.42Å; F206-F209 VanDerWaalsContact O-N 3.1Å; F206-A210 PolarHBondContact O-N 3.22Å
207	M	87.9	Confident	85	Confident	41 Å²	41	52 Å²	52	20%	0.202	26%	0.256	C	S	.	.	H	α-helix	trans	-60.9	-32.7	175.4	-74.6	-64.8	-162.6	0	0	112.1	R82 L83 L86 I203 I204 I205 F209 A210 Y211	R82-M207 HydrophobicContact CB-CB 4.07Å; L83-M207 HydrophobicContact CD2-CE 3.5Å; L83-M207 HydrophobicContact CD2-SD 4.36Å; L83-M207 HydrophobicContact CG-CE 4.46Å; L86-M207 HydrophobicContact CD1-SD 3.88Å; I203-M207 HydrophobicContact CG2-CG 4.39Å; I203-M207 WeakPolarHBondContact O-CB 3.34Å; I203-M207 VanDerWaalsContact O-CG 3.25Å; I203-M207 WeakPolarHBondContact O-CG 3Å; I203-M207 PolarHBondContact O-N 3.1Å; I204-M207 PolarHBondContact O-N 2.94Å; I205-M207 PolarHBondContact O-N 3.16Å; M207-F209 VanDerWaalsContact C-N 3.35Å; M207-A210 PolarHBondContact O-N 3.46Å; M207-Y211 WeakPolarHBondContact O-CD1 3.29Å; M207-Y211 PolarHBondContact O-N 3.22Å
208	S	86.8	Confident	85.5	Confident	3 Å²	3	52.2 Å²	52.2	2%	0.021	26%	0.256	C	S	.	.	H	α-helix	trans	-69.5	-34.5	176.9	80.4	0	0	0	0	113.3	I204 I205 F206 Y211 S212	I204-S208 PolarHBondContact O-N 2.93Å; I205-S208 WeakPolarHBondContact O-CA 3.34Å; I205-S208 WeakPolarHBondContact O-CB 3.33Å; I205-S208 PolarHBondContact O-N 2.85Å; I205-S208 PolarHBondContact O-OG 2.89Å; F206-S208 PolarHBondContact O-N 3.28Å; S208-Y211 VanDerWaalsContact CA-CE1 3.44Å; S208-Y211 WeakPolarHBondContact O-CD1 3.05Å; S208-Y211 VanDerWaalsContact O-CE1 3.3Å; S208-Y211 WeakPolarHBondContact O-CE1 3.11Å; S208-S212 WeakPolarHBondContact O-CB 3.12Å; S208-S212 PolarHBondContact O-N 3.39Å; S208-S212 PolarHBondContact O-OG 3.22Å
209	F	87.7	Confident	85.7	Confident	101 Å²	101	49.9 Å²	49.9	44%	0.443	24%	0.244	S	C	.	.	H	α-helix	trans	-72	-40.8	173.2	-177.5	-96.8	0	0	0	111.9	C173 I205 F206 M207 Y211 S212 I213	C173-F209 VanDerWaalsContact SG-CA 3.55Å; C173-F209 WeakPolarHBondContact SG-CD2 3.35Å; I205-F209 PolarHBondContact O-N 2.79Å; F206-F209 WeakPolarHBondContact O-CB 3.22Å; F206-F209 PolarHBondContact O-N 3.42Å; F206-F209 VanDerWaalsContact O-N 3.1Å; M207-F209 VanDerWaalsContact C-N 3.35Å; F209-Y211 PolarHBondContact O-N 3.01Å; F209-S212 WeakPolarHBondContact CA-OG 3.11Å; F209-S212 PolarHBondContact O-N 3.49Å; F209-S212 PolarHBondContact O-OG 3.12Å; F209-I213 HydrophobicContact CD1-CD1 3.6Å; F209-I213 HydrophobicContact CD1-CG1 4.48Å; F209-I213 HydrophobicContact CE1-CD1 3.08Å; F209-I213 HydrophobicContact CE1-CG1 4.25Å; F209-I213 HydrophobicContact CE2-CD1 4.05Å; F209-I213 HydrophobicContact CG-CD1 4.29Å; F209-I213 HydrophobicContact CZ-CD1 3.33Å; F209-I213 HydrophobicContact CZ-CG1 4.29Å; F209-I213 PolarHBondContact O-N 3.38Å
210	A	90.7	Very high	85.6	Confident	29 Å²	29	50 Å²	50	24%	0.24	24%	0.24	C	C	.	.	H	α-helix	trans	-60.9	-47.7	178.4	0	0	0	0	0	112.4	L86 F206 M207 S212 R214	L86-A210 HydrophobicContact CD2-CB 4.06Å; F206-A210 PolarHBondContact O-N 3.22Å; M207-A210 PolarHBondContact O-N 3.46Å; A210-S212 VanDerWaalsContact C-N 3.34Å; A210-S212 PolarHBondContact O-N 3.11Å; A210-R214 WeakPolarHBondContact O-CB 3.33Å; A210-R214 PolarHBondContact O-N 2.92Å
211	Y	89.1	Confident	85.4	Confident	2 Å²	2	52.6 Å²	52.6	1%	0.008	25%	0.246	C	C	.	.	H	α-helix	trans	-69.2	-32.8	179.2	87.8	-108.6	0	0	0	112.2	R82 M207 S208 F209 R214 L215	R82-Y211 HydrophobicContact CG-CD1 4.24Å; R82-Y211 HydrophobicContact CG-CE1 4.39Å; M207-Y211 WeakPolarHBondContact O-CD1 3.29Å; M207-Y211 PolarHBondContact O-N 3.22Å; S208-Y211 VanDerWaalsContact CA-CE1 3.44Å; S208-Y211 WeakPolarHBondContact O-CD1 3.05Å; S208-Y211 VanDerWaalsContact O-CE1 3.3Å; S208-Y211 WeakPolarHBondContact O-CE1 3.11Å; F209-Y211 PolarHBondContact O-N 3.01Å; Y211-R214 PolarHBondContact O-N 2.83Å; Y211-L215 PolarHBondContact O-N 3.16Å
212	S	87.7	Confident	84.9	Confident	7 Å²	7	52.4 Å²	52.4	5%	0.049	25%	0.245	C	C	.	.	H	α-helix	trans	-70.2	-41.3	-178.5	66.1	0	0	0	0	111.2	C173 S208 F209 A210 L215 A216	C173-S212 PolarHBondContact SG-OG 3.17Å; S208-S212 WeakPolarHBondContact O-CB 3.12Å; S208-S212 PolarHBondContact O-N 3.39Å; S208-S212 PolarHBondContact O-OG 3.22Å; F209-S212 WeakPolarHBondContact CA-OG 3.11Å; F209-S212 PolarHBondContact O-N 3.49Å; F209-S212 PolarHBondContact O-OG 3.12Å; A210-S212 VanDerWaalsContact C-N 3.34Å; A210-S212 PolarHBondContact O-N 3.11Å; S212-L215 PolarHBondContact O-N 3.1Å; S212-A216 PolarHBondContact O-N 3.29Å
213	I	87.9	Confident	84.2	Confident	87 Å²	87	50.9 Å²	50.9	45%	0.446	24%	0.235	S	C	.	.	H	α-helix	trans	-61.7	-46.9	171.2	-72.6	175.2	0	0	0	110.8	F209 L215 A216 Y217	F209-I213 HydrophobicContact CD1-CD1 3.6Å; F209-I213 HydrophobicContact CD1-CG1 4.48Å; F209-I213 HydrophobicContact CE1-CD1 3.08Å; F209-I213 HydrophobicContact CE1-CG1 4.25Å; F209-I213 HydrophobicContact CE2-CD1 4.05Å; F209-I213 HydrophobicContact CG-CD1 4.29Å; F209-I213 HydrophobicContact CZ-CD1 3.33Å; F209-I213 HydrophobicContact CZ-CG1 4.29Å; F209-I213 PolarHBondContact O-N 3.38Å; I213-L215 VanDerWaalsContact C-N 3.28Å; I213-L215 PolarHBondContact O-N 3.49Å; I213-A216 PolarHBondContact O-N 3.14Å; I213-A216 VanDerWaalsContact O-N 3.15Å; I213-Y217 WeakPolarHBondContact O-CB 3.43Å; I213-Y217 PolarHBondContact O-N 3.34Å
214	R	90	Very high	82.8	Confident	67 Å²	67	53.8 Å²	53.8	25%	0.253	25%	0.251	S	S	.	.	H	α-helix	trans	-55.4	-46.8	177.4	174.1	-170.8	151.1	75.8	-2.1	110.8	L86 E88 A210 Y211 Y217 L218	L86-R214 WeakPolarHBondContact O-CD 3.28Å; L86-R214 PolarHBondContact O-NE 2.82Å; E88-R214 PolarHBondContact O-NH2 2.63Å; A210-R214 WeakPolarHBondContact O-CB 3.33Å; A210-R214 PolarHBondContact O-N 2.92Å; Y211-R214 PolarHBondContact O-N 2.83Å; R214-Y217 PolarHBondContact O-N 3.36Å; R214-L218 HydrophobicContact CG-CD1 4.09Å; R214-L218 VanDerWaalsContact O-CG 3.31Å; R214-L218 WeakPolarHBondContact O-CG 3.31Å; R214-L218 PolarHBondContact O-N 3.24Å
215	L	87.4	Confident	81.3	Confident	2 Å²	2	56.1 Å²	56.1	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-63.8	-42.9	179	-174.5	67.8	0	0	0	111.4	L91 I94 L95 I136 L169 Y211 S212 I213 Y217 L218 L219	L91-L215 HydrophobicContact CD2-CD1 3.73Å; I94-L215 HydrophobicContact CD1-CD1 4.16Å; I94-L215 HydrophobicContact CG2-CD1 4.11Å; L95-L215 HydrophobicContact CD2-CD2 3.66Å; I136-L215 HydrophobicContact CD1-CD2 4.47Å; L169-L215 HydrophobicContact CD1-CB 4.25Å; L169-L215 HydrophobicContact CD1-CD2 3.91Å; L169-L215 HydrophobicContact CD1-CG 4.1Å; L169-L215 HydrophobicContact CD2-CD2 3.69Å; L169-L215 HydrophobicContact CG-CD2 4.34Å; Y211-L215 PolarHBondContact O-N 3.16Å; S212-L215 PolarHBondContact O-N 3.1Å; I213-L215 VanDerWaalsContact C-N 3.28Å; I213-L215 PolarHBondContact O-N 3.49Å; L215-Y217 VanDerWaalsContact C-N 3.34Å; L215-Y217 PolarHBondContact O-N 3.31Å; L215-L218 PolarHBondContact O-N 3.44Å; L215-L219 HydrophobicContact CG-CD1 4.2Å; L215-L219 VanDerWaalsContact O-CG 3.28Å; L215-L219 WeakPolarHBondContact O-CG 3.4Å; L215-L219 PolarHBondContact O-N 3.49Å
216	A	86.5	Confident	79.4	Confident	17 Å²	17	59.7 Å²	59.7	14%	0.14	28%	0.283	C	S	.	.	H	α-helix	trans	-60.4	-43.8	175.4	0	0	0	0	0	111.6	L169 S212 I213 L219 F220	L169-A216 HydrophobicContact CD1-CB 4.2Å; S212-A216 PolarHBondContact O-N 3.29Å; I213-A216 PolarHBondContact O-N 3.14Å; I213-A216 VanDerWaalsContact O-N 3.15Å; A216-L219 PolarHBondContact O-N 3Å; A216-F220 VanDerWaalsContact O-CD2 3.22Å; A216-F220 WeakPolarHBondContact O-CD2 3.48Å; A216-F220 PolarHBondContact O-N 3.05Å
217	Y	86.9	Confident	77.3	Confident	143 Å²	143	59.7 Å²	59.7	56%	0.561	29%	0.288	S	S	*	.	H	α-helix	trans	-60.8	-45.7	176.4	173.7	-97.7	0	0	0	112	I213 R214 L215 L219 F220 Y221	I213-Y217 WeakPolarHBondContact O-CB 3.43Å; I213-Y217 PolarHBondContact O-N 3.34Å; R214-Y217 PolarHBondContact O-N 3.36Å; L215-Y217 VanDerWaalsContact C-N 3.34Å; L215-Y217 PolarHBondContact O-N 3.31Å; Y217-L219 VanDerWaalsContact C-N 3.28Å; Y217-L219 PolarHBondContact O-N 3.01Å; Y217-F220 PolarHBondContact O-N 2.97Å; Y217-F220 VanDerWaalsContact O-N 3.17Å; Y217-Y221 WeakPolarHBondContact O-CB 3.5Å; Y217-Y221 PolarHBondContact O-N 2.94Å
218	L	85.1	Confident	75.1	Confident	20 Å²	20	61.2 Å²	61.2	11%	0.105	30%	0.299	C	S	.	.	H	α-helix	trans	-61.1	-38.7	177.7	-71	168.8	0	0	0	112.2	I94 R214 L215 S222	I94-L218 HydrophobicContact CD1-CD1 4.19Å; R214-L218 HydrophobicContact CG-CD1 4.09Å; R214-L218 VanDerWaalsContact O-CG 3.31Å; R214-L218 WeakPolarHBondContact O-CG 3.31Å; R214-L218 PolarHBondContact O-N 3.24Å; L215-L218 PolarHBondContact O-N 3.44Å; L218-S222 PolarHBondContact O-N 3.29Å
219	L	81.2	Confident	72.7	Confident	1 Å²	1	68.1 Å²	68.1	1%	0.005	34%	0.336	C	S	.	.	H	α-helix	trans	-71.5	-28	177.1	-70.8	173.6	0	0	0	113.1	L91 F139 L162 L169 L215 A216 Y217 S222	L91-L219 HydrophobicContact CD1-CD2 4.48Å; L91-L219 HydrophobicContact CD2-CD2 4.22Å; F139-L219 HydrophobicContact CE1-CD2 4.37Å; L162-L219 HydrophobicContact CD2-CB 4.03Å; L162-L219 HydrophobicContact CD2-CD2 4.03Å; L169-L219 HydrophobicContact CD1-CD1 4.42Å; L215-L219 HydrophobicContact CG-CD1 4.2Å; L215-L219 VanDerWaalsContact O-CG 3.28Å; L215-L219 WeakPolarHBondContact O-CG 3.4Å; L215-L219 PolarHBondContact O-N 3.49Å; A216-L219 PolarHBondContact O-N 3Å; Y217-L219 VanDerWaalsContact C-N 3.28Å; Y217-L219 PolarHBondContact O-N 3.01Å; L219-S222 PolarHBondContact O-OG 3.01Å
220	F	78.4	Confident	70.4	Confident	117 Å²	117	65 Å²	65	51%	0.513	33%	0.326	S	S	.	.	H	α-helix	trans	-82.5	-39	173.3	-83.2	-61.7	0	0	0	112.7	I166 A216 Y217 S222 F223	I166-F220 HydrophobicContact CD1-CD1 4.43Å; I166-F220 HydrophobicContact CD1-CD2 4Å; I166-F220 HydrophobicContact CD1-CE1 3.76Å; I166-F220 HydrophobicContact CD1-CE2 3.26Å; I166-F220 HydrophobicContact CD1-CZ 3.13Å; I166-F220 HydrophobicContact CG1-CE2 4.1Å; I166-F220 HydrophobicContact CG1-CZ 4.36Å; A216-F220 VanDerWaalsContact O-CD2 3.22Å; A216-F220 WeakPolarHBondContact O-CD2 3.48Å; A216-F220 PolarHBondContact O-N 3.05Å; Y217-F220 PolarHBondContact O-N 2.97Å; Y217-F220 VanDerWaalsContact O-N 3.17Å; F220-S222 PolarHBondContact O-N 3.34Å; F220-F223 WeakPolarHBondContact O-CB 3.41Å; F220-F223 PolarHBondContact O-N 3.26Å
221	Y	75.7	Confident	67.9	Low	117 Å²	117	72.1 Å²	72.1	46%	0.459	35%	0.352	S	S	.	.	H	α-helix	trans	-58.4	-34.8	179.3	-176.5	-95.9	0	0	0	111.4	Y217 F223 N224	Y217-Y221 WeakPolarHBondContact O-CB 3.5Å; Y217-Y221 PolarHBondContact O-N 2.94Å; Y221-F223 PolarHBondContact O-N 3.49Å; Y221-F223 VanDerWaalsContact O-N 3.11Å; Y221-N224 PolarHBondContact O-N 3.14Å
