A0A3B3UVU6_9TELE Loading...

Gap junction protein

One gap junction consists of a cluster of closely packed pairs of transmembrane channels, the connexons, through which materials of low MW diffuse from one cell to a neighboring cell. Structural component of eye lens gap junctions. Gap junctions are dodecameric channels that connect the cytoplasm of adjoining cells. They are formed by the docking of two hexameric hemichannels, one from each cell membrane. Small molecules and ions diffuse from one cell to a neighboring cell via the central pore.

AlphaFold DB , UniProt , Accession A0A3B3UVU6, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 396 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	40.4	Very low	58.1	Low	244 Å²	244	95.5 Å²	95.5	100%	1.202	52%	0.521	S	S	*	.				0	142	0	-72.4	168.5	172.2	0	0	108.9
2	G	53.9	Low	58.4	Low	48 Å²	48	99.8 Å²	99.8	50%	0.495	53%	0.534	S	S	.	.			trans	-112	143.7	177.5	0	0	0	0	0	111.6	W4	G2-W4 PolarHBondContact O-N 3.05Å
3	D	58.9	Low	58.3	Low	149 Å²	149	101.2 Å²	101.2	80%	0.797	54%	0.535	S	S	*	.			trans	-79.3	86.3	-178.2	-78.6	-55.8	0	0	0	112.5	S5	D3-S5 PolarHBondContact O-N 3.12Å
4	W	65	Low	58.2	Low	122 Å²	122	95.8 Å²	95.8	46%	0.462	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-9.2	175.5	-58.9	101.3	0	0	0	114.1	G2 F6 L7 G8 I34	G2-W4 PolarHBondContact O-N 3.05Å; W4-F6 PolarHBondContact O-N 3.29Å; W4-L7 HydrophobicContact CE3-CD1 3.68Å; W4-L7 HydrophobicContact CZ3-CD1 3.91Å; W4-L7 PolarHBondContact O-N 3.15Å; W4-G8 PolarHBondContact O-N 3.05Å; W4-I34 HydrophobicContact CD2-CG2 3.98Å; W4-I34 HydrophobicContact CE3-CD1 4.05Å; W4-I34 HydrophobicContact CE3-CG2 4.06Å; W4-I34 HydrophobicContact CG-CG2 4.28Å; W4-I34 HydrophobicContact CZ3-CD1 4.3Å; W4-I34 HydrophobicContact CZ3-CG1 4.49Å
5	S	60	Low	57.9	Low	74 Å²	74	92.5 Å²	92.5	52%	0.517	49%	0.491	S	S	.	.	H	α-helix	trans	-58.9	-41	-178.1	53.8	0	0	0	0	113.3	D3 L7 G8 N9	D3-S5 PolarHBondContact O-N 3.12Å; S5-L7 PolarHBondContact O-N 2.98Å; S5-G8 PolarHBondContact O-N 3.12Å; S5-N9 PolarHBondContact O-N 3.24Å; S5-N9 PolarHBondContact O-OD1 3.41Å
6	F	57.2	Low	57.9	Low	148 Å²	148	96.4 Å²	96.4	65%	0.649	51%	0.505	S	S	*	.	H	α-helix	trans	-64.3	-40	177.8	-176	-108.7	0	0	0	112.3	W4 I10	W4-F6 PolarHBondContact O-N 3.29Å; F6-I10 HydrophobicContact CD1-CD1 3.96Å; F6-I10 HydrophobicContact CD2-CD1 4.42Å; F6-I10 HydrophobicContact CE1-CD1 3.54Å; F6-I10 HydrophobicContact CE2-CD1 4.05Å; F6-I10 HydrophobicContact CG-CD1 4.39Å; F6-I10 HydrophobicContact CZ-CD1 3.6Å; F6-I10 WeakPolarHBondContact O-CG1 3.5Å; F6-I10 PolarHBondContact O-N 3.41Å
7	L	59.2	Low	57.7	Low	50 Å²	50	94.2 Å²	94.2	26%	0.262	49%	0.492	S	S	.	.	H	α-helix	trans	-66.4	-40.2	173.8	-80.5	162	0	0	0	111.6	W4 S5 L11	W4-L7 HydrophobicContact CE3-CD1 3.68Å; W4-L7 HydrophobicContact CZ3-CD1 3.91Å; W4-L7 PolarHBondContact O-N 3.15Å; S5-L7 PolarHBondContact O-N 2.98Å; L7-L11 VanDerWaalsContact O-CD1 3.25Å; L7-L11 WeakPolarHBondContact O-CD1 3.43Å; L7-L11 PolarHBondContact O-N 3Å
8	G	62	Low	57.9	Low	40 Å²	40	90.4 Å²	90.4	41%	0.412	48%	0.475	S	S	.	.	H	α-helix	trans	-57.7	-54	175.4	0	0	0	0	0	112.5	W4 S5 I10 L11 E12	W4-G8 PolarHBondContact O-N 3.05Å; S5-G8 PolarHBondContact O-N 3.12Å; G8-I10 VanDerWaalsContact C-N 3.32Å; G8-I10 PolarHBondContact O-N 3Å; G8-L11 PolarHBondContact O-N 3.46Å; G8-L11 VanDerWaalsContact O-N 3.13Å; G8-E12 PolarHBondContact O-N 3.26Å
9	N	62.4	Low	58.3	Low	110 Å²	110	87.2 Å²	87.2	59%	0.588	46%	0.459	S	S	*	.	H	α-helix	trans	-58.2	-42.5	-179.1	-66.2	-2.4	0	0	0	112.2	S5 E12 E13	S5-N9 PolarHBondContact O-N 3.24Å; S5-N9 PolarHBondContact O-OD1 3.41Å; N9-E12 PolarHBondContact O-N 3.4Å; N9-E13 PolarHBondContact O-N 3.05Å
10	I	60.4	Low	58.7	Low	42 Å²	42	87.9 Å²	87.9	22%	0.215	47%	0.467	C	S	.	.	H	α-helix	trans	-70.4	-36.6	178.7	-60.6	168	0	0	0	111.1	F6 G8 E12 E13 V14 L90	F6-I10 HydrophobicContact CD1-CD1 3.96Å; F6-I10 HydrophobicContact CD2-CD1 4.42Å; F6-I10 HydrophobicContact CE1-CD1 3.54Å; F6-I10 HydrophobicContact CE2-CD1 4.05Å; F6-I10 HydrophobicContact CG-CD1 4.39Å; F6-I10 HydrophobicContact CZ-CD1 3.6Å; F6-I10 WeakPolarHBondContact O-CG1 3.5Å; F6-I10 PolarHBondContact O-N 3.41Å; G8-I10 VanDerWaalsContact C-N 3.32Å; G8-I10 PolarHBondContact O-N 3Å; I10-E12 PolarHBondContact O-N 3.3Å; I10-E13 PolarHBondContact O-N 3.48Å; I10-V14 VanDerWaalsContact O-CG2 3.23Å; I10-V14 WeakPolarHBondContact O-CG2 3.35Å; I10-V14 PolarHBondContact O-N 3.01Å; I10-L90 HydrophobicContact CB-CD2 4.39Å; I10-L90 HydrophobicContact CG2-CD2 3.48Å; I10-L90 VanDerWaalsContact CG2-CD2 3.48Å
11	L	59.8	Low	59	Low	24 Å²	24	89.5 Å²	89.5	13%	0.126	47%	0.474	C	S	.	.	H	α-helix	trans	-63.6	-27.6	173.4	-101.3	100.1	0	0	0	113.4	L7 G8 T27 F30	L7-L11 VanDerWaalsContact O-CD1 3.25Å; L7-L11 WeakPolarHBondContact O-CD1 3.43Å; L7-L11 PolarHBondContact O-N 3Å; G8-L11 PolarHBondContact O-N 3.46Å; G8-L11 VanDerWaalsContact O-N 3.13Å; L11-T27 HydrophobicContact CD2-CG2 4.27Å; L11-F30 HydrophobicContact CD1-CD1 3.92Å; L11-F30 HydrophobicContact CD1-CE1 3.46Å; L11-F30 VanDerWaalsContact CD1-CE1 3.46Å; L11-F30 HydrophobicContact CD1-CZ 4.12Å; L11-F30 HydrophobicContact CD2-CB 4.17Å; L11-F30 HydrophobicContact CD2-CD1 3.31Å; L11-F30 HydrophobicContact CD2-CE1 3.8Å; L11-F30 HydrophobicContact CD2-CG 3.85Å; L11-F30 HydrophobicContact CG-CD1 4.27Å; L11-F30 HydrophobicContact CG-CE1 4.29Å
12	E	61.3	Low	60.2	Low	147 Å²	147	78.1 Å²	78.1	69%	0.687	42%	0.42	S	S	*	.	H	α-helix	trans	-72.8	-38.4	173.1	-166	159.2	-146.9	0	0	111.5	G8 N9 I10 N15	G8-E12 PolarHBondContact O-N 3.26Å; N9-E12 PolarHBondContact O-N 3.4Å; I10-E12 PolarHBondContact O-N 3.3Å; E12-N15 WeakPolarHBondContact O-CA 3.48Å; E12-N15 WeakPolarHBondContact O-CB 3.46Å; E12-N15 PolarHBondContact O-N 2.96Å
13	E	57.8	Low	61	Low	117 Å²	117	78.3 Å²	78.3	55%	0.547	41%	0.405	S	S	.	.	H	α-helix	trans	-72	-28.1	175.5	-162.1	173.2	171.2	0	0	113.4	N9 I10 N15	N9-E13 PolarHBondContact O-N 3.05Å; I10-E13 PolarHBondContact O-N 3.48Å; E13-N15 PolarHBondContact O-N 3.38Å; E13-N15 VanDerWaalsContact O-N 3.1Å
14	V	55.9	Low	61.7	Low	26 Å²	26	75 Å²	75	16%	0.158	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-55.3	-25.2	165.5	177.3	0	0	0	0	111.7	I10 E16 V93	I10-V14 VanDerWaalsContact O-CG2 3.23Å; I10-V14 WeakPolarHBondContact O-CG2 3.35Å; I10-V14 PolarHBondContact O-N 3.01Å; V14-E16 PolarHBondContact O-N 3.17Å; V14-V93 HydrophobicContact CB-CG2 3.83Å; V14-V93 HydrophobicContact CG1-CG2 4.08Å; V14-V93 HydrophobicContact CG2-CB 4.45Å; V14-V93 HydrophobicContact CG2-CG2 3.45Å; V14-V93 VanDerWaalsContact CG2-CG2 3.45Å
15	N	54.7	Low	62.1	Low	47 Å²	47	75.8 Å²	75.8	25%	0.251	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-88.1	1.9	-158.4	-141.4	6.9	0	0	0	115.1	E12 E13 R23	E12-N15 WeakPolarHBondContact O-CA 3.48Å; E12-N15 WeakPolarHBondContact O-CB 3.46Å; E12-N15 PolarHBondContact O-N 2.96Å; E13-N15 PolarHBondContact O-N 3.38Å; E13-N15 VanDerWaalsContact O-N 3.1Å; N15-R23 WeakPolarHBondContact O-CD 3.41Å; N15-R23 PolarHBondContact O-NH1 3.24Å; N15-R23 WeakPolarHBondContact OD1-CB 3.49Å; N15-R23 VanDerWaalsContact OD1-CD 3.28Å; N15-R23 WeakPolarHBondContact OD1-CD 3.46Å; N15-R23 VanDerWaalsContact OD1-CG 3.28Å; N15-R23 WeakPolarHBondContact OD1-CG 3.39Å
16	E	57.4	Low	62.7	Low	154 Å²	154	73.2 Å²	73.2	72%	0.72	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-85.7	-29.7	176.3	-76	-146.2	115.7	0	0	114.6	V14 R23	V14-E16 PolarHBondContact O-N 3.17Å; E16-R23 PolarHBondContact O-NH1 2.77Å
17	H	54.4	Low	63.7	Low	59 Å²	59	67.3 Å²	67.3	27%	0.273	35%	0.35	S	S	.	.	S	Bend	trans	-107.4	-4.7	-156	-67.6	92.8	0	0	0	117.5	F148	H17-F148 AromaticContact CD2-CD1 3.76Å; H17-F148 AromaticContact CD2-CE1 3.6Å; H17-F148 AromaticContact NE2-CE1 3.57Å; H17-F148 AromaticContact NE2-CZ 3.59Å
18	S	60.9	Low	64.7	Low	26 Å²	26	68.8 Å²	68.8	18%	0.182	36%	0.361	C	S	.	.	S	Bend	trans	-98.6	-164.4	-173.6	159.4	0	0	0	0	112.4	R23 Y158 E230	S18-R23 VanDerWaalsContact O-CZ 3.22Å; S18-R23 PolarHBondContact O-NE 2.69Å; S18-R23 PolarHBondContact O-NH2 2.82Å; S18-Y158 VanDerWaalsContact CB-OH 3.24Å; S18-Y158 WeakPolarHBondContact CB-OH 3.45Å; S18-Y158 PolarHBondContact OG-OH 3.15Å; S18-E230 PolarHBondContact OG-OE1 3.28Å
19	T	65.8	Low	65.6	Low	29 Å²	29	67.8 Å²	67.8	18%	0.178	35%	0.346	C	S	.	.			trans	-80.4	146.7	168.7	73.6	0	0	0	0	110.8	I21 G22 R23 E230	T19-I21 VanDerWaalsContact C-N 3.3Å; T19-I21 PolarHBondContact O-N 2.97Å; T19-G22 PolarHBondContact OG1-N 3.2Å; T19-R23 WeakPolarHBondContact O-CB 3.39Å; T19-R23 VanDerWaalsContact O-CG 3.24Å; T19-R23 WeakPolarHBondContact O-CG 3.43Å; T19-R23 PolarHBondContact O-N 3.3Å; T19-R23 PolarHBondContact O-NE 3.42Å; T19-R23 VanDerWaalsContact O-NE 3.15Å; T19-E230 WeakPolarHBondContact CB-OE1 3.38Å; T19-E230 HydrophobicContact CG2-CG 4.47Å; T19-E230 WeakPolarHBondContact CG2-OE1 2.8Å; T19-E230 PolarHBondContact N-OE1 3.31Å; T19-E230 PolarHBondContact OG1-OE1 2.68Å
20	V	66.7	Low	66.4	Low	101 Å²	101	63.3 Å²	63.3	61%	0.612	32%	0.321	S	S	*	.	H	α-helix	trans	-61.6	-38.2	-173.9	-179.3	0	0	0	0	112.3	V24	V20-V24 WeakPolarHBondContact O-CG2 3.37Å; V20-V24 PolarHBondContact O-N 3.04Å
21	I	65.3	Low	67.5	Low	123 Å²	123	66 Å²	66	63%	0.631	34%	0.335	S	S	*	.	H	α-helix	trans	-73.8	-47.7	-176.7	-61.8	170.2	0	0	0	111	T19 W25	T19-I21 VanDerWaalsContact C-N 3.3Å; T19-I21 PolarHBondContact O-N 2.97Å; I21-W25 PolarHBondContact O-N 2.71Å
22	G	65.9	Low	68.7	Low	5 Å²	5	68.6 Å²	68.6	5%	0.052	35%	0.345	C	S	.	.	H	α-helix	trans	-59.8	-47.3	176.7	0	0	0	0	0	111.4	T19 L26	T19-G22 PolarHBondContact OG1-N 3.2Å; G22-L26 WeakPolarHBondContact O-CB 3.39Å; G22-L26 WeakPolarHBondContact O-CD1 3.28Å; G22-L26 WeakPolarHBondContact O-CG 3.47Å; G22-L26 PolarHBondContact O-N 3.04Å
23	R	70.4	Confident	70.1	Confident	52 Å²	52	61.9 Å²	61.9	20%	0.196	31%	0.314	C	S	.	.	H	α-helix	trans	-49.4	-67.3	175.9	-87.5	-174.1	-83.3	178.2	-11.2	114.5	N15 E16 S18 T19 W25 L26 T27	N15-R23 WeakPolarHBondContact O-CD 3.41Å; N15-R23 PolarHBondContact O-NH1 3.24Å; N15-R23 WeakPolarHBondContact OD1-CB 3.49Å; N15-R23 VanDerWaalsContact OD1-CD 3.28Å; N15-R23 WeakPolarHBondContact OD1-CD 3.46Å; N15-R23 VanDerWaalsContact OD1-CG 3.28Å; N15-R23 WeakPolarHBondContact OD1-CG 3.39Å; E16-R23 PolarHBondContact O-NH1 2.77Å; S18-R23 VanDerWaalsContact O-CZ 3.22Å; S18-R23 PolarHBondContact O-NE 2.69Å; S18-R23 PolarHBondContact O-NH2 2.82Å; T19-R23 WeakPolarHBondContact O-CB 3.39Å; T19-R23 VanDerWaalsContact O-CG 3.24Å; T19-R23 WeakPolarHBondContact O-CG 3.43Å; T19-R23 PolarHBondContact O-N 3.3Å; T19-R23 PolarHBondContact O-NE 3.42Å; T19-R23 VanDerWaalsContact O-NE 3.15Å; R23-W25 VanDerWaalsContact C-N 3.29Å; R23-W25 PolarHBondContact O-N 3.39Å; R23-L26 PolarHBondContact O-N 3.35Å; R23-T27 WeakPolarHBondContact O-CB 3.33Å; R23-T27 PolarHBondContact O-N 2.86Å; R23-T27 PolarHBondContact O-OG1 3.47Å
24	V	72.1	Confident	71.5	Confident	79 Å²	79	57.8 Å²	57.8	48%	0.479	30%	0.295	S	S	.	.	H	α-helix	trans	-59.8	-44.1	-169.9	174.8	0	0	0	0	110.2	V20 V28	V20-V24 WeakPolarHBondContact O-CG2 3.37Å; V20-V24 PolarHBondContact O-N 3.04Å; V24-V28 HydrophobicContact CG1-CG2 4.48Å; V24-V28 WeakPolarHBondContact O-CB 3.37Å; V24-V28 WeakPolarHBondContact O-CG2 3.25Å; V24-V28 PolarHBondContact O-N 2.92Å
25	W	73.6	Confident	72.9	Confident	138 Å²	138	61.1 Å²	61.1	52%	0.523	31%	0.312	S	S	.	.	H	α-helix	trans	-70.2	-43.7	179.3	-78	87	0	0	0	113.5	I21 R23 T27 V28 L29 L226	I21-W25 PolarHBondContact O-N 2.71Å; R23-W25 VanDerWaalsContact C-N 3.29Å; R23-W25 PolarHBondContact O-N 3.39Å; W25-T27 VanDerWaalsContact C-N 3.34Å; W25-T27 PolarHBondContact O-N 2.95Å; W25-V28 PolarHBondContact O-N 3.1Å; W25-L29 WeakPolarHBondContact O-CB 3.38Å; W25-L29 WeakPolarHBondContact O-CD1 3.37Å; W25-L29 WeakPolarHBondContact O-CG 3.37Å; W25-L29 PolarHBondContact O-N 3.06Å; W25-L226 HydrophobicContact CB-CD1 3.54Å; W25-L226 HydrophobicContact CB-CD2 4.17Å; W25-L226 HydrophobicContact CG-CD1 4.32Å; W25-L226 HydrophobicContact CG-CD2 4.41Å
26	L	72.6	Confident	74.4	Confident	20 Å²	20	59.3 Å²	59.3	11%	0.105	30%	0.302	C	S	.	.	H	α-helix	trans	-66.4	-36.1	179.4	-70	169.7	0	0	0	111.9	G22 R23 F30 L226 N227	G22-L26 WeakPolarHBondContact O-CB 3.39Å; G22-L26 WeakPolarHBondContact O-CD1 3.28Å; G22-L26 WeakPolarHBondContact O-CG 3.47Å; G22-L26 PolarHBondContact O-N 3.04Å; R23-L26 PolarHBondContact O-N 3.35Å; L26-F30 VanDerWaalsContact O-CB 3.26Å; L26-F30 WeakPolarHBondContact O-CB 3.5Å; L26-F30 PolarHBondContact O-N 3.21Å; L26-L226 HydrophobicContact CD2-CB 4.19Å; L26-L226 HydrophobicContact CD2-CD1 4.48Å; L26-L226 HydrophobicContact CG-CB 4.5Å; L26-N227 WeakPolarHBondContact CD1-OD1 3.23Å
27	T	78	Confident	75.8	Confident	25 Å²	25	52.4 Å²	52.4	15%	0.153	27%	0.27	C	S	.	.	H	α-helix	trans	-70	-43.6	174.5	-62.1	0	0	0	0	111.5	L11 R23 W25 F30 I31	L11-T27 HydrophobicContact CD2-CG2 4.27Å; R23-T27 WeakPolarHBondContact O-CB 3.33Å; R23-T27 PolarHBondContact O-N 2.86Å; R23-T27 PolarHBondContact O-OG1 3.47Å; W25-T27 VanDerWaalsContact C-N 3.34Å; W25-T27 PolarHBondContact O-N 2.95Å; T27-F30 PolarHBondContact O-N 2.96Å; T27-I31 HydrophobicContact CG2-CD1 3.89Å; T27-I31 HydrophobicContact CG2-CG1 4.47Å; T27-I31 WeakPolarHBondContact O-CG1 3.36Å; T27-I31 PolarHBondContact O-N 3.11Å
28	V	80.1	Confident	77.3	Confident	81 Å²	81	52 Å²	52	49%	0.491	28%	0.282	S	S	.	.	H	α-helix	trans	-60.8	-47	175.2	166.2	0	0	0	0	111.5	V24 W25 F30 I31 F32	V24-V28 HydrophobicContact CG1-CG2 4.48Å; V24-V28 WeakPolarHBondContact O-CB 3.37Å; V24-V28 WeakPolarHBondContact O-CG2 3.25Å; V24-V28 PolarHBondContact O-N 2.92Å; W25-V28 PolarHBondContact O-N 3.1Å; V28-F30 VanDerWaalsContact C-N 3.27Å; V28-F30 PolarHBondContact O-N 3.23Å; V28-I31 PolarHBondContact O-N 2.86Å; V28-F32 WeakPolarHBondContact O-CB 3.46Å; V28-F32 PolarHBondContact O-N 3.09Å
29	L	81.2	Confident	78.4	Confident	18 Å²	18	54.2 Å²	54.2	9%	0.094	29%	0.294	C	S	.	.	H	α-helix	trans	-64.1	-32	177.6	-66.8	164.4	0	0	0	112.2	W25 R33 V219 V222 L226	W25-L29 WeakPolarHBondContact O-CB 3.38Å; W25-L29 WeakPolarHBondContact O-CD1 3.37Å; W25-L29 WeakPolarHBondContact O-CG 3.37Å; W25-L29 PolarHBondContact O-N 3.06Å; L29-R33 WeakPolarHBondContact O-CG 3.24Å; L29-R33 PolarHBondContact O-N 3.2Å; L29-R33 VanDerWaalsContact O-N 3.08Å; L29-V219 HydrophobicContact CB-CG1 4.25Å; L29-V219 HydrophobicContact CD2-CG1 4.06Å; L29-V222 HydrophobicContact CD1-CB 4.41Å; L29-V222 HydrophobicContact CD1-CG1 3.81Å; L29-V222 HydrophobicContact CD2-CG1 4.4Å; L29-L226 HydrophobicContact CD1-CD1 3.45Å; L29-L226 VanDerWaalsContact CD1-CD1 3.45Å
30	F	80.3	Confident	79.2	Confident	16 Å²	16	52.9 Å²	52.9	7%	0.07	29%	0.286	C	S	.	.	H	α-helix	trans	-72.6	-46.3	176.1	-172.3	-91.1	0	0	0	112.6	L11 L26 T27 V28 F32 R33 I34 I82	L11-F30 HydrophobicContact CD1-CD1 3.92Å; L11-F30 HydrophobicContact CD1-CE1 3.46Å; L11-F30 VanDerWaalsContact CD1-CE1 3.46Å; L11-F30 HydrophobicContact CD1-CZ 4.12Å; L11-F30 HydrophobicContact CD2-CB 4.17Å; L11-F30 HydrophobicContact CD2-CD1 3.31Å; L11-F30 HydrophobicContact CD2-CE1 3.8Å; L11-F30 HydrophobicContact CD2-CG 3.85Å; L11-F30 HydrophobicContact CG-CD1 4.27Å; L11-F30 HydrophobicContact CG-CE1 4.29Å; L26-F30 VanDerWaalsContact O-CB 3.26Å; L26-F30 WeakPolarHBondContact O-CB 3.5Å; L26-F30 PolarHBondContact O-N 3.21Å; T27-F30 PolarHBondContact O-N 2.96Å; V28-F30 VanDerWaalsContact C-N 3.27Å; V28-F30 PolarHBondContact O-N 3.23Å; F30-F32 PolarHBondContact O-N 3.47Å; F30-R33 WeakPolarHBondContact O-CB 3.48Å; F30-R33 PolarHBondContact O-N 3.05Å; F30-I34 HydrophobicContact CD1-CD1 3.94Å; F30-I34 HydrophobicContact CE1-CD1 3.4Å; F30-I34 HydrophobicContact CE1-CG1 4.32Å; F30-I34 HydrophobicContact CZ-CD1 4.05Å; F30-I34 PolarHBondContact O-N 3.24Å; F30-I34 VanDerWaalsContact O-N 3.15Å; F30-I82 HydrophobicContact CE2-CG2 3.7Å; F30-I82 HydrophobicContact CZ-CG2 3.66Å
31	I	83.8	Confident	79.9	Confident	99 Å²	99	49.3 Å²	49.3	51%	0.508	27%	0.267	S	S	.	.	H	α-helix	trans	-56.6	-43.8	172.3	-69.5	166.3	0	0	0	109.8	T27 V28 R33 I34 L35	T27-I31 HydrophobicContact CG2-CD1 3.89Å; T27-I31 HydrophobicContact CG2-CG1 4.47Å; T27-I31 WeakPolarHBondContact O-CG1 3.36Å; T27-I31 PolarHBondContact O-N 3.11Å; V28-I31 PolarHBondContact O-N 2.86Å; I31-R33 PolarHBondContact O-N 3.2Å; I31-I34 PolarHBondContact O-N 2.8Å; I31-L35 WeakPolarHBondContact O-CB 3.33Å; I31-L35 PolarHBondContact O-N 2.73Å
32	F	84.3	Confident	80.5	Confident	78 Å²	78	50.6 Å²	50.6	34%	0.342	27%	0.27	S	S	.	.	H	α-helix	trans	-65.6	-35.9	-178.7	-168	-146.7	0	0	0	112.9	V28 F30 L35 I36 F215 V219	V28-F32 WeakPolarHBondContact O-CB 3.46Å; V28-F32 PolarHBondContact O-N 3.09Å; F30-F32 PolarHBondContact O-N 3.47Å; F32-L35 PolarHBondContact O-N 2.97Å; F32-I36 HydrophobicContact CD1-CD1 4.26Å; F32-I36 HydrophobicContact CD2-CD1 4.02Å; F32-I36 HydrophobicContact CD2-CG1 4.32Å; F32-I36 HydrophobicContact CE1-CD1 4.22Å; F32-I36 HydrophobicContact CE2-CD1 3.93Å; F32-I36 HydrophobicContact CE2-CG1 4.29Å; F32-I36 HydrophobicContact CG-CD1 4.18Å; F32-I36 HydrophobicContact CZ-CD1 4.05Å; F32-I36 WeakPolarHBondContact O-CB 3.13Å; F32-I36 WeakPolarHBondContact O-CD1 3.5Å; F32-I36 VanDerWaalsContact O-CG1 3.26Å; F32-I36 WeakPolarHBondContact O-CG1 3.37Å; F32-I36 PolarHBondContact O-N 3.35Å; F32-F215 HydrophobicContact CD1-CE1 4.18Å; F32-F215 AromaticContact CE1-CE1 3.35Å; F32-F215 HydrophobicContact CE1-CE1 3.35Å; F32-F215 AromaticContact CE1-CZ 3.44Å; F32-F215 HydrophobicContact CE1-CZ 3.44Å; F32-F215 VanDerWaalsContact CE1-CZ 3.44Å; F32-F215 AromaticContact CZ-CE1 3.61Å; F32-F215 HydrophobicContact CZ-CE1 3.61Å; F32-F215 AromaticContact CZ-CZ 3.45Å; F32-F215 HydrophobicContact CZ-CZ 3.45Å; F32-F215 VanDerWaalsContact CZ-CZ 3.45Å; F32-V219 HydrophobicContact CD1-CG2 4.26Å; F32-V219 HydrophobicContact CE1-CG2 4.43Å
33	R	89.8	Confident	81.5	Confident	6 Å²	6	57.3 Å²	57.3	2%	0.023	30%	0.299	C	S	.	.	H	α-helix	trans	-60.8	-47.3	169.1	-77.6	175	167.2	175.6	-6.1	112.4	L29 F30 I31 L35 I36 L37 I82 E169 M216 V219 A220	L29-R33 WeakPolarHBondContact O-CG 3.24Å; L29-R33 PolarHBondContact O-N 3.2Å; L29-R33 VanDerWaalsContact O-N 3.08Å; F30-R33 WeakPolarHBondContact O-CB 3.48Å; F30-R33 PolarHBondContact O-N 3.05Å; I31-R33 PolarHBondContact O-N 3.2Å; R33-L35 VanDerWaalsContact C-N 3.34Å; R33-I36 PolarHBondContact O-N 3.32Å; R33-L37 WeakPolarHBondContact O-CD1 3.36Å; R33-L37 PolarHBondContact O-N 2.65Å; R33-I82 HydrophobicContact CB-CD1 3.98Å; R33-I82 HydrophobicContact CB-CG1 4.3Å; R33-E169 IonicContact CZ-OE1 3.34Å; R33-E169 IonicContact CZ-OE2 3.65Å; R33-E169 IonicContact NH1-OE1 2.73Å; R33-E169 PolarHBondContact NH1-OE1 3.26Å; R33-E169 VanDerWaalsContact NH1-OE1 3.08Å; R33-E169 IonicContact NH1-OE2 2.71Å; R33-E169 PolarHBondContact NH1-OE2 2.92Å; R33-E169 VanDerWaalsContact NH2-CD 3.32Å; R33-E169 IonicContact NH2-OE1 3.18Å; R33-E169 PolarHBondContact NH2-OE1 3.07Å; R33-E169 IonicContact NH2-OE2 2.68Å; R33-E169 PolarHBondContact NH2-OE2 3.4Å; R33-M216 HydrophobicContact CB-CE 4.41Å; R33-M216 HydrophobicContact CG-CE 4.09Å; R33-M216 HydrophobicContact CG-SD 4.19Å; R33-V219 HydrophobicContact CG-CG1 3.87Å; R33-A220 VanDerWaalsContact NH2-CB 3.3Å
34	I	87.4	Confident	82.5	Confident	31 Å²	31	55 Å²	55	16%	0.159	29%	0.29	C	S	.	.	H	α-helix	trans	-63.7	-41.8	179	-67.9	177.5	0	0	0	110.7	W4 F30 I31 L37 G38 I82	W4-I34 HydrophobicContact CD2-CG2 3.98Å; W4-I34 HydrophobicContact CE3-CD1 4.05Å; W4-I34 HydrophobicContact CE3-CG2 4.06Å; W4-I34 HydrophobicContact CG-CG2 4.28Å; W4-I34 HydrophobicContact CZ3-CD1 4.3Å; W4-I34 HydrophobicContact CZ3-CG1 4.49Å; F30-I34 HydrophobicContact CD1-CD1 3.94Å; F30-I34 HydrophobicContact CE1-CD1 3.4Å; F30-I34 HydrophobicContact CE1-CG1 4.32Å; F30-I34 HydrophobicContact CZ-CD1 4.05Å; F30-I34 PolarHBondContact O-N 3.24Å; F30-I34 VanDerWaalsContact O-N 3.15Å; I31-I34 PolarHBondContact O-N 2.8Å; I34-L37 PolarHBondContact O-N 2.95Å; I34-G38 PolarHBondContact O-N 2.94Å; I34-I82 HydrophobicContact CG1-CG2 4.45Å
35	L	86.7	Confident	83.4	Confident	97 Å²	97	51.8 Å²	51.8	51%	0.508	27%	0.269	S	S	.	.	H	α-helix	trans	-58.9	-49	174.9	-175.4	154.5	0	0	0	111.2	I31 F32 R33 L37 G38 T39	I31-L35 WeakPolarHBondContact O-CB 3.33Å; I31-L35 PolarHBondContact O-N 2.73Å; F32-L35 PolarHBondContact O-N 2.97Å; R33-L35 VanDerWaalsContact C-N 3.34Å; L35-L37 VanDerWaalsContact C-N 3.35Å; L35-L37 PolarHBondContact O-N 3.38Å; L35-G38 PolarHBondContact O-N 2.9Å; L35-G38 VanDerWaalsContact O-N 3.12Å; L35-T39 HydrophobicContact CD2-CG2 4.19Å; L35-T39 PolarHBondContact O-N 3.25Å; L35-T39 PolarHBondContact O-OG1 3.43Å
