A0A3Q0KNF9_SCHMA Loading...

Palmitoyltransferase AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KNF9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 412 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

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	44.2	Very low	51.9	Low	218 Å²	218	121.2 Å²	121.2	100%	1.074	58%	0.584	S	S	*	*				0	-24.5	0	-90.5	174.6	73.2	0	0	115.9	T4	M1-T4 PolarHBondContact O-OG1 2.94Å
2	K	50.4	Low	52.4	Low	187 Å²	187	118.8 Å²	118.8	81%	0.813	57%	0.574	S	S	*	*	H	α-helix	trans	-82.8	-18.8	-174.4	-70.8	-173.8	177	-179.3	0	116.8
3	I	48.2	Very low	53	Low	138 Å²	138	114.7 Å²	114.7	71%	0.708	56%	0.557	S	S	*	*	H	α-helix	trans	-88.5	-34.2	-177.6	-62.7	174.3	0	0	0	112.3	S7	I3-S7 PolarHBondContact O-N 2.98Å
4	T	47.7	Very low	53	Low	90 Å²	90	113 Å²	113	55%	0.552	55%	0.545	S	S	*	.	H	α-helix	trans	-69	-40.7	179.9	49.3	0	0	0	0	111.9	M1 F6 S7 D8	M1-T4 PolarHBondContact O-OG1 2.94Å; T4-F6 VanDerWaalsContact C-N 3.33Å; T4-F6 PolarHBondContact O-N 2.97Å; T4-S7 WeakPolarHBondContact O-CB 3.15Å; T4-S7 PolarHBondContact O-N 3.26Å; T4-D8 PolarHBondContact O-N 3.3Å; T4-D8 VanDerWaalsContact O-N 3.13Å
5	F	52.9	Low	53	Low	127 Å²	127	108.6 Å²	108.6	56%	0.557	53%	0.53	S	S	*	.	H	α-helix	trans	-58.1	-40.9	178.5	-173.7	-99.8	0	0	0	113.2	H9	F5-H9 AromaticContact CE1-CD2 3.64Å; F5-H9 AromaticContact CE1-NE2 3.79Å; F5-H9 AromaticContact CE2-CD2 3.85Å; F5-H9 AromaticContact CE2-NE2 3.41Å; F5-H9 WeakPolarHBondContact CE2-NE2 3.32Å; F5-H9 AromaticContact CZ-CD2 3.54Å; F5-H9 AromaticContact CZ-NE2 3.18Å; F5-H9 WeakPolarHBondContact CZ-NE2 3.47Å; F5-H9 PolarHBondContact O-CD2 3.29Å; F5-H9 PolarHBondContact O-N 2.83Å
6	F	49.6	Very low	52.9	Low	140 Å²	140	107.3 Å²	107.3	61%	0.614	53%	0.526	S	S	*	.	H	α-helix	trans	-69.8	-33.9	175.1	-92	-83.8	0	0	0	112.6	T4 I10	T4-F6 VanDerWaalsContact C-N 3.33Å; T4-F6 PolarHBondContact O-N 2.97Å; F6-I10 WeakPolarHBondContact O-CB 3.49Å; F6-I10 VanDerWaalsContact O-CD1 3.29Å; F6-I10 WeakPolarHBondContact O-CD1 3.07Å; F6-I10 WeakPolarHBondContact O-CG1 3.05Å; F6-I10 PolarHBondContact O-N 3.11Å
7	S	52.5	Low	52.7	Low	56 Å²	56	103.4 Å²	103.4	39%	0.392	51%	0.507	S	S	.	.	H	α-helix	trans	-62.8	-42.5	177.3	-177.2	0	0	0	0	111.9	I3 T4 I10 Y11	I3-S7 PolarHBondContact O-N 2.98Å; T4-S7 WeakPolarHBondContact O-CB 3.15Å; T4-S7 PolarHBondContact O-N 3.26Å; S7-I10 PolarHBondContact O-N 2.66Å; S7-Y11 PolarHBondContact O-N 3.11Å
8	D	51.1	Low	52.4	Low	99 Å²	99	107.4 Å²	107.4	53%	0.529	52%	0.516	S	S	.	.	H	α-helix	trans	-73.1	-42.3	-174.1	-61.8	-23.7	0	0	0	112.3	T4 I10 Y11 I12	T4-D8 PolarHBondContact O-N 3.3Å; T4-D8 VanDerWaalsContact O-N 3.13Å; D8-I10 VanDerWaalsContact C-N 3.31Å; D8-I10 PolarHBondContact O-N 3.26Å; D8-Y11 WeakPolarHBondContact O-CB 3.21Å; D8-Y11 PolarHBondContact O-N 3.21Å; D8-I12 WeakPolarHBondContact O-CG1 3.34Å; D8-I12 PolarHBondContact O-N 3.4Å
9	H	62.2	Low	52.4	Low	102 Å²	102	109.1 Å²	109.1	47%	0.472	53%	0.527	S	S	.	.	H	α-helix	trans	-66.6	-33.3	175	-77.9	-64.7	0	0	0	112.8	F5 I12 L13	F5-H9 AromaticContact CE1-CD2 3.64Å; F5-H9 AromaticContact CE1-NE2 3.79Å; F5-H9 AromaticContact CE2-CD2 3.85Å; F5-H9 AromaticContact CE2-NE2 3.41Å; F5-H9 WeakPolarHBondContact CE2-NE2 3.32Å; F5-H9 AromaticContact CZ-CD2 3.54Å; F5-H9 AromaticContact CZ-NE2 3.18Å; F5-H9 WeakPolarHBondContact CZ-NE2 3.47Å; F5-H9 PolarHBondContact O-CD2 3.29Å; F5-H9 PolarHBondContact O-N 2.83Å; H9-I12 PolarHBondContact O-N 3.24Å; H9-L13 PolarHBondContact O-N 3.35Å