222	S	70.4	Confident	65.4	Low	1 Å²	1	75.2 Å²	75.2	1%	0.007	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-60.5	-21.2	175.5	67.5	0	0	0	0	114.2	L152 C153 T154 L218 L219 F220 N224 N225	L152-S222 VanDerWaalsContact O-CA 3.31Å; L152-S222 WeakPolarHBondContact O-CA 3.34Å; L152-S222 VanDerWaalsContact O-CB 3.28Å; L152-S222 WeakPolarHBondContact O-CB 3.38Å; C153-S222 CarbonylContact C-O 3.58Å; C153-S222 WeakPolarHBondContact CA-O 3.43Å; T154-S222 WeakPolarHBondContact CG2-OG 3.49Å; T154-S222 PolarHBondContact N-O 3.16Å; T154-S222 VanDerWaalsContact OG1-C 3.25Å; T154-S222 PolarHBondContact OG1-O 3Å; T154-S222 PolarHBondContact OG1-OG 3.46Å; L218-S222 PolarHBondContact O-N 3.29Å; L219-S222 PolarHBondContact O-OG 3.01Å; F220-S222 PolarHBondContact O-N 3.34Å; S222-N224 VanDerWaalsContact C-N 3.31Å; S222-N224 PolarHBondContact O-N 3.41Å; S222-N225 PolarHBondContact O-N 3.44Å
223	F	65.9	Low	63	Low	50 Å²	50	81 Å²	81	22%	0.219	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-70.8	-24.3	-179.8	-157.4	-90.2	0	0	0	113.8	T154 E156 L159 L162 F220 Y221 N225	T154-F223 WeakPolarHBondContact OG1-CA 3.39Å; T154-F223 WeakPolarHBondContact OG1-CD2 3.38Å; T154-F223 PolarHBondContact OG1-N 2.87Å; T154-F223 VanDerWaalsContact OG1-N 3.14Å; E156-F223 HydrophobicContact CB-CZ 4.42Å; E156-F223 HydrophobicContact CG-CZ 3.88Å; L159-F223 HydrophobicContact CB-CE2 3.94Å; L159-F223 HydrophobicContact CD1-CE1 4.25Å; L159-F223 HydrophobicContact CD1-CE2 3.55Å; L159-F223 HydrophobicContact CD1-CZ 3.34Å; L159-F223 HydrophobicContact CG-CD2 4.48Å; L159-F223 HydrophobicContact CG-CE2 3.69Å; L159-F223 HydrophobicContact CG-CZ 4.04Å; L162-F223 HydrophobicContact CD1-CD2 4.05Å; F220-F223 WeakPolarHBondContact O-CB 3.41Å; F220-F223 PolarHBondContact O-N 3.26Å; Y221-F223 PolarHBondContact O-N 3.49Å; Y221-F223 VanDerWaalsContact O-N 3.11Å; F223-N225 VanDerWaalsContact C-N 3.33Å; F223-N225 PolarHBondContact O-N 3.29Å
224	N	57.1	Low	60.8	Low	131 Å²	131	84.7 Å²	84.7	70%	0.701	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-78.1	-17.4	179.3	-98.2	1.8	0	0	0	113.9	Y221 S222 N226	Y221-N224 PolarHBondContact O-N 3.14Å; S222-N224 VanDerWaalsContact C-N 3.31Å; S222-N224 PolarHBondContact O-N 3.41Å; N224-N226 PolarHBondContact O-N 3.3Å; N224-N226 VanDerWaalsContact O-N 3.12Å
225	N	53.3	Low	58.4	Low	53 Å²	53	87.6 Å²	87.6	28%	0.283	44%	0.437	S	S	.	.			trans	-90.3	79	-176.4	-65.8	-18.9	0	0	0	110.5	C153 S222 F223 I227	C153-N225 HydrophobicContact CB-CB 4.03Å; C153-N225 VanDerWaalsContact CB-O 3.23Å; C153-N225 WeakPolarHBondContact CB-O 3.37Å; C153-N225 WeakPolarHBondContact SG-CB 3.38Å; S222-N225 PolarHBondContact O-N 3.44Å; F223-N225 VanDerWaalsContact C-N 3.33Å; F223-N225 PolarHBondContact O-N 3.29Å; N225-I227 PolarHBondContact O-N 3.23Å
226	N	43.5	Very low	56.4	Low	126 Å²	126	89.1 Å²	89.1	67%	0.674	45%	0.449	S	S	*	.			trans	-70.8	92.3	179.7	-72.8	-25.8	0	0	0	111.9	N224	N224-N226 PolarHBondContact O-N 3.3Å; N224-N226 VanDerWaalsContact O-N 3.12Å
227	I	44.6	Very low	54.5	Low	139 Å²	139	91 Å²	91	71%	0.713	46%	0.456	S	S	*	.			trans	-130.3	-17.2	173.7	-62.1	-178.7	0	0	0	115.6	N225	N225-I227 PolarHBondContact O-N 3.23Å
228	V	41.6	Very low	52.7	Low	72 Å²	72	91.7 Å²	91.7	44%	0.436	46%	0.459	S	S	.	.			trans	-140.1	107.7	-172.4	-170.6	0	0	0	0	113	N155 P230	N155-V228 PolarHBondContact ND2-O 3.17Å; N155-V228 PolarHBondContact OD1-O 2.61Å; V228-P230 VanDerWaalsContact C-CD 3.47Å; V228-P230 WeakPolarHBondContact O-CD 3.32Å
229	N	35.7	Very low	51.1	Low	148 Å²	148	95.6 Å²	95.6	79%	0.791	48%	0.478	S	S	*	.			trans	-80.9	97.8	170	-77.5	-22	0	0	0	112.6	N155	N155-N229 VanDerWaalsContact ND2-CA 3.28Å; N155-N229 WeakPolarHBondContact ND2-CA 3.39Å; N155-N229 PolarHBondContact ND2-N 3.14Å; N155-N229 PolarHBondContact ND2-OD1 3.04Å
230	P	40.4	Very low	49.7	Very low	37 Å²	37	96 Å²	96	24%	0.24	48%	0.481	C	S	.	.			trans	-89.6	118.2	156.2	33.6	-33	0	0	0	109.2	V228 T232	V228-P230 VanDerWaalsContact C-CD 3.47Å; V228-P230 WeakPolarHBondContact O-CD 3.32Å; P230-T232 PolarHBondContact O-N 3.28Å
231	K	38	Very low	48.8	Very low	177 Å²	177	93 Å²	93	77%	0.77	47%	0.469	S	S	*	.			trans	-83.5	81.3	162.9	-73.4	-179.3	176	-177.9	0	108.7
232	T	37.1	Very low	48.2	Very low	67 Å²	67	92.3 Å²	92.3	41%	0.411	47%	0.473	S	S	.	.			trans	-147.6	97.6	160.4	42.8	0	0	0	0	109.3	P230	P230-T232 PolarHBondContact O-N 3.28Å
233	L	35.6	Very low	47.8	Very low	129 Å²	129	95.3 Å²	95.3	68%	0.675	49%	0.486	S	S	*	.			trans	-80.4	118	166.7	-88.3	149	0	0	0	107.8	L237	L233-L237 HydrophobicContact CD2-CD1 4.33Å
234	Y	42.8	Very low	47.8	Very low	165 Å²	165	94.1 Å²	94.1	65%	0.647	48%	0.482	S	S	*	.			trans	-101.6	144.3	166.5	-71.1	-73.4	0	0	0	110.5	F142 S236	F142-Y234 HydrophobicContact CZ-CD2 4.35Å; Y234-S236 PolarHBondContact O-N 3.03Å
235	P	38.5	Very low	48.2	Very low	127 Å²	127	88.3 Å²	88.3	83%	0.825	45%	0.451	S	S	*	.	S	Bend	trans	-73.4	92.9	-173.8	31.8	-33.8	0	0	0	109.4
236	S	46.1	Very low	48.9	Very low	35 Å²	35	89.8 Å²	89.8	25%	0.245	46%	0.459	C	S	.	.			trans	-147.7	20.4	160.5	71.2	0	0	0	0	113.8	R135 Y234 Y238 N240	R135-S236 PolarHBondContact NH1-OG 3.04Å; Y234-S236 PolarHBondContact O-N 3.03Å; S236-Y238 VanDerWaalsContact C-N 3.29Å; S236-Y238 PolarHBondContact O-N 3.46Å; S236-N240 PolarHBondContact O-ND2 3.37Å
237	L	47.4	Very low	50.1	Low	55 Å²	55	84.2 Å²	84.2	29%	0.288	43%	0.43	S	S	.	.	H	α-helix	trans	-61.3	-35.8	171.5	-89.1	159.1	0	0	0	112.3	P160 L233 N240 F292	P160-L237 HydrophobicContact CB-CD2 3.22Å; P160-L237 HydrophobicContact CB-CG 4.14Å; P160-L237 HydrophobicContact CG-CD2 3.77Å; P160-L237 HydrophobicContact CG-CG 4.32Å; L233-L237 HydrophobicContact CD2-CD1 4.33Å; L237-N240 VanDerWaalsContact O-CB 3.32Å; L237-N240 WeakPolarHBondContact O-CB 3.38Å; L237-N240 PolarHBondContact O-N 2.9Å; L237-F292 HydrophobicContact CD1-CE2 4.46Å
238	Y	47.6	Very low	51.2	Low	159 Å²	159	78.2 Å²	78.2	62%	0.624	40%	0.399	S	S	*	.	H	α-helix	trans	-73.1	-39.9	-176	-86	-84.4	0	0	0	114.2	S236 N240 F292	S236-Y238 VanDerWaalsContact C-N 3.29Å; S236-Y238 PolarHBondContact O-N 3.46Å; Y238-N240 PolarHBondContact O-N 3.47Å; Y238-F292 HydrophobicContact CE2-CE1 4.17Å; Y238-F292 HydrophobicContact CE2-CZ 4.15Å; Y238-F292 AromaticContact CZ-CE1 4Å; Y238-F292 VanDerWaalsContact OH-CE1 3.26Å; Y238-F292 WeakPolarHBondContact OH-CE1 3.39Å
239	I	53	Low	52.5	Low	101 Å²	101	76.6 Å²	76.6	52%	0.518	39%	0.392	S	S	.	.	H	α-helix	trans	-66.2	-23.5	178.8	-62.5	166.8	0	0	0	110.9
240	N	51.8	Low	54	Low	11 Å²	11	72.4 Å²	72.4	6%	0.059	37%	0.369	C	S	.	.	H	α-helix	trans	-76.3	-27.9	-172	-101.1	-11.4	0	0	0	114.1	R135 P160 T164 S236 L237 Y238	R135-N240 VanDerWaalsContact CZ-CG 3.47Å; R135-N240 PolarHBondContact NE-OD1 3.03Å; R135-N240 PolarHBondContact NH2-OD1 3.2Å; P160-N240 PolarHBondContact O-ND2 3.11Å; T164-N240 WeakPolarHBondContact CB-OD1 3.39Å; T164-N240 HydrophobicContact CG2-CB 3.18Å; T164-N240 WeakPolarHBondContact CG2-ND2 3.46Å; T164-N240 WeakPolarHBondContact CG2-O 3.33Å; T164-N240 WeakPolarHBondContact CG2-OD1 3.35Å; T164-N240 PolarHBondContact OG1-ND2 3.34Å; T164-N240 PolarHBondContact OG1-OD1 3.33Å; S236-N240 PolarHBondContact O-ND2 3.37Å; L237-N240 VanDerWaalsContact O-CB 3.32Å; L237-N240 WeakPolarHBondContact O-CB 3.38Å; L237-N240 PolarHBondContact O-N 2.9Å; Y238-N240 PolarHBondContact O-N 3.47Å
241	I	58.9	Low	55.3	Low	53 Å²	53	70.7 Å²	70.7	27%	0.272	36%	0.358	S	S	.	.	H	α-helix	trans	-89.3	-25.2	-174.9	-69.4	167.4	0	0	0	111.6	F243 P245 N288	I241-F243 VanDerWaalsContact C-N 3.34Å; I241-F243 PolarHBondContact O-N 3.45Å; I241-P245 WeakPolarHBondContact O-CD 3.48Å; I241-N288 HydrophobicContact CD1-CB 4.23Å; I241-N288 HydrophobicContact CG2-CB 3.34Å; I241-N288 VanDerWaalsContact CG2-CG 3.44Å
242	L	61.9	Low	56.6	Low	103 Å²	103	66.5 Å²	66.5	54%	0.539	34%	0.337	S	S	.	.	H	α-helix	trans	-74.4	-21	-178.2	-76.1	165.4	0	0	0	113.8	P245 L246	L242-P245 WeakPolarHBondContact O-CD 3.26Å; L242-L246 HydrophobicContact CB-CD1 4.36Å; L242-L246 WeakPolarHBondContact O-CB 3.39Å; L242-L246 WeakPolarHBondContact O-CD1 3.45Å; L242-L246 PolarHBondContact O-N 2.98Å
243	F	63.4	Low	58.2	Low	63 Å²	63	67.3 Å²	67.3	28%	0.276	34%	0.338	S	S	.	.	H	α-helix	trans	-71.6	-36.4	-171.3	-112.3	-76.7	0	0	0	114.7	L131 I241 L246 A247	L131-F243 HydrophobicContact CD1-CD1 3.6Å; L131-F243 HydrophobicContact CD1-CD2 3.92Å; L131-F243 HydrophobicContact CD1-CE1 3.16Å; L131-F243 HydrophobicContact CD1-CE2 3.51Å; L131-F243 HydrophobicContact CD1-CG 3.97Å; L131-F243 HydrophobicContact CD1-CZ 3.14Å; L131-F243 HydrophobicContact CD2-CD2 4.11Å; L131-F243 HydrophobicContact CD2-CE2 3.76Å; L131-F243 HydrophobicContact CD2-CZ 4.21Å; L131-F243 HydrophobicContact CG-CE2 4.24Å; L131-F243 HydrophobicContact CG-CZ 4.2Å; I241-F243 VanDerWaalsContact C-N 3.34Å; I241-F243 PolarHBondContact O-N 3.45Å; F243-L246 PolarHBondContact O-N 3.42Å; F243-A247 WeakPolarHBondContact O-CB 3.4Å; F243-A247 PolarHBondContact O-N 3.4Å
244	L	64.7	Low	59.6	Low	26 Å²	26	62.3 Å²	62.3	14%	0.136	31%	0.311	C	S	.	.	H	α-helix	trans	-68.8	-45.8	177.1	-169.5	143.7	0	0	0	111.5	I167 L246 A247 L248 F284	I167-L244 HydrophobicContact CB-CD1 4.34Å; I167-L244 HydrophobicContact CD1-CB 4.48Å; I167-L244 HydrophobicContact CD1-CD1 4.28Å; I167-L244 HydrophobicContact CG1-CD1 3.82Å; I167-L244 HydrophobicContact CG2-CB 3.76Å; I167-L244 HydrophobicContact CG2-CD1 3.86Å; I167-L244 HydrophobicContact CG2-CG 4.29Å; L244-L246 VanDerWaalsContact C-N 3.33Å; L244-L246 PolarHBondContact O-N 2.88Å; L244-A247 PolarHBondContact O-N 3.12Å; L244-L248 HydrophobicContact CD2-CD1 3.54Å; L244-L248 HydrophobicContact CD2-CG 4.23Å; L244-L248 HydrophobicContact CG-CD1 4.47Å; L244-L248 WeakPolarHBondContact O-CG 3.47Å; L244-L248 PolarHBondContact O-N 3Å; L244-F284 HydrophobicContact CD1-CE1 4.3Å; L244-F284 HydrophobicContact CD1-CZ 4.21Å; L244-F284 HydrophobicContact CD2-CD1 3.78Å; L244-F284 HydrophobicContact CD2-CD2 3.73Å; L244-F284 HydrophobicContact CD2-CE1 3.79Å; L244-F284 HydrophobicContact CD2-CE2 3.7Å; L244-F284 HydrophobicContact CD2-CG 3.77Å; L244-F284 HydrophobicContact CD2-CZ 3.75Å
245	P	66.1	Low	60.8	Low	9 Å²	9	55 Å²	55	6%	0.058	28%	0.283	C	S	.	.	H	α-helix	trans	-54.5	-44.9	169.6	-25.8	31.2	0	0	0	113.5	I241 L242 A247 L248 S249 T281 F284 I285	I241-P245 WeakPolarHBondContact O-CD 3.48Å; L242-P245 WeakPolarHBondContact O-CD 3.26Å; P245-A247 PolarHBondContact O-N 2.78Å; P245-L248 PolarHBondContact O-N 3.5Å; P245-S249 WeakPolarHBondContact O-CB 3.42Å; P245-S249 PolarHBondContact O-N 3.11Å; P245-S249 PolarHBondContact O-OG 3.01Å; P245-T281 WeakPolarHBondContact O-CG2 3.4Å; P245-F284 HydrophobicContact CG-CB 4.1Å; P245-I285 HydrophobicContact CB-CD1 4.16Å; P245-I285 HydrophobicContact CB-CG1 3.96Å; P245-I285 HydrophobicContact CG-CG1 4Å