36	I	85.2	Confident	84.1	Confident	9 Å²	9	47.9 Å²	47.9	5%	0.046	27%	0.272	C	S	.	.	H	α-helix	trans	-62.7	-40.4	179	-71.7	165.1	0	0	0	111.6	F32 R33 T39 A40 F212 F215 M216	F32-I36 HydrophobicContact CD1-CD1 4.26Å; F32-I36 HydrophobicContact CD2-CD1 4.02Å; F32-I36 HydrophobicContact CD2-CG1 4.32Å; F32-I36 HydrophobicContact CE1-CD1 4.22Å; F32-I36 HydrophobicContact CE2-CD1 3.93Å; F32-I36 HydrophobicContact CE2-CG1 4.29Å; F32-I36 HydrophobicContact CG-CD1 4.18Å; F32-I36 HydrophobicContact CZ-CD1 4.05Å; F32-I36 WeakPolarHBondContact O-CB 3.13Å; F32-I36 WeakPolarHBondContact O-CD1 3.5Å; F32-I36 VanDerWaalsContact O-CG1 3.26Å; F32-I36 WeakPolarHBondContact O-CG1 3.37Å; F32-I36 PolarHBondContact O-N 3.35Å; R33-I36 PolarHBondContact O-N 3.32Å; I36-T39 PolarHBondContact O-N 3.2Å; I36-T39 PolarHBondContact O-OG1 2.99Å; I36-A40 WeakPolarHBondContact O-CB 3.42Å; I36-A40 PolarHBondContact O-N 3.11Å; I36-F212 HydrophobicContact CG2-CD1 3.93Å; I36-F212 HydrophobicContact CG2-CE1 4.22Å; I36-F215 HydrophobicContact CD1-CD1 3.55Å; I36-F215 HydrophobicContact CD1-CE1 3.4Å; I36-F215 HydrophobicContact CD1-CZ 4.43Å; I36-M216 HydrophobicContact CB-SD 4.45Å; I36-M216 HydrophobicContact CG2-CG 4.44Å; I36-M216 HydrophobicContact CG2-SD 4Å
37	L	87.5	Confident	85	Confident	8 Å²	8	48 Å²	48	4%	0.042	27%	0.273	C	S	.	.	H	α-helix	trans	-59.6	-46.4	172	-98.3	68	0	0	0	111.3	R33 I34 L35 T39 A41 W78 V79 I82 M216	R33-L37 WeakPolarHBondContact O-CD1 3.36Å; R33-L37 PolarHBondContact O-N 2.65Å; I34-L37 PolarHBondContact O-N 2.95Å; L35-L37 VanDerWaalsContact C-N 3.35Å; L35-L37 PolarHBondContact O-N 3.38Å; L37-T39 VanDerWaalsContact C-N 3.34Å; L37-T39 PolarHBondContact O-N 3.47Å; L37-A41 WeakPolarHBondContact O-CB 3.32Å; L37-A41 PolarHBondContact O-N 3.34Å; L37-W78 HydrophobicContact CD1-CB 3.92Å; L37-W78 HydrophobicContact CD1-CE3 4.04Å; L37-V79 HydrophobicContact CD2-CB 4.46Å; L37-V79 HydrophobicContact CD2-CG2 3.5Å; L37-I82 HydrophobicContact CD1-CD1 3.93Å; L37-I82 HydrophobicContact CD2-CD1 3.59Å; L37-I82 HydrophobicContact CG-CD1 4.37Å; L37-M216 HydrophobicContact CD1-CE 3.6Å
38	G	85.2	Confident	85.7	Confident	51 Å²	51	48 Å²	48	53%	0.526	27%	0.271	S	S	.	.	H	α-helix	trans	-61	-37.6	177.4	0	0	0	0	0	113.7	I34 L35	I34-G38 PolarHBondContact O-N 2.94Å; L35-G38 PolarHBondContact O-N 2.9Å; L35-G38 VanDerWaalsContact O-N 3.12Å
39	T	84.1	Confident	86.3	Confident	73 Å²	73	49.1 Å²	49.1	45%	0.448	27%	0.271	S	S	.	.	H	α-helix	trans	-87.9	-23.8	-178.9	56.6	0	0	0	0	114.6	L35 I36 L37 F43	L35-T39 HydrophobicContact CD2-CG2 4.19Å; L35-T39 PolarHBondContact O-N 3.25Å; L35-T39 PolarHBondContact O-OG1 3.43Å; I36-T39 PolarHBondContact O-N 3.2Å; I36-T39 PolarHBondContact O-OG1 2.99Å; L37-T39 VanDerWaalsContact C-N 3.34Å; L37-T39 PolarHBondContact O-N 3.47Å; T39-F43 VanDerWaalsContact O-CD2 3.24Å; T39-F43 WeakPolarHBondContact O-CD2 3.4Å
40	A	82	Confident	86.9	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-105.7	-27.2	-174.3	0	0	0	0	0	114	I36 V44 W45 F212	I36-A40 WeakPolarHBondContact O-CB 3.42Å; I36-A40 PolarHBondContact O-N 3.11Å; A40-V44 HydrophobicContact CB-CG2 4.44Å; A40-V44 WeakPolarHBondContact O-CB 3.22Å; A40-V44 PolarHBondContact O-N 3.21Å; A40-W45 HydrophobicContact CB-CZ3 4.33Å; A40-W45 PolarHBondContact O-N 3.49Å; A40-F212 HydrophobicContact CB-CD1 3.88Å; A40-F212 HydrophobicContact CB-CE1 3.73Å; A40-F212 HydrophobicContact CB-CE2 4.43Å; A40-F212 HydrophobicContact CB-CG 4.3Å; A40-F212 HydrophobicContact CB-CZ 4.02Å
41	A	82.1	Confident	87.6	Confident	26 Å²	26	55.4 Å²	55.4	22%	0.215	31%	0.312	C	S	.	.	H	α-helix	trans	-60.9	-51.5	-174.3	0	0	0	0	0	112.7	L37 W45 G46 I75	L37-A41 WeakPolarHBondContact O-CB 3.32Å; L37-A41 PolarHBondContact O-N 3.34Å; A41-W45 CarbonylContact O-C 3.31Å; A41-W45 VanDerWaalsContact O-C 3.31Å; A41-W45 WeakPolarHBondContact O-CA 3.39Å; A41-W45 WeakPolarHBondContact O-CB 3.35Å; A41-W45 PolarHBondContact O-N 3.13Å; A41-G46 PolarHBondContact O-N 3.25Å; A41-G46 VanDerWaalsContact O-N 3.1Å; A41-I75 HydrophobicContact CB-CD1 3.99Å; A41-I75 HydrophobicContact CB-CG1 4.07Å; A41-I75 HydrophobicContact CB-CG2 3.72Å
42	E	78.6	Confident	88.2	Confident	150 Å²	150	50.7 Å²	50.7	70%	0.701	29%	0.288	S	S	*	.	H	α-helix	trans	-78.9	-35	-177.6	-63.6	179.6	179.2	0	0	111.9	G46	E42-G46 WeakPolarHBondContact O-CA 3.39Å; E42-G46 PolarHBondContact O-N 3.43Å
43	F	86.3	Confident	88.8	Confident	147 Å²	147	50.8 Å²	50.8	65%	0.645	29%	0.294	S	S	*	.	H	α-helix	trans	-83.8	-30.4	-174.2	-70.2	-89.9	0	0	0	115.3	T39	T39-F43 VanDerWaalsContact O-CD2 3.24Å; T39-F43 WeakPolarHBondContact O-CD2 3.4Å
44	V	91.1	Very high	89.2	Confident	3 Å²	3	50.8 Å²	50.8	2%	0.018	30%	0.296	C	S	.	.	H	α-helix	trans	-116.9	-21.5	-171.7	-173.2	0	0	0	0	111.6	A40 E208 K209 F212	A40-V44 HydrophobicContact CB-CG2 4.44Å; A40-V44 WeakPolarHBondContact O-CB 3.22Å; A40-V44 PolarHBondContact O-N 3.21Å; V44-E208 HydrophobicContact CG1-CB 4.22Å; V44-E208 HydrophobicContact CG1-CG 3.75Å; V44-E208 HydrophobicContact CG2-CG 4.19Å; V44-E208 WeakPolarHBondContact CG2-OE1 3.39Å; V44-K209 HydrophobicContact CG1-CG 3.78Å; V44-K209 WeakPolarHBondContact O-CE 3.04Å; V44-F212 HydrophobicContact CG1-CD2 4.22Å; V44-F212 HydrophobicContact CG1-CE2 4.48Å; V44-F212 HydrophobicContact CG2-CD2 4.27Å; V44-F212 HydrophobicContact CG2-CE2 3.77Å; V44-F212 HydrophobicContact CG2-CZ 4.43Å
45	W	92.3	Very high	89.6	Confident	11 Å²	11	55.3 Å²	55.3	4%	0.042	32%	0.32	C	S	.	.	S	Bend	trans	-119.7	-0.2	175.6	-81.8	-87.1	0	0	0	113.8	A40 A41 D47 E48 H74 I75 W78 K209 F212	A40-W45 HydrophobicContact CB-CZ3 4.33Å; A40-W45 PolarHBondContact O-N 3.49Å; A41-W45 CarbonylContact O-C 3.31Å; A41-W45 VanDerWaalsContact O-C 3.31Å; A41-W45 WeakPolarHBondContact O-CA 3.39Å; A41-W45 WeakPolarHBondContact O-CB 3.35Å; A41-W45 PolarHBondContact O-N 3.13Å; W45-D47 VanDerWaalsContact C-N 3.3Å; W45-D47 PolarHBondContact O-N 3.34Å; W45-E48 VanDerWaalsContact CD1-OE2 3.25Å; W45-E48 VanDerWaalsContact O-CB 3.29Å; W45-E48 WeakPolarHBondContact O-CB 3.45Å; W45-E48 VanDerWaalsContact O-CG 3.23Å; W45-E48 WeakPolarHBondContact O-CG 3.34Å; W45-E48 PolarHBondContact O-N 2.96Å; W45-H74 HydrophobicContact CZ2-CB 3.83Å; W45-I75 HydrophobicContact CB-CD1 4.46Å; W45-I75 HydrophobicContact CB-CG1 3.7Å; W45-I75 HydrophobicContact CD2-CD1 3.89Å; W45-I75 HydrophobicContact CD2-CG1 3.84Å; W45-I75 HydrophobicContact CE3-CD1 3.59Å; W45-I75 HydrophobicContact CE3-CG1 4.05Å; W45-I75 HydrophobicContact CG-CD1 4.28Å; W45-I75 HydrophobicContact CG-CG1 3.71Å; W45-I75 HydrophobicContact CZ3-CD1 4.16Å; W45-W78 AromaticContact CH2-CH2 3.49Å; W45-W78 HydrophobicContact CH2-CH2 3.49Å; W45-W78 VanDerWaalsContact CH2-CH2 3.49Å; W45-W78 AromaticContact CH2-CZ3 3.91Å; W45-W78 HydrophobicContact CH2-CZ3 3.91Å; W45-W78 HydrophobicContact CZ2-CH2 4.05Å; W45-W78 HydrophobicContact CZ3-CH2 4.03Å; W45-W78 AromaticContact CZ3-CZ3 3.99Å; W45-W78 HydrophobicContact CZ3-CZ3 3.99Å; W45-K209 HydrophobicContact CD2-CG 4.22Å; W45-K209 HydrophobicContact CH2-CB 3.97Å; W45-K209 HydrophobicContact CH2-CG 4.03Å; W45-K209 HydrophobicContact CZ2-CB 3.62Å; W45-K209 HydrophobicContact CZ2-CD 4.36Å; W45-K209 HydrophobicContact CZ2-CG 3.62Å; W45-K209 HydrophobicContact CZ3-CG 4.49Å; W45-F212 HydrophobicContact CH2-CB 3.71Å; W45-F212 HydrophobicContact CZ3-CB 3.84Å; W45-F212 HydrophobicContact CZ3-CD2 4.33Å; W45-F212 HydrophobicContact CZ3-CG 4.19Å
46	G	88.6	Confident	90.1	Very high	57 Å²	57	52.7 Å²	52.7	59%	0.588	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-33.4	174.3	0	0	0	0	0	113.4	A41 E42	A41-G46 PolarHBondContact O-N 3.25Å; A41-G46 VanDerWaalsContact O-N 3.1Å; E42-G46 WeakPolarHBondContact O-CA 3.39Å; E42-G46 PolarHBondContact O-N 3.43Å
47	D	90.9	Very high	90.7	Very high	22 Å²	22	61.8 Å²	61.8	12%	0.118	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	17.3	175.2	63.3	26.8	0	0	0	113.6	W45 Q49 S50 D51 S204 R205	W45-D47 VanDerWaalsContact C-N 3.3Å; W45-D47 PolarHBondContact O-N 3.34Å; D47-Q49 PolarHBondContact O-N 2.79Å; D47-Q49 VanDerWaalsContact O-N 3.1Å; D47-S50 WeakPolarHBondContact CA-OG 3.39Å; D47-S50 WeakPolarHBondContact CB-OG 3.41Å; D47-S50 PolarHBondContact O-N 3.11Å; D47-S50 PolarHBondContact O-OG 3.16Å; D47-D51 HydrophobicContact CB-CB 4.3Å; D47-D51 PolarHBondContact O-N 2.97Å; D47-S204 PolarHBondContact OD1-OG 3.25Å; D47-R205 IonicContact OD1-NE 3.37Å; D47-R205 PolarHBondContact OD1-NE 2.99Å; D47-R205 IonicContact OD2-CZ 3.16Å; D47-R205 IonicContact OD2-NE 2.7Å; D47-R205 PolarHBondContact OD2-NE 3.47Å; D47-R205 IonicContact OD2-NH2 2.76Å; D47-R205 PolarHBondContact OD2-NH2 3.44Å
48	E	92.3	Very high	91.1	Very high	25 Å²	25	65.1 Å²	65.1	12%	0.117	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-28.2	-172	71.4	172	163	0	0	114.5	W45 Y66 S73 R76	W45-E48 VanDerWaalsContact CD1-OE2 3.25Å; W45-E48 VanDerWaalsContact O-CB 3.29Å; W45-E48 WeakPolarHBondContact O-CB 3.45Å; W45-E48 VanDerWaalsContact O-CG 3.23Å; W45-E48 WeakPolarHBondContact O-CG 3.34Å; W45-E48 PolarHBondContact O-N 2.96Å; E48-Y66 VanDerWaalsContact CG-OH 3.26Å; E48-Y66 WeakPolarHBondContact CG-OH 3.02Å; E48-Y66 VanDerWaalsContact O-CE2 3.26Å; E48-Y66 WeakPolarHBondContact O-CE2 3.26Å; E48-Y66 PolarHBondContact OE1-OH 2.88Å; E48-Y66 PolarHBondContact OE2-OH 2.98Å; E48-S73 WeakPolarHBondContact OE1-CB 3.09Å; E48-S73 PolarHBondContact OE1-OG 3.02Å; E48-S73 WeakPolarHBondContact OE2-CB 3.38Å; E48-R76 IonicContact OE1-NH1 3.83Å
49	Q	92.4	Very high	91.7	Very high	105 Å²	105	67.5 Å²	67.5	49%	0.491	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	-25.7	-178.2	-171.5	179.4	-13.1	0	0	113.4	D47 Y66	D47-Q49 PolarHBondContact O-N 2.79Å; D47-Q49 VanDerWaalsContact O-N 3.1Å; Q49-Y66 HydrophobicContact CB-CD2 4.42Å; Q49-Y66 HydrophobicContact CB-CE1 4.14Å; Q49-Y66 HydrophobicContact CB-CE2 4.02Å; Q49-Y66 HydrophobicContact CG-CD1 3.94Å; Q49-Y66 HydrophobicContact CG-CD2 4.32Å; Q49-Y66 HydrophobicContact CG-CE1 3.94Å; Q49-Y66 HydrophobicContact CG-CE2 4.34Å; Q49-Y66 HydrophobicContact CG-CG 4.15Å
50	S	93.4	Very high	92.3	Very high	82 Å²	82	65.6 Å²	65.6	57%	0.573	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-32.6	177.7	55	0	0	0	0	112.7	D47	D47-S50 WeakPolarHBondContact CA-OG 3.39Å; D47-S50 WeakPolarHBondContact CB-OG 3.41Å; D47-S50 PolarHBondContact O-N 3.11Å; D47-S50 PolarHBondContact O-OG 3.16Å
51	D	95.1	Very high	93	Very high	83 Å²	83	65.6 Å²	65.6	44%	0.444	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.9	21.5	-173.3	-65.1	43.6	0	0	0	110.7	D47 S204	D47-D51 HydrophobicContact CB-CB 4.3Å; D47-D51 PolarHBondContact O-N 2.97Å; D51-S204 WeakPolarHBondContact O-CB 3.29Å; D51-S204 PolarHBondContact O-N 2.89Å
52	Y	96.3	Very high	93.7	Very high	1 Å²	1	67.9 Å²	67.9	0%	0.004	37%	0.373	C	S	.	.			trans	-96	97.4	168.7	-179.7	-87.9	0	0	0	108.5	E62 C65 Y66 A69 F70 Y188 C201 F202 V203	Y52-E62 HydrophobicContact CD1-CG 4.08Å; Y52-E62 VanDerWaalsContact O-CG 3.25Å; Y52-E62 WeakPolarHBondContact O-CG 3.49Å; Y52-C65 HydrophobicContact CE1-CB 4.02Å; Y52-C65 PolarHBondContact OH-O 3.01Å; Y52-Y66 HydrophobicContact CD1-CD2 4.15Å; Y52-Y66 HydrophobicContact CD1-CG 4.47Å; Y52-Y66 HydrophobicContact CD2-CD2 4.1Å; Y52-Y66 AromaticContact CG-CD2 3.84Å; Y52-Y66 HydrophobicContact CG-CD2 3.84Å; Y52-A69 HydrophobicContact CE2-CB 4.34Å; Y52-F70 HydrophobicContact CD2-CE2 4.05Å; Y52-F70 HydrophobicContact CE2-CD2 4.41Å; Y52-F70 AromaticContact CE2-CE2 3.9Å; Y52-F70 HydrophobicContact CE2-CE2 3.9Å; Y52-Y188 WeakPolarHBondContact OH-CD1 3.39Å; Y52-C201 HydrophobicContact CE1-CB 3.89Å; Y52-C201 HydrophobicContact CE2-CB 4.42Å; Y52-C201 WeakPolarHBondContact OH-CB 3.41Å; Y52-F202 WeakPolarHBondContact CA-O 3.39Å; Y52-V203 HydrophobicContact CD2-CG2 4.34Å; Y52-V203 HydrophobicContact CE2-CG2 4.12Å
53	V	97.2	Very high	94.6	Very high	79 Å²	79	65.2 Å²	65.2	48%	0.479	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	125.1	-168.9	-178.4	0	0	0	0	111	E62 C201 F202	V53-E62 WeakPolarHBondContact CA-OE2 3.34Å; V53-C201 CarbonylContact O-C 3.59Å; V53-C201 WeakPolarHBondContact O-CA 3.36Å; V53-F202 PolarHBondContact N-O 2.93Å; V53-F202 PolarHBondContact O-N 3.41Å
54	C	97.7	Very high	95.2	Very high	7 Å²	7	59.8 Å²	59.8	5%	0.047	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	137.6	173.1	-69.4	0	0	0	0	112.4	T56 E62 C201	C54-T56 HydrophobicContact CB-CG2 3.92Å; C54-T56 PolarHBondContact O-N 2.75Å; C54-E62 HydrophobicContact CB-CB 4.37Å; C54-E62 HydrophobicContact CB-CG 4.42Å; C54-E62 PolarHBondContact N-OE2 2.76Å; C54-C201 HydrophobicContact CB-CB 4.08Å; C54-C201 WeakPolarHBondContact CB-SG 3.25Å; C54-C201 WeakPolarHBondContact SG-CB 3.28Å; C54-C201 CovalentContact SG-SG 2.04Å; C54-C201 PolarHBondContact SG-SG 3.19Å
55	N	97.4	Very high	95.5	Very high	125 Å²	125	59.6 Å²	59.6	67%	0.668	34%	0.342	S	S	*	.	S	Bend	trans	-76.2	72.5	175.7	-173	12.8	0	0	0	111.2	D200	N55-D200 WeakPolarHBondContact CB-O 3.03Å; N55-D200 PolarHBondContact N-O 3.42Å
56	T	97.1	Very high	95.7	Very high	43 Å²	43	60 Å²	60	26%	0.264	34%	0.343	S	S	.	.			trans	-160.2	157.1	-178.2	-170.6	0	0	0	0	111.3	C54 Q58 C61	C54-T56 HydrophobicContact CB-CG2 3.92Å; C54-T56 PolarHBondContact O-N 2.75Å; T56-Q58 WeakPolarHBondContact OG1-CB 3.45Å; T56-Q58 PolarHBondContact OG1-N 3.22Å; T56-C61 HydrophobicContact CG2-CB 3.99Å
57	Q	96.8	Very high	96.1	Very high	200 Å²	200	61.1 Å²	61.1	94%	0.935	34%	0.336	S	S	*	.			trans	-104.7	5.7	169.6	-63	-177.7	4.4	0	0	112.2	P59	Q57-P59 WeakPolarHBondContact O-CD 3.48Å
58	Q	97.1	Very high	96.3	Very high	77 Å²	77	64 Å²	64	36%	0.36	35%	0.349	S	S	.	.			trans	-74.8	115.7	-177.9	177.1	58	43.6	0	0	111.3	T56 G60 C61 P194 P196	T56-Q58 WeakPolarHBondContact OG1-CB 3.45Å; T56-Q58 PolarHBondContact OG1-N 3.22Å; Q58-G60 PolarHBondContact O-N 2.98Å; Q58-C61 HydrophobicContact CB-CB 4.09Å; Q58-C61 HydrophobicContact CG-CB 4.08Å; Q58-C61 WeakPolarHBondContact O-CB 3.35Å; Q58-C61 PolarHBondContact O-N 3.24Å; Q58-P194 HydrophobicContact CG-CB 4.47Å; Q58-P194 WeakPolarHBondContact CG-O 3.27Å; Q58-P196 HydrophobicContact CB-CG 4.23Å
59	P	97.4	Very high	96.5	Very high	101 Å²	101	63.3 Å²	63.3	66%	0.656	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	138.9	179	24.4	-34.7	0	0	0	111.7	Q57 C61	Q57-P59 WeakPolarHBondContact O-CD 3.48Å; P59-C61 PolarHBondContact O-N 3.36Å
60	G	96.4	Very high	96.6	Very high	34 Å²	34	59.5 Å²	59.5	35%	0.351	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	77	-7.8	179.5	0	0	0	0	0	115.8	Q58 V64	Q58-G60 PolarHBondContact O-N 2.98Å; G60-V64 PolarHBondContact O-N 3.29Å
61	C	97.6	Very high	96.7	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-63.4	-45.8	177.8	173.1	0	0	0	0	111.6	T56 Q58 P59 N63 V64 C65 C195	T56-C61 HydrophobicContact CG2-CB 3.99Å; Q58-C61 HydrophobicContact CB-CB 4.09Å; Q58-C61 HydrophobicContact CG-CB 4.08Å; Q58-C61 WeakPolarHBondContact O-CB 3.35Å; Q58-C61 PolarHBondContact O-N 3.24Å; P59-C61 PolarHBondContact O-N 3.36Å; C61-N63 VanDerWaalsContact C-N 3.34Å; C61-N63 PolarHBondContact O-N 3.45Å; C61-V64 WeakPolarHBondContact O-CG2 3.21Å; C61-V64 PolarHBondContact O-N 2.92Å; C61-C65 PolarHBondContact O-N 2.81Å; C61-C65 PolarHBondContact O-SG 3.45Å; C61-C195 WeakPolarHBondContact CA-SG 3.5Å; C61-C195 HydrophobicContact CB-CB 4.08Å; C61-C195 WeakPolarHBondContact CB-SG 3.32Å; C61-C195 WeakPolarHBondContact SG-CB 3.45Å; C61-C195 CovalentContact SG-SG 2.03Å; C61-C195 PolarHBondContact SG-SG 3.12Å
62	E	96.9	Very high	96.7	Very high	73 Å²	73	57.7 Å²	57.7	34%	0.341	32%	0.317	S	S	.	.	H	α-helix	trans	-57.2	-44.5	178.8	-168.5	167.7	86.4	0	0	112.7	Y52 V53 C54 V64 C65 Y66	Y52-E62 HydrophobicContact CD1-CG 4.08Å; Y52-E62 VanDerWaalsContact O-CG 3.25Å; Y52-E62 WeakPolarHBondContact O-CG 3.49Å; V53-E62 WeakPolarHBondContact CA-OE2 3.34Å; C54-E62 HydrophobicContact CB-CB 4.37Å; C54-E62 HydrophobicContact CB-CG 4.42Å; C54-E62 PolarHBondContact N-OE2 2.76Å; E62-V64 PolarHBondContact O-N 3.23Å; E62-C65 PolarHBondContact O-N 2.91Å; E62-Y66 VanDerWaalsContact O-CB 3.32Å; E62-Y66 WeakPolarHBondContact O-CB 3.49Å; E62-Y66 PolarHBondContact O-N 3.27Å
63	N	96.8	Very high	96.5	Very high	95 Å²	95	57.8 Å²	57.8	51%	0.508	32%	0.317	S	S	.	.	H	α-helix	trans	-60.1	-42.3	177.5	-58.7	87.4	0	0	0	113.1	C61 D67	C61-N63 VanDerWaalsContact C-N 3.34Å; C61-N63 PolarHBondContact O-N 3.45Å; N63-D67 WeakPolarHBondContact O-CB 3.39Å; N63-D67 PolarHBondContact O-N 2.9Å; N63-D67 VanDerWaalsContact O-N 3.12Å
64	V	97.6	Very high	96.3	Very high	32 Å²	32	54 Å²	54	19%	0.194	30%	0.295	C	S	.	.	H	α-helix	trans	-77	-31.4	-178.9	-59.2	0	0	0	0	112.5	G60 C61 E62 E68 R192	G60-V64 PolarHBondContact O-N 3.29Å; C61-V64 WeakPolarHBondContact O-CG2 3.21Å; C61-V64 PolarHBondContact O-N 2.92Å; E62-V64 PolarHBondContact O-N 3.23Å; V64-E68 WeakPolarHBondContact O-CB 3.43Å; V64-E68 PolarHBondContact O-N 3.22Å; V64-R192 HydrophobicContact CB-CG 4.2Å; V64-R192 HydrophobicContact CG2-CB 4.36Å; V64-R192 HydrophobicContact CG2-CG 4.2Å; V64-R192 PolarHBondContact O-NH1 3Å
65	C	97.7	Very high	96	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-70.6	-39.2	174.3	-62.6	0	0	0	0	111.6	Y52 C61 E62 E68 A69 C190 C195	Y52-C65 HydrophobicContact CE1-CB 4.02Å; Y52-C65 PolarHBondContact OH-O 3.01Å; C61-C65 PolarHBondContact O-N 2.81Å; C61-C65 PolarHBondContact O-SG 3.45Å; E62-C65 PolarHBondContact O-N 2.91Å; C65-E68 PolarHBondContact O-N 2.72Å; C65-A69 VanDerWaalsContact O-CB 3.28Å; C65-A69 WeakPolarHBondContact O-CB 3.47Å; C65-A69 PolarHBondContact O-N 3.05Å; C65-C190 WeakPolarHBondContact CA-SG 3.2Å; C65-C190 HydrophobicContact CB-CB 3.62Å; C65-C190 WeakPolarHBondContact CB-SG 3.33Å; C65-C190 WeakPolarHBondContact SG-CB 3.34Å; C65-C190 CovalentContact SG-SG 2.03Å; C65-C190 PolarHBondContact SG-SG 3.43Å; C65-C195 PolarHBondContact SG-SG 3.38Å
66	Y	96.8	Very high	95.8	Very high	18 Å²	18	55.8 Å²	55.8	7%	0.071	29%	0.292	C	S	.	.	H	α-helix	trans	-61	-47.3	172.5	176.9	-96.3	0	0	0	111.7	E48 Q49 Y52 E62 E68 A69 F70	E48-Y66 VanDerWaalsContact CG-OH 3.26Å; E48-Y66 WeakPolarHBondContact CG-OH 3.02Å; E48-Y66 VanDerWaalsContact O-CE2 3.26Å; E48-Y66 WeakPolarHBondContact O-CE2 3.26Å; E48-Y66 PolarHBondContact OE1-OH 2.88Å; E48-Y66 PolarHBondContact OE2-OH 2.98Å; Q49-Y66 HydrophobicContact CB-CD2 4.42Å; Q49-Y66 HydrophobicContact CB-CE1 4.14Å; Q49-Y66 HydrophobicContact CB-CE2 4.02Å; Q49-Y66 HydrophobicContact CG-CD1 3.94Å; Q49-Y66 HydrophobicContact CG-CD2 4.32Å; Q49-Y66 HydrophobicContact CG-CE1 3.94Å; Q49-Y66 HydrophobicContact CG-CE2 4.34Å; Q49-Y66 HydrophobicContact CG-CG 4.15Å; Y52-Y66 HydrophobicContact CD1-CD2 4.15Å; Y52-Y66 HydrophobicContact CD1-CG 4.47Å; Y52-Y66 HydrophobicContact CD2-CD2 4.1Å; Y52-Y66 AromaticContact CG-CD2 3.84Å; Y52-Y66 HydrophobicContact CG-CD2 3.84Å; E62-Y66 VanDerWaalsContact O-CB 3.32Å; E62-Y66 WeakPolarHBondContact O-CB 3.49Å; E62-Y66 PolarHBondContact O-N 3.27Å; Y66-E68 VanDerWaalsContact C-N 3.29Å; Y66-E68 PolarHBondContact O-N 2.92Å; Y66-A69 PolarHBondContact O-N 3.49Å; Y66-F70 HydrophobicContact CD2-CD2 4.02Å; Y66-F70 HydrophobicContact CE2-CB 4.32Å; Y66-F70 AromaticContact CE2-CD2 3.87Å; Y66-F70 HydrophobicContact CE2-CD2 3.87Å; Y66-F70 PolarHBondContact O-N 2.82Å
67	D	96.6	Very high	95.7	Very high	82 Å²	82	54.5 Å²	54.5	44%	0.439	28%	0.284	S	S	.	.	H	α-helix	trans	-62.8	-32.1	175.7	179.3	80.8	0	0	0	112.9	N63 P71 R192	N63-D67 WeakPolarHBondContact O-CB 3.39Å; N63-D67 PolarHBondContact O-N 2.9Å; N63-D67 VanDerWaalsContact O-N 3.12Å; D67-P71 WeakPolarHBondContact O-CA 3.33Å; D67-R192 IonicContact OD2-CZ 3.06Å; D67-R192 IonicContact OD2-NH1 3.32Å; D67-R192 PolarHBondContact OD2-NH1 3.31Å; D67-R192 IonicContact OD2-NH2 3.6Å; D67-R192 PolarHBondContact OD2-NH2 3.39Å
68	E	96.3	Very high	95.5	Very high	83 Å²	83	45.3 Å²	45.3	39%	0.388	24%	0.241	S	C	.	.	H	α-helix	trans	-77	-38	176.7	-158	177.7	-164.7	0	0	112.5	V64 C65 Y66 Y188 R192	V64-E68 WeakPolarHBondContact O-CB 3.43Å; V64-E68 PolarHBondContact O-N 3.22Å; C65-E68 PolarHBondContact O-N 2.72Å; Y66-E68 VanDerWaalsContact C-N 3.29Å; Y66-E68 PolarHBondContact O-N 2.92Å; E68-Y188 VanDerWaalsContact CG-OH 3.29Å; E68-Y188 WeakPolarHBondContact CG-OH 3.47Å; E68-R192 VanDerWaalsContact N-NH1 3.17Å; E68-R192 WeakPolarHBondContact OE2-CB 3.26Å
69	A	95.3	Very high	95.3	Very high	10 Å²	10	44 Å²	44	8%	0.083	24%	0.238	C	C	.	.	H	α-helix	trans	-75.9	-35.4	178.9	0	0	0	0	0	112.9	Y52 C65 Y66 Y180 Y188	Y52-A69 HydrophobicContact CE2-CB 4.34Å; C65-A69 VanDerWaalsContact O-CB 3.28Å; C65-A69 WeakPolarHBondContact O-CB 3.47Å; C65-A69 PolarHBondContact O-N 3.05Å; Y66-A69 PolarHBondContact O-N 3.49Å; A69-Y180 WeakPolarHBondContact O-CE1 3.23Å; A69-Y188 HydrophobicContact CB-CD1 4.02Å; A69-Y188 HydrophobicContact CB-CD2 3.8Å; A69-Y188 HydrophobicContact CB-CE1 3.95Å; A69-Y188 HydrophobicContact CB-CE2 3.73Å; A69-Y188 HydrophobicContact CB-CG 3.94Å
