A0A077Z586_TRITR Loading...

acid phosphatase

AlphaFold DB , UniProt , Accession A0A077Z586, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 390 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	32.9	Very low	37.5	Very low	228 Å²	228	114.8 Å²	114.8	100%	1.123	60%	0.596	S	S	*	*				0	8.9	0	-143.8	166.2	169.4	0	0	113.8
2	G	32.4	Very low	37.8	Very low	47 Å²	47	109.9 Å²	109.9	49%	0.485	57%	0.571	S	S	.	*			trans	-145.9	15.5	-176.1	0	0	0	0	0	117.2
3	E	35.5	Very low	38.3	Very low	182 Å²	182	108.6 Å²	108.6	85%	0.85	56%	0.564	S	S	*	*	S	Bend	trans	-86.1	-28.8	-176.4	-75.7	-175.4	152.6	0	0	114.2
4	L	41.4	Very low	39.2	Very low	83 Å²	83	113.9 Å²	113.9	44%	0.435	58%	0.58	S	S	.	*	S	Bend	trans	-78.3	-28.2	-176.8	-94.8	141.1	0	0	0	113.8	K6 A7	L4-K6 PolarHBondContact O-N 3.28Å; L4-A7 PolarHBondContact O-N 3.5Å
5	T	40.9	Very low	40.2	Very low	73 Å²	73	111.9 Å²	111.9	45%	0.448	58%	0.578	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.5	-22.3	-175.6	35.8	0	0	0	0	114	T147	T5-T147 WeakPolarHBondContact CG2-O 3.09Å
6	K	35.7	Very low	41.4	Very low	195 Å²	195	106.5 Å²	106.5	85%	0.848	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	-8.7	173	-75	-174.5	179.6	178.3	0	113.9	L4 R8	L4-K6 PolarHBondContact O-N 3.28Å; K6-R8 VanDerWaalsContact C-N 3.26Å; K6-R8 PolarHBondContact O-N 3.39Å
7	A	35	Very low	43.2	Very low	21 Å²	21	103.6 Å²	103.6	17%	0.174	54%	0.538	C	S	.	.			trans	-76.7	79.5	172.3	0	0	0	0	0	109.4	L4 C9 A11	L4-A7 PolarHBondContact O-N 3.5Å; A7-C9 PolarHBondContact O-N 3.03Å; A7-A11 HydrophobicContact CB-CB 4.43Å
8	R	39.4	Very low	45.5	Very low	184 Å²	184	103.4 Å²	103.4	69%	0.694	54%	0.536	S	S	*	.			trans	-49.8	140	148.2	-70.2	-176.7	166.5	-175.3	-1.4	106	K6 F10 A11	K6-R8 VanDerWaalsContact C-N 3.26Å; K6-R8 PolarHBondContact O-N 3.39Å; R8-F10 HydrophobicContact CB-CB 4.37Å; R8-F10 HydrophobicContact CB-CD2 3.79Å; R8-F10 CarbonylContact O-C 3.54Å; R8-F10 WeakPolarHBondContact O-CA 3.47Å; R8-F10 PolarHBondContact O-N 3.39Å; R8-A11 PolarHBondContact O-N 3.06Å
9	C	43	Very low	47.6	Very low	39 Å²	39	101 Å²	101	26%	0.264	52%	0.524	S	S	.	.	G	3₁₀ helix	trans	-50.9	-14.9	-176.3	-56.2	0	0	0	0	113.9	A7 A11 L12 C166	A7-C9 PolarHBondContact O-N 3.03Å; C9-A11 PolarHBondContact O-N 3.31Å; C9-L12 PolarHBondContact O-N 2.94Å; C9-L12 VanDerWaalsContact O-N 3.1Å; C9-C166 HydrophobicContact CB-CB 4.16Å; C9-C166 WeakPolarHBondContact CB-SG 3.46Å; C9-C166 WeakPolarHBondContact SG-CB 3.42Å; C9-C166 CovalentContact SG-SG 2.06Å; C9-C166 PolarHBondContact SG-SG 2.94Å
10	F	40.3	Very low	49.6	Very low	131 Å²	131	97.3 Å²	97.3	58%	0.575	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-49.9	-22.1	164.5	-68.7	-91.9	0	0	0	116.5	R8 I13	R8-F10 HydrophobicContact CB-CB 4.37Å; R8-F10 HydrophobicContact CB-CD2 3.79Å; R8-F10 CarbonylContact O-C 3.54Å; R8-F10 WeakPolarHBondContact O-CA 3.47Å; R8-F10 PolarHBondContact O-N 3.39Å; F10-I13 WeakPolarHBondContact O-CD1 3.21Å; F10-I13 WeakPolarHBondContact O-CG1 3.49Å
11	A	36.1	Very low	51.6	Low	80 Å²	80	95.6 Å²	95.6	66%	0.661	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-84.5	-18.1	175.5	0	0	0	0	0	113.4	A7 R8 C9 I13	A7-A11 HydrophobicContact CB-CB 4.43Å; R8-A11 PolarHBondContact O-N 3.06Å; C9-A11 PolarHBondContact O-N 3.31Å; A11-I13 VanDerWaalsContact C-N 3.35Å; A11-I13 PolarHBondContact O-N 2.92Å
12	L	40.7	Very low	54.4	Low	56 Å²	56	89.3 Å²	89.3	29%	0.293	47%	0.47	S	S	.	.	S	Bend	trans	-96.2	23.6	-173.3	-64.3	168.8	0	0	0	113	C9 K14 S16	C9-L12 PolarHBondContact O-N 2.94Å; C9-L12 VanDerWaalsContact O-N 3.1Å; L12-K14 PolarHBondContact O-N 3Å; L12-S16 PolarHBondContact O-OG 3.03Å
13	I	44.8	Very low	57.1	Low	93 Å²	93	88.6 Å²	88.6	48%	0.477	45%	0.454	S	S	.	.	H	α-helix	trans	-58.5	-34.5	-162.5	-74.6	166.8	0	0	0	115	F10 A11 S16 L17	F10-I13 WeakPolarHBondContact O-CD1 3.21Å; F10-I13 WeakPolarHBondContact O-CG1 3.49Å; A11-I13 VanDerWaalsContact C-N 3.35Å; A11-I13 PolarHBondContact O-N 2.92Å; I13-S16 PolarHBondContact O-OG 3.39Å; I13-L17 WeakPolarHBondContact O-CB 3.43Å; I13-L17 PolarHBondContact O-N 2.68Å
14	K	50.3	Low	59.9	Low	183 Å²	183	81.5 Å²	81.5	80%	0.796	42%	0.421	S	S	*	.	H	α-helix	trans	-72.8	-56.9	-166.2	-77.8	-174.3	-179.6	-178.3	0	114.2	L12	L12-K14 PolarHBondContact O-N 3Å
15	P	55.2	Low	62.4	Low	84 Å²	84	82.3 Å²	82.3	55%	0.545	42%	0.419	S	S	.	.	H	α-helix	trans	-73.1	-33.8	-178.9	-16.3	31.5	0	0	0	112.9	L17 I18	P15-L17 VanDerWaalsContact C-N 3.32Å; P15-L17 PolarHBondContact O-N 3.15Å; P15-I18 PolarHBondContact O-N 3.38Å
16	S	58.7	Low	64.8	Low	25 Å²	25	82.3 Å²	82.3	18%	0.175	41%	0.413	C	S	.	.	H	α-helix	trans	-63.4	-37.3	-175.4	54.2	0	0	0	0	112.9	L12 I13 I18 L19 G20 H170	L12-S16 PolarHBondContact O-OG 3.03Å; I13-S16 PolarHBondContact O-OG 3.39Å; S16-I18 VanDerWaalsContact C-N 3.35Å; S16-I18 PolarHBondContact O-N 3.37Å; S16-L19 PolarHBondContact O-N 2.95Å; S16-G20 PolarHBondContact O-N 3.27Å; S16-H170 WeakPolarHBondContact CA-CE1 3.46Å; S16-H170 VanDerWaalsContact CB-CE1 3.42Å; S16-H170 WeakPolarHBondContact CB-CE1 3.23Å; S16-H170 WeakPolarHBondContact CB-NE2 3.48Å
17	L	71.9	Confident	67.4	Low	58 Å²	58	73.6 Å²	73.6	30%	0.304	38%	0.375	S	S	.	.	H	α-helix	trans	-65.2	-35.7	-178.9	-165	64.6	0	0	0	112.8	I13 P15 G20 I21 M60	I13-L17 WeakPolarHBondContact O-CB 3.43Å; I13-L17 PolarHBondContact O-N 2.68Å; P15-L17 VanDerWaalsContact C-N 3.32Å; P15-L17 PolarHBondContact O-N 3.15Å; L17-G20 PolarHBondContact O-N 3.43Å; L17-I21 HydrophobicContact CG-CD1 4.33Å; L17-I21 VanDerWaalsContact O-CG1 3.23Å; L17-I21 WeakPolarHBondContact O-CG1 3.31Å; L17-I21 PolarHBondContact O-N 3.45Å; L17-M60 HydrophobicContact CD1-CE 4Å; L17-M60 HydrophobicContact CD1-SD 3.92Å; L17-M60 HydrophobicContact CD2-CE 3.48Å; L17-M60 VanDerWaalsContact CD2-CE 3.48Å; L17-M60 HydrophobicContact CD2-SD 3.82Å; L17-M60 HydrophobicContact CG-CE 3.72Å; L17-M60 HydrophobicContact CG-SD 4.21Å
18	I	85.1	Confident	70.3	Confident	99 Å²	99	72.6 Å²	72.6	51%	0.508	37%	0.367	S	S	.	.	H	α-helix	trans	-66.9	-43.8	-180	-61.9	173.7	0	0	0	110.8	P15 S16 G20 I21 Q22	P15-I18 PolarHBondContact O-N 3.38Å; S16-I18 VanDerWaalsContact C-N 3.35Å; S16-I18 PolarHBondContact O-N 3.37Å; I18-G20 VanDerWaalsContact C-N 3.34Å; I18-G20 PolarHBondContact O-N 3.41Å; I18-I21 PolarHBondContact O-N 2.98Å; I18-Q22 WeakPolarHBondContact O-CG 3.39Å; I18-Q22 PolarHBondContact O-N 3.33Å
19	L	85.9	Confident	72.9	Confident	58 Å²	58	68.7 Å²	68.7	30%	0.304	36%	0.355	S	S	.	.	H	α-helix	trans	-62.2	-44.4	177.7	-177.8	61.9	0	0	0	110.7	S16 I21 Q22 E23 I169	S16-L19 PolarHBondContact O-N 2.95Å; L19-I21 PolarHBondContact O-N 2.93Å; L19-Q22 PolarHBondContact O-N 3.36Å; L19-E23 WeakPolarHBondContact O-CG 3.45Å; L19-E23 PolarHBondContact O-N 2.9Å; L19-I169 HydrophobicContact CD2-CG2 4.19Å
20	G	87.2	Confident	75.1	Confident	26 Å²	26	69.3 Å²	69.3	27%	0.268	35%	0.353	S	S	.	.	H	α-helix	trans	-58.4	-45.4	175.1	0	0	0	0	0	112.8	S16 L17 I18 Q22 E23 H24	S16-G20 PolarHBondContact O-N 3.27Å; L17-G20 PolarHBondContact O-N 3.43Å; I18-G20 VanDerWaalsContact C-N 3.34Å; I18-G20 PolarHBondContact O-N 3.41Å; G20-Q22 VanDerWaalsContact C-N 3.34Å; G20-Q22 PolarHBondContact O-N 3.49Å; G20-E23 PolarHBondContact O-N 2.98Å; G20-H24 PolarHBondContact O-CD2 3.47Å; G20-H24 PolarHBondContact O-N 3.47Å
21	I	91.7	Very high	77.6	Confident	62 Å²	62	64 Å²	64	32%	0.318	33%	0.331	S	S	.	.	H	α-helix	trans	-57.9	-46.2	174.5	-70.5	166.1	0	0	0	110.8	L17 I18 L19 H24 Y25 M60 A64	L17-I21 HydrophobicContact CG-CD1 4.33Å; L17-I21 VanDerWaalsContact O-CG1 3.23Å; L17-I21 WeakPolarHBondContact O-CG1 3.31Å; L17-I21 PolarHBondContact O-N 3.45Å; I18-I21 PolarHBondContact O-N 2.98Å; L19-I21 PolarHBondContact O-N 2.93Å; I21-H24 PolarHBondContact O-N 2.97Å; I21-Y25 WeakPolarHBondContact O-CB 3.34Å; I21-Y25 PolarHBondContact O-N 3.28Å; I21-M60 HydrophobicContact CD1-CE 3.7Å; I21-M60 HydrophobicContact CG1-CE 4.37Å; I21-A64 HydrophobicContact CB-CB 4.32Å; I21-A64 HydrophobicContact CG2-CB 3.87Å
22	Q	91.5	Very high	80.4	Confident	97 Å²	97	62 Å²	62	45%	0.453	31%	0.306	S	S	.	.	H	α-helix	trans	-63.4	-42.8	179.9	-72.3	175.8	-3.1	0	0	112.3	I18 L19 G20 Y25 K26	I18-Q22 WeakPolarHBondContact O-CG 3.39Å; I18-Q22 PolarHBondContact O-N 3.33Å; L19-Q22 PolarHBondContact O-N 3.36Å; G20-Q22 VanDerWaalsContact C-N 3.34Å; G20-Q22 PolarHBondContact O-N 3.49Å; Q22-Y25 PolarHBondContact O-N 2.93Å; Q22-K26 VanDerWaalsContact O-CG 3.25Å; Q22-K26 WeakPolarHBondContact O-CG 3.46Å; Q22-K26 PolarHBondContact O-N 3.46Å
23	E	89.5	Confident	82.9	Confident	32 Å²	32	67.8 Å²	67.8	15%	0.15	33%	0.329	C	S	.	.	H	α-helix	trans	-65.4	-43.6	177.5	-70.3	-53.4	125.6	0	0	111.6	L19 G20 Y25 K26 L27 A262	L19-E23 WeakPolarHBondContact O-CG 3.45Å; L19-E23 PolarHBondContact O-N 2.9Å; G20-E23 PolarHBondContact O-N 2.98Å; E23-Y25 PolarHBondContact O-N 3.49Å; E23-K26 PolarHBondContact O-N 2.88Å; E23-K26 IonicContact OE1-NZ 2.85Å; E23-K26 PolarHBondContact OE1-NZ 3.45Å; E23-L27 WeakPolarHBondContact O-CB 3.48Å; E23-L27 PolarHBondContact O-N 2.93Å; E23-A262 HydrophobicContact CB-CB 3.91Å
24	H	92.5	Very high	85	Confident	32 Å²	32	67.8 Å²	67.8	15%	0.148	32%	0.323	C	S	.	.	H	α-helix	trans	-65.5	-37.9	175.2	-85.8	-79.7	0	0	0	112.9	G20 I21 L27 G28 S61 A64 N65	G20-H24 PolarHBondContact O-CD2 3.47Å; G20-H24 PolarHBondContact O-N 3.47Å; I21-H24 PolarHBondContact O-N 2.97Å; H24-L27 WeakPolarHBondContact O-CB 3.34Å; H24-L27 PolarHBondContact O-N 3.31Å; H24-G28 PolarHBondContact O-N 2.92Å; H24-S61 WeakPolarHBondContact CB-O 3.01Å; H24-S61 VanDerWaalsContact CD2-CB 3.41Å; H24-S61 WeakPolarHBondContact CD2-CB 3.23Å; H24-S61 PolarHBondContact CD2-OG 2.65Å; H24-S61 VanDerWaalsContact NE2-CB 3.33Å; H24-S61 WeakPolarHBondContact NE2-CB 3.28Å; H24-S61 PolarHBondContact NE2-OG 3.35Å; H24-A64 HydrophobicContact CB-CB 3.92Å; H24-N65 HydrophobicContact CB-CB 4.33Å; H24-N65 VanDerWaalsContact O-CA 3.28Å; H24-N65 WeakPolarHBondContact O-CA 3.25Å; H24-N65 PolarHBondContact O-ND2 3.14Å
25	Y	94.1	Very high	87	Confident	101 Å²	101	60.9 Å²	60.9	40%	0.396	29%	0.292	S	S	.	.	H	α-helix	trans	-62.7	-43.8	173.5	179.9	-107.9	0	0	0	112.1	I21 Q22 E23 L27 G28 K29 A64 A67 G68	I21-Y25 WeakPolarHBondContact O-CB 3.34Å; I21-Y25 PolarHBondContact O-N 3.28Å; Q22-Y25 PolarHBondContact O-N 2.93Å; E23-Y25 PolarHBondContact O-N 3.49Å; Y25-L27 VanDerWaalsContact C-N 3.33Å; Y25-L27 PolarHBondContact O-N 3.37Å; Y25-G28 PolarHBondContact O-N 3.16Å; Y25-K29 HydrophobicContact CD1-CD 4.35Å; Y25-K29 HydrophobicContact CE1-CD 3.76Å; Y25-K29 HydrophobicContact CE1-CG 4.36Å; Y25-K29 PolarHBondContact O-N 2.89Å; Y25-A64 WeakPolarHBondContact CA-O 3.49Å; Y25-A67 HydrophobicContact CD2-CB 4.19Å; Y25-A67 HydrophobicContact CE2-CB 4.34Å; Y25-G68 VanDerWaalsContact CD2-CA 3.45Å; Y25-G68 VanDerWaalsContact CD2-N 3.34Å
26	K	92.2	Very high	88.9	Confident	73 Å²	73	59.2 Å²	59.2	32%	0.317	29%	0.285	S	S	.	.	H	α-helix	trans	-61.2	-42.1	173.3	-70.1	168.5	-168.5	170.3	0	111.3	Q22 E23 G28 K29 F30 A305	Q22-K26 VanDerWaalsContact O-CG 3.25Å; Q22-K26 WeakPolarHBondContact O-CG 3.46Å; Q22-K26 PolarHBondContact O-N 3.46Å; E23-K26 PolarHBondContact O-N 2.88Å; E23-K26 IonicContact OE1-NZ 2.85Å; E23-K26 PolarHBondContact OE1-NZ 3.45Å; K26-G28 VanDerWaalsContact C-N 3.31Å; K26-G28 PolarHBondContact O-N 2.71Å; K26-K29 PolarHBondContact O-N 3.47Å; K26-F30 WeakPolarHBondContact O-CB 3.33Å; K26-F30 PolarHBondContact O-N 2.88Å; K26-A305 HydrophobicContact CD-CB 4.05Å
27	L	91	Very high	90.6	Very high	12 Å²	12	66.2 Å²	66.2	6%	0.063	32%	0.321	C	S	.	.	H	α-helix	trans	-61.1	-40.7	174.7	-179.1	66.4	0	0	0	111.6	E23 H24 Y25 F30 I31 N65 A262 V264 K283	E23-L27 WeakPolarHBondContact O-CB 3.48Å; E23-L27 PolarHBondContact O-N 2.93Å; H24-L27 WeakPolarHBondContact O-CB 3.34Å; H24-L27 PolarHBondContact O-N 3.31Å; Y25-L27 VanDerWaalsContact C-N 3.33Å; Y25-L27 PolarHBondContact O-N 3.37Å; L27-F30 HydrophobicContact CD1-CD1 4.2Å; L27-F30 WeakPolarHBondContact O-CB 3.33Å; L27-F30 PolarHBondContact O-N 2.89Å; L27-I31 HydrophobicContact CG-CD1 4.2Å; L27-I31 WeakPolarHBondContact O-CG1 3.45Å; L27-I31 PolarHBondContact O-N 3.43Å; L27-N65 WeakPolarHBondContact CG-ND2 3.03Å; L27-A262 HydrophobicContact CD2-CB 4.41Å; L27-A262 WeakPolarHBondContact CD2-O 3.33Å; L27-V264 HydrophobicContact CD1-CB 4.47Å; L27-V264 HydrophobicContact CD1-CG1 3.8Å; L27-V264 HydrophobicContact CD2-CB 4.27Å; L27-V264 HydrophobicContact CD2-CG1 4.49Å; L27-K283 HydrophobicContact CD1-CD 4.07Å
28	G	94.6	Very high	91.6	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-59.6	-48	175	0	0	0	0	0	112.3	H24 Y25 K26 F30 I31 R32 N65 G68	H24-G28 PolarHBondContact O-N 2.92Å; Y25-G28 PolarHBondContact O-N 3.16Å; K26-G28 VanDerWaalsContact C-N 3.31Å; K26-G28 PolarHBondContact O-N 2.71Å; G28-F30 VanDerWaalsContact C-N 3.28Å; G28-F30 PolarHBondContact O-N 2.94Å; G28-I31 PolarHBondContact O-N 2.96Å; G28-R32 PolarHBondContact O-N 2.79Å; G28-N65 VanDerWaalsContact CA-O 3.27Å; G28-N65 WeakPolarHBondContact CA-O 3.35Å; G28-N65 PolarHBondContact N-ND2 2.94Å; G28-N65 VanDerWaalsContact N-ND2 3.15Å; G28-G68 VanDerWaalsContact C-C 3.45Å; G28-G68 CarbonylContact C-O 3.12Å
29	K	94.1	Very high	92	Very high	102 Å²	102	63.9 Å²	63.9	44%	0.443	31%	0.305	S	S	.	.	H	α-helix	trans	-60.8	-38.2	174.7	-69.4	-172.1	-64.8	177.4	0	112.4	Y25 K26 R32 K33 G68	Y25-K29 HydrophobicContact CD1-CD 4.35Å; Y25-K29 HydrophobicContact CE1-CD 3.76Å; Y25-K29 HydrophobicContact CE1-CG 4.36Å; Y25-K29 PolarHBondContact O-N 2.89Å; K26-K29 PolarHBondContact O-N 3.47Å; K29-R32 PolarHBondContact O-N 3.26Å; K29-K33 PolarHBondContact O-N 3.45Å; K29-G68 WeakPolarHBondContact CA-O 3.28Å; K29-G68 PolarHBondContact N-O 2.76Å
30	F	90.3	Very high	92.3	Very high	51 Å²	51	63.3 Å²	63.3	22%	0.224	31%	0.305	C	S	.	.	H	α-helix	trans	-60.8	-48.8	175.2	166.3	-92.3	0	0	0	111.2	K26 L27 G28 R32 K33 R34 K283 V309	K26-F30 WeakPolarHBondContact O-CB 3.33Å; K26-F30 PolarHBondContact O-N 2.88Å; L27-F30 HydrophobicContact CD1-CD1 4.2Å; L27-F30 WeakPolarHBondContact O-CB 3.33Å; L27-F30 PolarHBondContact O-N 2.89Å; G28-F30 VanDerWaalsContact C-N 3.28Å; G28-F30 PolarHBondContact O-N 2.94Å; F30-R32 VanDerWaalsContact C-N 3.35Å; F30-R32 PolarHBondContact O-N 2.98Å; F30-K33 PolarHBondContact O-N 2.9Å; F30-R34 WeakPolarHBondContact O-CB 3.32Å; F30-R34 PolarHBondContact O-N 3.22Å; F30-K283 HydrophobicContact CD1-CD 3.97Å; F30-K283 HydrophobicContact CE1-CD 3.87Å; F30-K283 HydrophobicContact CG-CD 4.46Å; F30-K283 HydrophobicContact CZ-CD 4.27Å; F30-V309 HydrophobicContact CE1-CG2 3.95Å; F30-V309 HydrophobicContact CE2-CG2 4.08Å; F30-V309 HydrophobicContact CZ-CG2 3.24Å
31	I	92.3	Very high	92.5	Very high	20 Å²	20	64.7 Å²	64.7	10%	0.103	31%	0.313	C	S	.	.	H	α-helix	trans	-62.1	-43.1	177.2	-64.1	168	0	0	0	110.2	L27 G28 K33 R34 Y35 L69	L27-I31 HydrophobicContact CG-CD1 4.2Å; L27-I31 WeakPolarHBondContact O-CG1 3.45Å; L27-I31 PolarHBondContact O-N 3.43Å; G28-I31 PolarHBondContact O-N 2.96Å; I31-K33 VanDerWaalsContact C-N 3.34Å; I31-K33 PolarHBondContact O-N 2.92Å; I31-R34 PolarHBondContact O-N 3.35Å; I31-Y35 HydrophobicContact CG2-CD2 3.72Å; I31-Y35 HydrophobicContact CG2-CE2 4.12Å; I31-Y35 WeakPolarHBondContact O-CD2 3.35Å; I31-Y35 PolarHBondContact O-N 3.46Å; I31-L69 HydrophobicContact CB-CD1 3.93Å; I31-L69 HydrophobicContact CG2-CD1 3.55Å; I31-L69 HydrophobicContact CG2-CD2 4.3Å
32	R	93.6	Very high	92.6	Very high	39 Å²	39	62.1 Å²	62.1	15%	0.147	30%	0.302	C	S	.	.	H	α-helix	trans	-56.5	-45.8	176.1	-179.1	59.6	-100.5	-177.3	-10.2	112.7	G28 K29 F30 A36 L39 P40 L69	G28-R32 PolarHBondContact O-N 2.79Å; K29-R32 PolarHBondContact O-N 3.26Å; F30-R32 VanDerWaalsContact C-N 3.35Å; F30-R32 PolarHBondContact O-N 2.98Å; R32-A36 VanDerWaalsContact NH2-CA 3.29Å; R32-A36 PolarHBondContact NH2-O 3.44Å; R32-A36 WeakPolarHBondContact O-CA 3.46Å; R32-A36 PolarHBondContact O-N 3.36Å; R32-A36 VanDerWaalsContact O-N 3.15Å; R32-L39 PolarHBondContact NH2-O 3.31Å; R32-P40 PolarHBondContact NH1-O 2.93Å; R32-L69 HydrophobicContact CB-CD1 3.99Å; R32-L69 WeakPolarHBondContact CD-O 3.43Å
33	K	93.6	Very high	92.7	Very high	176 Å²	176	59.1 Å²	59.1	77%	0.765	29%	0.286	S	S	*	.	H	α-helix	trans	-65.6	-43.8	178.1	-176.1	177	178.7	178.7	0	110.9	K29 F30 I31 Y35	K29-K33 PolarHBondContact O-N 3.45Å; F30-K33 PolarHBondContact O-N 2.9Å; I31-K33 VanDerWaalsContact C-N 3.34Å; I31-K33 PolarHBondContact O-N 2.92Å; K33-Y35 PolarHBondContact O-N 2.92Å
34	R	89.6	Confident	92.8	Very high	93 Å²	93	61.2 Å²	61.2	35%	0.351	30%	0.298	S	S	.	.	H	α-helix	trans	-63.6	-41.1	-178.6	-178.7	174.2	175	82.9	3	112.7	F30 I31 E268	F30-R34 WeakPolarHBondContact O-CB 3.32Å; F30-R34 PolarHBondContact O-N 3.22Å; I31-R34 PolarHBondContact O-N 3.35Å; R34-E268 IonicContact CZ-OE1 3.04Å; R34-E268 IonicContact NE-OE1 2.82Å; R34-E268 PolarHBondContact NE-OE1 3.27Å; R34-E268 IonicContact NH2-OE1 2.99Å; R34-E268 PolarHBondContact NH2-OE1 3.41Å
35	Y	92.7	Very high	92.7	Very high	39 Å²	39	62.6 Å²	62.6	15%	0.153	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	29.1	-176.4	-58.9	-71.7	0	0	0	112.7	I31 K33 N37 F38 L39 I266 E268	I31-Y35 HydrophobicContact CG2-CD2 3.72Å; I31-Y35 HydrophobicContact CG2-CE2 4.12Å; I31-Y35 WeakPolarHBondContact O-CD2 3.35Å; I31-Y35 PolarHBondContact O-N 3.46Å; K33-Y35 PolarHBondContact O-N 2.92Å; Y35-N37 PolarHBondContact O-N 3.49Å; Y35-F38 PolarHBondContact O-N 3.5Å; Y35-L39 PolarHBondContact O-N 3.27Å; Y35-I266 HydrophobicContact CE2-CD1 4.44Å; Y35-I266 VanDerWaalsContact OH-CG2 3.31Å; Y35-I266 WeakPolarHBondContact OH-CG2 3.48Å; Y35-E268 HydrophobicContact CE1-CG 4.33Å; Y35-E268 WeakPolarHBondContact CE1-OE1 3.48Å; Y35-E268 PolarHBondContact OH-OE1 2.87Å
36	A	94.1	Very high	92.5	Very high	48 Å²	48	65.8 Å²	65.8	40%	0.397	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-40.6	-175.7	0	0	0	0	0	113	R32	R32-A36 VanDerWaalsContact NH2-CA 3.29Å; R32-A36 PolarHBondContact NH2-O 3.44Å; R32-A36 WeakPolarHBondContact O-CA 3.46Å; R32-A36 PolarHBondContact O-N 3.36Å; R32-A36 VanDerWaalsContact O-N 3.15Å
37	N	94.2	Very high	92.4	Very high	172 Å²	172	63.2 Å²	63.2	92%	0.92	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-11.9	-177.3	-61	-16.4	0	0	0	113.6	Y35	Y35-N37 PolarHBondContact O-N 3.49Å
38	F	92.7	Very high	92.5	Very high	101 Å²	101	63 Å²	63	44%	0.443	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-39.7	-177.7	176.7	-110.6	0	0	0	112.1	Y35 K232	Y35-F38 PolarHBondContact O-N 3.5Å; F38-K232 HydrophobicContact CE1-CB 3.84Å; F38-K232 HydrophobicContact CE1-CD 4.4Å; F38-K232 HydrophobicContact CE1-CG 4.38Å; F38-K232 HydrophobicContact CZ-CB 4.01Å; F38-K232 HydrophobicContact CZ-CD 4.28Å; F38-K232 HydrophobicContact CZ-CG 4.14Å; F38-K232 PolarHBondContact O-NZ 3.01Å
39	L	93.7	Very high	92.4	Very high	7 Å²	7	64.7 Å²	64.7	4%	0.037	33%	0.329	C	S	.	.	S	Bend	trans	-94.3	141.9	-178.4	-57.1	172.8	0	0	0	111.4	R32 Y35 L69 K232 I233	R32-L39 PolarHBondContact NH2-O 3.31Å; Y35-L39 PolarHBondContact O-N 3.27Å; L39-L69 HydrophobicContact CD1-CD1 4.03Å; L39-K232 HydrophobicContact CD2-CB 4.15Å; L39-I233 HydrophobicContact CD1-CD1 3.33Å; L39-I233 HydrophobicContact CD1-CG1 4.47Å; L39-I233 HydrophobicContact CD2-CD1 3.34Å; L39-I233 HydrophobicContact CD2-CG1 3.58Å; L39-I233 HydrophobicContact CG-CD1 3.9Å
40	P	92.4	Very high	92.5	Very high	47 Å²	47	60 Å²	60	31%	0.305	31%	0.309	S	S	.	.			trans	-59.9	149.9	168.9	28.2	-34.5	0	0	0	110.7	R32 A42 T47	R32-P40 PolarHBondContact NH1-O 2.93Å; P40-A42 VanDerWaalsContact C-N 3.34Å; P40-A42 WeakPolarHBondContact CG-O 3.39Å; P40-T47 HydrophobicContact CG-CG2 4.31Å
41	A	92.8	Very high	92.7	Very high	54 Å²	54	58 Å²	58	45%	0.446	30%	0.3	S	S	.	.	S	Bend	trans	-63.7	-40.5	177.4	0	0	0	0	0	111.9
42	A	93.2	Very high	92.8	Very high	9 Å²	9	57 Å²	57	7%	0.074	30%	0.295	C	S	.	.	S	Bend	trans	-84.2	149.9	173.1	0	0	0	0	0	112.8	P40 Q73 Y75	P40-A42 VanDerWaalsContact C-N 3.34Å; P40-A42 WeakPolarHBondContact CG-O 3.39Å; A42-Q73 HydrophobicContact CB-CG 3.82Å; A42-Y75 HydrophobicContact CB-CE2 4.36Å; A42-Y75 WeakPolarHBondContact CB-OH 3.34Å
43	Y	93.6	Very high	92.7	Very high	34 Å²	34	55.2 Å²	55.2	13%	0.133	29%	0.288	C	S	.	.			trans	-63.9	138.9	166.6	168	-107.7	0	0	0	110.4	A45 V48 F70 Q76 I87 P88	Y43-A45 HydrophobicContact CE1-CB 4.43Å; Y43-A45 WeakPolarHBondContact OH-CA 3.47Å; Y43-V48 HydrophobicContact CD2-CB 4.45Å; Y43-V48 HydrophobicContact CD2-CG2 4.4Å; Y43-V48 HydrophobicContact CE2-CB 4.12Å; Y43-F70 HydrophobicContact CD2-CD2 4.44Å; Y43-Q76 PolarHBondContact O-NE2 2.98Å; Y43-I87 HydrophobicContact CD1-CG1 4.15Å; Y43-I87 HydrophobicContact CD2-CD1 3.86Å; Y43-I87 HydrophobicContact CD2-CG1 4Å; Y43-I87 HydrophobicContact CD2-CG2 3.96Å; Y43-I87 HydrophobicContact CE1-CG1 4.42Å; Y43-I87 HydrophobicContact CE2-CB 4.49Å; Y43-I87 HydrophobicContact CE2-CG1 4.28Å; Y43-I87 HydrophobicContact CE2-CG2 3.53Å; Y43-I87 HydrophobicContact CG-CD1 3.9Å; Y43-I87 HydrophobicContact CG-CG1 3.94Å; Y43-P88 WeakPolarHBondContact OH-CD 3.48Å
44	N	91.3	Very high	92.5	Very high	75 Å²	75	49.3 Å²	49.3	40%	0.401	27%	0.265	S	S	.	.			trans	-138.1	127.8	171	-179.4	-22.6	0	0	0	108.6	K46 T47 V48	N44-K46 PolarHBondContact O-N 2.91Å; N44-K46 VanDerWaalsContact O-N 3.11Å; N44-K46 WeakPolarHBondContact OD1-CB 3.49Å; N44-K46 PolarHBondContact OD1-N 2.65Å; N44-T47 HydrophobicContact CB-CG2 4.04Å; N44-T47 PolarHBondContact O-N 3.14Å; N44-T47 PolarHBondContact O-OG1 3.38Å; N44-V48 PolarHBondContact O-N 2.91Å
45	A	90.5	Very high	92.4	Very high	62 Å²	62	48.8 Å²	48.8	51%	0.512	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-21.2	-179.3	0	0	0	0	0	113.8	Y43 F231	Y43-A45 HydrophobicContact CE1-CB 4.43Å; Y43-A45 WeakPolarHBondContact OH-CA 3.47Å; A45-F231 VanDerWaalsContact O-CE1 3.31Å; A45-F231 WeakPolarHBondContact O-CE1 3.2Å
46	K	89.7	Confident	92.3	Very high	167 Å²	167	53.4 Å²	53.4	73%	0.726	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-13.1	175.3	-62.7	-174.5	177.4	-174.9	0	113.8	N44 F231	N44-K46 PolarHBondContact O-N 2.91Å; N44-K46 VanDerWaalsContact O-N 3.11Å; N44-K46 WeakPolarHBondContact OD1-CB 3.49Å; N44-K46 PolarHBondContact OD1-N 2.65Å; K46-F231 WeakPolarHBondContact O-CD1 2.73Å
47	T	89.4	Confident	92.1	Very high	19 Å²	19	56 Å²	56	12%	0.117	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-17.9	-174.6	61.9	0	0	0	0	113.6	P40 N44 F231 K232 I233	P40-T47 HydrophobicContact CG-CG2 4.31Å; N44-T47 HydrophobicContact CB-CG2 4.04Å; N44-T47 PolarHBondContact O-N 3.14Å; N44-T47 PolarHBondContact O-OG1 3.38Å; T47-F231 CarbonylContact O-C 3.59Å; T47-K232 WeakPolarHBondContact O-CA 3.34Å; T47-K232 PolarHBondContact O-N 2.9Å; T47-I233 PolarHBondContact O-N 3.46Å
48	V	93.3	Very high	92	Very high	7 Å²	7	48.1 Å²	48.1	4%	0.042	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	130.4	-173.6	-174.7	0	0	0	0	110.3	Y43 N44 V50 L66 F70 I233	Y43-V48 HydrophobicContact CD2-CB 4.45Å; Y43-V48 HydrophobicContact CD2-CG2 4.4Å; Y43-V48 HydrophobicContact CE2-CB 4.12Å; N44-V48 PolarHBondContact O-N 2.91Å; V48-V50 HydrophobicContact CG1-CG2 3.83Å; V48-L66 HydrophobicContact CG1-CD2 4.4Å; V48-F70 HydrophobicContact CB-CE2 4.41Å; V48-F70 HydrophobicContact CG1-CE2 4.15Å; V48-F70 HydrophobicContact CG2-CE1 4.24Å; V48-F70 HydrophobicContact CG2-CE2 3.52Å; V48-F70 HydrophobicContact CG2-CZ 3.28Å; V48-I233 WeakPolarHBondContact CA-O 3.27Å; V48-I233 HydrophobicContact CG1-CG2 4.46Å
49	H	94	Very high	92.1	Very high	37 Å²	37	45.1 Å²	45.1	17%	0.171	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	134.6	166.8	-175.2	93.9	0	0	0	110	H90 F231 I233 Y234 A235	H49-H90 AromaticContact CE1-CD2 3.27Å; H49-H90 PolarHBondContact CE1-CD2 2.98Å; H49-H90 AromaticContact CE1-NE2 3.7Å; H49-H90 AromaticContact ND1-CD2 3.8Å; H49-H90 AromaticContact ND1-NE2 3.95Å; H49-H90 AromaticContact NE2-CD2 3.75Å; H49-F231 HydrophobicContact CB-CD1 4.04Å; H49-F231 HydrophobicContact CB-CD2 3.63Å; H49-F231 HydrophobicContact CB-CE1 4.13Å; H49-F231 HydrophobicContact CB-CE2 3.71Å; H49-F231 HydrophobicContact CB-CG 3.81Å; H49-F231 HydrophobicContact CB-CZ 3.97Å; H49-I233 PolarHBondContact N-O 3.37Å; H49-Y234 HydrophobicContact CB-CD2 3.75Å; H49-Y234 HydrophobicContact CB-CE2 3.76Å; H49-Y234 AromaticContact CD2-CD2 3.8Å; H49-Y234 AromaticContact CD2-CE1 3.79Å; H49-Y234 AromaticContact CD2-CE2 3.02Å; H49-Y234 WeakPolarHBondContact CD2-CE2 3.5Å; H49-Y234 AromaticContact CD2-CZ 3.05Å; H49-Y234 PolarHBondContact CD2-OH 3.29Å; H49-Y234 AromaticContact CG-CE2 3.47Å; H49-Y234 VanDerWaalsContact CG-CE2 3.47Å; H49-Y234 AromaticContact CG-CZ 3.98Å; H49-Y234 AromaticContact NE2-CE2 3.76Å; H49-Y234 AromaticContact NE2-CZ 3.54Å; H49-Y234 PolarHBondContact NE2-OH 3.46Å; H49-Y234 WeakPolarHBondContact O-CA 3.49Å; H49-A235 PolarHBondContact O-N 2.8Å
50	V	96.1	Very high	92.1	Very high	4 Å²	4	47.9 Å²	47.9	2%	0.024	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	129.5	-177.8	-172.2	0	0	0	0	110.1	V48 A62 L66 V89 H90 A235	V48-V50 HydrophobicContact CG1-CG2 3.83Å; V50-A62 HydrophobicContact CG1-CB 4.18Å; V50-L66 HydrophobicContact CB-CD1 4.33Å; V50-L66 HydrophobicContact CG1-CD1 4.29Å; V50-L66 HydrophobicContact CG2-CD1 3.91Å; V50-L66 HydrophobicContact CG2-CD2 3.73Å; V50-L66 HydrophobicContact CG2-CG 4.29Å; V50-V89 HydrophobicContact CB-CG2 4.39Å; V50-V89 HydrophobicContact CG1-CG1 4.28Å; V50-V89 HydrophobicContact CG1-CG2 4.1Å; V50-H90 PolarHBondContact O-CD2 3.2Å; V50-H90 PolarHBondContact O-N 3.23Å; V50-A235 WeakPolarHBondContact CA-O 3.45Å; V50-A235 HydrophobicContact CG1-CB 4.19Å; V50-A235 HydrophobicContact CG2-CB 4.17Å
51	R	94.3	Very high	92.3	Very high	7 Å²	7	46.7 Å²	46.7	3%	0.026	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	136.7	176.8	-172.4	178.9	169	-172	-8.4	110.4	H90 F92 R103 L107 Y234 A235 Y236 S237	R51-H90 CarbonylContact C-O 3.24Å; R51-H90 VanDerWaalsContact CA-O 3.24Å; R51-H90 WeakPolarHBondContact CA-O 3.47Å; R51-F92 VanDerWaalsContact CZ-CE2 3.48Å; R51-F92 VanDerWaalsContact NH2-CD2 3.29Å; R51-R103 PolarHBondContact NH2-O 2.69Å; R51-L107 HydrophobicContact CB-CD1 4.41Å; R51-L107 HydrophobicContact CG-CD1 3.86Å; R51-Y234 HydrophobicContact CB-CE1 4.44Å; R51-A235 PolarHBondContact N-O 2.9Å; R51-Y236 HydrophobicContact CB-CD1 4.39Å; R51-Y236 CarbonylContact O-C 3.58Å; R51-Y236 VanDerWaalsContact O-CA 3.29Å; R51-Y236 WeakPolarHBondContact O-CA 3.05Å; R51-S237 PolarHBondContact O-N 3.38Å
52	S	94.2	Very high	92.5	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.007	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	155.6	177.8	-170.5	0	0	0	0	110.7	T58 I59 H90 S91 S237	S52-T58 VanDerWaalsContact OG-C 3.29Å; S52-T58 WeakPolarHBondContact OG-CB 3.32Å; S52-T58 PolarHBondContact OG-OG1 3.43Å; S52-I59 PolarHBondContact OG-N 2.99Å; S52-H90 PolarHBondContact N-O 2.68Å; S52-S91 WeakPolarHBondContact O-CA 2.91Å; S52-S237 CarbonylContact C-O 3.48Å; S52-S237 WeakPolarHBondContact CA-O 3.04Å
53	T	91.6	Very high	92.6	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	157.6	155.5	56.6	0	0	0	0	109.9	Y55 T58 L107 H108 S237 H239	T53-Y55 PolarHBondContact O-N 3.29Å; T53-T58 PolarHBondContact O-OG1 2.83Å; T53-T58 WeakPolarHBondContact OG1-CB 3.31Å; T53-T58 WeakPolarHBondContact OG1-CG2 3.34Å; T53-T58 PolarHBondContact OG1-OG1 3.5Å; T53-L107 HydrophobicContact CG2-CB 3.49Å; T53-L107 VanDerWaalsContact CG2-CB 3.49Å; T53-H108 WeakPolarHBondContact CB-NE2 3.35Å; T53-S237 PolarHBondContact N-O 3.03Å; T53-H239 PolarHBondContact OG1-NE2 3.19Å
54	D	88.3	Confident	92.7	Very high	53 Å²	53	45.9 Å²	45.9	28%	0.283	23%	0.234	S	C	.	.	S	Bend	trans	-86.3	58.4	-179.1	-160.3	41.5	0	0	0	112.4	S91 F92 P93 G94	D54-S91 PolarHBondContact OD1-OG 3.12Å; D54-F92 VanDerWaalsContact CB-O 3.25Å; D54-F92 WeakPolarHBondContact CB-O 3.1Å; D54-P93 WeakPolarHBondContact OD2-CA 3.39Å; D54-G94 PolarHBondContact OD2-N 2.97Å
55	Y	87.9	Confident	93	Very high	82 Å²	82	43.4 Å²	43.4	32%	0.322	22%	0.221	S	C	.	.			trans	-119.9	136.3	168.1	-72.5	-83	0	0	0	108.8	T53 R57 T58 I59 H239	T53-Y55 PolarHBondContact O-N 3.29Å; Y55-R57 PolarHBondContact O-N 2.88Å; Y55-T58 PolarHBondContact O-N 3.28Å; Y55-T58 PolarHBondContact O-OG1 3.47Å; Y55-I59 PolarHBondContact O-N 3.46Å; Y55-I59 VanDerWaalsContact O-N 3.09Å; Y55-H239 AromaticContact CD2-CE1 3.4Å; Y55-H239 VanDerWaalsContact CD2-CE1 3.4Å; Y55-H239 WeakPolarHBondContact CD2-CE1 3.41Å; Y55-H239 AromaticContact CD2-NE2 3.4Å; Y55-H239 WeakPolarHBondContact CD2-NE2 3.25Å; Y55-H239 AromaticContact CE2-CE1 3.74Å; Y55-H239 AromaticContact CE2-NE2 3.58Å
56	N	90.4	Very high	93.3	Very high	135 Å²	135	40.7 Å²	40.7	72%	0.722	20%	0.198	S	C	*	.	H	α-helix	trans	-48.5	-43.4	178.1	-71.9	-18.4	0	0	0	112.3	T58 M60	N56-T58 PolarHBondContact O-N 3.3Å; N56-M60 VanDerWaalsContact O-CB 3.29Å; N56-M60 WeakPolarHBondContact O-CB 3.43Å; N56-M60 WeakPolarHBondContact O-CG 3.25Å; N56-M60 PolarHBondContact O-N 2.8Å
57	R	90.1	Very high	93.6	Very high	104 Å²	104	34 Å²	34	39%	0.392	17%	0.174	S	C	.	.	H	α-helix	trans	-62.6	-39.3	179.5	66.7	-174.5	177.4	-75.3	-4.6	113.7	Y55 S61 H239	Y55-R57 PolarHBondContact O-N 2.88Å; R57-S61 VanDerWaalsContact O-CB 3.29Å; R57-S61 WeakPolarHBondContact O-CB 3.39Å; R57-S61 PolarHBondContact O-N 2.92Å; R57-S61 PolarHBondContact O-OG 3.41Å; R57-H239 PolarHBondContact NH2-CE1 3.21Å
58	T	92.5	Very high	93.9	Very high	6 Å²	6	33.1 Å²	33.1	4%	0.037	17%	0.168	C	C	.	.	H	α-helix	trans	-77.3	-39.4	-178.1	54	0	0	0	0	111.2	S52 T53 Y55 N56 S61 A62 S237 G238	S52-T58 VanDerWaalsContact OG-C 3.29Å; S52-T58 WeakPolarHBondContact OG-CB 3.32Å; S52-T58 PolarHBondContact OG-OG1 3.43Å; T53-T58 PolarHBondContact O-OG1 2.83Å; T53-T58 WeakPolarHBondContact OG1-CB 3.31Å; T53-T58 WeakPolarHBondContact OG1-CG2 3.34Å; T53-T58 PolarHBondContact OG1-OG1 3.5Å; Y55-T58 PolarHBondContact O-N 3.28Å; Y55-T58 PolarHBondContact O-OG1 3.47Å; N56-T58 PolarHBondContact O-N 3.3Å; T58-S61 WeakPolarHBondContact O-CB 3.45Å; T58-S61 PolarHBondContact O-N 2.85Å; T58-A62 PolarHBondContact O-N 2.95Å; T58-S237 PolarHBondContact O-OG 2.99Å; T58-S237 VanDerWaalsContact O-OG 3.08Å; T58-G238 WeakPolarHBondContact CG2-O 3.4Å