246	L	68.1	Low	62	Low	83 Å²	83	54.2 Å²	54.2	44%	0.435	27%	0.268	S	S	.	.	H	α-helix	trans	-64.3	-39.1	178.4	-93.8	150.9	0	0	0	112.8	L242 F243 L244 S249 N250	L242-L246 HydrophobicContact CB-CD1 4.36Å; L242-L246 WeakPolarHBondContact O-CB 3.39Å; L242-L246 WeakPolarHBondContact O-CD1 3.45Å; L242-L246 PolarHBondContact O-N 2.98Å; F243-L246 PolarHBondContact O-N 3.42Å; L244-L246 VanDerWaalsContact C-N 3.33Å; L244-L246 PolarHBondContact O-N 2.88Å; L246-S249 WeakPolarHBondContact CA-OG 3.3Å; L246-S249 PolarHBondContact O-OG 3.2Å; L246-N250 WeakPolarHBondContact O-CB 3.21Å; L246-N250 PolarHBondContact O-N 2.88Å
247	A	67.9	Low	63	Low	9 Å²	9	57.6 Å²	57.6	7%	0.074	28%	0.283	C	S	.	.	H	α-helix	trans	-68.8	-36.8	177.5	0	0	0	0	0	112.1	I171 S179 F243 L244 P245 G251	I171-A247 HydrophobicContact CD1-CB 3.54Å; I171-A247 HydrophobicContact CG1-CB 3.82Å; I171-A247 HydrophobicContact CG2-CB 4.39Å; S179-A247 PolarHBondContact N-O 2.89Å; F243-A247 WeakPolarHBondContact O-CB 3.4Å; F243-A247 PolarHBondContact O-N 3.4Å; L244-A247 PolarHBondContact O-N 3.12Å; P245-A247 PolarHBondContact O-N 2.78Å; A247-G251 PolarHBondContact O-N 2.98Å
248	L	68.4	Low	63.7	Low	13 Å²	13	58 Å²	58	7%	0.068	28%	0.282	C	S	.	.	H	α-helix	trans	-72.3	-41.1	175.4	-70.7	176.2	0	0	0	111.9	F177 L244 P245 N250 G251 W252 L280 T281	F177-L248 HydrophobicContact CB-CD2 3.96Å; L244-L248 HydrophobicContact CD2-CD1 3.54Å; L244-L248 HydrophobicContact CD2-CG 4.23Å; L244-L248 HydrophobicContact CG-CD1 4.47Å; L244-L248 WeakPolarHBondContact O-CG 3.47Å; L244-L248 PolarHBondContact O-N 3Å; P245-L248 PolarHBondContact O-N 3.5Å; L248-N250 VanDerWaalsContact C-N 3.32Å; L248-N250 PolarHBondContact O-N 3.17Å; L248-G251 PolarHBondContact O-N 3.42Å; L248-G251 VanDerWaalsContact O-N 3.16Å; L248-W252 PolarHBondContact O-N 2.86Å; L248-L280 HydrophobicContact CD1-CB 4.02Å; L248-T281 HydrophobicContact CB-CG2 3.38Å; L248-T281 HydrophobicContact CD1-CG2 4.08Å; L248-T281 HydrophobicContact CG-CG2 4.41Å
249	S	68.8	Low	64.1	Low	39 Å²	39	53.3 Å²	53.3	27%	0.273	27%	0.272	S	S	.	.	H	α-helix	trans	-64	-38.7	175.5	67.9	0	0	0	0	111.5	P245 L246 W252 I253	P245-S249 WeakPolarHBondContact O-CB 3.42Å; P245-S249 PolarHBondContact O-N 3.11Å; P245-S249 PolarHBondContact O-OG 3.01Å; L246-S249 WeakPolarHBondContact CA-OG 3.3Å; L246-S249 PolarHBondContact O-OG 3.2Å; S249-W252 WeakPolarHBondContact O-CB 3.39Å; S249-W252 PolarHBondContact O-N 3.31Å; S249-I253 WeakPolarHBondContact O-CG1 3.47Å; S249-I253 PolarHBondContact O-N 3.49Å; S249-I253 VanDerWaalsContact O-N 3.14Å
250	N	67.9	Low	64.3	Low	60 Å²	60	49.7 Å²	49.7	32%	0.321	25%	0.254	S	S	.	.	H	α-helix	trans	-66.5	-39.8	172.5	-77.3	-9.2	0	0	0	111.6	L246 L248 W252 I253 F254	L246-N250 WeakPolarHBondContact O-CB 3.21Å; L246-N250 PolarHBondContact O-N 2.88Å; L248-N250 VanDerWaalsContact C-N 3.32Å; L248-N250 PolarHBondContact O-N 3.17Å; N250-W252 VanDerWaalsContact C-N 3.27Å; N250-W252 PolarHBondContact O-N 2.88Å; N250-I253 PolarHBondContact O-N 2.92Å; N250-F254 WeakPolarHBondContact O-CD2 3.45Å; N250-F254 PolarHBondContact O-N 3.19Å; N250-F254 VanDerWaalsContact O-N 3.08Å
251	G	67.4	Low	64.3	Low	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-58.2	-40.3	172.5	0	0	0	0	0	112.3	A247 L248 F254 I255	A247-G251 PolarHBondContact O-N 2.98Å; L248-G251 PolarHBondContact O-N 3.42Å; L248-G251 VanDerWaalsContact O-N 3.16Å; G251-F254 WeakPolarHBondContact O-CB 3.22Å; G251-F254 PolarHBondContact O-N 2.85Å; G251-F254 VanDerWaalsContact O-N 3.15Å; G251-I255 WeakPolarHBondContact O-CG1 3.23Å; G251-I255 PolarHBondContact O-N 3.06Å
252	W	66.2	Low	63.8	Low	89 Å²	89	53.9 Å²	53.9	34%	0.337	28%	0.279	S	S	.	.	H	α-helix	trans	-59.8	-46	175.7	-168	48.7	0	0	0	112.7	L248 S249 N250 F254 I255 H256 L274 P277 L278	L248-W252 PolarHBondContact O-N 2.86Å; S249-W252 WeakPolarHBondContact O-CB 3.39Å; S249-W252 PolarHBondContact O-N 3.31Å; N250-W252 VanDerWaalsContact C-N 3.27Å; N250-W252 PolarHBondContact O-N 2.88Å; W252-F254 VanDerWaalsContact C-N 3.28Å; W252-F254 PolarHBondContact O-N 3.35Å; W252-I255 PolarHBondContact O-N 3.16Å; W252-H256 PolarHBondContact O-N 3.07Å; W252-H256 VanDerWaalsContact O-N 3.08Å; W252-L274 HydrophobicContact CG-CD2 4.15Å; W252-L274 PolarHBondContact NE1-O 3.05Å; W252-P277 HydrophobicContact CB-CG 4.32Å; W252-P277 HydrophobicContact CG-CG 4.24Å; W252-L278 HydrophobicContact CD2-CD1 4.36Å; W252-L278 HydrophobicContact CD2-CG 4.25Å; W252-L278 HydrophobicContact CE3-CD1 4.42Å; W252-L278 HydrophobicContact CE3-CG 4.22Å; W252-L278 HydrophobicContact CH2-CD1 3.3Å; W252-L278 HydrophobicContact CH2-CG 3.94Å; W252-L278 HydrophobicContact CZ2-CD1 3.16Å; W252-L278 HydrophobicContact CZ2-CG 3.94Å; W252-L278 HydrophobicContact CZ3-CD1 3.92Å; W252-L278 HydrophobicContact CZ3-CG 4.05Å
253	I	69.9	Low	62.9	Low	84 Å²	84	53.2 Å²	53.2	43%	0.431	28%	0.277	S	S	.	.	H	α-helix	trans	-60.9	-38.3	174.9	-64.2	163.7	0	0	0	111	S249 N250 H256 N257	S249-I253 WeakPolarHBondContact O-CG1 3.47Å; S249-I253 PolarHBondContact O-N 3.49Å; S249-I253 VanDerWaalsContact O-N 3.14Å; N250-I253 PolarHBondContact O-N 2.92Å; I253-H256 PolarHBondContact O-N 2.86Å; I253-N257 PolarHBondContact O-N 3.31Å; I253-N257 VanDerWaalsContact O-N 3.07Å
254	F	65.9	Low	62.2	Low	25 Å²	25	55.1 Å²	55.1	11%	0.11	29%	0.293	C	S	.	.	H	α-helix	trans	-63.2	-46	176.4	-88.5	-68.4	0	0	0	113	I120 Y182 N250 G251 W252 H256 N257 Y258	I120-F254 HydrophobicContact CB-CE1 4.37Å; I120-F254 HydrophobicContact CB-CZ 4.08Å; I120-F254 HydrophobicContact CD1-CE1 3.63Å; I120-F254 HydrophobicContact CD1-CZ 3.75Å; I120-F254 HydrophobicContact CG1-CE1 4.35Å; I120-F254 HydrophobicContact CG1-CZ 4.05Å; I120-F254 HydrophobicContact CG2-CE1 3.43Å; I120-F254 VanDerWaalsContact CG2-CE1 3.43Å; I120-F254 HydrophobicContact CG2-CE2 3.75Å; I120-F254 HydrophobicContact CG2-CZ 3.01Å; Y182-F254 HydrophobicContact CD2-CB 4.15Å; Y182-F254 HydrophobicContact CG-CB 4.11Å; N250-F254 WeakPolarHBondContact O-CD2 3.45Å; N250-F254 PolarHBondContact O-N 3.19Å; N250-F254 VanDerWaalsContact O-N 3.08Å; G251-F254 WeakPolarHBondContact O-CB 3.22Å; G251-F254 PolarHBondContact O-N 2.85Å; G251-F254 VanDerWaalsContact O-N 3.15Å; W252-F254 VanDerWaalsContact C-N 3.28Å; W252-F254 PolarHBondContact O-N 3.35Å; F254-H256 VanDerWaalsContact C-N 3.27Å; F254-H256 PolarHBondContact O-N 3.48Å; F254-N257 PolarHBondContact O-N 2.85Å; F254-Y258 AromaticContact CD1-CD2 3.69Å; F254-Y258 HydrophobicContact CD1-CD2 3.69Å; F254-Y258 AromaticContact CD1-CE2 3.96Å; F254-Y258 HydrophobicContact CD1-CE2 3.96Å; F254-Y258 HydrophobicContact CE1-CD2 4.05Å; F254-Y258 AromaticContact CE1-CE2 3.82Å; F254-Y258 HydrophobicContact CE1-CE2 3.82Å; F254-Y258 WeakPolarHBondContact O-CA 3.49Å; F254-Y258 WeakPolarHBondContact O-CB 3.43Å; F254-Y258 PolarHBondContact O-N 3.43Å
255	I	65.9	Low	61.4	Low	12 Å²	12	57.3 Å²	57.3	6%	0.062	31%	0.308	C	S	.	.	H	α-helix	trans	-60.1	-42	177.1	-61.3	159.5	0	0	0	110.5	F177 Y182 G251 W252 Y258 K270 L274 P277	F177-I255 HydrophobicContact CD1-CD1 4.32Å; Y182-I255 HydrophobicContact CD1-CG1 4.07Å; Y182-I255 HydrophobicContact CD2-CG1 4.18Å; Y182-I255 HydrophobicContact CE1-CD1 4.13Å; Y182-I255 HydrophobicContact CE1-CG1 3.4Å; Y182-I255 VanDerWaalsContact CE1-CG1 3.4Å; Y182-I255 HydrophobicContact CE2-CD1 3.69Å; Y182-I255 HydrophobicContact CE2-CG1 3.51Å; Y182-I255 HydrophobicContact CG-CG1 4.44Å; Y182-I255 WeakPolarHBondContact OH-CD1 3.01Å; Y182-I255 VanDerWaalsContact OH-CG1 3.31Å; Y182-I255 WeakPolarHBondContact OH-CG1 3.34Å; G251-I255 WeakPolarHBondContact O-CG1 3.23Å; G251-I255 PolarHBondContact O-N 3.06Å; W252-I255 PolarHBondContact O-N 3.16Å; I255-Y258 VanDerWaalsContact O-O 3.14Å; I255-K270 WeakPolarHBondContact O-CE 3.45Å; I255-K270 PolarHBondContact O-NZ 3.18Å; I255-L274 HydrophobicContact CB-CD2 3.73Å; I255-L274 HydrophobicContact CG2-CD2 3.58Å; I255-L274 HydrophobicContact CG2-CG 3.99Å; I255-P277 HydrophobicContact CD1-CG 4.34Å
256	H	65.5	Low	60.7	Low	110 Å²	110	62.2 Å²	62.2	51%	0.509	33%	0.325	S	S	.	.	H	α-helix	trans	-64.2	-48.7	-177.2	-168.2	-76.2	0	0	0	110.9	W252 I253 F254 K270 L274	W252-H256 PolarHBondContact O-N 3.07Å; W252-H256 VanDerWaalsContact O-N 3.08Å; I253-H256 PolarHBondContact O-N 2.86Å; F254-H256 VanDerWaalsContact C-N 3.27Å; F254-H256 PolarHBondContact O-N 3.48Å; H256-K270 PolarHBondContact O-NZ 2.68Å; H256-L274 HydrophobicContact CB-CD2 4.14Å
257	N	66.4	Low	59.9	Low	105 Å²	105	62.6 Å²	62.6	56%	0.561	33%	0.327	S	S	*	.	H	α-helix	trans	-80.8	-29.3	-174.1	-66.9	-8.8	0	0	0	113.4	I253 F254	I253-N257 PolarHBondContact O-N 3.31Å; I253-N257 VanDerWaalsContact O-N 3.07Å; F254-N257 PolarHBondContact O-N 2.85Å
258	Y	62.3	Low	59.3	Low	65 Å²	65	68.3 Å²	68.3	26%	0.255	36%	0.356	S	S	.	.	S	Bend	trans	-124.4	109.9	-176.4	-57.6	-83.7	0	0	0	109.2	L117 Y186 F254 I255 L260	L117-Y258 HydrophobicContact CD2-CD1 4.05Å; L117-Y258 HydrophobicContact CD2-CD2 4.46Å; L117-Y258 HydrophobicContact CD2-CE1 3.99Å; L117-Y258 HydrophobicContact CD2-CE2 4.4Å; L117-Y258 HydrophobicContact CD2-CG 4.29Å; Y186-Y258 WeakPolarHBondContact OH-CA 3.43Å; Y186-Y258 VanDerWaalsContact OH-CB 3.26Å; Y186-Y258 WeakPolarHBondContact OH-CB 3.49Å; Y186-Y258 PolarHBondContact OH-O 3.41Å; Y186-Y258 VanDerWaalsContact OH-O 3.05Å; F254-Y258 AromaticContact CD1-CD2 3.69Å; F254-Y258 HydrophobicContact CD1-CD2 3.69Å; F254-Y258 AromaticContact CD1-CE2 3.96Å; F254-Y258 HydrophobicContact CD1-CE2 3.96Å; F254-Y258 HydrophobicContact CE1-CD2 4.05Å; F254-Y258 AromaticContact CE1-CE2 3.82Å; F254-Y258 HydrophobicContact CE1-CE2 3.82Å; F254-Y258 WeakPolarHBondContact O-CA 3.49Å; F254-Y258 WeakPolarHBondContact O-CB 3.43Å; F254-Y258 PolarHBondContact O-N 3.43Å; I255-Y258 VanDerWaalsContact O-O 3.14Å; Y258-L260 PolarHBondContact O-N 3.33Å
259	S	56.3	Low	58.8	Low	60 Å²	60	71.9 Å²	71.9	42%	0.42	38%	0.375	S	S	.	.			trans	-78.4	106.1	173.1	52	0	0	0	0	112.1	Y186	Y186-S259 WeakPolarHBondContact OH-CA 3.45Å; Y186-S259 PolarHBondContact OH-N 3.09Å; Y186-S259 PolarHBondContact OH-O 2.96Å
260	L	55.7	Low	58.4	Low	25 Å²	25	72.5 Å²	72.5	13%	0.131	37%	0.373	C	S	.	.			trans	-51.7	132.8	-176.1	-85.6	161.9	0	0	0	109.3	Y181 Y182 E185 Y186 Y258 I262	Y181-L260 HydrophobicContact CE1-CD1 4.38Å; Y182-L260 HydrophobicContact CD1-CD1 3.74Å; Y182-L260 HydrophobicContact CD1-CG 4.27Å; Y182-L260 HydrophobicContact CE1-CD1 3.66Å; E185-L260 HydrophobicContact CB-CD2 4.28Å; Y186-L260 HydrophobicContact CD2-CD2 3.58Å; Y186-L260 HydrophobicContact CD2-CG 4.25Å; Y186-L260 HydrophobicContact CE2-CB 4.42Å; Y186-L260 HydrophobicContact CE2-CD2 3.5Å; Y186-L260 VanDerWaalsContact CE2-CD2 3.5Å; Y186-L260 HydrophobicContact CE2-CG 3.68Å; Y186-L260 HydrophobicContact CG-CD2 4.27Å; Y186-L260 VanDerWaalsContact OH-CA 3.29Å; Y186-L260 WeakPolarHBondContact OH-CA 3.42Å; Y186-L260 PolarHBondContact OH-N 3.16Å; Y258-L260 PolarHBondContact O-N 3.33Å; L260-I262 PolarHBondContact O-N 3.4Å