70	F	95.6	Very high	95.1	Very high	25 Å²	25	42.5 Å²	42.5	11%	0.11	22%	0.224	C	C	.	.			trans	-136.6	58.4	-172	-56.7	-62.9	0	0	0	113.4	Y52 Y66 I72 Y180 I184 V203	Y52-F70 HydrophobicContact CD2-CE2 4.05Å; Y52-F70 HydrophobicContact CE2-CD2 4.41Å; Y52-F70 AromaticContact CE2-CE2 3.9Å; Y52-F70 HydrophobicContact CE2-CE2 3.9Å; Y66-F70 HydrophobicContact CD2-CD2 4.02Å; Y66-F70 HydrophobicContact CE2-CB 4.32Å; Y66-F70 AromaticContact CE2-CD2 3.87Å; Y66-F70 HydrophobicContact CE2-CD2 3.87Å; Y66-F70 PolarHBondContact O-N 2.82Å; F70-I72 PolarHBondContact O-N 3.3Å; F70-Y180 HydrophobicContact CD1-CE1 4.16Å; F70-I184 HydrophobicContact CE1-CD1 4.18Å; F70-I184 HydrophobicContact CZ-CG2 4.42Å; F70-V203 HydrophobicContact CE2-CG1 3.9Å; F70-V203 HydrophobicContact CE2-CG2 4.08Å; F70-V203 HydrophobicContact CZ-CG1 3.68Å; F70-V203 HydrophobicContact CZ-CG2 3.96Å
71	P	95	Very high	95	Very high	80 Å²	80	41.4 Å²	41.4	52%	0.519	21%	0.21	S	C	.	.	S	Bend	trans	-59.7	-20.3	-177.3	24.7	-36.3	0	0	0	114.4	D67	D67-P71 WeakPolarHBondContact O-CA 3.33Å
72	I	94.9	Very high	94.6	Very high	47 Å²	47	41.8 Å²	41.8	24%	0.241	21%	0.212	C	C	.	.	S	Bend	trans	-144.9	111.7	164.2	-178.7	171.6	0	0	0	110.3	F70 R76 L77 L80 L179 Y180	F70-I72 PolarHBondContact O-N 3.3Å; I72-R76 HydrophobicContact CD1-CB 4.21Å; I72-R76 HydrophobicContact CG1-CB 3.85Å; I72-L77 HydrophobicContact CD1-CD1 4.44Å; I72-L80 HydrophobicContact CD1-CD1 3.84Å; I72-L179 HydrophobicContact CG2-CD1 4.31Å; I72-Y180 VanDerWaalsContact C-OH 3.29Å; I72-Y180 PolarHBondContact N-OH 3.03Å; I72-Y180 WeakPolarHBondContact O-CE2 3.37Å; I72-Y180 PolarHBondContact O-OH 3.29Å
73	S	93.2	Very high	94.4	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.014	22%	0.216	C	C	.	.			trans	-61.1	148.6	-177.5	55.1	0	0	0	0	113.9	E48 I75 R76 L77	E48-S73 WeakPolarHBondContact OE1-CB 3.09Å; E48-S73 PolarHBondContact OE1-OG 3.02Å; E48-S73 WeakPolarHBondContact OE2-CB 3.38Å; S73-I75 VanDerWaalsContact C-N 3.28Å; S73-I75 PolarHBondContact O-N 3.09Å; S73-R76 WeakPolarHBondContact O-CA 3.41Å; S73-R76 WeakPolarHBondContact O-CB 3.23Å; S73-R76 PolarHBondContact O-N 2.92Å; S73-R76 PolarHBondContact OG-NH1 3.49Å; S73-L77 PolarHBondContact O-N 3.11Å; S73-L77 VanDerWaalsContact O-N 3.13Å
74	H	92.4	Very high	94.2	Very high	1 Å²	1	42 Å²	42	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-56.4	-40.2	-167.7	-75.5	73.7	0	0	0	112.7	W45 R76 L77 W78 Q176 Y180 I213	W45-H74 HydrophobicContact CZ2-CB 3.83Å; H74-R76 VanDerWaalsContact C-N 3.34Å; H74-R76 PolarHBondContact O-N 3.32Å; H74-L77 PolarHBondContact O-N 3.05Å; H74-W78 HydrophobicContact CB-CH2 4.37Å; H74-W78 HydrophobicContact CB-CZ2 4.08Å; H74-W78 VanDerWaalsContact O-CG 3.22Å; H74-W78 PolarHBondContact O-N 3.25Å; H74-Q176 PolarHBondContact CD2-NE2 2.87Å; H74-Q176 VanDerWaalsContact CD2-NE2 3.3Å; H74-Q176 PolarHBondContact CD2-OE1 3.21Å; H74-Q176 VanDerWaalsContact CD2-OE1 3.29Å; H74-Q176 PolarHBondContact NE2-NE2 2.98Å; H74-Y180 AromaticContact CE1-CD1 4Å; H74-Y180 AromaticContact CE1-CD2 3.33Å; H74-Y180 WeakPolarHBondContact CE1-CD2 2.85Å; H74-Y180 AromaticContact CE1-CE2 3.85Å; H74-Y180 AromaticContact CE1-CG 3.41Å; H74-Y180 VanDerWaalsContact CE1-CG 3.41Å; H74-Y180 WeakPolarHBondContact NE2-CB 3.45Å; H74-Y180 AromaticContact NE2-CD2 3.31Å; H74-Y180 VanDerWaalsContact NE2-CD2 3.31Å; H74-Y180 WeakPolarHBondContact NE2-CD2 3.02Å; H74-Y180 AromaticContact NE2-CG 3.52Å; H74-I213 WeakPolarHBondContact NE2-CD1 3.33Å
75	I	92.1	Very high	93.9	Very high	22 Å²	22	40.6 Å²	40.6	11%	0.113	20%	0.202	C	C	.	.	H	α-helix	trans	-56.5	-45.6	173.8	-58.4	-57.3	0	0	0	111.6	A41 W45 S73 L77 W78 V79	A41-I75 HydrophobicContact CB-CD1 3.99Å; A41-I75 HydrophobicContact CB-CG1 4.07Å; A41-I75 HydrophobicContact CB-CG2 3.72Å; W45-I75 HydrophobicContact CB-CD1 4.46Å; W45-I75 HydrophobicContact CB-CG1 3.7Å; W45-I75 HydrophobicContact CD2-CD1 3.89Å; W45-I75 HydrophobicContact CD2-CG1 3.84Å; W45-I75 HydrophobicContact CE3-CD1 3.59Å; W45-I75 HydrophobicContact CE3-CG1 4.05Å; W45-I75 HydrophobicContact CG-CD1 4.28Å; W45-I75 HydrophobicContact CG-CG1 3.71Å; W45-I75 HydrophobicContact CZ3-CD1 4.16Å; S73-I75 VanDerWaalsContact C-N 3.28Å; S73-I75 PolarHBondContact O-N 3.09Å; I75-L77 VanDerWaalsContact C-N 3.35Å; I75-L77 PolarHBondContact O-N 3.24Å; I75-W78 HydrophobicContact CD1-CE3 3.84Å; I75-W78 HydrophobicContact CD1-CZ3 3.78Å; I75-W78 PolarHBondContact O-N 3.11Å; I75-V79 WeakPolarHBondContact O-CG2 3.34Å; I75-V79 PolarHBondContact O-N 2.95Å
76	R	92.9	Very high	93.4	Very high	146 Å²	146	41.2 Å²	41.2	55%	0.551	21%	0.206	S	C	*	.	H	α-helix	trans	-65.4	-39.8	179.9	-61.8	177.4	178.7	124.9	-5.2	110.8	E48 I72 S73 H74 V79 L80	E48-R76 IonicContact OE1-NH1 3.83Å; I72-R76 HydrophobicContact CD1-CB 4.21Å; I72-R76 HydrophobicContact CG1-CB 3.85Å; S73-R76 WeakPolarHBondContact O-CA 3.41Å; S73-R76 WeakPolarHBondContact O-CB 3.23Å; S73-R76 PolarHBondContact O-N 2.92Å; S73-R76 PolarHBondContact OG-NH1 3.49Å; H74-R76 VanDerWaalsContact C-N 3.34Å; H74-R76 PolarHBondContact O-N 3.32Å; R76-V79 PolarHBondContact O-N 2.83Å; R76-L80 WeakPolarHBondContact O-CG 3.19Å; R76-L80 PolarHBondContact O-N 3.11Å; R76-L80 VanDerWaalsContact O-N 3.08Å
77	L	93.4	Very high	93.1	Very high	16 Å²	16	43.1 Å²	43.1	8%	0.084	22%	0.22	C	C	.	.	H	α-helix	trans	-63.7	-40.7	174.3	-167.7	70.8	0	0	0	111.9	I72 S73 H74 I75 L80 Q81 F172 Q176	I72-L77 HydrophobicContact CD1-CD1 4.44Å; S73-L77 PolarHBondContact O-N 3.11Å; S73-L77 VanDerWaalsContact O-N 3.13Å; H74-L77 PolarHBondContact O-N 3.05Å; I75-L77 VanDerWaalsContact C-N 3.35Å; I75-L77 PolarHBondContact O-N 3.24Å; L77-L80 PolarHBondContact O-N 3.46Å; L77-Q81 WeakPolarHBondContact O-CB 3.16Å; L77-Q81 PolarHBondContact O-N 3.33Å; L77-F172 HydrophobicContact CD1-CD1 3.96Å; L77-F172 HydrophobicContact CD1-CE1 3.86Å; L77-F172 HydrophobicContact CG-CD1 4.11Å; L77-F172 HydrophobicContact CG-CE1 4.36Å; L77-Q176 HydrophobicContact CD2-CB 4.04Å
78	W	93.6	Very high	92.8	Very high	7 Å²	7	39.7 Å²	39.7	3%	0.027	20%	0.202	C	C	.	.	H	α-helix	trans	-71	-34.9	177.1	-58.5	-23	0	0	0	113.4	L37 W45 H74 I75 L80 Q81 I82 F212 I213 M216	L37-W78 HydrophobicContact CD1-CB 3.92Å; L37-W78 HydrophobicContact CD1-CE3 4.04Å; W45-W78 AromaticContact CH2-CH2 3.49Å; W45-W78 HydrophobicContact CH2-CH2 3.49Å; W45-W78 VanDerWaalsContact CH2-CH2 3.49Å; W45-W78 AromaticContact CH2-CZ3 3.91Å; W45-W78 HydrophobicContact CH2-CZ3 3.91Å; W45-W78 HydrophobicContact CZ2-CH2 4.05Å; W45-W78 HydrophobicContact CZ3-CH2 4.03Å; W45-W78 AromaticContact CZ3-CZ3 3.99Å; W45-W78 HydrophobicContact CZ3-CZ3 3.99Å; H74-W78 HydrophobicContact CB-CH2 4.37Å; H74-W78 HydrophobicContact CB-CZ2 4.08Å; H74-W78 VanDerWaalsContact O-CG 3.22Å; H74-W78 PolarHBondContact O-N 3.25Å; I75-W78 HydrophobicContact CD1-CE3 3.84Å; I75-W78 HydrophobicContact CD1-CZ3 3.78Å; I75-W78 PolarHBondContact O-N 3.11Å; W78-L80 VanDerWaalsContact C-N 3.34Å; W78-Q81 WeakPolarHBondContact O-CB 3.41Å; W78-Q81 PolarHBondContact O-N 3.46Å; W78-I82 WeakPolarHBondContact O-CB 3.46Å; W78-I82 WeakPolarHBondContact O-CD1 3.34Å; W78-I82 VanDerWaalsContact O-CG1 3.25Å; W78-I82 WeakPolarHBondContact O-CG1 3.2Å; W78-I82 PolarHBondContact O-N 3.23Å; W78-F212 HydrophobicContact CH2-CB 4.13Å; W78-I213 HydrophobicContact CH2-CG1 4.27Å; W78-I213 HydrophobicContact CZ2-CB 4.5Å; W78-I213 HydrophobicContact CZ2-CG1 3.85Å; W78-M216 HydrophobicContact CB-CE 3.87Å; W78-M216 HydrophobicContact CD2-CB 4.47Å; W78-M216 HydrophobicContact CD2-CE 3.8Å; W78-M216 HydrophobicContact CD2-CG 4.06Å; W78-M216 HydrophobicContact CE3-CE 3.98Å; W78-M216 HydrophobicContact CE3-CG 4.05Å; W78-M216 HydrophobicContact CG-CE 3.75Å; W78-M216 HydrophobicContact CH2-CG 3.97Å; W78-M216 HydrophobicContact CZ2-CB 4.07Å; W78-M216 HydrophobicContact CZ2-CG 3.99Å; W78-M216 HydrophobicContact CZ3-CG 4.01Å
79	V	92.4	Very high	92.3	Very high	50 Å²	50	36.5 Å²	36.5	30%	0.303	19%	0.189	S	C	.	.	H	α-helix	trans	-58.7	-48	170	168.1	0	0	0	0	110	L37 I75 R76 I82 I83	L37-V79 HydrophobicContact CD2-CB 4.46Å; L37-V79 HydrophobicContact CD2-CG2 3.5Å; I75-V79 WeakPolarHBondContact O-CG2 3.34Å; I75-V79 PolarHBondContact O-N 2.95Å; R76-V79 PolarHBondContact O-N 2.83Å; V79-I82 PolarHBondContact O-N 3.36Å; V79-I83 HydrophobicContact CG1-CD1 3.83Å; V79-I83 WeakPolarHBondContact O-CG1 3.21Å; V79-I83 PolarHBondContact O-N 3.4Å
80	L	93.8	Very high	91.8	Very high	69 Å²	69	38.9 Å²	38.9	36%	0.361	20%	0.2	S	C	.	.	H	α-helix	trans	-61.8	-45.3	176	-67.9	172.1	0	0	0	111.5	I72 R76 L77 W78 I82 I83 F84 F172	I72-L80 HydrophobicContact CD1-CD1 3.84Å; R76-L80 WeakPolarHBondContact O-CG 3.19Å; R76-L80 PolarHBondContact O-N 3.11Å; R76-L80 VanDerWaalsContact O-N 3.08Å; L77-L80 PolarHBondContact O-N 3.46Å; W78-L80 VanDerWaalsContact C-N 3.34Å; L80-I82 VanDerWaalsContact C-N 3.32Å; L80-I82 PolarHBondContact O-N 3.29Å; L80-I83 PolarHBondContact O-N 3.15Å; L80-F84 VanDerWaalsContact O-CD2 3.31Å; L80-F84 WeakPolarHBondContact O-CD2 3.17Å; L80-F84 PolarHBondContact O-N 3.42Å; L80-F172 HydrophobicContact CB-CE1 3.84Å; L80-F172 HydrophobicContact CB-CZ 3.89Å
81	Q	93.9	Very high	91.5	Very high	12 Å²	12	42.4 Å²	42.4	6%	0.056	22%	0.223	C	C	.	.	H	α-helix	trans	-54.4	-46.9	175.1	-177.3	178.1	4.4	0	0	111.6	L77 W78 I83 F84 V85 E169 F172	L77-Q81 WeakPolarHBondContact O-CB 3.16Å; L77-Q81 PolarHBondContact O-N 3.33Å; W78-Q81 WeakPolarHBondContact O-CB 3.41Å; W78-Q81 PolarHBondContact O-N 3.46Å; Q81-I83 PolarHBondContact O-N 2.78Å; Q81-F84 PolarHBondContact O-N 3.17Å; Q81-V85 HydrophobicContact CG-CG2 4.24Å; Q81-V85 WeakPolarHBondContact O-CB 3.17Å; Q81-V85 WeakPolarHBondContact O-CG2 3.24Å; Q81-V85 PolarHBondContact O-N 3.01Å; Q81-E169 PolarHBondContact NE2-OE1 3.36Å; Q81-F172 HydrophobicContact CB-CB 4.06Å; Q81-F172 HydrophobicContact CB-CD1 3.7Å; Q81-F172 HydrophobicContact CB-CD2 4.09Å; Q81-F172 HydrophobicContact CB-CE1 4.17Å; Q81-F172 HydrophobicContact CB-CG 3.66Å; Q81-F172 HydrophobicContact CG-CB 3.7Å; Q81-F172 HydrophobicContact CG-CD1 4.31Å; Q81-F172 HydrophobicContact CG-CD2 4.17Å; Q81-F172 HydrophobicContact CG-CG 3.79Å
82	I	90.4	Very high	91.1	Very high	7 Å²	7	39 Å²	39	4%	0.036	20%	0.2	C	C	.	.	H	α-helix	trans	-62.3	-42.5	178.5	-73.2	163.6	0	0	0	111.5	F30 R33 I34 L37 W78 V79 L80 S86	F30-I82 HydrophobicContact CE2-CG2 3.7Å; F30-I82 HydrophobicContact CZ-CG2 3.66Å; R33-I82 HydrophobicContact CB-CD1 3.98Å; R33-I82 HydrophobicContact CB-CG1 4.3Å; I34-I82 HydrophobicContact CG1-CG2 4.45Å; L37-I82 HydrophobicContact CD1-CD1 3.93Å; L37-I82 HydrophobicContact CD2-CD1 3.59Å; L37-I82 HydrophobicContact CG-CD1 4.37Å; W78-I82 WeakPolarHBondContact O-CB 3.46Å; W78-I82 WeakPolarHBondContact O-CD1 3.34Å; W78-I82 VanDerWaalsContact O-CG1 3.25Å; W78-I82 WeakPolarHBondContact O-CG1 3.2Å; W78-I82 PolarHBondContact O-N 3.23Å; V79-I82 PolarHBondContact O-N 3.36Å; L80-I82 VanDerWaalsContact C-N 3.32Å; L80-I82 PolarHBondContact O-N 3.29Å; I82-S86 VanDerWaalsContact O-CB 3.3Å; I82-S86 WeakPolarHBondContact O-CB 3.31Å; I82-S86 PolarHBondContact O-N 2.71Å; I82-S86 PolarHBondContact O-OG 2.97Å
83	I	91	Very high	90.5	Very high	85 Å²	85	37.5 Å²	37.5	44%	0.436	19%	0.193	S	C	.	.	H	α-helix	trans	-65	-49.8	177.2	-67.3	164.6	0	0	0	111.2	V79 L80 Q81 S86 T87	V79-I83 HydrophobicContact CG1-CD1 3.83Å; V79-I83 WeakPolarHBondContact O-CG1 3.21Å; V79-I83 PolarHBondContact O-N 3.4Å; L80-I83 PolarHBondContact O-N 3.15Å; Q81-I83 PolarHBondContact O-N 2.78Å; I83-S86 PolarHBondContact O-N 3.27Å; I83-S86 PolarHBondContact O-OG 2.9Å; I83-S86 VanDerWaalsContact O-OG 3.07Å; I83-T87 WeakPolarHBondContact O-CB 3.48Å; I83-T87 PolarHBondContact O-N 2.92Å; I83-T87 PolarHBondContact O-OG1 3.3Å
84	F	93.6	Very high	90.1	Very high	89 Å²	89	39.4 Å²	39.4	39%	0.39	21%	0.213	S	C	.	.	H	α-helix	trans	-68.4	-35.3	179.7	-81	-76.6	0	0	0	113	L80 Q81 P88 F168 F172	L80-F84 VanDerWaalsContact O-CD2 3.31Å; L80-F84 WeakPolarHBondContact O-CD2 3.17Å; L80-F84 PolarHBondContact O-N 3.42Å; Q81-F84 PolarHBondContact O-N 3.17Å; F84-P88 WeakPolarHBondContact O-CD 3.3Å; F84-F168 HydrophobicContact CB-CB 4.28Å; F84-F168 HydrophobicContact CB-CD1 4.43Å; F84-F168 HydrophobicContact CB-CD2 4.3Å; F84-F168 HydrophobicContact CB-CG 4.11Å; F84-F168 HydrophobicContact CD1-CD1 4.34Å; F84-F168 HydrophobicContact CD1-CE1 4.09Å; F84-F168 HydrophobicContact CD1-CE2 4.5Å; F84-F168 HydrophobicContact CD1-CZ 4.18Å; F84-F168 WeakPolarHBondContact O-CD2 3.38Å; F84-F172 HydrophobicContact CB-CE2 3.73Å; F84-F172 HydrophobicContact CB-CZ 4.43Å; F84-F172 AromaticContact CD2-CE2 3.77Å; F84-F172 HydrophobicContact CD2-CE2 3.77Å; F84-F172 AromaticContact CD2-CZ 3.65Å; F84-F172 HydrophobicContact CD2-CZ 3.65Å; F84-F172 HydrophobicContact CE2-CZ 4.33Å; F84-F172 AromaticContact CG-CE2 3.97Å; F84-F172 HydrophobicContact CG-CE2 3.97Å; F84-F172 HydrophobicContact CG-CZ 4.33Å
85	V	90.9	Very high	89.8	Confident	2 Å²	2	42 Å²	42	1%	0.012	23%	0.225	C	C	.	.	H	α-helix	trans	-74.9	-27.9	178.1	169.6	0	0	0	0	112.5	Q81 K165 F168 E169	Q81-V85 HydrophobicContact CG-CG2 4.24Å; Q81-V85 WeakPolarHBondContact O-CB 3.17Å; Q81-V85 WeakPolarHBondContact O-CG2 3.24Å; Q81-V85 PolarHBondContact O-N 3.01Å; V85-K165 HydrophobicContact CG1-CD 4.38Å; V85-K165 HydrophobicContact CG1-CG 3.89Å; V85-F168 HydrophobicContact CG2-CB 4.29Å; V85-E169 HydrophobicContact CG2-CB 4.12Å
86	S	87.8	Confident	89.4	Confident	13 Å²	13	41.2 Å²	41.2	9%	0.091	22%	0.222	C	C	.	.	H	α-helix	trans	-83.2	-33.9	174.9	54.4	0	0	0	0	113.7	I82 I83 S89 L90	I82-S86 VanDerWaalsContact O-CB 3.3Å; I82-S86 WeakPolarHBondContact O-CB 3.31Å; I82-S86 PolarHBondContact O-N 2.71Å; I82-S86 PolarHBondContact O-OG 2.97Å; I83-S86 PolarHBondContact O-N 3.27Å; I83-S86 PolarHBondContact O-OG 2.9Å; I83-S86 VanDerWaalsContact O-OG 3.07Å; S86-S89 WeakPolarHBondContact O-CB 3.37Å; S86-S89 PolarHBondContact O-N 3.35Å; S86-L90 PolarHBondContact O-N 2.95Å; S86-L90 VanDerWaalsContact O-N 3.09Å
87	T	89.8	Confident	88.9	Confident	58 Å²	58	37.7 Å²	37.7	36%	0.356	22%	0.217	S	C	.	.	H	α-helix	trans	-51.2	-45.5	-175.8	-66.4	0	0	0	0	114.1	I83 S89 L90 V91	I83-T87 WeakPolarHBondContact O-CB 3.48Å; I83-T87 PolarHBondContact O-N 2.92Å; I83-T87 PolarHBondContact O-OG1 3.3Å; T87-S89 VanDerWaalsContact C-N 3.31Å; T87-S89 PolarHBondContact O-N 3.24Å; T87-L90 PolarHBondContact O-N 3.33Å; T87-V91 HydrophobicContact CG2-CG2 4.41Å; T87-V91 WeakPolarHBondContact O-CG2 3.4Å; T87-V91 PolarHBondContact O-N 3.03Å
88	P	91	Very high	88.5	Confident	10 Å²	10	42.6 Å²	42.6	7%	0.065	24%	0.239	C	C	.	.	H	α-helix	trans	-58.7	-37.2	174.8	-27.1	35.5	0	0	0	114.1	F84 Y92 H161 F164 F168	F84-P88 WeakPolarHBondContact O-CD 3.3Å; P88-Y92 WeakPolarHBondContact O-CB 3.29Å; P88-Y92 PolarHBondContact O-N 3.47Å; P88-H161 HydrophobicContact CB-CB 4.08Å; P88-H161 WeakPolarHBondContact CB-O 3.44Å; P88-F164 HydrophobicContact CB-CB 4.2Å; P88-F164 HydrophobicContact CG-CB 3.85Å; P88-F168 HydrophobicContact CG-CD2 3.97Å; P88-F168 HydrophobicContact CG-CE2 3.88Å
89	S	85.3	Confident	88.1	Confident	16 Å²	16	44.9 Å²	44.9	11%	0.112	25%	0.25	C	C	.	.	H	α-helix	trans	-71.4	-38.2	178	-63.6	0	0	0	0	111.6	S86 T87 Y92 V93 H161	S86-S89 WeakPolarHBondContact O-CB 3.37Å; S86-S89 PolarHBondContact O-N 3.35Å; T87-S89 VanDerWaalsContact C-N 3.31Å; T87-S89 PolarHBondContact O-N 3.24Å; S89-Y92 PolarHBondContact O-N 3.09Å; S89-V93 WeakPolarHBondContact O-CG2 3.32Å; S89-V93 PolarHBondContact O-N 2.69Å; S89-H161 PolarHBondContact OG-CD2 3.08Å; S89-H161 PolarHBondContact OG-NE2 3.44Å
90	L	84.6	Confident	87.6	Confident	59 Å²	59	45.2 Å²	45.2	31%	0.309	25%	0.252	S	S	.	.	H	α-helix	trans	-61.1	-46	172.2	-60.7	176.3	0	0	0	111.5	I10 S86 T87 Y92 V93 G94	I10-L90 HydrophobicContact CB-CD2 4.39Å; I10-L90 HydrophobicContact CG2-CD2 3.48Å; I10-L90 VanDerWaalsContact CG2-CD2 3.48Å; S86-L90 PolarHBondContact O-N 2.95Å; S86-L90 VanDerWaalsContact O-N 3.09Å; T87-L90 PolarHBondContact O-N 3.33Å; L90-Y92 PolarHBondContact O-N 2.93Å; L90-V93 PolarHBondContact O-N 2.91Å; L90-G94 PolarHBondContact O-N 3.36Å
91	V	89.3	Confident	87.1	Confident	100 Å²	100	46.9 Å²	46.9	61%	0.606	26%	0.258	S	S	*	.	H	α-helix	trans	-63.4	-39.6	176.9	171.6	0	0	0	0	111.7	T87 H95	T87-V91 HydrophobicContact CG2-CG2 4.41Å; T87-V91 WeakPolarHBondContact O-CG2 3.4Å; T87-V91 PolarHBondContact O-N 3.03Å; V91-H95 WeakPolarHBondContact O-CB 3.23Å; V91-H95 PolarHBondContact O-N 3.46Å
92	Y	86.6	Confident	86.8	Confident	7 Å²	7	51.1 Å²	51.1	3%	0.027	28%	0.279	C	S	.	.	H	α-helix	trans	-62.3	-43.9	174.9	169.2	-106.9	0	0	0	112.3	P88 S89 L90 H95 A96 L154 Y158	P88-Y92 WeakPolarHBondContact O-CB 3.29Å; P88-Y92 PolarHBondContact O-N 3.47Å; S89-Y92 PolarHBondContact O-N 3.09Å; L90-Y92 PolarHBondContact O-N 2.93Å; Y92-H95 PolarHBondContact O-N 2.86Å; Y92-A96 WeakPolarHBondContact O-CB 3.33Å; Y92-A96 PolarHBondContact O-N 3.47Å; Y92-L154 HydrophobicContact CE2-CD2 4.02Å; Y92-L154 HydrophobicContact CE2-CG 4.42Å; Y92-L154 WeakPolarHBondContact OH-CD2 3.25Å; Y92-Y158 HydrophobicContact CD1-CD2 4.29Å; Y92-Y158 HydrophobicContact CD2-CD2 4.18Å; Y92-Y158 AromaticContact CE1-CD2 3.8Å; Y92-Y158 HydrophobicContact CE1-CD2 3.8Å; Y92-Y158 HydrophobicContact CE1-CE2 4.23Å; Y92-Y158 AromaticContact CE2-CD2 3.69Å; Y92-Y158 HydrophobicContact CE2-CD2 3.69Å; Y92-Y158 HydrophobicContact CE2-CG 4.13Å; Y92-Y158 HydrophobicContact CG-CD2 4.46Å; Y92-Y158 AromaticContact CZ-CD2 3.47Å; Y92-Y158 VanDerWaalsContact CZ-CD2 3.47Å
93	V	82.3	Confident	86.6	Confident	16 Å²	16	54.3 Å²	54.3	10%	0.097	29%	0.293	C	S	.	.	H	α-helix	trans	-67.9	-46.5	177.6	172.7	0	0	0	0	111.8	V14 S89 L90 H95 A96 V97	V14-V93 HydrophobicContact CB-CG2 3.83Å; V14-V93 HydrophobicContact CG1-CG2 4.08Å; V14-V93 HydrophobicContact CG2-CB 4.45Å; V14-V93 HydrophobicContact CG2-CG2 3.45Å; V14-V93 VanDerWaalsContact CG2-CG2 3.45Å; S89-V93 WeakPolarHBondContact O-CG2 3.32Å; S89-V93 PolarHBondContact O-N 2.69Å; L90-V93 PolarHBondContact O-N 2.91Å; V93-H95 PolarHBondContact O-N 3.26Å; V93-A96 PolarHBondContact O-N 3.23Å; V93-V97 HydrophobicContact CG1-CG2 3.97Å; V93-V97 WeakPolarHBondContact O-CG2 3.32Å; V93-V97 PolarHBondContact O-N 2.88Å
94	G	84.8	Confident	86.4	Confident	43 Å²	43	55.3 Å²	55.3	44%	0.443	30%	0.296	S	S	.	.	H	α-helix	trans	-55.2	-42.3	175.2	0	0	0	0	0	111.9	L90 H98	L90-G94 PolarHBondContact O-N 3.36Å; G94-H98 WeakPolarHBondContact O-CB 3.34Å; G94-H98 PolarHBondContact O-N 3.36Å
95	H	86.3	Confident	86.3	Confident	54 Å²	54	55.2 Å²	55.2	25%	0.25	30%	0.295	C	S	.	.	H	α-helix	trans	-64.1	-44.1	171.9	174.1	-79.8	0	0	0	112.9	V91 Y92 V93 H99 T157	V91-H95 WeakPolarHBondContact O-CB 3.23Å; V91-H95 PolarHBondContact O-N 3.46Å; Y92-H95 PolarHBondContact O-N 2.86Å; V93-H95 PolarHBondContact O-N 3.26Å; H95-H99 VanDerWaalsContact O-CB 3.24Å; H95-H99 WeakPolarHBondContact O-CB 3.47Å; H95-H99 PolarHBondContact O-N 3.24Å; H95-T157 PolarHBondContact CE1-OG1 2.65Å; H95-T157 PolarHBondContact ND1-OG1 3.08Å
96	A	84.2	Confident	86.2	Confident	6 Å²	6	61.3 Å²	61.3	5%	0.05	32%	0.318	C	S	.	.	H	α-helix	trans	-65.1	-49.9	-179.1	0	0	0	0	0	112.1	Y92 V93 H98 H99 V100 L154	Y92-A96 WeakPolarHBondContact O-CB 3.33Å; Y92-A96 PolarHBondContact O-N 3.47Å; V93-A96 PolarHBondContact O-N 3.23Å; A96-H98 PolarHBondContact O-N 3.42Å; A96-H99 PolarHBondContact O-N 2.87Å; A96-V100 WeakPolarHBondContact O-CG2 3.31Å; A96-V100 PolarHBondContact O-N 3.47Å; A96-L154 HydrophobicContact CB-CD1 4.2Å
97	V	83	Confident	86.3	Confident	72 Å²	72	64.2 Å²	64.2	44%	0.436	33%	0.329	S	S	.	.	H	α-helix	trans	-60.2	-46.1	176.8	174.7	0	0	0	0	110.6	V93 H99 V100 H101	V93-V97 HydrophobicContact CG1-CG2 3.97Å; V93-V97 WeakPolarHBondContact O-CG2 3.32Å; V93-V97 PolarHBondContact O-N 2.88Å; V97-H99 PolarHBondContact O-N 2.87Å; V97-V100 PolarHBondContact O-N 3.01Å; V97-H101 WeakPolarHBondContact O-CB 3.42Å; V97-H101 PolarHBondContact O-N 3.01Å
98	H	85.1	Confident	86.5	Confident	120 Å²	120	67.2 Å²	67.2	56%	0.556	34%	0.339	S	S	*	.	H	α-helix	trans	-60.1	-42.7	175	179.4	-93.3	0	0	0	112.4	G94 A96 H101 M102	G94-H98 WeakPolarHBondContact O-CB 3.34Å; G94-H98 PolarHBondContact O-N 3.36Å; A96-H98 PolarHBondContact O-N 3.42Å; H98-H101 PolarHBondContact O-N 2.88Å; H98-M102 WeakPolarHBondContact O-CB 3.49Å; H98-M102 VanDerWaalsContact O-CG 3.28Å; H98-M102 WeakPolarHBondContact O-CG 3.4Å; H98-M102 PolarHBondContact O-N 3.26Å
99	H	84.4	Confident	86.4	Confident	55 Å²	55	75.1 Å²	75.1	26%	0.255	37%	0.368	S	S	.	.	H	α-helix	trans	-64.3	-41.1	177.6	-171	-64.8	0	0	0	112.1	H95 A96 V97 E103	H95-H99 VanDerWaalsContact O-CB 3.24Å; H95-H99 WeakPolarHBondContact O-CB 3.47Å; H95-H99 PolarHBondContact O-N 3.24Å; A96-H99 PolarHBondContact O-N 2.87Å; V97-H99 PolarHBondContact O-N 2.87Å; H99-E103 IonicContact CE1-OE1 2.77Å; H99-E103 PolarHBondContact CE1-OE1 3.3Å; H99-E103 VanDerWaalsContact CE1-OE1 3.32Å; H99-E103 IonicContact ND1-OE1 2.69Å; H99-E103 WeakPolarHBondContact O-CB 3.4Å; H99-E103 PolarHBondContact O-N 3.44Å