59	I	94.5	Very high	94	Very high	38 Å²	38	33 Å²	33	20%	0.195	17%	0.167	C	C	.	.	H	α-helix	trans	-62.4	-46.7	174.3	-62.9	171.7	0	0	0	110.5	S52 Y55 S61 A62 L63	S52-I59 PolarHBondContact OG-N 2.99Å; Y55-I59 PolarHBondContact O-N 3.46Å; Y55-I59 VanDerWaalsContact O-N 3.09Å; I59-S61 VanDerWaalsContact C-N 3.34Å; I59-S61 PolarHBondContact O-N 3.5Å; I59-A62 WeakPolarHBondContact O-CB 3.49Å; I59-A62 PolarHBondContact O-N 2.9Å; I59-L63 HydrophobicContact CG2-CD1 4.04Å; I59-L63 WeakPolarHBondContact O-CG 3.28Å; I59-L63 PolarHBondContact O-N 3.2Å
60	M	94.9	Very high	94	Very high	65 Å²	65	31.3 Å²	31.3	32%	0.32	16%	0.16	S	C	.	.	H	α-helix	trans	-63.4	-39.7	177.1	-71.8	-178.8	69.3	0	0	112.3	L17 I21 N56 L63 A64	L17-M60 HydrophobicContact CD1-CE 4Å; L17-M60 HydrophobicContact CD1-SD 3.92Å; L17-M60 HydrophobicContact CD2-CE 3.48Å; L17-M60 VanDerWaalsContact CD2-CE 3.48Å; L17-M60 HydrophobicContact CD2-SD 3.82Å; L17-M60 HydrophobicContact CG-CE 3.72Å; L17-M60 HydrophobicContact CG-SD 4.21Å; I21-M60 HydrophobicContact CD1-CE 3.7Å; I21-M60 HydrophobicContact CG1-CE 4.37Å; N56-M60 VanDerWaalsContact O-CB 3.29Å; N56-M60 WeakPolarHBondContact O-CB 3.43Å; N56-M60 WeakPolarHBondContact O-CG 3.25Å; N56-M60 PolarHBondContact O-N 2.8Å; M60-L63 PolarHBondContact O-N 3.32Å; M60-A64 WeakPolarHBondContact O-CB 3.47Å; M60-A64 PolarHBondContact O-N 3.38Å
61	S	94.9	Very high	93.9	Very high	21 Å²	21	33.7 Å²	33.7	15%	0.147	18%	0.175	C	C	.	.	H	α-helix	trans	-58.9	-44.7	172.2	-79.7	0	0	0	0	112.5	H24 R57 T58 I59 N65	H24-S61 WeakPolarHBondContact CB-O 3.01Å; H24-S61 VanDerWaalsContact CD2-CB 3.41Å; H24-S61 WeakPolarHBondContact CD2-CB 3.23Å; H24-S61 PolarHBondContact CD2-OG 2.65Å; H24-S61 VanDerWaalsContact NE2-CB 3.33Å; H24-S61 WeakPolarHBondContact NE2-CB 3.28Å; H24-S61 PolarHBondContact NE2-OG 3.35Å; R57-S61 VanDerWaalsContact O-CB 3.29Å; R57-S61 WeakPolarHBondContact O-CB 3.39Å; R57-S61 PolarHBondContact O-N 2.92Å; R57-S61 PolarHBondContact O-OG 3.41Å; T58-S61 WeakPolarHBondContact O-CB 3.45Å; T58-S61 PolarHBondContact O-N 2.85Å; I59-S61 VanDerWaalsContact C-N 3.34Å; I59-S61 PolarHBondContact O-N 3.5Å; S61-N65 WeakPolarHBondContact O-CB 3.31Å; S61-N65 PolarHBondContact O-N 2.71Å
62	A	96.8	Very high	93.7	Very high	7 Å²	7	34.5 Å²	34.5	6%	0.058	18%	0.18	C	C	.	.	H	α-helix	trans	-62.5	-47	176.6	0	0	0	0	0	111.6	V50 T58 I59 N65 L66 V89	V50-A62 HydrophobicContact CG1-CB 4.18Å; T58-A62 PolarHBondContact O-N 2.95Å; I59-A62 WeakPolarHBondContact O-CB 3.49Å; I59-A62 PolarHBondContact O-N 2.9Å; A62-N65 WeakPolarHBondContact O-CB 3.29Å; A62-N65 PolarHBondContact O-N 3.47Å; A62-L66 WeakPolarHBondContact O-CB 3.44Å; A62-L66 WeakPolarHBondContact O-CD1 3.29Å; A62-L66 VanDerWaalsContact O-CG 3.25Å; A62-L66 WeakPolarHBondContact O-CG 3.2Å; A62-L66 PolarHBondContact O-N 3.08Å; A62-V89 HydrophobicContact CB-CG1 3.96Å; A62-V89 HydrophobicContact CB-CG2 3.95Å
63	L	97	Very high	93.5	Very high	63 Å²	63	37.1 Å²	37.1	33%	0.33	19%	0.192	S	C	.	.	H	α-helix	trans	-61.8	-44.6	178.1	-69	169.6	0	0	0	112.2	I59 M60 N65 L66 A67 V89	I59-L63 HydrophobicContact CG2-CD1 4.04Å; I59-L63 WeakPolarHBondContact O-CG 3.28Å; I59-L63 PolarHBondContact O-N 3.2Å; M60-L63 PolarHBondContact O-N 3.32Å; L63-N65 VanDerWaalsContact C-N 3.33Å; L63-N65 PolarHBondContact O-N 2.83Å; L63-L66 PolarHBondContact O-N 2.69Å; L63-A67 PolarHBondContact O-N 2.83Å; L63-V89 HydrophobicContact CD2-CG2 3.76Å; L63-V89 HydrophobicContact CG-CG2 4.13Å
64	A	95.8	Very high	93.3	Very high	11 Å²	11	42.2 Å²	42.2	9%	0.091	23%	0.227	C	C	.	.	H	α-helix	trans	-62.7	-40.8	176.6	0	0	0	0	0	111.9	I21 H24 Y25 M60 A67 G68	I21-A64 HydrophobicContact CB-CB 4.32Å; I21-A64 HydrophobicContact CG2-CB 3.87Å; H24-A64 HydrophobicContact CB-CB 3.92Å; Y25-A64 WeakPolarHBondContact CA-O 3.49Å; M60-A64 WeakPolarHBondContact O-CB 3.47Å; M60-A64 PolarHBondContact O-N 3.38Å; A64-A67 PolarHBondContact O-N 3.24Å; A64-G68 PolarHBondContact O-N 2.85Å
65	N	96.1	Very high	93.3	Very high	22 Å²	22	47.7 Å²	47.7	12%	0.118	25%	0.245	C	C	.	.	H	α-helix	trans	-62.3	-45.4	174.4	-170.5	-88.2	0	0	0	111.8	H24 L27 G28 S61 A62 L63 A67 G68 L69	H24-N65 HydrophobicContact CB-CB 4.33Å; H24-N65 VanDerWaalsContact O-CA 3.28Å; H24-N65 WeakPolarHBondContact O-CA 3.25Å; H24-N65 PolarHBondContact O-ND2 3.14Å; L27-N65 WeakPolarHBondContact CG-ND2 3.03Å; G28-N65 VanDerWaalsContact CA-O 3.27Å; G28-N65 WeakPolarHBondContact CA-O 3.35Å; G28-N65 PolarHBondContact N-ND2 2.94Å; G28-N65 VanDerWaalsContact N-ND2 3.15Å; S61-N65 WeakPolarHBondContact O-CB 3.31Å; S61-N65 PolarHBondContact O-N 2.71Å; A62-N65 WeakPolarHBondContact O-CB 3.29Å; A62-N65 PolarHBondContact O-N 3.47Å; L63-N65 VanDerWaalsContact C-N 3.33Å; L63-N65 PolarHBondContact O-N 2.83Å; N65-A67 VanDerWaalsContact C-N 3.33Å; N65-A67 PolarHBondContact O-N 3.25Å; N65-G68 PolarHBondContact O-N 2.66Å; N65-G68 VanDerWaalsContact O-N 3.1Å; N65-L69 WeakPolarHBondContact O-CB 3.3Å; N65-L69 PolarHBondContact O-N 2.85Å
66	L	97.4	Very high	93.4	Very high	6 Å²	6	46.2 Å²	46.2	3%	0.031	24%	0.242	C	C	.	.	H	α-helix	trans	-63.5	-37.5	178.6	-72.2	164	0	0	0	112.6	V48 V50 A62 L63 G68 L69 F70 I87 V89	V48-L66 HydrophobicContact CG1-CD2 4.4Å; V50-L66 HydrophobicContact CB-CD1 4.33Å; V50-L66 HydrophobicContact CG1-CD1 4.29Å; V50-L66 HydrophobicContact CG2-CD1 3.91Å; V50-L66 HydrophobicContact CG2-CD2 3.73Å; V50-L66 HydrophobicContact CG2-CG 4.29Å; A62-L66 WeakPolarHBondContact O-CB 3.44Å; A62-L66 WeakPolarHBondContact O-CD1 3.29Å; A62-L66 VanDerWaalsContact O-CG 3.25Å; A62-L66 WeakPolarHBondContact O-CG 3.2Å; A62-L66 PolarHBondContact O-N 3.08Å; L63-L66 PolarHBondContact O-N 2.69Å; L66-G68 VanDerWaalsContact C-N 3.26Å; L66-G68 PolarHBondContact O-N 3.01Å; L66-L69 PolarHBondContact O-N 2.95Å; L66-L69 VanDerWaalsContact O-N 3.17Å; L66-F70 HydrophobicContact CD2-CD2 4.27Å; L66-F70 HydrophobicContact CD2-CE2 4.38Å; L66-F70 PolarHBondContact O-N 3.2Å; L66-I87 HydrophobicContact CB-CB 4.37Å; L66-I87 HydrophobicContact CB-CD1 4.15Å; L66-I87 HydrophobicContact CD1-CB 4.05Å; L66-I87 HydrophobicContact CD1-CG2 3.82Å; L66-I87 HydrophobicContact CD2-CG2 4.07Å; L66-I87 HydrophobicContact CG-CG2 4.38Å; L66-V89 HydrophobicContact CD1-CG2 3.59Å
67	A	95.8	Very high	93.3	Very high	26 Å²	26	45.5 Å²	45.5	22%	0.215	23%	0.229	C	C	.	.	H	α-helix	trans	-61.2	-35.3	174.1	0	0	0	0	0	112.2	Y25 L63 A64 N65	Y25-A67 HydrophobicContact CD2-CB 4.19Å; Y25-A67 HydrophobicContact CE2-CB 4.34Å; L63-A67 PolarHBondContact O-N 2.83Å; A64-A67 PolarHBondContact O-N 3.24Å; N65-A67 VanDerWaalsContact C-N 3.33Å; N65-A67 PolarHBondContact O-N 3.25Å
68	G	95.2	Very high	93.4	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-78.6	-30.1	174.2	0	0	0	0	0	113.7	Y25 G28 K29 A64 N65 L66	Y25-G68 VanDerWaalsContact CD2-CA 3.45Å; Y25-G68 VanDerWaalsContact CD2-N 3.34Å; G28-G68 VanDerWaalsContact C-C 3.45Å; G28-G68 CarbonylContact C-O 3.12Å; K29-G68 WeakPolarHBondContact CA-O 3.28Å; K29-G68 PolarHBondContact N-O 2.76Å; A64-G68 PolarHBondContact O-N 2.85Å; N65-G68 PolarHBondContact O-N 2.66Å; N65-G68 VanDerWaalsContact O-N 3.1Å; L66-G68 VanDerWaalsContact C-N 3.26Å; L66-G68 PolarHBondContact O-N 3.01Å
69	L	95.4	Very high	93.4	Very high	5 Å²	5	49 Å²	49	3%	0.026	25%	0.247	C	C	.	.	H	α-helix	trans	-78.7	-37.8	-178.2	-178.4	56.2	0	0	0	112.8	I31 R32 L39 N65 L66 P71 I233	I31-L69 HydrophobicContact CB-CD1 3.93Å; I31-L69 HydrophobicContact CG2-CD1 3.55Å; I31-L69 HydrophobicContact CG2-CD2 4.3Å; R32-L69 HydrophobicContact CB-CD1 3.99Å; R32-L69 WeakPolarHBondContact CD-O 3.43Å; L39-L69 HydrophobicContact CD1-CD1 4.03Å; N65-L69 WeakPolarHBondContact O-CB 3.3Å; N65-L69 PolarHBondContact O-N 2.85Å; L66-L69 PolarHBondContact O-N 2.95Å; L66-L69 VanDerWaalsContact O-N 3.17Å; L69-P71 VanDerWaalsContact C-CD 3.48Å; L69-P71 WeakPolarHBondContact O-CD 3.3Å; L69-I233 HydrophobicContact CD2-CD1 4.29Å
70	F	95.4	Very high	93.2	Very high	2 Å²	2	55.1 Å²	55.1	1%	0.009	27%	0.274	C	S	.	.	S	Bend	trans	-124.3	74.7	-179.6	-65.4	-72.8	0	0	0	111.7	Y43 V48 L66 L72 I87	Y43-F70 HydrophobicContact CD2-CD2 4.44Å; V48-F70 HydrophobicContact CB-CE2 4.41Å; V48-F70 HydrophobicContact CG1-CE2 4.15Å; V48-F70 HydrophobicContact CG2-CE1 4.24Å; V48-F70 HydrophobicContact CG2-CE2 3.52Å; V48-F70 HydrophobicContact CG2-CZ 3.28Å; L66-F70 HydrophobicContact CD2-CD2 4.27Å; L66-F70 HydrophobicContact CD2-CE2 4.38Å; L66-F70 PolarHBondContact O-N 3.2Å; F70-L72 PolarHBondContact O-N 3.48Å; F70-I87 HydrophobicContact CB-CD1 3.74Å; F70-I87 HydrophobicContact CD2-CD1 3.85Å; F70-I87 HydrophobicContact CG-CD1 4.12Å
71	P	93	Very high	93	Very high	54 Å²	54	59 Å²	59	35%	0.351	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-54	140.1	171.3	-22.8	33.2	0	0	0	111.2	L69 Q73	L69-P71 VanDerWaalsContact C-CD 3.48Å; L69-P71 WeakPolarHBondContact O-CD 3.3Å; P71-Q73 PolarHBondContact O-N 2.97Å; P71-Q73 PolarHBondContact O-NE2 3.23Å
72	L	91.3	Very high	92.8	Very high	23 Å²	23	59.7 Å²	59.7	12%	0.12	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-59.7	119.9	-179.4	-167.9	64.7	0	0	0	110.5	F70 Q76 R77 V82 T83 Q85	F70-L72 PolarHBondContact O-N 3.48Å; L72-Q76 HydrophobicContact CD1-CB 4.13Å; L72-Q76 WeakPolarHBondContact CD1-O 3.41Å; L72-R77 HydrophobicContact CD2-CB 4.27Å; L72-R77 HydrophobicContact CD2-CG 3.99Å; L72-V82 WeakPolarHBondContact CD2-O 3.34Å; L72-T83 WeakPolarHBondContact CB-O 3.42Å; L72-Q85 HydrophobicContact CD1-CB 3.82Å; L72-Q85 HydrophobicContact CD1-CG 4.18Å
73	Q	89.7	Confident	92.4	Very high	56 Å²	56	64.3 Å²	64.3	26%	0.262	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-80.5	153.3	174.5	-57.5	-56.4	-66.3	0	0	110.2	A42 P71 Y75 Q76 R77	A42-Q73 HydrophobicContact CB-CG 3.82Å; P71-Q73 PolarHBondContact O-N 2.97Å; P71-Q73 PolarHBondContact O-NE2 3.23Å; Q73-Y75 VanDerWaalsContact C-N 3.28Å; Q73-Y75 HydrophobicContact CB-CD1 3.96Å; Q73-Y75 HydrophobicContact CB-CE1 3.64Å; Q73-Y75 HydrophobicContact CG-CE1 4.22Å; Q73-Y75 PolarHBondContact O-N 3.3Å; Q73-Q76 CarbonylContact O-C 3.59Å; Q73-Q76 PolarHBondContact O-N 2.64Å; Q73-R77 PolarHBondContact O-N 3.39Å; Q73-R77 VanDerWaalsContact O-N 3.16Å
74	S	87.4	Confident	92.1	Very high	107 Å²	107	67 Å²	67	75%	0.748	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-53.4	-42.7	-176.7	51.4	0	0	0	0	113.2	Q76 R77	S74-Q76 VanDerWaalsContact C-N 3.35Å; S74-R77 WeakPolarHBondContact O-CB 3.42Å; S74-R77 PolarHBondContact O-N 2.69Å
75	Y	88.9	Confident	91.9	Very high	168 Å²	168	67.6 Å²	67.6	66%	0.659	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-79.6	-12	180	66.4	-90.9	0	0	0	114.5	A42 Q73	A42-Y75 HydrophobicContact CB-CE2 4.36Å; A42-Y75 WeakPolarHBondContact CB-OH 3.34Å; Q73-Y75 VanDerWaalsContact C-N 3.28Å; Q73-Y75 HydrophobicContact CB-CD1 3.96Å; Q73-Y75 HydrophobicContact CB-CE1 3.64Å; Q73-Y75 HydrophobicContact CG-CE1 4.22Å; Q73-Y75 PolarHBondContact O-N 3.3Å
76	Q	88.3	Confident	91.8	Very high	52 Å²	52	70.6 Å²	70.6	24%	0.243	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-97.4	1.5	171.3	-63.1	-172	-55.1	0	0	111.5	Y43 L72 Q73 S74 W78	Y43-Q76 PolarHBondContact O-NE2 2.98Å; L72-Q76 HydrophobicContact CD1-CB 4.13Å; L72-Q76 WeakPolarHBondContact CD1-O 3.41Å; Q73-Q76 CarbonylContact O-C 3.59Å; Q73-Q76 PolarHBondContact O-N 2.64Å; S74-Q76 VanDerWaalsContact C-N 3.35Å; Q76-W78 PolarHBondContact O-N 3.39Å
77	R	89.8	Confident	91.7	Very high	120 Å²	120	70.7 Å²	70.7	45%	0.453	36%	0.355	S	S	.	.			trans	-68.2	116.9	-176.5	-168.2	177.9	-165.8	95.8	-2.9	110.1	L72 Q73 S74 S79 E80	L72-R77 HydrophobicContact CD2-CB 4.27Å; L72-R77 HydrophobicContact CD2-CG 3.99Å; Q73-R77 PolarHBondContact O-N 3.39Å; Q73-R77 VanDerWaalsContact O-N 3.16Å; S74-R77 WeakPolarHBondContact O-CB 3.42Å; S74-R77 PolarHBondContact O-N 2.69Å; R77-S79 VanDerWaalsContact CG-O 3.29Å; R77-S79 WeakPolarHBondContact CG-O 3.36Å; R77-S79 PolarHBondContact NE-O 3.4Å; R77-E80 PolarHBondContact NH2-O 3.04Å
78	W	90.7	Very high	91.7	Very high	149 Å²	149	72.6 Å²	72.6	56%	0.564	37%	0.365	S	S	*	.			trans	-105.7	-9.3	-178	62.7	-90	0	0	0	113.2	Q76 V82 W84	Q76-W78 PolarHBondContact O-N 3.39Å; W78-V82 HydrophobicContact CH2-CB 3.99Å; W78-V82 HydrophobicContact CH2-CG1 3.99Å; W78-V82 HydrophobicContact CH2-CG2 3.87Å; W78-V82 HydrophobicContact CZ2-CB 3.78Å; W78-V82 HydrophobicContact CZ2-CG1 3.47Å; W78-V82 VanDerWaalsContact CZ2-CG1 3.47Å; W78-V82 HydrophobicContact CZ2-CG2 4.19Å; W78-W84 PolarHBondContact NE1-O 2.93Å
79	S	92.3	Very high	91.7	Very high	35 Å²	35	74 Å²	74	25%	0.245	37%	0.374	C	S	.	.			trans	-147.3	145	178.6	172.5	0	0	0	0	110.7	R77 N81 V82	R77-S79 VanDerWaalsContact CG-O 3.29Å; R77-S79 WeakPolarHBondContact CG-O 3.36Å; R77-S79 PolarHBondContact NE-O 3.4Å; S79-N81 VanDerWaalsContact C-N 3.31Å; S79-N81 PolarHBondContact OG-N 3.1Å; S79-V82 PolarHBondContact OG-N 3.18Å
80	E	90.5	Very high	91.7	Very high	165 Å²	165	78.1 Å²	78.1	77%	0.771	39%	0.393	S	S	*	.	S	Bend	trans	-67.5	-32	176.5	-66.3	-175.2	173.2	0	0	112.5	R77	R77-E80 PolarHBondContact NH2-O 3.04Å
81	N	92.5	Very high	91.4	Very high	146 Å²	146	80.2 Å²	80.2	78%	0.781	41%	0.408	S	S	*	.	S	Bend	trans	-105.7	-15.9	-172.8	-66.9	-30.1	0	0	0	113.7	S79	S79-N81 VanDerWaalsContact C-N 3.31Å; S79-N81 PolarHBondContact OG-N 3.1Å
82	V	90.2	Very high	91	Very high	36 Å²	36	79.8 Å²	79.8	22%	0.218	40%	0.401	C	S	.	.			trans	-97.2	119.8	-178.4	-172.3	0	0	0	0	110.6	L72 W78 S79 W84	L72-V82 WeakPolarHBondContact CD2-O 3.34Å; W78-V82 HydrophobicContact CH2-CB 3.99Å; W78-V82 HydrophobicContact CH2-CG1 3.99Å; W78-V82 HydrophobicContact CH2-CG2 3.87Å; W78-V82 HydrophobicContact CZ2-CB 3.78Å; W78-V82 HydrophobicContact CZ2-CG1 3.47Å; W78-V82 VanDerWaalsContact CZ2-CG1 3.47Å; W78-V82 HydrophobicContact CZ2-CG2 4.19Å; S79-V82 PolarHBondContact OG-N 3.18Å; V82-W84 HydrophobicContact CG1-CG 4.12Å; V82-W84 VanDerWaalsContact CG1-NE1 3.35Å
83	T	87.6	Confident	90.2	Very high	105 Å²	105	83 Å²	83	64%	0.644	42%	0.423	S	S	*	.			trans	-97.1	5.8	-174.4	55.3	0	0	0	0	114.3	L72	L72-T83 WeakPolarHBondContact CB-O 3.42Å
84	W	91.2	Very high	88.9	Confident	120 Å²	120	82.1 Å²	82.1	46%	0.455	43%	0.428	S	S	.	.			trans	-125.1	166.3	178.7	76.3	-78.1	0	0	0	110.8	W78 V82 P86	W78-W84 PolarHBondContact NE1-O 2.93Å; V82-W84 HydrophobicContact CG1-CG 4.12Å; V82-W84 VanDerWaalsContact CG1-NE1 3.35Å; W84-P86 HydrophobicContact CH2-CG 4.16Å; W84-P86 HydrophobicContact CZ3-CB 4.34Å; W84-P86 HydrophobicContact CZ3-CG 4.27Å
85	Q	92.1	Very high	87.1	Confident	22 Å²	22	84.2 Å²	84.2	10%	0.103	43%	0.426	C	S	.	.			trans	-124.5	142.6	172.5	53.1	-172.9	-37.2	0	0	110.7	L72 I87	L72-Q85 HydrophobicContact CD1-CB 3.82Å; L72-Q85 HydrophobicContact CD1-CG 4.18Å; Q85-I87 HydrophobicContact CG-CD1 4.28Å; Q85-I87 HydrophobicContact CG-CG1 4.17Å; Q85-I87 PolarHBondContact O-N 3.16Å
86	P	92.9	Very high	85.1	Confident	85 Å²	85	82.8 Å²	82.8	55%	0.552	43%	0.43	S	S	*	.			trans	-57.2	127.7	167	-22.3	33.7	0	0	0	110.8	W84	W84-P86 HydrophobicContact CH2-CG 4.16Å; W84-P86 HydrophobicContact CZ3-CB 4.34Å; W84-P86 HydrophobicContact CZ3-CG 4.27Å
87	I	95.4	Very high	82.9	Confident	9 Å²	9	85.6 Å²	85.6	5%	0.046	45%	0.447	C	S	.	.			trans	-124.7	128.7	172.2	-64.7	173.7	0	0	0	107.4	Y43 L66 F70 Q85 V89	Y43-I87 HydrophobicContact CD1-CG1 4.15Å; Y43-I87 HydrophobicContact CD2-CD1 3.86Å; Y43-I87 HydrophobicContact CD2-CG1 4Å; Y43-I87 HydrophobicContact CD2-CG2 3.96Å; Y43-I87 HydrophobicContact CE1-CG1 4.42Å; Y43-I87 HydrophobicContact CE2-CB 4.49Å; Y43-I87 HydrophobicContact CE2-CG1 4.28Å; Y43-I87 HydrophobicContact CE2-CG2 3.53Å; Y43-I87 HydrophobicContact CG-CD1 3.9Å; Y43-I87 HydrophobicContact CG-CG1 3.94Å; L66-I87 HydrophobicContact CB-CB 4.37Å; L66-I87 HydrophobicContact CB-CD1 4.15Å; L66-I87 HydrophobicContact CD1-CB 4.05Å; L66-I87 HydrophobicContact CD1-CG2 3.82Å; L66-I87 HydrophobicContact CD2-CG2 4.07Å; L66-I87 HydrophobicContact CG-CG2 4.38Å; F70-I87 HydrophobicContact CB-CD1 3.74Å; F70-I87 HydrophobicContact CD2-CD1 3.85Å; F70-I87 HydrophobicContact CG-CD1 4.12Å; Q85-I87 HydrophobicContact CG-CD1 4.28Å; Q85-I87 HydrophobicContact CG-CG1 4.17Å; Q85-I87 PolarHBondContact O-N 3.16Å; I87-V89 PolarHBondContact O-N 3.43Å
88	P	95.8	Very high	80.7	Confident	65 Å²	65	86.9 Å²	86.9	42%	0.422	46%	0.458	S	S	.	.			trans	-58.7	131.6	-177.3	-25.3	34.7	0	0	0	112.9	Y43	Y43-P88 WeakPolarHBondContact OH-CD 3.48Å
89	V	96.6	Very high	78.6	Confident	31 Å²	31	81 Å²	81	19%	0.188	44%	0.439	C	S	.	.			trans	-121.3	119.8	168.6	176.5	0	0	0	0	107	V50 A62 L63 L66 I87	V50-V89 HydrophobicContact CB-CG2 4.39Å; V50-V89 HydrophobicContact CG1-CG1 4.28Å; V50-V89 HydrophobicContact CG1-CG2 4.1Å; A62-V89 HydrophobicContact CB-CG1 3.96Å; A62-V89 HydrophobicContact CB-CG2 3.95Å; L63-V89 HydrophobicContact CD2-CG2 3.76Å; L63-V89 HydrophobicContact CG-CG2 4.13Å; L66-V89 HydrophobicContact CD1-CG2 3.59Å; I87-V89 PolarHBondContact O-N 3.43Å
90	H	93.9	Very high	76.4	Confident	90 Å²	90	83.9 Å²	83.9	42%	0.417	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	130	-178.2	-57.5	-76.7	0	0	0	110.5	H49 V50 R51 S52	H49-H90 AromaticContact CE1-CD2 3.27Å; H49-H90 PolarHBondContact CE1-CD2 2.98Å; H49-H90 AromaticContact CE1-NE2 3.7Å; H49-H90 AromaticContact ND1-CD2 3.8Å; H49-H90 AromaticContact ND1-NE2 3.95Å; H49-H90 AromaticContact NE2-CD2 3.75Å; V50-H90 PolarHBondContact O-CD2 3.2Å; V50-H90 PolarHBondContact O-N 3.23Å; R51-H90 CarbonylContact C-O 3.24Å; R51-H90 VanDerWaalsContact CA-O 3.24Å; R51-H90 WeakPolarHBondContact CA-O 3.47Å; S52-H90 PolarHBondContact N-O 2.68Å
91	S	90.3	Very high	74.8	Confident	46 Å²	46	79.9 Å²	79.9	32%	0.322	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	161.1	169.1	62.9	0	0	0	0	110.7	S52 D54	S52-S91 WeakPolarHBondContact O-CA 2.91Å; D54-S91 PolarHBondContact OD1-OG 3.12Å
92	F	82.8	Confident	73.2	Confident	46 Å²	46	81.4 Å²	81.4	20%	0.202	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	136.2	166.4	-70.9	-89.1	0	0	0	107	R51 D54 G94 N101 R103 A104	R51-F92 VanDerWaalsContact CZ-CE2 3.48Å; R51-F92 VanDerWaalsContact NH2-CD2 3.29Å; D54-F92 VanDerWaalsContact CB-O 3.25Å; D54-F92 WeakPolarHBondContact CB-O 3.1Å; F92-G94 PolarHBondContact O-N 2.93Å; F92-N101 HydrophobicContact CD1-CB 4.29Å; F92-R103 HydrophobicContact CE1-CB 4.27Å; F92-R103 HydrophobicContact CE2-CB 4.1Å; F92-R103 HydrophobicContact CZ-CB 3.94Å; F92-A104 HydrophobicContact CB-CB 4.15Å
93	P	75.1	Confident	72.2	Confident	91 Å²	91	87.1 Å²	87.1	59%	0.591	45%	0.451	S	S	*	.			trans	-47.5	127.8	-178.2	-28.7	34.3	0	0	0	112.1	D54	D54-P93 WeakPolarHBondContact OD2-CA 3.39Å
94	G	62.5	Low	71.4	Confident	36 Å²	36	82.4 Å²	82.4	37%	0.371	42%	0.423	S	S	.	.			trans	-98.8	-22.6	-176.8	0	0	0	0	0	114.1	D54 F92	D54-G94 PolarHBondContact OD2-N 2.97Å; F92-G94 PolarHBondContact O-N 2.93Å
95	E	49.7	Very low	70.8	Confident	151 Å²	151	77.7 Å²	77.7	71%	0.706	41%	0.406	S	S	*	.			trans	-88.8	138.7	-172.3	-66.9	-179	164.5	0	0	110.8
96	D	46.7	Very low	70.6	Confident	139 Å²	139	77.2 Å²	77.2	74%	0.743	40%	0.404	S	S	*	.	S	Bend	trans	82.7	82.9	167.9	-48.8	-27	0	0	0	117.1	H98	D96-H98 WeakPolarHBondContact O-CB 3.28Å; D96-H98 PolarHBondContact O-N 3.39Å
97	D	43.3	Very low	70.5	Confident	110 Å²	110	73.2 Å²	73.2	59%	0.588	38%	0.378	S	S	*	.	S	Bend	trans	54.6	3.9	145.6	-120.9	0.8	0	0	0	119.5	R112	D97-R112 WeakPolarHBondContact OD1-CD 3.36Å; D97-R112 IonicContact OD1-CZ 3.67Å; D97-R112 IonicContact OD1-NE 3.4Å; D97-R112 IonicContact OD1-NH1 2.69Å; D97-R112 PolarHBondContact OD1-NH1 3.36Å; D97-R112 IonicContact OD2-NH1 3.08Å; D97-R112 PolarHBondContact OD2-NH1 2.96Å; D97-R112 VanDerWaalsContact OD2-NH1 3.08Å
98	H	42	Very low	70	Confident	147 Å²	147	73.9 Å²	73.9	68%	0.681	38%	0.381	S	S	*	.			trans	-142.7	84.7	-169	-80	-11.1	0	0	0	107.1	D96 V100	D96-H98 WeakPolarHBondContact O-CB 3.28Å; D96-H98 PolarHBondContact O-N 3.39Å; H98-V100 HydrophobicContact CB-CB 4.22Å; H98-V100 HydrophobicContact CB-CG2 3.5Å; H98-V100 PolarHBondContact O-N 3.15Å
99	C	46.9	Very low	69.6	Low	25 Å²	25	71 Å²	71	17%	0.169	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	47.5	149.5	-59.2	0	0	0	0	110.4	N101 A111 W338 K339	C99-N101 PolarHBondContact O-N 3.44Å; C99-A111 VanDerWaalsContact SG-CB 3.52Å; C99-W338 HydrophobicContact CB-CH2 3.94Å; C99-W338 HydrophobicContact CB-CZ3 3.8Å; C99-K339 WeakPolarHBondContact O-CE 3.2Å
100	V	47.4	Very low	68.8	Low	96 Å²	96	74.4 Å²	74.4	58%	0.582	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-33.5	174.9	164.6	0	0	0	0	108.9	H98 R102 K339	H98-V100 HydrophobicContact CB-CB 4.22Å; H98-V100 HydrophobicContact CB-CG2 3.5Å; H98-V100 PolarHBondContact O-N 3.15Å; V100-R102 PolarHBondContact O-N 3.27Å; V100-K339 WeakPolarHBondContact O-CE 3.23Å; V100-K339 PolarHBondContact O-NZ 3.22Å
101	N	55.2	Low	68.4	Low	81 Å²	81	70.5 Å²	70.5	43%	0.433	36%	0.362	S	S	.	.	S	Bend	trans	-75.1	108.4	171.4	-115.4	-44.2	0	0	0	110.5	F92 C99 R103 A104 Q105	F92-N101 HydrophobicContact CD1-CB 4.29Å; C99-N101 PolarHBondContact O-N 3.44Å; N101-R103 PolarHBondContact O-N 2.96Å; N101-A104 HydrophobicContact CB-CB 4.33Å; N101-A104 PolarHBondContact O-N 3.13Å; N101-Q105 PolarHBondContact O-OE1 2.97Å
102	R	59.5	Low	68.2	Low	178 Å²	178	73.7 Å²	73.7	67%	0.672	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	0.6	175.3	-78.4	-166.4	-110.7	-156.4	-3.2	115	V100 Q105 K339	V100-R102 PolarHBondContact O-N 3.27Å; R102-Q105 VanDerWaalsContact O-CD 3.26Å; R102-Q105 PolarHBondContact O-NE2 3.01Å; R102-Q105 PolarHBondContact O-OE1 3.4Å; R102-K339 HydrophobicContact CG-CD 4.35Å
103	R	69.3	Low	68.5	Low	157 Å²	157	71.6 Å²	71.6	59%	0.592	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112	-23.1	176.2	-67.3	-177.3	179.5	147.5	-0.5	112.6	R51 F92 N101 Q105 I106	R51-R103 PolarHBondContact NH2-O 2.69Å; F92-R103 HydrophobicContact CE1-CB 4.27Å; F92-R103 HydrophobicContact CE2-CB 4.1Å; F92-R103 HydrophobicContact CZ-CB 3.94Å; N101-R103 PolarHBondContact O-N 2.96Å; R103-Q105 VanDerWaalsContact C-N 3.25Å; R103-Q105 PolarHBondContact O-N 2.65Å; R103-I106 HydrophobicContact CB-CD1 4.16Å; R103-I106 HydrophobicContact CG-CD1 4.32Å; R103-I106 VanDerWaalsContact O-CB 3.26Å; R103-I106 WeakPolarHBondContact O-CB 3.37Å; R103-I106 VanDerWaalsContact O-CG1 3.31Å; R103-I106 WeakPolarHBondContact O-CG1 3.44Å; R103-I106 PolarHBondContact O-N 3.29Å
104	A	71.6	Confident	69.3	Low	5 Å²	5	69.6 Å²	69.6	4%	0.041	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-57.2	-39.2	-173.4	0	0	0	0	0	112.3	F92 N101 I106 L107 H108	F92-A104 HydrophobicContact CB-CB 4.15Å; N101-A104 HydrophobicContact CB-CB 4.33Å; N101-A104 PolarHBondContact O-N 3.13Å; A104-I106 PolarHBondContact O-N 3.26Å; A104-L107 PolarHBondContact O-N 3.31Å; A104-H108 PolarHBondContact O-CD2 3.41Å; A104-H108 PolarHBondContact O-N 3.21Å
105	Q	78.2	Confident	70.8	Confident	21 Å²	21	72.9 Å²	72.9	10%	0.098	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-61.9	-14.5	179	79.6	-78.4	15.4	0	0	114.8	N101 R102 R103 L107 A111 W338	N101-Q105 PolarHBondContact O-OE1 2.97Å; R102-Q105 VanDerWaalsContact O-CD 3.26Å; R102-Q105 PolarHBondContact O-NE2 3.01Å; R102-Q105 PolarHBondContact O-OE1 3.4Å; R103-Q105 VanDerWaalsContact C-N 3.25Å; R103-Q105 PolarHBondContact O-N 2.65Å; Q105-L107 PolarHBondContact O-N 2.95Å; Q105-A111 HydrophobicContact CB-CB 3.98Å; Q105-W338 HydrophobicContact CB-CD2 3.91Å; Q105-W338 HydrophobicContact CB-CE3 4.24Å; Q105-W338 HydrophobicContact CB-CG 4.46Å; Q105-W338 HydrophobicContact CB-CH2 4.07Å; Q105-W338 HydrophobicContact CB-CZ2 3.72Å; Q105-W338 HydrophobicContact CB-CZ3 4.31Å; Q105-W338 HydrophobicContact CG-CB 4.34Å; Q105-W338 HydrophobicContact CG-CD2 3.59Å; Q105-W338 HydrophobicContact CG-CE3 4.08Å; Q105-W338 HydrophobicContact CG-CG 3.68Å; Q105-W338 HydrophobicContact CG-CZ2 4.34Å
106	I	87.6	Confident	72.9	Confident	13 Å²	13	65.7 Å²	65.7	7%	0.067	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-60.4	-34.9	177.5	-68.8	170.2	0	0	0	111.1	R103 A104 L211 D214	R103-I106 HydrophobicContact CB-CD1 4.16Å; R103-I106 HydrophobicContact CG-CD1 4.32Å; R103-I106 VanDerWaalsContact O-CB 3.26Å; R103-I106 WeakPolarHBondContact O-CB 3.37Å; R103-I106 VanDerWaalsContact O-CG1 3.31Å; R103-I106 WeakPolarHBondContact O-CG1 3.44Å; R103-I106 PolarHBondContact O-N 3.29Å; A104-I106 PolarHBondContact O-N 3.26Å; I106-L211 HydrophobicContact CG2-CB 4.43Å; I106-L211 HydrophobicContact CG2-CD1 3.89Å; I106-L211 WeakPolarHBondContact O-CB 3.45Å; I106-D214 HydrophobicContact CG2-CB 4.34Å
107	L	89.7	Confident	75.1	Confident	1 Å²	1	62.3 Å²	62.3	1%	0.005	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	-16.2	179.9	-64.2	-179.9	0	0	0	114.3	R51 T53 A104 Q105 M109 L211 Y236 T242	R51-L107 HydrophobicContact CB-CD1 4.41Å; R51-L107 HydrophobicContact CG-CD1 3.86Å; T53-L107 HydrophobicContact CG2-CB 3.49Å; T53-L107 VanDerWaalsContact CG2-CB 3.49Å; A104-L107 PolarHBondContact O-N 3.31Å; Q105-L107 PolarHBondContact O-N 2.95Å; L107-M109 PolarHBondContact O-N 3.09Å; L107-L211 HydrophobicContact CD2-CD1 3.74Å; L107-L211 HydrophobicContact CD2-CD2 4.16Å; L107-Y236 HydrophobicContact CD1-CD1 4.15Å; L107-Y236 HydrophobicContact CD2-CD1 3.73Å; L107-Y236 HydrophobicContact CD2-CG 4.03Å; L107-Y236 HydrophobicContact CG-CD1 4.28Å; L107-T242 HydrophobicContact CD2-CG2 4.22Å; L107-T242 PolarHBondContact O-OG1 3.27Å
108	H	85.8	Confident	77.5	Confident	23 Å²	23	59.1 Å²	59.1	11%	0.106	28%	0.282	C	S	.	.			trans	-92.3	91.7	-179.3	-70.1	-107.2	0	0	0	109.8	T53 A104 D110 A111	T53-H108 WeakPolarHBondContact CB-NE2 3.35Å; A104-H108 PolarHBondContact O-CD2 3.41Å; A104-H108 PolarHBondContact O-N 3.21Å; H108-D110 PolarHBondContact O-N 3.13Å; H108-A111 HydrophobicContact CB-CB 4.15Å; H108-A111 WeakPolarHBondContact O-CB 3.46Å; H108-A111 PolarHBondContact O-N 2.97Å
109	M	87.1	Confident	80.1	Confident	5 Å²	5	53.6 Å²	53.6	3%	0.025	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-20.8	178.4	-60.5	-52.5	156	0	0	112.8	L107 R207 G208 L211 A241 T242 A245	L107-M109 PolarHBondContact O-N 3.09Å; M109-R207 WeakPolarHBondContact O-CD 3.46Å; M109-R207 PolarHBondContact O-NE 3Å; M109-R207 PolarHBondContact O-NH1 2.79Å; M109-G208 VanDerWaalsContact SD-CA 3.6Å; M109-G208 PolarHBondContact SD-N 3.32Å; M109-G208 VanDerWaalsContact SD-N 3.37Å; M109-L211 HydrophobicContact CE-CB 4.46Å; M109-L211 HydrophobicContact CE-CD2 4.2Å; M109-A241 HydrophobicContact CB-CB 4.28Å; M109-A241 HydrophobicContact CG-CB 4.45Å; M109-T242 HydrophobicContact CE-CG2 3.71Å; M109-A245 HydrophobicContact CE-CB 4.06Å; M109-A245 HydrophobicContact CG-CB 3.99Å; M109-A245 HydrophobicContact SD-CB 3.62Å
110	D	81.1	Confident	82.4	Confident	102 Å²	102	53 Å²	53	55%	0.545	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	16.1	174.5	-60.3	-43.3	0	0	0	113.4	H108 R112 R207	H108-D110 PolarHBondContact O-N 3.13Å; D110-R112 PolarHBondContact O-N 3.18Å; D110-R207 IonicContact OD1-NH1 2.66Å; D110-R207 PolarHBondContact OD1-NH1 3Å
111	A	84.7	Confident	84.6	Confident	8 Å²	8	55.6 Å²	55.6	7%	0.066	25%	0.251	C	S	.	.	S	Bend	trans	-52.2	131.8	169.4	0	0	0	0	0	109.9	C99 Q105 H108 C113 W338	C99-A111 VanDerWaalsContact SG-CB 3.52Å; Q105-A111 HydrophobicContact CB-CB 3.98Å; H108-A111 HydrophobicContact CB-CB 4.15Å; H108-A111 WeakPolarHBondContact O-CB 3.46Å; H108-A111 PolarHBondContact O-N 2.97Å; A111-C113 PolarHBondContact O-N 2.91Å; A111-W338 HydrophobicContact CB-CH2 3.77Å; A111-W338 HydrophobicContact CB-CZ2 3.65Å
112	R	85.5	Confident	86.6	Confident	112 Å²	112	54.5 Å²	54.5	42%	0.423	25%	0.253	S	S	.	.			trans	-52.2	116.9	-178.2	-180	174	178.8	168.5	-1.2	109.5	D97 D110 W338 L344	D97-R112 WeakPolarHBondContact OD1-CD 3.36Å; D97-R112 IonicContact OD1-CZ 3.67Å; D97-R112 IonicContact OD1-NE 3.4Å; D97-R112 IonicContact OD1-NH1 2.69Å; D97-R112 PolarHBondContact OD1-NH1 3.36Å; D97-R112 IonicContact OD2-NH1 3.08Å; D97-R112 PolarHBondContact OD2-NH1 2.96Å; D97-R112 VanDerWaalsContact OD2-NH1 3.08Å; D110-R112 PolarHBondContact O-N 3.18Å; R112-W338 WeakPolarHBondContact O-CH2 3.34Å; R112-L344 HydrophobicContact CG-CD2 4.36Å; R112-L344 WeakPolarHBondContact O-CD1 3.32Å
113	C	89.9	Confident	88.3	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.014	23%	0.226	C	C	.	.			trans	-149.7	88.9	-177.6	-178.2	0	0	0	0	108.4	A111 R115 A116 E117 W338 C342	A111-C113 PolarHBondContact O-N 2.91Å; C113-R115 PolarHBondContact O-N 2.88Å; C113-R115 VanDerWaalsContact O-N 3.09Å; C113-A116 HydrophobicContact CB-CB 3.93Å; C113-A116 PolarHBondContact O-N 2.96Å; C113-A116 VanDerWaalsContact SG-CB 3.52Å; C113-E117 PolarHBondContact N-OE1 3.28Å; C113-E117 WeakPolarHBondContact O-CG 3.09Å; C113-E117 PolarHBondContact O-N 3.22Å; C113-W338 HydrophobicContact CB-CH2 4.43Å; C113-W338 HydrophobicContact CB-CZ2 3.92Å; C113-C342 HydrophobicContact CB-CB 3.86Å; C113-C342 WeakPolarHBondContact CB-SG 3.5Å; C113-C342 VanDerWaalsContact SG-CA 3.58Å; C113-C342 WeakPolarHBondContact SG-CB 3.19Å; C113-C342 CovalentContact SG-SG 2.04Å; C113-C342 PolarHBondContact SG-SG 3.41Å
114	P	92.2	Very high	89.6	Confident	50 Å²	50	40.2 Å²	40.2	33%	0.325	20%	0.202	S	C	.	.	H	α-helix	trans	-50.5	-37.8	-176.8	-30.9	34.2	0	0	0	113.9	A118 C342 L344	P114-A118 VanDerWaalsContact O-CB 3.3Å; P114-A118 WeakPolarHBondContact O-CB 3.36Å; P114-A118 PolarHBondContact O-N 3.43Å; P114-C342 VanDerWaalsContact CD-O 3.28Å; P114-C342 WeakPolarHBondContact CD-O 3.36Å; P114-L344 HydrophobicContact CG-CD2 4.02Å