261	P	53.1	Low	58.1	Low	69 Å²	69	75.7 Å²	75.7	45%	0.448	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	4.9	-171	30.8	-37.7	0	0	0	114.1	Y190	Y190-P261 HydrophobicContact CD2-CB 4.33Å; Y190-P261 HydrophobicContact CD2-CG 4Å
262	I	48.2	Very low	57.9	Low	82 Å²	82	80.9 Å²	80.9	42%	0.421	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-13.2	-159.4	-71.3	149.4	0	0	0	114.1	L189 L260	L189-I262 HydrophobicContact CB-CD1 4.4Å; L189-I262 HydrophobicContact CD1-CD1 3.88Å; L260-I262 PolarHBondContact O-N 3.4Å
263	N	43.4	Very low	57.8	Low	90 Å²	90	77.7 Å²	77.7	48%	0.481	41%	0.408	S	S	.	.			trans	-167.8	139.5	165.6	-111.3	-19.3	0	0	0	112.1	T265 W266	N263-T265 PolarHBondContact O-N 3.07Å; N263-T265 VanDerWaalsContact O-N 3.16Å; N263-W266 PolarHBondContact O-N 2.97Å
264	T	48.3	Very low	57.5	Low	103 Å²	103	74.2 Å²	74.2	63%	0.632	39%	0.39	S	S	*	.	H	α-helix	trans	-54.4	-30.5	171.4	46.9	0	0	0	0	112	W266 I267 D268	T264-W266 VanDerWaalsContact C-N 3.26Å; T264-W266 PolarHBondContact O-N 2.82Å; T264-I267 WeakPolarHBondContact O-CB 3.49Å; T264-I267 PolarHBondContact O-N 3.46Å; T264-I267 VanDerWaalsContact O-N 3.1Å; T264-D268 PolarHBondContact O-N 2.78Å
265	T	47.7	Very low	57.6	Low	72 Å²	72	77 Å²	77	44%	0.442	41%	0.405	S	S	.	.	H	α-helix	trans	-63.8	-25.7	177.1	65.5	0	0	0	0	114.2	N263 N269	N263-T265 PolarHBondContact O-N 3.07Å; N263-T265 VanDerWaalsContact O-N 3.16Å; T265-N269 PolarHBondContact O-N 3.33Å
266	W	50.8	Low	57.7	Low	112 Å²	112	80 Å²	80	42%	0.424	42%	0.421	S	S	.	.	H	α-helix	trans	-78.6	-24.6	177.2	-73.3	75.2	0	0	0	112.4	N263 T264 K270 V273	N263-W266 PolarHBondContact O-N 2.97Å; T264-W266 VanDerWaalsContact C-N 3.26Å; T264-W266 PolarHBondContact O-N 2.82Å; W266-K270 WeakPolarHBondContact O-CA 3.33Å; W266-K270 PolarHBondContact O-N 3.38Å; W266-K270 VanDerWaalsContact O-N 3.11Å; W266-V273 HydrophobicContact CE3-CG1 4.17Å; W266-V273 HydrophobicContact CE3-CG2 4.01Å; W266-V273 HydrophobicContact CZ3-CG1 3.85Å; W266-V273 HydrophobicContact CZ3-CG2 4.07Å
267	I	52.1	Low	57.7	Low	91 Å²	91	74.9 Å²	74.9	47%	0.467	40%	0.397	S	S	.	.	H	α-helix	trans	-71.3	-38.9	173.4	-72.7	153.4	0	0	0	109.5	T264 K270	T264-I267 WeakPolarHBondContact O-CB 3.49Å; T264-I267 PolarHBondContact O-N 3.46Å; T264-I267 VanDerWaalsContact O-N 3.1Å; I267-K270 WeakPolarHBondContact O-CB 3.05Å; I267-K270 PolarHBondContact O-N 2.98Å
268	D	54.3	Low	57.7	Low	128 Å²	128	72.5 Å²	72.5	68%	0.684	38%	0.384	S	S	*	.	H	α-helix	trans	-69	-37.8	179.2	-59.7	-22.5	0	0	0	112.1	T264	T264-D268 PolarHBondContact O-N 2.78Å
269	N	59.7	Low	58.2	Low	88 Å²	88	74.3 Å²	74.3	47%	0.471	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	16.2	178.2	-77.3	-19.2	0	0	0	114.2	T265 N271 L272 V273	T265-N269 PolarHBondContact O-N 3.33Å; N269-N271 PolarHBondContact O-N 3.1Å; N269-N271 VanDerWaalsContact O-N 3.11Å; N269-L272 PolarHBondContact O-N 2.97Å; N269-V273 WeakPolarHBondContact O-CG2 3.38Å; N269-V273 PolarHBondContact O-N 3.02Å
270	K	60.2	Low	58.7	Low	52 Å²	52	74.7 Å²	74.7	23%	0.226	39%	0.394	C	S	.	.	H	α-helix	trans	-53.7	-40	-173.8	-151.3	179.7	-174.1	-166.9	0	111.8	I255 H256 W266 I267 V273 L274	I255-K270 WeakPolarHBondContact O-CE 3.45Å; I255-K270 PolarHBondContact O-NZ 3.18Å; H256-K270 PolarHBondContact O-NZ 2.68Å; W266-K270 WeakPolarHBondContact O-CA 3.33Å; W266-K270 PolarHBondContact O-N 3.38Å; W266-K270 VanDerWaalsContact O-N 3.11Å; I267-K270 WeakPolarHBondContact O-CB 3.05Å; I267-K270 PolarHBondContact O-N 2.98Å; K270-V273 PolarHBondContact O-N 3.37Å; K270-L274 WeakPolarHBondContact O-CB 3.19Å; K270-L274 WeakPolarHBondContact O-CD1 3.43Å; K270-L274 WeakPolarHBondContact O-CG 3.42Å; K270-L274 PolarHBondContact O-N 3.33Å
271	N	61.8	Low	59.2	Low	127 Å²	127	74.1 Å²	74.1	68%	0.679	39%	0.391	S	S	*	.	H	α-helix	trans	-67.5	-38.5	178.6	-67.5	-9.7	0	0	0	113.3	N269 L274 I275	N269-N271 PolarHBondContact O-N 3.1Å; N269-N271 VanDerWaalsContact O-N 3.11Å; N271-L274 PolarHBondContact O-N 3.25Å; N271-I275 WeakPolarHBondContact O-CG1 3.39Å; N271-I275 PolarHBondContact O-N 3.15Å
272	L	61.7	Low	60	Low	110 Å²	110	74.9 Å²	74.9	58%	0.576	39%	0.391	S	S	*	.	H	α-helix	trans	-69.1	-42.2	177	-87.9	161.2	0	0	0	111.6	N269 L274 I275	N269-L272 PolarHBondContact O-N 2.97Å; L272-L274 PolarHBondContact O-N 2.87Å; L272-I275 PolarHBondContact O-N 3.29Å; L272-I275 VanDerWaalsContact O-N 3.16Å
273	V	64.3	Low	61	Low	22 Å²	22	76 Å²	76	13%	0.133	39%	0.394	C	S	.	.	H	α-helix	trans	-66.2	-30.8	177.2	179	0	0	0	0	111.2	F177 W266 N269 K270 P277	F177-V273 HydrophobicContact CE1-CG1 3.92Å; W266-V273 HydrophobicContact CE3-CG1 4.17Å; W266-V273 HydrophobicContact CE3-CG2 4.01Å; W266-V273 HydrophobicContact CZ3-CG1 3.85Å; W266-V273 HydrophobicContact CZ3-CG2 4.07Å; N269-V273 WeakPolarHBondContact O-CG2 3.38Å; N269-V273 PolarHBondContact O-N 3.02Å; K270-V273 PolarHBondContact O-N 3.37Å; V273-P277 WeakPolarHBondContact O-CD 3.48Å
274	L	64.7	Low	62.1	Low	10 Å²	10	75 Å²	75	5%	0.052	39%	0.386	C	S	.	.	H	α-helix	trans	-69.9	-31.2	173.7	-78.3	169.6	0	0	0	112.6	W252 I255 H256 K270 N271 L272 P277	W252-L274 HydrophobicContact CG-CD2 4.15Å; W252-L274 PolarHBondContact NE1-O 3.05Å; I255-L274 HydrophobicContact CB-CD2 3.73Å; I255-L274 HydrophobicContact CG2-CD2 3.58Å; I255-L274 HydrophobicContact CG2-CG 3.99Å; H256-L274 HydrophobicContact CB-CD2 4.14Å; K270-L274 WeakPolarHBondContact O-CB 3.19Å; K270-L274 WeakPolarHBondContact O-CD1 3.43Å; K270-L274 WeakPolarHBondContact O-CG 3.42Å; K270-L274 PolarHBondContact O-N 3.33Å; N271-L274 PolarHBondContact O-N 3.25Å; L272-L274 PolarHBondContact O-N 2.87Å; L274-P277 WeakPolarHBondContact O-CD 3.47Å; L274-P277 WeakPolarHBondContact O-CG 3.22Å
275	I	67.1	Low	63	Low	83 Å²	83	74.5 Å²	74.5	43%	0.426	38%	0.378	S	S	.	.	H	α-helix	trans	-69.4	-36.1	-179.1	-71.2	163	0	0	0	111.7	N271 L272 L278 I279	N271-I275 WeakPolarHBondContact O-CG1 3.39Å; N271-I275 PolarHBondContact O-N 3.15Å; L272-I275 PolarHBondContact O-N 3.29Å; L272-I275 VanDerWaalsContact O-N 3.16Å; I275-L278 VanDerWaalsContact O-CB 3.3Å; I275-L278 WeakPolarHBondContact O-CB 3.49Å; I275-L278 PolarHBondContact O-N 2.94Å; I275-L278 VanDerWaalsContact O-N 3.16Å; I275-I279 HydrophobicContact CG2-CD1 3.44Å; I275-I279 VanDerWaalsContact CG2-CD1 3.44Å; I275-I279 HydrophobicContact CG2-CG1 3.9Å; I275-I279 WeakPolarHBondContact O-CG1 3.43Å; I275-I279 PolarHBondContact O-N 3.48Å
276	I	68.4	Low	63.9	Low	77 Å²	77	76.7 Å²	76.7	40%	0.395	39%	0.387	S	S	.	.	H	α-helix	trans	-57.2	-53.9	-176.6	-61.1	168.3	0	0	0	113.4	F177 L278 I279 L280	F177-I276 HydrophobicContact CD2-CG2 4.34Å; F177-I276 HydrophobicContact CE1-CB 4.3Å; F177-I276 HydrophobicContact CE1-CG2 4.31Å; F177-I276 HydrophobicContact CE2-CG2 3.72Å; F177-I276 HydrophobicContact CZ-CB 4.07Å; F177-I276 HydrophobicContact CZ-CD1 4.08Å; F177-I276 HydrophobicContact CZ-CG2 3.7Å; I276-L278 PolarHBondContact O-N 3.49Å; I276-I279 PolarHBondContact O-N 2.81Å; I276-L280 HydrophobicContact CG2-CD1 4.01Å; I276-L280 WeakPolarHBondContact O-CG 3.43Å; I276-L280 PolarHBondContact O-N 2.8Å
277	P	65.4	Low	64.7	Low	1 Å²	1	76.1 Å²	76.1	1%	0.006	39%	0.387	C	S	.	.	H	α-helix	trans	-64.5	-30.3	177.1	23.4	-32.2	0	0	0	112.4	F177 W252 I255 V273 L274 L280 T281	F177-P277 HydrophobicContact CB-CB 4.23Å; F177-P277 HydrophobicContact CD1-CB 4.35Å; F177-P277 HydrophobicContact CD1-CG 4.13Å; F177-P277 HydrophobicContact CG-CB 4.46Å; W252-P277 HydrophobicContact CB-CG 4.32Å; W252-P277 HydrophobicContact CG-CG 4.24Å; I255-P277 HydrophobicContact CD1-CG 4.34Å; V273-P277 WeakPolarHBondContact O-CD 3.48Å; L274-P277 WeakPolarHBondContact O-CD 3.47Å; L274-P277 WeakPolarHBondContact O-CG 3.22Å; P277-L280 PolarHBondContact O-N 3.36Å; P277-T281 WeakPolarHBondContact O-CG2 3.34Å; P277-T281 PolarHBondContact O-N 3.26Å; P277-T281 PolarHBondContact O-OG1 3.48Å
278	L	65.4	Low	65.1	Low	55 Å²	55	73.5 Å²	73.5	29%	0.288	37%	0.374	S	S	.	.	H	α-helix	trans	-66.6	-44	175.9	-126.4	174.8	0	0	0	111.7	W252 I275 I276 L280 T281 I282	W252-L278 HydrophobicContact CD2-CD1 4.36Å; W252-L278 HydrophobicContact CD2-CG 4.25Å; W252-L278 HydrophobicContact CE3-CD1 4.42Å; W252-L278 HydrophobicContact CE3-CG 4.22Å; W252-L278 HydrophobicContact CH2-CD1 3.3Å; W252-L278 HydrophobicContact CH2-CG 3.94Å; W252-L278 HydrophobicContact CZ2-CD1 3.16Å; W252-L278 HydrophobicContact CZ2-CG 3.94Å; W252-L278 HydrophobicContact CZ3-CD1 3.92Å; W252-L278 HydrophobicContact CZ3-CG 4.05Å; I275-L278 VanDerWaalsContact O-CB 3.3Å; I275-L278 WeakPolarHBondContact O-CB 3.49Å; I275-L278 PolarHBondContact O-N 2.94Å; I275-L278 VanDerWaalsContact O-N 3.16Å; I276-L278 PolarHBondContact O-N 3.49Å; L278-L280 VanDerWaalsContact C-N 3.34Å; L278-T281 WeakPolarHBondContact CA-OG1 3.41Å; L278-T281 PolarHBondContact O-N 2.87Å; L278-T281 PolarHBondContact O-OG1 3.32Å; L278-I282 HydrophobicContact CD2-CD1 3.73Å; L278-I282 HydrophobicContact CD2-CG1 4.29Å; L278-I282 WeakPolarHBondContact O-CB 3.17Å; L278-I282 WeakPolarHBondContact O-CD1 3.41Å; L278-I282 WeakPolarHBondContact O-CG1 3.21Å; L278-I282 PolarHBondContact O-N 3.4Å
279	I	72.9	Confident	65.4	Low	103 Å²	103	70.9 Å²	70.9	53%	0.528	36%	0.364	S	S	.	.	H	α-helix	trans	-64.7	-42.6	174.5	-67.5	174	0	0	0	110	I275 I276 I282 H283	I275-I279 HydrophobicContact CG2-CD1 3.44Å; I275-I279 VanDerWaalsContact CG2-CD1 3.44Å; I275-I279 HydrophobicContact CG2-CG1 3.9Å; I275-I279 WeakPolarHBondContact O-CG1 3.43Å; I275-I279 PolarHBondContact O-N 3.48Å; I276-I279 PolarHBondContact O-N 2.81Å; I279-I282 PolarHBondContact O-N 3.43Å; I279-H283 WeakPolarHBondContact O-CB 3.17Å; I279-H283 PolarHBondContact O-N 2.9Å
280	L	67.1	Low	65.4	Low	68 Å²	68	72.3 Å²	72.3	36%	0.356	37%	0.366	S	S	.	.	H	α-helix	trans	-63.5	-41	177.6	-77.8	164.5	0	0	0	112.3	L248 I276 P277 L278 F284	L248-L280 HydrophobicContact CD1-CB 4.02Å; I276-L280 HydrophobicContact CG2-CD1 4.01Å; I276-L280 WeakPolarHBondContact O-CG 3.43Å; I276-L280 PolarHBondContact O-N 2.8Å; P277-L280 PolarHBondContact O-N 3.36Å; L278-L280 VanDerWaalsContact C-N 3.34Å; L280-F284 WeakPolarHBondContact O-CB 3.21Å; L280-F284 PolarHBondContact O-N 3.48Å