100	V	81.3	Confident	86.7	Confident	57 Å²	57	78.2 Å²	78.2	35%	0.345	38%	0.38	S	S	.	.	H	α-helix	trans	-64	-49.4	176.3	171.9	0	0	0	0	110.6	A96 V97 M102 E103 E104 F148	A96-V100 WeakPolarHBondContact O-CG2 3.31Å; A96-V100 PolarHBondContact O-N 3.47Å; V97-V100 PolarHBondContact O-N 3.01Å; V100-M102 VanDerWaalsContact C-N 3.32Å; V100-M102 PolarHBondContact O-N 3.11Å; V100-E103 WeakPolarHBondContact O-CB 3.37Å; V100-E103 PolarHBondContact O-N 2.94Å; V100-E103 VanDerWaalsContact O-N 3.11Å; V100-E104 PolarHBondContact O-N 3.43Å; V100-F148 HydrophobicContact CG2-CE1 4.1Å; V100-F148 HydrophobicContact CG2-CZ 3.67Å
101	H	84.4	Confident	87	Confident	104 Å²	104	81.5 Å²	81.5	48%	0.481	39%	0.394	S	S	.	.	H	α-helix	trans	-62.4	-37.4	-180	-173.5	55.7	0	0	0	112.8	V97 H98 E104 K105	V97-H101 WeakPolarHBondContact O-CB 3.42Å; V97-H101 PolarHBondContact O-N 3.01Å; H98-H101 PolarHBondContact O-N 2.88Å; H101-E104 IonicContact CE1-OE2 3.55Å; H101-K105 WeakPolarHBondContact O-CB 3.32Å; H101-K105 WeakPolarHBondContact O-CG 3.35Å; H101-K105 PolarHBondContact O-N 2.92Å; H101-K105 VanDerWaalsContact O-N 3.09Å
102	M	87.2	Confident	87.1	Confident	101 Å²	101	79.2 Å²	79.2	50%	0.498	39%	0.386	S	S	.	.	H	α-helix	trans	-71.7	-32.4	173.9	-72.8	-62.5	-67.1	0	0	112.9	H98 V100 R106	H98-M102 WeakPolarHBondContact O-CB 3.49Å; H98-M102 VanDerWaalsContact O-CG 3.28Å; H98-M102 WeakPolarHBondContact O-CG 3.4Å; H98-M102 PolarHBondContact O-N 3.26Å; V100-M102 VanDerWaalsContact C-N 3.32Å; V100-M102 PolarHBondContact O-N 3.11Å; M102-R106 PolarHBondContact O-N 2.88Å
103	E	85.6	Confident	87.2	Confident	73 Å²	73	84.8 Å²	84.8	34%	0.341	41%	0.412	S	S	.	.	H	α-helix	trans	-71.3	-33.8	172.7	-104.3	-159.3	-142.5	0	0	113.2	H99 V100 R106 K107	H99-E103 IonicContact CE1-OE1 2.77Å; H99-E103 PolarHBondContact CE1-OE1 3.3Å; H99-E103 VanDerWaalsContact CE1-OE1 3.32Å; H99-E103 IonicContact ND1-OE1 2.69Å; H99-E103 WeakPolarHBondContact O-CB 3.4Å; H99-E103 PolarHBondContact O-N 3.44Å; V100-E103 WeakPolarHBondContact O-CB 3.37Å; V100-E103 PolarHBondContact O-N 2.94Å; V100-E103 VanDerWaalsContact O-N 3.11Å; E103-R106 PolarHBondContact O-N 3.25Å; E103-K107 WeakPolarHBondContact O-CD 3.24Å; E103-K107 WeakPolarHBondContact O-CG 3.48Å; E103-K107 PolarHBondContact O-N 2.69Å; E103-K107 IonicContact OE2-NZ 3.1Å; E103-K107 PolarHBondContact OE2-NZ 2.88Å
104	E	87.2	Confident	87.6	Confident	106 Å²	106	89.3 Å²	89.3	50%	0.495	44%	0.435	S	S	.	.	H	α-helix	trans	-67.3	-52.9	175.6	-172.2	159.4	-123.6	0	0	110.5	V100 H101 R106 K107 E108	V100-E104 PolarHBondContact O-N 3.43Å; H101-E104 IonicContact CE1-OE2 3.55Å; E104-R106 PolarHBondContact O-N 2.89Å; E104-K107 PolarHBondContact O-N 3.41Å; E104-E108 PolarHBondContact O-N 2.87Å
105	K	91.3	Very high	87.8	Confident	87 Å²	87	90.4 Å²	90.4	38%	0.378	44%	0.436	S	S	.	.	H	α-helix	trans	-56.2	-22.9	172.3	-79.8	173.4	164	168.9	0	114.9	H101 E108 R109	H101-K105 WeakPolarHBondContact O-CB 3.32Å; H101-K105 WeakPolarHBondContact O-CG 3.35Å; H101-K105 PolarHBondContact O-N 2.92Å; H101-K105 VanDerWaalsContact O-N 3.09Å; K105-E108 WeakPolarHBondContact CA-OE2 3.47Å; K105-R109 WeakPolarHBondContact O-CG 3.17Å
106	R	89.8	Confident	87.8	Confident	130 Å²	130	96.9 Å²	96.9	49%	0.491	46%	0.458	S	S	.	.	H	α-helix	trans	-79.4	-41.4	173.7	-145.5	-170.9	80.1	-133.5	-7.2	111.5	M102 E103 E104 R109 E110	M102-R106 PolarHBondContact O-N 2.88Å; E103-R106 PolarHBondContact O-N 3.25Å; E104-R106 PolarHBondContact O-N 2.89Å; R106-R109 PolarHBondContact O-N 2.9Å; R106-E110 IonicContact CZ-OE1 3.57Å; R106-E110 IonicContact NE-OE1 2.97Å; R106-E110 PolarHBondContact NE-OE1 2.73Å; R106-E110 IonicContact NH2-OE1 3.14Å; R106-E110 PolarHBondContact NH2-OE1 3.33Å; R106-E110 IonicContact NH2-OE2 3.17Å; R106-E110 WeakPolarHBondContact O-CG 3.31Å; R106-E110 PolarHBondContact O-N 3.44Å
107	K	90	Very high	87.8	Confident	75 Å²	75	102.7 Å²	102.7	33%	0.326	48%	0.484	S	S	.	.	H	α-helix	trans	-66.8	-40.5	177.1	-69.3	157.6	-167.2	143.3	0	111.7	E103 E104 R109 E110 E111	E103-K107 WeakPolarHBondContact O-CD 3.24Å; E103-K107 WeakPolarHBondContact O-CG 3.48Å; E103-K107 PolarHBondContact O-N 2.69Å; E103-K107 IonicContact OE2-NZ 3.1Å; E103-K107 PolarHBondContact OE2-NZ 2.88Å; E104-K107 PolarHBondContact O-N 3.41Å; K107-R109 PolarHBondContact O-N 3.22Å; K107-E110 PolarHBondContact O-N 3.45Å; K107-E111 WeakPolarHBondContact O-CB 3.5Å; K107-E111 WeakPolarHBondContact O-CG 3.48Å; K107-E111 PolarHBondContact O-N 2.59Å
108	E	92.1	Very high	87.8	Confident	121 Å²	121	105.4 Å²	105.4	57%	0.565	49%	0.492	S	S	*	.	H	α-helix	trans	-54.6	-38.3	172.3	-68.6	177.3	146.8	0	0	112.2	E104 K105 A112	E104-E108 PolarHBondContact O-N 2.87Å; K105-E108 WeakPolarHBondContact CA-OE2 3.47Å; E108-A112 VanDerWaalsContact O-CB 3.25Å; E108-A112 WeakPolarHBondContact O-CB 3.16Å; E108-A112 PolarHBondContact O-N 3.39Å
109	R	89.9	Confident	87.5	Confident	176 Å²	176	106.2 Å²	106.2	66%	0.664	50%	0.496	S	S	*	.	H	α-helix	trans	-74.4	-45.1	176.3	-68	174.1	-176.5	-141.7	-0.7	112.4	K105 R106 K107 E111 A112 E113	K105-R109 WeakPolarHBondContact O-CG 3.17Å; R106-R109 PolarHBondContact O-N 2.9Å; K107-R109 PolarHBondContact O-N 3.22Å; R109-E111 VanDerWaalsContact C-N 3.3Å; R109-E111 PolarHBondContact O-N 3.22Å; R109-A112 PolarHBondContact O-N 3.39Å; R109-E113 WeakPolarHBondContact O-CB 3.16Å; R109-E113 WeakPolarHBondContact O-CG 3.19Å; R109-E113 PolarHBondContact O-N 2.71Å
110	E	91.2	Very high	87.2	Confident	80 Å²	80	109.1 Å²	109.1	37%	0.374	51%	0.513	S	S	.	.	H	α-helix	trans	-57.9	-42.6	175.6	-71.2	166.7	-170.7	0	0	111.1	R106 K107 L114	R106-E110 IonicContact CZ-OE1 3.57Å; R106-E110 IonicContact NE-OE1 2.97Å; R106-E110 PolarHBondContact NE-OE1 2.73Å; R106-E110 IonicContact NH2-OE1 3.14Å; R106-E110 PolarHBondContact NH2-OE1 3.33Å; R106-E110 IonicContact NH2-OE2 3.17Å; R106-E110 WeakPolarHBondContact O-CG 3.31Å; R106-E110 PolarHBondContact O-N 3.44Å; K107-E110 PolarHBondContact O-N 3.45Å; E110-L114 WeakPolarHBondContact O-CB 3.24Å; E110-L114 WeakPolarHBondContact O-CD1 3.45Å; E110-L114 WeakPolarHBondContact O-CG 3.21Å; E110-L114 PolarHBondContact O-N 2.7Å
111	E	91.1	Very high	86.7	Confident	129 Å²	129	110 Å²	110	60%	0.603	52%	0.522	S	S	*	.	H	α-helix	trans	-70.3	-37	176.5	-70.4	177.2	-166.6	0	0	112.5	K107 R109 S115	K107-E111 WeakPolarHBondContact O-CB 3.5Å; K107-E111 WeakPolarHBondContact O-CG 3.48Å; K107-E111 PolarHBondContact O-N 2.59Å; R109-E111 VanDerWaalsContact C-N 3.3Å; R109-E111 PolarHBondContact O-N 3.22Å; E111-S115 WeakPolarHBondContact O-CB 3.43Å; E111-S115 PolarHBondContact O-N 3.18Å; E111-S115 PolarHBondContact O-OG 3.36Å
112	A	91.4	Very high	85.7	Confident	52 Å²	52	111.9 Å²	111.9	43%	0.43	53%	0.531	S	S	.	.	H	α-helix	trans	-69.3	-39.3	174.9	0	0	0	0	0	112.9	E108 R109 S115 R116	E108-A112 VanDerWaalsContact O-CB 3.25Å; E108-A112 WeakPolarHBondContact O-CB 3.16Å; E108-A112 PolarHBondContact O-N 3.39Å; R109-A112 PolarHBondContact O-N 3.39Å; A112-S115 PolarHBondContact O-N 3.18Å; A112-R116 WeakPolarHBondContact O-CG 3.45Å; A112-R116 PolarHBondContact O-N 2.89Å
113	E	89.4	Confident	84.5	Confident	124 Å²	124	115 Å²	115	58%	0.579	54%	0.544	S	S	*	.	H	α-helix	trans	-66.6	-42.5	175.1	-74.8	178.2	-160.4	0	0	111.6	R109 R116 Q117	R109-E113 WeakPolarHBondContact O-CB 3.16Å; R109-E113 WeakPolarHBondContact O-CG 3.19Å; R109-E113 PolarHBondContact O-N 2.71Å; E113-R116 PolarHBondContact O-N 2.85Å; E113-Q117 WeakPolarHBondContact O-CG 3.25Å; E113-Q117 PolarHBondContact O-N 3Å
114	L	90.3	Very high	83.2	Confident	111 Å²	111	121.5 Å²	121.5	58%	0.581	57%	0.565	S	S	*	*	H	α-helix	trans	-59.9	-43.7	172.1	-79.8	165.6	0	0	0	112	E110 R116 Q117 Q118	E110-L114 WeakPolarHBondContact O-CB 3.24Å; E110-L114 WeakPolarHBondContact O-CD1 3.45Å; E110-L114 WeakPolarHBondContact O-CG 3.21Å; E110-L114 PolarHBondContact O-N 2.7Å; L114-R116 PolarHBondContact O-N 3.47Å; L114-Q117 PolarHBondContact O-N 3.07Å; L114-Q118 PolarHBondContact O-N 2.69Å
115	S	88.4	Confident	81.8	Confident	66 Å²	66	122.9 Å²	122.9	46%	0.462	58%	0.576	S	S	.	*	H	α-helix	trans	-59.9	-46.5	177.9	-58.9	0	0	0	0	111.6	E111 A112 Q117 Q118 E119	E111-S115 WeakPolarHBondContact O-CB 3.43Å; E111-S115 PolarHBondContact O-N 3.18Å; E111-S115 PolarHBondContact O-OG 3.36Å; A112-S115 PolarHBondContact O-N 3.18Å; S115-Q117 PolarHBondContact O-N 3.45Å; S115-Q118 PolarHBondContact O-N 3.01Å; S115-E119 PolarHBondContact O-N 3.39Å
116	R	86.8	Confident	80	Confident	190 Å²	190	124.2 Å²	124.2	72%	0.717	59%	0.593	S	S	*	*	H	α-helix	trans	-67.4	-32.4	177.3	-67.9	-168.2	74.6	172	4.8	113.5	A112 E113 L114 Q118 L120	A112-R116 WeakPolarHBondContact O-CG 3.45Å; A112-R116 PolarHBondContact O-N 2.89Å; E113-R116 PolarHBondContact O-N 2.85Å; L114-R116 PolarHBondContact O-N 3.47Å; R116-Q118 VanDerWaalsContact C-N 3.34Å; R116-L120 WeakPolarHBondContact O-CB 3.44Å; R116-L120 PolarHBondContact O-N 3.13Å; R116-L120 VanDerWaalsContact O-N 3.12Å
117	Q	83.8	Confident	78.3	Confident	127 Å²	127	126 Å²	126	59%	0.593	61%	0.612	S	S	*	*	H	α-helix	trans	-67.4	-36.2	172.3	-73.7	-179.5	27.1	0	0	111.8	E113 L114 S115 S121	E113-Q117 WeakPolarHBondContact O-CG 3.25Å; E113-Q117 PolarHBondContact O-N 3Å; L114-Q117 PolarHBondContact O-N 3.07Å; S115-Q117 PolarHBondContact O-N 3.45Å; Q117-S121 WeakPolarHBondContact O-CB 3.46Å; Q117-S121 PolarHBondContact O-N 3.1Å
118	Q	83.6	Confident	76.2	Confident	130 Å²	130	127.3 Å²	127.3	61%	0.607	64%	0.636	S	S	*	*	H	α-helix	trans	-68.4	-47.7	176.9	-170.1	172	-28.4	0	0	111.6	L114 S115 R116 L120 S121 E122	L114-Q118 PolarHBondContact O-N 2.69Å; S115-Q118 PolarHBondContact O-N 3.01Å; R116-Q118 VanDerWaalsContact C-N 3.34Å; Q118-L120 PolarHBondContact O-N 3Å; Q118-S121 WeakPolarHBondContact O-CB 3.22Å; Q118-S121 PolarHBondContact O-N 3.01Å; Q118-E122 PolarHBondContact O-N 3.18Å
119	E	79.1	Confident	74.6	Confident	136 Å²	136	127.3 Å²	127.3	64%	0.636	65%	0.646	S	S	*	*	H	α-helix	trans	-56.4	-47	174.9	-70.1	179.4	147.1	0	0	112	S115 S121 E122 E123	S115-E119 PolarHBondContact O-N 3.39Å; E119-S121 PolarHBondContact O-N 2.96Å; E119-E122 PolarHBondContact O-N 3.2Å; E119-E122 VanDerWaalsContact O-N 3.12Å; E119-E123 PolarHBondContact O-N 2.85Å
120	L	77.6	Confident	72.4	Confident	117 Å²	117	125.3 Å²	125.3	61%	0.613	65%	0.649	S	S	*	*	H	α-helix	trans	-64.8	-26.5	177.4	-164.4	78.8	0	0	0	112.7	R116 Q118 R124	R116-L120 WeakPolarHBondContact O-CB 3.44Å; R116-L120 PolarHBondContact O-N 3.13Å; R116-L120 VanDerWaalsContact O-N 3.12Å; Q118-L120 PolarHBondContact O-N 3Å; L120-R124 WeakPolarHBondContact O-CB 3.28Å
121	S	69.8	Low	70.1	Confident	74 Å²	74	129.5 Å²	129.5	52%	0.517	67%	0.669	S	S	.	*	H	α-helix	trans	-80.3	-26.9	174.6	-169.8	0	0	0	0	112.9	Q117 Q118 E119 L125	Q117-S121 WeakPolarHBondContact O-CB 3.46Å; Q117-S121 PolarHBondContact O-N 3.1Å; Q118-S121 WeakPolarHBondContact O-CB 3.22Å; Q118-S121 PolarHBondContact O-N 3.01Å; E119-S121 PolarHBondContact O-N 2.96Å; S121-L125 WeakPolarHBondContact O-CD1 3.28Å
122	E	64.8	Low	68.1	Low	144 Å²	144	127.4 Å²	127.4	67%	0.673	68%	0.682	S	S	*	*	H	α-helix	trans	-79.3	-42.8	177.3	-128.2	169.5	126.9	0	0	111	Q118 E119 R124 L125	Q118-E122 PolarHBondContact O-N 3.18Å; E119-E122 PolarHBondContact O-N 3.2Å; E119-E122 VanDerWaalsContact O-N 3.12Å; E122-R124 PolarHBondContact O-N 3.34Å; E122-R124 VanDerWaalsContact O-N 3.15Å; E122-L125 PolarHBondContact O-N 3.28Å
123	E	60.8	Low	65.6	Low	166 Å²	166	130.9 Å²	130.9	78%	0.776	70%	0.703	S	S	*	*	H	α-helix	trans	-58.5	-28.1	174.1	-168.7	-177.7	90.9	0	0	112.5	E119 L125	E119-E123 PolarHBondContact O-N 2.85Å; E123-L125 VanDerWaalsContact C-N 3.33Å; E123-L125 PolarHBondContact O-N 3.34Å
124	R	58.8	Low	63.7	Low	210 Å²	210	130.5 Å²	130.5	79%	0.792	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	5	-176.7	-144.2	175.2	-167.3	177.6	5.3	115.1	L120 E122 P126	L120-R124 WeakPolarHBondContact O-CB 3.28Å; E122-R124 PolarHBondContact O-N 3.34Å; E122-R124 VanDerWaalsContact O-N 3.15Å; R124-P126 WeakPolarHBondContact O-CD 3.49Å
125	L	58.8	Low	61.5	Low	136 Å²	136	136.1 Å²	136.1	71%	0.712	72%	0.722	S	S	*	*			trans	-115.3	86.3	172	-89.7	79.9	0	0	0	112.2	S121 E122 E123 L127	S121-L125 WeakPolarHBondContact O-CD1 3.28Å; E122-L125 PolarHBondContact O-N 3.28Å; E123-L125 VanDerWaalsContact C-N 3.33Å; E123-L125 PolarHBondContact O-N 3.34Å; L125-L127 PolarHBondContact O-N 2.76Å
126	P	52.4	Low	59.2	Low	115 Å²	115	139.1 Å²	139.1	75%	0.747	74%	0.738	S	S	*	*			trans	-71.5	117.3	170.1	-14.5	30.1	0	0	0	111.6	R124	R124-P126 WeakPolarHBondContact O-CD 3.49Å
127	L	54.2	Low	56.9	Low	168 Å²	168	135.5 Å²	135.5	88%	0.88	74%	0.737	S	S	*	*			trans	30.1	100.7	154.6	-72.8	165.8	0	0	0	118.4	L125	L125-L127 PolarHBondContact O-N 2.76Å
128	A	46.6	Very low	54.7	Low	101 Å²	101	139.1 Å²	139.1	84%	0.835	75%	0.751	S	S	*	*			trans	-132.9	102.8	151.1	0	0	0	0	0	109.6
129	P	57.5	Low	52.3	Low	121 Å²	121	141.3 Å²	141.3	79%	0.786	76%	0.761	S	S	*	*			trans	-82.6	119.3	172.2	31.7	-30.3	0	0	0	110.4
130	D	43.8	Very low	50.3	Low	134 Å²	134	140.6 Å²	140.6	72%	0.717	77%	0.766	S	S	*	*				170.2	162	115.8	-166.3	21.4	0	0	0	111
131	Q	43	Very low	48.2	Very low	168 Å²	168	140.3 Å²	140.3	79%	0.785	77%	0.774	S	S	*	*			trans	62.8	96.4	165.4	-40.6	-160.7	8.7	0	0	116.5
132	G	49.2	Very low	46.6	Very low	85 Å²	85	142.9 Å²	142.9	88%	0.876	79%	0.787	S	S	*	*			trans	-76.1	156	176.3	0	0	0	0	0	114
133	S	39.5	Very low	45.3	Very low	125 Å²	125	146.2 Å²	146.2	87%	0.874	80%	0.799	S	S	*	*			trans	-141.7	147.9	158.4	-170.5	0	0	0	0	110.5	R135	S133-R135 PolarHBondContact O-N 2.85Å
134	V	50.1	Low	44	Very low	116 Å²	116	140.7 Å²	140.7	70%	0.703	79%	0.787	S	S	*	*			trans	-66.2	119.3	-169.7	176.9	0	0	0	0	111.4	T136	V134-T136 HydrophobicContact CG1-CG2 4.17Å
135	R	42.6	Very low	42.8	Very low	229 Å²	229	135.4 Å²	135.4	86%	0.864	78%	0.782	S	S	*	*			trans	-132.1	74.1	154.1	-104.9	-179	179.6	169.4	1	112.2	S133 T137	S133-R135 PolarHBondContact O-N 2.85Å; R135-T137 PolarHBondContact O-N 3.3Å
136	T	41.3	Very low	41.9	Very low	129 Å²	129	138.4 Å²	138.4	79%	0.791	79%	0.789	S	S	*	*			trans	-68.6	71.9	162.4	48.6	0	0	0	0	110.8	V134	V134-T136 HydrophobicContact CG1-CG2 4.17Å
137	T	37.1	Very low	41.3	Very low	115 Å²	115	141.1 Å²	141.1	71%	0.706	79%	0.789	S	S	*	*			trans	-118	46.7	165.5	54.7	0	0	0	0	110	R135 E139	R135-T137 PolarHBondContact O-N 3.3Å; T137-E139 PolarHBondContact O-N 3.48Å
138	K	37.8	Very low	40.9	Very low	202 Å²	202	138.9 Å²	138.9	88%	0.878	77%	0.773	S	S	*	*			trans	-68.8	87.8	156.2	-171.7	167.3	-170.2	167.5	0	106	T140	K138-T140 PolarHBondContact O-N 2.94Å
139	E	34.2	Very low	41	Very low	177 Å²	177	142.7 Å²	142.7	83%	0.827	77%	0.765	S	S	*	*			trans	-50.3	127.5	-171.6	-171.1	175.6	157.2	0	0	109.4	T137 S141	T137-E139 PolarHBondContact O-N 3.48Å; E139-S141 PolarHBondContact O-N 3.3Å
140	T	35.4	Very low	41.1	Very low	120 Å²	120	139.2 Å²	139.2	74%	0.736	74%	0.74	S	S	*	*			trans	-73.1	76.1	179.9	43.3	0	0	0	0	109.1	K138 T142	K138-T140 PolarHBondContact O-N 2.94Å; T140-T142 VanDerWaalsContact C-N 3.33Å; T140-T142 WeakPolarHBondContact O-CA 2.93Å; T140-T142 PolarHBondContact O-N 3.41Å; T140-T142 PolarHBondContact O-OG1 3.46Å
141	S	35.3	Very low	42.1	Very low	112 Å²	112	137.7 Å²	137.7	78%	0.783	73%	0.729	S	S	*	*			trans	-45.1	102.2	169.3	177.5	0	0	0	0	107.2	E139 K143	E139-S141 PolarHBondContact O-N 3.3Å; S141-K143 PolarHBondContact O-N 3.39Å
142	T	34.5	Very low	43.7	Very low	128 Å²	128	132.7 Å²	132.7	79%	0.785	72%	0.722	S	S	*	*			trans	-76.1	104.6	-159.2	-58.2	0	0	0	0	106.2	T140 G144	T140-T142 VanDerWaalsContact C-N 3.33Å; T140-T142 WeakPolarHBondContact O-CA 2.93Å; T140-T142 PolarHBondContact O-N 3.41Å; T140-T142 PolarHBondContact O-OG1 3.46Å; T142-G144 PolarHBondContact O-N 3.44Å
143	K	37.7	Very low	45.1	Very low	213 Å²	213	132.5 Å²	132.5	93%	0.926	70%	0.704	S	S	*	*			trans	-70.8	43.1	178.1	-157.3	174.3	-176.3	176	0	111.5	S141	S141-K143 PolarHBondContact O-N 3.39Å
144	G	33.5	Very low	47.2	Very low	50 Å²	50	127.2 Å²	127.2	52%	0.515	67%	0.666	S	S	.	*			trans	-55.4	140.6	166.1	0	0	0	0	0	108.5	T142 K146	T142-G144 PolarHBondContact O-N 3.44Å; G144-K146 PolarHBondContact O-N 2.92Å
145	S	35.5	Very low	48.7	Very low	99 Å²	99	123.1 Å²	123.1	69%	0.692	64%	0.64	S	S	*	*			trans	-51.3	127.4	-176.3	38.4	0	0	0	0	110.5	K147	S145-K147 PolarHBondContact O-N 2.89Å
146	K	38.6	Very low	50.7	Low	199 Å²	199	121.1 Å²	121.1	87%	0.865	63%	0.632	S	S	*	*			trans	-63.5	74.7	172.4	-72.9	-177.3	177.5	177.9	0	108.9	G144 F148	G144-K146 PolarHBondContact O-N 2.92Å; K146-F148 PolarHBondContact O-N 3.29Å
147	K	39.4	Very low	53	Low	172 Å²	172	116.7 Å²	116.7	75%	0.748	61%	0.605	S	S	*	*			trans	-60.4	109.9	169.4	-79.1	-175.9	175.1	177.3	0	106.5	S145 R149	S145-K147 PolarHBondContact O-N 2.89Å; K147-R149 VanDerWaalsContact C-N 3.31Å; K147-R149 PolarHBondContact O-N 3.4Å
148	F	45.4	Very low	55.2	Low	121 Å²	121	111.3 Å²	111.3	53%	0.531	57%	0.572	S	S	.	*			trans	-55.5	96	171.7	-120.8	-98.8	0	0	0	108.4	H17 V100 K146 L150	H17-F148 AromaticContact CD2-CD1 3.76Å; H17-F148 AromaticContact CD2-CE1 3.6Å; H17-F148 AromaticContact NE2-CE1 3.57Å; H17-F148 AromaticContact NE2-CZ 3.59Å; V100-F148 HydrophobicContact CG2-CE1 4.1Å; V100-F148 HydrophobicContact CG2-CZ 3.67Å; K146-F148 PolarHBondContact O-N 3.29Å; F148-L150 PolarHBondContact O-N 2.93Å
149	R	50	Low	57.6	Low	181 Å²	181	104.9 Å²	104.9	68%	0.683	55%	0.546	S	S	*	.			trans	-79	102.4	178.6	-82	172.3	68.9	172.6	-0.5	106.7	K147 E151	K147-R149 VanDerWaalsContact C-N 3.31Å; K147-R149 PolarHBondContact O-N 3.4Å; R149-E151 HydrophobicContact CB-CG 4.05Å; R149-E151 IonicContact CZ-OE1 3.08Å; R149-E151 IonicContact CZ-OE2 3.22Å; R149-E151 IonicContact NE-OE1 3.53Å; R149-E151 PolarHBondContact NE-OE1 2.85Å; R149-E151 IonicContact NE-OE2 2.73Å; R149-E151 PolarHBondContact NE-OE2 3.3Å; R149-E151 VanDerWaalsContact NH2-CD 3.27Å; R149-E151 IonicContact NH2-OE1 2.83Å; R149-E151 PolarHBondContact NH2-OE1 2.99Å; R149-E151 IonicContact NH2-OE2 3.34Å; R149-E151 PolarHBondContact NH2-OE2 2.87Å; R149-E151 PolarHBondContact O-N 3.46Å
150	L	59	Low	60.3	Low	48 Å²	48	98.9 Å²	98.9	25%	0.251	52%	0.523	S	S	.	.			trans	-66.3	80.6	172.8	-138.3	85.3	0	0	0	108.7	F148 L154 L155 Y158	F148-L150 PolarHBondContact O-N 2.93Å; L150-L154 HydrophobicContact CD1-CD2 3.39Å; L150-L154 HydrophobicContact CG-CD2 3.75Å; L150-L155 HydrophobicContact CD2-CD1 4.16Å; L150-Y158 HydrophobicContact CD2-CD1 3.87Å; L150-Y158 HydrophobicContact CD2-CE1 4.28Å; L150-Y158 HydrophobicContact CD2-CG 4.16Å
151	E	65	Low	62.9	Low	103 Å²	103	94.1 Å²	94.1	48%	0.481	49%	0.493	S	S	.	.			trans	-126.5	162	-169.7	-80.6	-174.2	151	0	0	112.8	R149 T153 L154	R149-E151 HydrophobicContact CB-CG 4.05Å; R149-E151 IonicContact CZ-OE1 3.08Å; R149-E151 IonicContact CZ-OE2 3.22Å; R149-E151 IonicContact NE-OE1 3.53Å; R149-E151 PolarHBondContact NE-OE1 2.85Å; R149-E151 IonicContact NE-OE2 2.73Å; R149-E151 PolarHBondContact NE-OE2 3.3Å; R149-E151 VanDerWaalsContact NH2-CD 3.27Å; R149-E151 IonicContact NH2-OE1 2.83Å; R149-E151 PolarHBondContact NH2-OE1 2.99Å; R149-E151 IonicContact NH2-OE2 3.34Å; R149-E151 PolarHBondContact NH2-OE2 2.87Å; R149-E151 PolarHBondContact O-N 3.46Å; E151-T153 PolarHBondContact O-N 3.38Å; E151-L154 PolarHBondContact O-N 3.43Å
152	G	76.1	Confident	65.4	Low	62 Å²	62	88.9 Å²	88.9	64%	0.639	46%	0.456	S	S	*	.	H	α-helix	trans	49.2	-121.2	177.4	0	0	0	0	0	113.4	L154 L155 R156	G152-L154 PolarHBondContact O-N 3.22Å; G152-L155 PolarHBondContact O-N 3.22Å; G152-R156 PolarHBondContact O-N 2.96Å; G152-R156 VanDerWaalsContact O-N 3.16Å
153	T	79.8	Confident	68.2	Low	81 Å²	81	86.5 Å²	86.5	50%	0.497	44%	0.437	S	S	.	.	H	α-helix	trans	-59.1	-41.9	-175.3	-45.8	0	0	0	0	113	E151 R156 T157	E151-T153 PolarHBondContact O-N 3.38Å; T153-R156 WeakPolarHBondContact O-CB 3.19Å; T153-R156 PolarHBondContact O-N 3.26Å; T153-R156 VanDerWaalsContact O-N 3.11Å; T153-T157 PolarHBondContact O-N 2.73Å; T153-T157 PolarHBondContact O-OG1 2.83Å
154	L	82	Confident	70.9	Confident	14 Å²	14	81.6 Å²	81.6	7%	0.073	42%	0.417	C	S	.	.	H	α-helix	trans	-73.2	-34.3	-174	-162.4	151.2	0	0	0	111.5	Y92 A96 L150 E151 G152 R156 T157 Y158	Y92-L154 HydrophobicContact CE2-CD2 4.02Å; Y92-L154 HydrophobicContact CE2-CG 4.42Å; Y92-L154 WeakPolarHBondContact OH-CD2 3.25Å; A96-L154 HydrophobicContact CB-CD1 4.2Å; L150-L154 HydrophobicContact CD1-CD2 3.39Å; L150-L154 HydrophobicContact CG-CD2 3.75Å; E151-L154 PolarHBondContact O-N 3.43Å; G152-L154 PolarHBondContact O-N 3.22Å; L154-R156 VanDerWaalsContact C-N 3.34Å; L154-T157 PolarHBondContact O-OG1 3.34Å; L154-Y158 WeakPolarHBondContact O-CB 3.35Å; L154-Y158 PolarHBondContact O-N 3.04Å