115	R	93.6	Very high	90.8	Very high	105 Å²	105	46.2 Å²	46.2	40%	0.396	23%	0.229	S	C	.	.	H	α-helix	trans	-63.6	-50.6	175.6	-179.2	55.8	-180	164	0.7	112.4	C113 E117 A118 L119 E202 L206 E341 C342	C113-R115 PolarHBondContact O-N 2.88Å; C113-R115 VanDerWaalsContact O-N 3.09Å; R115-E117 VanDerWaalsContact C-N 3.33Å; R115-E117 PolarHBondContact O-N 3.32Å; R115-A118 PolarHBondContact O-N 2.06Å; R115-L119 HydrophobicContact CG-CD1 4.15Å; R115-L119 WeakPolarHBondContact O-CB 3.44Å; R115-L119 VanDerWaalsContact O-CG 3.26Å; R115-L119 WeakPolarHBondContact O-CG 3.31Å; R115-L119 PolarHBondContact O-N 3.33Å; R115-E202 IonicContact CZ-OE1 2.66Å; R115-E202 IonicContact CZ-OE2 2.81Å; R115-E202 IonicContact NE-OE1 2.74Å; R115-E202 PolarHBondContact NE-OE1 3.13Å; R115-E202 IonicContact NE-OE2 3.07Å; R115-E202 IonicContact NH2-OE1 2.62Å; R115-E202 PolarHBondContact NH2-OE1 3.35Å; R115-E202 IonicContact NH2-OE2 3.47Å; R115-E202 PolarHBondContact NH2-OE2 3.28Å; R115-L206 HydrophobicContact CB-CD1 4.13Å; R115-L206 HydrophobicContact CG-CD1 3.73Å; R115-E341 WeakPolarHBondContact CB-O 3.42Å; R115-C342 PolarHBondContact N-O 2.8Å
116	A	92.9	Very high	91.7	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.8	-38.8	178.8	0	0	0	0	0	111.8	C113 L119 Q120 L206 R207	C113-A116 HydrophobicContact CB-CB 3.93Å; C113-A116 PolarHBondContact O-N 2.96Å; C113-A116 VanDerWaalsContact SG-CB 3.52Å; A116-L119 PolarHBondContact O-N 3.34Å; A116-Q120 WeakPolarHBondContact O-CB 3.38Å; A116-Q120 VanDerWaalsContact O-CG 3.26Å; A116-Q120 WeakPolarHBondContact O-CG 3.39Å; A116-Q120 PolarHBondContact O-N 3.21Å; A116-L206 HydrophobicContact CB-CB 4.08Å; A116-L206 HydrophobicContact CB-CD1 4.06Å; A116-R207 HydrophobicContact CB-CG 4.22Å
117	E	92.9	Very high	92.2	Very high	68 Å²	68	54 Å²	54	32%	0.318	27%	0.267	S	S	.	.	H	α-helix	trans	-62.9	-44.1	175.8	-69.6	162.2	-154	0	0	112.1	C113 R115 Q120 R121	C113-E117 PolarHBondContact N-OE1 3.28Å; C113-E117 WeakPolarHBondContact O-CG 3.09Å; C113-E117 PolarHBondContact O-N 3.22Å; R115-E117 VanDerWaalsContact C-N 3.33Å; R115-E117 PolarHBondContact O-N 3.32Å; E117-Q120 PolarHBondContact O-N 2.95Å; E117-R121 WeakPolarHBondContact O-CB 3.47Å; E117-R121 PolarHBondContact O-N 2.95Å
118	A	95.4	Very high	92.4	Very high	43 Å²	43	58.5 Å²	58.5	36%	0.355	29%	0.287	S	S	.	.	H	α-helix	trans	-64.1	-42.6	176.5	0	0	0	0	0	111.7	P114 R115 R121 A122	P114-A118 VanDerWaalsContact O-CB 3.3Å; P114-A118 WeakPolarHBondContact O-CB 3.36Å; P114-A118 PolarHBondContact O-N 3.43Å; R115-A118 PolarHBondContact O-N 2.06Å; A118-R121 PolarHBondContact O-N 3.45Å; A118-A122 WeakPolarHBondContact O-CB 3.4Å; A118-A122 PolarHBondContact O-N 3.47Å
119	L	95.5	Very high	92.9	Very high	31 Å²	31	57.4 Å²	57.4	16%	0.162	28%	0.282	C	S	.	.	H	α-helix	trans	-60.1	-46.6	175.1	-72.8	168.4	0	0	0	110.7	R115 A116 A122 T123 E202 Q203 L206	R115-L119 HydrophobicContact CG-CD1 4.15Å; R115-L119 WeakPolarHBondContact O-CB 3.44Å; R115-L119 VanDerWaalsContact O-CG 3.26Å; R115-L119 WeakPolarHBondContact O-CG 3.31Å; R115-L119 PolarHBondContact O-N 3.33Å; A116-L119 PolarHBondContact O-N 3.34Å; L119-A122 PolarHBondContact O-N 3.3Å; L119-T123 PolarHBondContact O-N 2.9Å; L119-T123 PolarHBondContact O-OG1 3.4Å; L119-E202 HydrophobicContact CD1-CB 3.96Å; L119-E202 HydrophobicContact CD1-CG 3.79Å; L119-Q203 HydrophobicContact CB-CG 3.47Å; L119-Q203 VanDerWaalsContact CB-CG 3.47Å; L119-Q203 HydrophobicContact CD1-CG 3.92Å; L119-Q203 HydrophobicContact CG-CG 4.27Å; L119-Q203 PolarHBondContact O-NE2 2.95Å; L119-L206 HydrophobicContact CD1-CD1 4.3Å
120	Q	94.4	Very high	93.4	Very high	13 Å²	13	60.7 Å²	60.7	6%	0.061	30%	0.302	C	S	.	.	H	α-helix	trans	-63.3	-43.8	179.8	-76.1	171.5	-24.4	0	0	112.1	A116 E117 A122 T123 F124 W197 R207	A116-Q120 WeakPolarHBondContact O-CB 3.38Å; A116-Q120 VanDerWaalsContact O-CG 3.26Å; A116-Q120 WeakPolarHBondContact O-CG 3.39Å; A116-Q120 PolarHBondContact O-N 3.21Å; E117-Q120 PolarHBondContact O-N 2.95Å; Q120-A122 VanDerWaalsContact C-N 3.32Å; Q120-A122 PolarHBondContact O-N 2.71Å; Q120-T123 WeakPolarHBondContact O-CB 3.36Å; Q120-T123 PolarHBondContact O-N 2.84Å; Q120-T123 VanDerWaalsContact O-N 3.11Å; Q120-F124 WeakPolarHBondContact O-CD2 3.44Å; Q120-F124 PolarHBondContact O-N 3.5Å; Q120-W197 PolarHBondContact NE2-O 3.13Å; Q120-W197 VanDerWaalsContact NE2-O 3.09Å; Q120-R207 VanDerWaalsContact NE2-CZ 3.34Å
121	R	95	Very high	94.2	Very high	150 Å²	150	58.4 Å²	58.4	57%	0.566	29%	0.29	S	S	*	.	H	α-helix	trans	-56.2	-48.5	174.8	-170.9	-176.6	-54.9	139	7.2	111	E117 A118 T123 F124 E125	E117-R121 WeakPolarHBondContact O-CB 3.47Å; E117-R121 PolarHBondContact O-N 2.95Å; A118-R121 PolarHBondContact O-N 3.45Å; R121-T123 VanDerWaalsContact C-N 3.29Å; R121-T123 PolarHBondContact O-N 3.21Å; R121-F124 PolarHBondContact O-N 3.19Å; R121-F124 VanDerWaalsContact O-N 3.15Å; R121-E125 HydrophobicContact CG-CG 4.43Å; R121-E125 VanDerWaalsContact CG-OE1 3.23Å; R121-E125 WeakPolarHBondContact CG-OE1 3.38Å; R121-E125 WeakPolarHBondContact O-CB 3.49Å; R121-E125 WeakPolarHBondContact O-CG 3.43Å; R121-E125 PolarHBondContact O-N 3.06Å
122	A	96.2	Very high	94.8	Very high	58 Å²	58	59.2 Å²	59.2	48%	0.479	29%	0.293	S	S	.	.	H	α-helix	trans	-60.7	-35.8	176.6	0	0	0	0	0	112.8	A118 L119 Q120 S126	A118-A122 WeakPolarHBondContact O-CB 3.4Å; A118-A122 PolarHBondContact O-N 3.47Å; L119-A122 PolarHBondContact O-N 3.3Å; Q120-A122 VanDerWaalsContact C-N 3.32Å; Q120-A122 PolarHBondContact O-N 2.71Å; A122-S126 PolarHBondContact O-N 3.23Å
123	T	96.3	Very high	95.3	Very high	18 Å²	18	54.6 Å²	54.6	11%	0.11	28%	0.277	C	S	.	.	H	α-helix	trans	-63.3	-48.5	172.9	-63.7	0	0	0	0	111.6	L119 Q120 R121 E125 S126 V129 Y196 K199 Q203	L119-T123 PolarHBondContact O-N 2.9Å; L119-T123 PolarHBondContact O-OG1 3.4Å; Q120-T123 WeakPolarHBondContact O-CB 3.36Å; Q120-T123 PolarHBondContact O-N 2.84Å; Q120-T123 VanDerWaalsContact O-N 3.11Å; R121-T123 VanDerWaalsContact C-N 3.29Å; R121-T123 PolarHBondContact O-N 3.21Å; T123-E125 VanDerWaalsContact C-N 3.27Å; T123-E125 PolarHBondContact O-N 2.87Å; T123-S126 VanDerWaalsContact O-CB 3.23Å; T123-S126 WeakPolarHBondContact O-CB 3.02Å; T123-S126 PolarHBondContact O-N 3.43Å; T123-S126 VanDerWaalsContact O-N 3.13Å; T123-S126 PolarHBondContact O-OG 3.01Å; T123-V129 HydrophobicContact CG2-CG2 4.48Å; T123-V129 VanDerWaalsContact O-CG2 3.3Å; T123-V129 WeakPolarHBondContact O-CG2 3.18Å; T123-Y196 HydrophobicContact CG2-CD1 3.86Å; T123-Y196 HydrophobicContact CG2-CG 4.47Å; T123-Y196 WeakPolarHBondContact CG2-O 3.31Å; T123-K199 HydrophobicContact CG2-CB 4.19Å; T123-K199 HydrophobicContact CG2-CD 4.21Å; T123-Q203 PolarHBondContact OG1-NE2 2.97Å
124	F	96.7	Very high	95.6	Very high	16 Å²	16	61.7 Å²	61.7	7%	0.07	31%	0.308	C	S	.	.	H	α-helix	trans	-71	-21.8	-178.3	-75.8	-70.1	0	0	0	113.7	Q120 R121 V129 L154 N155 W197	Q120-F124 WeakPolarHBondContact O-CD2 3.44Å; Q120-F124 PolarHBondContact O-N 3.5Å; R121-F124 PolarHBondContact O-N 3.19Å; R121-F124 VanDerWaalsContact O-N 3.15Å; F124-V129 HydrophobicContact CD1-CG1 4.05Å; F124-L154 HydrophobicContact CD1-CB 4.35Å; F124-L154 HydrophobicContact CE1-CB 4.49Å; F124-N155 HydrophobicContact CD1-CB 3.78Å; F124-N155 HydrophobicContact CD2-CB 4.13Å; F124-N155 HydrophobicContact CE1-CB 3.72Å; F124-N155 HydrophobicContact CE2-CB 4.08Å; F124-N155 HydrophobicContact CG-CB 4Å; F124-N155 HydrophobicContact CZ-CB 3.88Å; F124-N155 WeakPolarHBondContact CZ-OD1 3.45Å; F124-W197 HydrophobicContact CE2-CE3 4.26Å; F124-W197 HydrophobicContact CZ-CE3 4.15Å
125	E	96.7	Very high	95.9	Very high	132 Å²	132	66.6 Å²	66.6	62%	0.617	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-5.7	172.5	-69.2	170.1	178.7	0	0	112.9	R121 T123	R121-E125 HydrophobicContact CG-CG 4.43Å; R121-E125 VanDerWaalsContact CG-OE1 3.23Å; R121-E125 WeakPolarHBondContact CG-OE1 3.38Å; R121-E125 WeakPolarHBondContact O-CB 3.49Å; R121-E125 WeakPolarHBondContact O-CG 3.43Å; R121-E125 PolarHBondContact O-N 3.06Å; T123-E125 VanDerWaalsContact C-N 3.27Å; T123-E125 PolarHBondContact O-N 2.87Å
126	S	96.8	Very high	96.1	Very high	35 Å²	35	63 Å²	63	25%	0.245	32%	0.315	C	S	.	.	S	Bend	trans	-64.3	147	179.4	73.3	0	0	0	0	111.2	A122 T123 E128 V129 V130	A122-S126 PolarHBondContact O-N 3.23Å; T123-S126 VanDerWaalsContact O-CB 3.23Å; T123-S126 WeakPolarHBondContact O-CB 3.02Å; T123-S126 PolarHBondContact O-N 3.43Å; T123-S126 VanDerWaalsContact O-N 3.13Å; T123-S126 PolarHBondContact O-OG 3.01Å; S126-E128 PolarHBondContact O-N 2.99Å; S126-E128 VanDerWaalsContact O-N 3.13Å; S126-V129 PolarHBondContact O-N 3.4Å; S126-V130 WeakPolarHBondContact O-CG2 3.12Å; S126-V130 PolarHBondContact O-N 3.09Å
127	K	97.2	Very high	96.3	Very high	163 Å²	163	66.6 Å²	66.6	71%	0.709	33%	0.332	S	S	*	.	H	α-helix	trans	-49.7	-42.8	180	-177.8	180	177.5	-177.5	0	112.4	V129 V130 D131	K127-V129 PolarHBondContact O-N 3.4Å; K127-V130 PolarHBondContact O-N 3.38Å; K127-D131 WeakPolarHBondContact CG-OD2 3.33Å; K127-D131 VanDerWaalsContact O-CB 3.27Å; K127-D131 WeakPolarHBondContact O-CB 3.42Å; K127-D131 PolarHBondContact O-N 2.93Å
128	E	95.6	Very high	96.5	Very high	95 Å²	95	70.4 Å²	70.4	44%	0.444	36%	0.355	S	S	.	.	H	α-helix	trans	-58.3	-45.9	179.3	-173.5	-172.8	135.2	0	0	112.5	S126 I132 Y196 K199	S126-E128 PolarHBondContact O-N 2.99Å; S126-E128 VanDerWaalsContact O-N 3.13Å; E128-I132 WeakPolarHBondContact O-CG1 3.33Å; E128-I132 PolarHBondContact O-N 3.13Å; E128-Y196 VanDerWaalsContact OE1-CE1 3.28Å; E128-Y196 WeakPolarHBondContact OE1-CE1 3.26Å; E128-Y196 PolarHBondContact OE1-OH 3.03Å; E128-K199 IonicContact OE1-NZ 2.65Å; E128-K199 PolarHBondContact OE1-NZ 3.28Å; E128-K199 IonicContact OE2-NZ 2.81Å; E128-K199 PolarHBondContact OE2-NZ 3.48Å
129	V	96.3	Very high	96.6	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-75.7	-38.4	-179.2	179.4	0	0	0	0	111.4	T123 F124 S126 K127 D131 I132 V133 L154 Y196	T123-V129 HydrophobicContact CG2-CG2 4.48Å; T123-V129 VanDerWaalsContact O-CG2 3.3Å; T123-V129 WeakPolarHBondContact O-CG2 3.18Å; F124-V129 HydrophobicContact CD1-CG1 4.05Å; S126-V129 PolarHBondContact O-N 3.4Å; K127-V129 PolarHBondContact O-N 3.4Å; V129-D131 VanDerWaalsContact C-N 3.3Å; V129-D131 PolarHBondContact O-N 3.31Å; V129-I132 WeakPolarHBondContact O-CB 3.34Å; V129-I132 PolarHBondContact O-N 3.02Å; V129-V133 PolarHBondContact O-N 3.43Å; V129-L154 HydrophobicContact CG1-CB 3.76Å; V129-L154 HydrophobicContact CG1-CD2 3.9Å; V129-L154 HydrophobicContact CG1-CG 4.49Å; V129-Y196 HydrophobicContact CG2-CD1 3.43Å; V129-Y196 VanDerWaalsContact CG2-CD1 3.43Å; V129-Y196 HydrophobicContact CG2-CD2 4.12Å; V129-Y196 HydrophobicContact CG2-CE1 3.49Å; V129-Y196 VanDerWaalsContact CG2-CE1 3.49Å; V129-Y196 HydrophobicContact CG2-CE2 4.19Å; V129-Y196 HydrophobicContact CG2-CG 3.78Å
130	V	97.1	Very high	96.8	Very high	73 Å²	73	67.9 Å²	67.9	44%	0.442	33%	0.334	S	S	.	.	H	α-helix	trans	-61.9	-40.2	174.7	172.9	0	0	0	0	111	S126 K127 I132 V133 K134	S126-V130 WeakPolarHBondContact O-CG2 3.12Å; S126-V130 PolarHBondContact O-N 3.09Å; K127-V130 PolarHBondContact O-N 3.38Å; V130-I132 VanDerWaalsContact C-N 3.32Å; V130-I132 PolarHBondContact O-N 2.86Å; V130-V133 PolarHBondContact O-N 3.34Å; V130-K134 WeakPolarHBondContact O-CB 3.42Å; V130-K134 PolarHBondContact O-N 2.98Å
131	D	97.5	Very high	96.9	Very high	55 Å²	55	69.1 Å²	69.1	29%	0.294	35%	0.346	S	S	.	.	H	α-helix	trans	-64.6	-34.9	176.4	-74.9	-21.5	0	0	0	111.6	K127 V129 K134 Q135	K127-D131 WeakPolarHBondContact CG-OD2 3.33Å; K127-D131 VanDerWaalsContact O-CB 3.27Å; K127-D131 WeakPolarHBondContact O-CB 3.42Å; K127-D131 PolarHBondContact O-N 2.93Å; V129-D131 VanDerWaalsContact C-N 3.3Å; V129-D131 PolarHBondContact O-N 3.31Å; D131-K134 PolarHBondContact O-N 3.43Å; D131-Q135 WeakPolarHBondContact O-CB 3.33Å; D131-Q135 WeakPolarHBondContact O-CG 3.41Å; D131-Q135 PolarHBondContact O-N 3.05Å
132	I	96.4	Very high	97.1	Very high	24 Å²	24	65.1 Å²	65.1	12%	0.123	33%	0.334	C	S	.	.	H	α-helix	trans	-63.1	-44.8	173.8	-69.1	167.1	0	0	0	111.3	E128 V129 V130 K134 Q135 N136 L154 L189 Y196	E128-I132 WeakPolarHBondContact O-CG1 3.33Å; E128-I132 PolarHBondContact O-N 3.13Å; V129-I132 WeakPolarHBondContact O-CB 3.34Å; V129-I132 PolarHBondContact O-N 3.02Å; V130-I132 VanDerWaalsContact C-N 3.32Å; V130-I132 PolarHBondContact O-N 2.86Å; I132-K134 VanDerWaalsContact C-N 3.34Å; I132-Q135 PolarHBondContact O-N 2.96Å; I132-N136 PolarHBondContact O-N 3.02Å; I132-N136 PolarHBondContact O-ND2 3.33Å; I132-L154 HydrophobicContact CG2-CD2 4.4Å; I132-L189 HydrophobicContact CG2-CD2 4.43Å; I132-Y196 HydrophobicContact CD1-CE2 3.62Å; I132-Y196 WeakPolarHBondContact CD1-OH 3.42Å
133	V	96.4	Very high	97.2	Very high	15 Å²	15	62.4 Å²	62.4	9%	0.091	31%	0.311	C	S	.	.	H	α-helix	trans	-62.1	-46.4	176.6	178.1	0	0	0	0	109.7	V129 V130 Q135 N136 E137 F140 L154	V129-V133 PolarHBondContact O-N 3.43Å; V130-V133 PolarHBondContact O-N 3.34Å; V133-Q135 PolarHBondContact O-N 3.11Å; V133-N136 CarbonylContact O-C 3.59Å; V133-N136 VanDerWaalsContact O-C 3.24Å; V133-N136 WeakPolarHBondContact O-CA 3.36Å; V133-N136 PolarHBondContact O-N 3.13Å; V133-E137 PolarHBondContact O-N 2.66Å; V133-F140 HydrophobicContact CG1-CD1 4.4Å; V133-F140 HydrophobicContact CG1-CD2 4.2Å; V133-F140 HydrophobicContact CG1-CE1 4.45Å; V133-F140 HydrophobicContact CG1-CE2 4.25Å; V133-F140 HydrophobicContact CG1-CG 4.3Å; V133-F140 HydrophobicContact CG1-CZ 4.38Å; V133-F140 HydrophobicContact CG2-CZ 4.3Å; V133-L154 HydrophobicContact CG2-CB 3.86Å
134	K	96.9	Very high	97.2	Very high	151 Å²	151	65 Å²	65	66%	0.657	32%	0.318	S	S	*	.	H	α-helix	trans	-61	-39.9	178.4	-173.6	178.9	178.8	-178.6	0	113	V130 D131 I132 N136 E137	V130-K134 WeakPolarHBondContact O-CB 3.42Å; V130-K134 PolarHBondContact O-N 2.98Å; D131-K134 PolarHBondContact O-N 3.43Å; I132-K134 VanDerWaalsContact C-N 3.34Å; K134-N136 PolarHBondContact O-N 2.84Å; K134-E137 VanDerWaalsContact O-CB 3.31Å; K134-E137 WeakPolarHBondContact O-CB 3.17Å; K134-E137 PolarHBondContact O-N 3.2Å
135	Q	97.5	Very high	97.3	Very high	153 Å²	153	70.3 Å²	70.3	72%	0.715	35%	0.348	S	S	*	.	H	α-helix	trans	-65.5	-22.6	174.7	-74.3	167.7	27.8	0	0	112.7	D131 I132 V133	D131-Q135 WeakPolarHBondContact O-CB 3.33Å; D131-Q135 WeakPolarHBondContact O-CG 3.41Å; D131-Q135 PolarHBondContact O-N 3.05Å; I132-Q135 PolarHBondContact O-N 2.96Å; V133-Q135 PolarHBondContact O-N 3.11Å
136	N	97.6	Very high	97.3	Very high	31 Å²	31	66.2 Å²	66.2	17%	0.166	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	17.3	178.3	-70.9	-83.6	0	0	0	112.5	I132 V133 K134 D138 F139 F140 K185	I132-N136 PolarHBondContact O-N 3.02Å; I132-N136 PolarHBondContact O-ND2 3.33Å; V133-N136 CarbonylContact O-C 3.59Å; V133-N136 VanDerWaalsContact O-C 3.24Å; V133-N136 WeakPolarHBondContact O-CA 3.36Å; V133-N136 PolarHBondContact O-N 3.13Å; K134-N136 PolarHBondContact O-N 2.84Å; N136-D138 VanDerWaalsContact C-N 3.31Å; N136-D138 PolarHBondContact O-N 3.42Å; N136-F139 WeakPolarHBondContact O-CA 3.42Å; N136-F139 WeakPolarHBondContact O-CB 3.49Å; N136-F139 PolarHBondContact O-N 3.45Å; N136-F140 HydrophobicContact CB-CD2 3.85Å; N136-F140 HydrophobicContact CB-CE2 3.93Å; N136-F140 WeakPolarHBondContact O-CD2 3.49Å; N136-F140 PolarHBondContact O-N 2.95Å; N136-K185 WeakPolarHBondContact OD1-CE 3.43Å; N136-K185 PolarHBondContact OD1-NZ 2.78Å
137	E	97.6	Very high	97.2	Very high	75 Å²	75	65.4 Å²	65.4	35%	0.35	32%	0.322	S	S	.	.	H	α-helix	trans	-57.6	-40.9	-169	-176.3	56.6	-150.9	0	0	112.8	V133 K134 F139 F140 A141 R144	V133-E137 PolarHBondContact O-N 2.66Å; K134-E137 VanDerWaalsContact O-CB 3.31Å; K134-E137 WeakPolarHBondContact O-CB 3.17Å; K134-E137 PolarHBondContact O-N 3.2Å; E137-F139 VanDerWaalsContact C-N 3.25Å; E137-F139 PolarHBondContact O-N 3.42Å; E137-F140 PolarHBondContact O-N 2.04Å; E137-A141 VanDerWaalsContact O-CB 3.3Å; E137-A141 WeakPolarHBondContact O-CB 3.43Å; E137-A141 PolarHBondContact O-N 3.19Å; E137-R144 IonicContact OE1-CZ 3.55Å; E137-R144 IonicContact OE1-NH1 3.25Å; E137-R144 PolarHBondContact OE1-NH1 2.85Å; E137-R144 IonicContact OE1-NH2 3.45Å; E137-R144 PolarHBondContact OE1-NH2 2.89Å
138	D	97.8	Very high	97.1	Very high	148 Å²	148	60.9 Å²	60.9	79%	0.791	32%	0.322	S	S	*	.	H	α-helix	trans	-59.5	-37.9	176.3	-65.5	-22.4	0	0	0	112.1	N136 F142	N136-D138 VanDerWaalsContact C-N 3.31Å; N136-D138 PolarHBondContact O-N 3.42Å; D138-F142 WeakPolarHBondContact O-CB 3.05Å; D138-F142 PolarHBondContact O-N 3.06Å
139	F	98.2	Very high	97.1	Very high	21 Å²	21	58.9 Å²	58.9	9%	0.092	31%	0.314	C	S	.	.	H	α-helix	trans	-73.9	-41.3	178.2	-173.3	-111.6	0	0	0	111.7	N136 E137 A141 F142 L143 V182 K185 V186 L189	N136-F139 WeakPolarHBondContact O-CA 3.42Å; N136-F139 WeakPolarHBondContact O-CB 3.49Å; N136-F139 PolarHBondContact O-N 3.45Å; E137-F139 VanDerWaalsContact C-N 3.25Å; E137-F139 PolarHBondContact O-N 3.42Å; F139-A141 VanDerWaalsContact C-N 3.34Å; F139-F142 HydrophobicContact CD2-CD1 4.22Å; F139-F142 HydrophobicContact CE2-CD1 4.18Å; F139-F142 HydrophobicContact CE2-CE1 4.45Å; F139-F142 WeakPolarHBondContact O-CB 3.3Å; F139-F142 PolarHBondContact O-N 3.46Å; F139-L143 HydrophobicContact CD1-CD1 3.95Å; F139-L143 HydrophobicContact CD1-CG 4.49Å; F139-L143 HydrophobicContact CE1-CD1 3.59Å; F139-L143 HydrophobicContact CE1-CG 4.22Å; F139-L143 HydrophobicContact CZ-CD1 4.09Å; F139-L143 HydrophobicContact CZ-CD2 4.39Å; F139-L143 HydrophobicContact CZ-CG 4.32Å; F139-L143 WeakPolarHBondContact O-CG 3.26Å; F139-L143 PolarHBondContact O-N 3.27Å; F139-V182 HydrophobicContact CE2-CG1 4.13Å; F139-V182 HydrophobicContact CE2-CG2 4.45Å; F139-V182 HydrophobicContact CZ-CG1 4.17Å; F139-K185 HydrophobicContact CB-CD 4.4Å; F139-K185 HydrophobicContact CD1-CD 3.92Å; F139-K185 HydrophobicContact CD1-CG 3.99Å; F139-K185 HydrophobicContact CD2-CD 3.83Å; F139-K185 HydrophobicContact CE1-CB 4.12Å; F139-K185 HydrophobicContact CE1-CD 4.07Å; F139-K185 HydrophobicContact CE1-CG 3.74Å; F139-K185 HydrophobicContact CE2-CB 4.26Å; F139-K185 HydrophobicContact CE2-CD 4Å; F139-K185 HydrophobicContact CE2-CG 4.29Å; F139-K185 HydrophobicContact CG-CD 3.78Å; F139-K185 HydrophobicContact CG-CG 4.36Å; F139-K185 HydrophobicContact CZ-CB 3.82Å; F139-K185 HydrophobicContact CZ-CD 4.1Å; F139-K185 HydrophobicContact CZ-CG 3.89Å; F139-V186 HydrophobicContact CE1-CG2 4.09Å; F139-V186 HydrophobicContact CZ-CG2 3.88Å; F139-L189 HydrophobicContact CD1-CD1 3.69Å; F139-L189 HydrophobicContact CE1-CD1 3.79Å
140	F	98	Very high	97	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-62.2	-42.7	172.5	-84.8	-94.5	0	0	0	110.8	V133 N136 E137 F142 L143 R144 L151 L154 L189	V133-F140 HydrophobicContact CG1-CD1 4.4Å; V133-F140 HydrophobicContact CG1-CD2 4.2Å; V133-F140 HydrophobicContact CG1-CE1 4.45Å; V133-F140 HydrophobicContact CG1-CE2 4.25Å; V133-F140 HydrophobicContact CG1-CG 4.3Å; V133-F140 HydrophobicContact CG1-CZ 4.38Å; V133-F140 HydrophobicContact CG2-CZ 4.3Å; N136-F140 HydrophobicContact CB-CD2 3.85Å; N136-F140 HydrophobicContact CB-CE2 3.93Å; N136-F140 WeakPolarHBondContact O-CD2 3.49Å; N136-F140 PolarHBondContact O-N 2.95Å; E137-F140 PolarHBondContact O-N 2.04Å; F140-F142 PolarHBondContact O-N 3.35Å; F140-L143 PolarHBondContact O-N 2.92Å; F140-R144 VanDerWaalsContact O-CG 3.28Å; F140-R144 WeakPolarHBondContact O-CG 3.27Å; F140-R144 PolarHBondContact O-N 2.98Å; F140-L151 HydrophobicContact CD1-CB 3.94Å; F140-L151 HydrophobicContact CE1-CB 4.46Å; F140-L154 HydrophobicContact CZ-CD1 4.27Å; F140-L189 HydrophobicContact CE2-CD1 3.99Å; F140-L189 HydrophobicContact CZ-CD1 4.39Å
141	A	97.9	Very high	96.8	Very high	38 Å²	38	59.9 Å²	59.9	31%	0.314	32%	0.322	S	S	.	.	H	α-helix	trans	-59.9	-45.1	175.6	0	0	0	0	0	112.3	E137 F139 R144 N145	E137-A141 VanDerWaalsContact O-CB 3.3Å; E137-A141 WeakPolarHBondContact O-CB 3.43Å; E137-A141 PolarHBondContact O-N 3.19Å; F139-A141 VanDerWaalsContact C-N 3.34Å; A141-R144 PolarHBondContact O-N 3.2Å; A141-N145 PolarHBondContact O-N 3.31Å
142	F	98.2	Very high	96.6	Very high	67 Å²	67	62.7 Å²	62.7	29%	0.294	34%	0.341	S	S	.	.	H	α-helix	trans	-55.5	-51.2	171.8	164.1	-103.3	0	0	0	111.6	D138 F139 F140 R144 N145 E146 W177 V182	D138-F142 WeakPolarHBondContact O-CB 3.05Å; D138-F142 PolarHBondContact O-N 3.06Å; F139-F142 HydrophobicContact CD2-CD1 4.22Å; F139-F142 HydrophobicContact CE2-CD1 4.18Å; F139-F142 HydrophobicContact CE2-CE1 4.45Å; F139-F142 WeakPolarHBondContact O-CB 3.3Å; F139-F142 PolarHBondContact O-N 3.46Å; F140-F142 PolarHBondContact O-N 3.35Å; F142-R144 VanDerWaalsContact C-N 3.34Å; F142-R144 PolarHBondContact O-N 3.37Å; F142-N145 PolarHBondContact O-N 3.03Å; F142-E146 HydrophobicContact CD2-CG 3.94Å; F142-E146 HydrophobicContact CE2-CG 3.55Å; F142-E146 HydrophobicContact CZ-CG 3.9Å; F142-E146 WeakPolarHBondContact O-CG 3.23Å; F142-E146 PolarHBondContact O-N 3.22Å; F142-W177 HydrophobicContact CE1-CE3 4.34Å; F142-W177 HydrophobicContact CE2-CB 4.48Å; F142-W177 HydrophobicContact CZ-CB 4.07Å; F142-W177 HydrophobicContact CZ-CE3 4.22Å; F142-V182 HydrophobicContact CE1-CG1 3.96Å; F142-V182 HydrophobicContact CE1-CG2 4.04Å; F142-V182 HydrophobicContact CZ-CG2 4.31Å
143	L	97.8	Very high	96.5	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-63	-38.3	179.4	-68.2	176.4	0	0	0	112.5	F139 F140 E146 T147 L151 I157 I160 W177 V186	F139-L143 HydrophobicContact CD1-CD1 3.95Å; F139-L143 HydrophobicContact CD1-CG 4.49Å; F139-L143 HydrophobicContact CE1-CD1 3.59Å; F139-L143 HydrophobicContact CE1-CG 4.22Å; F139-L143 HydrophobicContact CZ-CD1 4.09Å; F139-L143 HydrophobicContact CZ-CD2 4.39Å; F139-L143 HydrophobicContact CZ-CG 4.32Å; F139-L143 WeakPolarHBondContact O-CG 3.26Å; F139-L143 PolarHBondContact O-N 3.27Å; F140-L143 PolarHBondContact O-N 2.92Å; L143-E146 PolarHBondContact O-N 3Å; L143-T147 WeakPolarHBondContact O-CB 3.17Å; L143-T147 WeakPolarHBondContact O-CG2 3.47Å; L143-T147 PolarHBondContact O-N 3.44Å; L143-T147 PolarHBondContact O-OG1 3.09Å; L143-L151 HydrophobicContact CB-CD1 3.4Å; L143-L151 VanDerWaalsContact CB-CD1 3.4Å; L143-L151 HydrophobicContact CD1-CD1 4.32Å; L143-I157 HydrophobicContact CD1-CD1 3.83Å; L143-I160 HydrophobicContact CD1-CG1 4.41Å; L143-I160 HydrophobicContact CD1-CG2 4.34Å; L143-I160 HydrophobicContact CD2-CG2 4.07Å; L143-W177 HydrophobicContact CD2-CZ3 4.21Å; L143-V186 HydrophobicContact CD1-CG2 4.44Å
144	R	97.5	Very high	96.5	Very high	72 Å²	72	62 Å²	62	27%	0.272	34%	0.339	S	S	.	.	H	α-helix	trans	-62.3	-42.7	175.4	-69.1	-171.5	-60.4	-104.5	0.7	111.3	E137 F140 A141 F142 G148 L149 P150 L151	E137-R144 IonicContact OE1-CZ 3.55Å; E137-R144 IonicContact OE1-NH1 3.25Å; E137-R144 PolarHBondContact OE1-NH1 2.85Å; E137-R144 IonicContact OE1-NH2 3.45Å; E137-R144 PolarHBondContact OE1-NH2 2.89Å; F140-R144 VanDerWaalsContact O-CG 3.28Å; F140-R144 WeakPolarHBondContact O-CG 3.27Å; F140-R144 PolarHBondContact O-N 2.98Å; A141-R144 PolarHBondContact O-N 3.2Å; F142-R144 VanDerWaalsContact C-N 3.34Å; F142-R144 PolarHBondContact O-N 3.37Å; R144-G148 VanDerWaalsContact O-CA 3.28Å; R144-G148 WeakPolarHBondContact O-CA 3.21Å; R144-G148 PolarHBondContact O-N 2.88Å; R144-L149 VanDerWaalsContact CG-O 3.28Å; R144-L149 WeakPolarHBondContact CG-O 3.26Å; R144-P150 WeakPolarHBondContact CD-O 3.49Å; R144-L151 HydrophobicContact CG-CB 3.88Å; R144-L151 HydrophobicContact CG-CD1 4.06Å; R144-L151 HydrophobicContact CG-CG 4.15Å
145	N	97.6	Very high	96.5	Very high	128 Å²	128	56.6 Å²	56.6	68%	0.684	32%	0.318	S	S	*	.	H	α-helix	trans	-64.3	-44.9	177	-172.5	62.5	0	0	0	112.1	A141 F142	A141-N145 PolarHBondContact O-N 3.31Å; F142-N145 PolarHBondContact O-N 3.03Å
146	E	96.7	Very high	96.4	Very high	47 Å²	47	50.7 Å²	50.7	22%	0.22	29%	0.291	C	S	.	.	H	α-helix	trans	-77.4	-23.4	-175.8	-66.9	-52.5	133.1	0	0	114.1	F142 L143 Y176 W177	F142-E146 HydrophobicContact CD2-CG 3.94Å; F142-E146 HydrophobicContact CE2-CG 3.55Å; F142-E146 HydrophobicContact CZ-CG 3.9Å; F142-E146 WeakPolarHBondContact O-CG 3.23Å; F142-E146 PolarHBondContact O-N 3.22Å; L143-E146 PolarHBondContact O-N 3Å; E146-Y176 VanDerWaalsContact OE2-CZ 3.31Å; E146-Y176 PolarHBondContact OE2-OH 2.68Å; E146-W177 HydrophobicContact CB-CD2 4.04Å; E146-W177 HydrophobicContact CB-CG 4.02Å; E146-W177 HydrophobicContact CB-CZ2 4.44Å; E146-W177 HydrophobicContact CG-CB 4.14Å; E146-W177 HydrophobicContact CG-CD2 4.26Å; E146-W177 HydrophobicContact CG-CG 3.89Å
147	T	95.1	Very high	96.3	Very high	18 Å²	18	49.2 Å²	49.2	11%	0.11	28%	0.283	C	S	.	.	H	α-helix	trans	-113.8	-20.1	-175.8	67.5	0	0	0	0	114.8	T5 L143 L149 I160 W177	T5-T147 WeakPolarHBondContact CG2-O 3.09Å; L143-T147 WeakPolarHBondContact O-CB 3.17Å; L143-T147 WeakPolarHBondContact O-CG2 3.47Å; L143-T147 PolarHBondContact O-N 3.44Å; L143-T147 PolarHBondContact O-OG1 3.09Å; T147-L149 PolarHBondContact O-N 3.25Å; T147-L149 WeakPolarHBondContact OG1-CB 3.04Å; T147-L149 PolarHBondContact OG1-N 3.46Å; T147-I160 HydrophobicContact CG2-CD1 3.66Å; T147-W177 HydrophobicContact CG2-CH2 4.16Å; T147-W177 HydrophobicContact CG2-CZ2 3.8Å
148	G	95.2	Very high	96.1	Very high	68 Å²	68	49.5 Å²	49.5	70%	0.701	28%	0.281	S	S	*	.			trans	68.4	8.7	-171.7	0	0	0	0	0	114.3	R144	R144-G148 VanDerWaalsContact O-CA 3.28Å; R144-G148 WeakPolarHBondContact O-CA 3.21Å; R144-G148 PolarHBondContact O-N 2.88Å
149	L	95	Very high	95.9	Very high	53 Å²	53	46.3 Å²	46.3	28%	0.277	26%	0.26	S	S	.	.			trans	-81.1	148.4	175.4	-67	171.8	0	0	0	110.3	R144 T147 L151 F159 I160	R144-L149 VanDerWaalsContact CG-O 3.28Å; R144-L149 WeakPolarHBondContact CG-O 3.26Å; T147-L149 PolarHBondContact O-N 3.25Å; T147-L149 WeakPolarHBondContact OG1-CB 3.04Å; T147-L149 PolarHBondContact OG1-N 3.46Å; L149-L151 HydrophobicContact CB-CD2 3.96Å; L149-L151 HydrophobicContact CB-CG 3.94Å; L149-L151 HydrophobicContact CD1-CD2 4.48Å; L149-F159 HydrophobicContact CD1-CB 4.09Å; L149-I160 HydrophobicContact CD1-CD1 3.64Å
150	P	94.3	Very high	95.8	Very high	92 Å²	92	45.6 Å²	45.6	60%	0.597	26%	0.257	S	S	*	.			trans	-72.7	-29.1	-176	28.5	-35.8	0	0	0	113.7	R144 T152	R144-P150 WeakPolarHBondContact CD-O 3.49Å; P150-T152 HydrophobicContact CB-CG2 4.23Å; P150-T152 PolarHBondContact O-N 3.47Å
151	L	94.5	Very high	95.5	Very high	1 Å²	1	46 Å²	46	1%	0.005	26%	0.259	C	S	.	.			trans	37.9	60.9	176.6	-52.3	177.9	0	0	0	113.7	F140 L143 R144 L149 D156 I160	F140-L151 HydrophobicContact CD1-CB 3.94Å; F140-L151 HydrophobicContact CE1-CB 4.46Å; L143-L151 HydrophobicContact CB-CD1 3.4Å; L143-L151 VanDerWaalsContact CB-CD1 3.4Å; L143-L151 HydrophobicContact CD1-CD1 4.32Å; R144-L151 HydrophobicContact CG-CB 3.88Å; R144-L151 HydrophobicContact CG-CD1 4.06Å; R144-L151 HydrophobicContact CG-CG 4.15Å; L149-L151 HydrophobicContact CB-CD2 3.96Å; L149-L151 HydrophobicContact CB-CG 3.94Å; L149-L151 HydrophobicContact CD1-CD2 4.48Å; L151-D156 HydrophobicContact CD2-CB 3.93Å; L151-I160 HydrophobicContact CD1-CD1 3.98Å; L151-I160 HydrophobicContact CD1-CG1 4.01Å; L151-I160 HydrophobicContact CD2-CD1 4.03Å; L151-I160 HydrophobicContact CD2-CG1 3.78Å
152	T	92.6	Very high	95.2	Very high	114 Å²	114	47 Å²	47	70%	0.699	26%	0.259	S	S	*	.			trans	-88.7	-23.7	-173.2	50.1	0	0	0	0	113.7	P150 D156	P150-T152 HydrophobicContact CB-CG2 4.23Å; P150-T152 PolarHBondContact O-N 3.47Å; T152-D156 PolarHBondContact N-OD2 3.04Å; T152-D156 PolarHBondContact OG1-OD2 3.02Å
153	S	94.9	Very high	94.8	Very high	26 Å²	26	45.6 Å²	45.6	18%	0.182	26%	0.256	C	S	.	.	S	Bend	trans	-126.2	155	-179.4	-178.9	0	0	0	0	110	N155 D156	S153-N155 PolarHBondContact O-N 3.49Å; S153-N155 VanDerWaalsContact O-N 3.13Å; S153-N155 PolarHBondContact OG-N 2.85Å; S153-D156 PolarHBondContact N-OD2 3.49Å; S153-D156 WeakPolarHBondContact O-CB 3.47Å; S153-D156 PolarHBondContact O-N 3.27Å
154	L	96.7	Very high	94.6	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-52.7	-33.5	168.1	-178	60.9	0	0	0	111	F124 V129 I132 V133 F140 D156 I157 L189 L192 S193 Y196	F124-L154 HydrophobicContact CD1-CB 4.35Å; F124-L154 HydrophobicContact CE1-CB 4.49Å; V129-L154 HydrophobicContact CG1-CB 3.76Å; V129-L154 HydrophobicContact CG1-CD2 3.9Å; V129-L154 HydrophobicContact CG1-CG 4.49Å; I132-L154 HydrophobicContact CG2-CD2 4.4Å; V133-L154 HydrophobicContact CG2-CB 3.86Å; F140-L154 HydrophobicContact CZ-CD1 4.27Å; L154-D156 PolarHBondContact O-N 3.17Å; L154-I157 WeakPolarHBondContact O-CB 3.2Å; L154-I157 WeakPolarHBondContact O-CG2 3.42Å; L154-I157 PolarHBondContact O-N 3.49Å; L154-I157 VanDerWaalsContact O-N 3.13Å; L154-L189 HydrophobicContact CD1-CB 4.28Å; L154-L189 HydrophobicContact CD1-CD2 4.07Å; L154-L192 HydrophobicContact CD2-CB 4.45Å; L154-S193 PolarHBondContact O-OG 2.88Å; L154-Y196 HydrophobicContact CD2-CD2 3.84Å; L154-Y196 HydrophobicContact CD2-CE2 4.28Å
155	N	94.9	Very high	94.1	Very high	37 Å²	37	43.5 Å²	43.5	20%	0.198	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-58.3	-29.2	177.1	-164.9	38.4	0	0	0	114.1	F124 S153 I157 R158 S193 W197	F124-N155 HydrophobicContact CD1-CB 3.78Å; F124-N155 HydrophobicContact CD2-CB 4.13Å; F124-N155 HydrophobicContact CE1-CB 3.72Å; F124-N155 HydrophobicContact CE2-CB 4.08Å; F124-N155 HydrophobicContact CG-CB 4Å; F124-N155 HydrophobicContact CZ-CB 3.88Å; F124-N155 WeakPolarHBondContact CZ-OD1 3.45Å; S153-N155 PolarHBondContact O-N 3.49Å; S153-N155 VanDerWaalsContact O-N 3.13Å; S153-N155 PolarHBondContact OG-N 2.85Å; N155-I157 PolarHBondContact O-N 3.1Å; N155-R158 WeakPolarHBondContact O-CG 3.42Å; N155-S193 WeakPolarHBondContact CA-OG 3.3Å; N155-W197 WeakPolarHBondContact OD1-CZ3 3.27Å
156	D	95.6	Very high	93.6	Very high	28 Å²	28	37.8 Å²	37.8	15%	0.15	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-73.6	-14.8	-177	-62.2	-34.3	0	0	0	112.1	L151 T152 S153 L154 R158 F159	L151-D156 HydrophobicContact CD2-CB 3.93Å; T152-D156 PolarHBondContact N-OD2 3.04Å; T152-D156 PolarHBondContact OG1-OD2 3.02Å; S153-D156 PolarHBondContact N-OD2 3.49Å; S153-D156 WeakPolarHBondContact O-CB 3.47Å; S153-D156 PolarHBondContact O-N 3.27Å; L154-D156 PolarHBondContact O-N 3.17Å; D156-R158 PolarHBondContact O-N 2.95Å; D156-R158 VanDerWaalsContact O-N 3.09Å; D156-F159 HydrophobicContact CB-CD2 4.14Å; D156-F159 WeakPolarHBondContact O-CB 3.18Å; D156-F159 VanDerWaalsContact O-CD2 3.29Å; D156-F159 WeakPolarHBondContact O-CD2 3.5Å; D156-F159 PolarHBondContact O-N 3Å