281	T	67.6	Low	65.2	Low	14 Å²	14	74 Å²	74	9%	0.086	38%	0.377	C	S	.	.	H	α-helix	trans	-66.5	-46.1	176.5	54.3	0	0	0	0	111.1	P245 L248 P277 L278 H283 F284 I285	P245-T281 WeakPolarHBondContact O-CG2 3.4Å; L248-T281 HydrophobicContact CB-CG2 3.38Å; L248-T281 HydrophobicContact CD1-CG2 4.08Å; L248-T281 HydrophobicContact CG-CG2 4.41Å; P277-T281 WeakPolarHBondContact O-CG2 3.34Å; P277-T281 PolarHBondContact O-N 3.26Å; P277-T281 PolarHBondContact O-OG1 3.48Å; L278-T281 WeakPolarHBondContact CA-OG1 3.41Å; L278-T281 PolarHBondContact O-N 2.87Å; L278-T281 PolarHBondContact O-OG1 3.32Å; T281-H283 VanDerWaalsContact C-N 3.35Å; T281-H283 PolarHBondContact O-N 2.98Å; T281-F284 PolarHBondContact O-N 3.45Å; T281-I285 WeakPolarHBondContact O-CB 2.78Å; T281-I285 WeakPolarHBondContact O-CD1 3.4Å; T281-I285 WeakPolarHBondContact O-CG1 3.22Å; T281-I285 PolarHBondContact O-N 3.29Å
282	I	69.8	Low	64.8	Low	85 Å²	85	71.4 Å²	71.4	44%	0.436	36%	0.36	S	S	.	.	H	α-helix	trans	-60.7	-46.1	177	-69.2	166.5	0	0	0	110.4	L278 I279 F284 I285 L286	L278-I282 HydrophobicContact CD2-CD1 3.73Å; L278-I282 HydrophobicContact CD2-CG1 4.29Å; L278-I282 WeakPolarHBondContact O-CB 3.17Å; L278-I282 WeakPolarHBondContact O-CD1 3.41Å; L278-I282 WeakPolarHBondContact O-CG1 3.21Å; L278-I282 PolarHBondContact O-N 3.4Å; I279-I282 PolarHBondContact O-N 3.43Å; I282-F284 PolarHBondContact O-N 3.41Å; I282-I285 PolarHBondContact O-N 3.43Å; I282-L286 HydrophobicContact CG2-CD1 3.63Å; I282-L286 HydrophobicContact CG2-CG 4.32Å; I282-L286 WeakPolarHBondContact O-CB 3.42Å; I282-L286 WeakPolarHBondContact O-CG 3.44Å; I282-L286 PolarHBondContact O-N 2.84Å
283	H	68.4	Low	64.8	Low	106 Å²	106	71.8 Å²	71.8	49%	0.491	36%	0.357	S	S	.	.	H	α-helix	trans	-62.7	-44	178.6	-169.1	64	0	0	0	111.4	I279 T281 I285 L286 F287	I279-H283 WeakPolarHBondContact O-CB 3.17Å; I279-H283 PolarHBondContact O-N 2.9Å; T281-H283 VanDerWaalsContact C-N 3.35Å; T281-H283 PolarHBondContact O-N 2.98Å; H283-I285 PolarHBondContact O-N 3.48Å; H283-L286 PolarHBondContact O-N 2.78Å; H283-F287 AromaticContact CE1-CD2 3.93Å; H283-F287 WeakPolarHBondContact O-CB 3.32Å; H283-F287 PolarHBondContact O-N 3.31Å
284	F	65.7	Low	64.2	Low	68 Å²	68	75.5 Å²	75.5	30%	0.298	37%	0.374	S	S	.	.	H	α-helix	trans	-63.6	-40.3	175	-102.6	-94.2	0	0	0	112.8	L244 P245 L280 T281 I282 N288	L244-F284 HydrophobicContact CD1-CE1 4.3Å; L244-F284 HydrophobicContact CD1-CZ 4.21Å; L244-F284 HydrophobicContact CD2-CD1 3.78Å; L244-F284 HydrophobicContact CD2-CD2 3.73Å; L244-F284 HydrophobicContact CD2-CE1 3.79Å; L244-F284 HydrophobicContact CD2-CE2 3.7Å; L244-F284 HydrophobicContact CD2-CG 3.77Å; L244-F284 HydrophobicContact CD2-CZ 3.75Å; P245-F284 HydrophobicContact CG-CB 4.1Å; L280-F284 WeakPolarHBondContact O-CB 3.21Å; L280-F284 PolarHBondContact O-N 3.48Å; T281-F284 PolarHBondContact O-N 3.45Å; I282-F284 PolarHBondContact O-N 3.41Å; F284-N288 WeakPolarHBondContact CD1-ND2 3.28Å; F284-N288 WeakPolarHBondContact O-CB 3.46Å; F284-N288 PolarHBondContact O-N 2.77Å; F284-N288 PolarHBondContact O-ND2 3.43Å
285	I	68.3	Low	63.7	Low	92 Å²	92	80 Å²	80	47%	0.472	40%	0.395	S	S	.	.	H	α-helix	trans	-67.9	-37.8	179.6	-69.3	163.7	0	0	0	110.9	P245 T281 I282 H283 P289	P245-I285 HydrophobicContact CB-CD1 4.16Å; P245-I285 HydrophobicContact CB-CG1 3.96Å; P245-I285 HydrophobicContact CG-CG1 4Å; T281-I285 WeakPolarHBondContact O-CB 2.78Å; T281-I285 WeakPolarHBondContact O-CD1 3.4Å; T281-I285 WeakPolarHBondContact O-CG1 3.22Å; T281-I285 PolarHBondContact O-N 3.29Å; I282-I285 PolarHBondContact O-N 3.43Å; H283-I285 PolarHBondContact O-N 3.48Å; I285-P289 WeakPolarHBondContact O-CD 3.1Å; I285-P289 WeakPolarHBondContact O-CG 3.49Å
286	L	67.1	Low	63.3	Low	119 Å²	119	78.2 Å²	78.2	62%	0.623	39%	0.39	S	S	*	.	H	α-helix	trans	-80.1	-41.6	-179.9	-70.4	172.5	0	0	0	113.1	I282 H283 P289	I282-L286 HydrophobicContact CG2-CD1 3.63Å; I282-L286 HydrophobicContact CG2-CG 4.32Å; I282-L286 WeakPolarHBondContact O-CB 3.42Å; I282-L286 WeakPolarHBondContact O-CG 3.44Å; I282-L286 PolarHBondContact O-N 2.84Å; H283-L286 PolarHBondContact O-N 2.78Å; L286-P289 WeakPolarHBondContact O-CD 3.46Å; L286-P289 WeakPolarHBondContact O-CG 3.37Å
287	F	66.5	Low	62.7	Low	100 Å²	100	78.3 Å²	78.3	44%	0.439	39%	0.391	S	S	.	.	H	α-helix	trans	-78.2	-33.3	-169.9	-157.4	-104.7	0	0	0	112.9	H283 F290 L291	H283-F287 AromaticContact CE1-CD2 3.93Å; H283-F287 WeakPolarHBondContact O-CB 3.32Å; H283-F287 PolarHBondContact O-N 3.31Å; F287-F290 PolarHBondContact O-N 3.19Å; F287-L291 HydrophobicContact CD1-CD1 3.47Å; F287-L291 VanDerWaalsContact CD1-CD1 3.47Å; F287-L291 HydrophobicContact CD1-CG 4.01Å; F287-L291 HydrophobicContact CE1-CD1 3.41Å; F287-L291 VanDerWaalsContact CE1-CD1 3.41Å; F287-L291 HydrophobicContact CE1-CD2 4.47Å; F287-L291 HydrophobicContact CE1-CG 3.81Å; F287-L291 PolarHBondContact O-N 3.38Å
288	N	61.5	Low	62.3	Low	35 Å²	35	84.1 Å²	84.1	19%	0.187	42%	0.418	C	S	.	.	H	α-helix	trans	-67.1	-46.5	-179.7	-81.3	-62	0	0	0	115.5	I241 F284 F290 L291 F292	I241-N288 HydrophobicContact CD1-CB 4.23Å; I241-N288 HydrophobicContact CG2-CB 3.34Å; I241-N288 VanDerWaalsContact CG2-CG 3.44Å; F284-N288 WeakPolarHBondContact CD1-ND2 3.28Å; F284-N288 WeakPolarHBondContact O-CB 3.46Å; F284-N288 PolarHBondContact O-N 2.77Å; F284-N288 PolarHBondContact O-ND2 3.43Å; N288-F290 PolarHBondContact O-N 2.92Å; N288-L291 PolarHBondContact O-N 3.1Å; N288-F292 WeakPolarHBondContact O-CB 3.45Å; N288-F292 PolarHBondContact O-N 3.19Å
289	P	60.1	Low	61.7	Low	73 Å²	73	85.1 Å²	85.1	47%	0.474	42%	0.423	S	S	.	.	H	α-helix	trans	-63.8	-31.8	175	23.8	-32.1	0	0	0	111.3	I285 L286 F292 F293	I285-P289 WeakPolarHBondContact O-CD 3.1Å; I285-P289 WeakPolarHBondContact O-CG 3.49Å; L286-P289 WeakPolarHBondContact O-CD 3.46Å; L286-P289 WeakPolarHBondContact O-CG 3.37Å; P289-F292 PolarHBondContact O-N 2.96Å; P289-F293 WeakPolarHBondContact O-CB 2.93Å; P289-F293 PolarHBondContact O-N 2.94Å
290	F	60.7	Low	60.9	Low	119 Å²	119	82.6 Å²	82.6	52%	0.522	42%	0.417	S	S	.	.	H	α-helix	trans	-66.8	-48.8	175.5	-173.1	-97.5	0	0	0	112.4	F287 N288 F292 F293 M294	F287-F290 PolarHBondContact O-N 3.19Å; N288-F290 PolarHBondContact O-N 2.92Å; F290-F292 VanDerWaalsContact C-N 3.3Å; F290-F292 PolarHBondContact O-N 3.03Å; F290-F293 WeakPolarHBondContact O-CB 3.42Å; F290-F293 PolarHBondContact O-N 3.4Å; F290-M294 HydrophobicContact CD1-CG 4.32Å; F290-M294 HydrophobicContact CE1-CG 3.98Å; F290-M294 HydrophobicContact CZ-CG 4.27Å; F290-M294 HydrophobicContact CZ-SD 4.4Å; F290-M294 WeakPolarHBondContact O-CG 3.27Å; F290-M294 PolarHBondContact O-N 2.91Å
291	L	54.6	Low	60	Low	87 Å²	87	85.6 Å²	85.6	46%	0.455	43%	0.431	S	S	.	.	H	α-helix	trans	-60.1	-40	173.8	-89.7	170.5	0	0	0	112.2	F287 N288 M294 H295	F287-L291 HydrophobicContact CD1-CD1 3.47Å; F287-L291 VanDerWaalsContact CD1-CD1 3.47Å; F287-L291 HydrophobicContact CD1-CG 4.01Å; F287-L291 HydrophobicContact CE1-CD1 3.41Å; F287-L291 VanDerWaalsContact CE1-CD1 3.41Å; F287-L291 HydrophobicContact CE1-CD2 4.47Å; F287-L291 HydrophobicContact CE1-CG 3.81Å; F287-L291 PolarHBondContact O-N 3.38Å; N288-L291 PolarHBondContact O-N 3.1Å; L291-M294 PolarHBondContact O-N 3.41Å; L291-H295 WeakPolarHBondContact O-CB 2.98Å; L291-H295 PolarHBondContact O-N 3.36Å
292	F	54.2	Low	59.3	Low	73 Å²	73	88.1 Å²	88.1	32%	0.32	44%	0.443	S	S	.	.	H	α-helix	trans	-62.9	-43.2	175.9	178.9	-99.7	0	0	0	111.6	L237 Y238 N288 P289 F290 M294 H295 S296	L237-F292 HydrophobicContact CD1-CE2 4.46Å; Y238-F292 HydrophobicContact CE2-CE1 4.17Å; Y238-F292 HydrophobicContact CE2-CZ 4.15Å; Y238-F292 AromaticContact CZ-CE1 4Å; Y238-F292 VanDerWaalsContact OH-CE1 3.26Å; Y238-F292 WeakPolarHBondContact OH-CE1 3.39Å; N288-F292 WeakPolarHBondContact O-CB 3.45Å; N288-F292 PolarHBondContact O-N 3.19Å; P289-F292 PolarHBondContact O-N 2.96Å; F290-F292 VanDerWaalsContact C-N 3.3Å; F290-F292 PolarHBondContact O-N 3.03Å; F292-M294 VanDerWaalsContact C-N 3.34Å; F292-M294 PolarHBondContact O-N 3.41Å; F292-H295 PolarHBondContact O-N 2.92Å; F292-S296 WeakPolarHBondContact O-CB 3.39Å; F292-S296 PolarHBondContact O-N 3.38Å; F292-S296 PolarHBondContact O-OG 2.93Å
293	F	61.5	Low	58.4	Low	118 Å²	118	87.4 Å²	87.4	52%	0.518	44%	0.441	S	S	.	.	H	α-helix	trans	-61.7	-42.3	176.1	-177.2	-103.3	0	0	0	111.8	P289 F290 H295 S296 L297	P289-F293 WeakPolarHBondContact O-CB 2.93Å; P289-F293 PolarHBondContact O-N 2.94Å; F290-F293 WeakPolarHBondContact O-CB 3.42Å; F290-F293 PolarHBondContact O-N 3.4Å; F293-H295 PolarHBondContact O-N 3.37Å; F293-S296 WeakPolarHBondContact CA-OG 3.41Å; F293-S296 PolarHBondContact O-OG 3.47Å; F293-L297 HydrophobicContact CD1-CD1 3.75Å; F293-L297 HydrophobicContact CE1-CD1 3.35Å; F293-L297 HydrophobicContact CE1-CG 4.21Å; F293-L297 HydrophobicContact CZ-CD1 3.79Å; F293-L297 HydrophobicContact CZ-CG 4.25Å; F293-L297 WeakPolarHBondContact O-CB 3.16Å; F293-L297 VanDerWaalsContact O-CG 3.31Å; F293-L297 WeakPolarHBondContact O-CG 3.49Å; F293-L297 PolarHBondContact O-N 3.35Å
294	M	51.5	Low	57.3	Low	99 Å²	99	87.4 Å²	87.4	49%	0.488	44%	0.444	S	S	.	.	H	α-helix	trans	-64.5	-40.4	175.6	-67.6	-62.7	-77.5	0	0	111.8	F290 L291 F292 Q298	F290-M294 HydrophobicContact CD1-CG 4.32Å; F290-M294 HydrophobicContact CE1-CG 3.98Å; F290-M294 HydrophobicContact CZ-CG 4.27Å; F290-M294 HydrophobicContact CZ-SD 4.4Å; F290-M294 WeakPolarHBondContact O-CG 3.27Å; F290-M294 PolarHBondContact O-N 2.91Å; L291-M294 PolarHBondContact O-N 3.41Å; F292-M294 VanDerWaalsContact C-N 3.34Å; F292-M294 PolarHBondContact O-N 3.41Å; M294-Q298 PolarHBondContact O-N 3.33Å
295	H	55	Low	56.5	Low	106 Å²	106	88.6 Å²	88.6	49%	0.491	46%	0.457	S	S	.	.	H	α-helix	trans	-72.2	-38.5	179.1	-169.2	25.4	0	0	0	112.7	L291 F292 F293 L297 Q298 L299	L291-H295 WeakPolarHBondContact O-CB 2.98Å; L291-H295 PolarHBondContact O-N 3.36Å; F292-H295 PolarHBondContact O-N 2.92Å; F293-H295 PolarHBondContact O-N 3.37Å; H295-L297 VanDerWaalsContact C-N 3.34Å; H295-Q298 WeakPolarHBondContact O-CB 3.29Å; H295-Q298 PolarHBondContact O-N 3.05Å; H295-Q298 VanDerWaalsContact O-N 3.17Å; H295-L299 PolarHBondContact O-N 3.43Å
296	S	58.2	Low	55.1	Low	44 Å²	44	92 Å²	92	31%	0.308	46%	0.463	S	S	.	.	H	α-helix	trans	-65.6	-38.6	175.8	66.9	0	0	0	0	111.4	F292 F293 Q298 L299 A300	F292-S296 WeakPolarHBondContact O-CB 3.39Å; F292-S296 PolarHBondContact O-N 3.38Å; F292-S296 PolarHBondContact O-OG 2.93Å; F293-S296 WeakPolarHBondContact CA-OG 3.41Å; F293-S296 PolarHBondContact O-OG 3.47Å; S296-Q298 VanDerWaalsContact C-N 3.33Å; S296-Q298 PolarHBondContact O-N 3.29Å; S296-L299 PolarHBondContact O-N 3.26Å; S296-A300 WeakPolarHBondContact O-CB 3.39Å; S296-A300 PolarHBondContact O-N 2.93Å