155	L	81.9	Confident	73.6	Confident	30 Å²	30	80.1 Å²	80.1	16%	0.157	40%	0.396	C	S	.	.	H	α-helix	trans	-66.7	-34.1	168.2	-179.8	62.4	0	0	0	112.3	L150 G152 I159	L150-L155 HydrophobicContact CD2-CD1 4.16Å; G152-L155 PolarHBondContact O-N 3.22Å; L155-I159 HydrophobicContact CD1-CD1 4.11Å; L155-I159 HydrophobicContact CD1-CG1 4.35Å; L155-I159 HydrophobicContact CG-CD1 4.04Å; L155-I159 VanDerWaalsContact O-CG1 3.32Å; L155-I159 WeakPolarHBondContact O-CG1 3.01Å; L155-I159 PolarHBondContact O-N 2.89Å
156	R	86.1	Confident	76.4	Confident	187 Å²	187	77 Å²	77	71%	0.706	37%	0.373	S	S	*	.	H	α-helix	trans	-67.3	-50.1	176.5	-178.3	-176.8	175	-169.6	-1.6	111.3	G152 T153 L154 Y158 I159 C160	G152-R156 PolarHBondContact O-N 2.96Å; G152-R156 VanDerWaalsContact O-N 3.16Å; T153-R156 WeakPolarHBondContact O-CB 3.19Å; T153-R156 PolarHBondContact O-N 3.26Å; T153-R156 VanDerWaalsContact O-N 3.11Å; L154-R156 VanDerWaalsContact C-N 3.34Å; R156-Y158 VanDerWaalsContact C-N 3.28Å; R156-Y158 PolarHBondContact O-N 3.49Å; R156-I159 PolarHBondContact O-N 3.47Å; R156-C160 PolarHBondContact O-N 2.78Å; R156-C160 PolarHBondContact O-SG 3.23Å; R156-C160 VanDerWaalsContact O-SG 3.34Å
157	T	88	Confident	79.1	Confident	37 Å²	37	72.7 Å²	72.7	23%	0.227	36%	0.358	C	S	.	.	H	α-helix	trans	-64.3	-36	177.5	54.1	0	0	0	0	111.3	H95 T153 L154 C160 H161	H95-T157 PolarHBondContact CE1-OG1 2.65Å; H95-T157 PolarHBondContact ND1-OG1 3.08Å; T153-T157 PolarHBondContact O-N 2.73Å; T153-T157 PolarHBondContact O-OG1 2.83Å; L154-T157 PolarHBondContact O-OG1 3.34Å; T157-C160 PolarHBondContact O-N 2.71Å; T157-H161 PolarHBondContact O-N 3.13Å
158	Y	84.9	Confident	81.8	Confident	2 Å²	2	67.6 Å²	67.6	1%	0.008	34%	0.337	C	S	.	.	H	α-helix	trans	-58	-50.3	171	-171.4	-117.2	0	0	0	112.7	S18 Y92 L150 L154 R156 C160 H161 I162 E230 L234	S18-Y158 VanDerWaalsContact CB-OH 3.24Å; S18-Y158 WeakPolarHBondContact CB-OH 3.45Å; S18-Y158 PolarHBondContact OG-OH 3.15Å; Y92-Y158 HydrophobicContact CD1-CD2 4.29Å; Y92-Y158 HydrophobicContact CD2-CD2 4.18Å; Y92-Y158 AromaticContact CE1-CD2 3.8Å; Y92-Y158 HydrophobicContact CE1-CD2 3.8Å; Y92-Y158 HydrophobicContact CE1-CE2 4.23Å; Y92-Y158 AromaticContact CE2-CD2 3.69Å; Y92-Y158 HydrophobicContact CE2-CD2 3.69Å; Y92-Y158 HydrophobicContact CE2-CG 4.13Å; Y92-Y158 HydrophobicContact CG-CD2 4.46Å; Y92-Y158 AromaticContact CZ-CD2 3.47Å; Y92-Y158 VanDerWaalsContact CZ-CD2 3.47Å; L150-Y158 HydrophobicContact CD2-CD1 3.87Å; L150-Y158 HydrophobicContact CD2-CE1 4.28Å; L150-Y158 HydrophobicContact CD2-CG 4.16Å; L154-Y158 WeakPolarHBondContact O-CB 3.35Å; L154-Y158 PolarHBondContact O-N 3.04Å; R156-Y158 VanDerWaalsContact C-N 3.28Å; R156-Y158 PolarHBondContact O-N 3.49Å; Y158-C160 PolarHBondContact O-N 2.91Å; Y158-H161 AromaticContact CD2-CE1 3.59Å; Y158-H161 AromaticContact CD2-ND1 3.61Å; Y158-H161 AromaticContact CE2-CE1 3.54Å; Y158-H161 PolarHBondContact O-N 2.9Å; Y158-H161 PolarHBondContact O-ND1 3.33Å; Y158-I162 HydrophobicContact CD1-CD1 4.34Å; Y158-I162 HydrophobicContact CE1-CD1 3.92Å; Y158-I162 PolarHBondContact O-N 3.33Å; Y158-E230 PolarHBondContact OH-OE1 3.39Å; Y158-E230 PolarHBondContact OH-OE2 3.05Å; Y158-L234 HydrophobicContact CD1-CD1 4.13Å; Y158-L234 HydrophobicContact CE1-CD1 3.66Å; Y158-L234 HydrophobicContact CE1-CD2 4.22Å
159	I	87.6	Confident	84.2	Confident	67 Å²	67	61.9 Å²	61.9	34%	0.344	31%	0.311	S	S	.	.	H	α-helix	trans	-62.4	-43.2	177.5	-70.2	166	0	0	0	111.1	L155 R156 H161 I162 I163	L155-I159 HydrophobicContact CD1-CD1 4.11Å; L155-I159 HydrophobicContact CD1-CG1 4.35Å; L155-I159 HydrophobicContact CG-CD1 4.04Å; L155-I159 VanDerWaalsContact O-CG1 3.32Å; L155-I159 WeakPolarHBondContact O-CG1 3.01Å; L155-I159 PolarHBondContact O-N 2.89Å; R156-I159 PolarHBondContact O-N 3.47Å; I159-H161 VanDerWaalsContact C-N 3.32Å; I159-H161 PolarHBondContact O-N 2.73Å; I159-I162 PolarHBondContact O-N 2.88Å; I159-I163 HydrophobicContact CG2-CD1 3.8Å; I159-I163 WeakPolarHBondContact O-CG1 3.48Å; I159-I163 PolarHBondContact O-N 2.88Å; I159-I163 VanDerWaalsContact O-N 3.15Å
160	C	90.4	Very high	86.4	Confident	51 Å²	51	56.3 Å²	56.3	35%	0.345	30%	0.297	S	S	.	.	H	α-helix	trans	-59.7	-40.4	176.6	-70.1	0	0	0	0	112.5	R156 T157 Y158 I163 F164	R156-C160 PolarHBondContact O-N 2.78Å; R156-C160 PolarHBondContact O-SG 3.23Å; R156-C160 VanDerWaalsContact O-SG 3.34Å; T157-C160 PolarHBondContact O-N 2.71Å; Y158-C160 PolarHBondContact O-N 2.91Å; C160-I163 PolarHBondContact O-N 3.02Å; C160-F164 WeakPolarHBondContact O-CD2 3.32Å; C160-F164 PolarHBondContact O-N 3.49Å
161	H	89.4	Confident	88.3	Confident	20 Å²	20	56 Å²	56	9%	0.093	31%	0.306	C	S	.	.	H	α-helix	trans	-66.5	-39.3	-178.2	109.1	-82.4	0	0	0	112.6	P88 S89 T157 Y158 I159 I163 F164 K165	P88-H161 HydrophobicContact CB-CB 4.08Å; P88-H161 WeakPolarHBondContact CB-O 3.44Å; S89-H161 PolarHBondContact OG-CD2 3.08Å; S89-H161 PolarHBondContact OG-NE2 3.44Å; T157-H161 PolarHBondContact O-N 3.13Å; Y158-H161 AromaticContact CD2-CE1 3.59Å; Y158-H161 AromaticContact CD2-ND1 3.61Å; Y158-H161 AromaticContact CE2-CE1 3.54Å; Y158-H161 PolarHBondContact O-N 2.9Å; Y158-H161 PolarHBondContact O-ND1 3.33Å; I159-H161 VanDerWaalsContact C-N 3.32Å; I159-H161 PolarHBondContact O-N 2.73Å; H161-I163 VanDerWaalsContact C-N 3.34Å; H161-F164 PolarHBondContact O-N 3.04Å; H161-K165 VanDerWaalsContact O-CB 3.26Å; H161-K165 WeakPolarHBondContact O-CB 3.39Å; H161-K165 PolarHBondContact O-N 3.49Å
162	I	89.5	Confident	89.8	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-68.5	-37	176.4	-47.2	171.3	0	0	0	110.3	Y158 I159 K165 T166 N227 E230 I231 L234	Y158-I162 HydrophobicContact CD1-CD1 4.34Å; Y158-I162 HydrophobicContact CE1-CD1 3.92Å; Y158-I162 PolarHBondContact O-N 3.33Å; I159-I162 PolarHBondContact O-N 2.88Å; I162-K165 PolarHBondContact O-N 3.37Å; I162-T166 WeakPolarHBondContact O-CB 3.18Å; I162-T166 PolarHBondContact O-N 3.31Å; I162-T166 PolarHBondContact O-OG1 3.28Å; I162-N227 HydrophobicContact CG2-CB 3.87Å; I162-E230 HydrophobicContact CD1-CG 4.05Å; I162-I231 HydrophobicContact CB-CD1 4.27Å; I162-I231 HydrophobicContact CB-CG1 4.23Å; I162-I231 HydrophobicContact CD1-CG1 4.45Å; I162-I231 HydrophobicContact CG2-CD1 3.73Å; I162-I231 HydrophobicContact CG2-CG1 3.81Å; I162-L234 HydrophobicContact CD1-CD1 4.04Å
163	I	91.9	Very high	90.7	Very high	78 Å²	78	51 Å²	51	40%	0.4	27%	0.267	S	S	.	.	H	α-helix	trans	-61.1	-52.1	174.6	-68.6	168.1	0	0	0	110.6	I159 C160 H161 K165 T166 L167	I159-I163 HydrophobicContact CG2-CD1 3.8Å; I159-I163 WeakPolarHBondContact O-CG1 3.48Å; I159-I163 PolarHBondContact O-N 2.88Å; I159-I163 VanDerWaalsContact O-N 3.15Å; C160-I163 PolarHBondContact O-N 3.02Å; H161-I163 VanDerWaalsContact C-N 3.34Å; I163-K165 PolarHBondContact O-N 2.91Å; I163-T166 PolarHBondContact O-N 3.25Å; I163-L167 HydrophobicContact CG2-CD1 3.9Å; I163-L167 HydrophobicContact CG2-CG 4.4Å; I163-L167 WeakPolarHBondContact O-CG 3.21Å; I163-L167 PolarHBondContact O-N 3.06Å
164	F	94.2	Very high	91.5	Very high	111 Å²	111	50.2 Å²	50.2	49%	0.487	26%	0.262	S	S	.	.	H	α-helix	trans	-61.2	-42.5	177.5	-77.4	-63.7	0	0	0	112.4	P88 C160 H161 T166 L167 F168	P88-F164 HydrophobicContact CB-CB 4.2Å; P88-F164 HydrophobicContact CG-CB 3.85Å; C160-F164 WeakPolarHBondContact O-CD2 3.32Å; C160-F164 PolarHBondContact O-N 3.49Å; H161-F164 PolarHBondContact O-N 3.04Å; F164-T166 VanDerWaalsContact C-N 3.32Å; F164-T166 PolarHBondContact O-N 2.94Å; F164-L167 PolarHBondContact O-N 3.23Å; F164-F168 HydrophobicContact CB-CE2 4.18Å; F164-F168 WeakPolarHBondContact O-CD2 3.48Å; F164-F168 WeakPolarHBondContact O-CG 3.41Å; F164-F168 PolarHBondContact O-N 3.49Å
165	K	91.6	Very high	92.2	Very high	19 Å²	19	50.8 Å²	50.8	8%	0.083	27%	0.272	C	S	.	.	H	α-helix	trans	-57.6	-44.9	175	-170.9	176.8	-174.2	179.2	0	111.9	V85 H161 I162 I163 E169	V85-K165 HydrophobicContact CG1-CD 4.38Å; V85-K165 HydrophobicContact CG1-CG 3.89Å; H161-K165 VanDerWaalsContact O-CB 3.26Å; H161-K165 WeakPolarHBondContact O-CB 3.39Å; H161-K165 PolarHBondContact O-N 3.49Å; I162-K165 PolarHBondContact O-N 3.37Å; I163-K165 PolarHBondContact O-N 2.91Å; K165-E169 WeakPolarHBondContact O-CB 3.3Å; K165-E169 PolarHBondContact O-N 3.02Å
166	T	93	Very high	92.9	Very high	34 Å²	34	50.1 Å²	50.1	21%	0.209	27%	0.268	C	S	.	.	H	α-helix	trans	-65.8	-42.7	177.6	-53	0	0	0	0	111.4	I162 I163 F164 E169 V170 L224	I162-T166 WeakPolarHBondContact O-CB 3.18Å; I162-T166 PolarHBondContact O-N 3.31Å; I162-T166 PolarHBondContact O-OG1 3.28Å; I163-T166 PolarHBondContact O-N 3.25Å; F164-T166 VanDerWaalsContact C-N 3.32Å; F164-T166 PolarHBondContact O-N 2.94Å; T166-E169 PolarHBondContact O-N 3.24Å; T166-V170 HydrophobicContact CG2-CG2 4.5Å; T166-V170 WeakPolarHBondContact O-CB 3.5Å; T166-V170 WeakPolarHBondContact O-CG2 3.31Å; T166-V170 PolarHBondContact O-N 2.7Å; T166-L224 HydrophobicContact CG2-CD2 3.93Å
167	L	96.2	Very high	93.3	Very high	107 Å²	107	46.9 Å²	46.9	56%	0.56	26%	0.256	S	S	*	.	H	α-helix	trans	-64.3	-42.7	178	-71.8	171.8	0	0	0	112.4	I163 F164 G171	I163-L167 HydrophobicContact CG2-CD1 3.9Å; I163-L167 HydrophobicContact CG2-CG 4.4Å; I163-L167 WeakPolarHBondContact O-CG 3.21Å; I163-L167 PolarHBondContact O-N 3.06Å; F164-L167 PolarHBondContact O-N 3.23Å; L167-G171 PolarHBondContact O-N 3.34Å
168	F	96.3	Very high	93.7	Very high	66 Å²	66	52.9 Å²	52.9	29%	0.289	28%	0.279	S	S	.	.	H	α-helix	trans	-67.2	-45.8	174.7	-64.5	-45.7	0	0	0	111.6	F84 V85 P88 F164 V170 G171 F172	F84-F168 HydrophobicContact CB-CB 4.28Å; F84-F168 HydrophobicContact CB-CD1 4.43Å; F84-F168 HydrophobicContact CB-CD2 4.3Å; F84-F168 HydrophobicContact CB-CG 4.11Å; F84-F168 HydrophobicContact CD1-CD1 4.34Å; F84-F168 HydrophobicContact CD1-CE1 4.09Å; F84-F168 HydrophobicContact CD1-CE2 4.5Å; F84-F168 HydrophobicContact CD1-CZ 4.18Å; F84-F168 WeakPolarHBondContact O-CD2 3.38Å; V85-F168 HydrophobicContact CG2-CB 4.29Å; P88-F168 HydrophobicContact CG-CD2 3.97Å; P88-F168 HydrophobicContact CG-CE2 3.88Å; F164-F168 HydrophobicContact CB-CE2 4.18Å; F164-F168 WeakPolarHBondContact O-CD2 3.48Å; F164-F168 WeakPolarHBondContact O-CG 3.41Å; F164-F168 PolarHBondContact O-N 3.49Å; F168-V170 PolarHBondContact O-N 3.4Å; F168-G171 PolarHBondContact O-N 3.45Å; F168-G171 VanDerWaalsContact O-N 3.11Å; F168-F172 WeakPolarHBondContact O-CD2 3.29Å; F168-F172 PolarHBondContact O-N 3.01Å
169	E	95.3	Very high	94.2	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-60.8	-42	179.3	-169.9	81.3	-91.2	0	0	111.8	R33 Q81 V85 K165 T166 V173 S223 L224	R33-E169 IonicContact CZ-OE1 3.34Å; R33-E169 IonicContact CZ-OE2 3.65Å; R33-E169 IonicContact NH1-OE1 2.73Å; R33-E169 PolarHBondContact NH1-OE1 3.26Å; R33-E169 VanDerWaalsContact NH1-OE1 3.08Å; R33-E169 IonicContact NH1-OE2 2.71Å; R33-E169 PolarHBondContact NH1-OE2 2.92Å; R33-E169 VanDerWaalsContact NH2-CD 3.32Å; R33-E169 IonicContact NH2-OE1 3.18Å; R33-E169 PolarHBondContact NH2-OE1 3.07Å; R33-E169 IonicContact NH2-OE2 2.68Å; R33-E169 PolarHBondContact NH2-OE2 3.4Å; Q81-E169 PolarHBondContact NE2-OE1 3.36Å; V85-E169 HydrophobicContact CG2-CB 4.12Å; K165-E169 WeakPolarHBondContact O-CB 3.3Å; K165-E169 PolarHBondContact O-N 3.02Å; T166-E169 PolarHBondContact O-N 3.24Å; E169-V173 WeakPolarHBondContact O-CG2 3.46Å; E169-V173 PolarHBondContact O-N 2.92Å; E169-S223 VanDerWaalsContact OE2-CB 3.31Å; E169-S223 WeakPolarHBondContact OE2-CB 3.39Å; E169-S223 PolarHBondContact OE2-OG 2.91Å; E169-L224 HydrophobicContact CB-CD2 3.69Å; E169-L224 HydrophobicContact CB-CG 4.33Å; E169-L224 HydrophobicContact CG-CD1 4.39Å; E169-L224 HydrophobicContact CG-CD2 3.58Å; E169-L224 HydrophobicContact CG-CG 3.66Å
170	V	97.1	Very high	94.5	Very high	65 Å²	65	55.2 Å²	55.2	39%	0.394	29%	0.29	S	S	.	.	H	α-helix	trans	-65	-45.8	170.2	172.4	0	0	0	0	111.2	T166 F168 F172 V173 V174 L224	T166-V170 HydrophobicContact CG2-CG2 4.5Å; T166-V170 WeakPolarHBondContact O-CB 3.5Å; T166-V170 WeakPolarHBondContact O-CG2 3.31Å; T166-V170 PolarHBondContact O-N 2.7Å; F168-V170 PolarHBondContact O-N 3.4Å; V170-F172 VanDerWaalsContact C-N 3.34Å; V170-F172 PolarHBondContact O-N 2.97Å; V170-V173 PolarHBondContact O-N 3.48Å; V170-V174 HydrophobicContact CG1-CG2 4Å; V170-V174 WeakPolarHBondContact O-CB 3.39Å; V170-V174 WeakPolarHBondContact O-CG2 3.4Å; V170-V174 PolarHBondContact O-N 3.29Å; V170-L224 HydrophobicContact CG2-CD1 4.02Å; V170-L224 HydrophobicContact CG2-CD2 3.63Å
171	G	97.5	Very high	94.6	Very high	42 Å²	42	53.7 Å²	53.7	43%	0.433	28%	0.283	S	S	.	.	H	α-helix	trans	-58.8	-41.5	-178.2	0	0	0	0	0	113.3	L167 F168 G175	L167-G171 PolarHBondContact O-N 3.34Å; F168-G171 PolarHBondContact O-N 3.45Å; F168-G171 VanDerWaalsContact O-N 3.11Å; G171-G175 PolarHBondContact O-N 2.87Å
172	F	96.5	Very high	94.7	Very high	33 Å²	33	57.2 Å²	57.2	15%	0.145	30%	0.299	C	S	.	.	H	α-helix	trans	-71.2	-38.8	175.5	-84.9	-81.4	0	0	0	112.8	L77 L80 Q81 F84 F168 V170 G175 Q176	L77-F172 HydrophobicContact CD1-CD1 3.96Å; L77-F172 HydrophobicContact CD1-CE1 3.86Å; L77-F172 HydrophobicContact CG-CD1 4.11Å; L77-F172 HydrophobicContact CG-CE1 4.36Å; L80-F172 HydrophobicContact CB-CE1 3.84Å; L80-F172 HydrophobicContact CB-CZ 3.89Å; Q81-F172 HydrophobicContact CB-CB 4.06Å; Q81-F172 HydrophobicContact CB-CD1 3.7Å; Q81-F172 HydrophobicContact CB-CD2 4.09Å; Q81-F172 HydrophobicContact CB-CE1 4.17Å; Q81-F172 HydrophobicContact CB-CG 3.66Å; Q81-F172 HydrophobicContact CG-CB 3.7Å; Q81-F172 HydrophobicContact CG-CD1 4.31Å; Q81-F172 HydrophobicContact CG-CD2 4.17Å; Q81-F172 HydrophobicContact CG-CG 3.79Å; F84-F172 HydrophobicContact CB-CE2 3.73Å; F84-F172 HydrophobicContact CB-CZ 4.43Å; F84-F172 AromaticContact CD2-CE2 3.77Å; F84-F172 HydrophobicContact CD2-CE2 3.77Å; F84-F172 AromaticContact CD2-CZ 3.65Å; F84-F172 HydrophobicContact CD2-CZ 3.65Å; F84-F172 HydrophobicContact CE2-CZ 4.33Å; F84-F172 AromaticContact CG-CE2 3.97Å; F84-F172 HydrophobicContact CG-CE2 3.97Å; F84-F172 HydrophobicContact CG-CZ 4.33Å; F168-F172 WeakPolarHBondContact O-CD2 3.29Å; F168-F172 PolarHBondContact O-N 3.01Å; V170-F172 VanDerWaalsContact C-N 3.34Å; V170-F172 PolarHBondContact O-N 2.97Å; F172-G175 PolarHBondContact O-N 3.25Å; F172-Q176 VanDerWaalsContact O-CB 3.24Å; F172-Q176 WeakPolarHBondContact O-CB 3.33Å; F172-Q176 PolarHBondContact O-N 3.25Å
173	V	96.2	Very high	94.9	Very high	27 Å²	27	65.5 Å²	65.5	16%	0.164	33%	0.33	C	S	.	.	H	α-helix	trans	-63.2	-43.7	174.3	167.6	0	0	0	0	111.5	E169 V170 Y177 L217 A220	E169-V173 WeakPolarHBondContact O-CG2 3.46Å; E169-V173 PolarHBondContact O-N 2.92Å; V170-V173 PolarHBondContact O-N 3.48Å; V173-Y177 WeakPolarHBondContact O-CB 3.44Å; V173-Y177 PolarHBondContact O-N 2.94Å; V173-L217 HydrophobicContact CG1-CD1 3.72Å; V173-L217 HydrophobicContact CG2-CD1 4.29Å; V173-A220 HydrophobicContact CG2-CB 3.57Å
174	V	97	Very high	95	Very high	63 Å²	63	62.4 Å²	62.4	38%	0.382	31%	0.314	S	S	.	.	H	α-helix	trans	-69.7	-40.2	177.9	172.6	0	0	0	0	111.3	V170 Y177 F178	V170-V174 HydrophobicContact CG1-CG2 4Å; V170-V174 WeakPolarHBondContact O-CB 3.39Å; V170-V174 WeakPolarHBondContact O-CG2 3.4Å; V170-V174 PolarHBondContact O-N 3.29Å; V174-Y177 PolarHBondContact O-N 3.07Å; V174-F178 HydrophobicContact CG1-CD2 3.65Å; V174-F178 HydrophobicContact CG1-CE2 3.61Å; V174-F178 VanDerWaalsContact O-CD2 3.32Å; V174-F178 WeakPolarHBondContact O-CD2 3.17Å; V174-F178 PolarHBondContact O-N 3.49Å
175	G	96.3	Very high	95	Very high	27 Å²	27	62.7 Å²	62.7	28%	0.278	32%	0.32	S	S	.	.	H	α-helix	trans	-63.4	-46.9	175.3	0	0	0	0	0	112.9	G171 F172 Y177 F178 L179	G171-G175 PolarHBondContact O-N 2.87Å; F172-G175 PolarHBondContact O-N 3.25Å; G175-Y177 VanDerWaalsContact C-N 3.3Å; G175-Y177 PolarHBondContact O-N 2.95Å; G175-F178 PolarHBondContact O-N 3.43Å; G175-L179 WeakPolarHBondContact O-CB 3.17Å; G175-L179 WeakPolarHBondContact O-CG 3.36Å; G175-L179 PolarHBondContact O-N 2.99Å
176	Q	95.4	Very high	95.2	Very high	16 Å²	16	65.3 Å²	65.3	8%	0.075	34%	0.339	C	S	.	.	H	α-helix	trans	-54.9	-45.2	171.7	168.7	65.9	45.2	0	0	111.3	H74 L77 F172 L179 Y180 G181	H74-Q176 PolarHBondContact CD2-NE2 2.87Å; H74-Q176 VanDerWaalsContact CD2-NE2 3.3Å; H74-Q176 PolarHBondContact CD2-OE1 3.21Å; H74-Q176 VanDerWaalsContact CD2-OE1 3.29Å; H74-Q176 PolarHBondContact NE2-NE2 2.98Å; L77-Q176 HydrophobicContact CD2-CB 4.04Å; F172-Q176 VanDerWaalsContact O-CB 3.24Å; F172-Q176 WeakPolarHBondContact O-CB 3.33Å; F172-Q176 PolarHBondContact O-N 3.25Å; Q176-L179 PolarHBondContact O-N 2.88Å; Q176-Y180 PolarHBondContact O-N 2.62Å; Q176-G181 PolarHBondContact O-N 3.01Å
177	Y	95.9	Very high	95.4	Very high	118 Å²	118	66.6 Å²	66.6	46%	0.463	34%	0.344	S	S	.	.	H	α-helix	trans	-64	-42.3	179.1	175.1	-106	0	0	0	112.9	V173 V174 G175 G181 F182	V173-Y177 WeakPolarHBondContact O-CB 3.44Å; V173-Y177 PolarHBondContact O-N 2.94Å; V174-Y177 PolarHBondContact O-N 3.07Å; G175-Y177 VanDerWaalsContact C-N 3.3Å; G175-Y177 PolarHBondContact O-N 2.95Å; Y177-G181 WeakPolarHBondContact O-CA 3.37Å; Y177-G181 PolarHBondContact O-N 3.35Å; Y177-F182 HydrophobicContact CD2-CD1 4.14Å; Y177-F182 AromaticContact CD2-CD2 3.92Å; Y177-F182 HydrophobicContact CD2-CD2 3.92Å; Y177-F182 AromaticContact CD2-CE1 3.67Å; Y177-F182 HydrophobicContact CD2-CE1 3.67Å; Y177-F182 AromaticContact CD2-CE2 3.42Å; Y177-F182 HydrophobicContact CD2-CE2 3.42Å; Y177-F182 VanDerWaalsContact CD2-CE2 3.42Å; Y177-F182 HydrophobicContact CD2-CG 4.26Å; Y177-F182 AromaticContact CD2-CZ 3.29Å; Y177-F182 HydrophobicContact CD2-CZ 3.29Å; Y177-F182 AromaticContact CE2-CD2 3.99Å; Y177-F182 HydrophobicContact CE2-CD2 3.99Å; Y177-F182 AromaticContact CE2-CE2 3.53Å; Y177-F182 HydrophobicContact CE2-CE2 3.53Å; Y177-F182 AromaticContact CE2-CZ 3.88Å; Y177-F182 HydrophobicContact CE2-CZ 3.88Å; Y177-F182 HydrophobicContact CG-CE1 4.27Å; Y177-F182 HydrophobicContact CG-CE2 4.49Å; Y177-F182 AromaticContact CG-CZ 4Å; Y177-F182 HydrophobicContact CG-CZ 4Å
178	F	96.1	Very high	95.4	Very high	163 Å²	163	64.6 Å²	64.6	72%	0.715	33%	0.33	S	S	*	.	H	α-helix	trans	-76.5	-26.1	178.4	-78.8	-62.5	0	0	0	114.4	V174 G175	V174-F178 HydrophobicContact CG1-CD2 3.65Å; V174-F178 HydrophobicContact CG1-CE2 3.61Å; V174-F178 VanDerWaalsContact O-CD2 3.32Å; V174-F178 WeakPolarHBondContact O-CD2 3.17Å; V174-F178 PolarHBondContact O-N 3.49Å; G175-F178 PolarHBondContact O-N 3.43Å
179	L	94.2	Very high	95.5	Very high	90 Å²	90	67.4 Å²	67.4	47%	0.471	34%	0.342	S	S	.	.	H	α-helix	trans	-80.3	-45.7	175.5	-73.7	166.8	0	0	0	112.5	I72 G175 Q176	I72-L179 HydrophobicContact CG2-CD1 4.31Å; G175-L179 WeakPolarHBondContact O-CB 3.17Å; G175-L179 WeakPolarHBondContact O-CG 3.36Å; G175-L179 PolarHBondContact O-N 2.99Å; Q176-L179 PolarHBondContact O-N 2.88Å
180	Y	93.9	Very high	95.6	Very high	28 Å²	28	67.4 Å²	67.4	11%	0.11	34%	0.342	C	S	.	.	H	α-helix	trans	-135.9	-3.1	-166.2	-54.7	-53.3	0	0	0	114.4	A69 F70 I72 H74 Q176	A69-Y180 WeakPolarHBondContact O-CE1 3.23Å; F70-Y180 HydrophobicContact CD1-CE1 4.16Å; I72-Y180 VanDerWaalsContact C-OH 3.29Å; I72-Y180 PolarHBondContact N-OH 3.03Å; I72-Y180 WeakPolarHBondContact O-CE2 3.37Å; I72-Y180 PolarHBondContact O-OH 3.29Å; H74-Y180 AromaticContact CE1-CD1 4Å; H74-Y180 AromaticContact CE1-CD2 3.33Å; H74-Y180 WeakPolarHBondContact CE1-CD2 2.85Å; H74-Y180 AromaticContact CE1-CE2 3.85Å; H74-Y180 AromaticContact CE1-CG 3.41Å; H74-Y180 VanDerWaalsContact CE1-CG 3.41Å; H74-Y180 WeakPolarHBondContact NE2-CB 3.45Å; H74-Y180 AromaticContact NE2-CD2 3.31Å; H74-Y180 VanDerWaalsContact NE2-CD2 3.31Å; H74-Y180 WeakPolarHBondContact NE2-CD2 3.02Å; H74-Y180 AromaticContact NE2-CG 3.52Å; Q176-Y180 PolarHBondContact O-N 2.62Å
181	G	93.6	Very high	95.6	Very high	19 Å²	19	68.1 Å²	68.1	20%	0.196	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	-145.3	-172.8	0	0	0	0	0	112.8	Q176 Y177	Q176-G181 PolarHBondContact O-N 3.01Å; Y177-G181 WeakPolarHBondContact O-CA 3.37Å; Y177-G181 PolarHBondContact O-N 3.35Å
182	F	91.2	Very high	95.6	Very high	94 Å²	94	70.3 Å²	70.3	41%	0.412	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	2	-178.8	-57.3	-47.9	0	0	0	113.9	Y177 L217	Y177-F182 HydrophobicContact CD2-CD1 4.14Å; Y177-F182 AromaticContact CD2-CD2 3.92Å; Y177-F182 HydrophobicContact CD2-CD2 3.92Å; Y177-F182 AromaticContact CD2-CE1 3.67Å; Y177-F182 HydrophobicContact CD2-CE1 3.67Å; Y177-F182 AromaticContact CD2-CE2 3.42Å; Y177-F182 HydrophobicContact CD2-CE2 3.42Å; Y177-F182 VanDerWaalsContact CD2-CE2 3.42Å; Y177-F182 HydrophobicContact CD2-CG 4.26Å; Y177-F182 AromaticContact CD2-CZ 3.29Å; Y177-F182 HydrophobicContact CD2-CZ 3.29Å; Y177-F182 AromaticContact CE2-CD2 3.99Å; Y177-F182 HydrophobicContact CE2-CD2 3.99Å; Y177-F182 AromaticContact CE2-CE2 3.53Å; Y177-F182 HydrophobicContact CE2-CE2 3.53Å; Y177-F182 AromaticContact CE2-CZ 3.88Å; Y177-F182 HydrophobicContact CE2-CZ 3.88Å; Y177-F182 HydrophobicContact CG-CE1 4.27Å; Y177-F182 HydrophobicContact CG-CE2 4.49Å; Y177-F182 AromaticContact CG-CZ 4Å; Y177-F182 HydrophobicContact CG-CZ 4Å; F182-L217 HydrophobicContact CD1-CD2 3.53Å; F182-L217 HydrophobicContact CE1-CD1 4.15Å; F182-L217 HydrophobicContact CE1-CD2 3.6Å; F182-L217 HydrophobicContact CG-CD2 4.28Å; F182-L217 HydrophobicContact CZ-CD2 4.4Å