157	I	96	Very high	93.1	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-59.2	-26.3	-180	-161.3	63.4	0	0	0	112.4	L143 L154 N155 F159 I160 F161 V186 L189 F190	L143-I157 HydrophobicContact CD1-CD1 3.83Å; L154-I157 WeakPolarHBondContact O-CB 3.2Å; L154-I157 WeakPolarHBondContact O-CG2 3.42Å; L154-I157 PolarHBondContact O-N 3.49Å; L154-I157 VanDerWaalsContact O-N 3.13Å; N155-I157 PolarHBondContact O-N 3.1Å; I157-F159 PolarHBondContact O-N 3.22Å; I157-I160 HydrophobicContact CD1-CB 4.35Å; I157-I160 HydrophobicContact CD1-CG1 4.42Å; I157-I160 WeakPolarHBondContact O-CA 3.41Å; I157-I160 WeakPolarHBondContact O-CB 3.4Å; I157-I160 PolarHBondContact O-N 3.39Å; I157-F161 PolarHBondContact O-N 3.47Å; I157-V186 HydrophobicContact CG1-CG1 4.43Å; I157-L189 HydrophobicContact CD1-CB 4.41Å; I157-L189 HydrophobicContact CD1-CD1 4.27Å; I157-L189 HydrophobicContact CG1-CB 3.87Å; I157-F190 HydrophobicContact CG2-CB 4.26Å; I157-F190 HydrophobicContact CG2-CD2 4.41Å
158	R	92.9	Very high	92.6	Very high	81 Å²	81	38.5 Å²	38.5	31%	0.306	22%	0.22	S	C	.	.	H	α-helix	trans	-57.3	-32.1	175	76	-176.5	-165.6	82.5	-7.4	112.8	N155 D156 I160 F161 D162 F190	N155-R158 WeakPolarHBondContact O-CG 3.42Å; D156-R158 PolarHBondContact O-N 2.95Å; D156-R158 VanDerWaalsContact O-N 3.09Å; R158-I160 PolarHBondContact O-N 3.01Å; R158-F161 PolarHBondContact O-N 2.95Å; R158-D162 PolarHBondContact O-N 3.07Å; R158-F190 HydrophobicContact CB-CD2 4.15Å; R158-F190 HydrophobicContact CB-CE2 3.88Å
159	F	94.1	Very high	92	Very high	82 Å²	82	36.8 Å²	36.8	36%	0.36	19%	0.194	S	C	.	.	H	α-helix	trans	-70.6	-18.4	178.7	-63	-65.3	0	0	0	112.5	L149 D156 I157 P163	L149-F159 HydrophobicContact CD1-CB 4.09Å; D156-F159 HydrophobicContact CB-CD2 4.14Å; D156-F159 WeakPolarHBondContact O-CB 3.18Å; D156-F159 VanDerWaalsContact O-CD2 3.29Å; D156-F159 WeakPolarHBondContact O-CD2 3.5Å; D156-F159 PolarHBondContact O-N 3Å; I157-F159 PolarHBondContact O-N 3.22Å; F159-P163 VanDerWaalsContact O-CD 3.3Å; F159-P163 WeakPolarHBondContact O-CD 2.83Å; F159-P163 WeakPolarHBondContact O-CG 3.17Å
160	I	95.8	Very high	91.3	Very high	5 Å²	5	36.2 Å²	36.2	3%	0.026	19%	0.19	C	C	.	.	H	α-helix	trans	-92.1	-47.6	172.4	-53	-64.1	0	0	0	109.5	L143 T147 L149 L151 I157 R158 P163 L164 V186	L143-I160 HydrophobicContact CD1-CG1 4.41Å; L143-I160 HydrophobicContact CD1-CG2 4.34Å; L143-I160 HydrophobicContact CD2-CG2 4.07Å; T147-I160 HydrophobicContact CG2-CD1 3.66Å; L149-I160 HydrophobicContact CD1-CD1 3.64Å; L151-I160 HydrophobicContact CD1-CD1 3.98Å; L151-I160 HydrophobicContact CD1-CG1 4.01Å; L151-I160 HydrophobicContact CD2-CD1 4.03Å; L151-I160 HydrophobicContact CD2-CG1 3.78Å; I157-I160 HydrophobicContact CD1-CB 4.35Å; I157-I160 HydrophobicContact CD1-CG1 4.42Å; I157-I160 WeakPolarHBondContact O-CA 3.41Å; I157-I160 WeakPolarHBondContact O-CB 3.4Å; I157-I160 PolarHBondContact O-N 3.39Å; R158-I160 PolarHBondContact O-N 3.01Å; I160-P163 WeakPolarHBondContact O-CD 3.34Å; I160-L164 HydrophobicContact CG2-CD1 3.58Å; I160-L164 WeakPolarHBondContact O-CB 3.37Å; I160-L164 WeakPolarHBondContact O-CD1 3.25Å; I160-L164 WeakPolarHBondContact O-CG 3.4Å; I160-L164 PolarHBondContact O-N 2.82Å; I160-V186 HydrophobicContact CB-CG1 4.45Å; I160-V186 HydrophobicContact CG2-CG1 4.05Å; I160-V186 HydrophobicContact CG2-CG2 3.91Å
161	F	93.2	Very high	90.8	Very high	10 Å²	10	41.1 Å²	41.1	4%	0.044	20%	0.202	C	C	.	.	H	α-helix	trans	-61.1	-53.5	-177.5	175	-98.4	0	0	0	112.8	I157 R158 L164 N165 V186 F190	I157-F161 PolarHBondContact O-N 3.47Å; R158-F161 PolarHBondContact O-N 2.95Å; F161-L164 PolarHBondContact O-N 3.28Å; F161-N165 HydrophobicContact CE1-CB 4.21Å; F161-N165 HydrophobicContact CE2-CB 4.21Å; F161-N165 HydrophobicContact CZ-CB 4.05Å; F161-N165 WeakPolarHBondContact O-CB 3.4Å; F161-N165 PolarHBondContact O-N 3.31Å; F161-V186 HydrophobicContact CB-CG1 3.8Å; F161-V186 HydrophobicContact CD2-CG1 4.23Å; F161-F190 HydrophobicContact CB-CB 3.98Å; F161-F190 HydrophobicContact CB-CD2 3.75Å; F161-F190 HydrophobicContact CB-CE2 4.41Å; F161-F190 HydrophobicContact CB-CG 3.86Å; F161-F190 HydrophobicContact CD1-CB 4.41Å; F161-F190 AromaticContact CD1-CD1 3.53Å; F161-F190 HydrophobicContact CD1-CD1 3.53Å; F161-F190 AromaticContact CD1-CD2 3.6Å; F161-F190 HydrophobicContact CD1-CD2 3.6Å; F161-F190 AromaticContact CD1-CE1 3.52Å; F161-F190 HydrophobicContact CD1-CE1 3.52Å; F161-F190 AromaticContact CD1-CE2 3.58Å; F161-F190 HydrophobicContact CD1-CE2 3.58Å; F161-F190 AromaticContact CD1-CG 3.56Å; F161-F190 HydrophobicContact CD1-CG 3.56Å; F161-F190 AromaticContact CD1-CZ 3.55Å; F161-F190 HydrophobicContact CD1-CZ 3.55Å; F161-F190 HydrophobicContact CD2-CB 3.91Å; F161-F190 AromaticContact CD2-CD1 3.97Å; F161-F190 HydrophobicContact CD2-CD1 3.97Å; F161-F190 AromaticContact CD2-CG 3.89Å; F161-F190 HydrophobicContact CD2-CG 3.89Å; F161-F190 AromaticContact CE1-CD1 3.49Å; F161-F190 HydrophobicContact CE1-CD1 3.49Å; F161-F190 VanDerWaalsContact CE1-CD1 3.49Å; F161-F190 HydrophobicContact CE1-CD2 4.36Å; F161-F190 AromaticContact CE1-CE1 3.26Å; F161-F190 HydrophobicContact CE1-CE1 3.26Å; F161-F190 HydrophobicContact CE1-CE2 4.17Å; F161-F190 HydrophobicContact CE1-CG 4.04Å; F161-F190 AromaticContact CE1-CZ 3.63Å; F161-F190 HydrophobicContact CE1-CZ 3.63Å; F161-F190 AromaticContact CE2-CD1 3.93Å; F161-F190 HydrophobicContact CE2-CD1 3.93Å; F161-F190 HydrophobicContact CE2-CE1 4.49Å; F161-F190 HydrophobicContact CE2-CG 4.33Å; F161-F190 HydrophobicContact CG-CB 3.83Å; F161-F190 AromaticContact CG-CD1 3.77Å; F161-F190 HydrophobicContact CG-CD1 3.77Å; F161-F190 AromaticContact CG-CD2 3.72Å; F161-F190 HydrophobicContact CG-CD2 3.72Å; F161-F190 HydrophobicContact CG-CE1 4.25Å; F161-F190 HydrophobicContact CG-CE2 4.2Å; F161-F190 AromaticContact CG-CG 3.47Å; F161-F190 HydrophobicContact CG-CG 3.47Å; F161-F190 VanDerWaalsContact CG-CG 3.47Å; F161-F190 HydrophobicContact CG-CZ 4.44Å; F161-F190 AromaticContact CZ-CD1 3.7Å; F161-F190 HydrophobicContact CZ-CD1 3.7Å; F161-F190 AromaticContact CZ-CE1 3.8Å; F161-F190 HydrophobicContact CZ-CE1 3.8Å; F161-F190 HydrophobicContact CZ-CG 4.4Å
162	D	90.4	Very high	90.3	Very high	58 Å²	58	44.2 Å²	44.2	31%	0.31	22%	0.216	S	C	.	.	H	α-helix	trans	-58.4	-51.5	-170.6	-66.5	-18	0	0	0	112.5	R158 N165 C166	R158-D162 PolarHBondContact O-N 3.07Å; D162-N165 PolarHBondContact O-N 3.45Å; D162-C166 WeakPolarHBondContact O-CB 3.44Å; D162-C166 PolarHBondContact O-N 3.06Å; D162-C166 PolarHBondContact O-SG 3.09Å
163	P	90.9	Very high	90	Very high	37 Å²	37	46.1 Å²	46.1	24%	0.24	22%	0.222	C	C	.	.	H	α-helix	trans	-66.4	-40.9	-178.6	-20.4	35	0	0	0	112.6	F159 I160 C166 A167	F159-P163 VanDerWaalsContact O-CD 3.3Å; F159-P163 WeakPolarHBondContact O-CD 2.83Å; F159-P163 WeakPolarHBondContact O-CG 3.17Å; I160-P163 WeakPolarHBondContact O-CD 3.34Å; P163-C166 PolarHBondContact O-N 2.93Å; P163-A167 WeakPolarHBondContact O-CB 3.29Å; P163-A167 PolarHBondContact O-N 2.99Å
164	L	92.2	Very high	89.7	Confident	12 Å²	12	47.7 Å²	47.7	6%	0.063	23%	0.23	C	C	.	.	H	α-helix	trans	-65.5	-42	179	-65.7	177.5	0	0	0	111.2	I160 F161 A167 R168 P175 W177 L178 F183	I160-L164 HydrophobicContact CG2-CD1 3.58Å; I160-L164 WeakPolarHBondContact O-CB 3.37Å; I160-L164 WeakPolarHBondContact O-CD1 3.25Å; I160-L164 WeakPolarHBondContact O-CG 3.4Å; I160-L164 PolarHBondContact O-N 2.82Å; F161-L164 PolarHBondContact O-N 3.28Å; L164-A167 PolarHBondContact O-N 3.37Å; L164-R168 WeakPolarHBondContact O-CG 3.03Å; L164-R168 PolarHBondContact O-N 3.46Å; L164-P175 HydrophobicContact CD2-CG 4.04Å; L164-W177 HydrophobicContact CD1-CH2 3.96Å; L164-W177 HydrophobicContact CD1-CZ3 4.18Å; L164-W177 HydrophobicContact CD2-CH2 3.93Å; L164-W177 HydrophobicContact CG-CH2 4.47Å; L164-L178 HydrophobicContact CD1-CD1 3.69Å; L164-L178 HydrophobicContact CD2-CD1 4.09Å; L164-L178 HydrophobicContact CD2-CD2 3.92Å; L164-L178 HydrophobicContact CD2-CG 4.48Å; L164-L178 HydrophobicContact CG-CD1 4.4Å; L164-F183 HydrophobicContact CB-CD2 4.16Å; L164-F183 HydrophobicContact CB-CE2 3.94Å
165	N	87.8	Confident	89.5	Confident	16 Å²	16	48.8 Å²	48.8	9%	0.086	24%	0.237	C	C	.	.	H	α-helix	trans	-63.9	-48.8	177.7	-178.2	34.9	0	0	0	111.5	F161 D162 A167 R168 I169 F183 F288	F161-N165 HydrophobicContact CE1-CB 4.21Å; F161-N165 HydrophobicContact CE2-CB 4.21Å; F161-N165 HydrophobicContact CZ-CB 4.05Å; F161-N165 WeakPolarHBondContact O-CB 3.4Å; F161-N165 PolarHBondContact O-N 3.31Å; D162-N165 PolarHBondContact O-N 3.45Å; N165-A167 VanDerWaalsContact C-N 3.32Å; N165-A167 PolarHBondContact O-N 3.18Å; N165-R168 PolarHBondContact O-N 2.94Å; N165-I169 WeakPolarHBondContact O-CG1 3.27Å; N165-I169 PolarHBondContact O-N 3.03Å; N165-I169 VanDerWaalsContact OD1-CD1 3.24Å; N165-I169 WeakPolarHBondContact OD1-CD1 3.48Å; N165-F183 HydrophobicContact CB-CZ 4.36Å; N165-F288 WeakPolarHBondContact OD1-CE1 3.14Å; N165-F288 WeakPolarHBondContact OD1-CZ 3.36Å
166	C	86	Confident	89.5	Confident	9 Å²	9	55.4 Å²	55.4	6%	0.061	26%	0.261	C	S	.	.	H	α-helix	trans	-54	-49.4	172.4	-72.4	0	0	0	0	111.1	C9 D162 P163 R168 I169 H170	C9-C166 HydrophobicContact CB-CB 4.16Å; C9-C166 WeakPolarHBondContact CB-SG 3.46Å; C9-C166 WeakPolarHBondContact SG-CB 3.42Å; C9-C166 CovalentContact SG-SG 2.06Å; C9-C166 PolarHBondContact SG-SG 2.94Å; D162-C166 WeakPolarHBondContact O-CB 3.44Å; D162-C166 PolarHBondContact O-N 3.06Å; D162-C166 PolarHBondContact O-SG 3.09Å; P163-C166 PolarHBondContact O-N 2.93Å; C166-R168 PolarHBondContact O-N 3.48Å; C166-I169 PolarHBondContact O-N 3.41Å; C166-H170 WeakPolarHBondContact O-CB 3.17Å; C166-H170 PolarHBondContact O-CD2 3.44Å; C166-H170 PolarHBondContact O-N 2.9Å
167	A	87.3	Confident	89.5	Confident	3 Å²	3	55.7 Å²	55.7	3%	0.025	26%	0.26	C	S	.	.	H	α-helix	trans	-60	-45.5	-178.3	0	0	0	0	0	112	P163 L164 N165 K171 H172 T174	P163-A167 WeakPolarHBondContact O-CB 3.29Å; P163-A167 PolarHBondContact O-N 2.99Å; L164-A167 PolarHBondContact O-N 3.37Å; N165-A167 VanDerWaalsContact C-N 3.32Å; N165-A167 PolarHBondContact O-N 3.18Å; A167-K171 PolarHBondContact O-N 2.65Å; A167-H172 HydrophobicContact CB-CB 4.24Å; A167-H172 PolarHBondContact O-N 3.01Å; A167-T174 HydrophobicContact CB-CG2 4.38Å
168	R	85.2	Confident	89.5	Confident	76 Å²	76	56.4 Å²	56.4	29%	0.287	26%	0.264	S	S	.	.	H	α-helix	trans	-65	-46.7	178.9	-73.1	-174.8	72.1	114	-0.4	112.6	L164 N165 C166 H170 K171 T174 L178 D180	L164-R168 WeakPolarHBondContact O-CG 3.03Å; L164-R168 PolarHBondContact O-N 3.46Å; N165-R168 PolarHBondContact O-N 2.94Å; C166-R168 PolarHBondContact O-N 3.48Å; R168-H170 VanDerWaalsContact C-N 3.3Å; R168-H170 PolarHBondContact O-N 3.44Å; R168-K171 PolarHBondContact O-N 3.34Å; R168-K171 VanDerWaalsContact O-N 3.13Å; R168-T174 HydrophobicContact CG-CG2 3.88Å; R168-L178 HydrophobicContact CG-CD2 4.35Å; R168-D180 IonicContact CZ-OD1 3.96Å; R168-D180 VanDerWaalsContact CZ-OD1 3.29Å; R168-D180 IonicContact NH1-OD1 3.64Å; R168-D180 PolarHBondContact NH1-OD1 3.13Å; R168-D180 IonicContact NH2-OD1 3Å; R168-D180 PolarHBondContact NH2-OD1 3.06Å
169	I	80.9	Confident	89.5	Confident	33 Å²	33	55.2 Å²	55.2	17%	0.169	27%	0.267	C	S	.	.	H	α-helix	trans	-62.5	-40.4	-178.9	-71.8	172.6	0	0	0	111.2	L19 N165 C166 K171 Y261 F288	L19-I169 HydrophobicContact CD2-CG2 4.19Å; N165-I169 WeakPolarHBondContact O-CG1 3.27Å; N165-I169 PolarHBondContact O-N 3.03Å; N165-I169 VanDerWaalsContact OD1-CD1 3.24Å; N165-I169 WeakPolarHBondContact OD1-CD1 3.48Å; C166-I169 PolarHBondContact O-N 3.41Å; I169-K171 VanDerWaalsContact C-N 3.27Å; I169-K171 PolarHBondContact O-N 3.44Å; I169-Y261 HydrophobicContact CB-CE2 4.44Å; I169-Y261 HydrophobicContact CD1-CD2 3.76Å; I169-Y261 HydrophobicContact CD1-CE2 3.38Å; I169-Y261 HydrophobicContact CG1-CE2 4.47Å; I169-Y261 HydrophobicContact CG2-CD2 4.24Å; I169-Y261 HydrophobicContact CG2-CE2 4.05Å; I169-F288 HydrophobicContact CD1-CZ 4.25Å
170	H	80.9	Confident	89.4	Confident	40 Å²	40	54.7 Å²	54.7	19%	0.185	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	6.7	179.4	-63.6	-60.5	0	0	0	113.8	S16 C166 R168 H172	S16-H170 WeakPolarHBondContact CA-CE1 3.46Å; S16-H170 VanDerWaalsContact CB-CE1 3.42Å; S16-H170 WeakPolarHBondContact CB-CE1 3.23Å; S16-H170 WeakPolarHBondContact CB-NE2 3.48Å; C166-H170 WeakPolarHBondContact O-CB 3.17Å; C166-H170 PolarHBondContact O-CD2 3.44Å; C166-H170 PolarHBondContact O-N 2.9Å; R168-H170 VanDerWaalsContact C-N 3.3Å; R168-H170 PolarHBondContact O-N 3.44Å; H170-H172 VanDerWaalsContact CB-CD2 3.43Å; H170-H172 WeakPolarHBondContact CB-CD2 3.07Å; H170-H172 PolarHBondContact O-N 2.75Å
171	K	83.9	Confident	89.3	Confident	196 Å²	196	59.2 Å²	59.2	85%	0.852	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	36.3	-179	-54.8	-179.4	179.6	-178.1	0	112.8	A167 R168 I169	A167-K171 PolarHBondContact O-N 2.65Å; R168-K171 PolarHBondContact O-N 3.34Å; R168-K171 VanDerWaalsContact O-N 3.13Å; I169-K171 VanDerWaalsContact C-N 3.27Å; I169-K171 PolarHBondContact O-N 3.44Å
172	H	83.4	Confident	89.3	Confident	65 Å²	65	59.6 Å²	59.6	30%	0.301	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-77.6	164.1	170.7	-70.2	-52.4	0	0	0	110.7	A167 H170 T174	A167-H172 HydrophobicContact CB-CB 4.24Å; A167-H172 PolarHBondContact O-N 3.01Å; H170-H172 VanDerWaalsContact CB-CD2 3.43Å; H170-H172 WeakPolarHBondContact CB-CD2 3.07Å; H170-H172 PolarHBondContact O-N 2.75Å; H172-T174 PolarHBondContact O-N 2.86Å
173	L	88.2	Confident	89.5	Confident	155 Å²	155	57 Å²	57	81%	0.812	28%	0.282	S	S	*	.	P	Polyproline II helix	trans	-58	125.2	172.3	-97.4	73.8	0	0	0	109.7
174	T	88.7	Confident	89.5	Confident	59 Å²	59	59.6 Å²	59.6	36%	0.362	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-91.9	154.4	170.2	52.3	0	0	0	0	109.9	A167 R168 H172 L178	A167-T174 HydrophobicContact CB-CG2 4.38Å; R168-T174 HydrophobicContact CG-CG2 3.88Å; H172-T174 PolarHBondContact O-N 2.86Å; T174-L178 HydrophobicContact CG2-CD2 3.63Å
175	P	92.6	Very high	89.6	Confident	23 Å²	23	62.6 Å²	62.6	15%	0.149	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-57.5	149.9	173.6	-23	33.9	0	0	0	112.2	L164 W177 L178	L164-P175 HydrophobicContact CD2-CG 4.04Å; P175-W177 HydrophobicContact CB-CD2 3.85Å; P175-W177 HydrophobicContact CB-CG 4.08Å; P175-W177 HydrophobicContact CB-CZ2 3.77Å; P175-W177 VanDerWaalsContact CB-NE1 3.28Å; P175-W177 HydrophobicContact CG-CH2 4.35Å; P175-W177 HydrophobicContact CG-CZ2 3.7Å; P175-W177 PolarHBondContact O-N 3.43Å; P175-W177 VanDerWaalsContact O-N 3.16Å; P175-L178 WeakPolarHBondContact O-CB 3.24Å; P175-L178 PolarHBondContact O-N 3.43Å
176	Y	94.6	Very high	90	Very high	175 Å²	175	61.8 Å²	61.8	69%	0.686	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-28	-177.8	67.5	-95	0	0	0	113.3	E146 L178	E146-Y176 VanDerWaalsContact OE2-CZ 3.31Å; E146-Y176 PolarHBondContact OE2-OH 2.68Å; Y176-L178 VanDerWaalsContact C-N 3.31Å
177	W	95.2	Very high	90.2	Very high	34 Å²	34	61.8 Å²	61.8	13%	0.129	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-8.2	-179.4	53.8	-107.8	0	0	0	113.2	F142 L143 E146 T147 L164 P175 S179 V182	F142-W177 HydrophobicContact CE1-CE3 4.34Å; F142-W177 HydrophobicContact CE2-CB 4.48Å; F142-W177 HydrophobicContact CZ-CB 4.07Å; F142-W177 HydrophobicContact CZ-CE3 4.22Å; L143-W177 HydrophobicContact CD2-CZ3 4.21Å; E146-W177 HydrophobicContact CB-CD2 4.04Å; E146-W177 HydrophobicContact CB-CG 4.02Å; E146-W177 HydrophobicContact CB-CZ2 4.44Å; E146-W177 HydrophobicContact CG-CB 4.14Å; E146-W177 HydrophobicContact CG-CD2 4.26Å; E146-W177 HydrophobicContact CG-CG 3.89Å; T147-W177 HydrophobicContact CG2-CH2 4.16Å; T147-W177 HydrophobicContact CG2-CZ2 3.8Å; L164-W177 HydrophobicContact CD1-CH2 3.96Å; L164-W177 HydrophobicContact CD1-CZ3 4.18Å; L164-W177 HydrophobicContact CD2-CH2 3.93Å; L164-W177 HydrophobicContact CG-CH2 4.47Å; P175-W177 HydrophobicContact CB-CD2 3.85Å; P175-W177 HydrophobicContact CB-CG 4.08Å; P175-W177 HydrophobicContact CB-CZ2 3.77Å; P175-W177 VanDerWaalsContact CB-NE1 3.28Å; P175-W177 HydrophobicContact CG-CH2 4.35Å; P175-W177 HydrophobicContact CG-CZ2 3.7Å; P175-W177 PolarHBondContact O-N 3.43Å; P175-W177 VanDerWaalsContact O-N 3.16Å; W177-S179 PolarHBondContact O-N 3.36Å; W177-S179 VanDerWaalsContact O-N 3.13Å; W177-V182 HydrophobicContact CE3-CG1 4.23Å; W177-V182 HydrophobicContact CZ3-CG1 4.13Å
178	L	94.6	Very high	90.5	Very high	16 Å²	16	65.1 Å²	65.1	8%	0.084	31%	0.313	C	S	.	.			trans	-83.3	89.6	-177.2	-171.7	72.6	0	0	0	111.4	L164 R168 T174 P175 Y176 V182 F183	L164-L178 HydrophobicContact CD1-CD1 3.69Å; L164-L178 HydrophobicContact CD2-CD1 4.09Å; L164-L178 HydrophobicContact CD2-CD2 3.92Å; L164-L178 HydrophobicContact CD2-CG 4.48Å; L164-L178 HydrophobicContact CG-CD1 4.4Å; R168-L178 HydrophobicContact CG-CD2 4.35Å; T174-L178 HydrophobicContact CG2-CD2 3.63Å; P175-L178 WeakPolarHBondContact O-CB 3.24Å; P175-L178 PolarHBondContact O-N 3.43Å; Y176-L178 VanDerWaalsContact C-N 3.31Å; L178-V182 HydrophobicContact CD1-CG1 4.07Å; L178-F183 HydrophobicContact CD1-CB 4Å; L178-F183 HydrophobicContact CD1-CD2 4.24Å; L178-F183 HydrophobicContact CG-CB 4.45Å
179	S	93.8	Very high	90.9	Very high	55 Å²	55	61.8 Å²	61.8	39%	0.385	30%	0.3	S	S	.	.			trans	-80.8	166.6	164.9	73.1	0	0	0	0	111.9	W177 D181 V182 F183	W177-S179 PolarHBondContact O-N 3.36Å; W177-S179 VanDerWaalsContact O-N 3.13Å; S179-D181 VanDerWaalsContact C-N 3.27Å; S179-D181 PolarHBondContact O-N 2.98Å; S179-V182 PolarHBondContact O-N 3.39Å; S179-V182 WeakPolarHBondContact OG-CG2 3.44Å; S179-V182 PolarHBondContact OG-N 3.42Å; S179-F183 PolarHBondContact O-N 3.25Å
180	D	91.2	Very high	91.5	Very high	71 Å²	71	61 Å²	61	38%	0.38	30%	0.296	S	S	.	.	H	α-helix	trans	-63.3	-33.9	174.5	-75.1	-25.5	0	0	0	112.2	R168 F183 R184 F290	R168-D180 IonicContact CZ-OD1 3.96Å; R168-D180 VanDerWaalsContact CZ-OD1 3.29Å; R168-D180 IonicContact NH1-OD1 3.64Å; R168-D180 PolarHBondContact NH1-OD1 3.13Å; R168-D180 IonicContact NH2-OD1 3Å; R168-D180 PolarHBondContact NH2-OD1 3.06Å; D180-F183 PolarHBondContact O-N 3.4Å; D180-R184 WeakPolarHBondContact O-CB 3.23Å; D180-R184 PolarHBondContact O-N 3.39Å; D180-F290 HydrophobicContact CB-CE1 4.35Å; D180-F290 HydrophobicContact CB-CZ 4.43Å
181	D	93.6	Very high	92	Very high	100 Å²	100	59.6 Å²	59.6	54%	0.535	29%	0.291	S	S	.	.	H	α-helix	trans	-67.9	-43.1	175.7	-69.2	-30.2	0	0	0	112.4	S179 F183 R184 K185	S179-D181 VanDerWaalsContact C-N 3.27Å; S179-D181 PolarHBondContact O-N 2.98Å; D181-F183 VanDerWaalsContact C-N 3.34Å; D181-R184 PolarHBondContact O-N 2.98Å; D181-R184 IonicContact OD1-CZ 3.3Å; D181-R184 IonicContact OD1-NE 2.6Å; D181-R184 IonicContact OD1-NH2 2.74Å; D181-R184 PolarHBondContact OD1-NH2 3.42Å; D181-K185 PolarHBondContact O-N 3.3Å
182	V	95.1	Very high	92.4	Very high	19 Å²	19	53.4 Å²	53.4	12%	0.115	27%	0.267	C	S	.	.	H	α-helix	trans	-60.7	-47.1	174.3	170.2	0	0	0	0	109.7	F139 F142 W177 L178 S179 R184 K185 V186	F139-V182 HydrophobicContact CE2-CG1 4.13Å; F139-V182 HydrophobicContact CE2-CG2 4.45Å; F139-V182 HydrophobicContact CZ-CG1 4.17Å; F142-V182 HydrophobicContact CE1-CG1 3.96Å; F142-V182 HydrophobicContact CE1-CG2 4.04Å; F142-V182 HydrophobicContact CZ-CG2 4.31Å; W177-V182 HydrophobicContact CE3-CG1 4.23Å; W177-V182 HydrophobicContact CZ3-CG1 4.13Å; L178-V182 HydrophobicContact CD1-CG1 4.07Å; S179-V182 PolarHBondContact O-N 3.39Å; S179-V182 WeakPolarHBondContact OG-CG2 3.44Å; S179-V182 PolarHBondContact OG-N 3.42Å; V182-R184 PolarHBondContact O-N 2.7Å; V182-K185 PolarHBondContact O-N 2.74Å; V182-V186 WeakPolarHBondContact O-CG2 3.48Å; V182-V186 PolarHBondContact O-N 2.93Å
183	F	93.7	Very high	92.9	Very high	4 Å²	4	50.5 Å²	50.5	2%	0.018	25%	0.254	C	S	.	.	H	α-helix	trans	-63.1	-42.9	-179.9	-172.8	-110.1	0	0	0	112.2	L164 N165 L178 S179 D180 D181 K185 V186 C187 F288	L164-F183 HydrophobicContact CB-CD2 4.16Å; L164-F183 HydrophobicContact CB-CE2 3.94Å; N165-F183 HydrophobicContact CB-CZ 4.36Å; L178-F183 HydrophobicContact CD1-CB 4Å; L178-F183 HydrophobicContact CD1-CD2 4.24Å; L178-F183 HydrophobicContact CG-CB 4.45Å; S179-F183 PolarHBondContact O-N 3.25Å; D180-F183 PolarHBondContact O-N 3.4Å; D181-F183 VanDerWaalsContact C-N 3.34Å; F183-K185 PolarHBondContact O-N 3.46Å; F183-V186 WeakPolarHBondContact O-CB 3.25Å; F183-V186 PolarHBondContact O-N 2.96Å; F183-C187 VanDerWaalsContact CE1-SG 3.59Å; F183-C187 PolarHBondContact O-N 3.23Å; F183-C187 PolarHBondContact O-SG 3.13Å; F183-F288 HydrophobicContact CE1-CD1 4.32Å; F183-F288 HydrophobicContact CE1-CE1 4.19Å; F183-F288 HydrophobicContact CZ-CE1 4.18Å
184	R	91.6	Very high	93.1	Very high	90 Å²	90	44 Å²	44	34%	0.34	22%	0.22	S	C	.	.	H	α-helix	trans	-57.7	-47.3	175.4	175.2	168.2	50.8	165	-1.4	111.6	D180 D181 V182 V186 C187 D188	D180-R184 WeakPolarHBondContact O-CB 3.23Å; D180-R184 PolarHBondContact O-N 3.39Å; D181-R184 PolarHBondContact O-N 2.98Å; D181-R184 IonicContact OD1-CZ 3.3Å; D181-R184 IonicContact OD1-NE 2.6Å; D181-R184 IonicContact OD1-NH2 2.74Å; D181-R184 PolarHBondContact OD1-NH2 3.42Å; V182-R184 PolarHBondContact O-N 2.7Å; R184-V186 VanDerWaalsContact C-N 3.32Å; R184-V186 PolarHBondContact O-N 2.96Å; R184-C187 WeakPolarHBondContact O-CA 3.27Å; R184-C187 WeakPolarHBondContact O-CB 3.39Å; R184-C187 PolarHBondContact O-N 3.15Å; R184-D188 PolarHBondContact O-N 3.24Å
185	K	94.5	Very high	93.2	Very high	75 Å²	75	42.3 Å²	42.3	33%	0.326	21%	0.212	S	C	.	.	H	α-helix	trans	-64.1	-35.7	178.1	-169.8	165.4	-178.7	171.8	0	112.8	N136 F139 D181 V182 F183 D188 L189	N136-K185 WeakPolarHBondContact OD1-CE 3.43Å; N136-K185 PolarHBondContact OD1-NZ 2.78Å; F139-K185 HydrophobicContact CB-CD 4.4Å; F139-K185 HydrophobicContact CD1-CD 3.92Å; F139-K185 HydrophobicContact CD1-CG 3.99Å; F139-K185 HydrophobicContact CD2-CD 3.83Å; F139-K185 HydrophobicContact CE1-CB 4.12Å; F139-K185 HydrophobicContact CE1-CD 4.07Å; F139-K185 HydrophobicContact CE1-CG 3.74Å; F139-K185 HydrophobicContact CE2-CB 4.26Å; F139-K185 HydrophobicContact CE2-CD 4Å; F139-K185 HydrophobicContact CE2-CG 4.29Å; F139-K185 HydrophobicContact CG-CD 3.78Å; F139-K185 HydrophobicContact CG-CG 4.36Å; F139-K185 HydrophobicContact CZ-CB 3.82Å; F139-K185 HydrophobicContact CZ-CD 4.1Å; F139-K185 HydrophobicContact CZ-CG 3.89Å; D181-K185 PolarHBondContact O-N 3.3Å; V182-K185 PolarHBondContact O-N 2.74Å; F183-K185 PolarHBondContact O-N 3.46Å; K185-D188 PolarHBondContact O-N 3.22Å; K185-L189 HydrophobicContact CG-CD1 4.4Å; K185-L189 WeakPolarHBondContact O-CG 3.42Å; K185-L189 PolarHBondContact O-N 3.46Å; K185-L189 VanDerWaalsContact O-N 3.1Å
186	V	94.8	Very high	93.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62.3	-43.6	171	172.8	0	0	0	0	111	F139 L143 I157 I160 F161 V182 F183 R184 L189 F190	F139-V186 HydrophobicContact CE1-CG2 4.09Å; F139-V186 HydrophobicContact CZ-CG2 3.88Å; L143-V186 HydrophobicContact CD1-CG2 4.44Å; I157-V186 HydrophobicContact CG1-CG1 4.43Å; I160-V186 HydrophobicContact CB-CG1 4.45Å; I160-V186 HydrophobicContact CG2-CG1 4.05Å; I160-V186 HydrophobicContact CG2-CG2 3.91Å; F161-V186 HydrophobicContact CB-CG1 3.8Å; F161-V186 HydrophobicContact CD2-CG1 4.23Å; V182-V186 WeakPolarHBondContact O-CG2 3.48Å; V182-V186 PolarHBondContact O-N 2.93Å; F183-V186 WeakPolarHBondContact O-CB 3.25Å; F183-V186 PolarHBondContact O-N 2.96Å; R184-V186 VanDerWaalsContact C-N 3.32Å; R184-V186 PolarHBondContact O-N 2.96Å; V186-L189 PolarHBondContact O-N 2.95Å; V186-F190 VanDerWaalsContact O-CB 3.27Å; V186-F190 WeakPolarHBondContact O-CB 3.29Å; V186-F190 PolarHBondContact O-N 3.1Å
187	C	91.5	Very high	93	Very high	8 Å²	8	36.6 Å²	36.6	5%	0.054	19%	0.187	C	C	.	.	H	α-helix	trans	-61.3	-44.4	176.9	-67	0	0	0	0	112.2	F183 R184 F190 A191	F183-C187 VanDerWaalsContact CE1-SG 3.59Å; F183-C187 PolarHBondContact O-N 3.23Å; F183-C187 PolarHBondContact O-SG 3.13Å; R184-C187 WeakPolarHBondContact O-CA 3.27Å; R184-C187 WeakPolarHBondContact O-CB 3.39Å; R184-C187 PolarHBondContact O-N 3.15Å; C187-F190 PolarHBondContact O-N 3.46Å; C187-A191 WeakPolarHBondContact O-CB 3.41Å; C187-A191 PolarHBondContact O-N 2.82Å
188	D	92.3	Very high	92.8	Very high	74 Å²	74	35.1 Å²	35.1	40%	0.396	18%	0.181	S	C	.	.	H	α-helix	trans	-62.8	-46.3	179.9	-63	-24.9	0	0	0	111.1	R184 K185 F190 A191 L192	R184-D188 PolarHBondContact O-N 3.24Å; K185-D188 PolarHBondContact O-N 3.22Å; D188-F190 VanDerWaalsContact C-N 3.34Å; D188-F190 PolarHBondContact O-N 3.33Å; D188-A191 PolarHBondContact O-N 3.41Å; D188-L192 WeakPolarHBondContact O-CG 3.41Å; D188-L192 PolarHBondContact O-N 3.28Å
189	L	94.5	Very high	92.5	Very high	6 Å²	6	38.5 Å²	38.5	3%	0.031	20%	0.195	C	C	.	.	H	α-helix	trans	-65.1	-36.5	176	-70.5	172.3	0	0	0	112.2	I132 F139 F140 L154 I157 K185 V186 L192 S193	I132-L189 HydrophobicContact CG2-CD2 4.43Å; F139-L189 HydrophobicContact CD1-CD1 3.69Å; F139-L189 HydrophobicContact CE1-CD1 3.79Å; F140-L189 HydrophobicContact CE2-CD1 3.99Å; F140-L189 HydrophobicContact CZ-CD1 4.39Å; L154-L189 HydrophobicContact CD1-CB 4.28Å; L154-L189 HydrophobicContact CD1-CD2 4.07Å; I157-L189 HydrophobicContact CD1-CB 4.41Å; I157-L189 HydrophobicContact CD1-CD1 4.27Å; I157-L189 HydrophobicContact CG1-CB 3.87Å; K185-L189 HydrophobicContact CG-CD1 4.4Å; K185-L189 WeakPolarHBondContact O-CG 3.42Å; K185-L189 PolarHBondContact O-N 3.46Å; K185-L189 VanDerWaalsContact O-N 3.1Å; V186-L189 PolarHBondContact O-N 2.95Å; L189-L192 PolarHBondContact O-N 2.6Å; L189-S193 WeakPolarHBondContact O-CB 3.38Å; L189-S193 PolarHBondContact O-N 2.72Å
190	F	93.5	Very high	92.4	Very high	17 Å²	17	37.1 Å²	37.1	8%	0.075	19%	0.19	C	C	.	.	H	α-helix	trans	-67.3	-40.7	174.8	178.2	-101.4	0	0	0	112.4	I157 R158 F161 V186 C187 D188 L192 S193 T194 V258	I157-F190 HydrophobicContact CG2-CB 4.26Å; I157-F190 HydrophobicContact CG2-CD2 4.41Å; R158-F190 HydrophobicContact CB-CD2 4.15Å; R158-F190 HydrophobicContact CB-CE2 3.88Å; F161-F190 HydrophobicContact CB-CB 3.98Å; F161-F190 HydrophobicContact CB-CD2 3.75Å; F161-F190 HydrophobicContact CB-CE2 4.41Å; F161-F190 HydrophobicContact CB-CG 3.86Å; F161-F190 HydrophobicContact CD1-CB 4.41Å; F161-F190 AromaticContact CD1-CD1 3.53Å; F161-F190 HydrophobicContact CD1-CD1 3.53Å; F161-F190 AromaticContact CD1-CD2 3.6Å; F161-F190 HydrophobicContact CD1-CD2 3.6Å; F161-F190 AromaticContact CD1-CE1 3.52Å; F161-F190 HydrophobicContact CD1-CE1 3.52Å; F161-F190 AromaticContact CD1-CE2 3.58Å; F161-F190 HydrophobicContact CD1-CE2 3.58Å; F161-F190 AromaticContact CD1-CG 3.56Å; F161-F190 HydrophobicContact CD1-CG 3.56Å; F161-F190 AromaticContact CD1-CZ 3.55Å; F161-F190 HydrophobicContact CD1-CZ 3.55Å; F161-F190 HydrophobicContact CD2-CB 3.91Å; F161-F190 AromaticContact CD2-CD1 3.97Å; F161-F190 HydrophobicContact CD2-CD1 3.97Å; F161-F190 AromaticContact CD2-CG 3.89Å; F161-F190 HydrophobicContact CD2-CG 3.89Å; F161-F190 AromaticContact CE1-CD1 3.49Å; F161-F190 HydrophobicContact CE1-CD1 3.49Å; F161-F190 VanDerWaalsContact CE1-CD1 3.49Å; F161-F190 HydrophobicContact CE1-CD2 4.36Å; F161-F190 AromaticContact CE1-CE1 3.26Å; F161-F190 HydrophobicContact CE1-CE1 3.26Å; F161-F190 HydrophobicContact CE1-CE2 4.17Å; F161-F190 HydrophobicContact CE1-CG 4.04Å; F161-F190 AromaticContact CE1-CZ 3.63Å; F161-F190 HydrophobicContact CE1-CZ 3.63Å; F161-F190 AromaticContact CE2-CD1 3.93Å; F161-F190 HydrophobicContact CE2-CD1 3.93Å; F161-F190 HydrophobicContact CE2-CE1 4.49Å; F161-F190 HydrophobicContact CE2-CG 4.33Å; F161-F190 HydrophobicContact CG-CB 3.83Å; F161-F190 AromaticContact CG-CD1 3.77Å; F161-F190 HydrophobicContact CG-CD1 3.77Å; F161-F190 AromaticContact CG-CD2 3.72Å; F161-F190 HydrophobicContact CG-CD2 3.72Å; F161-F190 HydrophobicContact CG-CE1 4.25Å; F161-F190 HydrophobicContact CG-CE2 4.2Å; F161-F190 AromaticContact CG-CG 3.47Å; F161-F190 HydrophobicContact CG-CG 3.47Å; F161-F190 VanDerWaalsContact CG-CG 3.47Å; F161-F190 HydrophobicContact CG-CZ 4.44Å; F161-F190 AromaticContact CZ-CD1 3.7Å; F161-F190 HydrophobicContact CZ-CD1 3.7Å; F161-F190 AromaticContact CZ-CE1 3.8Å; F161-F190 HydrophobicContact CZ-CE1 3.8Å; F161-F190 HydrophobicContact CZ-CG 4.4Å; V186-F190 VanDerWaalsContact O-CB 3.27Å; V186-F190 WeakPolarHBondContact O-CB 3.29Å; V186-F190 PolarHBondContact O-N 3.1Å; C187-F190 PolarHBondContact O-N 3.46Å; D188-F190 VanDerWaalsContact C-N 3.34Å; D188-F190 PolarHBondContact O-N 3.33Å; F190-L192 VanDerWaalsContact C-N 3.34Å; F190-S193 PolarHBondContact O-N 3.28Å; F190-T194 WeakPolarHBondContact O-CB 3.28Å; F190-T194 PolarHBondContact O-N 3.19Å; F190-T194 PolarHBondContact O-OG1 2.62Å; F190-V258 HydrophobicContact CD1-CG1 4.43Å; F190-V258 HydrophobicContact CE1-CG1 4.06Å
191	A	90.7	Very high	92.4	Very high	10 Å²	10	40 Å²	40	8%	0.083	21%	0.206	C	C	.	.	H	α-helix	trans	-62.7	-42.7	175.7	0	0	0	0	0	111.2	C187 D188 T194 A195 T255 V258	C187-A191 WeakPolarHBondContact O-CB 3.41Å; C187-A191 PolarHBondContact O-N 2.82Å; D188-A191 PolarHBondContact O-N 3.41Å; A191-T194 PolarHBondContact O-N 2.81Å; A191-A195 PolarHBondContact O-N 3Å; A191-A195 VanDerWaalsContact O-N 3.09Å; A191-T255 HydrophobicContact CB-CG2 4.35Å; A191-V258 HydrophobicContact CB-CG2 3.75Å
192	L	92.3	Very high	92.4	Very high	66 Å²	66	38.4 Å²	38.4	35%	0.346	20%	0.195	S	C	.	.	H	α-helix	trans	-62	-50.6	172.2	-72.9	172.7	0	0	0	111.6	L154 D188 L189 F190 T194 A195 Y196	L154-L192 HydrophobicContact CD2-CB 4.45Å; D188-L192 WeakPolarHBondContact O-CG 3.41Å; D188-L192 PolarHBondContact O-N 3.28Å; L189-L192 PolarHBondContact O-N 2.6Å; F190-L192 VanDerWaalsContact C-N 3.34Å; L192-T194 PolarHBondContact O-N 2.88Å; L192-A195 WeakPolarHBondContact O-CB 3.29Å; L192-A195 PolarHBondContact O-N 3.34Å; L192-A195 VanDerWaalsContact O-N 3.08Å; L192-Y196 WeakPolarHBondContact O-CD2 3.43Å; L192-Y196 PolarHBondContact O-N 3.41Å