297	L	56.5	Low	53.9	Low	80 Å²	80	92.6 Å²	92.6	42%	0.419	46%	0.459	S	S	.	.	H	α-helix	trans	-59.7	-44.5	169.9	-78.8	172	0	0	0	111.4	F293 H295 L299 A300 M301	F293-L297 HydrophobicContact CD1-CD1 3.75Å; F293-L297 HydrophobicContact CE1-CD1 3.35Å; F293-L297 HydrophobicContact CE1-CG 4.21Å; F293-L297 HydrophobicContact CZ-CD1 3.79Å; F293-L297 HydrophobicContact CZ-CG 4.25Å; F293-L297 WeakPolarHBondContact O-CB 3.16Å; F293-L297 VanDerWaalsContact O-CG 3.31Å; F293-L297 WeakPolarHBondContact O-CG 3.49Å; F293-L297 PolarHBondContact O-N 3.35Å; H295-L297 VanDerWaalsContact C-N 3.34Å; L297-L299 PolarHBondContact O-N 3.35Å; L297-A300 PolarHBondContact O-N 3.4Å; L297-M301 WeakPolarHBondContact O-CG 3.46Å; L297-M301 PolarHBondContact O-N 3.49Å
298	Q	55.6	Low	52.7	Low	122 Å²	122	96 Å²	96	57%	0.57	47%	0.473	S	S	*	.	H	α-helix	trans	-63.8	-41.1	179.9	-149.2	175.8	6.3	0	0	112	M294 H295 S296 M301 I302	M294-Q298 PolarHBondContact O-N 3.33Å; H295-Q298 WeakPolarHBondContact O-CB 3.29Å; H295-Q298 PolarHBondContact O-N 3.05Å; H295-Q298 VanDerWaalsContact O-N 3.17Å; S296-Q298 VanDerWaalsContact C-N 3.33Å; S296-Q298 PolarHBondContact O-N 3.29Å; Q298-M301 PolarHBondContact O-N 3.43Å; Q298-I302 HydrophobicContact CG-CD1 4.48Å; Q298-I302 WeakPolarHBondContact O-CD1 3.4Å; Q298-I302 VanDerWaalsContact O-CG1 3.23Å; Q298-I302 WeakPolarHBondContact O-CG1 3.31Å; Q298-I302 PolarHBondContact O-N 2.93Å
299	L	53.8	Low	51.6	Low	76 Å²	76	100.1 Å²	100.1	40%	0.398	49%	0.491	S	S	.	.	H	α-helix	trans	-65.7	-44.1	174.8	-73.5	167.7	0	0	0	111.8	H295 S296 L297 M301 I302 D303	H295-L299 PolarHBondContact O-N 3.43Å; S296-L299 PolarHBondContact O-N 3.26Å; L297-L299 PolarHBondContact O-N 3.35Å; L299-M301 VanDerWaalsContact C-N 3.27Å; L299-M301 PolarHBondContact O-N 3.05Å; L299-I302 PolarHBondContact O-N 2.94Å; L299-I302 VanDerWaalsContact O-N 3.15Å; L299-D303 WeakPolarHBondContact O-CB 3.49Å; L299-D303 PolarHBondContact O-N 2.94Å
300	A	55.5	Low	50.7	Low	50 Å²	50	102.5 Å²	102.5	41%	0.413	49%	0.494	S	S	.	.	H	α-helix	trans	-59.8	-38.2	176.2	0	0	0	0	0	112	S296 L297 N304	S296-A300 WeakPolarHBondContact O-CB 3.39Å; S296-A300 PolarHBondContact O-N 2.93Å; L297-A300 PolarHBondContact O-N 3.4Å; A300-N304 WeakPolarHBondContact O-CB 3.43Å; A300-N304 VanDerWaalsContact O-CG 3.24Å; A300-N304 PolarHBondContact O-N 3.44Å; A300-N304 VanDerWaalsContact O-N 3.14Å; A300-N304 PolarHBondContact O-ND2 2.97Å
301	M	47.8	Very low	49.9	Very low	132 Å²	132	100.1 Å²	100.1	65%	0.65	49%	0.49	S	S	*	.	H	α-helix	trans	-68.4	-41.2	175.6	-67	-72.2	-89.8	0	0	112	L297 Q298 L299 V305	L297-M301 WeakPolarHBondContact O-CG 3.46Å; L297-M301 PolarHBondContact O-N 3.49Å; Q298-M301 PolarHBondContact O-N 3.43Å; L299-M301 VanDerWaalsContact C-N 3.27Å; L299-M301 PolarHBondContact O-N 3.05Å; M301-V305 WeakPolarHBondContact O-CG2 3.23Å; M301-V305 PolarHBondContact O-N 3.47Å
302	I	53.6	Low	49.9	Very low	66 Å²	66	100.5 Å²	100.5	34%	0.338	50%	0.497	S	S	.	.	H	α-helix	trans	-68.2	-41	179.2	-69.5	164.2	0	0	0	111.4	Q298 L299 V305 R306	Q298-I302 HydrophobicContact CG-CD1 4.48Å; Q298-I302 WeakPolarHBondContact O-CD1 3.4Å; Q298-I302 VanDerWaalsContact O-CG1 3.23Å; Q298-I302 WeakPolarHBondContact O-CG1 3.31Å; Q298-I302 PolarHBondContact O-N 2.93Å; L299-I302 PolarHBondContact O-N 2.94Å; L299-I302 VanDerWaalsContact O-N 3.15Å; I302-V305 PolarHBondContact O-N 3.39Å; I302-R306 HydrophobicContact CG2-CG 4.43Å; I302-R306 WeakPolarHBondContact O-CG 3.26Å; I302-R306 PolarHBondContact O-N 3.17Å
303	D	49.8	Very low	49.6	Very low	71 Å²	71	101.4 Å²	101.4	38%	0.38	50%	0.504	S	S	.	.	H	α-helix	trans	-64.4	-44.4	177.8	-74.8	-20.5	0	0	0	110.2	L299 V305 R306 Y307	L299-D303 WeakPolarHBondContact O-CB 3.49Å; L299-D303 PolarHBondContact O-N 2.94Å; D303-V305 VanDerWaalsContact C-N 3.27Å; D303-V305 PolarHBondContact O-N 2.93Å; D303-R306 PolarHBondContact O-N 3.05Å; D303-R306 VanDerWaalsContact O-N 3.12Å; D303-Y307 HydrophobicContact CB-CD2 4.06Å; D303-Y307 HydrophobicContact CB-CE2 4.03Å; D303-Y307 WeakPolarHBondContact O-CB 3.37Å; D303-Y307 WeakPolarHBondContact O-CD2 3.49Å; D303-Y307 PolarHBondContact O-N 3.46Å
304	N	47.2	Very low	48.8	Very low	106 Å²	106	101.5 Å²	101.5	57%	0.567	50%	0.504	S	S	*	.	H	α-helix	trans	-58.1	-35.8	175.9	-76.7	-19.5	0	0	0	113.7	A300	A300-N304 WeakPolarHBondContact O-CB 3.43Å; A300-N304 VanDerWaalsContact O-CG 3.24Å; A300-N304 PolarHBondContact O-N 3.44Å; A300-N304 VanDerWaalsContact O-N 3.14Å; A300-N304 PolarHBondContact O-ND2 2.97Å
305	V	47.7	Very low	48.8	Very low	92 Å²	92	100.4 Å²	100.4	56%	0.558	51%	0.505	S	S	*	.	H	α-helix	trans	-75.1	-40.1	176.3	176	0	0	0	0	111.5	M301 I302 D303	M301-V305 WeakPolarHBondContact O-CG2 3.23Å; M301-V305 PolarHBondContact O-N 3.47Å; I302-V305 PolarHBondContact O-N 3.39Å; D303-V305 VanDerWaalsContact C-N 3.27Å; D303-V305 PolarHBondContact O-N 2.93Å
306	R	38.8	Very low	48.6	Very low	163 Å²	163	101.9 Å²	101.9	62%	0.615	51%	0.51	S	S	*	.	H	α-helix	trans	-70.6	-40.6	179.6	-74.2	179.2	178.9	168.5	0.9	112.4	I302 D303 K308 H309 F310	I302-R306 HydrophobicContact CG2-CG 4.43Å; I302-R306 WeakPolarHBondContact O-CG 3.26Å; I302-R306 PolarHBondContact O-N 3.17Å; D303-R306 PolarHBondContact O-N 3.05Å; D303-R306 VanDerWaalsContact O-N 3.12Å; R306-K308 VanDerWaalsContact C-N 3.28Å; R306-K308 PolarHBondContact O-N 3.5Å; R306-H309 PolarHBondContact O-N 3.25Å; R306-F310 WeakPolarHBondContact O-CB 3.4Å; R306-F310 PolarHBondContact O-N 3.49Å
307	Y	42.4	Very low	47.9	Very low	133 Å²	133	104.4 Å²	104.4	52%	0.522	52%	0.519	S	S	.	.	H	α-helix	trans	-66	-27.2	179.7	-81.8	-74.2	0	0	0	113.3	D303 P311	D303-Y307 HydrophobicContact CB-CD2 4.06Å; D303-Y307 HydrophobicContact CB-CE2 4.03Å; D303-Y307 WeakPolarHBondContact O-CB 3.37Å; D303-Y307 WeakPolarHBondContact O-CD2 3.49Å; D303-Y307 PolarHBondContact O-N 3.46Å; Y307-P311 WeakPolarHBondContact O-CD 3.45Å; Y307-P311 WeakPolarHBondContact O-CG 3.43Å
308	K	40.5	Very low	47.5	Very low	171 Å²	171	107.7 Å²	107.7	74%	0.743	53%	0.527	S	S	*	.	H	α-helix	trans	-75	-31.6	174.7	-78.9	-178	176.2	179.4	0	114	R306	R306-K308 VanDerWaalsContact C-N 3.28Å; R306-K308 PolarHBondContact O-N 3.5Å
309	H	38.4	Very low	47.2	Very low	121 Å²	121	109.4 Å²	109.4	56%	0.56	53%	0.533	S	S	*	.	H	α-helix	trans	-101.3	-20.6	-175.4	-73.6	-66.1	0	0	0	115	R306 T312	R306-H309 PolarHBondContact O-N 3.25Å; H309-T312 PolarHBondContact O-OG1 3.49Å
310	F	41.6	Very low	46.9	Very low	124 Å²	124	109.5 Å²	109.5	54%	0.544	53%	0.534	S	S	.	.	H	α-helix	trans	-69.9	-37.1	-179.3	-134.5	-97.2	0	0	0	115.9	R306 T312 F314	R306-F310 WeakPolarHBondContact O-CB 3.4Å; R306-F310 PolarHBondContact O-N 3.49Å; F310-T312 PolarHBondContact O-N 2.96Å; F310-F314 HydrophobicContact CE1-CD2 4.23Å; F310-F314 PolarHBondContact O-N 3Å
311	P	45	Very low	46.5	Very low	68 Å²	68	116.1 Å²	116.1	44%	0.442	55%	0.549	S	S	.	.	H	α-helix	trans	-73.1	-11.9	-177.8	26.3	-31.6	0	0	0	113.9	Y307 P315	Y307-P311 WeakPolarHBondContact O-CD 3.45Å; Y307-P311 WeakPolarHBondContact O-CG 3.43Å; P311-P315 WeakPolarHBondContact O-CD 3.45Å; P311-P315 VanDerWaalsContact O-CG 3.24Å; P311-P315 WeakPolarHBondContact O-CG 3.41Å
312	T	53.6	Low	46.5	Very low	96 Å²	96	113 Å²	113	59%	0.589	53%	0.534	S	S	*	.	H	α-helix	trans	-89.6	-31.3	177.5	54.3	0	0	0	0	113.2	H309 F310	H309-T312 PolarHBondContact O-OG1 3.49Å; F310-T312 PolarHBondContact O-N 2.96Å
313	I	48.1	Very low	46.3	Very low	91 Å²	91	113.1 Å²	113.1	47%	0.467	54%	0.541	S	S	.	.	H	α-helix	trans	-84.1	-36.8	-176.1	-57.1	169.3	0	0	0	111	F316 L317	I313-F316 PolarHBondContact O-N 2.91Å; I313-L317 HydrophobicContact CG2-CD1 3.68Å; I313-L317 HydrophobicContact CG2-CG 4.23Å; I313-L317 PolarHBondContact O-N 3.22Å
314	F	44.9	Very low	46.2	Very low	120 Å²	120	113 Å²	113	53%	0.526	55%	0.546	S	S	.	.	H	α-helix	trans	-64.9	-42.4	-174.2	-155.5	-98.2	0	0	0	114.4	F310 F316 Y318	F310-F314 HydrophobicContact CE1-CD2 4.23Å; F310-F314 PolarHBondContact O-N 3Å; F314-F316 VanDerWaalsContact C-N 3.3Å; F314-F316 PolarHBondContact O-N 2.98Å; F314-Y318 VanDerWaalsContact O-CB 3.32Å; F314-Y318 WeakPolarHBondContact O-CB 3.27Å; F314-Y318 PolarHBondContact O-N 3.19Å
315	P	50.8	Low	46	Very low	77 Å²	77	113 Å²	113	50%	0.5	54%	0.54	S	S	.	.	H	α-helix	trans	-65	-34.2	174.6	-18.2	30.9	0	0	0	112.5	P311 K319	P311-P315 WeakPolarHBondContact O-CD 3.45Å; P311-P315 VanDerWaalsContact O-CG 3.24Å; P311-P315 WeakPolarHBondContact O-CG 3.41Å; P315-K319 VanDerWaalsContact O-CB 3.24Å; P315-K319 WeakPolarHBondContact O-CB 3.41Å; P315-K319 PolarHBondContact O-N 3.21Å
316	F	52.1	Low	45.8	Very low	137 Å²	137	116 Å²	116	60%	0.601	54%	0.543	S	S	*	.	H	α-helix	trans	-68.2	-45.1	179.6	-171.3	-98.2	0	0	0	111.8	I313 F314 N320	I313-F316 PolarHBondContact O-N 2.91Å; F314-F316 VanDerWaalsContact C-N 3.3Å; F314-F316 PolarHBondContact O-N 2.98Å; F316-N320 WeakPolarHBondContact CE1-ND2 3.16Å; F316-N320 PolarHBondContact O-N 3.48Å; F316-N320 VanDerWaalsContact O-N 3.14Å
317	L	42.5	Very low	46.1	Very low	96 Å²	96	115.9 Å²	115.9	50%	0.503	55%	0.547	S	S	.	.	H	α-helix	trans	-67.2	-40.7	176.2	-71.7	170.2	0	0	0	112.2	I313 N320 Y321	I313-L317 HydrophobicContact CG2-CD1 3.68Å; I313-L317 HydrophobicContact CG2-CG 4.23Å; I313-L317 PolarHBondContact O-N 3.22Å; L317-N320 PolarHBondContact O-N 2.81Å; L317-Y321 PolarHBondContact O-N 3.4Å
318	Y	48.2	Very low	45.9	Very low	149 Å²	149	113.9 Å²	113.9	58%	0.584	55%	0.545	S	S	*	.	H	α-helix	trans	-65.3	-42.9	178.1	-171.9	-106.2	0	0	0	112.2	F314 N320 Y321 I322	F314-Y318 VanDerWaalsContact O-CB 3.32Å; F314-Y318 WeakPolarHBondContact O-CB 3.27Å; F314-Y318 PolarHBondContact O-N 3.19Å; Y318-N320 PolarHBondContact O-N 3.01Å; Y318-Y321 PolarHBondContact O-N 3.09Å; Y318-I322 HydrophobicContact CD1-CD1 3.76Å; Y318-I322 HydrophobicContact CE1-CD1 3.25Å; Y318-I322 HydrophobicContact CE1-CG1 4.41Å; Y318-I322 HydrophobicContact CE2-CD1 4.18Å; Y318-I322 HydrophobicContact CG-CD1 4.42Å; Y318-I322 VanDerWaalsContact CZ-CD1 3.49Å; Y318-I322 PolarHBondContact O-N 3.27Å; Y318-I322 VanDerWaalsContact O-N 3.09Å
319	K	49.8	Very low	45.9	Very low	158 Å²	158	110.2 Å²	110.2	69%	0.687	53%	0.531	S	S	*	.	H	α-helix	trans	-62.4	-42.1	176.3	-170.3	175.3	-178.8	179.7	0	111.9	P315 S323	P315-K319 VanDerWaalsContact O-CB 3.24Å; P315-K319 WeakPolarHBondContact O-CB 3.41Å; P315-K319 PolarHBondContact O-N 3.21Å; K319-S323 PolarHBondContact O-N 3.49Å; K319-S323 VanDerWaalsContact O-N 3.11Å
320	N	47.2	Very low	45.9	Very low	78 Å²	78	112.5 Å²	112.5	42%	0.417	54%	0.539	S	S	.	.	H	α-helix	trans	-67.5	-40	177.2	-73.4	-13.9	0	0	0	112.1	F316 L317 Y318 S323 C324	F316-N320 WeakPolarHBondContact CE1-ND2 3.16Å; F316-N320 PolarHBondContact O-N 3.48Å; F316-N320 VanDerWaalsContact O-N 3.14Å; L317-N320 PolarHBondContact O-N 2.81Å; Y318-N320 PolarHBondContact O-N 3.01Å; N320-S323 PolarHBondContact O-N 3.34Å; N320-S323 PolarHBondContact O-OG 2.99Å; N320-C324 PolarHBondContact O-N 2.99Å; N320-C324 VanDerWaalsContact O-N 3.09Å