183	R	93.5	Very high	95.6	Very high	175 Å²	175	79.2 Å²	79.2	66%	0.66	38%	0.378	S	S	*	.			trans	-154.5	127.4	-176	176.9	169.1	-170.5	179.6	3.9	110.7	T210	R183-T210 HydrophobicContact CB-CG2 4.1Å; R183-T210 HydrophobicContact CG-CG2 3.94Å
184	I	93.9	Very high	95.7	Very high	13 Å²	13	79.1 Å²	79.1	7%	0.067	38%	0.378	C	S	.	.			trans	-79.8	130.1	169.5	-66.4	-179.7	0	0	0	108.4	F70 V203 P206 K209 T210 I213	F70-I184 HydrophobicContact CE1-CD1 4.18Å; F70-I184 HydrophobicContact CZ-CG2 4.42Å; I184-V203 HydrophobicContact CG2-CB 4.28Å; I184-V203 HydrophobicContact CG2-CG1 3.82Å; I184-V203 HydrophobicContact CG2-CG2 4.44Å; I184-P206 HydrophobicContact CG2-CB 3.91Å; I184-K209 HydrophobicContact CD1-CB 3.94Å; I184-K209 HydrophobicContact CD1-CD 4.45Å; I184-T210 PolarHBondContact N-OG1 3.3Å; I184-I213 HydrophobicContact CD1-CD1 3.72Å; I184-I213 HydrophobicContact CG1-CD1 3.86Å
185	L	94.2	Very high	95.7	Very high	117 Å²	117	76.8 Å²	76.8	61%	0.613	36%	0.364	S	S	*	.			trans	-82.2	147.2	171.2	-68.1	173.8	0	0	0	109.8	L187	L185-L187 PolarHBondContact O-N 3.27Å
186	P	95.5	Very high	95.7	Very high	74 Å²	74	78.3 Å²	78.3	48%	0.481	37%	0.369	S	S	.	.	S	Bend	trans	-69.9	-20.3	179	30.1	-36.5	0	0	0	113.2	F202 V203 P206	P186-F202 WeakPolarHBondContact O-CA 3.46Å; P186-V203 PolarHBondContact O-N 2.99Å; P186-P206 HydrophobicContact CB-CB 4.44Å; P186-P206 HydrophobicContact CB-CG 3.85Å
187	L	96.8	Very high	95.7	Very high	62 Å²	62	84.4 Å²	84.4	33%	0.325	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	128.9	-177.4	173.7	63.1	0	0	0	109.5	L185 D200 F202	L185-L187 PolarHBondContact O-N 3.27Å; L187-D200 HydrophobicContact CD1-CB 3.61Å; L187-F202 HydrophobicContact CD1-CD1 4.41Å; L187-F202 HydrophobicContact CD1-CE1 4.06Å; L187-F202 HydrophobicContact CD1-CZ 4.36Å
188	Y	97	Very high	95.8	Very high	65 Å²	65	83.1 Å²	83.1	26%	0.255	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	137.4	169.4	-176.4	-97.6	0	0	0	108.9	Y52 E68 A69 C190 C201	Y52-Y188 WeakPolarHBondContact OH-CD1 3.39Å; E68-Y188 VanDerWaalsContact CG-OH 3.29Å; E68-Y188 WeakPolarHBondContact CG-OH 3.47Å; A69-Y188 HydrophobicContact CB-CD1 4.02Å; A69-Y188 HydrophobicContact CB-CD2 3.8Å; A69-Y188 HydrophobicContact CB-CE1 3.95Å; A69-Y188 HydrophobicContact CB-CE2 3.73Å; A69-Y188 HydrophobicContact CB-CG 3.94Å; Y188-C190 HydrophobicContact CD1-CB 3.95Å; Y188-C190 HydrophobicContact CE1-CB 3.78Å; Y188-C201 PolarHBondContact N-O 2.87Å; Y188-C201 PolarHBondContact O-N 3.37Å
189	K	97.8	Very high	95.9	Very high	124 Å²	124	75.8 Å²	75.8	54%	0.539	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	114.9	178	-65	-161.6	177.3	-96.8	0	109.3	T198 V199 D200	K189-T198 HydrophobicContact CB-CG2 3.96Å; K189-V199 WeakPolarHBondContact CA-O 3.26Å; K189-D200 WeakPolarHBondContact CE-OD1 2.94Å; K189-D200 WeakPolarHBondContact CG-OD1 3.42Å; K189-D200 IonicContact NZ-OD1 3.39Å; K189-D200 PolarHBondContact NZ-OD1 3.2Å; K189-D200 IonicContact NZ-OD2 2.65Å; K189-D200 PolarHBondContact NZ-OD2 2.88Å
190	C	97.9	Very high	96.1	Very high	0 Å²	0	74 Å²	74	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	138.5	-170.6	175.7	0	0	0	0	110.7	C65 Y188 T198 V199	C65-C190 WeakPolarHBondContact CA-SG 3.2Å; C65-C190 HydrophobicContact CB-CB 3.62Å; C65-C190 WeakPolarHBondContact CB-SG 3.33Å; C65-C190 WeakPolarHBondContact SG-CB 3.34Å; C65-C190 CovalentContact SG-SG 2.03Å; C65-C190 PolarHBondContact SG-SG 3.43Å; Y188-C190 HydrophobicContact CD1-CB 3.95Å; Y188-C190 HydrophobicContact CE1-CB 3.78Å; C190-T198 CarbonylContact O-C 3.51Å; C190-T198 VanDerWaalsContact O-CA 3.27Å; C190-T198 WeakPolarHBondContact O-CA 3.4Å; C190-V199 HydrophobicContact CB-CG2 3.95Å; C190-V199 PolarHBondContact N-O 3.39Å; C190-V199 PolarHBondContact O-N 3.46Å
191	S	97.6	Very high	96.2	Very high	81 Å²	81	72.6 Å²	72.6	57%	0.566	36%	0.361	S	S	*	.			trans	-134.4	16.8	176.4	57.1	0	0	0	0	113.5
192	R	97.4	Very high	96.4	Very high	87 Å²	87	76.6 Å²	76.6	33%	0.328	37%	0.373	S	S	.	.			trans	-76.6	138.6	-178.8	-178.3	173.1	179.7	-165.7	4.1	111.6	V64 D67 E68 C195	V64-R192 HydrophobicContact CB-CG 4.2Å; V64-R192 HydrophobicContact CG2-CB 4.36Å; V64-R192 HydrophobicContact CG2-CG 4.2Å; V64-R192 PolarHBondContact O-NH1 3Å; D67-R192 IonicContact OD2-CZ 3.06Å; D67-R192 IonicContact OD2-NH1 3.32Å; D67-R192 PolarHBondContact OD2-NH1 3.31Å; D67-R192 IonicContact OD2-NH2 3.6Å; D67-R192 PolarHBondContact OD2-NH2 3.39Å; E68-R192 VanDerWaalsContact N-NH1 3.17Å; E68-R192 WeakPolarHBondContact OE2-CB 3.26Å; R192-C195 WeakPolarHBondContact O-CB 3.34Å; R192-C195 PolarHBondContact O-N 3.3Å; R192-C195 PolarHBondContact O-SG 3.25Å
193	W	96.6	Very high	96.7	Very high	221 Å²	221	72.8 Å²	72.8	84%	0.837	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	132.9	176.9	-174.1	93.2	0	0	0	110.7
194	P	97.3	Very high	96.7	Very high	24 Å²	24	65 Å²	65	16%	0.156	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	cis	-94.2	12.5	19	37.4	-38.2	0	0	0	116.8	Q58	Q58-P194 HydrophobicContact CG-CB 4.47Å; Q58-P194 WeakPolarHBondContact CG-O 3.27Å
195	C	97.6	Very high	96.7	Very high	14 Å²	14	69.3 Å²	69.3	10%	0.095	35%	0.345	C	S	.	.	S	Bend	trans	-61.1	142.7	-172.8	-59.4	0	0	0	0	114.6	C61 C65 R192 N197 V199	C61-C195 WeakPolarHBondContact CA-SG 3.5Å; C61-C195 HydrophobicContact CB-CB 4.08Å; C61-C195 WeakPolarHBondContact CB-SG 3.32Å; C61-C195 WeakPolarHBondContact SG-CB 3.45Å; C61-C195 CovalentContact SG-SG 2.03Å; C61-C195 PolarHBondContact SG-SG 3.12Å; C65-C195 PolarHBondContact SG-SG 3.38Å; R192-C195 WeakPolarHBondContact O-CB 3.34Å; R192-C195 PolarHBondContact O-N 3.3Å; R192-C195 PolarHBondContact O-SG 3.25Å; C195-N197 PolarHBondContact O-N 3.03Å; C195-V199 HydrophobicContact CB-CG1 4.4Å; C195-V199 HydrophobicContact CB-CG2 4.28Å
196	P	96.4	Very high	96.8	Very high	60 Å²	60	64.9 Å²	64.9	39%	0.39	32%	0.324	S	S	.	.	S	Bend	trans	-83	105.2	177.9	32.5	-32.3	0	0	0	110.8	Q58 V199	Q58-P196 HydrophobicContact CB-CG 4.23Å; P196-V199 HydrophobicContact CG-CG1 4.35Å
197	N	95.8	Very high	96.7	Very high	144 Å²	144	66.3 Å²	66.3	77%	0.77	33%	0.331	S	S	*	.	S	Bend	trans	59.3	-146.9	-173.4	-44.3	-76.2	0	0	0	111.2	C195	C195-N197 PolarHBondContact O-N 3.03Å
198	T	97.4	Very high	96.6	Very high	90 Å²	90	66.7 Å²	66.7	55%	0.552	33%	0.331	S	S	*	.	S	Bend	trans	-89.3	123.5	172.6	-50.8	0	0	0	0	110.3	K189 C190	K189-T198 HydrophobicContact CB-CG2 3.96Å; C190-T198 CarbonylContact O-C 3.51Å; C190-T198 VanDerWaalsContact O-CA 3.27Å; C190-T198 WeakPolarHBondContact O-CA 3.4Å
199	V	97.8	Very high	96.4	Very high	9 Å²	9	63.8 Å²	63.8	6%	0.055	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	151.1	173.8	-61.1	0	0	0	0	111.4	K189 C190 C195 P196	K189-V199 WeakPolarHBondContact CA-O 3.26Å; C190-V199 HydrophobicContact CB-CG2 3.95Å; C190-V199 PolarHBondContact N-O 3.39Å; C190-V199 PolarHBondContact O-N 3.46Å; C195-V199 HydrophobicContact CB-CG1 4.4Å; C195-V199 HydrophobicContact CB-CG2 4.28Å; P196-V199 HydrophobicContact CG-CG1 4.35Å
200	D	97.9	Very high	96.3	Very high	52 Å²	52	58.5 Å²	58.5	28%	0.278	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	122.1	172.8	-80.6	-18.7	0	0	0	109.4	N55 L187 K189	N55-D200 WeakPolarHBondContact CB-O 3.03Å; N55-D200 PolarHBondContact N-O 3.42Å; L187-D200 HydrophobicContact CD1-CB 3.61Å; K189-D200 WeakPolarHBondContact CE-OD1 2.94Å; K189-D200 WeakPolarHBondContact CG-OD1 3.42Å; K189-D200 IonicContact NZ-OD1 3.39Å; K189-D200 PolarHBondContact NZ-OD1 3.2Å; K189-D200 IonicContact NZ-OD2 2.65Å; K189-D200 PolarHBondContact NZ-OD2 2.88Å
201	C	97.8	Very high	96.1	Very high	0 Å²	0	63 Å²	63	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	137.2	179.3	-56.6	0	0	0	0	111.5	Y52 V53 C54 Y188	Y52-C201 HydrophobicContact CE1-CB 3.89Å; Y52-C201 HydrophobicContact CE2-CB 4.42Å; Y52-C201 WeakPolarHBondContact OH-CB 3.41Å; V53-C201 CarbonylContact O-C 3.59Å; V53-C201 WeakPolarHBondContact O-CA 3.36Å; C54-C201 HydrophobicContact CB-CB 4.08Å; C54-C201 WeakPolarHBondContact CB-SG 3.25Å; C54-C201 WeakPolarHBondContact SG-CB 3.28Å; C54-C201 CovalentContact SG-SG 2.04Å; C54-C201 PolarHBondContact SG-SG 3.19Å; Y188-C201 PolarHBondContact N-O 2.87Å; Y188-C201 PolarHBondContact O-N 3.37Å
202	F	97.4	Very high	95.9	Very high	102 Å²	102	61.4 Å²	61.4	45%	0.447	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	131.6	-172.1	-61	-80.5	0	0	0	111.4	Y52 V53 P186 L187	Y52-F202 WeakPolarHBondContact CA-O 3.39Å; V53-F202 PolarHBondContact N-O 2.93Å; V53-F202 PolarHBondContact O-N 3.41Å; P186-F202 WeakPolarHBondContact O-CA 3.46Å; L187-F202 HydrophobicContact CD1-CD1 4.41Å; L187-F202 HydrophobicContact CD1-CE1 4.06Å; L187-F202 HydrophobicContact CD1-CZ 4.36Å
203	V	96.1	Very high	95.7	Very high	14 Å²	14	57.5 Å²	57.5	9%	0.085	29%	0.294	C	S	.	.			trans	-92.9	124	-177.5	-172.7	0	0	0	0	110.3	Y52 F70 I184 P186 P206	Y52-V203 HydrophobicContact CD2-CG2 4.34Å; Y52-V203 HydrophobicContact CE2-CG2 4.12Å; F70-V203 HydrophobicContact CE2-CG1 3.9Å; F70-V203 HydrophobicContact CE2-CG2 4.08Å; F70-V203 HydrophobicContact CZ-CG1 3.68Å; F70-V203 HydrophobicContact CZ-CG2 3.96Å; I184-V203 HydrophobicContact CG2-CB 4.28Å; I184-V203 HydrophobicContact CG2-CG1 3.82Å; I184-V203 HydrophobicContact CG2-CG2 4.44Å; P186-V203 PolarHBondContact O-N 2.99Å; V203-P206 WeakPolarHBondContact O-CD 3.36Å
204	S	94.1	Very high	95.6	Very high	13 Å²	13	51.4 Å²	51.4	9%	0.091	28%	0.276	C	S	.	.	S	Bend	trans	-53.9	138.3	170.1	149.5	0	0	0	0	112.4	D47 D51 K209	D47-S204 PolarHBondContact OD1-OG 3.25Å; D51-S204 WeakPolarHBondContact O-CB 3.29Å; D51-S204 PolarHBondContact O-N 2.89Å; S204-K209 WeakPolarHBondContact O-CD 3.45Å; S204-K209 WeakPolarHBondContact O-CE 3.46Å; S204-K209 PolarHBondContact O-NZ 3.36Å; S204-K209 PolarHBondContact OG-NZ 2.98Å
205	R	94.2	Very high	95.4	Very high	103 Å²	103	54.4 Å²	54.4	39%	0.389	29%	0.287	S	S	.	.	S	Bend	trans	46.9	47.1	170.3	-59.7	171.7	-166.9	-85.5	-4.7	115.7	D47 T207 E208 K209	D47-R205 IonicContact OD1-NE 3.37Å; D47-R205 PolarHBondContact OD1-NE 2.99Å; D47-R205 IonicContact OD2-CZ 3.16Å; D47-R205 IonicContact OD2-NE 2.7Å; D47-R205 PolarHBondContact OD2-NE 3.47Å; D47-R205 IonicContact OD2-NH2 2.76Å; D47-R205 PolarHBondContact OD2-NH2 3.44Å; R205-T207 VanDerWaalsContact C-N 3.32Å; R205-T207 PolarHBondContact O-N 3.37Å; R205-E208 HydrophobicContact CB-CB 4.15Å; R205-E208 WeakPolarHBondContact CD-OE2 3.49Å; R205-E208 IonicContact NH1-OE2 3.43Å; R205-E208 PolarHBondContact NH1-OE2 3.15Å; R205-E208 PolarHBondContact O-N 3.25Å; R205-K209 HydrophobicContact CB-CD 4.47Å; R205-K209 HydrophobicContact CB-CG 4.41Å; R205-K209 WeakPolarHBondContact O-CB 3.38Å; R205-K209 VanDerWaalsContact O-CG 3.3Å; R205-K209 WeakPolarHBondContact O-CG 3.48Å; R205-K209 PolarHBondContact O-N 3.08Å
206	P	95.3	Very high	95.1	Very high	24 Å²	24	54 Å²	54	16%	0.156	28%	0.284	C	S	.	.	H	α-helix	trans	-70.4	-30.3	-167.7	30.1	-32.6	0	0	0	112.4	I184 P186 V203 T210	I184-P206 HydrophobicContact CG2-CB 3.91Å; P186-P206 HydrophobicContact CB-CB 4.44Å; P186-P206 HydrophobicContact CB-CG 3.85Å; V203-P206 WeakPolarHBondContact O-CD 3.36Å; P206-T210 VanDerWaalsContact O-CB 3.23Å; P206-T210 WeakPolarHBondContact O-CB 3.08Å; P206-T210 PolarHBondContact O-N 2.91Å; P206-T210 VanDerWaalsContact O-N 3.08Å; P206-T210 PolarHBondContact O-OG1 3.39Å
207	T	94.6	Very high	95	Very high	103 Å²	103	53 Å²	53	63%	0.632	28%	0.275	S	S	*	.	H	α-helix	trans	-69.9	-48.4	173.7	43.2	0	0	0	0	112	R205 T210 V211	R205-T207 VanDerWaalsContact C-N 3.32Å; R205-T207 PolarHBondContact O-N 3.37Å; T207-T210 WeakPolarHBondContact O-CB 3.46Å; T207-T210 PolarHBondContact O-N 2.86Å; T207-V211 WeakPolarHBondContact O-CG2 3.2Å; T207-V211 PolarHBondContact O-N 3.42Å
208	E	93.7	Very high	94.9	Very high	71 Å²	71	48.7 Å²	48.7	33%	0.332	26%	0.259	S	S	.	.	H	α-helix	trans	-63	-49.8	179.1	-166.6	174.9	-168.2	0	0	110.9	V44 R205 T210 V211 F212	V44-E208 HydrophobicContact CG1-CB 4.22Å; V44-E208 HydrophobicContact CG1-CG 3.75Å; V44-E208 HydrophobicContact CG2-CG 4.19Å; V44-E208 WeakPolarHBondContact CG2-OE1 3.39Å; R205-E208 HydrophobicContact CB-CB 4.15Å; R205-E208 WeakPolarHBondContact CD-OE2 3.49Å; R205-E208 IonicContact NH1-OE2 3.43Å; R205-E208 PolarHBondContact NH1-OE2 3.15Å; R205-E208 PolarHBondContact O-N 3.25Å; E208-T210 VanDerWaalsContact C-N 3.28Å; E208-T210 PolarHBondContact O-N 2.74Å; E208-V211 WeakPolarHBondContact O-CB 3.35Å; E208-V211 PolarHBondContact O-N 2.94Å; E208-F212 HydrophobicContact CG-CD2 4.3Å; E208-F212 HydrophobicContact CG-CE2 4.09Å; E208-F212 WeakPolarHBondContact O-CD2 3.44Å; E208-F212 PolarHBondContact O-N 3.17Å; E208-F212 VanDerWaalsContact O-N 3.11Å
209	K	94.3	Very high	94.6	Very high	4 Å²	4	44.8 Å²	44.8	2%	0.017	24%	0.235	C	C	.	.	H	α-helix	trans	-55.6	-42.4	173.3	-68.2	172.6	-178.9	158.7	0	111.4	V44 W45 I184 S204 R205 F212 I213	V44-K209 HydrophobicContact CG1-CG 3.78Å; V44-K209 WeakPolarHBondContact O-CE 3.04Å; W45-K209 HydrophobicContact CD2-CG 4.22Å; W45-K209 HydrophobicContact CH2-CB 3.97Å; W45-K209 HydrophobicContact CH2-CG 4.03Å; W45-K209 HydrophobicContact CZ2-CB 3.62Å; W45-K209 HydrophobicContact CZ2-CD 4.36Å; W45-K209 HydrophobicContact CZ2-CG 3.62Å; W45-K209 HydrophobicContact CZ3-CG 4.49Å; I184-K209 HydrophobicContact CD1-CB 3.94Å; I184-K209 HydrophobicContact CD1-CD 4.45Å; S204-K209 WeakPolarHBondContact O-CD 3.45Å; S204-K209 WeakPolarHBondContact O-CE 3.46Å; S204-K209 PolarHBondContact O-NZ 3.36Å; S204-K209 PolarHBondContact OG-NZ 2.98Å; R205-K209 HydrophobicContact CB-CD 4.47Å; R205-K209 HydrophobicContact CB-CG 4.41Å; R205-K209 WeakPolarHBondContact O-CB 3.38Å; R205-K209 VanDerWaalsContact O-CG 3.3Å; R205-K209 WeakPolarHBondContact O-CG 3.48Å; R205-K209 PolarHBondContact O-N 3.08Å; K209-F212 PolarHBondContact O-N 3.24Å; K209-I213 WeakPolarHBondContact O-CD1 3.25Å; K209-I213 WeakPolarHBondContact O-CG1 3.22Å; K209-I213 PolarHBondContact O-N 3.05Å
210	T	94.7	Very high	94.4	Very high	12 Å²	12	44.4 Å²	44.4	7%	0.074	23%	0.233	C	C	.	.	H	α-helix	trans	-62.1	-41.2	174.7	-66.2	0	0	0	0	112.9	R183 I184 P206 T207 E208 I213 I214	R183-T210 HydrophobicContact CB-CG2 4.1Å; R183-T210 HydrophobicContact CG-CG2 3.94Å; I184-T210 PolarHBondContact N-OG1 3.3Å; P206-T210 VanDerWaalsContact O-CB 3.23Å; P206-T210 WeakPolarHBondContact O-CB 3.08Å; P206-T210 PolarHBondContact O-N 2.91Å; P206-T210 VanDerWaalsContact O-N 3.08Å; P206-T210 PolarHBondContact O-OG1 3.39Å; T207-T210 WeakPolarHBondContact O-CB 3.46Å; T207-T210 PolarHBondContact O-N 2.86Å; E208-T210 VanDerWaalsContact C-N 3.28Å; E208-T210 PolarHBondContact O-N 2.74Å; T210-I213 PolarHBondContact O-N 3.43Å; T210-I214 HydrophobicContact CG2-CD1 3.75Å; T210-I214 HydrophobicContact CG2-CG1 4.34Å; T210-I214 WeakPolarHBondContact O-CG1 3.26Å; T210-I214 PolarHBondContact O-N 2.82Å
211	V	94.2	Very high	94.2	Very high	94 Å²	94	45 Å²	45	57%	0.57	24%	0.241	S	C	*	.	H	α-helix	trans	-60.2	-47.7	176.4	169.4	0	0	0	0	110.5	T207 E208 I213 I214 F215	T207-V211 WeakPolarHBondContact O-CG2 3.2Å; T207-V211 PolarHBondContact O-N 3.42Å; E208-V211 WeakPolarHBondContact O-CB 3.35Å; E208-V211 PolarHBondContact O-N 2.94Å; V211-I213 PolarHBondContact O-N 3.09Å; V211-I214 PolarHBondContact O-N 3Å; V211-F215 WeakPolarHBondContact O-CB 3.32Å; V211-F215 PolarHBondContact O-N 3.34Å
212	F	93.3	Very high	93.9	Very high	49 Å²	49	48 Å²	48	22%	0.215	26%	0.258	C	S	.	.	H	α-helix	trans	-65	-34.9	176.8	-78.4	-76.4	0	0	0	113.2	I36 A40 V44 W45 W78 E208 K209 F215 M216	I36-F212 HydrophobicContact CG2-CD1 3.93Å; I36-F212 HydrophobicContact CG2-CE1 4.22Å; A40-F212 HydrophobicContact CB-CD1 3.88Å; A40-F212 HydrophobicContact CB-CE1 3.73Å; A40-F212 HydrophobicContact CB-CE2 4.43Å; A40-F212 HydrophobicContact CB-CG 4.3Å; A40-F212 HydrophobicContact CB-CZ 4.02Å; V44-F212 HydrophobicContact CG1-CD2 4.22Å; V44-F212 HydrophobicContact CG1-CE2 4.48Å; V44-F212 HydrophobicContact CG2-CD2 4.27Å; V44-F212 HydrophobicContact CG2-CE2 3.77Å; V44-F212 HydrophobicContact CG2-CZ 4.43Å; W45-F212 HydrophobicContact CH2-CB 3.71Å; W45-F212 HydrophobicContact CZ3-CB 3.84Å; W45-F212 HydrophobicContact CZ3-CD2 4.33Å; W45-F212 HydrophobicContact CZ3-CG 4.19Å; W78-F212 HydrophobicContact CH2-CB 4.13Å; E208-F212 HydrophobicContact CG-CD2 4.3Å; E208-F212 HydrophobicContact CG-CE2 4.09Å; E208-F212 WeakPolarHBondContact O-CD2 3.44Å; E208-F212 PolarHBondContact O-N 3.17Å; E208-F212 VanDerWaalsContact O-N 3.11Å; K209-F212 PolarHBondContact O-N 3.24Å; F212-F215 WeakPolarHBondContact O-CB 3.44Å; F212-F215 PolarHBondContact O-N 2.93Å; F212-M216 WeakPolarHBondContact O-CB 3.48Å; F212-M216 WeakPolarHBondContact O-CG 3.26Å; F212-M216 PolarHBondContact O-N 3.16Å
213	I	93.7	Very high	93.6	Very high	5 Å²	5	43.3 Å²	43.3	3%	0.026	24%	0.239	C	C	.	.	H	α-helix	trans	-63.1	-50.1	173.5	-70.6	160.1	0	0	0	111.4	H74 W78 I184 K209 T210 V211 F215 M216 L217	H74-I213 WeakPolarHBondContact NE2-CD1 3.33Å; W78-I213 HydrophobicContact CH2-CG1 4.27Å; W78-I213 HydrophobicContact CZ2-CB 4.5Å; W78-I213 HydrophobicContact CZ2-CG1 3.85Å; I184-I213 HydrophobicContact CD1-CD1 3.72Å; I184-I213 HydrophobicContact CG1-CD1 3.86Å; K209-I213 WeakPolarHBondContact O-CD1 3.25Å; K209-I213 WeakPolarHBondContact O-CG1 3.22Å; K209-I213 PolarHBondContact O-N 3.05Å; T210-I213 PolarHBondContact O-N 3.43Å; V211-I213 PolarHBondContact O-N 3.09Å; I213-F215 PolarHBondContact O-N 3.4Å; I213-M216 PolarHBondContact O-N 3.34Å; I213-L217 VanDerWaalsContact O-CB 3.32Å; I213-L217 WeakPolarHBondContact O-CB 3.29Å; I213-L217 PolarHBondContact O-N 2.03Å
214	I	94.3	Very high	93.4	Very high	93 Å²	93	44.3 Å²	44.3	48%	0.477	24%	0.244	S	C	.	.	H	α-helix	trans	-60.4	-37.7	176.3	-67.5	168.9	0	0	0	110.3	T210 V211 A218	T210-I214 HydrophobicContact CG2-CD1 3.75Å; T210-I214 HydrophobicContact CG2-CG1 4.34Å; T210-I214 WeakPolarHBondContact O-CG1 3.26Å; T210-I214 PolarHBondContact O-N 2.82Å; V211-I214 PolarHBondContact O-N 3Å; I214-A218 WeakPolarHBondContact O-CB 3.4Å; I214-A218 PolarHBondContact O-N 2.91Å
215	F	92.4	Very high	93.2	Very high	86 Å²	86	49.9 Å²	49.9	38%	0.377	27%	0.266	S	S	.	.	H	α-helix	trans	-65.4	-50.5	178.3	-159.7	-77.7	0	0	0	112.6	F32 I36 V211 F212 I213 L217 A218 V219	F32-F215 HydrophobicContact CD1-CE1 4.18Å; F32-F215 AromaticContact CE1-CE1 3.35Å; F32-F215 HydrophobicContact CE1-CE1 3.35Å; F32-F215 AromaticContact CE1-CZ 3.44Å; F32-F215 HydrophobicContact CE1-CZ 3.44Å; F32-F215 VanDerWaalsContact CE1-CZ 3.44Å; F32-F215 AromaticContact CZ-CE1 3.61Å; F32-F215 HydrophobicContact CZ-CE1 3.61Å; F32-F215 AromaticContact CZ-CZ 3.45Å; F32-F215 HydrophobicContact CZ-CZ 3.45Å; F32-F215 VanDerWaalsContact CZ-CZ 3.45Å; I36-F215 HydrophobicContact CD1-CD1 3.55Å; I36-F215 HydrophobicContact CD1-CE1 3.4Å; I36-F215 HydrophobicContact CD1-CZ 4.43Å; V211-F215 WeakPolarHBondContact O-CB 3.32Å; V211-F215 PolarHBondContact O-N 3.34Å; F212-F215 WeakPolarHBondContact O-CB 3.44Å; F212-F215 PolarHBondContact O-N 2.93Å; I213-F215 PolarHBondContact O-N 3.4Å; F215-L217 VanDerWaalsContact C-N 3.29Å; F215-L217 PolarHBondContact O-N 2.96Å; F215-A218 WeakPolarHBondContact O-CB 3.43Å; F215-A218 PolarHBondContact O-N 3.41Å; F215-A218 VanDerWaalsContact O-N 3.16Å; F215-V219 HydrophobicContact CD1-CG2 3.99Å; F215-V219 HydrophobicContact CE1-CG2 3.7Å; F215-V219 WeakPolarHBondContact O-CG2 3.23Å; F215-V219 PolarHBondContact O-N 3.35Å
216	M	92	Very high	93	Very high	5 Å²	5	45.9 Å²	45.9	3%	0.025	25%	0.253	C	S	.	.	H	α-helix	trans	-64.5	-34.9	178.6	-72.5	-68.6	-81.3	0	0	111.9	R33 I36 L37 W78 F212 I213 A220	R33-M216 HydrophobicContact CB-CE 4.41Å; R33-M216 HydrophobicContact CG-CE 4.09Å; R33-M216 HydrophobicContact CG-SD 4.19Å; I36-M216 HydrophobicContact CB-SD 4.45Å; I36-M216 HydrophobicContact CG2-CG 4.44Å; I36-M216 HydrophobicContact CG2-SD 4Å; L37-M216 HydrophobicContact CD1-CE 3.6Å; W78-M216 HydrophobicContact CB-CE 3.87Å; W78-M216 HydrophobicContact CD2-CB 4.47Å; W78-M216 HydrophobicContact CD2-CE 3.8Å; W78-M216 HydrophobicContact CD2-CG 4.06Å; W78-M216 HydrophobicContact CE3-CE 3.98Å; W78-M216 HydrophobicContact CE3-CG 4.05Å; W78-M216 HydrophobicContact CG-CE 3.75Å; W78-M216 HydrophobicContact CH2-CG 3.97Å; W78-M216 HydrophobicContact CZ2-CB 4.07Å; W78-M216 HydrophobicContact CZ2-CG 3.99Å; W78-M216 HydrophobicContact CZ3-CG 4.01Å; F212-M216 WeakPolarHBondContact O-CB 3.48Å; F212-M216 WeakPolarHBondContact O-CG 3.26Å; F212-M216 PolarHBondContact O-N 3.16Å; I213-M216 PolarHBondContact O-N 3.34Å; M216-A220 PolarHBondContact O-N 3.32Å