193	S	94.2	Very high	92.2	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.021	19%	0.19	C	C	.	.	H	α-helix	trans	-53.7	-41.1	177.2	-174	0	0	0	0	111.9	L154 N155 L189 F190 Y196 W197	L154-S193 PolarHBondContact O-OG 2.88Å; N155-S193 WeakPolarHBondContact CA-OG 3.3Å; L189-S193 WeakPolarHBondContact O-CB 3.38Å; L189-S193 PolarHBondContact O-N 2.72Å; F190-S193 PolarHBondContact O-N 3.28Å; S193-Y196 PolarHBondContact O-N 2.98Å; S193-W197 PolarHBondContact O-N 3.23Å; S193-W197 VanDerWaalsContact O-N 3.1Å
194	T	91.4	Very high	92.2	Very high	19 Å²	19	39.3 Å²	39.3	12%	0.117	20%	0.197	C	C	.	.	H	α-helix	trans	-66	-41.9	178.8	-62.4	0	0	0	0	111.8	F190 A191 L192 Y196 W197 Y198 V244	F190-T194 WeakPolarHBondContact O-CB 3.28Å; F190-T194 PolarHBondContact O-N 3.19Å; F190-T194 PolarHBondContact O-OG1 2.62Å; A191-T194 PolarHBondContact O-N 2.81Å; L192-T194 PolarHBondContact O-N 2.88Å; T194-Y196 VanDerWaalsContact C-N 3.35Å; T194-W197 VanDerWaalsContact O-CB 3.27Å; T194-W197 WeakPolarHBondContact O-CB 3.45Å; T194-W197 PolarHBondContact O-N 2.78Å; T194-Y198 WeakPolarHBondContact O-CD2 3.46Å; T194-V244 HydrophobicContact CG2-CB 4.31Å; T194-V244 HydrophobicContact CG2-CG1 3.72Å; T194-V244 HydrophobicContact CG2-CG2 3.87Å
195	A	90.8	Very high	92.3	Very high	23 Å²	23	37.6 Å²	37.6	19%	0.19	19%	0.191	C	C	.	.	H	α-helix	trans	-62.4	-41.9	174.2	0	0	0	0	0	111.6	A191 L192 W197 Y198 K199 Y253 T255	A191-A195 PolarHBondContact O-N 3Å; A191-A195 VanDerWaalsContact O-N 3.09Å; L192-A195 WeakPolarHBondContact O-CB 3.29Å; L192-A195 PolarHBondContact O-N 3.34Å; L192-A195 VanDerWaalsContact O-N 3.08Å; A195-W197 VanDerWaalsContact C-N 3.26Å; A195-W197 PolarHBondContact O-N 3.02Å; A195-Y198 CarbonylContact O-C 3.58Å; A195-Y198 PolarHBondContact O-N 3.32Å; A195-K199 PolarHBondContact O-N 3.37Å; A195-Y253 HydrophobicContact CB-CE1 4.14Å; A195-T255 HydrophobicContact CB-CG2 4.47Å
196	Y	92.8	Very high	92.2	Very high	29 Å²	29	34.2 Å²	34.2	11%	0.114	18%	0.176	C	C	.	.	H	α-helix	trans	-66.2	-26	177.6	-78.2	-69.2	0	0	0	113.8	T123 E128 V129 I132 L154 L192 S193 T194 Y198 K199	T123-Y196 HydrophobicContact CG2-CD1 3.86Å; T123-Y196 HydrophobicContact CG2-CG 4.47Å; T123-Y196 WeakPolarHBondContact CG2-O 3.31Å; E128-Y196 VanDerWaalsContact OE1-CE1 3.28Å; E128-Y196 WeakPolarHBondContact OE1-CE1 3.26Å; E128-Y196 PolarHBondContact OE1-OH 3.03Å; V129-Y196 HydrophobicContact CG2-CD1 3.43Å; V129-Y196 VanDerWaalsContact CG2-CD1 3.43Å; V129-Y196 HydrophobicContact CG2-CD2 4.12Å; V129-Y196 HydrophobicContact CG2-CE1 3.49Å; V129-Y196 VanDerWaalsContact CG2-CE1 3.49Å; V129-Y196 HydrophobicContact CG2-CE2 4.19Å; V129-Y196 HydrophobicContact CG2-CG 3.78Å; I132-Y196 HydrophobicContact CD1-CE2 3.62Å; I132-Y196 WeakPolarHBondContact CD1-OH 3.42Å; L154-Y196 HydrophobicContact CD2-CD2 3.84Å; L154-Y196 HydrophobicContact CD2-CE2 4.28Å; L192-Y196 WeakPolarHBondContact O-CD2 3.43Å; L192-Y196 PolarHBondContact O-N 3.41Å; S193-Y196 PolarHBondContact O-N 2.98Å; T194-Y196 VanDerWaalsContact C-N 3.35Å; Y196-Y198 PolarHBondContact O-N 2.65Å; Y196-K199 HydrophobicContact CD1-CB 4.43Å; Y196-K199 HydrophobicContact CD1-CD 3.58Å; Y196-K199 HydrophobicContact CE1-CD 3.66Å; Y196-K199 PolarHBondContact O-N 3.21Å
197	W	90.7	Very high	92	Very high	49 Å²	49	34.9 Å²	34.9	19%	0.186	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-25.3	175.7	-157.8	-76.2	0	0	0	113.3	Q120 F124 N155 S193 T194 A195	Q120-W197 PolarHBondContact NE2-O 3.13Å; Q120-W197 VanDerWaalsContact NE2-O 3.09Å; F124-W197 HydrophobicContact CE2-CE3 4.26Å; F124-W197 HydrophobicContact CZ-CE3 4.15Å; N155-W197 WeakPolarHBondContact OD1-CZ3 3.27Å; S193-W197 PolarHBondContact O-N 3.23Å; S193-W197 VanDerWaalsContact O-N 3.1Å; T194-W197 VanDerWaalsContact O-CB 3.27Å; T194-W197 WeakPolarHBondContact O-CB 3.45Å; T194-W197 PolarHBondContact O-N 2.78Å; A195-W197 VanDerWaalsContact C-N 3.26Å; A195-W197 PolarHBondContact O-N 3.02Å
198	Y	90.7	Very high	92	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.016	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.5	19.5	-177.6	-59.3	-78.4	0	0	0	112.5	T194 A195 Y196 G200 K204 R207 A241 V244 A245 E248	T194-Y198 WeakPolarHBondContact O-CD2 3.46Å; A195-Y198 CarbonylContact O-C 3.58Å; A195-Y198 PolarHBondContact O-N 3.32Å; Y196-Y198 PolarHBondContact O-N 2.65Å; Y198-G200 PolarHBondContact O-N 3.32Å; Y198-K204 WeakPolarHBondContact O-CD 3.35Å; Y198-K204 WeakPolarHBondContact O-CE 3.44Å; Y198-K204 WeakPolarHBondContact O-CG 3.33Å; Y198-R207 HydrophobicContact CD1-CB 4.4Å; Y198-R207 HydrophobicContact CE1-CB 3.98Å; Y198-A241 PolarHBondContact OH-O 3.12Å; Y198-V244 HydrophobicContact CD2-CG1 3.53Å; Y198-V244 HydrophobicContact CE2-CB 4.06Å; Y198-V244 HydrophobicContact CE2-CG1 3.53Å; Y198-A245 HydrophobicContact CD1-CB 4.15Å; Y198-A245 HydrophobicContact CE1-CB 3.48Å; Y198-A245 VanDerWaalsContact CE1-CB 3.48Å; Y198-E248 HydrophobicContact CD2-CG 4.35Å; Y198-E248 HydrophobicContact CG-CB 4.45Å; Y198-E248 HydrophobicContact CG-CG 4.17Å
199	K	88.6	Confident	92.1	Very high	86 Å²	86	31.2 Å²	31.2	37%	0.374	16%	0.159	S	C	.	.			trans	-61.4	-41.8	-171.6	179	170	175.3	178.3	0	114.2	T123 E128 A195 Y196	T123-K199 HydrophobicContact CG2-CB 4.19Å; T123-K199 HydrophobicContact CG2-CD 4.21Å; E128-K199 IonicContact OE1-NZ 2.65Å; E128-K199 PolarHBondContact OE1-NZ 3.28Å; E128-K199 IonicContact OE2-NZ 2.81Å; E128-K199 PolarHBondContact OE2-NZ 3.48Å; A195-K199 PolarHBondContact O-N 3.37Å; Y196-K199 HydrophobicContact CD1-CB 4.43Å; Y196-K199 HydrophobicContact CD1-CD 3.58Å; Y196-K199 HydrophobicContact CE1-CD 3.66Å; Y196-K199 PolarHBondContact O-N 3.21Å
200	G	91	Very high	92	Very high	27 Å²	27	31.7 Å²	31.7	28%	0.278	16%	0.163	S	C	.	.	S	Bend	trans	-88.3	141.2	-172.9	0	0	0	0	0	113.7	Y198 E202 Q203 K204	Y198-G200 PolarHBondContact O-N 3.32Å; G200-E202 VanDerWaalsContact C-N 3.29Å; G200-E202 PolarHBondContact O-N 3Å; G200-Q203 WeakPolarHBondContact O-CA 3.43Å; G200-Q203 VanDerWaalsContact O-CB 3.29Å; G200-Q203 WeakPolarHBondContact O-CB 3.42Å; G200-Q203 PolarHBondContact O-N 3.25Å; G200-K204 WeakPolarHBondContact O-CG 3.45Å; G200-K204 PolarHBondContact O-N 3.17Å
201	D	92.3	Very high	92	Very high	132 Å²	132	31 Å²	31	71%	0.706	16%	0.161	S	C	*	.	H	α-helix	trans	-57	-40.7	-179.3	-65.1	-26.7	0	0	0	113	Q203 K204 R205	D201-Q203 VanDerWaalsContact C-N 3.33Å; D201-Q203 PolarHBondContact O-N 2.96Å; D201-K204 PolarHBondContact O-N 3.1Å; D201-R205 VanDerWaalsContact O-CB 3.32Å; D201-R205 WeakPolarHBondContact O-CB 3.18Å; D201-R205 PolarHBondContact O-N 3.36Å
202	E	93.8	Very high	92.1	Very high	65 Å²	65	30.6 Å²	30.6	30%	0.304	16%	0.157	S	C	.	.	H	α-helix	trans	-65.7	-36.4	175.8	-167.5	-176.9	171.5	0	0	112	R115 L119 G200 R205 L206	R115-E202 IonicContact CZ-OE1 2.66Å; R115-E202 IonicContact CZ-OE2 2.81Å; R115-E202 IonicContact NE-OE1 2.74Å; R115-E202 PolarHBondContact NE-OE1 3.13Å; R115-E202 IonicContact NE-OE2 3.07Å; R115-E202 IonicContact NH2-OE1 2.62Å; R115-E202 PolarHBondContact NH2-OE1 3.35Å; R115-E202 IonicContact NH2-OE2 3.47Å; R115-E202 PolarHBondContact NH2-OE2 3.28Å; L119-E202 HydrophobicContact CD1-CB 3.96Å; L119-E202 HydrophobicContact CD1-CG 3.79Å; G200-E202 VanDerWaalsContact C-N 3.29Å; G200-E202 PolarHBondContact O-N 3Å; E202-R205 PolarHBondContact O-N 3.08Å; E202-L206 HydrophobicContact CG-CD1 4.21Å; E202-L206 WeakPolarHBondContact O-CB 3.34Å; E202-L206 VanDerWaalsContact O-CG 3.29Å; E202-L206 WeakPolarHBondContact O-CG 3.38Å; E202-L206 PolarHBondContact O-N 3.22Å
203	Q	91.5	Very high	92.1	Very high	5 Å²	5	30.9 Å²	30.9	2%	0.023	16%	0.155	C	C	.	.	H	α-helix	trans	-65.7	-47.7	175.9	-61.6	166.1	-13.8	0	0	110.7	L119 T123 G200 D201 R205 L206 R207	L119-Q203 HydrophobicContact CB-CG 3.47Å; L119-Q203 VanDerWaalsContact CB-CG 3.47Å; L119-Q203 HydrophobicContact CD1-CG 3.92Å; L119-Q203 HydrophobicContact CG-CG 4.27Å; L119-Q203 PolarHBondContact O-NE2 2.95Å; T123-Q203 PolarHBondContact OG1-NE2 2.97Å; G200-Q203 WeakPolarHBondContact O-CA 3.43Å; G200-Q203 VanDerWaalsContact O-CB 3.29Å; G200-Q203 WeakPolarHBondContact O-CB 3.42Å; G200-Q203 PolarHBondContact O-N 3.25Å; D201-Q203 VanDerWaalsContact C-N 3.33Å; D201-Q203 PolarHBondContact O-N 2.96Å; Q203-R205 VanDerWaalsContact C-N 3.28Å; Q203-R205 PolarHBondContact O-N 3.38Å; Q203-L206 PolarHBondContact O-N 3.24Å; Q203-R207 WeakPolarHBondContact O-CB 3.24Å; Q203-R207 PolarHBondContact O-N 3.33Å
204	K	92.9	Very high	92	Very high	37 Å²	37	32.3 Å²	32.3	16%	0.161	16%	0.163	C	C	.	.	H	α-helix	trans	-56.8	-44.6	176.5	-65.9	179.3	-179.7	-163.4	0	111.1	Y198 G200 D201 R207 G209 E248 N249	Y198-K204 WeakPolarHBondContact O-CD 3.35Å; Y198-K204 WeakPolarHBondContact O-CE 3.44Å; Y198-K204 WeakPolarHBondContact O-CG 3.33Å; G200-K204 WeakPolarHBondContact O-CG 3.45Å; G200-K204 PolarHBondContact O-N 3.17Å; D201-K204 PolarHBondContact O-N 3.1Å; K204-R207 CarbonylContact O-C 3.56Å; K204-R207 PolarHBondContact O-N 2.84Å; K204-G209 PolarHBondContact O-N 2.89Å; K204-E248 HydrophobicContact CD-CB 4.39Å; K204-E248 WeakPolarHBondContact CE-OE2 3.42Å; K204-E248 HydrophobicContact CG-CB 4.45Å; K204-E248 PolarHBondContact NZ-O 2.83Å; K204-E248 IonicContact NZ-OE2 3.93Å; K204-E248 PolarHBondContact NZ-OE2 3.41Å; K204-N249 PolarHBondContact O-ND2 3.47Å; K204-N249 PolarHBondContact O-OD1 3.09Å; K204-N249 VanDerWaalsContact O-OD1 3.13Å
205	R	93.4	Very high	92.1	Very high	54 Å²	54	32.1 Å²	32.1	20%	0.204	16%	0.161	C	C	.	.	I	π-helix	trans	-61.6	-49.2	178.6	-169.3	169.4	69.2	76.9	9.2	111.5	D201 E202 Q203 R207 G209 H332 S333 P335 E341	D201-R205 VanDerWaalsContact O-CB 3.32Å; D201-R205 WeakPolarHBondContact O-CB 3.18Å; D201-R205 PolarHBondContact O-N 3.36Å; E202-R205 PolarHBondContact O-N 3.08Å; Q203-R205 VanDerWaalsContact C-N 3.28Å; Q203-R205 PolarHBondContact O-N 3.38Å; R205-R207 VanDerWaalsContact C-N 3.33Å; R205-R207 PolarHBondContact O-N 3.32Å; R205-G209 WeakPolarHBondContact O-CA 2.99Å; R205-G209 PolarHBondContact O-N 2.88Å; R205-H332 WeakPolarHBondContact CD-O 3.34Å; R205-S333 WeakPolarHBondContact CG-O 3.5Å; R205-P335 VanDerWaalsContact NH1-CA 3.34Å; R205-P335 WeakPolarHBondContact O-CD 3.41Å; R205-E341 IonicContact CZ-OE2 3.13Å; R205-E341 IonicContact NH1-OE1 3.82Å; R205-E341 PolarHBondContact NH1-OE1 3.36Å; R205-E341 IonicContact NH1-OE2 3.3Å; R205-E341 PolarHBondContact NH1-OE2 3.28Å; R205-E341 IonicContact NH2-OE2 3.83Å; R205-E341 PolarHBondContact NH2-OE2 3.14Å
206	L	92.8	Very high	92.1	Very high	5 Å²	5	31.4 Å²	31.4	3%	0.026	15%	0.154	C	C	.	.	I	π-helix	trans	-69.1	-28.3	178.8	-67.9	172.9	0	0	0	113.3	R115 A116 L119 E202 Q203 P335 W338 E341	R115-L206 HydrophobicContact CB-CD1 4.13Å; R115-L206 HydrophobicContact CG-CD1 3.73Å; A116-L206 HydrophobicContact CB-CB 4.08Å; A116-L206 HydrophobicContact CB-CD1 4.06Å; L119-L206 HydrophobicContact CD1-CD1 4.3Å; E202-L206 HydrophobicContact CG-CD1 4.21Å; E202-L206 WeakPolarHBondContact O-CB 3.34Å; E202-L206 VanDerWaalsContact O-CG 3.29Å; E202-L206 WeakPolarHBondContact O-CG 3.38Å; E202-L206 PolarHBondContact O-N 3.22Å; Q203-L206 PolarHBondContact O-N 3.24Å; L206-P335 HydrophobicContact CD2-CB 4.39Å; L206-P335 HydrophobicContact CD2-CG 4.49Å; L206-W338 PolarHBondContact O-NE1 2.92Å; L206-W338 VanDerWaalsContact O-NE1 3.1Å; L206-E341 HydrophobicContact CD2-CB 3.99Å
207	R	91.3	Very high	92	Very high	14 Å²	14	34.6 Å²	34.6	5%	0.053	17%	0.171	C	C	.	.	I	π-helix	trans	-121.7	97.2	179.9	-64.8	-171.7	174.5	-131.2	7.6	111.3	M109 D110 A116 Q120 Y198 Q203 K204 R205 N249	M109-R207 WeakPolarHBondContact O-CD 3.46Å; M109-R207 PolarHBondContact O-NE 3Å; M109-R207 PolarHBondContact O-NH1 2.79Å; D110-R207 IonicContact OD1-NH1 2.66Å; D110-R207 PolarHBondContact OD1-NH1 3Å; A116-R207 HydrophobicContact CB-CG 4.22Å; Q120-R207 VanDerWaalsContact NE2-CZ 3.34Å; Y198-R207 HydrophobicContact CD1-CB 4.4Å; Y198-R207 HydrophobicContact CE1-CB 3.98Å; Q203-R207 WeakPolarHBondContact O-CB 3.24Å; Q203-R207 PolarHBondContact O-N 3.33Å; K204-R207 CarbonylContact O-C 3.56Å; K204-R207 PolarHBondContact O-N 2.84Å; R205-R207 VanDerWaalsContact C-N 3.33Å; R205-R207 PolarHBondContact O-N 3.32Å; R207-N249 PolarHBondContact O-ND2 3.16Å
208	G	90.9	Very high	91.9	Very high	4 Å²	4	36.2 Å²	36.2	4%	0.041	18%	0.177	C	C	.	.	I	π-helix	trans	108.6	-28.1	177.8	0	0	0	0	0	113.9	M109 S210 L211 L212	M109-G208 VanDerWaalsContact SD-CA 3.6Å; M109-G208 PolarHBondContact SD-N 3.32Å; M109-G208 VanDerWaalsContact SD-N 3.37Å; G208-S210 VanDerWaalsContact C-N 3.31Å; G208-S210 PolarHBondContact O-N 3.39Å; G208-L211 WeakPolarHBondContact O-CB 3.41Å; G208-L211 PolarHBondContact O-N 3.22Å; G208-L212 PolarHBondContact O-N 2.88Å
209	G	93.5	Very high	91.9	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.181	C	C	.	.	I	π-helix	trans	-53.9	-44.9	177.2	0	0	0	0	0	113.7	K204 R205 L211 L212 K213 N249 S333 A334	K204-G209 PolarHBondContact O-N 2.89Å; R205-G209 WeakPolarHBondContact O-CA 2.99Å; R205-G209 PolarHBondContact O-N 2.88Å; G209-L211 VanDerWaalsContact C-N 3.26Å; G209-L211 PolarHBondContact O-N 2.95Å; G209-L212 PolarHBondContact O-N 3.15Å; G209-K213 PolarHBondContact O-N 2.9Å; G209-N249 PolarHBondContact N-ND2 2.96Å; G209-S333 WeakPolarHBondContact CA-O 3.35Å; G209-A334 WeakPolarHBondContact O-CB 3.48Å
210	S	92.7	Very high	92	Very high	16 Å²	16	34.4 Å²	34.4	11%	0.112	17%	0.171	C	C	.	.	H	α-helix	trans	-61.2	-31.2	177.4	-58.2	0	0	0	0	113.8	G208 D214	G208-S210 VanDerWaalsContact C-N 3.31Å; G208-S210 PolarHBondContact O-N 3.39Å; S210-D214 WeakPolarHBondContact O-CB 3.29Å; S210-D214 PolarHBondContact O-N 3.46Å
211	L	93.5	Very high	91.9	Very high	4 Å²	4	35.2 Å²	35.2	2%	0.021	17%	0.173	C	C	.	.	H	α-helix	trans	-69.8	-47.4	174.6	-179	55.5	0	0	0	111.2	I106 L107 M109 G208 G209 K213 D214 I215 Y236 T242 L246	I106-L211 HydrophobicContact CG2-CB 4.43Å; I106-L211 HydrophobicContact CG2-CD1 3.89Å; I106-L211 WeakPolarHBondContact O-CB 3.45Å; L107-L211 HydrophobicContact CD2-CD1 3.74Å; L107-L211 HydrophobicContact CD2-CD2 4.16Å; M109-L211 HydrophobicContact CE-CB 4.46Å; M109-L211 HydrophobicContact CE-CD2 4.2Å; G208-L211 WeakPolarHBondContact O-CB 3.41Å; G208-L211 PolarHBondContact O-N 3.22Å; G209-L211 VanDerWaalsContact C-N 3.26Å; G209-L211 PolarHBondContact O-N 2.95Å; L211-K213 VanDerWaalsContact C-N 3.3Å; L211-K213 PolarHBondContact O-N 3.3Å; L211-D214 PolarHBondContact O-N 3.01Å; L211-I215 HydrophobicContact CD1-CD1 4.18Å; L211-I215 HydrophobicContact CD1-CG1 4.39Å; L211-I215 HydrophobicContact CG-CD1 4.04Å; L211-I215 WeakPolarHBondContact O-CG1 3.34Å; L211-I215 PolarHBondContact O-N 3.3Å; L211-Y236 HydrophobicContact CD1-CD1 3.92Å; L211-Y236 HydrophobicContact CD1-CD2 4.22Å; L211-Y236 HydrophobicContact CD1-CE1 3.94Å; L211-Y236 HydrophobicContact CD1-CE2 4.29Å; L211-Y236 HydrophobicContact CD1-CG 4.04Å; L211-T242 HydrophobicContact CD2-CG2 3.58Å; L211-L246 HydrophobicContact CD2-CD2 4.27Å; L211-L246 HydrophobicContact CG-CD1 4.47Å
212	L	93.7	Very high	91.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-58.4	-45.4	178	-178.9	55	0	0	0	110.7	G208 G209 D214 I215 L216 L246 N249 L250 F330	G208-L212 PolarHBondContact O-N 2.88Å; G209-L212 PolarHBondContact O-N 3.15Å; L212-D214 PolarHBondContact O-N 3.39Å; L212-I215 PolarHBondContact O-N 3.08Å; L212-L216 HydrophobicContact CD1-CD1 4.09Å; L212-L216 HydrophobicContact CD1-CG 4.18Å; L212-L216 HydrophobicContact CG-CD1 4.1Å; L212-L216 WeakPolarHBondContact O-CG 3.32Å; L212-L216 PolarHBondContact O-N 2.98Å; L212-L246 HydrophobicContact CB-CD1 3.87Å; L212-L246 HydrophobicContact CD1-CD1 4.04Å; L212-L246 HydrophobicContact CG-CD1 4.47Å; L212-N249 HydrophobicContact CD2-CB 3.93Å; L212-L250 HydrophobicContact CD1-CD2 3.87Å; L212-L250 HydrophobicContact CD1-CG 4.46Å; L212-L250 HydrophobicContact CD2-CD2 4.17Å; L212-F330 HydrophobicContact CD2-CB 4.19Å; L212-F330 HydrophobicContact CD2-CD1 3.7Å; L212-F330 HydrophobicContact CD2-CD2 4.29Å; L212-F330 HydrophobicContact CD2-CE1 4.12Å; L212-F330 HydrophobicContact CD2-CG 3.81Å
213	K	92.6	Very high	91.4	Very high	73 Å²	73	29.1 Å²	29.1	32%	0.317	15%	0.145	S	C	.	.	H	α-helix	trans	-60.9	-44	174.7	-178.7	163.1	-178.6	165.1	0	112.7	G209 L211 I215 L216 M217 A334	G209-K213 PolarHBondContact O-N 2.9Å; L211-K213 VanDerWaalsContact C-N 3.3Å; L211-K213 PolarHBondContact O-N 3.3Å; K213-I215 VanDerWaalsContact C-N 3.31Å; K213-I215 PolarHBondContact O-N 3.21Å; K213-L216 PolarHBondContact O-N 2.97Å; K213-M217 HydrophobicContact CG-CG 3.97Å; K213-M217 VanDerWaalsContact O-CB 3.32Å; K213-M217 WeakPolarHBondContact O-CB 3.33Å; K213-M217 WeakPolarHBondContact O-CG 3.34Å; K213-M217 PolarHBondContact O-N 3.19Å; K213-A334 HydrophobicContact CB-CB 3.61Å; K213-A334 HydrophobicContact CD-CB 3.55Å; K213-A334 HydrophobicContact CG-CB 4.23Å
214	D	91.6	Very high	91.2	Very high	33 Å²	33	33 Å²	33	18%	0.176	17%	0.166	C	C	.	.	H	α-helix	trans	-61.8	-39	177.8	-163.6	68.8	0	0	0	111.7	I106 S210 L211 L212 R218 Y236	I106-D214 HydrophobicContact CG2-CB 4.34Å; S210-D214 WeakPolarHBondContact O-CB 3.29Å; S210-D214 PolarHBondContact O-N 3.46Å; L211-D214 PolarHBondContact O-N 3.01Å; L212-D214 PolarHBondContact O-N 3.39Å; D214-R218 WeakPolarHBondContact O-CD 3.17Å; D214-R218 WeakPolarHBondContact O-CG 3.11Å; D214-R218 PolarHBondContact O-N 2.96Å; D214-R218 IonicContact OD1-CZ 2.86Å; D214-R218 IonicContact OD1-NE 2.66Å; D214-R218 IonicContact OD1-NH2 3.22Å; D214-R218 PolarHBondContact OD1-NH2 2.9Å; D214-R218 VanDerWaalsContact OD1-NH2 3.13Å; D214-R218 IonicContact OD2-CZ 3.29Å; D214-R218 VanDerWaalsContact OD2-CZ 3.3Å; D214-R218 IonicContact OD2-NE 2.86Å; D214-R218 PolarHBondContact OD2-NE 3.46Å; D214-R218 IonicContact OD2-NH2 2.75Å; D214-R218 PolarHBondContact OD2-NH2 3.34Å; D214-Y236 PolarHBondContact OD2-OH 2.96Å
215	I	92.2	Very high	90.6	Very high	14 Å²	14	37.7 Å²	37.7	7%	0.072	19%	0.193	C	C	.	.	H	α-helix	trans	-62.9	-53.1	174.9	-67.4	164.8	0	0	0	110.8	L211 L212 K213 R218 M219 Y236 L246 F267	L211-I215 HydrophobicContact CD1-CD1 4.18Å; L211-I215 HydrophobicContact CD1-CG1 4.39Å; L211-I215 HydrophobicContact CG-CD1 4.04Å; L211-I215 WeakPolarHBondContact O-CG1 3.34Å; L211-I215 PolarHBondContact O-N 3.3Å; L212-I215 PolarHBondContact O-N 3.08Å; K213-I215 VanDerWaalsContact C-N 3.31Å; K213-I215 PolarHBondContact O-N 3.21Å; I215-R218 PolarHBondContact O-N 3.19Å; I215-M219 HydrophobicContact CG2-CE 4.23Å; I215-M219 HydrophobicContact CG2-SD 4.49Å; I215-M219 WeakPolarHBondContact O-CG 3.41Å; I215-M219 PolarHBondContact O-N 3.02Å; I215-M219 VanDerWaalsContact O-N 3.14Å; I215-Y236 HydrophobicContact CD1-CE2 4.36Å; I215-Y236 HydrophobicContact CG1-CE2 3.74Å; I215-L246 HydrophobicContact CD1-CD1 4.26Å; I215-L246 HydrophobicContact CD1-CD2 4.02Å; I215-F267 HydrophobicContact CD1-CD2 4.29Å; I215-F267 HydrophobicContact CD1-CE2 3.95Å; I215-F267 HydrophobicContact CD1-CZ 4.33Å; I215-F267 HydrophobicContact CG2-CB 4.36Å; I215-F267 HydrophobicContact CG2-CD1 4.17Å; I215-F267 HydrophobicContact CG2-CD2 4.31Å; I215-F267 HydrophobicContact CG2-CG 4.04Å
216	L	92	Very high	89.4	Confident	9 Å²	9	44.1 Å²	44.1	5%	0.047	22%	0.217	C	C	.	.	H	α-helix	trans	-64.6	-42.8	-176.3	-67.7	176.3	0	0	0	112.1	L212 K213 R218 M219 L220 L326 V327 F330	L212-L216 HydrophobicContact CD1-CD1 4.09Å; L212-L216 HydrophobicContact CD1-CG 4.18Å; L212-L216 HydrophobicContact CG-CD1 4.1Å; L212-L216 WeakPolarHBondContact O-CG 3.32Å; L212-L216 PolarHBondContact O-N 2.98Å; K213-L216 PolarHBondContact O-N 2.97Å; L216-R218 VanDerWaalsContact C-N 3.28Å; L216-R218 PolarHBondContact O-N 3.31Å; L216-M219 PolarHBondContact O-N 3.37Å; L216-M219 VanDerWaalsContact O-N 3.15Å; L216-L220 WeakPolarHBondContact O-CB 3.5Å; L216-L220 PolarHBondContact O-N 2.94Å; L216-L326 HydrophobicContact CD2-CB 4.19Å; L216-V327 HydrophobicContact CB-CG2 4.35Å; L216-F330 HydrophobicContact CD1-CB 3.64Å; L216-F330 HydrophobicContact CD1-CD2 4.06Å; L216-F330 HydrophobicContact CD1-CG 4.25Å
217	M	90	Very high	87.7	Confident	95 Å²	95	46.3 Å²	46.3	47%	0.468	23%	0.231	S	C	.	.	H	α-helix	trans	-65.1	-31.6	178.7	-68.3	-56.5	-64.3	0	0	112.6	K213 L220 S221	K213-M217 HydrophobicContact CG-CG 3.97Å; K213-M217 VanDerWaalsContact O-CB 3.32Å; K213-M217 WeakPolarHBondContact O-CB 3.33Å; K213-M217 WeakPolarHBondContact O-CG 3.34Å; K213-M217 PolarHBondContact O-N 3.19Å; M217-L220 HydrophobicContact CE-CD2 4.38Å; M217-L220 HydrophobicContact SD-CD2 4.23Å; M217-S221 WeakPolarHBondContact O-CB 3.49Å; M217-S221 PolarHBondContact O-N 3.44Å
218	R	89.5	Confident	86.1	Confident	83 Å²	83	54.5 Å²	54.5	31%	0.313	28%	0.276	S	S	.	.	H	α-helix	trans	-67.9	-43.8	172.3	-73.7	173.4	-166.2	-61.2	-11.5	111.7	D214 I215 L216 L220 S221 V222 Y234 Y236	D214-R218 WeakPolarHBondContact O-CD 3.17Å; D214-R218 WeakPolarHBondContact O-CG 3.11Å; D214-R218 PolarHBondContact O-N 2.96Å; D214-R218 IonicContact OD1-CZ 2.86Å; D214-R218 IonicContact OD1-NE 2.66Å; D214-R218 IonicContact OD1-NH2 3.22Å; D214-R218 PolarHBondContact OD1-NH2 2.9Å; D214-R218 VanDerWaalsContact OD1-NH2 3.13Å; D214-R218 IonicContact OD2-CZ 3.29Å; D214-R218 VanDerWaalsContact OD2-CZ 3.3Å; D214-R218 IonicContact OD2-NE 2.86Å; D214-R218 PolarHBondContact OD2-NE 3.46Å; D214-R218 IonicContact OD2-NH2 2.75Å; D214-R218 PolarHBondContact OD2-NH2 3.34Å; I215-R218 PolarHBondContact O-N 3.19Å; L216-R218 VanDerWaalsContact C-N 3.28Å; L216-R218 PolarHBondContact O-N 3.31Å; R218-L220 VanDerWaalsContact C-N 3.32Å; R218-L220 PolarHBondContact O-N 3.43Å; R218-S221 WeakPolarHBondContact O-CB 3.44Å; R218-S221 PolarHBondContact O-N 2.62Å; R218-V222 PolarHBondContact O-N 3.26Å; R218-V222 VanDerWaalsContact O-N 3.16Å; R218-Y234 PolarHBondContact NH2-OH 3.19Å; R218-Y236 WeakPolarHBondContact CD-OH 3.36Å; R218-Y236 PolarHBondContact NE-OH 2.96Å
219	M	90.7	Very high	84.7	Confident	20 Å²	20	57.8 Å²	57.8	10%	0.099	30%	0.298	C	S	.	.	H	α-helix	trans	-61.5	-43.4	176.2	-68.5	-173	168.2	0	0	111.4	I215 L216 S221 V222 S223 F267 L269 V278 L323	I215-M219 HydrophobicContact CG2-CE 4.23Å; I215-M219 HydrophobicContact CG2-SD 4.49Å; I215-M219 WeakPolarHBondContact O-CG 3.41Å; I215-M219 PolarHBondContact O-N 3.02Å; I215-M219 VanDerWaalsContact O-N 3.14Å; L216-M219 PolarHBondContact O-N 3.37Å; L216-M219 VanDerWaalsContact O-N 3.15Å; M219-S221 VanDerWaalsContact C-N 3.3Å; M219-S221 PolarHBondContact O-N 3.47Å; M219-V222 PolarHBondContact O-N 2.95Å; M219-S223 PolarHBondContact O-N 3.49Å; M219-F267 HydrophobicContact CE-CB 3.31Å; M219-F267 HydrophobicContact CE-CG 4.38Å; M219-L269 HydrophobicContact CB-CD1 4.31Å; M219-L269 HydrophobicContact CB-CD2 4.12Å; M219-L269 HydrophobicContact CE-CB 4.3Å; M219-L269 HydrophobicContact CG-CB 4.3Å; M219-L269 HydrophobicContact CG-CD2 4.42Å; M219-L269 HydrophobicContact SD-CB 4.31Å; M219-V278 HydrophobicContact CE-CG1 4.27Å; M219-V278 HydrophobicContact SD-CB 4.43Å; M219-V278 HydrophobicContact SD-CG1 3.91Å; M219-V278 HydrophobicContact SD-CG2 3.65Å; M219-L323 HydrophobicContact CB-CD1 3.81Å; M219-L323 HydrophobicContact CB-CD2 4.25Å
220	L	90	Very high	83.6	Confident	32 Å²	32	60 Å²	60	17%	0.168	32%	0.317	C	S	.	.	H	α-helix	trans	-64.4	-32.5	176.1	-171.1	65.1	0	0	0	113	L216 M217 R218 S223 N224 L323 V327	L216-L220 WeakPolarHBondContact O-CB 3.5Å; L216-L220 PolarHBondContact O-N 2.94Å; M217-L220 HydrophobicContact CE-CD2 4.38Å; M217-L220 HydrophobicContact SD-CD2 4.23Å; R218-L220 VanDerWaalsContact C-N 3.32Å; R218-L220 PolarHBondContact O-N 3.43Å; L220-S223 WeakPolarHBondContact CA-OG 3.07Å; L220-S223 PolarHBondContact O-OG 2.83Å; L220-N224 WeakPolarHBondContact CD1-ND2 3.18Å; L220-N224 WeakPolarHBondContact CG-ND2 3.32Å; L220-N224 WeakPolarHBondContact O-CB 3.47Å; L220-N224 PolarHBondContact O-N 3.47Å; L220-N224 VanDerWaalsContact O-N 3.16Å; L220-N224 PolarHBondContact O-ND2 2.66Å; L220-L323 HydrophobicContact CD1-CD2 4.5Å; L220-V327 HydrophobicContact CD2-CG1 4.2Å; L220-V327 HydrophobicContact CD2-CG2 4.44Å
221	S	89.2	Confident	83.4	Confident	45 Å²	45	62.1 Å²	62.1	32%	0.315	32%	0.324	S	S	.	.	H	α-helix	trans	-66.3	-40.5	174.1	-162.7	0	0	0	0	111.8	M217 R218 M219 R226	M217-S221 WeakPolarHBondContact O-CB 3.49Å; M217-S221 PolarHBondContact O-N 3.44Å; R218-S221 WeakPolarHBondContact O-CB 3.44Å; R218-S221 PolarHBondContact O-N 2.62Å; M219-S221 VanDerWaalsContact C-N 3.3Å; M219-S221 PolarHBondContact O-N 3.47Å; S221-R226 PolarHBondContact O-N 2.88Å; S221-R226 VanDerWaalsContact O-N 3.12Å; S221-R226 PolarHBondContact OG-O 3.01Å
222	V	87.8	Confident	83.2	Confident	51 Å²	51	66.8 Å²	66.8	31%	0.309	34%	0.344	S	S	.	.	H	α-helix	trans	-68.2	-45.8	177.6	174.1	0	0	0	0	110.5	R218 M219 N224 N225 T227 A230 L269	R218-V222 PolarHBondContact O-N 3.26Å; R218-V222 VanDerWaalsContact O-N 3.16Å; M219-V222 PolarHBondContact O-N 2.95Å; V222-N224 VanDerWaalsContact C-N 3.31Å; V222-N224 PolarHBondContact O-N 3.4Å; V222-N225 PolarHBondContact O-N 3.43Å; V222-T227 HydrophobicContact CG2-CG2 4.35Å; V222-A230 HydrophobicContact CG2-CB 4.49Å; V222-L269 HydrophobicContact CB-CD2 3.99Å; V222-L269 HydrophobicContact CG1-CD2 3.92Å
223	S	87.9	Confident	83.2	Confident	18 Å²	18	68.2 Å²	68.2	13%	0.126	35%	0.352	C	S	.	.	H	α-helix	trans	-63.8	-34.1	-179.7	65.4	0	0	0	0	113.4	M219 L220 N225	M219-S223 PolarHBondContact O-N 3.49Å; L220-S223 WeakPolarHBondContact CA-OG 3.07Å; L220-S223 PolarHBondContact O-OG 2.83Å; S223-N225 PolarHBondContact O-N 3.13Å
224	N	87.3	Confident	83.2	Confident	85 Å²	85	67.5 Å²	67.5	46%	0.455	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	9.7	179.2	-74	-49.2	0	0	0	114.1	L220 V222 R226	L220-N224 WeakPolarHBondContact CD1-ND2 3.18Å; L220-N224 WeakPolarHBondContact CG-ND2 3.32Å; L220-N224 WeakPolarHBondContact O-CB 3.47Å; L220-N224 PolarHBondContact O-N 3.47Å; L220-N224 VanDerWaalsContact O-N 3.16Å; L220-N224 PolarHBondContact O-ND2 2.66Å; V222-N224 VanDerWaalsContact C-N 3.31Å; V222-N224 PolarHBondContact O-N 3.4Å; N224-R226 HydrophobicContact CB-CG 3.97Å; N224-R226 PolarHBondContact O-N 3.24Å
225	N	79.4	Confident	83.4	Confident	137 Å²	137	67.5 Å²	67.5	73%	0.733	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	20.2	-173.3	-75	-25.7	0	0	0	114.4	V222 S223 T227	V222-N225 PolarHBondContact O-N 3.43Å; S223-N225 PolarHBondContact O-N 3.13Å; N225-T227 VanDerWaalsContact C-N 3.35Å; N225-T227 PolarHBondContact O-N 2.94Å; N225-T227 VanDerWaalsContact O-N 3.11Å
226	R	67.7	Low	83.5	Confident	188 Å²	188	69.6 Å²	69.6	71%	0.709	36%	0.359	S	S	*	.			trans	-85.5	71.8	177.1	-66	-176.4	-177.6	179.4	2	108.7	S221 N224	S221-R226 PolarHBondContact O-N 2.88Å; S221-R226 VanDerWaalsContact O-N 3.12Å; S221-R226 PolarHBondContact OG-O 3.01Å; N224-R226 HydrophobicContact CB-CG 3.97Å; N224-R226 PolarHBondContact O-N 3.24Å
227	T	58.1	Low	83.7	Confident	52 Å²	52	70 Å²	70	32%	0.319	36%	0.363	S	S	.	.			trans	-149.7	109.8	179.7	45.9	0	0	0	0	116	V222 N225 A230	V222-T227 HydrophobicContact CG2-CG2 4.35Å; N225-T227 VanDerWaalsContact C-N 3.35Å; N225-T227 PolarHBondContact O-N 2.94Å; N225-T227 VanDerWaalsContact O-N 3.11Å; T227-A230 HydrophobicContact CG2-CB 3.98Å; T227-A230 WeakPolarHBondContact OG1-CB 3.01Å
228	D	58.3	Low	83.8	Confident	185 Å²	185	66.7 Å²	66.7	99%	0.989	35%	0.353	S	S	*	.	S	Bend	trans	-75.3	-7.5	151.3	-69	-38.1	0	0	0	112
229	S	60.1	Low	83.8	Confident	73 Å²	73	64.5 Å²	64.5	51%	0.51	35%	0.346	S	S	.	.			trans	-147.8	64	-177	62.9	0	0	0	0	113	F231	S229-F231 VanDerWaalsContact C-N 3.3Å; S229-F231 PolarHBondContact O-N 3.27Å
230	A	71.3	Confident	83.7	Confident	48 Å²	48	67.3 Å²	67.3	40%	0.397	36%	0.362	S	S	.	.			trans	-78.7	77.9	170.1	0	0	0	0	0	110.4	V222 T227 K232	V222-A230 HydrophobicContact CG2-CB 4.49Å; T227-A230 HydrophobicContact CG2-CB 3.98Å; T227-A230 WeakPolarHBondContact OG1-CB 3.01Å; A230-K232 PolarHBondContact O-N 3.36Å
231	F	88.2	Confident	83.7	Confident	59 Å²	59	66.8 Å²	66.8	26%	0.259	36%	0.362	S	S	.	.			trans	-58.9	133.9	168.6	-58.1	-68.1	0	0	0	109.2	A45 K46 T47 H49 S229 I233 Y234	A45-F231 VanDerWaalsContact O-CE1 3.31Å; A45-F231 WeakPolarHBondContact O-CE1 3.2Å; K46-F231 WeakPolarHBondContact O-CD1 2.73Å; T47-F231 CarbonylContact O-C 3.59Å; H49-F231 HydrophobicContact CB-CD1 4.04Å; H49-F231 HydrophobicContact CB-CD2 3.63Å; H49-F231 HydrophobicContact CB-CE1 4.13Å; H49-F231 HydrophobicContact CB-CE2 3.71Å; H49-F231 HydrophobicContact CB-CG 3.81Å; H49-F231 HydrophobicContact CB-CZ 3.97Å; S229-F231 VanDerWaalsContact C-N 3.3Å; S229-F231 PolarHBondContact O-N 3.27Å; F231-I233 VanDerWaalsContact C-N 3.31Å; F231-Y234 HydrophobicContact CD2-CD2 4.23Å
232	K	89.8	Confident	83.8	Confident	102 Å²	102	64.9 Å²	64.9	44%	0.443	35%	0.348	S	S	.	.	S	Bend	trans	-70.1	-31.1	172.1	-71.8	-169.9	169	-170	0	111.9	F38 L39 T47 A230	F38-K232 HydrophobicContact CE1-CB 3.84Å; F38-K232 HydrophobicContact CE1-CD 4.4Å; F38-K232 HydrophobicContact CE1-CG 4.38Å; F38-K232 HydrophobicContact CZ-CB 4.01Å; F38-K232 HydrophobicContact CZ-CD 4.28Å; F38-K232 HydrophobicContact CZ-CG 4.14Å; F38-K232 PolarHBondContact O-NZ 3.01Å; L39-K232 HydrophobicContact CD2-CB 4.15Å; T47-K232 WeakPolarHBondContact O-CA 3.34Å; T47-K232 PolarHBondContact O-N 2.9Å; A230-K232 PolarHBondContact O-N 3.36Å
233	I	92.8	Very high	83.9	Confident	31 Å²	31	64 Å²	64	16%	0.159	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	129.8	174.6	-70.6	-178.8	0	0	0	109.6	L39 T47 V48 H49 L69 F231 A235	L39-I233 HydrophobicContact CD1-CD1 3.33Å; L39-I233 HydrophobicContact CD1-CG1 4.47Å; L39-I233 HydrophobicContact CD2-CD1 3.34Å; L39-I233 HydrophobicContact CD2-CG1 3.58Å; L39-I233 HydrophobicContact CG-CD1 3.9Å; T47-I233 PolarHBondContact O-N 3.46Å; V48-I233 WeakPolarHBondContact CA-O 3.27Å; V48-I233 HydrophobicContact CG1-CG2 4.46Å; H49-I233 PolarHBondContact N-O 3.37Å; L69-I233 HydrophobicContact CD2-CD1 4.29Å; F231-I233 VanDerWaalsContact C-N 3.31Å; I233-A235 HydrophobicContact CG2-CB 4.21Å