321	Y	46.2	Very low	45.7	Very low	189 Å²	189	111.8 Å²	111.8	74%	0.741	54%	0.54	S	S	*	.	H	α-helix	trans	-63.8	-43.3	177.6	-117.4	-88.7	0	0	0	112.9	L317 Y318 C324 F325	L317-Y321 PolarHBondContact O-N 3.4Å; Y318-Y321 PolarHBondContact O-N 3.09Å; Y321-C324 PolarHBondContact O-N 2.89Å; Y321-F325 WeakPolarHBondContact O-CB 3.38Å; Y321-F325 PolarHBondContact O-N 3.28Å
322	I	48.9	Very low	45.1	Very low	66 Å²	66	116.2 Å²	116.2	34%	0.338	55%	0.548	S	S	.	.	H	α-helix	trans	-65.2	-41.3	176.6	-70.2	174.8	0	0	0	111.1	Y318 C324 F325 Y326	Y318-I322 HydrophobicContact CD1-CD1 3.76Å; Y318-I322 HydrophobicContact CE1-CD1 3.25Å; Y318-I322 HydrophobicContact CE1-CG1 4.41Å; Y318-I322 HydrophobicContact CE2-CD1 4.18Å; Y318-I322 HydrophobicContact CG-CD1 4.42Å; Y318-I322 VanDerWaalsContact CZ-CD1 3.49Å; Y318-I322 PolarHBondContact O-N 3.27Å; Y318-I322 VanDerWaalsContact O-N 3.09Å; I322-C324 VanDerWaalsContact C-N 3.28Å; I322-C324 PolarHBondContact O-N 3.48Å; I322-F325 WeakPolarHBondContact O-CB 3.47Å; I322-F325 PolarHBondContact O-N 3.44Å; I322-Y326 HydrophobicContact CG2-CD2 3.73Å; I322-Y326 HydrophobicContact CG2-CE2 3.83Å; I322-Y326 WeakPolarHBondContact O-CD2 3.45Å; I322-Y326 PolarHBondContact O-N 3.02Å
323	S	49.7	Very low	44.3	Very low	69 Å²	69	118.8 Å²	118.8	48%	0.483	56%	0.558	S	S	.	*	H	α-helix	trans	-61.7	-37.7	178	78.4	0	0	0	0	112.4	K319 N320 K327	K319-S323 PolarHBondContact O-N 3.49Å; K319-S323 VanDerWaalsContact O-N 3.11Å; N320-S323 PolarHBondContact O-N 3.34Å; N320-S323 PolarHBondContact O-OG 2.99Å; S323-K327 PolarHBondContact O-N 3.33Å
324	C	45.9	Very low	43.8	Very low	70 Å²	70	121.2 Å²	121.2	47%	0.473	57%	0.572	S	S	.	*	H	α-helix	trans	-71.1	-37.2	175.7	-128.1	0	0	0	0	111.9	N320 Y321 I322 K327 N328	N320-C324 PolarHBondContact O-N 2.99Å; N320-C324 VanDerWaalsContact O-N 3.09Å; Y321-C324 PolarHBondContact O-N 2.89Å; I322-C324 VanDerWaalsContact C-N 3.28Å; I322-C324 PolarHBondContact O-N 3.48Å; C324-K327 PolarHBondContact O-N 3.28Å; C324-N328 WeakPolarHBondContact O-CB 3.12Å; C324-N328 PolarHBondContact O-N 3.37Å
325	F	44.6	Very low	43.1	Very low	104 Å²	104	121.7 Å²	121.7	46%	0.456	58%	0.579	S	S	.	*	H	α-helix	trans	-63.2	-45.5	177.1	-169.6	-93.2	0	0	0	112.2	Y321 I322 N328 Q329 F349	Y321-F325 WeakPolarHBondContact O-CB 3.38Å; Y321-F325 PolarHBondContact O-N 3.28Å; I322-F325 WeakPolarHBondContact O-CB 3.47Å; I322-F325 PolarHBondContact O-N 3.44Å; F325-N328 PolarHBondContact O-N 2.98Å; F325-Q329 HydrophobicContact CE1-CG 4.27Å; F325-Q329 PolarHBondContact O-N 3.5Å; F325-F349 HydrophobicContact CE2-CZ 4.33Å
326	Y	42.5	Very low	42.1	Very low	157 Å²	157	124.3 Å²	124.3	62%	0.616	59%	0.589	S	S	*	*	H	α-helix	trans	-67.6	-36.4	176.5	-87.2	-77.4	0	0	0	112.9	I322 Q329 K330	I322-Y326 HydrophobicContact CG2-CD2 3.73Å; I322-Y326 HydrophobicContact CG2-CE2 3.83Å; I322-Y326 WeakPolarHBondContact O-CD2 3.45Å; I322-Y326 PolarHBondContact O-N 3.02Å; Y326-Q329 PolarHBondContact O-N 3.23Å; Y326-K330 PolarHBondContact O-N 3Å
327	K	44.3	Very low	40.9	Very low	159 Å²	159	125.1 Å²	125.1	69%	0.691	60%	0.599	S	S	*	*	H	α-helix	trans	-62.5	-42.1	173.4	-112	179.3	175.7	179.7	0	111.9	S323 C324 L331	S323-K327 PolarHBondContact O-N 3.33Å; C324-K327 PolarHBondContact O-N 3.28Å; K327-L331 PolarHBondContact O-N 3.41Å
328	N	39.3	Very low	40	Very low	92 Å²	92	126.5 Å²	126.5	49%	0.492	61%	0.607	S	S	.	*	H	α-helix	trans	-74.6	-29.4	-179.9	-75.1	-16.2	0	0	0	113.6	C324 F325 R332	C324-N328 WeakPolarHBondContact O-CB 3.12Å; C324-N328 PolarHBondContact O-N 3.37Å; F325-N328 PolarHBondContact O-N 2.98Å; N328-R332 WeakPolarHBondContact O-CB 3.48Å; N328-R332 PolarHBondContact O-N 3.37Å
329	Q	41.2	Very low	39	Very low	94 Å²	94	129.6 Å²	129.6	44%	0.439	62%	0.619	S	S	.	*	H	α-helix	trans	-68.7	-40.4	171.8	-93.8	-175.4	-19.1	0	0	112.5	F325 Y326 L331 R332 L333	F325-Q329 HydrophobicContact CE1-CG 4.27Å; F325-Q329 PolarHBondContact O-N 3.5Å; Y326-Q329 PolarHBondContact O-N 3.23Å; Q329-L331 VanDerWaalsContact C-N 3.33Å; Q329-L331 PolarHBondContact O-N 3.15Å; Q329-R332 PolarHBondContact O-N 3.02Å; Q329-L333 PolarHBondContact O-N 3.41Å; Q329-L333 VanDerWaalsContact O-N 3.09Å
330	K	37.7	Very low	38.1	Very low	169 Å²	169	127 Å²	127	74%	0.735	62%	0.618	S	S	*	*	H	α-helix	trans	-63	-38.2	173.8	-99.2	-177.5	173.8	-179.5	0	112.4	Y326	Y326-K330 PolarHBondContact O-N 3Å
331	L	36.4	Very low	37.1	Very low	109 Å²	109	134 Å²	134	57%	0.571	64%	0.641	S	S	*	*	H	α-helix	trans	-70.7	-32.2	175.2	-80.3	161.3	0	0	0	113	K327 Q329	K327-L331 PolarHBondContact O-N 3.41Å; Q329-L331 VanDerWaalsContact C-N 3.33Å; Q329-L331 PolarHBondContact O-N 3.15Å
332	R	33.1	Very low	36.3	Very low	160 Å²	160	132.9 Å²	132.9	60%	0.604	64%	0.635	S	S	*	*	H	α-helix	trans	-76.3	-30.4	178.5	-89.9	-175.7	172.4	173.4	1.8	114.6	N328 Q329 N334 L335	N328-R332 WeakPolarHBondContact O-CB 3.48Å; N328-R332 PolarHBondContact O-N 3.37Å; Q329-R332 PolarHBondContact O-N 3.02Å; R332-N334 PolarHBondContact O-N 3.25Å; R332-L335 PolarHBondContact O-N 2.95Å
333	L	37.6	Very low	35.6	Very low	150 Å²	150	136.1 Å²	136.1	79%	0.785	65%	0.653	S	S	*	*	H	α-helix	trans	-68.8	-18.8	177.3	-78.5	164.6	0	0	0	112.9	Q329	Q329-L333 PolarHBondContact O-N 3.41Å; Q329-L333 VanDerWaalsContact O-N 3.09Å
334	N	36.9	Very low	34.8	Very low	143 Å²	143	137.4 Å²	137.4	77%	0.765	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-5.5	178.7	-74.8	-0.1	0	0	0	114.5	R332	R332-N334 PolarHBondContact O-N 3.25Å
335	L	30.8	Very low	34.3	Very low	130 Å²	130	138.8 Å²	138.8	68%	0.681	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.8	-3.8	-164.8	-83.3	169.8	0	0	0	117.7	R332	R332-L335 PolarHBondContact O-N 2.95Å
336	N	28.5	Very low	33.9	Very low	132 Å²	132	140.1 Å²	140.1	71%	0.706	67%	0.67	S	S	*	*			trans	-121.4	76.1	-176.1	-81.4	12.3	0	0	0	113.6
337	N	27	Very low	33.4	Very low	153 Å²	153	138.3 Å²	138.3	82%	0.818	67%	0.672	S	S	*	*			trans	-84.2	120.3	133.9	-80.5	-15.1	0	0	0	106.9
338	N	24.7	Very low	33.1	Very low	125 Å²	125	133.6 Å²	133.6	67%	0.668	66%	0.658	S	S	*	*	S	Bend	trans	103.3	117.5	163.5	-55.6	-15.1	0	0	0	119.3
339	Y	26.4	Very low	33.3	Very low	215 Å²	215	134.5 Å²	134.5	84%	0.843	66%	0.658	S	S	*	*			trans	98.7	135.9	151.1	-61.7	-70.7	0	0	0	121.9
340	P	31.9	Very low	33.3	Very low	102 Å²	102	135.1 Å²	135.1	66%	0.662	66%	0.664	S	S	*	*			trans	-108.2	119.9	-163	36.7	-22.2	0	0	0	112.8
341	Y	25.8	Very low	33.3	Very low	227 Å²	227	134.5 Å²	134.5	89%	0.89	66%	0.661	S	S	*	*			trans	-158.7	51.7	169.9	-107.9	-75.9	0	0	0	112.4
342	W	28.4	Very low	33.6	Very low	165 Å²	165	135.5 Å²	135.5	63%	0.625	66%	0.661	S	S	*	*			trans	-136.7	73.3	-169	-81.2	59.4	0	0	0	113.5
343	N	34.5	Very low	34.4	Very low	134 Å²	134	132 Å²	132	72%	0.717	65%	0.653	S	S	*	*	S	Bend	trans	-128	-12.2	169.6	-105.1	1.8	0	0	0	116.1
344	S	33.4	Very low	34.7	Very low	96 Å²	96	133.2 Å²	133.2	67%	0.671	65%	0.649	S	S	*	*	S	Bend	trans	-85.7	-32.9	176.6	55.1	0	0	0	0	113.8	K346	S344-K346 PolarHBondContact O-N 3.33Å
345	N	34.6	Very low	35	Very low	98 Å²	98	133.3 Å²	133.3	52%	0.524	64%	0.64	S	S	.	*	H	α-helix	trans	-76.7	-22.4	-175.4	-78.2	-15.1	0	0	0	114.5	N347 S348 F349	N345-N347 VanDerWaalsContact C-N 3.34Å; N345-N347 PolarHBondContact O-N 3.32Å; N345-S348 PolarHBondContact O-N 3.27Å; N345-S348 PolarHBondContact O-OG 2.97Å; N345-F349 WeakPolarHBondContact O-CB 3.45Å; N345-F349 PolarHBondContact O-N 3.34Å; N345-F349 VanDerWaalsContact O-N 3.1Å
346	K	36.9	Very low	35.8	Very low	132 Å²	132	134.5 Å²	134.5	57%	0.574	64%	0.636	S	S	*	*	H	α-helix	trans	-62.5	-38.8	178.7	-80.3	-177.7	177.2	174.7	0	112.3	S344 F349 L350	S344-K346 PolarHBondContact O-N 3.33Å; K346-F349 PolarHBondContact O-N 2.84Å; K346-L350 WeakPolarHBondContact O-CB 3.37Å; K346-L350 PolarHBondContact O-N 2.98Å
347	N	32.7	Very low	36.6	Very low	120 Å²	120	130.7 Å²	130.7	64%	0.642	62%	0.62	S	S	*	*	H	α-helix	trans	-70.2	-39.6	179.7	-72.2	-4	0	0	0	111.8	N345 F349 F351	N345-N347 VanDerWaalsContact C-N 3.34Å; N345-N347 PolarHBondContact O-N 3.32Å; N347-F349 VanDerWaalsContact C-N 3.29Å; N347-F349 PolarHBondContact O-N 2.88Å; N347-F351 WeakPolarHBondContact O-CB 3.32Å; N347-F351 PolarHBondContact O-N 2.91Å
348	S	38	Very low	37.4	Very low	59 Å²	59	130.6 Å²	130.6	41%	0.413	61%	0.609	S	S	.	*	H	α-helix	trans	-66.3	-32.3	175.7	77.8	0	0	0	0	112.6	N345 K352	N345-S348 PolarHBondContact O-N 3.27Å; N345-S348 PolarHBondContact O-OG 2.97Å; S348-K352 WeakPolarHBondContact O-CG 3.49Å; S348-K352 PolarHBondContact O-N 3.12Å
349	F	43.4	Very low	38.6	Very low	112 Å²	112	127.4 Å²	127.4	49%	0.491	59%	0.591	S	S	.	*	H	α-helix	trans	-75.8	-44.4	179.2	-172.8	-103.5	0	0	0	112.2	F325 N345 K346 N347 F351 K352 I353	F325-F349 HydrophobicContact CE2-CZ 4.33Å; N345-F349 WeakPolarHBondContact O-CB 3.45Å; N345-F349 PolarHBondContact O-N 3.34Å; N345-F349 VanDerWaalsContact O-N 3.1Å; K346-F349 PolarHBondContact O-N 2.84Å; N347-F349 VanDerWaalsContact C-N 3.29Å; N347-F349 PolarHBondContact O-N 2.88Å; F349-F351 VanDerWaalsContact C-N 3.29Å; F349-F351 PolarHBondContact O-N 3.28Å; F349-K352 PolarHBondContact O-N 3.14Å; F349-I353 HydrophobicContact CD1-CD1 3.72Å; F349-I353 HydrophobicContact CE1-CD1 3.36Å; F349-I353 HydrophobicContact CE1-CG1 4.38Å; F349-I353 HydrophobicContact CZ-CD1 3.94Å; F349-I353 WeakPolarHBondContact O-CG1 3.48Å; F349-I353 PolarHBondContact O-N 3.36Å
350	L	40.1	Very low	39.6	Very low	106 Å²	106	124.9 Å²	124.9	56%	0.555	58%	0.581	S	S	*	*	H	α-helix	trans	-59.9	-39.6	172.3	-92.9	152.2	0	0	0	111.6	K346 K352 I353 Y354	K346-L350 WeakPolarHBondContact O-CB 3.37Å; K346-L350 PolarHBondContact O-N 2.98Å; L350-K352 PolarHBondContact O-N 3.34Å; L350-I353 PolarHBondContact O-N 3.09Å; L350-Y354 PolarHBondContact O-N 3.44Å
351	F	38.6	Very low	40.2	Very low	156 Å²	156	126.4 Å²	126.4	68%	0.684	58%	0.579	S	S	*	*	H	α-helix	trans	-64.2	-40.7	177.2	-150.3	-87	0	0	0	112.2	N347 F349 Y354 Y355	N347-F351 WeakPolarHBondContact O-CB 3.32Å; N347-F351 PolarHBondContact O-N 2.91Å; F349-F351 VanDerWaalsContact C-N 3.29Å; F349-F351 PolarHBondContact O-N 3.28Å; F351-Y354 PolarHBondContact O-N 2.78Å; F351-Y355 VanDerWaalsContact O-CB 3.27Å; F351-Y355 WeakPolarHBondContact O-CB 3.37Å; F351-Y355 PolarHBondContact O-N 3.18Å
352	K	42.6	Very low	41	Very low	130 Å²	130	118.2 Å²	118.2	57%	0.565	56%	0.555	S	S	*	*	H	α-helix	trans	-63.9	-42.8	174.5	-76.1	178.4	-178.7	-179.6	0	111.6	S348 F349 L350 Y355 Y356	S348-K352 WeakPolarHBondContact O-CG 3.49Å; S348-K352 PolarHBondContact O-N 3.12Å; F349-K352 PolarHBondContact O-N 3.14Å; L350-K352 PolarHBondContact O-N 3.34Å; K352-Y355 PolarHBondContact O-N 3.02Å; K352-Y356 HydrophobicContact CB-CE2 4.38Å; K352-Y356 WeakPolarHBondContact O-CD2 3.47Å; K352-Y356 PolarHBondContact O-N 3Å