217	L	93.7	Very high	92.7	Very high	41 Å²	41	44.8 Å²	44.8	22%	0.215	25%	0.245	C	C	.	.	H	α-helix	trans	-62.2	-46.7	170.2	177.6	66.1	0	0	0	111.9	V173 F182 I213 F215 V219 A220 C221	V173-L217 HydrophobicContact CG1-CD1 3.72Å; V173-L217 HydrophobicContact CG2-CD1 4.29Å; F182-L217 HydrophobicContact CD1-CD2 3.53Å; F182-L217 HydrophobicContact CE1-CD1 4.15Å; F182-L217 HydrophobicContact CE1-CD2 3.6Å; F182-L217 HydrophobicContact CG-CD2 4.28Å; F182-L217 HydrophobicContact CZ-CD2 4.4Å; I213-L217 VanDerWaalsContact O-CB 3.32Å; I213-L217 WeakPolarHBondContact O-CB 3.29Å; I213-L217 PolarHBondContact O-N 2.03Å; F215-L217 VanDerWaalsContact C-N 3.29Å; F215-L217 PolarHBondContact O-N 2.96Å; L217-V219 VanDerWaalsContact C-N 3.34Å; L217-V219 PolarHBondContact O-N 3.38Å; L217-A220 WeakPolarHBondContact O-CA 3.06Å; L217-A220 WeakPolarHBondContact O-CB 3.14Å; L217-A220 PolarHBondContact O-N 3.35Å; L217-A220 VanDerWaalsContact O-N 3.09Å; L217-C221 PolarHBondContact O-N 2.03Å; L217-C221 PolarHBondContact O-SG 3.35Å; L217-C221 VanDerWaalsContact O-SG 3.4Å
218	A	93.8	Very high	92.4	Very high	52 Å²	52	46.1 Å²	46.1	43%	0.43	24%	0.243	S	C	.	.	H	α-helix	trans	-60.4	-43.8	177.8	0	0	0	0	0	111.6	I214 F215 A220 C221 V222	I214-A218 WeakPolarHBondContact O-CB 3.4Å; I214-A218 PolarHBondContact O-N 2.91Å; F215-A218 WeakPolarHBondContact O-CB 3.43Å; F215-A218 PolarHBondContact O-N 3.41Å; F215-A218 VanDerWaalsContact O-N 3.16Å; A218-A220 VanDerWaalsContact C-N 3.29Å; A218-A220 PolarHBondContact O-N 3.02Å; A218-C221 PolarHBondContact O-N 3.18Å; A218-V222 WeakPolarHBondContact O-CG2 3.32Å; A218-V222 PolarHBondContact O-N 2.91Å
219	V	92.3	Very high	92.1	Very high	8 Å²	8	45.6 Å²	45.6	5%	0.048	24%	0.244	C	C	.	.	H	α-helix	trans	-61.1	-36.7	173.8	174.1	0	0	0	0	111.6	L29 F32 R33 F215 L217 S223	L29-V219 HydrophobicContact CB-CG1 4.25Å; L29-V219 HydrophobicContact CD2-CG1 4.06Å; F32-V219 HydrophobicContact CD1-CG2 4.26Å; F32-V219 HydrophobicContact CE1-CG2 4.43Å; R33-V219 HydrophobicContact CG-CG1 3.87Å; F215-V219 HydrophobicContact CD1-CG2 3.99Å; F215-V219 HydrophobicContact CE1-CG2 3.7Å; F215-V219 WeakPolarHBondContact O-CG2 3.23Å; F215-V219 PolarHBondContact O-N 3.35Å; L217-V219 VanDerWaalsContact C-N 3.34Å; L217-V219 PolarHBondContact O-N 3.38Å; V219-S223 WeakPolarHBondContact O-CB 3.37Å; V219-S223 PolarHBondContact O-N 3.45Å
220	A	92.6	Very high	91.7	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.008	25%	0.245	C	C	.	.	H	α-helix	trans	-67.4	-43.6	173.6	0	0	0	0	0	113	R33 V173 M216 L217 A218 V222 S223 L224	R33-A220 VanDerWaalsContact NH2-CB 3.3Å; V173-A220 HydrophobicContact CG2-CB 3.57Å; M216-A220 PolarHBondContact O-N 3.32Å; L217-A220 WeakPolarHBondContact O-CA 3.06Å; L217-A220 WeakPolarHBondContact O-CB 3.14Å; L217-A220 PolarHBondContact O-N 3.35Å; L217-A220 VanDerWaalsContact O-N 3.09Å; A218-A220 VanDerWaalsContact C-N 3.29Å; A218-A220 PolarHBondContact O-N 3.02Å; A220-V222 VanDerWaalsContact C-N 3.33Å; A220-V222 PolarHBondContact O-N 3.29Å; A220-S223 WeakPolarHBondContact O-CB 3.48Å; A220-S223 PolarHBondContact O-N 3.47Å; A220-L224 WeakPolarHBondContact O-CG 3.4Å; A220-L224 PolarHBondContact O-N 3.4Å
221	C	93.6	Very high	91.1	Very high	66 Å²	66	48 Å²	48	45%	0.446	26%	0.256	S	S	.	.	H	α-helix	trans	-61.1	-40.4	175.5	-68.9	0	0	0	0	112.1	L217 A218 L224 F225	L217-C221 PolarHBondContact O-N 2.03Å; L217-C221 PolarHBondContact O-SG 3.35Å; L217-C221 VanDerWaalsContact O-SG 3.4Å; A218-C221 PolarHBondContact O-N 3.18Å; C221-L224 PolarHBondContact O-N 3.28Å; C221-F225 WeakPolarHBondContact O-CB 3.39Å; C221-F225 PolarHBondContact O-N 3.1Å
222	V	92.3	Very high	90.7	Very high	61 Å²	61	45.4 Å²	45.4	37%	0.37	24%	0.242	S	C	.	.	H	α-helix	trans	-68.7	-41.1	174.9	179.6	0	0	0	0	111.4	L29 A218 A220 F225 L226	L29-V222 HydrophobicContact CD1-CB 4.41Å; L29-V222 HydrophobicContact CD1-CG1 3.81Å; L29-V222 HydrophobicContact CD2-CG1 4.4Å; A218-V222 WeakPolarHBondContact O-CG2 3.32Å; A218-V222 PolarHBondContact O-N 2.91Å; A220-V222 VanDerWaalsContact C-N 3.33Å; A220-V222 PolarHBondContact O-N 3.29Å; V222-F225 PolarHBondContact O-N 3.21Å; V222-L226 HydrophobicContact CG1-CD1 3.91Å; V222-L226 HydrophobicContact CG1-CG 4.44Å; V222-L226 WeakPolarHBondContact O-CD1 3.42Å; V222-L226 VanDerWaalsContact O-CG 3.3Å; V222-L226 WeakPolarHBondContact O-CG 3.46Å; V222-L226 PolarHBondContact O-N 2.98Å
223	S	90.2	Very high	90.2	Very high	5 Å²	5	46.7 Å²	46.7	4%	0.035	25%	0.249	C	C	.	.	H	α-helix	trans	-55.2	-51.6	171.8	176.6	0	0	0	0	111.3	E169 V219 A220 F225 L226 N227	E169-S223 VanDerWaalsContact OE2-CB 3.31Å; E169-S223 WeakPolarHBondContact OE2-CB 3.39Å; E169-S223 PolarHBondContact OE2-OG 2.91Å; V219-S223 WeakPolarHBondContact O-CB 3.37Å; V219-S223 PolarHBondContact O-N 3.45Å; A220-S223 WeakPolarHBondContact O-CB 3.48Å; A220-S223 PolarHBondContact O-N 3.47Å; S223-F225 PolarHBondContact O-N 3.44Å; S223-L226 PolarHBondContact O-N 2.94Å; S223-N227 VanDerWaalsContact O-CG 3.26Å; S223-N227 PolarHBondContact O-N 3.42Å; S223-N227 PolarHBondContact O-ND2 3.12Å; S223-N227 PolarHBondContact OG-ND2 2.93Å
224	L	91.8	Very high	89.5	Confident	35 Å²	35	47.9 Å²	47.9	18%	0.183	26%	0.255	C	S	.	.	H	α-helix	trans	-58.1	-46.2	177.2	-72.5	173.4	0	0	0	112.5	T166 E169 V170 A220 C221 L226 N227 F228	T166-L224 HydrophobicContact CG2-CD2 3.93Å; E169-L224 HydrophobicContact CB-CD2 3.69Å; E169-L224 HydrophobicContact CB-CG 4.33Å; E169-L224 HydrophobicContact CG-CD1 4.39Å; E169-L224 HydrophobicContact CG-CD2 3.58Å; E169-L224 HydrophobicContact CG-CG 3.66Å; V170-L224 HydrophobicContact CG2-CD1 4.02Å; V170-L224 HydrophobicContact CG2-CD2 3.63Å; A220-L224 WeakPolarHBondContact O-CG 3.4Å; A220-L224 PolarHBondContact O-N 3.4Å; C221-L224 PolarHBondContact O-N 3.28Å; L224-L226 PolarHBondContact O-N 3.3Å; L224-N227 PolarHBondContact O-N 3.48Å; L224-F228 WeakPolarHBondContact O-CB 3.43Å; L224-F228 PolarHBondContact O-N 3.45Å
225	F	91.3	Very high	88.8	Confident	129 Å²	129	44.8 Å²	44.8	57%	0.566	25%	0.246	S	C	*	.	H	α-helix	trans	-59.9	-44.2	177.3	177.7	-104	0	0	0	112.1	C221 V222 S223 F228 V229	C221-F225 WeakPolarHBondContact O-CB 3.39Å; C221-F225 PolarHBondContact O-N 3.1Å; V222-F225 PolarHBondContact O-N 3.21Å; S223-F225 PolarHBondContact O-N 3.44Å; F225-F228 PolarHBondContact O-N 3.35Å; F225-V229 HydrophobicContact CD1-CG2 4.25Å; F225-V229 HydrophobicContact CD2-CG2 4.36Å; F225-V229 HydrophobicContact CE1-CG2 3.83Å; F225-V229 HydrophobicContact CE2-CG2 3.95Å; F225-V229 HydrophobicContact CG-CG2 4.5Å; F225-V229 HydrophobicContact CZ-CG2 3.67Å; F225-V229 WeakPolarHBondContact O-CB 3.33Å; F225-V229 WeakPolarHBondContact O-CG2 3.5Å; F225-V229 PolarHBondContact O-N 2.84Å
226	L	88.8	Confident	88.2	Confident	20 Å²	20	45.8 Å²	45.8	11%	0.105	26%	0.255	C	S	.	.	H	α-helix	trans	-65.9	-43.8	178.2	-70.6	163.9	0	0	0	112.4	W25 L26 L29 V222 S223 L224 F228 V229 E230	W25-L226 HydrophobicContact CB-CD1 3.54Å; W25-L226 HydrophobicContact CB-CD2 4.17Å; W25-L226 HydrophobicContact CG-CD1 4.32Å; W25-L226 HydrophobicContact CG-CD2 4.41Å; L26-L226 HydrophobicContact CD2-CB 4.19Å; L26-L226 HydrophobicContact CD2-CD1 4.48Å; L26-L226 HydrophobicContact CG-CB 4.5Å; L29-L226 HydrophobicContact CD1-CD1 3.45Å; L29-L226 VanDerWaalsContact CD1-CD1 3.45Å; V222-L226 HydrophobicContact CG1-CD1 3.91Å; V222-L226 HydrophobicContact CG1-CG 4.44Å; V222-L226 WeakPolarHBondContact O-CD1 3.42Å; V222-L226 VanDerWaalsContact O-CG 3.3Å; V222-L226 WeakPolarHBondContact O-CG 3.46Å; V222-L226 PolarHBondContact O-N 2.98Å; S223-L226 PolarHBondContact O-N 2.94Å; L224-L226 PolarHBondContact O-N 3.3Å; L226-F228 VanDerWaalsContact C-N 3.29Å; L226-F228 PolarHBondContact O-N 3.3Å; L226-V229 PolarHBondContact O-N 3.18Å; L226-E230 WeakPolarHBondContact O-CB 3.36Å; L226-E230 PolarHBondContact O-N 2.9Å
227	N	88.6	Confident	87.3	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-58.8	-41.9	174	-66.9	-47.2	0	0	0	110.9	L26 I162 S223 L224 E230 I231	L26-N227 WeakPolarHBondContact CD1-OD1 3.23Å; I162-N227 HydrophobicContact CG2-CB 3.87Å; S223-N227 VanDerWaalsContact O-CG 3.26Å; S223-N227 PolarHBondContact O-N 3.42Å; S223-N227 PolarHBondContact O-ND2 3.12Å; S223-N227 PolarHBondContact OG-ND2 2.93Å; L224-N227 PolarHBondContact O-N 3.48Å; N227-E230 PolarHBondContact O-N 2.88Å; N227-I231 WeakPolarHBondContact O-CG1 3.36Å; N227-I231 PolarHBondContact O-N 2.86Å
228	F	88.4	Confident	86.3	Confident	130 Å²	130	54.9 Å²	54.9	57%	0.57	29%	0.292	S	S	*	.	H	α-helix	trans	-67.3	-41.9	176.5	177.8	-96	0	0	0	113.1	L224 F225 L226 E230 I231 S232	L224-F228 WeakPolarHBondContact O-CB 3.43Å; L224-F228 PolarHBondContact O-N 3.45Å; F225-F228 PolarHBondContact O-N 3.35Å; L226-F228 VanDerWaalsContact C-N 3.29Å; L226-F228 PolarHBondContact O-N 3.3Å; F228-E230 VanDerWaalsContact C-N 3.32Å; F228-E230 PolarHBondContact O-N 3.35Å; F228-I231 PolarHBondContact O-N 2.82Å; F228-S232 VanDerWaalsContact O-CB 3.29Å; F228-S232 WeakPolarHBondContact O-CB 3.3Å; F228-S232 PolarHBondContact O-N 2.7Å; F228-S232 PolarHBondContact O-OG 3.38Å
229	V	87.8	Confident	85	Confident	61 Å²	61	56.8 Å²	56.8	37%	0.37	29%	0.294	S	S	.	.	H	α-helix	trans	-63.4	-38.5	175.3	167.1	0	0	0	0	110.9	F225 L226 S232 H233	F225-V229 HydrophobicContact CD1-CG2 4.25Å; F225-V229 HydrophobicContact CD2-CG2 4.36Å; F225-V229 HydrophobicContact CE1-CG2 3.83Å; F225-V229 HydrophobicContact CE2-CG2 3.95Å; F225-V229 HydrophobicContact CG-CG2 4.5Å; F225-V229 HydrophobicContact CZ-CG2 3.67Å; F225-V229 WeakPolarHBondContact O-CB 3.33Å; F225-V229 WeakPolarHBondContact O-CG2 3.5Å; F225-V229 PolarHBondContact O-N 2.84Å; L226-V229 PolarHBondContact O-N 3.18Å; V229-S232 PolarHBondContact O-N 3.08Å; V229-H233 VanDerWaalsContact O-CB 3.31Å; V229-H233 WeakPolarHBondContact O-CB 3.1Å; V229-H233 PolarHBondContact O-N 2.95Å
230	E	85.3	Confident	84	Confident	6 Å²	6	63.9 Å²	63.9	3%	0.028	32%	0.32	C	S	.	.	H	α-helix	trans	-67.4	-48.4	176.4	-176.3	152.7	-135.4	0	0	112.2	S18 T19 Y158 I162 L226 N227 F228 S232 H233 L234	S18-E230 PolarHBondContact OG-OE1 3.28Å; T19-E230 WeakPolarHBondContact CB-OE1 3.38Å; T19-E230 HydrophobicContact CG2-CG 4.47Å; T19-E230 WeakPolarHBondContact CG2-OE1 2.8Å; T19-E230 PolarHBondContact N-OE1 3.31Å; T19-E230 PolarHBondContact OG1-OE1 2.68Å; Y158-E230 PolarHBondContact OH-OE1 3.39Å; Y158-E230 PolarHBondContact OH-OE2 3.05Å; I162-E230 HydrophobicContact CD1-CG 4.05Å; L226-E230 WeakPolarHBondContact O-CB 3.36Å; L226-E230 PolarHBondContact O-N 2.9Å; N227-E230 PolarHBondContact O-N 2.88Å; F228-E230 VanDerWaalsContact C-N 3.32Å; F228-E230 PolarHBondContact O-N 3.35Å; E230-S232 VanDerWaalsContact C-N 3.29Å; E230-S232 PolarHBondContact O-N 3.25Å; E230-H233 PolarHBondContact O-N 3.46Å; E230-L234 HydrophobicContact CG-CD1 4.02Å; E230-L234 WeakPolarHBondContact O-CD1 3.41Å; E230-L234 VanDerWaalsContact O-CG 3.23Å; E230-L234 WeakPolarHBondContact O-CG 3.07Å; E230-L234 PolarHBondContact O-N 3.1Å
231	I	83.6	Confident	82.6	Confident	61 Å²	61	72.3 Å²	72.3	31%	0.313	36%	0.357	S	S	.	.	H	α-helix	trans	-53.6	-47.4	171.2	-71.5	168	0	0	0	110.7	I162 N227 F228 H233 L234 G235	I162-I231 HydrophobicContact CB-CD1 4.27Å; I162-I231 HydrophobicContact CB-CG1 4.23Å; I162-I231 HydrophobicContact CD1-CG1 4.45Å; I162-I231 HydrophobicContact CG2-CD1 3.73Å; I162-I231 HydrophobicContact CG2-CG1 3.81Å; N227-I231 WeakPolarHBondContact O-CG1 3.36Å; N227-I231 PolarHBondContact O-N 2.86Å; F228-I231 PolarHBondContact O-N 2.82Å; I231-H233 PolarHBondContact O-N 3.28Å; I231-L234 PolarHBondContact O-N 2.87Å; I231-G235 PolarHBondContact O-N 3.35Å
232	S	84.2	Confident	81.3	Confident	39 Å²	39	74.2 Å²	74.2	27%	0.273	37%	0.366	S	S	.	.	H	α-helix	trans	-60.9	-44.3	179.4	-60.9	0	0	0	0	112.1	F228 V229 E230 L234 G235 L236	F228-S232 VanDerWaalsContact O-CB 3.29Å; F228-S232 WeakPolarHBondContact O-CB 3.3Å; F228-S232 PolarHBondContact O-N 2.7Å; F228-S232 PolarHBondContact O-OG 3.38Å; V229-S232 PolarHBondContact O-N 3.08Å; E230-S232 VanDerWaalsContact C-N 3.29Å; E230-S232 PolarHBondContact O-N 3.25Å; S232-L234 PolarHBondContact O-N 3.3Å; S232-G235 PolarHBondContact O-N 2.94Å; S232-L236 WeakPolarHBondContact O-CB 3.39Å; S232-L236 VanDerWaalsContact O-CG 3.23Å; S232-L236 WeakPolarHBondContact O-CG 3.36Å; S232-L236 PolarHBondContact O-N 3.38Å
233	H	83.1	Confident	80.1	Confident	76 Å²	76	79.7 Å²	79.7	35%	0.352	39%	0.385	S	S	.	.	H	α-helix	trans	-64.6	-37.1	178.2	174.5	-148.8	0	0	0	112.8	V229 E230 I231 K237	V229-H233 VanDerWaalsContact O-CB 3.31Å; V229-H233 WeakPolarHBondContact O-CB 3.1Å; V229-H233 PolarHBondContact O-N 2.95Å; E230-H233 PolarHBondContact O-N 3.46Å; I231-H233 PolarHBondContact O-N 3.28Å; H233-K237 PolarHBondContact CE1-NZ 2.94Å; H233-K237 VanDerWaalsContact CE1-NZ 3.26Å; H233-K237 WeakPolarHBondContact NE2-CE 3.48Å; H233-K237 PolarHBondContact NE2-NZ 3.19Å; H233-K237 WeakPolarHBondContact O-CG 3.46Å; H233-K237 PolarHBondContact O-N 2.92Å
234	L	79.9	Confident	78.8	Confident	29 Å²	29	89.4 Å²	89.4	15%	0.152	42%	0.421	C	S	.	.	H	α-helix	trans	-69.2	-46.1	174.2	-64.2	161.4	0	0	0	111.2	Y158 I162 E230 I231 S232 K237 K238	Y158-L234 HydrophobicContact CD1-CD1 4.13Å; Y158-L234 HydrophobicContact CE1-CD1 3.66Å; Y158-L234 HydrophobicContact CE1-CD2 4.22Å; I162-L234 HydrophobicContact CD1-CD1 4.04Å; E230-L234 HydrophobicContact CG-CD1 4.02Å; E230-L234 WeakPolarHBondContact O-CD1 3.41Å; E230-L234 VanDerWaalsContact O-CG 3.23Å; E230-L234 WeakPolarHBondContact O-CG 3.07Å; E230-L234 PolarHBondContact O-N 3.1Å; I231-L234 PolarHBondContact O-N 2.87Å; S232-L234 PolarHBondContact O-N 3.3Å; L234-K237 WeakPolarHBondContact O-CB 3.38Å; L234-K237 PolarHBondContact O-N 3.05Å; L234-K238 PolarHBondContact O-N 2.85Å
235	G	79.6	Confident	76.8	Confident	29 Å²	29	96.3 Å²	96.3	30%	0.299	45%	0.45	S	S	.	.	H	α-helix	trans	-59.1	-50.4	176.6	0	0	0	0	0	112.3	I231 S232 K237 K238 I239	I231-G235 PolarHBondContact O-N 3.35Å; S232-G235 PolarHBondContact O-N 2.94Å; G235-K237 PolarHBondContact O-N 3.11Å; G235-K238 WeakPolarHBondContact O-CB 3.24Å; G235-K238 PolarHBondContact O-N 2.83Å; G235-K238 VanDerWaalsContact O-N 3.11Å; G235-I239 WeakPolarHBondContact O-CB 3.35Å; G235-I239 VanDerWaalsContact O-CG1 3.29Å; G235-I239 WeakPolarHBondContact O-CG1 3.38Å; G235-I239 PolarHBondContact O-N 3.46Å
236	L	79.3	Confident	75	Confident	106 Å²	106	95.9 Å²	95.9	56%	0.555	46%	0.46	S	S	*	.	H	α-helix	trans	-62.3	-26.7	177.5	-71	169.4	0	0	0	113.2	S232 R240	S232-L236 WeakPolarHBondContact O-CB 3.39Å; S232-L236 VanDerWaalsContact O-CG 3.23Å; S232-L236 WeakPolarHBondContact O-CG 3.36Å; S232-L236 PolarHBondContact O-N 3.38Å; L236-R240 WeakPolarHBondContact O-CB 3.36Å; L236-R240 PolarHBondContact O-N 3.22Å
237	K	74.1	Confident	73.4	Confident	106 Å²	106	99.1 Å²	99.1	46%	0.461	49%	0.49	S	S	.	.	H	α-helix	trans	-72	-48.4	170.2	-82.4	171.6	169.7	166.1	0	111.7	H233 L234 G235 F241	H233-K237 PolarHBondContact CE1-NZ 2.94Å; H233-K237 VanDerWaalsContact CE1-NZ 3.26Å; H233-K237 WeakPolarHBondContact NE2-CE 3.48Å; H233-K237 PolarHBondContact NE2-NZ 3.19Å; H233-K237 WeakPolarHBondContact O-CG 3.46Å; H233-K237 PolarHBondContact O-N 2.92Å; L234-K237 WeakPolarHBondContact O-CB 3.38Å; L234-K237 PolarHBondContact O-N 3.05Å; G235-K237 PolarHBondContact O-N 3.11Å; K237-F241 PolarHBondContact O-N 3.29Å; K237-F241 VanDerWaalsContact O-N 3.11Å
238	K	72.6	Confident	71.6	Confident	132 Å²	132	105 Å²	105	57%	0.574	53%	0.528	S	S	*	.	H	α-helix	trans	-57.5	-53.1	175.2	-91.8	-87.1	-172.1	169.4	0	111.9	L234 G235 R240 F241 V242	L234-K238 PolarHBondContact O-N 2.85Å; G235-K238 WeakPolarHBondContact O-CB 3.24Å; G235-K238 PolarHBondContact O-N 2.83Å; G235-K238 VanDerWaalsContact O-N 3.11Å; K238-R240 PolarHBondContact O-N 2.04Å; K238-F241 WeakPolarHBondContact O-CB 3.48Å; K238-F241 PolarHBondContact O-N 3.05Å; K238-F241 VanDerWaalsContact O-N 3.11Å; K238-V242 PolarHBondContact O-N 3.24Å; K238-V242 VanDerWaalsContact O-N 3.13Å
239	I	66.9	Low	70.1	Confident	92 Å²	92	103.1 Å²	103.1	47%	0.472	54%	0.536	S	S	.	.	H	α-helix	trans	-60	-49.2	-177.4	-68.8	166.3	0	0	0	110.6	G235 F241 V242 F243	G235-I239 WeakPolarHBondContact O-CB 3.35Å; G235-I239 VanDerWaalsContact O-CG1 3.29Å; G235-I239 WeakPolarHBondContact O-CG1 3.38Å; G235-I239 PolarHBondContact O-N 3.46Å; I239-F241 PolarHBondContact O-N 3.22Å; I239-V242 PolarHBondContact O-N 2.8Å; I239-V242 VanDerWaalsContact O-N 3.09Å; I239-F243 HydrophobicContact CG2-CD2 3.67Å; I239-F243 HydrophobicContact CG2-CE2 3.76Å; I239-F243 WeakPolarHBondContact O-CD2 3.48Å; I239-F243 PolarHBondContact O-N 2.7Å
240	R	71	Confident	68.3	Low	157 Å²	157	105.9 Å²	105.9	59%	0.592	56%	0.556	S	S	*	*	H	α-helix	trans	-62.7	-26.9	176.9	178.9	164.6	42.6	163.1	-6.8	113.3	L236 K238 R244	L236-R240 WeakPolarHBondContact O-CB 3.36Å; L236-R240 PolarHBondContact O-N 3.22Å; K238-R240 PolarHBondContact O-N 2.04Å; R240-R244 VanDerWaalsContact O-CB 3.25Å; R240-R244 WeakPolarHBondContact O-CB 3.47Å; R240-R244 PolarHBondContact O-N 2.92Å
241	F	61.7	Low	66.2	Low	177 Å²	177	110.3 Å²	110.3	78%	0.776	59%	0.593	S	S	*	*	H	α-helix	trans	-74.5	-35.5	174	-155.6	-87	0	0	0	112.1	K237 K238 I239	K237-F241 PolarHBondContact O-N 3.29Å; K237-F241 VanDerWaalsContact O-N 3.11Å; K238-F241 WeakPolarHBondContact O-CB 3.48Å; K238-F241 PolarHBondContact O-N 3.05Å; K238-F241 VanDerWaalsContact O-N 3.11Å; I239-F241 PolarHBondContact O-N 3.22Å
242	V	67.2	Low	64.2	Low	106 Å²	106	116.8 Å²	116.8	64%	0.642	62%	0.622	S	S	*	*	H	α-helix	trans	-66	-48.7	173.8	175.6	0	0	0	0	111	K238 I239 R244 K245	K238-V242 PolarHBondContact O-N 3.24Å; K238-V242 VanDerWaalsContact O-N 3.13Å; I239-V242 PolarHBondContact O-N 2.8Å; I239-V242 VanDerWaalsContact O-N 3.09Å; V242-R244 PolarHBondContact O-N 2.82Å; V242-K245 PolarHBondContact O-N 2.76Å
243	F	66.4	Low	62	Low	176 Å²	176	118.4 Å²	118.4	77%	0.772	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	-8	179.6	-80.1	-71.5	0	0	0	115	I239	I239-F243 HydrophobicContact CG2-CD2 3.67Å; I239-F243 HydrophobicContact CG2-CE2 3.76Å; I239-F243 WeakPolarHBondContact O-CD2 3.48Å; I239-F243 PolarHBondContact O-N 2.7Å
244	R	63.5	Low	60	Low	209 Å²	209	124.5 Å²	124.5	79%	0.789	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.3	17.6	-179.5	-145.8	179	-159.6	-169.7	5.2	113.9	R240 V242 P246	R240-R244 VanDerWaalsContact O-CB 3.25Å; R240-R244 WeakPolarHBondContact O-CB 3.47Å; R240-R244 PolarHBondContact O-N 2.92Å; V242-R244 PolarHBondContact O-N 2.82Å; R244-P246 WeakPolarHBondContact O-CD 3.32Å
245	K	50.2	Low	57.9	Low	181 Å²	181	126.7 Å²	126.7	79%	0.787	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-57.6	122.9	161.7	-93	-170	171.3	-174.3	0	108.8	V242	V242-K245 PolarHBondContact O-N 2.76Å
246	P	53.5	Low	55.8	Low	120 Å²	120	132.2 Å²	132.2	78%	0.779	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-61.2	149	171.2	-21.1	33.7	0	0	0	110.8	R244	R244-P246 WeakPolarHBondContact O-CD 3.32Å
247	A	55.4	Low	54	Low	87 Å²	87	131.3 Å²	131.3	72%	0.719	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-59.1	146.9	164.9	0	0	0	0	0	109.7	A249	A247-A249 PolarHBondContact O-N 3.37Å
248	P	51	Low	52.6	Low	125 Å²	125	131.9 Å²	131.9	81%	0.812	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-58.8	132.7	172.8	26.3	-33.7	0	0	0	109.3
249	A	56.7	Low	51.5	Low	90 Å²	90	131.4 Å²	131.4	74%	0.744	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-61.5	138.9	174.2	0	0	0	0	0	109.4	A247 A251	A247-A249 PolarHBondContact O-N 3.37Å; A249-A251 PolarHBondContact O-N 3.48Å
250	P	48.8	Very low	50.3	Low	120 Å²	120	134.8 Å²	134.8	78%	0.779	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-60.7	132.2	176.3	26	-33.6	0	0	0	109.6	Q252	P250-Q252 PolarHBondContact O-N 3.49Å
251	A	42.3	Very low	49.1	Very low	99 Å²	99	132.8 Å²	132.8	82%	0.818	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-60.8	136.4	177.4	0	0	0	0	0	110.2	A249 G253	A249-A251 PolarHBondContact O-N 3.48Å; A251-G253 PolarHBondContact O-N 3.29Å; A251-G253 VanDerWaalsContact O-N 3.11Å
252	Q	41.5	Very low	48.4	Very low	197 Å²	197	129.4 Å²	129.4	92%	0.921	79%	0.786	S	S	*	*			trans	-70.9	106.1	171.1	-68.8	-177.5	-6.3	0	0	108.3	P250	P250-Q252 PolarHBondContact O-N 3.49Å
253	G	36.3	Very low	47	Very low	73 Å²	73	133.4 Å²	133.4	75%	0.753	80%	0.797	S	S	*	*			trans	-75.2	127.4	168.6	0	0	0	0	0	110	A251 G255	A251-G253 PolarHBondContact O-N 3.29Å; A251-G253 VanDerWaalsContact O-N 3.11Å; G253-G255 PolarHBondContact O-N 3.46Å
254	E	42.6	Very low	45.3	Very low	204 Å²	204	128.8 Å²	128.8	95%	0.953	80%	0.799	S	S	*	*			trans	-64.8	125	172.1	-66.4	178	92.9	0	0	109.9