234	Y	93.5	Very high	84	Confident	57 Å²	57	63.3 Å²	63.3	22%	0.224	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	116.6	162.1	-154.4	-77.3	0	0	0	108.3	H49 R51 R218 F231 Y236	H49-Y234 HydrophobicContact CB-CD2 3.75Å; H49-Y234 HydrophobicContact CB-CE2 3.76Å; H49-Y234 AromaticContact CD2-CD2 3.8Å; H49-Y234 AromaticContact CD2-CE1 3.79Å; H49-Y234 AromaticContact CD2-CE2 3.02Å; H49-Y234 WeakPolarHBondContact CD2-CE2 3.5Å; H49-Y234 AromaticContact CD2-CZ 3.05Å; H49-Y234 PolarHBondContact CD2-OH 3.29Å; H49-Y234 AromaticContact CG-CE2 3.47Å; H49-Y234 VanDerWaalsContact CG-CE2 3.47Å; H49-Y234 AromaticContact CG-CZ 3.98Å; H49-Y234 AromaticContact NE2-CE2 3.76Å; H49-Y234 AromaticContact NE2-CZ 3.54Å; H49-Y234 PolarHBondContact NE2-OH 3.46Å; H49-Y234 WeakPolarHBondContact O-CA 3.49Å; R51-Y234 HydrophobicContact CB-CE1 4.44Å; R218-Y234 PolarHBondContact NH2-OH 3.19Å; F231-Y234 HydrophobicContact CD2-CD2 4.23Å; Y234-Y236 HydrophobicContact CD1-CD1 4.32Å; Y234-Y236 HydrophobicContact CD1-CD2 4.24Å; Y234-Y236 AromaticContact CD1-CE1 3.69Å; Y234-Y236 HydrophobicContact CD1-CE1 3.69Å; Y234-Y236 AromaticContact CD1-CE2 3.56Å; Y234-Y236 HydrophobicContact CD1-CE2 3.56Å; Y234-Y236 AromaticContact CD1-CZ 3.24Å; Y234-Y236 VanDerWaalsContact CD1-OH 3.28Å; Y234-Y236 WeakPolarHBondContact CD1-OH 3.45Å; Y234-Y236 AromaticContact CE1-CD1 3.99Å; Y234-Y236 HydrophobicContact CE1-CD1 3.99Å; Y234-Y236 AromaticContact CE1-CE1 3.28Å; Y234-Y236 HydrophobicContact CE1-CE1 3.28Å; Y234-Y236 HydrophobicContact CE1-CE2 4.08Å; Y234-Y236 AromaticContact CE1-CZ 3.32Å; Y234-Y236 WeakPolarHBondContact CE1-OH 3.18Å
235	A	95.3	Very high	84.3	Confident	33 Å²	33	59.2 Å²	59.2	27%	0.273	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	137.5	-176.4	0	0	0	0	0	111.2	H49 V50 R51 I233	H49-A235 PolarHBondContact O-N 2.8Å; V50-A235 WeakPolarHBondContact CA-O 3.45Å; V50-A235 HydrophobicContact CG1-CB 4.19Å; V50-A235 HydrophobicContact CG2-CB 4.17Å; R51-A235 PolarHBondContact N-O 2.9Å; I233-A235 HydrophobicContact CG2-CB 4.21Å
236	Y	94.7	Very high	84.9	Confident	59 Å²	59	53 Å²	53	23%	0.231	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	123.5	174.7	-55.1	-87.3	0	0	0	109.5	R51 L107 L211 D214 I215 R218 Y234	R51-Y236 HydrophobicContact CB-CD1 4.39Å; R51-Y236 CarbonylContact O-C 3.58Å; R51-Y236 VanDerWaalsContact O-CA 3.29Å; R51-Y236 WeakPolarHBondContact O-CA 3.05Å; L107-Y236 HydrophobicContact CD1-CD1 4.15Å; L107-Y236 HydrophobicContact CD2-CD1 3.73Å; L107-Y236 HydrophobicContact CD2-CG 4.03Å; L107-Y236 HydrophobicContact CG-CD1 4.28Å; L211-Y236 HydrophobicContact CD1-CD1 3.92Å; L211-Y236 HydrophobicContact CD1-CD2 4.22Å; L211-Y236 HydrophobicContact CD1-CE1 3.94Å; L211-Y236 HydrophobicContact CD1-CE2 4.29Å; L211-Y236 HydrophobicContact CD1-CG 4.04Å; D214-Y236 PolarHBondContact OD2-OH 2.96Å; I215-Y236 HydrophobicContact CD1-CE2 4.36Å; I215-Y236 HydrophobicContact CG1-CE2 3.74Å; R218-Y236 WeakPolarHBondContact CD-OH 3.36Å; R218-Y236 PolarHBondContact NE-OH 2.96Å; Y234-Y236 HydrophobicContact CD1-CD1 4.32Å; Y234-Y236 HydrophobicContact CD1-CD2 4.24Å; Y234-Y236 AromaticContact CD1-CE1 3.69Å; Y234-Y236 HydrophobicContact CD1-CE1 3.69Å; Y234-Y236 AromaticContact CD1-CE2 3.56Å; Y234-Y236 HydrophobicContact CD1-CE2 3.56Å; Y234-Y236 AromaticContact CD1-CZ 3.24Å; Y234-Y236 VanDerWaalsContact CD1-OH 3.28Å; Y234-Y236 WeakPolarHBondContact CD1-OH 3.45Å; Y234-Y236 AromaticContact CE1-CD1 3.99Å; Y234-Y236 HydrophobicContact CE1-CD1 3.99Å; Y234-Y236 AromaticContact CE1-CE1 3.28Å; Y234-Y236 HydrophobicContact CE1-CE1 3.28Å; Y234-Y236 HydrophobicContact CE1-CE2 4.08Å; Y234-Y236 AromaticContact CE1-CZ 3.32Å; Y234-Y236 WeakPolarHBondContact CE1-OH 3.18Å
237	S	95.1	Very high	85.9	Confident	17 Å²	17	44.2 Å²	44.2	12%	0.119	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	118.7	170.2	-168.1	0	0	0	0	109.6	R51 S52 T53 T58	R51-S237 PolarHBondContact O-N 3.38Å; S52-S237 CarbonylContact C-O 3.48Å; S52-S237 WeakPolarHBondContact CA-O 3.04Å; T53-S237 PolarHBondContact N-O 3.03Å; T58-S237 PolarHBondContact O-OG 2.99Å; T58-S237 VanDerWaalsContact O-OG 3.08Å
238	G	92.1	Very high	87.5	Confident	26 Å²	26	42.9 Å²	42.9	27%	0.268	24%	0.239	S	C	.	.			trans	-142.8	-143.8	-176.1	0	0	0	0	0	111.5	T58	T58-G238 WeakPolarHBondContact CG2-O 3.4Å
239	H	91	Very high	89.1	Confident	37 Å²	37	34.9 Å²	34.9	17%	0.171	20%	0.196	C	C	.	.			trans	-115.9	167.6	-173.8	-55.3	-78.4	0	0	0	110.9	T53 Y55 R57 A241 T242 L243	T53-H239 PolarHBondContact OG1-NE2 3.19Å; Y55-H239 AromaticContact CD2-CE1 3.4Å; Y55-H239 VanDerWaalsContact CD2-CE1 3.4Å; Y55-H239 WeakPolarHBondContact CD2-CE1 3.41Å; Y55-H239 AromaticContact CD2-NE2 3.4Å; Y55-H239 WeakPolarHBondContact CD2-NE2 3.25Å; Y55-H239 AromaticContact CE2-CE1 3.74Å; Y55-H239 AromaticContact CE2-NE2 3.58Å; R57-H239 PolarHBondContact NH2-CE1 3.21Å; H239-A241 HydrophobicContact CB-CB 4.41Å; H239-A241 PolarHBondContact O-N 3.49Å; H239-T242 PolarHBondContact N-OG1 3.37Å; H239-T242 WeakPolarHBondContact O-CA 3.37Å; H239-T242 WeakPolarHBondContact O-CB 3.4Å; H239-T242 PolarHBondContact O-N 2.81Å; H239-L243 PolarHBondContact O-N 3.24Å
240	D	87.5	Confident	90.5	Very high	78 Å²	78	31.7 Å²	31.7	42%	0.417	17%	0.173	S	C	.	.	H	α-helix	trans	-48.8	-46.9	163.5	50	-6.7	0	0	0	111.5	T242 L243 V244 P259	D240-T242 PolarHBondContact O-N 3.09Å; D240-L243 PolarHBondContact O-N 2.85Å; D240-V244 WeakPolarHBondContact O-CG2 3.32Å; D240-V244 PolarHBondContact O-N 3.01Å; D240-P259 HydrophobicContact CB-CB 4.22Å; D240-P259 HydrophobicContact CB-CG 4.36Å
241	A	90	Very high	91.3	Very high	21 Å²	21	31.9 Å²	31.9	17%	0.174	18%	0.18	C	C	.	.	H	α-helix	trans	-54.5	-38.3	173	0	0	0	0	0	112.8	M109 Y198 H239 L243 A245	M109-A241 HydrophobicContact CB-CB 4.28Å; M109-A241 HydrophobicContact CG-CB 4.45Å; Y198-A241 PolarHBondContact OH-O 3.12Å; H239-A241 HydrophobicContact CB-CB 4.41Å; H239-A241 PolarHBondContact O-N 3.49Å; A241-L243 VanDerWaalsContact C-N 3.34Å; A241-L243 PolarHBondContact O-N 2.93Å; A241-A245 WeakPolarHBondContact O-CB 3.49Å; A241-A245 PolarHBondContact O-N 2.95Å
242	T	91.6	Very high	91.1	Very high	5 Å²	5	30.3 Å²	30.3	3%	0.031	17%	0.174	C	C	.	.	H	α-helix	trans	-62.3	-41.6	176.3	-51.7	0	0	0	0	111.5	L107 M109 L211 H239 D240 L246	L107-T242 HydrophobicContact CD2-CG2 4.22Å; L107-T242 PolarHBondContact O-OG1 3.27Å; M109-T242 HydrophobicContact CE-CG2 3.71Å; L211-T242 HydrophobicContact CD2-CG2 3.58Å; H239-T242 PolarHBondContact N-OG1 3.37Å; H239-T242 WeakPolarHBondContact O-CA 3.37Å; H239-T242 WeakPolarHBondContact O-CB 3.4Å; H239-T242 PolarHBondContact O-N 2.81Å; D240-T242 PolarHBondContact O-N 3.09Å; T242-L246 WeakPolarHBondContact O-CB 3.18Å; T242-L246 PolarHBondContact O-N 3.16Å
243	L	90.8	Very high	90.9	Very high	34 Å²	34	26.9 Å²	26.9	18%	0.178	16%	0.158	C	C	.	.	H	α-helix	trans	-72	-45.1	179.7	-59.6	-179.6	0	0	0	111.2	H239 D240 A241 A245 L246 L247 P259 I265	H239-L243 PolarHBondContact O-N 3.24Å; D240-L243 PolarHBondContact O-N 2.85Å; A241-L243 VanDerWaalsContact C-N 3.34Å; A241-L243 PolarHBondContact O-N 2.93Å; L243-A245 PolarHBondContact O-N 2.92Å; L243-L246 PolarHBondContact O-N 3.2Å; L243-L247 VanDerWaalsContact O-CG 3.32Å; L243-L247 WeakPolarHBondContact O-CG 3.45Å; L243-L247 PolarHBondContact O-N 2.78Å; L243-P259 HydrophobicContact CB-CB 4.38Å; L243-P259 HydrophobicContact CB-CG 3.83Å; L243-P259 HydrophobicContact CD1-CB 3.8Å; L243-P259 HydrophobicContact CD1-CG 4.18Å; L243-I265 HydrophobicContact CB-CD1 4Å; L243-I265 HydrophobicContact CD2-CD1 3.78Å; L243-I265 HydrophobicContact CD2-CG1 3.96Å; L243-I265 HydrophobicContact CG-CD1 4.46Å
244	V	90.2	Very high	90.3	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.012	17%	0.169	C	C	.	.	H	α-helix	trans	-58.1	-49.8	175.7	175.5	0	0	0	0	110.3	T194 Y198 D240 L246 L247 E248 Y253 P259	T194-V244 HydrophobicContact CG2-CB 4.31Å; T194-V244 HydrophobicContact CG2-CG1 3.72Å; T194-V244 HydrophobicContact CG2-CG2 3.87Å; Y198-V244 HydrophobicContact CD2-CG1 3.53Å; Y198-V244 HydrophobicContact CE2-CB 4.06Å; Y198-V244 HydrophobicContact CE2-CG1 3.53Å; D240-V244 WeakPolarHBondContact O-CG2 3.32Å; D240-V244 PolarHBondContact O-N 3.01Å; V244-L246 PolarHBondContact O-N 2.67Å; V244-L247 PolarHBondContact O-N 3.43Å; V244-L247 VanDerWaalsContact O-N 3.12Å; V244-E248 HydrophobicContact CG1-CG 4.11Å; V244-E248 WeakPolarHBondContact O-CB 3.33Å; V244-E248 WeakPolarHBondContact O-CG 3.46Å; V244-E248 PolarHBondContact O-N 3.28Å; V244-Y253 HydrophobicContact CB-CE2 4.23Å; V244-Y253 HydrophobicContact CG1-CD2 4.07Å; V244-Y253 HydrophobicContact CG1-CE1 4.29Å; V244-Y253 HydrophobicContact CG1-CE2 3.8Å; V244-Y253 HydrophobicContact CG1-CG 4.43Å; V244-Y253 HydrophobicContact CG2-CE2 3.79Å; V244-P259 HydrophobicContact CG2-CG 3.88Å
245	A	92.3	Very high	89.5	Confident	0 Å²	0	29 Å²	29	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-55.7	-40.7	178.5	0	0	0	0	0	112	M109 Y198 A241 L243 N249	M109-A245 HydrophobicContact CE-CB 4.06Å; M109-A245 HydrophobicContact CG-CB 3.99Å; M109-A245 HydrophobicContact SD-CB 3.62Å; Y198-A245 HydrophobicContact CD1-CB 4.15Å; Y198-A245 HydrophobicContact CE1-CB 3.48Å; Y198-A245 VanDerWaalsContact CE1-CB 3.48Å; A241-A245 WeakPolarHBondContact O-CB 3.49Å; A241-A245 PolarHBondContact O-N 2.95Å; L243-A245 PolarHBondContact O-N 2.92Å; A245-N249 WeakPolarHBondContact O-CB 3.44Å; A245-N249 PolarHBondContact O-N 3.39Å; A245-N249 PolarHBondContact O-ND2 3.01Å
246	L	91.6	Very high	88.3	Confident	7 Å²	7	30.5 Å²	30.5	4%	0.037	18%	0.179	C	C	.	.	H	α-helix	trans	-68.4	-43.3	177.6	-171.4	58.4	0	0	0	112.3	L211 L212 I215 T242 L243 V244 E248 N249 L250 I265 F267	L211-L246 HydrophobicContact CD2-CD2 4.27Å; L211-L246 HydrophobicContact CG-CD1 4.47Å; L212-L246 HydrophobicContact CB-CD1 3.87Å; L212-L246 HydrophobicContact CD1-CD1 4.04Å; L212-L246 HydrophobicContact CG-CD1 4.47Å; I215-L246 HydrophobicContact CD1-CD1 4.26Å; I215-L246 HydrophobicContact CD1-CD2 4.02Å; T242-L246 WeakPolarHBondContact O-CB 3.18Å; T242-L246 PolarHBondContact O-N 3.16Å; L243-L246 PolarHBondContact O-N 3.2Å; V244-L246 PolarHBondContact O-N 2.67Å; L246-E248 VanDerWaalsContact C-N 3.35Å; L246-N249 PolarHBondContact O-N 3.5Å; L246-L250 WeakPolarHBondContact O-CG 3.17Å; L246-L250 PolarHBondContact O-N 3.34Å; L246-I265 HydrophobicContact CB-CD1 4.35Å; L246-I265 HydrophobicContact CD2-CD1 4.07Å; L246-I265 HydrophobicContact CD2-CG2 4.42Å; L246-I265 HydrophobicContact CG-CD1 4.46Å; L246-F267 HydrophobicContact CD1-CZ 4.29Å; L246-F267 HydrophobicContact CD2-CE2 3.62Å; L246-F267 HydrophobicContact CD2-CZ 3.85Å; L246-F267 HydrophobicContact CG-CE2 4.41Å; L246-F267 HydrophobicContact CG-CZ 4.14Å
247	L	90.1	Very high	87.2	Confident	3 Å²	3	29.3 Å²	29.3	2%	0.016	18%	0.177	C	C	.	.	H	α-helix	trans	-66	-37.1	177.2	-66.1	171.5	0	0	0	112.2	L243 V244 L250 G251 I252 Y253 L257 I265 V282 L312	L243-L247 VanDerWaalsContact O-CG 3.32Å; L243-L247 WeakPolarHBondContact O-CG 3.45Å; L243-L247 PolarHBondContact O-N 2.78Å; V244-L247 PolarHBondContact O-N 3.43Å; V244-L247 VanDerWaalsContact O-N 3.12Å; L247-L250 PolarHBondContact O-N 2.9Å; L247-G251 PolarHBondContact O-N 3.28Å; L247-G251 VanDerWaalsContact O-N 3.09Å; L247-I252 HydrophobicContact CB-CG1 4.36Å; L247-I252 HydrophobicContact CD2-CD1 3.87Å; L247-I252 HydrophobicContact CD2-CG1 3.83Å; L247-I252 PolarHBondContact O-N 3.28Å; L247-Y253 HydrophobicContact CB-CD2 4.02Å; L247-Y253 HydrophobicContact CB-CG 4.41Å; L247-Y253 HydrophobicContact CD1-CD2 4.03Å; L247-Y253 PolarHBondContact O-N 3.3Å; L247-L257 HydrophobicContact CD1-CB 4.39Å; L247-L257 HydrophobicContact CD1-CD1 4.44Å; L247-I265 HydrophobicContact CD1-CD1 4.28Å; L247-I265 HydrophobicContact CD2-CD1 3.79Å; L247-I265 HydrophobicContact CD2-CG1 4.43Å; L247-I265 HydrophobicContact CG-CD1 3.74Å; L247-V282 HydrophobicContact CD2-CG2 4.28Å; L247-L312 HydrophobicContact CD2-CD1 3.76Å
248	E	91.3	Very high	86.5	Confident	24 Å²	24	30 Å²	30	11%	0.112	18%	0.18	C	C	.	.	H	α-helix	trans	-66.9	-41.9	176.1	-80.3	-75.2	-173.6	0	0	112	Y198 K204 V244 L246 L250 G251 Y253	Y198-E248 HydrophobicContact CD2-CG 4.35Å; Y198-E248 HydrophobicContact CG-CB 4.45Å; Y198-E248 HydrophobicContact CG-CG 4.17Å; K204-E248 HydrophobicContact CD-CB 4.39Å; K204-E248 WeakPolarHBondContact CE-OE2 3.42Å; K204-E248 HydrophobicContact CG-CB 4.45Å; K204-E248 PolarHBondContact NZ-O 2.83Å; K204-E248 IonicContact NZ-OE2 3.93Å; K204-E248 PolarHBondContact NZ-OE2 3.41Å; V244-E248 HydrophobicContact CG1-CG 4.11Å; V244-E248 WeakPolarHBondContact O-CB 3.33Å; V244-E248 WeakPolarHBondContact O-CG 3.46Å; V244-E248 PolarHBondContact O-N 3.28Å; L246-E248 VanDerWaalsContact C-N 3.35Å; E248-L250 VanDerWaalsContact C-N 3.27Å; E248-L250 PolarHBondContact O-N 3.27Å; E248-G251 PolarHBondContact O-N 2.97Å; E248-G251 VanDerWaalsContact O-N 3.12Å; E248-Y253 HydrophobicContact CG-CD1 4.06Å; E248-Y253 HydrophobicContact CG-CG 3.93Å; E248-Y253 WeakPolarHBondContact OE1-CD1 3.29Å
249	N	91.6	Very high	86	Confident	17 Å²	17	29.4 Å²	29.4	9%	0.091	17%	0.172	C	C	.	.	H	α-helix	trans	-65.6	-30.9	173.6	-85.9	-86.9	0	0	0	112.2	K204 R207 G209 L212 A245 L246 G251 F330	K204-N249 PolarHBondContact O-ND2 3.47Å; K204-N249 PolarHBondContact O-OD1 3.09Å; K204-N249 VanDerWaalsContact O-OD1 3.13Å; R207-N249 PolarHBondContact O-ND2 3.16Å; G209-N249 PolarHBondContact N-ND2 2.96Å; L212-N249 HydrophobicContact CD2-CB 3.93Å; A245-N249 WeakPolarHBondContact O-CB 3.44Å; A245-N249 PolarHBondContact O-N 3.39Å; A245-N249 PolarHBondContact O-ND2 3.01Å; L246-N249 PolarHBondContact O-N 3.5Å; N249-G251 VanDerWaalsContact C-N 3.3Å; N249-F330 WeakPolarHBondContact O-CE1 3.44Å
250	L	89.4	Confident	85.6	Confident	5 Å²	5	28.3 Å²	28.3	3%	0.026	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-10.6	173.5	-71.9	173.4	0	0	0	113.7	L212 L246 L247 E248 I252 F267 V280 L314 F330	L212-L250 HydrophobicContact CD1-CD2 3.87Å; L212-L250 HydrophobicContact CD1-CG 4.46Å; L212-L250 HydrophobicContact CD2-CD2 4.17Å; L246-L250 WeakPolarHBondContact O-CG 3.17Å; L246-L250 PolarHBondContact O-N 3.34Å; L247-L250 PolarHBondContact O-N 2.9Å; E248-L250 VanDerWaalsContact C-N 3.27Å; E248-L250 PolarHBondContact O-N 3.27Å; L250-I252 VanDerWaalsContact C-N 3.33Å; L250-I252 HydrophobicContact CB-CD1 3.89Å; L250-I252 HydrophobicContact CB-CG1 3.86Å; L250-I252 HydrophobicContact CD1-CD1 3.81Å; L250-F267 HydrophobicContact CD1-CE1 4.1Å; L250-F267 HydrophobicContact CD1-CZ 3.85Å; L250-V280 HydrophobicContact CD1-CG1 4.39Å; L250-L314 HydrophobicContact CB-CD2 4.35Å; L250-L314 HydrophobicContact CD1-CD2 4.45Å; L250-L314 HydrophobicContact CD2-CD2 4.21Å; L250-F330 HydrophobicContact CD2-CE1 4.5Å; L250-F330 HydrophobicContact CD2-CE2 3.79Å; L250-F330 HydrophobicContact CD2-CZ 3.73Å
251	G	88	Confident	85.4	Confident	52 Å²	52	29.8 Å²	29.8	54%	0.536	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	25.8	-177.1	0	0	0	0	0	114.3	L247 E248 N249	L247-G251 PolarHBondContact O-N 3.28Å; L247-G251 VanDerWaalsContact O-N 3.09Å; E248-G251 PolarHBondContact O-N 2.97Å; E248-G251 VanDerWaalsContact O-N 3.12Å; N249-G251 VanDerWaalsContact C-N 3.3Å
252	I	85.6	Confident	85.3	Confident	26 Å²	26	29.1 Å²	29.1	13%	0.133	16%	0.164	C	C	.	.			trans	-122.4	4.7	-177.3	63.8	-173.6	0	0	0	113.4	L247 L250 L312 L314 P315	L247-I252 HydrophobicContact CB-CG1 4.36Å; L247-I252 HydrophobicContact CD2-CD1 3.87Å; L247-I252 HydrophobicContact CD2-CG1 3.83Å; L247-I252 PolarHBondContact O-N 3.28Å; L250-I252 VanDerWaalsContact C-N 3.33Å; L250-I252 HydrophobicContact CB-CD1 3.89Å; L250-I252 HydrophobicContact CB-CG1 3.86Å; L250-I252 HydrophobicContact CD1-CD1 3.81Å; I252-L312 HydrophobicContact CD1-CB 4.12Å; I252-L312 HydrophobicContact CD1-CD1 3.47Å; I252-L312 VanDerWaalsContact CD1-CD1 3.47Å; I252-L312 HydrophobicContact CD1-CG 4.45Å; I252-L312 HydrophobicContact CG1-CD1 4.19Å; I252-L314 HydrophobicContact CD1-CD2 3.91Å; I252-L314 HydrophobicContact CG2-CD2 4.09Å; I252-P315 HydrophobicContact CG2-CG 4.49Å
253	Y	85.2	Confident	85.1	Confident	30 Å²	30	29.8 Å²	29.8	12%	0.118	17%	0.169	C	C	.	.			trans	-65.7	139.3	175.8	-175.5	-106.6	0	0	0	110.8	A195 V244 L247 E248 L257	A195-Y253 HydrophobicContact CB-CE1 4.14Å; V244-Y253 HydrophobicContact CB-CE2 4.23Å; V244-Y253 HydrophobicContact CG1-CD2 4.07Å; V244-Y253 HydrophobicContact CG1-CE1 4.29Å; V244-Y253 HydrophobicContact CG1-CE2 3.8Å; V244-Y253 HydrophobicContact CG1-CG 4.43Å; V244-Y253 HydrophobicContact CG2-CE2 3.79Å; L247-Y253 HydrophobicContact CB-CD2 4.02Å; L247-Y253 HydrophobicContact CB-CG 4.41Å; L247-Y253 HydrophobicContact CD1-CD2 4.03Å; L247-Y253 PolarHBondContact O-N 3.3Å; E248-Y253 HydrophobicContact CG-CD1 4.06Å; E248-Y253 HydrophobicContact CG-CG 3.93Å; E248-Y253 WeakPolarHBondContact OE1-CD1 3.29Å; Y253-L257 HydrophobicContact CD2-CB 4.43Å; Y253-L257 HydrophobicContact CE2-CB 4.37Å
254	N	80.7	Confident	85.1	Confident	73 Å²	73	29.4 Å²	29.4	39%	0.39	17%	0.168	S	C	.	.			trans	-134.9	147.8	173	179.4	1.2	0	0	0	106.7	L256 L257	N254-L256 PolarHBondContact O-N 3.47Å; N254-L256 VanDerWaalsContact O-N 3.09Å; N254-L256 PolarHBondContact OD1-N 3.18Å; N254-L257 HydrophobicContact CB-CD1 4.22Å; N254-L257 HydrophobicContact CB-CG 4.24Å; N254-L257 WeakPolarHBondContact O-CA 3.45Å; N254-L257 WeakPolarHBondContact O-CB 3.48Å; N254-L257 PolarHBondContact O-N 3.05Å
255	T	76	Confident	85.1	Confident	59 Å²	59	30.4 Å²	30.4	36%	0.362	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-59.8	-19.1	175.7	51.7	0	0	0	0	112.9	A191 A195 L257 V258	A191-T255 HydrophobicContact CB-CG2 4.35Å; A195-T255 HydrophobicContact CB-CG2 4.47Å; T255-L257 VanDerWaalsContact C-N 3.25Å; T255-L257 PolarHBondContact O-N 2.94Å; T255-V258 WeakPolarHBondContact O-CG2 3.26Å
256	L	70.6	Confident	85.1	Confident	65 Å²	65	31.6 Å²	31.6	34%	0.34	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-73.7	-11.6	170	-58.9	-179.2	0	0	0	114.1	N254	N254-L256 PolarHBondContact O-N 3.47Å; N254-L256 VanDerWaalsContact O-N 3.09Å; N254-L256 PolarHBondContact OD1-N 3.18Å
257	L	71.3	Confident	85.1	Confident	35 Å²	35	33 Å²	33	18%	0.183	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-100.5	20.2	-177.1	-63.5	175.9	0	0	0	113.3	L247 Y253 N254 T255 P259 V284	L247-L257 HydrophobicContact CD1-CB 4.39Å; L247-L257 HydrophobicContact CD1-CD1 4.44Å; Y253-L257 HydrophobicContact CD2-CB 4.43Å; Y253-L257 HydrophobicContact CE2-CB 4.37Å; N254-L257 HydrophobicContact CB-CD1 4.22Å; N254-L257 HydrophobicContact CB-CG 4.24Å; N254-L257 WeakPolarHBondContact O-CA 3.45Å; N254-L257 WeakPolarHBondContact O-CB 3.48Å; N254-L257 PolarHBondContact O-N 3.05Å; T255-L257 VanDerWaalsContact C-N 3.25Å; T255-L257 PolarHBondContact O-N 2.94Å; L257-P259 WeakPolarHBondContact O-CD 3.44Å; L257-V284 HydrophobicContact CD2-CG2 4.04Å
258	V	79.3	Confident	85.2	Confident	30 Å²	30	33.8 Å²	33.8	18%	0.182	19%	0.188	C	C	.	.			trans	-53.6	116	173.2	176.4	0	0	0	0	108.9	F190 A191 T255 A260	F190-V258 HydrophobicContact CD1-CG1 4.43Å; F190-V258 HydrophobicContact CE1-CG1 4.06Å; A191-V258 HydrophobicContact CB-CG2 3.75Å; T255-V258 WeakPolarHBondContact O-CG2 3.26Å; V258-A260 PolarHBondContact O-N 3.43Å
259	P	82.6	Confident	85.2	Confident	15 Å²	15	35.1 Å²	35.1	10%	0.097	20%	0.196	C	C	.	.			trans	-69.2	124.6	-173.1	-17.9	30.3	0	0	0	111	D240 L243 V244 L257	D240-P259 HydrophobicContact CB-CB 4.22Å; D240-P259 HydrophobicContact CB-CG 4.36Å; L243-P259 HydrophobicContact CB-CB 4.38Å; L243-P259 HydrophobicContact CB-CG 3.83Å; L243-P259 HydrophobicContact CD1-CB 3.8Å; L243-P259 HydrophobicContact CD1-CG 4.18Å; V244-P259 HydrophobicContact CG2-CG 3.88Å; L257-P259 WeakPolarHBondContact O-CD 3.44Å
260	A	81.9	Confident	85.2	Confident	14 Å²	14	38.4 Å²	38.4	12%	0.116	21%	0.207	C	C	.	.			trans	-88	174.7	166.3	0	0	0	0	0	111.1	V258 S263 V285 F288	V258-A260 PolarHBondContact O-N 3.43Å; A260-S263 PolarHBondContact N-OG 2.94Å; A260-S263 VanDerWaalsContact O-CB 3.26Å; A260-S263 WeakPolarHBondContact O-CB 3.25Å; A260-S263 PolarHBondContact O-N 3.28Å; A260-S263 VanDerWaalsContact O-N 3.16Å; A260-S263 PolarHBondContact O-OG 3.43Å; A260-V285 WeakPolarHBondContact CB-O 2.91Å; A260-F288 HydrophobicContact CB-CE2 4.12Å
261	Y	84	Confident	85.2	Confident	109 Å²	109	44 Å²	44	43%	0.427	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	142.2	-177.1	-60.9	-54	0	0	0	112.7	I169 S263	I169-Y261 HydrophobicContact CB-CE2 4.44Å; I169-Y261 HydrophobicContact CD1-CD2 3.76Å; I169-Y261 HydrophobicContact CD1-CE2 3.38Å; I169-Y261 HydrophobicContact CG1-CE2 4.47Å; I169-Y261 HydrophobicContact CG2-CD2 4.24Å; I169-Y261 HydrophobicContact CG2-CE2 4.05Å; Y261-S263 PolarHBondContact O-N 3.3Å
262	A	87.4	Confident	85.2	Confident	7 Å²	7	44.7 Å²	44.7	6%	0.058	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	25.5	-177.1	0	0	0	0	0	114.8	E23 L27	E23-A262 HydrophobicContact CB-CB 3.91Å; L27-A262 HydrophobicContact CD2-CB 4.41Å; L27-A262 WeakPolarHBondContact CD2-O 3.33Å
263	S	87.9	Confident	85.4	Confident	19 Å²	19	49.1 Å²	49.1	13%	0.133	26%	0.257	C	S	.	.			trans	-67.4	150.7	166.4	-64.3	0	0	0	0	111.3	A260 Y261 K283 V285	A260-S263 PolarHBondContact N-OG 2.94Å; A260-S263 VanDerWaalsContact O-CB 3.26Å; A260-S263 WeakPolarHBondContact O-CB 3.25Å; A260-S263 PolarHBondContact O-N 3.28Å; A260-S263 VanDerWaalsContact O-N 3.16Å; A260-S263 PolarHBondContact O-OG 3.43Å; Y261-S263 PolarHBondContact O-N 3.3Å; S263-K283 WeakPolarHBondContact CA-O 3.49Å; S263-V285 PolarHBondContact OG-N 3.47Å
264	V	89.8	Confident	85.5	Confident	26 Å²	26	51.7 Å²	51.7	16%	0.158	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	140.9	-179.5	64.7	0	0	0	0	111.9	L27 I266 K283	L27-V264 HydrophobicContact CD1-CB 4.47Å; L27-V264 HydrophobicContact CD1-CG1 3.8Å; L27-V264 HydrophobicContact CD2-CB 4.27Å; L27-V264 HydrophobicContact CD2-CG1 4.49Å; V264-I266 HydrophobicContact CG1-CD1 4.35Å; V264-I266 HydrophobicContact CG1-CG1 4.29Å; V264-I266 HydrophobicContact CG2-CG1 3.86Å; V264-K283 HydrophobicContact CG1-CB 3.78Å; V264-K283 HydrophobicContact CG1-CD 4.43Å; V264-K283 PolarHBondContact N-O 3.42Å; V264-K283 PolarHBondContact O-N 3.41Å
265	I	91	Very high	85.9	Confident	22 Å²	22	55.1 Å²	55.1	11%	0.113	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	129.3	165.5	-57.8	169.5	0	0	0	106.8	L243 L246 L247 F267 V280 V282	L243-I265 HydrophobicContact CB-CD1 4Å; L243-I265 HydrophobicContact CD2-CD1 3.78Å; L243-I265 HydrophobicContact CD2-CG1 3.96Å; L243-I265 HydrophobicContact CG-CD1 4.46Å; L246-I265 HydrophobicContact CB-CD1 4.35Å; L246-I265 HydrophobicContact CD2-CD1 4.07Å; L246-I265 HydrophobicContact CD2-CG2 4.42Å; L246-I265 HydrophobicContact CG-CD1 4.46Å; L247-I265 HydrophobicContact CD1-CD1 4.28Å; L247-I265 HydrophobicContact CD2-CD1 3.79Å; L247-I265 HydrophobicContact CD2-CG1 4.43Å; L247-I265 HydrophobicContact CG-CD1 3.74Å; I265-F267 HydrophobicContact CB-CE2 4.46Å; I265-F267 HydrophobicContact CG2-CD2 3.99Å; I265-F267 HydrophobicContact CG2-CE2 3.39Å; I265-F267 HydrophobicContact CG2-CZ 4.05Å; I265-V280 HydrophobicContact CG2-CG1 4.07Å; I265-V282 HydrophobicContact CB-CG2 4.14Å; I265-V282 HydrophobicContact CG1-CG1 4.32Å; I265-V282 HydrophobicContact CG1-CG2 3.75Å; I265-V282 HydrophobicContact CG2-CG2 3.91Å
266	I	91.3	Very high	86.6	Confident	25 Å²	25	55.3 Å²	55.3	13%	0.128	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	122.2	-178.8	-51.2	171.1	0	0	0	108.6	Y35 V264 E268 C281	Y35-I266 HydrophobicContact CE2-CD1 4.44Å; Y35-I266 VanDerWaalsContact OH-CG2 3.31Å; Y35-I266 WeakPolarHBondContact OH-CG2 3.48Å; V264-I266 HydrophobicContact CG1-CD1 4.35Å; V264-I266 HydrophobicContact CG1-CG1 4.29Å; V264-I266 HydrophobicContact CG2-CG1 3.86Å; I266-E268 HydrophobicContact CG2-CG 4.24Å; I266-C281 HydrophobicContact CB-CB 4.35Å; I266-C281 PolarHBondContact N-O 2.87Å; I266-C281 PolarHBondContact O-N 2.86Å
267	F	91.7	Very high	87.5	Confident	38 Å²	38	53.9 Å²	53.9	17%	0.167	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	126	169.8	-62.8	-108.7	0	0	0	108.4	I215 M219 L246 L250 I265 V278 V280	I215-F267 HydrophobicContact CD1-CD2 4.29Å; I215-F267 HydrophobicContact CD1-CE2 3.95Å; I215-F267 HydrophobicContact CD1-CZ 4.33Å; I215-F267 HydrophobicContact CG2-CB 4.36Å; I215-F267 HydrophobicContact CG2-CD1 4.17Å; I215-F267 HydrophobicContact CG2-CD2 4.31Å; I215-F267 HydrophobicContact CG2-CG 4.04Å; M219-F267 HydrophobicContact CE-CB 3.31Å; M219-F267 HydrophobicContact CE-CG 4.38Å; L246-F267 HydrophobicContact CD1-CZ 4.29Å; L246-F267 HydrophobicContact CD2-CE2 3.62Å; L246-F267 HydrophobicContact CD2-CZ 3.85Å; L246-F267 HydrophobicContact CG-CE2 4.41Å; L246-F267 HydrophobicContact CG-CZ 4.14Å; L250-F267 HydrophobicContact CD1-CE1 4.1Å; L250-F267 HydrophobicContact CD1-CZ 3.85Å; I265-F267 HydrophobicContact CB-CE2 4.46Å; I265-F267 HydrophobicContact CG2-CD2 3.99Å; I265-F267 HydrophobicContact CG2-CE2 3.39Å; I265-F267 HydrophobicContact CG2-CZ 4.05Å; F267-V278 HydrophobicContact CD1-CG1 4.16Å; F267-V280 HydrophobicContact CD1-CG1 4.43Å; F267-V280 HydrophobicContact CD1-CG2 3.68Å; F267-V280 HydrophobicContact CE1-CG1 4.17Å; F267-V280 HydrophobicContact CE1-CG2 3.71Å; F267-V280 HydrophobicContact CZ-CG1 4.29Å
268	E	92.1	Very high	88.2	Confident	18 Å²	18	52.2 Å²	52.2	8%	0.084	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	118.3	176.8	-63.3	176.1	173.7	0	0	109	R34 Y35 I266 R270 V278 R279	R34-E268 IonicContact CZ-OE1 3.04Å; R34-E268 IonicContact NE-OE1 2.82Å; R34-E268 PolarHBondContact NE-OE1 3.27Å; R34-E268 IonicContact NH2-OE1 2.99Å; R34-E268 PolarHBondContact NH2-OE1 3.41Å; Y35-E268 HydrophobicContact CE1-CG 4.33Å; Y35-E268 WeakPolarHBondContact CE1-OE1 3.48Å; Y35-E268 PolarHBondContact OH-OE1 2.87Å; I266-E268 HydrophobicContact CG2-CG 4.24Å; E268-R270 HydrophobicContact CB-CG 4.36Å; E268-R270 IonicContact OE2-CZ 3.44Å; E268-R270 IonicContact OE2-NE 2.7Å; E268-R270 PolarHBondContact OE2-NE 3.34Å; E268-R270 IonicContact OE2-NH2 3.56Å; E268-R270 PolarHBondContact OE2-NH2 2.74Å; E268-V278 CarbonylContact O-C 3.39Å; E268-V278 WeakPolarHBondContact O-CA 3.17Å; E268-R279 HydrophobicContact CB-CB 4.34Å; E268-R279 PolarHBondContact N-O 3.19Å; E268-R279 PolarHBondContact O-N 3.13Å
269	L	91.9	Very high	88.5	Confident	53 Å²	53	52.9 Å²	52.9	28%	0.277	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	121.8	166.2	-178.6	64.6	0	0	0	108.5	M219 V222 Y276 F277 V278 L323	M219-L269 HydrophobicContact CB-CD1 4.31Å; M219-L269 HydrophobicContact CB-CD2 4.12Å; M219-L269 HydrophobicContact CE-CB 4.3Å; M219-L269 HydrophobicContact CG-CB 4.3Å; M219-L269 HydrophobicContact CG-CD2 4.42Å; M219-L269 HydrophobicContact SD-CB 4.31Å; V222-L269 HydrophobicContact CB-CD2 3.99Å; V222-L269 HydrophobicContact CG1-CD2 3.92Å; L269-Y276 HydrophobicContact CD1-CD1 4.09Å; L269-Y276 HydrophobicContact CD1-CG 4.44Å; L269-Y276 HydrophobicContact CD2-CD1 4.38Å; L269-Y276 HydrophobicContact CG-CD1 4.15Å; L269-F277 WeakPolarHBondContact CA-O 3.44Å; L269-V278 HydrophobicContact CD1-CG2 4.3Å; L269-L323 HydrophobicContact CD1-CD2 3.96Å
270	R	90.5	Very high	88.3	Confident	85 Å²	85	52.4 Å²	52.4	32%	0.321	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	136.7	-176	-63.5	179.6	172.5	-151.6	-3.3	109.7	E268 Y276 F277	E268-R270 HydrophobicContact CB-CG 4.36Å; E268-R270 IonicContact OE2-CZ 3.44Å; E268-R270 IonicContact OE2-NE 2.7Å; E268-R270 PolarHBondContact OE2-NE 3.34Å; E268-R270 IonicContact OE2-NH2 3.56Å; E268-R270 PolarHBondContact OE2-NH2 2.74Å; R270-Y276 CarbonylContact O-C 3.58Å; R270-Y276 WeakPolarHBondContact O-CA 3.39Å; R270-F277 PolarHBondContact N-O 3.49Å; R270-F277 PolarHBondContact O-N 3.03Å
271	E	89.8	Confident	88.1	Confident	122 Å²	122	51.8 Å²	51.8	57%	0.57	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.7	121.3	169.4	-167	-179.4	155.1	0	0	108.9	R275 Y276	E271-R275 CarbonylContact C-O 3.49Å; E271-R275 WeakPolarHBondContact CA-O 3.32Å; E271-Y276 HydrophobicContact CB-CD1 4.13Å; E271-Y276 HydrophobicContact CB-CE1 3.78Å; E271-Y276 HydrophobicContact CG-CD1 4.38Å; E271-Y276 HydrophobicContact CG-CE1 3.91Å; E271-Y276 PolarHBondContact OE2-OH 2.98Å; E271-Y276 VanDerWaalsContact OE2-OH 3.13Å
272	I	89.1	Confident	87.6	Confident	68 Å²	68	46.8 Å²	46.8	35%	0.349	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	119.2	177.6	-54.1	174	0	0	0	106.8	A274 R275 F277	I272-A274 VanDerWaalsContact C-N 3.32Å; I272-A274 PolarHBondContact O-N 3.38Å; I272-R275 PolarHBondContact N-O 3.27Å; I272-R275 PolarHBondContact O-N 3.02Å; I272-F277 HydrophobicContact CB-CD2 3.87Å; I272-F277 HydrophobicContact CB-CE2 3.8Å; I272-F277 HydrophobicContact CD1-CD2 3.99Å; I272-F277 HydrophobicContact CD1-CE2 4.48Å; I272-F277 HydrophobicContact CD1-CG 4.39Å; I272-F277 HydrophobicContact CG1-CD2 4.04Å; I272-F277 HydrophobicContact CG1-CE2 4.45Å
273	S	89.7	Confident	86.9	Confident	118 Å²	118	46.7 Å²	46.7	83%	0.825	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	51	48	178.7	-54.2	0	0	0	0	113.2	R275	S273-R275 PolarHBondContact O-N 2.71Å
274	A	86.2	Confident	85.7	Confident	84 Å²	84	47.3 Å²	47.3	69%	0.694	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.9	18	-177.9	0	0	0	0	0	115.7	I272	I272-A274 VanDerWaalsContact C-N 3.32Å; I272-A274 PolarHBondContact O-N 3.38Å
275	R	89.4	Confident	84.1	Confident	146 Å²	146	46.8 Å²	46.8	55%	0.551	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-119.6	149.4	171.4	-65.9	-176.7	69.7	-178.3	0.7	110.6	E271 I272 S273 F277	E271-R275 CarbonylContact C-O 3.49Å; E271-R275 WeakPolarHBondContact CA-O 3.32Å; I272-R275 PolarHBondContact N-O 3.27Å; I272-R275 PolarHBondContact O-N 3.02Å; S273-R275 PolarHBondContact O-N 2.71Å; R275-F277 HydrophobicContact CB-CD2 4.49Å; R275-F277 HydrophobicContact CB-CE2 3.66Å; R275-F277 HydrophobicContact CB-CZ 4.13Å; R275-F277 WeakPolarHBondContact O-CD2 3.28Å