353	I	49.1	Very low	41.9	Very low	86 Å²	86	115 Å²	115	44%	0.441	54%	0.543	S	S	.	.	H	α-helix	trans	-62	-45.8	176.7	-68.7	168.7	0	0	0	111	F349 L350 Y355 Y356 S357	F349-I353 HydrophobicContact CD1-CD1 3.72Å; F349-I353 HydrophobicContact CE1-CD1 3.36Å; F349-I353 HydrophobicContact CE1-CG1 4.38Å; F349-I353 HydrophobicContact CZ-CD1 3.94Å; F349-I353 WeakPolarHBondContact O-CG1 3.48Å; F349-I353 PolarHBondContact O-N 3.36Å; L350-I353 PolarHBondContact O-N 3.09Å; I353-Y355 VanDerWaalsContact C-N 3.32Å; I353-Y355 PolarHBondContact O-N 3.17Å; I353-Y356 PolarHBondContact O-N 3.36Å; I353-S357 PolarHBondContact O-N 3.11Å; I353-S357 PolarHBondContact O-OG 3.03Å
354	Y	44.6	Very low	42.3	Very low	176 Å²	176	114.6 Å²	114.6	69%	0.69	54%	0.535	S	S	*	.	H	α-helix	trans	-64	-38.4	178.9	-134.7	-87	0	0	0	112.2	L350 F351 S357 Y358	L350-Y354 PolarHBondContact O-N 3.44Å; F351-Y354 PolarHBondContact O-N 2.78Å; Y354-S357 WeakPolarHBondContact CA-OG 3.31Å; Y354-S357 PolarHBondContact O-N 3.09Å; Y354-S357 PolarHBondContact O-OG 3.05Å; Y354-Y358 VanDerWaalsContact O-CB 3.29Å; Y354-Y358 WeakPolarHBondContact O-CB 3.41Å; Y354-Y358 PolarHBondContact O-N 3.42Å
355	Y	43.8	Very low	42.7	Very low	146 Å²	146	114 Å²	114	57%	0.573	53%	0.528	S	S	*	.	H	α-helix	trans	-64.7	-43.4	176.1	-169.9	-101.6	0	0	0	111.5	F351 K352 I353 Y358 I359	F351-Y355 VanDerWaalsContact O-CB 3.27Å; F351-Y355 WeakPolarHBondContact O-CB 3.37Å; F351-Y355 PolarHBondContact O-N 3.18Å; K352-Y355 PolarHBondContact O-N 3.02Å; I353-Y355 VanDerWaalsContact C-N 3.32Å; I353-Y355 PolarHBondContact O-N 3.17Å; Y355-Y358 PolarHBondContact O-N 2.97Å; Y355-I359 HydrophobicContact CD1-CD1 3.61Å; Y355-I359 HydrophobicContact CE1-CD1 3.38Å; Y355-I359 HydrophobicContact CE1-CG1 4.47Å; Y355-I359 HydrophobicContact CG-CD1 4.43Å; Y355-I359 VanDerWaalsContact O-CG1 3.27Å; Y355-I359 WeakPolarHBondContact O-CG1 3.47Å; Y355-I359 PolarHBondContact O-N 3.36Å
356	Y	47.9	Very low	43.1	Very low	155 Å²	155	112.1 Å²	112.1	61%	0.608	52%	0.522	S	S	*	.	H	α-helix	trans	-70.3	-35.8	176.5	-73.3	-62.1	0	0	0	113.2	K352 I353 I359 Y360	K352-Y356 HydrophobicContact CB-CE2 4.38Å; K352-Y356 WeakPolarHBondContact O-CD2 3.47Å; K352-Y356 PolarHBondContact O-N 3Å; I353-Y356 PolarHBondContact O-N 3.36Å; Y356-I359 PolarHBondContact O-N 2.98Å; Y356-Y360 PolarHBondContact O-N 3.48Å
357	S	44.3	Very low	43.4	Very low	51 Å²	51	111.2 Å²	111.2	36%	0.357	52%	0.516	S	S	.	.	H	α-helix	trans	-68.2	-37.5	174.3	61.6	0	0	0	0	112.1	I353 Y354 Y360 Q361	I353-S357 PolarHBondContact O-N 3.11Å; I353-S357 PolarHBondContact O-OG 3.03Å; Y354-S357 WeakPolarHBondContact CA-OG 3.31Å; Y354-S357 PolarHBondContact O-N 3.09Å; Y354-S357 PolarHBondContact O-OG 3.05Å; S357-Y360 PolarHBondContact O-N 3.11Å; S357-Q361 WeakPolarHBondContact O-CB 3.09Å; S357-Q361 PolarHBondContact O-N 3.49Å
358	Y	44.9	Very low	43.7	Very low	152 Å²	152	111.4 Å²	111.4	60%	0.596	52%	0.515	S	S	*	.	H	α-helix	trans	-64.5	-44.3	175.4	-173	-99	0	0	0	111.6	Y354 Y355 Y360 Q361 C362	Y354-Y358 VanDerWaalsContact O-CB 3.29Å; Y354-Y358 WeakPolarHBondContact O-CB 3.41Å; Y354-Y358 PolarHBondContact O-N 3.42Å; Y355-Y358 PolarHBondContact O-N 2.97Å; Y358-Y360 VanDerWaalsContact C-N 3.34Å; Y358-Y360 PolarHBondContact O-N 3.35Å; Y358-Q361 PolarHBondContact O-N 2.8Å; Y358-C362 PolarHBondContact O-N 3.27Å; Y358-C362 PolarHBondContact O-SG 3.18Å; Y358-C362 VanDerWaalsContact O-SG 3.41Å
359	I	48.1	Very low	43.7	Very low	57 Å²	57	113.8 Å²	113.8	29%	0.292	52%	0.523	S	S	.	.	H	α-helix	trans	-57.8	-47.2	173.4	-70.5	166.9	0	0	0	110.5	Y355 Y356 Q361 C362 Y363	Y355-I359 HydrophobicContact CD1-CD1 3.61Å; Y355-I359 HydrophobicContact CE1-CD1 3.38Å; Y355-I359 HydrophobicContact CE1-CG1 4.47Å; Y355-I359 HydrophobicContact CG-CD1 4.43Å; Y355-I359 VanDerWaalsContact O-CG1 3.27Å; Y355-I359 WeakPolarHBondContact O-CG1 3.47Å; Y355-I359 PolarHBondContact O-N 3.36Å; Y356-I359 PolarHBondContact O-N 2.98Å; I359-Q361 VanDerWaalsContact C-N 3.3Å; I359-Q361 PolarHBondContact O-N 2.95Å; I359-C362 PolarHBondContact O-N 3.36Å; I359-Y363 HydrophobicContact CG2-CD2 3.69Å; I359-Y363 HydrophobicContact CG2-CE2 3.83Å; I359-Y363 VanDerWaalsContact O-CD2 3.31Å; I359-Y363 WeakPolarHBondContact O-CD2 3.07Å; I359-Y363 PolarHBondContact O-N 3.46Å
360	Y	47.7	Very low	43.9	Very low	163 Å²	163	112 Å²	112	64%	0.639	53%	0.528	S	S	*	.	H	α-helix	trans	-60.1	-39.9	178.7	-176.9	-103	0	0	0	112.7	Y356 S357 Y358 Y363 K364	Y356-Y360 PolarHBondContact O-N 3.48Å; S357-Y360 PolarHBondContact O-N 3.11Å; Y358-Y360 VanDerWaalsContact C-N 3.34Å; Y358-Y360 PolarHBondContact O-N 3.35Å; Y360-Y363 PolarHBondContact O-N 2.99Å; Y360-K364 PolarHBondContact O-N 3.3Å
361	Q	45.3	Very low	43.9	Very low	133 Å²	133	116 Å²	116	62%	0.621	54%	0.538	S	S	*	.	H	α-helix	trans	-70.4	-40.6	-179.1	-156.7	156.5	-2.2	0	0	112.1	S357 Y358 I359 Y363 K364 T365	S357-Q361 WeakPolarHBondContact O-CB 3.09Å; S357-Q361 PolarHBondContact O-N 3.49Å; Y358-Q361 PolarHBondContact O-N 2.8Å; I359-Q361 VanDerWaalsContact C-N 3.3Å; I359-Q361 PolarHBondContact O-N 2.95Å; Q361-Y363 VanDerWaalsContact C-N 3.34Å; Q361-Y363 PolarHBondContact O-N 3.23Å; Q361-K364 PolarHBondContact O-N 3.28Å; Q361-T365 PolarHBondContact O-N 3.25Å; Q361-T365 VanDerWaalsContact O-N 3.11Å; Q361-T365 PolarHBondContact O-OG1 3.11Å
362	C	41.9	Very low	44	Very low	55 Å²	55	113.7 Å²	113.7	37%	0.372	54%	0.537	S	S	.	.	H	α-helix	trans	-62.9	-38.2	171.8	-68.7	0	0	0	0	112.5	Y358 I359 T365 S366	Y358-C362 PolarHBondContact O-N 3.27Å; Y358-C362 PolarHBondContact O-SG 3.18Å; Y358-C362 VanDerWaalsContact O-SG 3.41Å; I359-C362 PolarHBondContact O-N 3.36Å; C362-T365 WeakPolarHBondContact CA-OG1 3.24Å; C362-T365 PolarHBondContact O-N 2.97Å; C362-T365 PolarHBondContact O-OG1 2.8Å; C362-S366 PolarHBondContact O-N 3.23Å; C362-S366 VanDerWaalsContact O-N 3.11Å; C362-S366 PolarHBondContact O-OG 3.12Å
363	Y	47.8	Very low	43.4	Very low	99 Å²	99	117.7 Å²	117.7	39%	0.388	56%	0.564	S	S	.	*	H	α-helix	trans	-67	-41.3	175.9	-95.1	-78.5	0	0	0	112.1	I359 Y360 Q361 T365 S366 Y367	I359-Y363 HydrophobicContact CG2-CD2 3.69Å; I359-Y363 HydrophobicContact CG2-CE2 3.83Å; I359-Y363 VanDerWaalsContact O-CD2 3.31Å; I359-Y363 WeakPolarHBondContact O-CD2 3.07Å; I359-Y363 PolarHBondContact O-N 3.46Å; Y360-Y363 PolarHBondContact O-N 2.99Å; Q361-Y363 VanDerWaalsContact C-N 3.34Å; Q361-Y363 PolarHBondContact O-N 3.23Å; Y363-T365 VanDerWaalsContact C-N 3.34Å; Y363-T365 PolarHBondContact O-N 3.42Å; Y363-S366 WeakPolarHBondContact CA-OG 3.25Å; Y363-S366 PolarHBondContact O-N 3.32Å; Y363-S366 PolarHBondContact O-OG 3.4Å; Y363-Y367 PolarHBondContact O-N 3Å
364	K	42	Very low	43.1	Very low	124 Å²	124	119.3 Å²	119.3	54%	0.539	57%	0.57	S	S	.	*	H	α-helix	trans	-61.4	-41.9	176.1	-170.1	176.8	179.8	-178.6	0	111.6	Y360 Q361 Y367 M368	Y360-K364 PolarHBondContact O-N 3.3Å; Q361-K364 PolarHBondContact O-N 3.28Å; K364-Y367 PolarHBondContact O-N 3.49Å; K364-M368 VanDerWaalsContact O-CG 3.25Å; K364-M368 WeakPolarHBondContact O-CG 3.24Å; K364-M368 PolarHBondContact O-N 3.14Å; K364-M368 VanDerWaalsContact O-N 3.12Å
365	T	43.2	Very low	43.1	Very low	84 Å²	84	116.3 Å²	116.3	52%	0.515	56%	0.564	S	S	.	*	H	α-helix	trans	-66.8	-38	177.1	48.2	0	0	0	0	112.7	Q361 C362 Y363 N369	Q361-T365 PolarHBondContact O-N 3.25Å; Q361-T365 VanDerWaalsContact O-N 3.11Å; Q361-T365 PolarHBondContact O-OG1 3.11Å; C362-T365 WeakPolarHBondContact CA-OG1 3.24Å; C362-T365 PolarHBondContact O-N 2.97Å; C362-T365 PolarHBondContact O-OG1 2.8Å; Y363-T365 VanDerWaalsContact C-N 3.34Å; Y363-T365 PolarHBondContact O-N 3.42Å; T365-N369 PolarHBondContact O-N 3.47Å
366	S	43.2	Very low	43	Very low	59 Å²	59	114.6 Å²	114.6	41%	0.413	56%	0.563	S	S	.	*	H	α-helix	trans	-69.4	-33.1	175.9	55.5	0	0	0	0	113.4	C362 Y363 A370	C362-S366 PolarHBondContact O-N 3.23Å; C362-S366 VanDerWaalsContact O-N 3.11Å; C362-S366 PolarHBondContact O-OG 3.12Å; Y363-S366 WeakPolarHBondContact CA-OG 3.25Å; Y363-S366 PolarHBondContact O-N 3.32Å; Y363-S366 PolarHBondContact O-OG 3.4Å; S366-A370 PolarHBondContact O-N 3.43Å
367	Y	43.4	Very low	42.7	Very low	112 Å²	112	112.2 Å²	112.2	44%	0.439	56%	0.561	S	S	.	*	H	α-helix	trans	-71.7	-37.6	177.7	-120.7	-85.8	0	0	0	112	Y363 K364 A370 Y371	Y363-Y367 PolarHBondContact O-N 3Å; K364-Y367 PolarHBondContact O-N 3.49Å; Y367-A370 PolarHBondContact O-N 3.31Å; Y367-Y371 HydrophobicContact CD1-CD2 4.47Å; Y367-Y371 AromaticContact CD1-CE2 3.92Å; Y367-Y371 HydrophobicContact CD1-CE2 3.92Å; Y367-Y371 HydrophobicContact CE1-CE2 4.05Å; Y367-Y371 WeakPolarHBondContact O-CD2 3.39Å
368	M	37.3	Very low	42.7	Very low	125 Å²	125	116.1 Å²	116.1	62%	0.616	57%	0.573	S	S	*	*	H	α-helix	trans	-69.3	-35.6	179.4	-64.7	-67.7	-94.3	0	0	112	K364 A370 Y371	K364-M368 VanDerWaalsContact O-CG 3.25Å; K364-M368 WeakPolarHBondContact O-CG 3.24Å; K364-M368 PolarHBondContact O-N 3.14Å; K364-M368 VanDerWaalsContact O-N 3.12Å; M368-A370 VanDerWaalsContact C-N 3.32Å; M368-A370 PolarHBondContact O-N 3.42Å; M368-Y371 PolarHBondContact O-N 3.43Å
369	N	39.6	Very low	42.5	Very low	109 Å²	109	113.7 Å²	113.7	58%	0.583	57%	0.572	S	S	*	*	H	α-helix	trans	-71.1	-26.3	177.7	-70.8	5	0	0	0	113.2	T365 Y371 T372	T365-N369 PolarHBondContact O-N 3.47Å; N369-Y371 PolarHBondContact O-N 3.15Å; N369-T372 PolarHBondContact O-N 3.47Å; N369-T372 PolarHBondContact O-OG1 3.36Å
370	A	45.6	Very low	42.1	Very low	74 Å²	74	117.7 Å²	117.7	61%	0.612	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	-8.5	178.8	0	0	0	0	0	114.1	S366 Y367 M368	S366-A370 PolarHBondContact O-N 3.43Å; Y367-A370 PolarHBondContact O-N 3.31Å; M368-A370 VanDerWaalsContact C-N 3.32Å; M368-A370 PolarHBondContact O-N 3.42Å
371	Y	42.1	Very low	41.7	Very low	190 Å²	190	114.2 Å²	114.2	75%	0.745	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.1	-0.4	176.3	-79.1	-78.6	0	0	0	113.2	Y367 M368 N369	Y367-Y371 HydrophobicContact CD1-CD2 4.47Å; Y367-Y371 AromaticContact CD1-CE2 3.92Å; Y367-Y371 HydrophobicContact CD1-CE2 3.92Å; Y367-Y371 HydrophobicContact CE1-CE2 4.05Å; Y367-Y371 WeakPolarHBondContact O-CD2 3.39Å; M368-Y371 PolarHBondContact O-N 3.43Å; N369-Y371 PolarHBondContact O-N 3.15Å
372	T	39.6	Very low	41.4	Very low	108 Å²	108	112.7 Å²	112.7	66%	0.663	59%	0.585	S	S	*	*			trans	-104.6	0.9	178.8	51.5	0	0	0	0	114.4	N369	N369-T372 PolarHBondContact O-N 3.47Å; N369-T372 PolarHBondContact O-OG1 3.36Å
373	D	30.8	Very low	41.3	Very low	213 Å²	213	117.9 Å²	117.9	100%	1.139	61%	0.605	S	S	*	*			trans	-109.4	0	176.1	-70.3	-9.5	0	0	0	111.9

Retrieved 373 of 373 residues in 986.9 ms (Link to these results)

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