255	G	35.2	Very low	43.9	Very low	75 Å²	75	129 Å²	129	77%	0.773	81%	0.806	S	S	*	*			trans	-131	108.1	-177.4	0	0	0	0	0	111.3	G253	G253-G255 PolarHBondContact O-N 3.46Å
256	T	36.5	Very low	42.9	Very low	144 Å²	144	123.9 Å²	123.9	88%	0.883	80%	0.804	S	S	*	*			trans	-74.3	132.3	-172.9	-38.4	0	0	0	0	112.5
257	A	40.4	Very low	41.9	Very low	87 Å²	87	126.6 Å²	126.6	72%	0.719	81%	0.812	S	S	*	*			trans	-86.5	147.4	172.7	0	0	0	0	0	112.3
258	P	45.5	Very low	41.1	Very low	119 Å²	119	127.7 Å²	127.7	77%	0.773	81%	0.814	S	S	*	*				-141.6	-163.4	126.4	42.6	-27.4	0	0	0	111.7
259	P	47.8	Very low	40.7	Very low	121 Å²	121	127.8 Å²	127.8	79%	0.786	82%	0.815	S	S	*	*				-125.6	168.6	-94.2	36.3	-17.6	0	0	0	116.3
260	L	42	Very low	39.8	Very low	163 Å²	163	131 Å²	131	85%	0.853	82%	0.818	S	S	*	*			trans	-81.1	153.7	172	-106.4	96.4	0	0	0	113.3
261	P	46.7	Very low	39	Very low	116 Å²	116	130 Å²	130	75%	0.753	82%	0.82	S	S	*	*				-151.7	-166.9	106	38.9	-19.2	0	0	0	113.7
262	P	47.9	Very low	38.7	Very low	106 Å²	106	131.4 Å²	131.4	69%	0.688	82%	0.818	S	S	*	*				-134.5	163.7	-61.8	40.1	-25.2	0	0	0	115.9
263	Q	37.1	Very low	39.3	Very low	190 Å²	190	127.1 Å²	127.1	89%	0.888	81%	0.808	S	S	*	*			trans	55.5	124.2	148.5	-66.9	-89.4	28.4	0	0	121.6
264	G	30.1	Very low	39.2	Very low	79 Å²	79	128.5 Å²	128.5	81%	0.814	81%	0.812	S	S	*	*			trans	179.8	102.4	166	0	0	0	0	0	116.2
265	K	34.4	Very low	38.8	Very low	212 Å²	212	125.6 Å²	125.6	92%	0.922	80%	0.802	S	S	*	*			trans	-67.7	143.3	-172.7	-58.1	166	-178	172.8	0	114.9
266	G	29.9	Very low	38.8	Very low	74 Å²	74	128.5 Å²	128.5	76%	0.763	80%	0.796	S	S	*	*			trans	-166.6	151.5	165.7	0	0	0	0	0	111.5
267	L	31.5	Very low	38.5	Very low	178 Å²	178	132.2 Å²	132.2	93%	0.932	79%	0.794	S	S	*	*			trans	-104.8	151.8	-170.9	-76.7	89.3	0	0	0	114.7
268	S	38.4	Very low	38.1	Very low	110 Å²	110	132.2 Å²	132.2	77%	0.769	79%	0.794	S	S	*	*			trans	-70.5	165.3	165.2	-39.1	0	0	0	0	112.4
269	P	44.1	Very low	37.5	Very low	127 Å²	127	136.8 Å²	136.8	83%	0.825	80%	0.801	S	S	*	*				-134.5	176.3	89.6	12.9	9.4	0	0	0	113
270	L	36.2	Very low	36.5	Very low	157 Å²	157	134.4 Å²	134.4	82%	0.822	80%	0.799	S	S	*	*			cis	166.1	104.2	-25.4	175.8	85.3	0	0	0	106.4
271	A	32.5	Very low	35.7	Very low	99 Å²	99	136.6 Å²	136.6	82%	0.818	80%	0.797	S	S	*	*			trans	-160.1	118.6	163	0	0	0	0	0	110.4
272	V	37.3	Very low	34.9	Very low	128 Å²	128	139.9 Å²	139.9	78%	0.776	80%	0.8	S	S	*	*			trans	-162.9	158.9	-163	-169.3	0	0	0	0	107.8
273	P	53.9	Low	33.9	Very low	107 Å²	107	140.4 Å²	140.4	70%	0.695	80%	0.796	S	S	*	*			cis	-122.4	-168.4	-41.5	39.1	-24	0	0	0	112.1
274	A	32.5	Very low	33.7	Very low	103 Å²	103	138 Å²	138	85%	0.851	79%	0.789	S	S	*	*			trans	-136.9	151.5	141.9	0	0	0	0	0	109.6
275	L	35.6	Very low	33.7	Very low	143 Å²	143	141.5 Å²	141.5	75%	0.749	78%	0.784	S	S	*	*			trans	-146.3	134.9	-160.4	-165.6	88.2	0	0	0	115.2
276	Q	34.5	Very low	33.4	Very low	135 Å²	135	139.4 Å²	139.4	63%	0.631	78%	0.777	S	S	*	*			trans	78.2	150.6	147.8	-102.6	-178	37.3	0	0	123.5
277	R	29.9	Very low	33.4	Very low	222 Å²	222	142.4 Å²	142.4	84%	0.838	77%	0.771	S	S	*	*			trans	71.1	156.1	154.5	-72.3	174.6	168.5	132.5	-7.2	118.3
278	A	31.3	Very low	33.2	Very low	87 Å²	87	141.5 Å²	141.5	72%	0.719	76%	0.76	S	S	*	*			cis	-166.4	149.7	-26.4	0	0	0	0	0	113.2
279	K	33.4	Very low	33	Very low	216 Å²	216	142.7 Å²	142.7	94%	0.939	76%	0.762	S	S	*	*			trans	15.2	111.2	141.9	-165.7	175.8	-172.1	176	0	118.7
280	G	27	Very low	32.9	Very low	71 Å²	71	141.8 Å²	141.8	73%	0.732	76%	0.756	S	S	*	*			trans	-165.6	146.3	172	0	0	0	0	0	115.7
281	Y	25.5	Very low	33.2	Very low	209 Å²	209	139.7 Å²	139.7	82%	0.82	75%	0.752	S	S	*	*			trans	-98.4	166.5	-159.8	36.4	-99.1	0	0	0	116.9
282	K	29.6	Very low	33.1	Very low	185 Å²	185	140.9 Å²	140.9	80%	0.804	75%	0.749	S	S	*	*			trans	64.2	164.7	151.6	-81.1	-157.7	168.4	-167.8	0	119.2
283	L	27	Very low	32.6	Very low	117 Å²	117	141.1 Å²	141.1	61%	0.613	75%	0.751	S	S	*	*			cis	-178	128	-24.1	171	74.3	0	0	0	110.4
284	L	32.2	Very low	31.5	Very low	139 Å²	139	143.8 Å²	143.8	73%	0.728	75%	0.754	S	S	*	*			trans	58.8	167.6	167.8	-62.8	162.4	0	0	0	115.1
285	E	30.1	Very low	31.3	Very low	153 Å²	153	147 Å²	147	72%	0.715	76%	0.756	S	S	*	*			cis	-141.1	-145.7	1.5	-155.4	132.2	90.1	0	0	110.7
286	E	29.6	Very low	31.1	Very low	168 Å²	168	149.6 Å²	149.6	79%	0.785	76%	0.757	S	S	*	*			trans	-53.4	166.8	179.1	-67.9	177.8	58.9	0	0	115.5
287	E	30	Very low	31.4	Very low	136 Å²	136	149 Å²	149	64%	0.636	77%	0.765	S	S	*	*				-174.3	169.5	52	-151.3	-156.6	44.2	0	0	114.8
288	K	26.5	Very low	31.5	Very low	160 Å²	160	145.6 Å²	145.6	70%	0.696	76%	0.762	S	S	*	*			trans	62.8	128.6	152.1	-93.8	-172.4	-164.2	78.9	0	124.7
289	V	35.1	Very low	31.6	Very low	134 Å²	134	146.2 Å²	146.2	81%	0.812	77%	0.767	S	S	*	*			trans	-73.9	137.6	152.8	166.3	0	0	0	0	110.4
290	P	40.2	Very low	31.5	Very low	108 Å²	108	144.3 Å²	144.3	70%	0.701	76%	0.762	S	S	*	*				-155.1	-176.4	113.4	40.8	-23.1	0	0	0	114.5
291	P	43.6	Very low	31.7	Very low	114 Å²	114	148 Å²	148	74%	0.74	77%	0.77	S	S	*	*			cis	-122.9	177.4	-19	21	2	0	0	0	113.6
292	V	30.5	Very low	31.8	Very low	124 Å²	124	141.7 Å²	141.7	75%	0.752	77%	0.768	S	S	*	*			trans	-90.7	145.2	166.1	172.6	0	0	0	0	110.4
293	T	27.5	Very low	31.9	Very low	133 Å²	133	141 Å²	141	82%	0.816	77%	0.77	S	S	*	*			trans	-132.9	129	162	-49.4	0	0	0	0	109.9
294	H	28.9	Very low	32	Very low	162 Å²	162	143 Å²	143	75%	0.75	78%	0.777	S	S	*	*			trans	-77	150.9	176.2	-76.7	-120.8	0	0	0	112.1
295	L	29.8	Very low	31.9	Very low	172 Å²	172	140.6 Å²	140.6	90%	0.901	78%	0.776	S	S	*	*			trans	-166.2	123.6	138.3	-105.8	154	0	0	0	110.9
296	Y	31	Very low	31.8	Very low	197 Å²	197	137.1 Å²	137.1	77%	0.773	78%	0.782	S	S	*	*			trans	-91.4	163.5	163	-112.1	-92.2	0	0	0	108.7	L298	Y296-L298 HydrophobicContact CD1-CG 4.34Å; Y296-L298 HydrophobicContact CE1-CG 4.38Å
297	P	40.3	Very low	31.7	Very low	123 Å²	123	141.3 Å²	141.3	80%	0.799	79%	0.79	S	S	*	*				-136.3	152.6	110.7	36.7	-27.6	0	0	0	114
298	L	33.3	Very low	31.6	Very low	149 Å²	149	138.5 Å²	138.5	78%	0.78	80%	0.798	S	S	*	*			trans	-94.8	150.7	165.6	-87.3	168.1	0	0	0	110.5	Y296	Y296-L298 HydrophobicContact CD1-CG 4.34Å; Y296-L298 HydrophobicContact CE1-CG 4.38Å
299	A	31.7	Very low	31.8	Very low	100 Å²	100	137.6 Å²	137.6	83%	0.826	81%	0.806	S	S	*	*			trans	-151.2	144.3	155.5	0	0	0	0	0	108.5
300	E	32.6	Very low	32.2	Very low	176 Å²	176	136.6 Å²	136.6	82%	0.822	80%	0.802	S	S	*	*			trans	-113.7	178.8	-171.6	-65.4	-174.7	113.5	0	0	113.1
301	V	30.6	Very low	32.3	Very low	149 Å²	149	137 Å²	137	90%	0.903	80%	0.804	S	S	*	*			trans	78.8	129.1	159.4	-164.1	0	0	0	0	117.7
302	G	27.7	Very low	31.5	Very low	76 Å²	76	140.6 Å²	140.6	78%	0.784	81%	0.809	S	S	*	*			trans	151.2	127.8	162	0	0	0	0	0	113
303	M	31	Very low	31.3	Very low	172 Å²	172	143.6 Å²	143.6	85%	0.847	82%	0.815	S	S	*	*			trans	-124.7	158.7	-177.6	-153.4	176.9	126.8	0	0	111.6
304	E	30.4	Very low	31.3	Very low	159 Å²	159	144.1 Å²	144.1	74%	0.743	82%	0.818	S	S	*	*			trans	84.3	137.5	162.8	-71.3	-63.3	91.9	0	0	123.5
305	A	30.5	Very low	31.3	Very low	87 Å²	87	144.5 Å²	144.5	72%	0.719	83%	0.825	S	S	*	*			trans	69.5	66.2	141.4	0	0	0	0	0	122.9
306	G	27.3	Very low	31.3	Very low	81 Å²	81	145.6 Å²	145.6	84%	0.835	83%	0.825	S	S	*	*				51.6	138.9	113.4	0	0	0	0	0	124.8
307	R	28.1	Very low	31.3	Very low	256 Å²	256	143.9 Å²	143.9	97%	0.966	82%	0.824	S	S	*	*			trans	176.8	119.9	135.3	-178.6	175.3	-63.5	-121.8	0.1	111.6
308	G	26.3	Very low	30.7	Very low	76 Å²	76	146.1 Å²	146.1	78%	0.784	82%	0.821	S	S	*	*			trans	166.5	112.2	170.5	0	0	0	0	0	115.6
309	T	31.7	Very low	30.4	Very low	141 Å²	141	144.5 Å²	144.5	87%	0.865	82%	0.817	S	S	*	*			trans	-91.8	177.5	171.9	41.1	0	0	0	0	110.7
310	P	43.8	Very low	30.2	Very low	113 Å²	113	148.2 Å²	148.2	73%	0.734	82%	0.818	S	S	*	*			cis	-142.9	-154.4	19.3	46.5	-25.9	0	0	0	114
311	P	42.7	Very low	30	Very low	116 Å²	116	146.5 Å²	146.5	75%	0.753	81%	0.81	S	S	*	*			cis	-124.2	147.7	-31	22.9	-2.1	0	0	0	115.4
312	F	26	Very low	29.8	Very low	190 Å²	190	145.7 Å²	145.7	83%	0.833	81%	0.805	S	S	*	*			trans	20.5	120.8	136.4	-128.3	-97.3	0	0	0	122.1
313	Q	26.8	Very low	29.8	Very low	188 Å²	188	148.6 Å²	148.6	88%	0.879	80%	0.801	S	S	*	*				-175	113.5	119.7	-105.6	-179.3	44.6	0	0	112.7
314	T	26.9	Very low	30.5	Very low	143 Å²	143	145.3 Å²	145.3	88%	0.877	79%	0.793	S	S	*	*			trans	-149.1	156.7	158.6	-16.8	0	0	0	0	110.1
315	L	29	Very low	30.2	Very low	171 Å²	171	144.9 Å²	144.9	90%	0.895	79%	0.793	S	S	*	*			trans	-89.3	151.1	-172.5	-163.1	72.5	0	0	0	112
316	E	29	Very low	30.1	Very low	195 Å²	195	148.7 Å²	148.7	91%	0.911	80%	0.795	S	S	*	*			trans	-101.5	171.7	176.2	-135.8	174.6	144.5	0	0	112.7
317	E	31.6	Very low	30.2	Very low	161 Å²	161	150.7 Å²	150.7	75%	0.752	79%	0.787	S	S	*	*			trans	-116	-177.3	-157.5	-162.3	-162.2	79.3	0	0	113.7
318	K	26.9	Very low	30.2	Very low	170 Å²	170	146.6 Å²	146.6	74%	0.739	78%	0.783	S	S	*	*			trans	94.4	150.3	160.4	-62.9	-172.6	176	177.6	0	116.5
319	V	28.2	Very low	30.2	Very low	114 Å²	114	147 Å²	147	69%	0.691	77%	0.774	S	S	*	*			cis	-153.2	139.5	48.8	160.7	0	0	0	0	114.9
320	E	27.7	Very low	30.1	Very low	179 Å²	179	150 Å²	150	84%	0.836	78%	0.775	S	S	*	*			trans	49.6	149.2	151.8	-68.6	162.5	165.4	0	0	123.1
321	E	28	Very low	29.4	Very low	140 Å²	140	150.7 Å²	150.7	65%	0.654	78%	0.776	S	S	*	*			cis	-139.6	-130.8	-16.1	-156.9	-159.8	102.9	0	0	110.1	L323	E321-L323 WeakPolarHBondContact OE1-CG 3.37Å; E321-L323 PolarHBondContact OE1-N 2.95Å
322	V	26.3	Very low	28.7	Very low	132 Å²	132	155.1 Å²	155.1	80%	0.8	78%	0.779	S	S	*	*			cis	-144.6	155.4	6.8	-172.6	0	0	0	0	112.3
323	L	26.8	Very low	28.6	Very low	136 Å²	136	152.8 Å²	152.8	71%	0.712	78%	0.776	S	S	*	*			trans	-73.4	-177.1	178	-70.2	167.2	0	0	0	118.2	E321	E321-L323 WeakPolarHBondContact OE1-CG 3.37Å; E321-L323 PolarHBondContact OE1-N 2.95Å
324	P	46.5	Very low	28.8	Very low	103 Å²	103	152 Å²	152	67%	0.669	77%	0.772	S	S	*	*			cis	-145.5	-165.6	-47.7	42.2	-23.4	0	0	0	116.7
325	M	25.2	Very low	29	Very low	150 Å²	150	151 Å²	151	74%	0.739	77%	0.766	S	S	*	*			trans	87	143.1	158.8	-59.8	-95.8	-74.1	0	0	118.5
326	E	28	Very low	29	Very low	167 Å²	167	150.3 Å²	150.3	78%	0.78	76%	0.763	S	S	*	*			cis	-147.7	179	-2.8	-145.3	168.2	-176.8	0	0	112.9
327	D	28.1	Very low	29.1	Very low	123 Å²	123	147 Å²	147	66%	0.658	76%	0.757	S	S	*	*			trans	-84	156.1	-175.3	180	23	0	0	0	114	S329	D327-S329 PolarHBondContact OD1-N 3Å; D327-S329 PolarHBondContact OD1-OG 3.3Å
328	I	29	Very low	29	Very low	171 Å²	171	144.2 Å²	144.2	88%	0.877	76%	0.756	S	S	*	*			trans	-159.7	120	143.2	-100.5	151.3	0	0	0	108.5
329	S	26.5	Very low	29.1	Very low	85 Å²	85	147 Å²	147	59%	0.594	76%	0.764	S	S	*	*			trans	-144.2	115.7	170.6	53.6	0	0	0	0	111.3	D327	D327-S329 PolarHBondContact OD1-N 3Å; D327-S329 PolarHBondContact OD1-OG 3.3Å
330	K	30.1	Very low	29.2	Very low	204 Å²	204	145.3 Å²	145.3	89%	0.887	76%	0.757	S	S	*	*			trans	168.5	159.8	158.8	-98	149.8	-168.1	164	0	113.1
331	V	28.9	Very low	29.4	Very low	126 Å²	126	146 Å²	146	76%	0.764	76%	0.76	S	S	*	*			trans	117	96.3	157.9	177.7	0	0	0	0	113.7
332	Y	26.2	Very low	29.5	Very low	209 Å²	209	145.5 Å²	145.5	82%	0.82	77%	0.767	S	S	*	*			trans	41.4	128.2	153.1	-62.8	-96.2	0	0	0	120.2
333	D	25.9	Very low	29.7	Very low	141 Å²	141	146.2 Å²	146.2	75%	0.754	77%	0.772	S	S	*	*			cis	90.2	147.4	32	-158.9	13.7	0	0	0	114.3
334	E	30.2	Very low	29.8	Very low	171 Å²	171	143.4 Å²	143.4	80%	0.799	78%	0.775	S	S	*	*			trans	60.8	139	-171.6	-68.9	-163.7	87.2	0	0	116.5
335	T	30.1	Very low	28.9	Very low	123 Å²	123	145.6 Å²	145.6	76%	0.755	79%	0.787	S	S	*	*			cis	-148.4	162.9	18.4	32.8	0	0	0	0	111.3
336	L	30.8	Very low	29	Very low	157 Å²	157	141.6 Å²	141.6	82%	0.822	78%	0.784	S	S	*	*			trans	-144.3	112.4	174.4	-159	173.1	0	0	0	110.5
337	P	31	Very low	29.2	Very low	124 Å²	124	142 Å²	142	81%	0.805	79%	0.786	S	S	*	*			trans	-79.9	140.3	-179.3	-13.6	29.6	0	0	0	113.7
338	S	29.8	Very low	29.1	Very low	104 Å²	104	143.4 Å²	143.4	73%	0.727	79%	0.794	S	S	*	*			trans	-143.4	127.8	169	65.6	0	0	0	0	111.4
339	Y	28.7	Very low	29.3	Very low	228 Å²	228	139 Å²	139	89%	0.894	78%	0.783	S	S	*	*			trans	177.1	153.1	161.4	-118.1	-132.1	0	0	0	107.3
340	S	29.9	Very low	29.4	Very low	79 Å²	79	144.5 Å²	144.5	55%	0.552	80%	0.799	S	S	*	*			cis	-165.4	158.3	-11.4	38.2	0	0	0	0	110
341	Q	32.4	Very low	29.4	Very low	194 Å²	194	137.8 Å²	137.8	91%	0.907	79%	0.787	S	S	*	*			trans	-80.6	145.2	156.7	-69.6	176.3	-21.7	0	0	109.9
342	T	28.6	Very low	29.6	Very low	128 Å²	128	141.1 Å²	141.1	79%	0.785	80%	0.795	S	S	*	*			trans	-137.7	114.1	168.4	49.5	0	0	0	0	110.7
343	T	30.8	Very low	29.8	Very low	147 Å²	147	140.2 Å²	140.2	90%	0.902	80%	0.798	S	S	*	*			trans	-102.6	133.4	165.1	49.1	0	0	0	0	109.3
344	G	28.6	Very low	30.2	Very low	77 Å²	77	137.3 Å²	137.3	79%	0.794	79%	0.794	S	S	*	*			trans	-165.6	142.3	173.9	0	0	0	0	0	110.7
345	T	29	Very low	30.2	Very low	150 Å²	150	137.3 Å²	137.3	92%	0.92	79%	0.794	S	S	*	*			trans	-135.7	149.3	-172.5	45.2	0	0	0	0	111.4
346	G	27.5	Very low	30.3	Very low	65 Å²	65	136.7 Å²	136.7	67%	0.67	79%	0.786	S	S	*	*			trans	87.1	158.4	173.1	0	0	0	0	0	114.7
347	E	30.6	Very low	30.3	Very low	175 Å²	175	137.2 Å²	137.2	82%	0.818	78%	0.784	S	S	*	*			cis	-170	143.7	-18.7	-124.6	155.1	-174	0	0	107.8
348	D	27.6	Very low	30.4	Very low	154 Å²	154	139 Å²	139	82%	0.824	78%	0.782	S	S	*	*			trans	57.6	158.5	163.5	-45.9	-32	0	0	0	119.1
349	A	31.7	Very low	30.3	Very low	78 Å²	78	140.7 Å²	140.7	65%	0.645	78%	0.78	S	S	*	*			cis	-153.1	142.9	14.8	0	0	0	0	0	114.4
350	E	29.3	Very low	30.4	Very low	201 Å²	201	137.6 Å²	137.6	94%	0.939	77%	0.773	S	S	*	*				55.6	156.1	129.1	-59	-178.6	137.9	0	0	125.1
351	G	29.1	Very low	30.3	Very low	62 Å²	62	140 Å²	140	64%	0.639	79%	0.785	S	S	*	*			trans	117.6	86.5	178.7	0	0	0	0	0	112.9
352	E	33.1	Very low	30.9	Very low	197 Å²	197	136.3 Å²	136.3	92%	0.921	78%	0.778	S	S	*	*				63	131.6	78.5	-58.5	-177.1	131.3	0	0	112.3
353	E	30.9	Very low	31	Very low	189 Å²	189	134.1 Å²	134.1	88%	0.883	77%	0.772	S	S	*	*			cis	-139.5	170.8	17	-79	-179.4	98	0	0	109.8
354	A	33.4	Very low	30.9	Very low	81 Å²	81	136.5 Å²	136.5	67%	0.669	77%	0.773	S	S	*	*			cis	-170.3	170.1	-19	0	0	0	0	0	110.7
355	E	31.7	Very low	31.1	Very low	170 Å²	170	137.4 Å²	137.4	79%	0.794	77%	0.774	S	S	*	*			trans	18.9	151.2	146.6	-59.3	-165.1	149.9	0	0	123.6
356	N	30.7	Very low	31.1	Very low	111 Å²	111	139.5 Å²	139.5	59%	0.594	77%	0.773	S	S	*	*			cis	-164.3	163.2	-11.3	-101	-18.6	0	0	0	111.3
357	E	32.3	Very low	31.4	Very low	167 Å²	167	142.8 Å²	142.8	78%	0.78	78%	0.78	S	S	*	*			trans	22.9	150.6	143	-59.6	177.6	146.9	0	0	121.6
358	E	32.5	Very low	31.4	Very low	162 Å²	162	143.9 Å²	143.9	76%	0.757	79%	0.785	S	S	*	*			cis	-162.2	164	21.5	-144.3	-178.3	-177	0	0	114.1
359	M	28.4	Very low	31.6	Very low	139 Å²	139	140.2 Å²	140.2	69%	0.685	78%	0.776	S	S	*	*			trans	67.5	125.6	144.8	-147.6	105.3	178.5	0	0	125.1
360	E	29.9	Very low	31.6	Very low	163 Å²	163	142.8 Å²	142.8	76%	0.762	78%	0.784	S	S	*	*			trans	77.6	159.2	144.2	-92.7	173.9	-177.6	0	0	124.6
361	T	29.2	Very low	31.7	Very low	129 Å²	129	139.5 Å²	139.5	79%	0.791	77%	0.773	S	S	*	*			trans	-131.2	178.9	-169.9	62.4	0	0	0	0	108.1
362	P	44.8	Very low	31.9	Very low	118 Å²	118	142.1 Å²	142.1	77%	0.766	78%	0.776	S	S	*	*			cis	-144.5	-164.7	12.4	41	-18.5	0	0	0	116.4
363	A	30.3	Very low	31.9	Very low	81 Å²	81	139.4 Å²	139.4	67%	0.669	77%	0.767	S	S	*	*			trans	96.2	126.6	140.3	0	0	0	0	0	122.4
364	E	28.7	Very low	32	Very low	197 Å²	197	138.9 Å²	138.9	92%	0.921	76%	0.764	S	S	*	*			trans	74.2	164.5	138.5	-69.2	175.2	-173	0	0	120.8
365	A	31.3	Very low	31.8	Very low	97 Å²	97	141.5 Å²	141.5	80%	0.802	77%	0.767	S	S	*	*			trans	-149.6	152.6	-159.1	0	0	0	0	0	112.6
366	E	31.1	Very low	32	Very low	194 Å²	194	139.1 Å²	139.1	91%	0.907	76%	0.764	S	S	*	*			trans	-100.8	112.2	-174.4	-65.1	-170.1	125.4	0	0	114.1
367	V	32.8	Very low	32.3	Very low	133 Å²	133	144.8 Å²	144.8	81%	0.806	78%	0.777	S	S	*	*				25.4	121.1	127.3	-175.4	0	0	0	0	119.7
368	E	29.7	Very low	33.1	Very low	199 Å²	199	142.3 Å²	142.3	93%	0.93	78%	0.776	S	S	*	*				-144.4	161.5	121.3	-152.9	167.1	-164.3	0	0	109.9
369	A	33.3	Very low	33	Very low	77 Å²	77	142.3 Å²	142.3	64%	0.636	78%	0.78	S	S	*	*			trans	-124.1	177.8	-150.9	0	0	0	0	0	117.5
370	T	31.2	Very low	33.1	Very low	132 Å²	132	140.1 Å²	140.1	81%	0.81	78%	0.778	S	S	*	*			trans	105.3	138.9	170.2	66.2	0	0	0	0	115.7
371	D	31.9	Very low	33.3	Very low	131 Å²	131	143.1 Å²	143.1	70%	0.701	78%	0.783	S	S	*	*			cis	-156	-179.3	-2.7	-138.8	-45	0	0	0	113.8
372	T	32.5	Very low	33.5	Very low	117 Å²	117	144.9 Å²	144.9	72%	0.718	79%	0.787	S	S	*	*			trans	68	71.6	154.5	49.9	0	0	0	0	119.9
373	I	33.1	Very low	32.9	Very low	140 Å²	140	145 Å²	145	72%	0.718	79%	0.79	S	S	*	*				41	113.8	112.5	-61.6	178	0	0	0	119.4
374	E	32.7	Very low	33.1	Very low	179 Å²	179	150.9 Å²	150.9	84%	0.836	80%	0.801	S	S	*	*			trans	56.3	151.6	139.9	-58.7	180	146.4	0	0	121.1
375	D	29	Very low	33.2	Very low	136 Å²	136	146 Å²	146	73%	0.727	79%	0.794	S	S	*	*			cis	-140.1	163.2	10.5	-172.5	15	0	0	0	111.6
376	T	37.4	Very low	33.3	Very low	119 Å²	119	147.2 Å²	147.2	73%	0.73	80%	0.796	S	S	*	*			trans	-137.5	120.1	176.5	47.3	0	0	0	0	114.7
377	R	35.3	Very low	33.6	Very low	230 Å²	230	143.8 Å²	143.8	87%	0.868	79%	0.794	S	S	*	*			trans	-164	141.4	146.5	-127.1	162.4	-69.7	-176.4	1	114.7
378	P	49.8	Very low	33.7	Very low	115 Å²	115	149 Å²	149	75%	0.747	80%	0.799	S	S	*	*			trans	-98.6	144.5	173	36.1	-32.2	0	0	0	113
379	L	30.6	Very low	34	Very low	162 Å²	162	144.4 Å²	144.4	85%	0.848	80%	0.796	S	S	*	*			trans	-142.8	114.9	168.3	-85.5	-178.3	0	0	0	114.9
380	S	31.1	Very low	34.4	Very low	93 Å²	93	150.8 Å²	150.8	65%	0.65	80%	0.803	S	S	*	*			trans	36.9	123.5	137.1	65.4	0	0	0	0	123.2
381	R	32.9	Very low	34.7	Very low	226 Å²	226	149.7 Å²	149.7	85%	0.853	80%	0.801	S	S	*	*			trans	63.8	135.2	131.7	-70.4	-176.5	171.7	-175.2	-1.6	121.1
382	L	34.5	Very low	35.5	Very low	167 Å²	167	149.2 Å²	149.2	87%	0.874	80%	0.798	S	S	*	*			trans	67.1	130	156	-62.6	158.5	0	0	0	114.8
383	S	32	Very low	36.1	Very low	121 Å²	121	150.8 Å²	150.8	85%	0.846	80%	0.802	S	S	*	*				-155.1	-154.1	56.4	68.2	0	0	0	0	114.1
384	K	33.5	Very low	36.8	Very low	204 Å²	204	151.2 Å²	151.2	89%	0.887	81%	0.805	S	S	*	*			trans	-145.1	91.4	-156.4	176.9	-171.2	174.8	-179	0	111.6
385	A	31	Very low	37.4	Very low	95 Å²	95	148.6 Å²	148.6	79%	0.785	80%	0.802	S	S	*	*			trans	-160.3	138.3	165.9	0	0	0	0	0	108
386	S	33.8	Very low	38	Very low	121 Å²	121	152.5 Å²	152.5	85%	0.846	83%	0.83	S	S	*	*			cis	84.6	81.1	38.8	-177.8	0	0	0	0	114.7
387	S	37	Very low	38.1	Very low	122 Å²	122	154.2 Å²	154.2	85%	0.853	84%	0.835	S	S	*	*			trans	-144.8	96.1	156.9	38.3	0	0	0	0	111.4	A389	S387-A389 PolarHBondContact O-N 3.43Å
388	R	36.3	Very low	38.2	Very low	242 Å²	242	150.2 Å²	150.2	91%	0.913	83%	0.833	S	S	*	*			trans	-58.4	115.8	170.4	-177.9	-172.7	-157.4	154.4	1.9	109.9
389	A	35.9	Very low	37.6	Very low	104 Å²	104	152.1 Å²	152.1	86%	0.86	84%	0.838	S	S	*	*			trans	-62.9	140.2	171.4	0	0	0	0	0	110.5	S387	S387-A389 PolarHBondContact O-N 3.43Å
390	R	40.2	Very low	38	Very low	210 Å²	210	151.5 Å²	151.5	79%	0.792	84%	0.837	S	S	*	*			trans	-132.9	123.6	174.9	176.5	176.3	179.2	129.5	7.3	108.1	D392	R390-D392 IonicContact CZ-OD2 3.41Å; R390-D392 IonicContact NE-OD2 2.76Å; R390-D392 PolarHBondContact NE-OD2 3.45Å; R390-D392 VanDerWaalsContact NE-OD2 3.1Å; R390-D392 IonicContact NH2-OD2 2.75Å; R390-D392 PolarHBondContact NH2-OD2 3.42Å
391	S	39	Very low	38.4	Very low	110 Å²	110	155.2 Å²	155.2	77%	0.769	85%	0.849	S	S	*	*			trans	-66.7	135.4	165.6	-43.2	0	0	0	0	109.4
392	D	47.5	Very low	38.8	Very low	120 Å²	120	150.5 Å²	150.5	64%	0.642	85%	0.849	S	S	*	*			trans	177.9	82	153.1	-83.6	-36.3	0	0	0	108.7	R390	R390-D392 IonicContact CZ-OD2 3.41Å; R390-D392 IonicContact NE-OD2 2.76Å; R390-D392 PolarHBondContact NE-OD2 3.45Å; R390-D392 VanDerWaalsContact NE-OD2 3.1Å; R390-D392 IonicContact NH2-OD2 2.75Å; R390-D392 PolarHBondContact NH2-OD2 3.42Å
393	D	46.2	Very low	39.1	Very low	150 Å²	150	149.3 Å²	149.3	80%	0.802	85%	0.847	S	S	*	*			trans	-166.2	103.6	158.5	-107.4	-25.6	0	0	0	106.9
394	L	47.3	Very low	39.6	Very low	149 Å²	149	151.5 Å²	151.5	78%	0.78	85%	0.847	S	S	*	*				91.5	114.2	76.7	-103	77.3	0	0	0	114.3
395	T	45.4	Very low	40.2	Very low	125 Å²	125	147.1 Å²	147.1	77%	0.767	84%	0.844	S	S	*	*			trans	-21.5	131.8	153.8	51.6	0	0	0	0	117.3
396	V	42.3	Very low	41	Very low	217 Å²	217	151.8 Å²	151.8	100%	1.315	85%	0.849	S	S	*	*				-137.7	0	103.7	158.3	0	0	0	0	108

Retrieved 396 of 396 residues in 53.5 ms (Link to these results)

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