276	Y	91	Very high	82.1	Confident	63 Å²	63	47.1 Å²	47.1	25%	0.247	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	132.9	-179	-70.8	-76.1	0	0	0	112.1	L269 R270 E271 L323	L269-Y276 HydrophobicContact CD1-CD1 4.09Å; L269-Y276 HydrophobicContact CD1-CG 4.44Å; L269-Y276 HydrophobicContact CD2-CD1 4.38Å; L269-Y276 HydrophobicContact CG-CD1 4.15Å; R270-Y276 CarbonylContact O-C 3.58Å; R270-Y276 WeakPolarHBondContact O-CA 3.39Å; E271-Y276 HydrophobicContact CB-CD1 4.13Å; E271-Y276 HydrophobicContact CB-CE1 3.78Å; E271-Y276 HydrophobicContact CG-CD1 4.38Å; E271-Y276 HydrophobicContact CG-CE1 3.91Å; E271-Y276 PolarHBondContact OE2-OH 2.98Å; E271-Y276 VanDerWaalsContact OE2-OH 3.13Å; Y276-L323 PolarHBondContact O-N 2.98Å
277	F	88.7	Confident	79.9	Confident	34 Å²	34	48.6 Å²	48.6	15%	0.149	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	149.2	179	-60.1	-97.2	0	0	0	110.9	L269 R270 I272 R275 N320 C321 P322	L269-F277 WeakPolarHBondContact CA-O 3.44Å; R270-F277 PolarHBondContact N-O 3.49Å; R270-F277 PolarHBondContact O-N 3.03Å; I272-F277 HydrophobicContact CB-CD2 3.87Å; I272-F277 HydrophobicContact CB-CE2 3.8Å; I272-F277 HydrophobicContact CD1-CD2 3.99Å; I272-F277 HydrophobicContact CD1-CE2 4.48Å; I272-F277 HydrophobicContact CD1-CG 4.39Å; I272-F277 HydrophobicContact CG1-CD2 4.04Å; I272-F277 HydrophobicContact CG1-CE2 4.45Å; R275-F277 HydrophobicContact CB-CD2 4.49Å; R275-F277 HydrophobicContact CB-CE2 3.66Å; R275-F277 HydrophobicContact CB-CZ 4.13Å; R275-F277 WeakPolarHBondContact O-CD2 3.28Å; F277-N320 HydrophobicContact CB-CB 3.92Å; F277-N320 HydrophobicContact CD1-CB 4.09Å; F277-N320 HydrophobicContact CG-CB 4.2Å; F277-C321 CarbonylContact C-O 3.6Å; F277-C321 WeakPolarHBondContact CA-O 3.37Å; F277-C321 WeakPolarHBondContact CB-O 3.42Å; F277-P322 HydrophobicContact CD1-CB 4.49Å; F277-P322 HydrophobicContact CD1-CG 4.22Å; F277-P322 HydrophobicContact CE1-CB 4.47Å; F277-P322 HydrophobicContact CE1-CG 4Å
278	V	87.4	Confident	77.7	Confident	1 Å²	1	48 Å²	48	1%	0.006	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	133.3	174.9	-175.4	0	0	0	0	109.5	M219 F267 E268 L269 V280 C321 L323 L326	M219-V278 HydrophobicContact CE-CG1 4.27Å; M219-V278 HydrophobicContact SD-CB 4.43Å; M219-V278 HydrophobicContact SD-CG1 3.91Å; M219-V278 HydrophobicContact SD-CG2 3.65Å; F267-V278 HydrophobicContact CD1-CG1 4.16Å; E268-V278 CarbonylContact O-C 3.39Å; E268-V278 WeakPolarHBondContact O-CA 3.17Å; L269-V278 HydrophobicContact CD1-CG2 4.3Å; V278-V280 HydrophobicContact CG1-CG2 4.47Å; V278-C321 PolarHBondContact N-O 2.78Å; V278-C321 PolarHBondContact O-N 2.81Å; V278-L323 HydrophobicContact CG2-CB 4.19Å; V278-L323 HydrophobicContact CG2-CD1 3.56Å; V278-L323 HydrophobicContact CG2-CG 4.45Å; V278-L326 HydrophobicContact CB-CD1 3.38Å; V278-L326 HydrophobicContact CG1-CD1 3.95Å; V278-L326 HydrophobicContact CG2-CD1 3.6Å
279	R	84.3	Confident	75	Confident	44 Å²	44	51.4 Å²	51.4	17%	0.166	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	129.4	171.8	179.6	179	-177.1	137.3	11.3	109.5	E268 L311 E319	E268-R279 HydrophobicContact CB-CB 4.34Å; E268-R279 PolarHBondContact N-O 3.19Å; E268-R279 PolarHBondContact O-N 3.13Å; R279-L311 HydrophobicContact CG-CD1 3.7Å; R279-E319 WeakPolarHBondContact CG-O 3.47Å; R279-E319 IonicContact CZ-OE2 3.46Å; R279-E319 IonicContact NH1-OE2 3.35Å; R279-E319 PolarHBondContact NH1-OE2 2.94Å; R279-E319 IonicContact NH2-OE2 3.08Å; R279-E319 PolarHBondContact NH2-OE2 3.49Å; R279-E319 VanDerWaalsContact NH2-OE2 3.08Å
280	V	80.1	Confident	72.5	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.024	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	115.7	179.2	-171.6	0	0	0	0	109.8	L250 I265 F267 V278 L312 L314	L250-V280 HydrophobicContact CD1-CG1 4.39Å; I265-V280 HydrophobicContact CG2-CG1 4.07Å; F267-V280 HydrophobicContact CD1-CG1 4.43Å; F267-V280 HydrophobicContact CD1-CG2 3.68Å; F267-V280 HydrophobicContact CE1-CG1 4.17Å; F267-V280 HydrophobicContact CE1-CG2 3.71Å; F267-V280 HydrophobicContact CZ-CG1 4.29Å; V278-V280 HydrophobicContact CG1-CG2 4.47Å; V280-L312 PolarHBondContact O-N 3.04Å; V280-L312 VanDerWaalsContact O-N 3.11Å; V280-L314 HydrophobicContact CG2-CD1 4.17Å; V280-L314 HydrophobicContact CG2-CD2 4.28Å; V280-L314 HydrophobicContact CG2-CG 4.4Å
281	C	77.3	Confident	70.2	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.014	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	141.1	176.7	-59.9	0	0	0	0	109.6	I266 V309	I266-C281 HydrophobicContact CB-CB 4.35Å; I266-C281 PolarHBondContact N-O 2.87Å; I266-C281 PolarHBondContact O-N 2.86Å; C281-V309 HydrophobicContact CB-CG1 3.72Å
282	V	73.3	Confident	67.8	Low	4 Å²	4	46.3 Å²	46.3	2%	0.024	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	132.7	174.1	178	0	0	0	0	110.3	L247 I265 V284 V310 L312	L247-V282 HydrophobicContact CD2-CG2 4.28Å; I265-V282 HydrophobicContact CB-CG2 4.14Å; I265-V282 HydrophobicContact CG1-CG1 4.32Å; I265-V282 HydrophobicContact CG1-CG2 3.75Å; I265-V282 HydrophobicContact CG2-CG2 3.91Å; V282-V284 HydrophobicContact CG1-CG2 3.6Å; V282-V310 PolarHBondContact N-O 3.49Å; V282-V310 PolarHBondContact O-N 2.86Å; V282-L312 HydrophobicContact CB-CD1 3.75Å; V282-L312 HydrophobicContact CB-CD2 4.39Å; V282-L312 HydrophobicContact CB-CG 3.84Å; V282-L312 HydrophobicContact CG2-CD1 3.14Å; V282-L312 HydrophobicContact CG2-CG 3.62Å
283	K	71.5	Confident	65	Low	5 Å²	5	49.1 Å²	49.1	2%	0.022	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	95.5	167.9	-179	-172.5	171.6	83.4	0	106.5	L27 F30 S263 V264 V285 A305 A307 V309	L27-K283 HydrophobicContact CD1-CD 4.07Å; F30-K283 HydrophobicContact CD1-CD 3.97Å; F30-K283 HydrophobicContact CE1-CD 3.87Å; F30-K283 HydrophobicContact CG-CD 4.46Å; F30-K283 HydrophobicContact CZ-CD 4.27Å; S263-K283 WeakPolarHBondContact CA-O 3.49Å; V264-K283 HydrophobicContact CG1-CB 3.78Å; V264-K283 HydrophobicContact CG1-CD 4.43Å; V264-K283 PolarHBondContact N-O 3.42Å; V264-K283 PolarHBondContact O-N 3.41Å; K283-V285 PolarHBondContact O-N 2.96Å; K283-A305 PolarHBondContact NZ-O 2.99Å; K283-A307 PolarHBondContact NZ-O 3.2Å; K283-V309 HydrophobicContact CB-CG2 4.42Å
284	V	64.7	Low	62.4	Low	31 Å²	31	50.2 Å²	50.2	19%	0.188	26%	0.261	C	S	.	.			trans	-79.6	116	165.3	-171.7	0	0	0	0	106.5	L257 V282 C286	L257-V284 HydrophobicContact CD2-CG2 4.04Å; V282-V284 HydrophobicContact CG1-CG2 3.6Å; V284-C286 HydrophobicContact CG1-CB 4.46Å; V284-C286 PolarHBondContact O-N 3.44Å
285	V	56.1	Low	59.9	Low	15 Å²	15	54.1 Å²	54.1	9%	0.091	27%	0.271	C	S	.	.			trans	-81	80.3	166.7	-179.3	0	0	0	0	105.5	A260 S263 K283 S287	A260-V285 WeakPolarHBondContact CB-O 2.91Å; S263-V285 PolarHBondContact OG-N 3.47Å; K283-V285 PolarHBondContact O-N 2.96Å; V285-S287 PolarHBondContact O-N 3.06Å
286	C	48.1	Very low	57.2	Low	30 Å²	30	51.9 Å²	51.9	20%	0.203	28%	0.283	C	S	.	.			trans	-67.7	119.4	171.7	-165.4	0	0	0	0	107.2	V284 F288 I292 Y301	V284-C286 HydrophobicContact CG1-CB 4.46Å; V284-C286 PolarHBondContact O-N 3.44Å; C286-F288 VanDerWaalsContact C-N 3.3Å; C286-F288 PolarHBondContact SG-N 3.32Å; C286-I292 HydrophobicContact CB-CD1 4.02Å; C286-Y301 WeakPolarHBondContact O-CE2 3.33Å
287	S	44.3	Very low	54.1	Low	56 Å²	56	53.6 Å²	53.6	39%	0.392	30%	0.296	S	S	.	.			trans	-92.3	5.1	172.2	-165.9	0	0	0	0	111.8	V285 Y301	V285-S287 PolarHBondContact O-N 3.06Å; S287-Y301 PolarHBondContact O-OH 3.44Å
288	F	46.1	Very low	51	Low	24 Å²	24	60.8 Å²	60.8	11%	0.105	33%	0.33	C	S	.	.			trans	-104.8	116.5	-173.9	-55.2	-79	0	0	0	111.3	N165 I169 F183 A260 C286 F290 C291 Y301	N165-F288 WeakPolarHBondContact OD1-CE1 3.14Å; N165-F288 WeakPolarHBondContact OD1-CZ 3.36Å; I169-F288 HydrophobicContact CD1-CZ 4.25Å; F183-F288 HydrophobicContact CE1-CD1 4.32Å; F183-F288 HydrophobicContact CE1-CE1 4.19Å; F183-F288 HydrophobicContact CZ-CE1 4.18Å; A260-F288 HydrophobicContact CB-CE2 4.12Å; C286-F288 VanDerWaalsContact C-N 3.3Å; C286-F288 PolarHBondContact SG-N 3.32Å; F288-F290 VanDerWaalsContact C-N 3.27Å; F288-C291 HydrophobicContact CB-CB 3.76Å; F288-C291 HydrophobicContact CD2-CB 4.47Å; F288-C291 HydrophobicContact CG-CB 4.2Å; F288-C291 VanDerWaalsContact CG-SG 3.59Å; F288-Y301 WeakPolarHBondContact O-CE2 3.25Å
289	V	36.3	Very low	48.2	Very low	90 Å²	90	65.1 Å²	65.1	55%	0.545	35%	0.352	S	S	.	.	S	Bend	trans	-68.1	-31.3	163.5	177.6	0	0	0	0	110.5	Y301	V289-Y301 HydrophobicContact CG2-CD1 3.9Å; V289-Y301 HydrophobicContact CG2-CE1 3.38Å
290	F	39.4	Very low	45.4	Very low	79 Å²	79	70.8 Å²	70.8	35%	0.346	38%	0.384	S	S	.	.	S	Bend	trans	-93.4	-26	-170	-87.3	-86.7	0	0	0	115.8	D180 F288 I292	D180-F290 HydrophobicContact CB-CE1 4.35Å; D180-F290 HydrophobicContact CB-CZ 4.43Å; F288-F290 VanDerWaalsContact C-N 3.27Å; F290-I292 PolarHBondContact O-N 3.12Å; F290-I292 VanDerWaalsContact O-N 3.16Å
291	C	41.3	Very low	43	Very low	37 Å²	37	74 Å²	74	25%	0.25	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-0.6	178.1	-59.9	0	0	0	0	113.8	F288	F288-C291 HydrophobicContact CB-CB 3.76Å; F288-C291 HydrophobicContact CD2-CB 4.47Å; F288-C291 HydrophobicContact CG-CB 4.2Å; F288-C291 VanDerWaalsContact CG-SG 3.59Å
292	I	39.7	Very low	40.5	Very low	37 Å²	37	80.8 Å²	80.8	19%	0.19	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.6	8.3	-175.7	-41.5	-178.8	0	0	0	112.3	C286 F290 H294 I299 Y301	C286-I292 HydrophobicContact CB-CD1 4.02Å; F290-I292 PolarHBondContact O-N 3.12Å; F290-I292 VanDerWaalsContact O-N 3.16Å; I292-H294 PolarHBondContact O-N 3.09Å; I292-I299 HydrophobicContact CG2-CB 4.27Å; I292-Y301 HydrophobicContact CD1-CD2 4.38Å
293	M	31	Very low	38.4	Very low	127 Å²	127	85.8 Å²	85.8	63%	0.626	45%	0.452	S	S	*	.			trans	-85.7	66	174.5	-66.4	-97.9	-74.2	0	0	110.4
294	H	34.9	Very low	36.9	Very low	141 Å²	141	87 Å²	87	65%	0.653	47%	0.467	S	S	*	.			trans	-104.4	117.8	158.3	-117.8	-82.9	0	0	0	106.9	I292 A296	I292-H294 PolarHBondContact O-N 3.09Å; H294-A296 VanDerWaalsContact C-N 3.31Å; H294-A296 PolarHBondContact O-N 2.83Å
295	D	33.3	Very low	35.7	Very low	167 Å²	167	87.4 Å²	87.4	89%	0.893	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	84.4	179.8	-69.4	-44.6	0	0	0	111.2
296	A	32.1	Very low	35	Very low	98 Å²	98	91.8 Å²	91.8	81%	0.81	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	179.6	-16.2	158.8	0	0	0	0	0	113.7	H294	H294-A296 VanDerWaalsContact C-N 3.31Å; H294-A296 PolarHBondContact O-N 2.83Å
297	I	27.2	Very low	35.3	Very low	100 Å²	100	91.3 Å²	91.3	51%	0.513	49%	0.494	S	S	.	.			trans	-131.5	92.7	178	-50.3	178.3	0	0	0	108.7	I299	I297-I299 HydrophobicContact CG2-CD1 4.32Å; I297-I299 HydrophobicContact CG2-CG1 3.56Å; I297-I299 PolarHBondContact O-N 3.03Å
298	Q	23.7	Very low	35.9	Very low	185 Å²	185	96.9 Å²	96.9	86%	0.864	51%	0.514	S	S	*	.			trans	-65.9	78.6	162.2	-73.3	-177.5	-1.4	0	0	108.7	L300	Q298-L300 VanDerWaalsContact C-N 3.31Å; Q298-L300 PolarHBondContact O-N 3.29Å
299	I	27.9	Very low	36.7	Very low	92 Å²	92	97.5 Å²	97.5	47%	0.472	52%	0.52	S	S	.	.			trans	-67.7	101.8	157.3	-55.8	-176.6	0	0	0	104.4	I292 I297 Y301	I292-I299 HydrophobicContact CG2-CB 4.27Å; I297-I299 HydrophobicContact CG2-CD1 4.32Å; I297-I299 HydrophobicContact CG2-CG1 3.56Å; I297-I299 PolarHBondContact O-N 3.03Å; I299-Y301 VanDerWaalsContact C-N 3.34Å; I299-Y301 PolarHBondContact O-N 2.99Å
300	L	24.5	Very low	38.2	Very low	162 Å²	162	97 Å²	97	85%	0.848	52%	0.517	S	S	*	.			trans	-52.1	98.3	174.2	-82.8	126.9	0	0	0	109.6	Q298 K302	Q298-L300 VanDerWaalsContact C-N 3.31Å; Q298-L300 PolarHBondContact O-N 3.29Å; L300-K302 PolarHBondContact O-N 3.22Å
301	Y	29.9	Very low	39.4	Very low	72 Å²	72	95.6 Å²	95.6	28%	0.282	51%	0.513	S	S	.	.			trans	-68.8	110.2	175.3	176	-94	0	0	0	108.9	C286 S287 F288 V289 I292 I299 N303	C286-Y301 WeakPolarHBondContact O-CE2 3.33Å; S287-Y301 PolarHBondContact O-OH 3.44Å; F288-Y301 WeakPolarHBondContact O-CE2 3.25Å; V289-Y301 HydrophobicContact CG2-CD1 3.9Å; V289-Y301 HydrophobicContact CG2-CE1 3.38Å; I292-Y301 HydrophobicContact CD1-CD2 4.38Å; I299-Y301 VanDerWaalsContact C-N 3.34Å; I299-Y301 PolarHBondContact O-N 2.99Å; Y301-N303 HydrophobicContact CE1-CB 3.87Å
302	K	24.4	Very low	40.7	Very low	144 Å²	144	95 Å²	95	63%	0.626	51%	0.507	S	S	*	.			trans	-108.1	105.8	162.2	-156	173	-172.7	175.4	0	108.4	L300 N306	L300-K302 PolarHBondContact O-N 3.22Å; K302-N306 HydrophobicContact CD-CB 4.32Å
303	N	29.3	Very low	42.2	Very low	109 Å²	109	99.5 Å²	99.5	58%	0.583	53%	0.525	S	S	*	.			trans	-40.2	142	172.8	-164.4	5	0	0	0	112.3	Y301	Y301-N303 HydrophobicContact CE1-CB 3.87Å
304	G	40.1	Very low	44.4	Very low	32 Å²	32	93.7 Å²	93.7	33%	0.33	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	118.2	156.8	0	0	0	0	0	117.7	N306	G304-N306 PolarHBondContact O-N 3.08Å
305	A	39.4	Very low	46.4	Very low	39 Å²	39	91.5 Å²	91.5	32%	0.322	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	65	-34.5	173.3	0	0	0	0	0	117.3	K26 K283	K26-A305 HydrophobicContact CD-CB 4.05Å; K283-A305 PolarHBondContact NZ-O 2.99Å
306	N	42.5	Very low	48.6	Very low	106 Å²	106	86.5 Å²	86.5	57%	0.567	47%	0.465	S	S	*	.			trans	-98.9	6.8	-172	-76	-22	0	0	0	115.1	K302 G304 Q308	K302-N306 HydrophobicContact CD-CB 4.32Å; G304-N306 PolarHBondContact O-N 3.08Å; N306-Q308 PolarHBondContact O-N 2.85Å; N306-Q308 VanDerWaalsContact O-N 3.14Å
307	A	54.3	Low	50.8	Low	20 Å²	20	82.9 Å²	82.9	17%	0.165	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-48.7	122.7	174.1	0	0	0	0	0	110.1	K283	K283-A307 PolarHBondContact NZ-O 3.2Å
308	Q	57.1	Low	53.3	Low	174 Å²	174	83.6 Å²	83.6	81%	0.813	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-63.2	144.8	178.6	-78.5	-175.6	-10.9	0	0	109.6	N306 V310	N306-Q308 PolarHBondContact O-N 2.85Å; N306-Q308 VanDerWaalsContact O-N 3.14Å; Q308-V310 PolarHBondContact O-N 3.07Å
309	V	61.8	Low	55.9	Low	36 Å²	36	79.6 Å²	79.6	22%	0.218	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-67.4	123.2	168.6	178.3	0	0	0	0	107	F30 C281 K283	F30-V309 HydrophobicContact CE1-CG2 3.95Å; F30-V309 HydrophobicContact CE2-CG2 4.08Å; F30-V309 HydrophobicContact CZ-CG2 3.24Å; C281-V309 HydrophobicContact CB-CG1 3.72Å; K283-V309 HydrophobicContact CB-CG2 4.42Å
310	V	68.7	Low	58.7	Low	80 Å²	80	77.6 Å²	77.6	49%	0.485	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	123.8	171.2	-176.1	0	0	0	0	106.9	V282 Q308 L312	V282-V310 PolarHBondContact N-O 3.49Å; V282-V310 PolarHBondContact O-N 2.86Å; Q308-V310 PolarHBondContact O-N 3.07Å; V310-L312 HydrophobicContact CG1-CD2 4.19Å; V310-L312 PolarHBondContact O-N 2.78Å
311	L	64.7	Low	61.7	Low	50 Å²	50	70 Å²	70	26%	0.262	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	126	167.6	-178.7	64.2	0	0	0	108.3	R279 E319	R279-L311 HydrophobicContact CG-CD1 3.7Å; L311-E319 HydrophobicContact CD2-CB 3.98Å; L311-E319 HydrophobicContact CD2-CG 3.47Å; L311-E319 VanDerWaalsContact CD2-CG 3.47Å; L311-E319 WeakPolarHBondContact CD2-OE1 3.38Å; L311-E319 WeakPolarHBondContact CD2-OE2 3.38Å
312	L	69.1	Low	64.7	Low	23 Å²	23	67.7 Å²	67.7	12%	0.12	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-92	124.4	171.8	-63.6	-166.6	0	0	0	109.4	L247 I252 V280 V282 V310	L247-L312 HydrophobicContact CD2-CD1 3.76Å; I252-L312 HydrophobicContact CD1-CB 4.12Å; I252-L312 HydrophobicContact CD1-CD1 3.47Å; I252-L312 VanDerWaalsContact CD1-CD1 3.47Å; I252-L312 HydrophobicContact CD1-CG 4.45Å; I252-L312 HydrophobicContact CG1-CD1 4.19Å; V280-L312 PolarHBondContact O-N 3.04Å; V280-L312 VanDerWaalsContact O-N 3.11Å; V282-L312 HydrophobicContact CB-CD1 3.75Å; V282-L312 HydrophobicContact CB-CD2 4.39Å; V282-L312 HydrophobicContact CB-CG 3.84Å; V282-L312 HydrophobicContact CG2-CD1 3.14Å; V282-L312 HydrophobicContact CG2-CG 3.62Å; V310-L312 HydrophobicContact CG1-CD2 4.19Å; V310-L312 PolarHBondContact O-N 2.78Å
313	K	71.4	Confident	67.8	Low	133 Å²	133	60.9 Å²	60.9	58%	0.578	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-82.9	120.8	168.2	-172.9	171.3	-175.8	165	0	107.9	C317 D318	K313-C317 WeakPolarHBondContact CE-O 3.29Å; K313-D318 IonicContact NZ-OD1 3.5Å; K313-D318 PolarHBondContact NZ-OD1 3.36Å
314	L	76.6	Confident	70.8	Confident	5 Å²	5	60.4 Å²	60.4	3%	0.026	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-71.3	142.7	169.2	-57.8	173	0	0	0	108.2	L250 I252 V280 F316 C317 C321 L326	L250-L314 HydrophobicContact CB-CD2 4.35Å; L250-L314 HydrophobicContact CD1-CD2 4.45Å; L250-L314 HydrophobicContact CD2-CD2 4.21Å; I252-L314 HydrophobicContact CD1-CD2 3.91Å; I252-L314 HydrophobicContact CG2-CD2 4.09Å; V280-L314 HydrophobicContact CG2-CD1 4.17Å; V280-L314 HydrophobicContact CG2-CD2 4.28Å; V280-L314 HydrophobicContact CG2-CG 4.4Å; L314-F316 HydrophobicContact CB-CE1 4.2Å; L314-F316 HydrophobicContact CB-CE2 4.2Å; L314-F316 HydrophobicContact CB-CZ 3.93Å; L314-F316 HydrophobicContact CD1-CE2 4.18Å; L314-F316 HydrophobicContact CD1-CZ 3.97Å; L314-F316 HydrophobicContact CG-CZ 4.43Å; L314-F316 PolarHBondContact O-N 2.94Å; L314-C317 PolarHBondContact O-N 2.9Å; L314-C321 HydrophobicContact CD1-CB 4.44Å; L314-L326 HydrophobicContact CD1-CD2 3.64Å
315	P	77.3	Confident	73.2	Confident	95 Å²	95	62.7 Å²	62.7	62%	0.617	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-18.4	-166.8	22.2	-30.5	0	0	0	113.7	I252	I252-P315 HydrophobicContact CG2-CG 4.49Å
316	F	79	Confident	75.5	Confident	62 Å²	62	61 Å²	61	27%	0.272	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	2.9	-174	50.8	-98.2	0	0	0	113.8	L314 L326 R329 F330	L314-F316 HydrophobicContact CB-CE1 4.2Å; L314-F316 HydrophobicContact CB-CE2 4.2Å; L314-F316 HydrophobicContact CB-CZ 3.93Å; L314-F316 HydrophobicContact CD1-CE2 4.18Å; L314-F316 HydrophobicContact CD1-CZ 3.97Å; L314-F316 HydrophobicContact CG-CZ 4.43Å; L314-F316 PolarHBondContact O-N 2.94Å; F316-L326 HydrophobicContact CE2-CD2 3.62Å; F316-L326 HydrophobicContact CZ-CD2 3.77Å; F316-R329 VanDerWaalsContact CE1-CD 3.48Å; F316-F330 HydrophobicContact CE1-CE2 4.36Å; F316-F330 AromaticContact CE1-CZ 3.93Å; F316-F330 HydrophobicContact CE1-CZ 3.93Å; F316-F330 AromaticContact CZ-CE2 3.72Å; F316-F330 HydrophobicContact CZ-CE2 3.72Å; F316-F330 AromaticContact CZ-CZ 3.76Å; F316-F330 HydrophobicContact CZ-CZ 3.76Å
317	C	78.6	Confident	77.9	Confident	22 Å²	22	57.3 Å²	57.3	15%	0.149	30%	0.304	C	S	.	.	S	Bend	trans	-147.3	168.7	178.3	73.3	0	0	0	0	112.3	K313 L314 C321	K313-C317 WeakPolarHBondContact CE-O 3.29Å; L314-C317 PolarHBondContact O-N 2.9Å; C317-C321 HydrophobicContact CB-CB 3.94Å; C317-C321 WeakPolarHBondContact CB-SG 3.34Å; C317-C321 WeakPolarHBondContact SG-CB 3.46Å; C317-C321 PolarHBondContact SG-SG 3.15Å
318	D	78.8	Confident	79.7	Confident	115 Å²	115	63.7 Å²	63.7	62%	0.615	33%	0.33	S	S	*	.			trans	-78.4	-170.4	170.3	-68.5	-40.1	0	0	0	112	K313 N320	K313-D318 IonicContact NZ-OD1 3.5Å; K313-D318 PolarHBondContact NZ-OD1 3.36Å; D318-N320 PolarHBondContact O-N 2.88Å; D318-N320 VanDerWaalsContact O-N 3.09Å
319	E	79.6	Confident	81.2	Confident	100 Å²	100	62.6 Å²	62.6	47%	0.467	32%	0.319	S	S	.	.	S	Bend	trans	-55.6	-30.8	-174.1	-61	-163.7	177.8	0	0	114.4	R279 L311	R279-E319 WeakPolarHBondContact CG-O 3.47Å; R279-E319 IonicContact CZ-OE2 3.46Å; R279-E319 IonicContact NH1-OE2 3.35Å; R279-E319 PolarHBondContact NH1-OE2 2.94Å; R279-E319 IonicContact NH2-OE2 3.08Å; R279-E319 PolarHBondContact NH2-OE2 3.49Å; R279-E319 VanDerWaalsContact NH2-OE2 3.08Å; L311-E319 HydrophobicContact CD2-CB 3.98Å; L311-E319 HydrophobicContact CD2-CG 3.47Å; L311-E319 VanDerWaalsContact CD2-CG 3.47Å; L311-E319 WeakPolarHBondContact CD2-OE1 3.38Å; L311-E319 WeakPolarHBondContact CD2-OE2 3.38Å
320	N	84.7	Confident	82.5	Confident	50 Å²	50	61.8 Å²	61.8	27%	0.267	31%	0.312	S	S	.	.	S	Bend	trans	-115.6	104.7	176.8	-61.3	-53.4	0	0	0	108.2	F277 D318	F277-N320 HydrophobicContact CB-CB 3.92Å; F277-N320 HydrophobicContact CD1-CB 4.09Å; F277-N320 HydrophobicContact CG-CB 4.2Å; D318-N320 PolarHBondContact O-N 2.88Å; D318-N320 VanDerWaalsContact O-N 3.09Å
321	C	88.6	Confident	83.4	Confident	2 Å²	2	62 Å²	62	1%	0.014	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	134.5	176.7	-161.2	0	0	0	0	110.3	F277 V278 L314 C317 L323 L326	F277-C321 CarbonylContact C-O 3.6Å; F277-C321 WeakPolarHBondContact CA-O 3.37Å; F277-C321 WeakPolarHBondContact CB-O 3.42Å; V278-C321 PolarHBondContact N-O 2.78Å; V278-C321 PolarHBondContact O-N 2.81Å; L314-C321 HydrophobicContact CD1-CB 4.44Å; C317-C321 HydrophobicContact CB-CB 3.94Å; C317-C321 WeakPolarHBondContact CB-SG 3.34Å; C317-C321 WeakPolarHBondContact SG-CB 3.46Å; C317-C321 PolarHBondContact SG-SG 3.15Å; C321-L323 PolarHBondContact O-N 3.19Å; C321-L326 HydrophobicContact CB-CD1 3.7Å; C321-L326 HydrophobicContact CB-CD2 4.22Å; C321-L326 HydrophobicContact CB-CG 3.88Å; C321-L326 WeakPolarHBondContact SG-CG 3.41Å
322	P	91.8	Very high	84.6	Confident	24 Å²	24	66.9 Å²	66.9	16%	0.156	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.4	135.3	168	-23.3	34.2	0	0	0	110.7	F277 D324 D325 L326	F277-P322 HydrophobicContact CD1-CB 4.49Å; F277-P322 HydrophobicContact CD1-CG 4.22Å; F277-P322 HydrophobicContact CE1-CB 4.47Å; F277-P322 HydrophobicContact CE1-CG 4Å; P322-D324 VanDerWaalsContact C-N 3.34Å; P322-D324 PolarHBondContact O-N 2.95Å; P322-D325 HydrophobicContact CB-CB 4.18Å; P322-D325 WeakPolarHBondContact CG-OD2 3.02Å; P322-L326 PolarHBondContact O-N 3.21Å
323	L	91.5	Very high	85.5	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-63.2	-41.3	-177.8	173.8	63.1	0	0	0	111.7	M219 L220 L269 Y276 V278 C321 L326 V327	M219-L323 HydrophobicContact CB-CD1 3.81Å; M219-L323 HydrophobicContact CB-CD2 4.25Å; L220-L323 HydrophobicContact CD1-CD2 4.5Å; L269-L323 HydrophobicContact CD1-CD2 3.96Å; Y276-L323 PolarHBondContact O-N 2.98Å; V278-L323 HydrophobicContact CG2-CB 4.19Å; V278-L323 HydrophobicContact CG2-CD1 3.56Å; V278-L323 HydrophobicContact CG2-CG 4.45Å; C321-L323 PolarHBondContact O-N 3.19Å; L323-L326 WeakPolarHBondContact O-CB 3.48Å; L323-L326 PolarHBondContact O-N 2.78Å; L323-V327 HydrophobicContact CD1-CG2 4.09Å; L323-V327 HydrophobicContact CG-CG2 4.38Å; L323-V327 WeakPolarHBondContact O-CG2 3.35Å; L323-V327 PolarHBondContact O-N 2.86Å
324	D	91.4	Very high	86.5	Confident	99 Å²	99	60.6 Å²	60.6	53%	0.529	31%	0.307	S	S	.	.	H	α-helix	trans	-62.3	-45.3	-178.2	-58.7	-39.4	0	0	0	111	P322 L326 V327 E328	P322-D324 VanDerWaalsContact C-N 3.34Å; P322-D324 PolarHBondContact O-N 2.95Å; D324-L326 VanDerWaalsContact C-N 3.27Å; D324-L326 PolarHBondContact O-N 3.47Å; D324-V327 PolarHBondContact O-N 3.17Å; D324-V327 VanDerWaalsContact O-N 3.15Å; D324-E328 WeakPolarHBondContact O-CB 3.35Å; D324-E328 PolarHBondContact O-N 3.36Å
325	D	89.6	Confident	87.1	Confident	81 Å²	81	60.8 Å²	60.8	43%	0.433	31%	0.308	S	S	.	.	H	α-helix	trans	-59	-36.6	175.8	-58.1	12.4	0	0	0	112.3	P322 R329	P322-D325 HydrophobicContact CB-CB 4.18Å; P322-D325 WeakPolarHBondContact CG-OD2 3.02Å; D325-R329 WeakPolarHBondContact O-CB 3.28Å; D325-R329 PolarHBondContact O-N 3.1Å
326	L	89.6	Confident	87.7	Confident	4 Å²	4	62.7 Å²	62.7	2%	0.021	32%	0.318	C	S	.	.	H	α-helix	trans	-69.8	-44.6	175.5	-76.1	171.3	0	0	0	112.2	L216 V278 L314 F316 C321 P322 L323 D324 E328 R329 F330	L216-L326 HydrophobicContact CD2-CB 4.19Å; V278-L326 HydrophobicContact CB-CD1 3.38Å; V278-L326 HydrophobicContact CG1-CD1 3.95Å; V278-L326 HydrophobicContact CG2-CD1 3.6Å; L314-L326 HydrophobicContact CD1-CD2 3.64Å; F316-L326 HydrophobicContact CE2-CD2 3.62Å; F316-L326 HydrophobicContact CZ-CD2 3.77Å; C321-L326 HydrophobicContact CB-CD1 3.7Å; C321-L326 HydrophobicContact CB-CD2 4.22Å; C321-L326 HydrophobicContact CB-CG 3.88Å; C321-L326 WeakPolarHBondContact SG-CG 3.41Å; P322-L326 PolarHBondContact O-N 3.21Å; L323-L326 WeakPolarHBondContact O-CB 3.48Å; L323-L326 PolarHBondContact O-N 2.78Å; D324-L326 VanDerWaalsContact C-N 3.27Å; D324-L326 PolarHBondContact O-N 3.47Å; L326-E328 VanDerWaalsContact C-N 3.34Å; L326-R329 PolarHBondContact O-N 3.32Å; L326-F330 HydrophobicContact CD2-CD2 4.11Å; L326-F330 HydrophobicContact CD2-CE2 3.68Å; L326-F330 WeakPolarHBondContact O-CB 3.43Å; L326-F330 VanDerWaalsContact O-CD2 3.25Å; L326-F330 WeakPolarHBondContact O-CD2 3.34Å; L326-F330 PolarHBondContact O-N 3.02Å
327	V	91.2	Very high	88.1	Confident	28 Å²	28	62.6 Å²	62.6	17%	0.17	32%	0.32	C	S	.	.	H	α-helix	trans	-61.9	-46.7	178.9	171.2	0	0	0	0	109.7	L216 L220 L323 D324 F330 D331	L216-V327 HydrophobicContact CB-CG2 4.35Å; L220-V327 HydrophobicContact CD2-CG1 4.2Å; L220-V327 HydrophobicContact CD2-CG2 4.44Å; L323-V327 HydrophobicContact CD1-CG2 4.09Å; L323-V327 HydrophobicContact CG-CG2 4.38Å; L323-V327 WeakPolarHBondContact O-CG2 3.35Å; L323-V327 PolarHBondContact O-N 2.86Å; D324-V327 PolarHBondContact O-N 3.17Å; D324-V327 VanDerWaalsContact O-N 3.15Å; V327-F330 CarbonylContact O-C 3.6Å; V327-F330 PolarHBondContact O-N 3.47Å; V327-D331 WeakPolarHBondContact O-CA 3.4Å; V327-D331 WeakPolarHBondContact O-CB 3.48Å; V327-D331 PolarHBondContact O-N 3.21Å
328	E	91.7	Very high	88.6	Confident	154 Å²	154	62.1 Å²	62.1	72%	0.72	32%	0.315	S	S	*	.	H	α-helix	trans	-60.6	-48	177.9	-175	178.3	-179.1	0	0	111.5	D324 L326 F330 D331	D324-E328 WeakPolarHBondContact O-CB 3.35Å; D324-E328 PolarHBondContact O-N 3.36Å; L326-E328 VanDerWaalsContact C-N 3.34Å; E328-F330 VanDerWaalsContact C-N 3.32Å; E328-F330 PolarHBondContact O-N 2.88Å; E328-D331 PolarHBondContact O-N 3.41Å
329	R	89	Confident	89.1	Confident	151 Å²	151	59.1 Å²	59.1	57%	0.57	30%	0.297	S	S	*	.	H	α-helix	trans	-64.1	-35.7	-179.1	178.4	168.7	-76.2	-101.7	-0.9	113.4	F316 D325 L326	F316-R329 VanDerWaalsContact CE1-CD 3.48Å; D325-R329 WeakPolarHBondContact O-CB 3.28Å; D325-R329 PolarHBondContact O-N 3.1Å; L326-R329 PolarHBondContact O-N 3.32Å
330	F	90	Very high	89.5	Confident	18 Å²	18	56.1 Å²	56.1	8%	0.079	29%	0.289	C	S	.	.	H	α-helix	trans	-102.6	10.7	-176.9	-65	-61.7	0	0	0	113.6	L212 L216 N249 L250 F316 L326 V327 E328 H332 S333	L212-F330 HydrophobicContact CD2-CB 4.19Å; L212-F330 HydrophobicContact CD2-CD1 3.7Å; L212-F330 HydrophobicContact CD2-CD2 4.29Å; L212-F330 HydrophobicContact CD2-CE1 4.12Å; L212-F330 HydrophobicContact CD2-CG 3.81Å; L216-F330 HydrophobicContact CD1-CB 3.64Å; L216-F330 HydrophobicContact CD1-CD2 4.06Å; L216-F330 HydrophobicContact CD1-CG 4.25Å; N249-F330 WeakPolarHBondContact O-CE1 3.44Å; L250-F330 HydrophobicContact CD2-CE1 4.5Å; L250-F330 HydrophobicContact CD2-CE2 3.79Å; L250-F330 HydrophobicContact CD2-CZ 3.73Å; F316-F330 HydrophobicContact CE1-CE2 4.36Å; F316-F330 AromaticContact CE1-CZ 3.93Å; F316-F330 HydrophobicContact CE1-CZ 3.93Å; F316-F330 AromaticContact CZ-CE2 3.72Å; F316-F330 HydrophobicContact CZ-CE2 3.72Å; F316-F330 AromaticContact CZ-CZ 3.76Å; F316-F330 HydrophobicContact CZ-CZ 3.76Å; L326-F330 HydrophobicContact CD2-CD2 4.11Å; L326-F330 HydrophobicContact CD2-CE2 3.68Å; L326-F330 WeakPolarHBondContact O-CB 3.43Å; L326-F330 VanDerWaalsContact O-CD2 3.25Å; L326-F330 WeakPolarHBondContact O-CD2 3.34Å; L326-F330 PolarHBondContact O-N 3.02Å; V327-F330 CarbonylContact O-C 3.6Å; V327-F330 PolarHBondContact O-N 3.47Å; E328-F330 VanDerWaalsContact C-N 3.32Å; E328-F330 PolarHBondContact O-N 2.88Å; F330-H332 PolarHBondContact O-N 3.48Å; F330-S333 WeakPolarHBondContact O-CB 3.27Å; F330-S333 PolarHBondContact O-N 2.76Å; F330-S333 PolarHBondContact O-OG 3.3Å
331	D	87.7	Confident	89.9	Confident	85 Å²	85	56.4 Å²	56.4	46%	0.455	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-58.5	-37.7	179.7	-174.3	52.9	0	0	0	111.9	V327 E328	V327-D331 WeakPolarHBondContact O-CA 3.4Å; V327-D331 WeakPolarHBondContact O-CB 3.48Å; V327-D331 PolarHBondContact O-N 3.21Å; E328-D331 PolarHBondContact O-N 3.41Å
332	H	89	Confident	90	Very high	153 Å²	153	56.3 Å²	56.3	71%	0.708	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-91.1	1.7	177.6	-54.8	-34.8	0	0	0	114	R205 F330 A334	R205-H332 WeakPolarHBondContact CD-O 3.34Å; F330-H332 PolarHBondContact O-N 3.48Å; H332-A334 PolarHBondContact O-N 2.92Å
333	S	88.5	Confident	89.8	Confident	19 Å²	19	58 Å²	58	13%	0.133	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-78.3	-1.6	-177.9	85.7	0	0	0	0	113.2	R205 G209 F330	R205-S333 WeakPolarHBondContact CG-O 3.5Å; G209-S333 WeakPolarHBondContact CA-O 3.35Å; F330-S333 WeakPolarHBondContact O-CB 3.27Å; F330-S333 PolarHBondContact O-N 2.76Å; F330-S333 PolarHBondContact O-OG 3.3Å
334	A	91.4	Very high	89.5	Confident	4 Å²	4	60.4 Å²	60.4	3%	0.033	32%	0.322	C	S	.	.	S	Bend	trans	-129.8	151	177.5	0	0	0	0	0	111.5	G209 K213 H332	G209-A334 WeakPolarHBondContact O-CB 3.48Å; K213-A334 HydrophobicContact CB-CB 3.61Å; K213-A334 HydrophobicContact CD-CB 3.55Å; K213-A334 HydrophobicContact CG-CB 4.23Å; H332-A334 PolarHBondContact O-N 2.92Å
335	P	90.6	Very high	88.6	Confident	9 Å²	9	62.2 Å²	62.2	6%	0.058	33%	0.328	C	S	.	.			trans	-65.7	144.7	173.1	24.5	-30.7	0	0	0	111.8	R205 L206 W338 E341	R205-P335 VanDerWaalsContact NH1-CA 3.34Å; R205-P335 WeakPolarHBondContact O-CD 3.41Å; L206-P335 HydrophobicContact CD2-CB 4.39Å; L206-P335 HydrophobicContact CD2-CG 4.49Å; P335-W338 HydrophobicContact CB-CB 4.3Å; P335-W338 HydrophobicContact CG-CB 3.84Å; P335-W338 HydrophobicContact CG-CG 4.15Å; P335-E341 WeakPolarHBondContact CA-OE1 3.42Å; P335-E341 WeakPolarHBondContact CB-OE1 3.21Å
336	V	88.9	Confident	87.4	Confident	136 Å²	136	63.2 Å²	63.2	82%	0.824	34%	0.341	S	S	*	.	S	Bend	trans	-74.6	-48.4	175.5	178.8	0	0	0	0	108.7	E341	V336-E341 PolarHBondContact N-OE1 2.98Å
337	D	88.8	Confident	86	Confident	60 Å²	60	72.2 Å²	72.2	32%	0.321	38%	0.38	S	S	.	.	S	Bend	trans	-128.4	96.9	168.8	-169.6	-31.2	0	0	0	109.4	K339 A340 E341	D337-K339 PolarHBondContact O-N 3.41Å; D337-K339 VanDerWaalsContact O-N 3.15Å; D337-K339 WeakPolarHBondContact OD1-CB 3.41Å; D337-K339 PolarHBondContact OD1-N 3.16Å; D337-A340 HydrophobicContact CB-CB 3.92Å; D337-A340 PolarHBondContact O-N 3.34Å; D337-A340 PolarHBondContact OD1-N 3.21Å; D337-E341 PolarHBondContact N-OE1 3.4Å; D337-E341 WeakPolarHBondContact O-CB 3.48Å; D337-E341 VanDerWaalsContact O-CG 3.27Å; D337-E341 WeakPolarHBondContact O-CG 3.48Å; D337-E341 PolarHBondContact O-N 2.89Å
338	W	89	Confident	84.5	Confident	12 Å²	12	76.3 Å²	76.3	5%	0.045	41%	0.407	C	S	.	.	H	α-helix	trans	-54.9	-34.7	-179.5	-176.6	95.2	0	0	0	112.9	C99 Q105 A111 R112 C113 L206 P335 C342 L344	C99-W338 HydrophobicContact CB-CH2 3.94Å; C99-W338 HydrophobicContact CB-CZ3 3.8Å; Q105-W338 HydrophobicContact CB-CD2 3.91Å; Q105-W338 HydrophobicContact CB-CE3 4.24Å; Q105-W338 HydrophobicContact CB-CG 4.46Å; Q105-W338 HydrophobicContact CB-CH2 4.07Å; Q105-W338 HydrophobicContact CB-CZ2 3.72Å; Q105-W338 HydrophobicContact CB-CZ3 4.31Å; Q105-W338 HydrophobicContact CG-CB 4.34Å; Q105-W338 HydrophobicContact CG-CD2 3.59Å; Q105-W338 HydrophobicContact CG-CE3 4.08Å; Q105-W338 HydrophobicContact CG-CG 3.68Å; Q105-W338 HydrophobicContact CG-CZ2 4.34Å; A111-W338 HydrophobicContact CB-CH2 3.77Å; A111-W338 HydrophobicContact CB-CZ2 3.65Å; R112-W338 WeakPolarHBondContact O-CH2 3.34Å; C113-W338 HydrophobicContact CB-CH2 4.43Å; C113-W338 HydrophobicContact CB-CZ2 3.92Å; L206-W338 PolarHBondContact O-NE1 2.92Å; L206-W338 VanDerWaalsContact O-NE1 3.1Å; P335-W338 HydrophobicContact CB-CB 4.3Å; P335-W338 HydrophobicContact CG-CB 3.84Å; P335-W338 HydrophobicContact CG-CG 4.15Å; W338-C342 VanDerWaalsContact CZ2-SG 3.58Å; W338-C342 WeakPolarHBondContact O-CB 3.48Å; W338-C342 PolarHBondContact O-N 3.06Å; W338-C342 PolarHBondContact O-SG 3.23Å; W338-L344 HydrophobicContact CE3-CD1 4.37Å; W338-L344 HydrophobicContact CH2-CD1 3.78Å; W338-L344 HydrophobicContact CZ3-CD1 3.47Å; W338-L344 VanDerWaalsContact CZ3-CD1 3.47Å
339	K	87.3	Confident	83.3	Confident	51 Å²	51	76.5 Å²	76.5	22%	0.222	41%	0.406	C	S	.	.	H	α-helix	trans	-72.6	-45.7	-178.7	-70.7	-173.5	176.7	-174.8	0	111.5	C99 V100 R102 D337 C342 G343 L344	C99-K339 WeakPolarHBondContact O-CE 3.2Å; V100-K339 WeakPolarHBondContact O-CE 3.23Å; V100-K339 PolarHBondContact O-NZ 3.22Å; R102-K339 HydrophobicContact CG-CD 4.35Å; D337-K339 PolarHBondContact O-N 3.41Å; D337-K339 VanDerWaalsContact O-N 3.15Å; D337-K339 WeakPolarHBondContact OD1-CB 3.41Å; D337-K339 PolarHBondContact OD1-N 3.16Å; K339-C342 PolarHBondContact O-N 2.99Å; K339-G343 PolarHBondContact O-N 2.76Å; K339-L344 HydrophobicContact CB-CB 4.46Å; K339-L344 PolarHBondContact O-N 2.87Å
340	A	89.7	Confident	82.5	Confident	37 Å²	37	71.3 Å²	71.3	31%	0.306	40%	0.395	S	S	.	.	H	α-helix	trans	-61.1	-47.9	177.6	0	0	0	0	0	110.7	D337 C342 G343 E345	D337-A340 HydrophobicContact CB-CB 3.92Å; D337-A340 PolarHBondContact O-N 3.34Å; D337-A340 PolarHBondContact OD1-N 3.21Å; A340-C342 VanDerWaalsContact C-N 3.32Å; A340-C342 PolarHBondContact O-N 3.3Å; A340-G343 PolarHBondContact O-N 2.97Å; A340-E345 HydrophobicContact CB-CG 4.28Å; A340-E345 VanDerWaalsContact CB-OE1 3.25Å; A340-E345 WeakPolarHBondContact CB-OE1 3.38Å
341	E	92.5	Very high	82.2	Confident	57 Å²	57	78 Å²	78	27%	0.266	42%	0.42	S	S	.	.	H	α-helix	trans	-70.1	-27.4	-178.1	-63.1	-171.7	-116.1	0	0	113.3	R115 R205 L206 P335 V336 D337 G343	R115-E341 WeakPolarHBondContact CB-O 3.42Å; R205-E341 IonicContact CZ-OE2 3.13Å; R205-E341 IonicContact NH1-OE1 3.82Å; R205-E341 PolarHBondContact NH1-OE1 3.36Å; R205-E341 IonicContact NH1-OE2 3.3Å; R205-E341 PolarHBondContact NH1-OE2 3.28Å; R205-E341 IonicContact NH2-OE2 3.83Å; R205-E341 PolarHBondContact NH2-OE2 3.14Å; L206-E341 HydrophobicContact CD2-CB 3.99Å; P335-E341 WeakPolarHBondContact CA-OE1 3.42Å; P335-E341 WeakPolarHBondContact CB-OE1 3.21Å; V336-E341 PolarHBondContact N-OE1 2.98Å; D337-E341 PolarHBondContact N-OE1 3.4Å; D337-E341 WeakPolarHBondContact O-CB 3.48Å; D337-E341 VanDerWaalsContact O-CG 3.27Å; D337-E341 WeakPolarHBondContact O-CG 3.48Å; D337-E341 PolarHBondContact O-N 2.89Å; E341-G343 VanDerWaalsContact C-N 3.27Å
342	C	90.7	Very high	82.1	Confident	0 Å²	0	81.1 Å²	81.1	0%	0	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-11	169.7	-77.6	0	0	0	0	113.9	C113 P114 R115 W338 K339 A340 L344	C113-C342 HydrophobicContact CB-CB 3.86Å; C113-C342 WeakPolarHBondContact CB-SG 3.5Å; C113-C342 VanDerWaalsContact SG-CA 3.58Å; C113-C342 WeakPolarHBondContact SG-CB 3.19Å; C113-C342 CovalentContact SG-SG 2.04Å; C113-C342 PolarHBondContact SG-SG 3.41Å; P114-C342 VanDerWaalsContact CD-O 3.28Å; P114-C342 WeakPolarHBondContact CD-O 3.36Å; R115-C342 PolarHBondContact N-O 2.8Å; W338-C342 VanDerWaalsContact CZ2-SG 3.58Å; W338-C342 WeakPolarHBondContact O-CB 3.48Å; W338-C342 PolarHBondContact O-N 3.06Å; W338-C342 PolarHBondContact O-SG 3.23Å; K339-C342 PolarHBondContact O-N 2.99Å; A340-C342 VanDerWaalsContact C-N 3.32Å; A340-C342 PolarHBondContact O-N 3.3Å; C342-L344 HydrophobicContact CB-CD1 3.98Å; C342-L344 HydrophobicContact CB-CG 3.91Å
343	G	88.2	Confident	82	Confident	59 Å²	59	77.9 Å²	77.9	61%	0.608	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	75	27.7	-173.7	0	0	0	0	0	113.6	K339 A340 E341	K339-G343 PolarHBondContact O-N 2.76Å; A340-G343 PolarHBondContact O-N 2.97Å; E341-G343 VanDerWaalsContact C-N 3.27Å
344	L	83.7	Confident	81.9	Confident	51 Å²	51	84 Å²	84	27%	0.267	44%	0.442	S	S	.	.			trans	-98.9	9.5	-179.4	-63.4	175.7	0	0	0	113.6	R112 P114 W338 K339 C342 S346	R112-L344 HydrophobicContact CG-CD2 4.36Å; R112-L344 WeakPolarHBondContact O-CD1 3.32Å; P114-L344 HydrophobicContact CG-CD2 4.02Å; W338-L344 HydrophobicContact CE3-CD1 4.37Å; W338-L344 HydrophobicContact CH2-CD1 3.78Å; W338-L344 HydrophobicContact CZ3-CD1 3.47Å; W338-L344 VanDerWaalsContact CZ3-CD1 3.47Å; K339-L344 HydrophobicContact CB-CB 4.46Å; K339-L344 PolarHBondContact O-N 2.87Å; C342-L344 HydrophobicContact CB-CD1 3.98Å; C342-L344 HydrophobicContact CB-CG 3.91Å; L344-S346 PolarHBondContact O-N 2.88Å; L344-S346 VanDerWaalsContact O-N 3.12Å
345	E	73.3	Confident	82	Confident	138 Å²	138	86 Å²	86	65%	0.645	46%	0.458	S	S	*	.			trans	-56.4	123.4	172.9	-81.5	-177.6	-176.5	0	0	109.5	A340 K347	A340-E345 HydrophobicContact CB-CG 4.28Å; A340-E345 VanDerWaalsContact CB-OE1 3.25Å; A340-E345 WeakPolarHBondContact CB-OE1 3.38Å; E345-K347 PolarHBondContact O-N 3.11Å
346	S	65.2	Low	82.1	Confident	101 Å²	101	90.9 Å²	90.9	71%	0.706	48%	0.483	S	S	*	.			trans	-57	126.6	162.6	56.6	0	0	0	0	106.6	L344	L344-S346 PolarHBondContact O-N 2.88Å; L344-S346 VanDerWaalsContact O-N 3.12Å
347	K	59.6	Low	82.3	Confident	193 Å²	193	88.4 Å²	88.4	84%	0.839	47%	0.468	S	S	*	.			trans	-43.3	125	162.4	-73.9	-175.6	178.2	179.3	0	106.1	E345 F349	E345-K347 PolarHBondContact O-N 3.11Å; K347-F349 PolarHBondContact O-N 3.47Å
348	P	59.9	Low	82.6	Confident	114 Å²	114	92.6 Å²	92.6	74%	0.74	48%	0.484	S	S	*	.			trans	-49.1	123.2	-176.2	16.5	-29.2	0	0	0	107	A350	P348-A350 PolarHBondContact O-N 2.81Å
349	F	65.5	Low	83	Confident	158 Å²	158	98.4 Å²	98.4	69%	0.693	51%	0.51	S	S	*	.			trans	-46.8	118.9	178.9	178.3	-105.7	0	0	0	106.3	K347 W351 Y354	K347-F349 PolarHBondContact O-N 3.47Å; F349-W351 HydrophobicContact CD1-CB 3.8Å; F349-W351 HydrophobicContact CE1-CB 4.02Å; F349-W351 PolarHBondContact O-N 2.97Å; F349-Y354 HydrophobicContact CE1-CD2 4.4Å; F349-Y354 HydrophobicContact CE2-CE2 4.19Å; F349-Y354 HydrophobicContact CZ-CD2 4.18Å; F349-Y354 HydrophobicContact CZ-CE2 4.2Å
350	A	72.9	Confident	83.4	Confident	42 Å²	42	99.3 Å²	99.3	35%	0.347	52%	0.52	S	S	.	.			trans	-75.4	44.1	-164.3	0	0	0	0	0	111.3	P348 K352 T353 Y354	P348-A350 PolarHBondContact O-N 2.81Å; A350-K352 PolarHBondContact O-N 2.97Å; A350-K352 VanDerWaalsContact O-N 3.14Å; A350-T353 CarbonylContact O-C 3.51Å; A350-T353 WeakPolarHBondContact O-CA 3.33Å; A350-T353 VanDerWaalsContact O-CB 3.29Å; A350-T353 WeakPolarHBondContact O-CB 3.48Å; A350-T353 PolarHBondContact O-N 3.3Å; A350-Y354 HydrophobicContact CB-CD2 4.4Å; A350-Y354 HydrophobicContact CB-CE2 4.27Å; A350-Y354 WeakPolarHBondContact O-CD2 3.2Å; A350-Y354 PolarHBondContact O-N 2.78Å
351	W	83.9	Confident	83.7	Confident	159 Å²	159	103.2 Å²	103.2	60%	0.602	53%	0.533	S	S	*	.	H	α-helix	trans	-56.6	-30.7	-177.8	75.7	-88	0	0	0	111.5	F349 Y354 A355	F349-W351 HydrophobicContact CD1-CB 3.8Å; F349-W351 HydrophobicContact CE1-CB 4.02Å; F349-W351 PolarHBondContact O-N 2.97Å; W351-Y354 PolarHBondContact O-N 2.86Å; W351-A355 HydrophobicContact CE3-CB 4.37Å; W351-A355 WeakPolarHBondContact O-CA 3.48Å; W351-A355 WeakPolarHBondContact O-CB 3.31Å; W351-A355 PolarHBondContact O-N 2.94Å
352	K	85.4	Confident	83.9	Confident	151 Å²	151	103.3 Å²	103.3	66%	0.657	54%	0.538	S	S	*	.	H	α-helix	trans	-64.3	-42.9	171.8	-68.3	-172.7	178.5	-178.9	0	111.6	A350 L356	A350-K352 PolarHBondContact O-N 2.97Å; A350-K352 VanDerWaalsContact O-N 3.14Å; K352-L356 VanDerWaalsContact O-CB 3.31Å; K352-L356 WeakPolarHBondContact O-CB 3.35Å; K352-L356 PolarHBondContact O-N 2.95Å
353	T	85.8	Confident	84.2	Confident	85 Å²	85	106.2 Å²	106.2	52%	0.521	56%	0.555	S	S	.	*	H	α-helix	trans	-66.4	-45.3	174.9	-44.5	0	0	0	0	110.7	A350 L356 V357	A350-T353 CarbonylContact O-C 3.51Å; A350-T353 WeakPolarHBondContact O-CA 3.33Å; A350-T353 VanDerWaalsContact O-CB 3.29Å; A350-T353 WeakPolarHBondContact O-CB 3.48Å; A350-T353 PolarHBondContact O-N 3.3Å; T353-L356 PolarHBondContact O-N 3.2Å; T353-V357 WeakPolarHBondContact O-CB 3.39Å; T353-V357 VanDerWaalsContact O-CG2 3.25Å; T353-V357 WeakPolarHBondContact O-CG2 3.47Å; T353-V357 PolarHBondContact O-N 3.39Å
354	Y	88.5	Confident	84.6	Confident	146 Å²	146	107.5 Å²	107.5	57%	0.573	55%	0.547	S	S	*	.	H	α-helix	trans	-64.6	-39.5	175.9	-69.2	-63.3	0	0	0	112.6	F349 A350 W351 V357 F358	F349-Y354 HydrophobicContact CE1-CD2 4.4Å; F349-Y354 HydrophobicContact CE2-CE2 4.19Å; F349-Y354 HydrophobicContact CZ-CD2 4.18Å; F349-Y354 HydrophobicContact CZ-CE2 4.2Å; A350-Y354 HydrophobicContact CB-CD2 4.4Å; A350-Y354 HydrophobicContact CB-CE2 4.27Å; A350-Y354 WeakPolarHBondContact O-CD2 3.2Å; A350-Y354 PolarHBondContact O-N 2.78Å; W351-Y354 PolarHBondContact O-N 2.86Å; Y354-V357 PolarHBondContact O-N 3.21Å; Y354-F358 VanDerWaalsContact O-CB 3.23Å; Y354-F358 WeakPolarHBondContact O-CB 3.44Å; Y354-F358 PolarHBondContact O-N 3.38Å
355	A	91.6	Very high	85.3	Confident	46 Å²	46	107.6 Å²	107.6	38%	0.38	56%	0.555	S	S	.	*	H	α-helix	trans	-66.4	-40.1	176	0	0	0	0	0	111.2	W351 F358 F359	W351-A355 HydrophobicContact CE3-CB 4.37Å; W351-A355 WeakPolarHBondContact O-CA 3.48Å; W351-A355 WeakPolarHBondContact O-CB 3.31Å; W351-A355 PolarHBondContact O-N 2.94Å; A355-F358 PolarHBondContact O-N 2.66Å; A355-F359 VanDerWaalsContact O-CB 3.25Å; A355-F359 WeakPolarHBondContact O-CB 3.49Å; A355-F359 PolarHBondContact O-N 3.23Å
356	L	93.1	Very high	86.4	Confident	112 Å²	112	104.8 Å²	104.8	59%	0.586	55%	0.548	S	S	*	.	H	α-helix	trans	-64.2	-46.7	173.5	-177.5	67.4	0	0	0	111.3	K352 T353 F358 F359 V360	K352-L356 VanDerWaalsContact O-CB 3.31Å; K352-L356 WeakPolarHBondContact O-CB 3.35Å; K352-L356 PolarHBondContact O-N 2.95Å; T353-L356 PolarHBondContact O-N 3.2Å; L356-F358 VanDerWaalsContact C-N 3.34Å; L356-F358 PolarHBondContact O-N 3.14Å; L356-F359 PolarHBondContact O-N 3.03Å; L356-V360 WeakPolarHBondContact O-CG2 3.31Å; L356-V360 PolarHBondContact O-N 2.89Å
357	V	94.1	Very high	87.9	Confident	84 Å²	84	104.8 Å²	104.8	51%	0.509	54%	0.539	S	S	.	.	H	α-helix	trans	-60	-45.7	176	170.1	0	0	0	0	110.4	T353 Y354 F359 V360 M361	T353-V357 WeakPolarHBondContact O-CB 3.39Å; T353-V357 VanDerWaalsContact O-CG2 3.25Å; T353-V357 WeakPolarHBondContact O-CG2 3.47Å; T353-V357 PolarHBondContact O-N 3.39Å; Y354-V357 PolarHBondContact O-N 3.21Å; V357-F359 PolarHBondContact O-N 3.05Å; V357-V360 PolarHBondContact O-N 3.48Å; V357-M361 HydrophobicContact CG1-CG 4.41Å; V357-M361 WeakPolarHBondContact O-CB 3.36Å; V357-M361 VanDerWaalsContact O-CG 3.25Å; V357-M361 WeakPolarHBondContact O-CG 2.97Å; V357-M361 PolarHBondContact O-N 3.3Å
358	F	95.4	Very high	89.6	Confident	149 Å²	149	100.6 Å²	100.6	65%	0.654	53%	0.526	S	S	*	.	H	α-helix	trans	-62	-44	177.2	-171.8	-95.6	0	0	0	111.6	Y354 A355 L356 M361 T362	Y354-F358 VanDerWaalsContact O-CB 3.23Å; Y354-F358 WeakPolarHBondContact O-CB 3.44Å; Y354-F358 PolarHBondContact O-N 3.38Å; A355-F358 PolarHBondContact O-N 2.66Å; L356-F358 VanDerWaalsContact C-N 3.34Å; L356-F358 PolarHBondContact O-N 3.14Å; F358-M361 PolarHBondContact O-N 2.99Å; F358-T362 WeakPolarHBondContact O-CB 3.41Å; F358-T362 PolarHBondContact O-N 2.98Å; F358-T362 PolarHBondContact O-OG1 3.2Å
359	F	96.1	Very high	91.3	Very high	134 Å²	134	100.4 Å²	100.4	59%	0.588	52%	0.518	S	S	*	.	H	α-helix	trans	-59.9	-48.8	175.6	-179.8	-99.9	0	0	0	111.9	A355 L356 V357 M361 T362 V363	A355-F359 VanDerWaalsContact O-CB 3.25Å; A355-F359 WeakPolarHBondContact O-CB 3.49Å; A355-F359 PolarHBondContact O-N 3.23Å; L356-F359 PolarHBondContact O-N 3.03Å; V357-F359 PolarHBondContact O-N 3.05Å; F359-M361 PolarHBondContact O-N 2.97Å; F359-T362 WeakPolarHBondContact O-CB 3.05Å; F359-T362 PolarHBondContact O-N 3.22Å; F359-T362 VanDerWaalsContact O-N 3.14Å; F359-V363 HydrophobicContact CD1-CG2 4.32Å; F359-V363 HydrophobicContact CE1-CG2 3.96Å; F359-V363 HydrophobicContact CE2-CG2 4.4Å; F359-V363 HydrophobicContact CZ-CG2 4Å; F359-V363 WeakPolarHBondContact O-CG2 3.46Å; F359-V363 PolarHBondContact O-N 2.92Å
360	V	96.5	Very high	92.7	Very high	70 Å²	70	96.7 Å²	96.7	42%	0.424	51%	0.508	S	S	.	.	H	α-helix	trans	-60.8	-45	177.3	172.1	0	0	0	0	111.2	L356 V357 T362 V363 I364	L356-V360 WeakPolarHBondContact O-CG2 3.31Å; L356-V360 PolarHBondContact O-N 2.89Å; V357-V360 PolarHBondContact O-N 3.48Å; V360-T362 VanDerWaalsContact C-N 3.26Å; V360-T362 PolarHBondContact O-N 3.41Å; V360-V363 PolarHBondContact O-N 3.37Å; V360-I364 HydrophobicContact CG1-CD1 3.84Å; V360-I364 HydrophobicContact CG1-CG1 4.47Å; V360-I364 VanDerWaalsContact O-CG1 3.31Å; V360-I364 WeakPolarHBondContact O-CG1 3.25Å; V360-I364 PolarHBondContact O-N 3.42Å
361	M	96.4	Very high	93.8	Very high	118 Å²	118	97.4 Å²	97.4	58%	0.581	51%	0.514	S	S	*	.	H	α-helix	trans	-60.5	-36.9	175.6	-73.6	-62.1	-66.1	0	0	112.3	V357 F358 F359 I364 A365	V357-M361 HydrophobicContact CG1-CG 4.41Å; V357-M361 WeakPolarHBondContact O-CB 3.36Å; V357-M361 VanDerWaalsContact O-CG 3.25Å; V357-M361 WeakPolarHBondContact O-CG 2.97Å; V357-M361 PolarHBondContact O-N 3.3Å; F358-M361 PolarHBondContact O-N 2.99Å; F359-M361 PolarHBondContact O-N 2.97Å; M361-I364 PolarHBondContact O-N 3.37Å; M361-A365 WeakPolarHBondContact O-CB 3.19Å; M361-A365 PolarHBondContact O-N 3.03Å
362	T	96.5	Very high	94.3	Very high	60 Å²	60	95.6 Å²	95.6	37%	0.368	51%	0.512	S	S	.	.	H	α-helix	trans	-69.4	-43.3	178	-50	0	0	0	0	110.8	F358 F359 V360 I364 A365 V366	F358-T362 WeakPolarHBondContact O-CB 3.41Å; F358-T362 PolarHBondContact O-N 2.98Å; F358-T362 PolarHBondContact O-OG1 3.2Å; F359-T362 WeakPolarHBondContact O-CB 3.05Å; F359-T362 PolarHBondContact O-N 3.22Å; F359-T362 VanDerWaalsContact O-N 3.14Å; V360-T362 VanDerWaalsContact C-N 3.26Å; V360-T362 PolarHBondContact O-N 3.41Å; T362-I364 PolarHBondContact O-N 3.45Å; T362-A365 PolarHBondContact O-N 2.88Å; T362-V366 WeakPolarHBondContact O-CB 3.43Å; T362-V366 VanDerWaalsContact O-CG2 3.27Å; T362-V366 WeakPolarHBondContact O-CG2 3.46Å; T362-V366 PolarHBondContact O-N 3.15Å
363	V	96.8	Very high	94.7	Very high	61 Å²	61	92 Å²	92	37%	0.37	50%	0.503	S	S	.	.	H	α-helix	trans	-61.5	-43.8	175	172.1	0	0	0	0	110.9	F359 V360 V366 N367	F359-V363 HydrophobicContact CD1-CG2 4.32Å; F359-V363 HydrophobicContact CE1-CG2 3.96Å; F359-V363 HydrophobicContact CE2-CG2 4.4Å; F359-V363 HydrophobicContact CZ-CG2 4Å; F359-V363 WeakPolarHBondContact O-CG2 3.46Å; F359-V363 PolarHBondContact O-N 2.92Å; V360-V363 PolarHBondContact O-N 3.37Å; V363-V366 PolarHBondContact O-N 2.98Å; V363-N367 WeakPolarHBondContact CG1-ND2 3.37Å; V363-N367 WeakPolarHBondContact O-CB 3.47Å; V363-N367 PolarHBondContact O-N 3.29Å; V363-N367 PolarHBondContact O-ND2 2.87Å
364	I	96.9	Very high	95.1	Very high	85 Å²	85	92.4 Å²	92.4	44%	0.436	51%	0.505	S	S	.	.	H	α-helix	trans	-61.9	-47.3	176	-67.6	167.3	0	0	0	110.5	V360 M361 T362 V366 N367 L368	V360-I364 HydrophobicContact CG1-CD1 3.84Å; V360-I364 HydrophobicContact CG1-CG1 4.47Å; V360-I364 VanDerWaalsContact O-CG1 3.31Å; V360-I364 WeakPolarHBondContact O-CG1 3.25Å; V360-I364 PolarHBondContact O-N 3.42Å; M361-I364 PolarHBondContact O-N 3.37Å; T362-I364 PolarHBondContact O-N 3.45Å; I364-V366 PolarHBondContact O-N 3.29Å; I364-N367 PolarHBondContact O-N 3.19Å; I364-L368 HydrophobicContact CG2-CD1 3.95Å; I364-L368 HydrophobicContact CG2-CG 4.38Å; I364-L368 WeakPolarHBondContact O-CG 3.41Å; I364-L368 PolarHBondContact O-N 3.42Å
365	A	96.7	Very high	95.3	Very high	53 Å²	53	92.8 Å²	92.8	44%	0.438	51%	0.506	S	S	.	.	H	α-helix	trans	-60.3	-44	178.9	0	0	0	0	0	112.2	M361 T362 L368 L369	M361-A365 WeakPolarHBondContact O-CB 3.19Å; M361-A365 PolarHBondContact O-N 3.03Å; T362-A365 PolarHBondContact O-N 2.88Å; A365-L368 PolarHBondContact O-N 3.23Å; A365-L369 WeakPolarHBondContact O-CB 3.41Å; A365-L369 PolarHBondContact O-N 3.16Å
366	V	96.9	Very high	95.3	Very high	80 Å²	80	96.7 Å²	96.7	49%	0.485	52%	0.515	S	S	.	.	H	α-helix	trans	-62.2	-44.9	176.2	170.8	0	0	0	0	111.1	T362 V363 I364 L368 L369 V370	T362-V366 WeakPolarHBondContact O-CB 3.43Å; T362-V366 VanDerWaalsContact O-CG2 3.27Å; T362-V366 WeakPolarHBondContact O-CG2 3.46Å; T362-V366 PolarHBondContact O-N 3.15Å; V363-V366 PolarHBondContact O-N 2.98Å; I364-V366 PolarHBondContact O-N 3.29Å; V366-L368 PolarHBondContact O-N 2.91Å; V366-L369 PolarHBondContact O-N 3.03Å; V366-V370 HydrophobicContact CG1-CG2 4.44Å; V366-V370 WeakPolarHBondContact O-CG2 3.41Å; V366-V370 PolarHBondContact O-N 3.49Å
367	N	96.2	Very high	95.2	Very high	100 Å²	100	94.5 Å²	94.5	54%	0.535	51%	0.506	S	S	.	.	H	α-helix	trans	-63.9	-39.1	177.9	-81.4	-74.9	0	0	0	112.4	V363 I364 L369 V370 A371	V363-N367 WeakPolarHBondContact CG1-ND2 3.37Å; V363-N367 WeakPolarHBondContact O-CB 3.47Å; V363-N367 PolarHBondContact O-N 3.29Å; V363-N367 PolarHBondContact O-ND2 2.87Å; I364-N367 PolarHBondContact O-N 3.19Å; N367-L369 VanDerWaalsContact C-N 3.34Å; N367-V370 PolarHBondContact O-N 2.88Å; N367-A371 WeakPolarHBondContact O-CB 3.47Å; N367-A371 PolarHBondContact O-N 3.28Å
368	L	96.2	Very high	94.9	Very high	106 Å²	106	95.2 Å²	95.2	56%	0.555	50%	0.504	S	S	*	.	H	α-helix	trans	-63.8	-39.7	174.1	-71.7	172.1	0	0	0	111.8	I364 A365 V366 A371 Q372	I364-L368 HydrophobicContact CG2-CD1 3.95Å; I364-L368 HydrophobicContact CG2-CG 4.38Å; I364-L368 WeakPolarHBondContact O-CG 3.41Å; I364-L368 PolarHBondContact O-N 3.42Å; A365-L368 PolarHBondContact O-N 3.23Å; V366-L368 PolarHBondContact O-N 2.91Å; L368-A371 PolarHBondContact O-N 3.11Å; L368-Q372 WeakPolarHBondContact O-CB 3.47Å; L368-Q372 WeakPolarHBondContact O-CG 3.47Å; L368-Q372 PolarHBondContact O-N 3.16Å
369	L	95.9	Very high	94.5	Very high	109 Å²	109	92.7 Å²	92.7	57%	0.571	49%	0.493	S	S	*	.	H	α-helix	trans	-69.1	-40.2	179.2	-148.3	149.5	0	0	0	111.3	A365 V366 N367 Q372 T373	A365-L369 WeakPolarHBondContact O-CB 3.41Å; A365-L369 PolarHBondContact O-N 3.16Å; V366-L369 PolarHBondContact O-N 3.03Å; N367-L369 VanDerWaalsContact C-N 3.34Å; L369-Q372 PolarHBondContact O-N 2.97Å; L369-T373 WeakPolarHBondContact O-CB 3.32Å; L369-T373 PolarHBondContact O-N 2.91Å; L369-T373 PolarHBondContact O-OG1 3.37Å
370	V	95.5	Very high	94	Very high	80 Å²	80	92 Å²	92	49%	0.485	49%	0.491	S	S	.	.	H	α-helix	trans	-62.4	-46.8	171.2	172.4	0	0	0	0	110.7	V366 N367 Q372 T373 V374	V366-V370 HydrophobicContact CG1-CG2 4.44Å; V366-V370 WeakPolarHBondContact O-CG2 3.41Å; V366-V370 PolarHBondContact O-N 3.49Å; N367-V370 PolarHBondContact O-N 2.88Å; V370-Q372 VanDerWaalsContact C-N 3.35Å; V370-Q372 PolarHBondContact O-N 3.15Å; V370-T373 PolarHBondContact O-N 3.04Å; V370-T373 VanDerWaalsContact O-N 3.16Å; V370-V374 HydrophobicContact CG1-CG2 4.34Å; V370-V374 WeakPolarHBondContact O-CG2 3.47Å; V370-V374 PolarHBondContact O-N 2.86Å
371	A	94.6	Very high	93.2	Very high	57 Å²	57	96.7 Å²	96.7	47%	0.471	50%	0.501	S	S	.	.	H	α-helix	trans	-60.7	-42.3	178.2	0	0	0	0	0	112.2	N367 L368 V374 Y375	N367-A371 WeakPolarHBondContact O-CB 3.47Å; N367-A371 PolarHBondContact O-N 3.28Å; L368-A371 PolarHBondContact O-N 3.11Å; A371-V374 PolarHBondContact O-N 3.21Å; A371-Y375 WeakPolarHBondContact O-CB 3.39Å; A371-Y375 PolarHBondContact O-N 3.11Å
372	Q	95	Very high	92.4	Very high	121 Å²	121	98.6 Å²	98.6	57%	0.565	50%	0.502	S	S	*	.	H	α-helix	trans	-61.2	-44.8	173.2	-77.7	177.7	-11.1	0	0	111.7	L368 L369 V370 Y375 F376	L368-Q372 WeakPolarHBondContact O-CB 3.47Å; L368-Q372 WeakPolarHBondContact O-CG 3.47Å; L368-Q372 PolarHBondContact O-N 3.16Å; L369-Q372 PolarHBondContact O-N 2.97Å; V370-Q372 VanDerWaalsContact C-N 3.35Å; V370-Q372 PolarHBondContact O-N 3.15Å; Q372-Y375 WeakPolarHBondContact O-CB 3.44Å; Q372-Y375 PolarHBondContact O-N 3.47Å; Q372-F376 WeakPolarHBondContact O-CD2 3.47Å; Q372-F376 PolarHBondContact O-N 3.44Å
373	T	93.7	Very high	91.4	Very high	75 Å²	75	100.7 Å²	100.7	46%	0.46	51%	0.508	S	S	.	.	H	α-helix	trans	-63.6	-45.1	179.7	-51	0	0	0	0	111.3	L369 V370 Y375 F376 V377	L369-T373 WeakPolarHBondContact O-CB 3.32Å; L369-T373 PolarHBondContact O-N 2.91Å; L369-T373 PolarHBondContact O-OG1 3.37Å; V370-T373 PolarHBondContact O-N 3.04Å; V370-T373 VanDerWaalsContact O-N 3.16Å; T373-Y375 VanDerWaalsContact C-N 3.34Å; T373-Y375 PolarHBondContact O-N 2.66Å; T373-F376 PolarHBondContact O-N 2.82Å; T373-V377 WeakPolarHBondContact O-CG2 3.37Å; T373-V377 PolarHBondContact O-N 3.06Å
374	V	93.4	Very high	90.3	Very high	94 Å²	94	102.2 Å²	102.2	57%	0.57	51%	0.513	S	S	*	.	H	α-helix	trans	-61.3	-43	175.4	172.2	0	0	0	0	111.1	V370 A371 V377 H378	V370-V374 HydrophobicContact CG1-CG2 4.34Å; V370-V374 WeakPolarHBondContact O-CG2 3.47Å; V370-V374 PolarHBondContact O-N 2.86Å; A371-V374 PolarHBondContact O-N 3.21Å; V374-V377 PolarHBondContact O-N 3.2Å; V374-H378 WeakPolarHBondContact O-CB 3.4Å; V374-H378 PolarHBondContact O-N 3.5Å
375	Y	93.4	Very high	89	Confident	154 Å²	154	103 Å²	103	60%	0.604	52%	0.517	S	S	*	.	H	α-helix	trans	-59.8	-47.1	175.8	174.7	-95.1	0	0	0	112	A371 Q372 T373 H378 K379	A371-Y375 WeakPolarHBondContact O-CB 3.39Å; A371-Y375 PolarHBondContact O-N 3.11Å; Q372-Y375 WeakPolarHBondContact O-CB 3.44Å; Q372-Y375 PolarHBondContact O-N 3.47Å; T373-Y375 VanDerWaalsContact C-N 3.34Å; T373-Y375 PolarHBondContact O-N 2.66Å; Y375-H378 PolarHBondContact O-N 2.57Å; Y375-K379 WeakPolarHBondContact O-CB 3.43Å; Y375-K379 PolarHBondContact O-N 2.78Å
376	F	91.6	Very high	87.5	Confident	128 Å²	128	107.8 Å²	107.8	56%	0.561	53%	0.528	S	S	*	.	H	α-helix	trans	-62.8	-44.4	177.7	-93.3	-78	0	0	0	112.7	Q372 T373 H378 K379 Q380	Q372-F376 WeakPolarHBondContact O-CD2 3.47Å; Q372-F376 PolarHBondContact O-N 3.44Å; T373-F376 PolarHBondContact O-N 2.82Å; F376-H378 PolarHBondContact O-N 2.99Å; F376-K379 PolarHBondContact O-N 2.9Å; F376-Q380 PolarHBondContact O-N 3.15Å
377	V	90.5	Very high	86	Confident	67 Å²	67	108.9 Å²	108.9	41%	0.406	54%	0.535	S	S	.	.	H	α-helix	trans	-63.9	-41	176.9	172.4	0	0	0	0	111.3	T373 V374 Q380 R381	T373-V377 WeakPolarHBondContact O-CG2 3.37Å; T373-V377 PolarHBondContact O-N 3.06Å; V374-V377 PolarHBondContact O-N 3.2Å; V377-Q380 PolarHBondContact O-N 2.98Å; V377-R381 WeakPolarHBondContact O-CG 3.32Å; V377-R381 PolarHBondContact O-N 3.12Å
378	H	88.1	Confident	84.4	Confident	98 Å²	98	112.5 Å²	112.5	45%	0.454	55%	0.546	S	S	.	.	H	α-helix	trans	-65.7	-40.4	176.9	-168.7	79.9	0	0	0	111.9	V374 Y375 F376 R381 R382	V374-H378 WeakPolarHBondContact O-CB 3.4Å; V374-H378 PolarHBondContact O-N 3.5Å; Y375-H378 PolarHBondContact O-N 2.57Å; F376-H378 PolarHBondContact O-N 2.99Å; H378-R381 PolarHBondContact O-N 2.73Å; H378-R382 PolarHBondContact NE2-NE 3.38Å; H378-R382 PolarHBondContact NE2-NH2 3.42Å; H378-R382 PolarHBondContact O-N 3.37Å
379	K	87.9	Confident	82.4	Confident	97 Å²	97	115.7 Å²	115.7	42%	0.422	56%	0.556	S	S	.	*	H	α-helix	trans	-60.7	-49.3	174.9	-174	-178	174.3	-173.6	0	111.4	Y375 F376 R381 R382 E383	Y375-K379 WeakPolarHBondContact O-CB 3.43Å; Y375-K379 PolarHBondContact O-N 2.78Å; F376-K379 PolarHBondContact O-N 2.9Å; K379-R381 VanDerWaalsContact C-N 3.34Å; K379-R381 PolarHBondContact O-N 3.21Å; K379-R382 PolarHBondContact O-N 3.49Å; K379-R382 VanDerWaalsContact O-N 3.15Å; K379-E383 WeakPolarHBondContact CE-OE1 3.42Å; K379-E383 PolarHBondContact O-N 2.81Å
380	Q	84.6	Confident	80.3	Confident	119 Å²	119	119.2 Å²	119.2	56%	0.556	58%	0.581	S	S	*	*	H	α-helix	trans	-59.7	-41.9	176.3	-80.1	-173.2	-24.1	0	0	112.5	F376 V377 R382 E383 I384	F376-Q380 PolarHBondContact O-N 3.15Å; V377-Q380 PolarHBondContact O-N 2.98Å; Q380-R382 VanDerWaalsContact C-N 3.33Å; Q380-R382 PolarHBondContact O-N 3.02Å; Q380-E383 PolarHBondContact O-N 2.74Å; Q380-I384 VanDerWaalsContact O-CG1 3.31Å; Q380-I384 WeakPolarHBondContact O-CG1 3.5Å; Q380-I384 PolarHBondContact O-N 2.93Å
381	R	81.2	Confident	79.5	Confident	169 Å²	169	121.2 Å²	121.2	64%	0.638	59%	0.586	S	S	*	*	H	α-helix	trans	-61.2	-40.6	175.5	-78.7	-176	176.8	-169.6	-0	112.3	V377 H378 K379 I384 I385	V377-R381 WeakPolarHBondContact O-CG 3.32Å; V377-R381 PolarHBondContact O-N 3.12Å; H378-R381 PolarHBondContact O-N 2.73Å; K379-R381 VanDerWaalsContact C-N 3.34Å; K379-R381 PolarHBondContact O-N 3.21Å; R381-I384 PolarHBondContact O-N 3.33Å; R381-I385 WeakPolarHBondContact O-CB 3.12Å; R381-I385 WeakPolarHBondContact O-CD1 3.42Å; R381-I385 VanDerWaalsContact O-CG1 3.23Å; R381-I385 WeakPolarHBondContact O-CG1 3.34Å; R381-I385 PolarHBondContact O-N 2.79Å
382	R	78.4	Confident	78.7	Confident	158 Å²	158	124.5 Å²	124.5	60%	0.596	59%	0.592	S	S	*	*	H	α-helix	trans	-63.9	-43.3	175.3	-75.7	-171	-178.9	-154.9	0.1	111.6	H378 K379 Q380 I385 F386	H378-R382 PolarHBondContact NE2-NE 3.38Å; H378-R382 PolarHBondContact NE2-NH2 3.42Å; H378-R382 PolarHBondContact O-N 3.37Å; K379-R382 PolarHBondContact O-N 3.49Å; K379-R382 VanDerWaalsContact O-N 3.15Å; Q380-R382 VanDerWaalsContact C-N 3.33Å; Q380-R382 PolarHBondContact O-N 3.02Å; R382-I385 PolarHBondContact O-N 3.09Å; R382-F386 WeakPolarHBondContact O-CB 3.38Å; R382-F386 WeakPolarHBondContact O-CD2 3.46Å; R382-F386 PolarHBondContact O-N 3.04Å
383	E	76.3	Confident	77.8	Confident	104 Å²	104	124.7 Å²	124.7	49%	0.486	59%	0.593	S	S	.	*	H	α-helix	trans	-62.1	-43.3	176.2	-71.7	172.6	-179.7	0	0	111.6	K379 Q380 F386 T387	K379-E383 WeakPolarHBondContact CE-OE1 3.42Å; K379-E383 PolarHBondContact O-N 2.81Å; Q380-E383 PolarHBondContact O-N 2.74Å; E383-F386 PolarHBondContact O-N 2.99Å; E383-T387 PolarHBondContact O-N 3.35Å; E383-T387 PolarHBondContact O-OG1 3.13Å
384	I	73.5	Confident	76.9	Confident	92 Å²	92	127.6 Å²	127.6	47%	0.472	60%	0.601	S	S	.	*	H	α-helix	trans	-62.9	-46.4	175.8	-66.9	165.2	0	0	0	111.2	Q380 R381 F386 T387 F388	Q380-I384 VanDerWaalsContact O-CG1 3.31Å; Q380-I384 WeakPolarHBondContact O-CG1 3.5Å; Q380-I384 PolarHBondContact O-N 2.93Å; R381-I384 PolarHBondContact O-N 3.33Å; I384-F386 VanDerWaalsContact C-N 3.29Å; I384-F386 PolarHBondContact O-N 3.08Å; I384-T387 WeakPolarHBondContact O-CB 3.46Å; I384-T387 PolarHBondContact O-N 2.88Å; I384-F388 HydrophobicContact CG2-CD2 3.79Å; I384-F388 HydrophobicContact CG2-CE2 3.87Å; I384-F388 WeakPolarHBondContact O-CD2 3.11Å; I384-F388 PolarHBondContact O-N 2.85Å
385	I	69.3	Low	75.9	Confident	101 Å²	101	129.8 Å²	129.8	52%	0.518	60%	0.603	S	S	.	*	H	α-helix	trans	-62.6	-37.1	178	-68.7	165.3	0	0	0	111.5	R381 R382 T387 F388 K389	R381-I385 WeakPolarHBondContact O-CB 3.12Å; R381-I385 WeakPolarHBondContact O-CD1 3.42Å; R381-I385 VanDerWaalsContact O-CG1 3.23Å; R381-I385 WeakPolarHBondContact O-CG1 3.34Å; R381-I385 PolarHBondContact O-N 2.79Å; R382-I385 PolarHBondContact O-N 3.09Å; I385-T387 VanDerWaalsContact C-N 3.32Å; I385-F388 PolarHBondContact O-N 3.2Å; I385-K389 PolarHBondContact O-N 3.01Å
386	F	64.3	Low	74.7	Confident	155 Å²	155	128.1 Å²	128.1	68%	0.68	60%	0.603	S	S	*	*	H	α-helix	trans	-66.5	-35.1	173.4	-99.5	-81.6	0	0	0	112.1	R382 E383 I384 K389	R382-F386 WeakPolarHBondContact O-CB 3.38Å; R382-F386 WeakPolarHBondContact O-CD2 3.46Å; R382-F386 PolarHBondContact O-N 3.04Å; E383-F386 PolarHBondContact O-N 2.99Å; I384-F386 VanDerWaalsContact C-N 3.29Å; I384-F386 PolarHBondContact O-N 3.08Å; F386-K389 PolarHBondContact O-N 3.3Å
387	T	66.6	Low	73.5	Confident	103 Å²	103	128.1 Å²	128.1	63%	0.632	61%	0.606	S	S	*	*	H	α-helix	trans	-70.6	-32.3	178.2	-41.2	0	0	0	0	112.4	E383 I384 I385	E383-T387 PolarHBondContact O-N 3.35Å; E383-T387 PolarHBondContact O-OG1 3.13Å; I384-T387 WeakPolarHBondContact O-CB 3.46Å; I384-T387 PolarHBondContact O-N 2.88Å; I385-T387 VanDerWaalsContact C-N 3.32Å
388	F	61.3	Low	72.2	Confident	176 Å²	176	132.8 Å²	132.8	77%	0.772	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-6.5	176.1	-84.7	-80	0	0	0	114.4	I384 I385	I384-F388 HydrophobicContact CG2-CD2 3.79Å; I384-F388 HydrophobicContact CG2-CE2 3.87Å; I384-F388 WeakPolarHBondContact O-CD2 3.11Å; I384-F388 PolarHBondContact O-N 2.85Å; I385-F388 PolarHBondContact O-N 3.2Å
389	K	55.7	Low	70.8	Confident	173 Å²	173	135.8 Å²	135.8	75%	0.752	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	-0.5	175.6	-87.6	-170.6	175.2	-173.4	0	113.8	I385 F386	I385-K389 PolarHBondContact O-N 3.01Å; F386-K389 PolarHBondContact O-N 3.3Å
390	V	50.9	Low	69.3	Low	182 Å²	182	139.3 Å²	139.3	100%	1.103	66%	0.655	S	S	*	*			trans	-97.9	0	167.2	-174.7	0	0	0	0	107.5

Retrieved 390 of 390 residues in 155.8 ms (Link to these results)

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