10	I	56.5	Low	52.2	Low	17 Å²	17	113.1 Å²	113.1	9%	0.087	54%	0.538	C	S	.	.	H	α-helix	trans	-70.9	-34.2	173.7	-69	170.7	0	0	0	110.9	F6 S7 D8 L13 K14 W45 F49	F6-I10 WeakPolarHBondContact O-CB 3.49Å; F6-I10 VanDerWaalsContact O-CD1 3.29Å; F6-I10 WeakPolarHBondContact O-CD1 3.07Å; F6-I10 WeakPolarHBondContact O-CG1 3.05Å; F6-I10 PolarHBondContact O-N 3.11Å; S7-I10 PolarHBondContact O-N 2.66Å; D8-I10 VanDerWaalsContact C-N 3.31Å; D8-I10 PolarHBondContact O-N 3.26Å; I10-L13 PolarHBondContact O-N 3.35Å; I10-K14 HydrophobicContact CG2-CD 4.13Å; I10-K14 HydrophobicContact CG2-CG 4.44Å; I10-K14 WeakPolarHBondContact O-CB 3.45Å; I10-K14 VanDerWaalsContact O-CG 3.24Å; I10-K14 WeakPolarHBondContact O-CG 3.02Å; I10-K14 PolarHBondContact O-N 3.48Å; I10-W45 HydrophobicContact CD1-CH2 3.48Å; I10-W45 VanDerWaalsContact CD1-CH2 3.48Å; I10-W45 HydrophobicContact CD1-CZ2 3.8Å; I10-F49 HydrophobicContact CD1-CD2 4.31Å; I10-F49 HydrophobicContact CD1-CE2 3.82Å; I10-F49 HydrophobicContact CD1-CZ 4.22Å; I10-F49 HydrophobicContact CG1-CE2 3.99Å; I10-F49 HydrophobicContact CG1-CZ 4.41Å; I10-F49 HydrophobicContact CG2-CE2 4.38Å
11	Y	55.1	Low	52.2	Low	159 Å²	159	112.5 Å²	112.5	62%	0.624	54%	0.536	S	S	*	.	H	α-helix	trans	-62.1	-45.1	172.3	-179.8	-98.4	0	0	0	111.3	S7 D8 L13 K14 C15	S7-Y11 PolarHBondContact O-N 3.11Å; D8-Y11 WeakPolarHBondContact O-CB 3.21Å; D8-Y11 PolarHBondContact O-N 3.21Å; Y11-L13 PolarHBondContact O-N 3.21Å; Y11-K14 WeakPolarHBondContact O-CB 3.45Å; Y11-K14 PolarHBondContact O-N 2.89Å; Y11-C15 VanDerWaalsContact CE1-SG 3.55Å; Y11-C15 PolarHBondContact O-N 3.34Å; Y11-C15 PolarHBondContact O-SG 3.05Å
12	I	58.5	Low	52	Low	92 Å²	92	107 Å²	107	47%	0.472	52%	0.516	S	S	.	.	H	α-helix	trans	-60.9	-46.2	175.5	-65.6	169.2	0	0	0	110.8	D8 H9 K14 C15 L16	D8-I12 WeakPolarHBondContact O-CG1 3.34Å; D8-I12 PolarHBondContact O-N 3.4Å; H9-I12 PolarHBondContact O-N 3.24Å; I12-K14 VanDerWaalsContact C-N 3.3Å; I12-K14 PolarHBondContact O-N 3.17Å; I12-C15 WeakPolarHBondContact O-CB 3.44Å; I12-C15 PolarHBondContact O-N 2.93Å; I12-C15 VanDerWaalsContact O-N 3.14Å; I12-L16 HydrophobicContact CG2-CD1 4.04Å; I12-L16 HydrophobicContact CG2-CG 4.4Å; I12-L16 WeakPolarHBondContact O-CG 3.43Å; I12-L16 PolarHBondContact O-N 3.45Å
13	L	60.4	Low	51.8	Low	66 Å²	66	105.6 Å²	105.6	35%	0.346	52%	0.518	S	S	.	.	H	α-helix	trans	-60	-40.5	176.7	-170	68.3	0	0	0	111.6	H9 I10 Y11 L16 L17	H9-L13 PolarHBondContact O-N 3.35Å; I10-L13 PolarHBondContact O-N 3.35Å; Y11-L13 PolarHBondContact O-N 3.21Å; L13-L16 PolarHBondContact O-N 3.02Å; L13-L17 HydrophobicContact CG-CD1 4.27Å; L13-L17 WeakPolarHBondContact O-CB 3.37Å; L13-L17 WeakPolarHBondContact O-CD1 3.47Å; L13-L17 VanDerWaalsContact O-CG 3.22Å; L13-L17 WeakPolarHBondContact O-CG 3.42Å; L13-L17 PolarHBondContact O-N 3.23Å
14	K	52.3	Low	51.7	Low	91 Å²	91	101.3 Å²	101.3	40%	0.396	50%	0.498	S	S	.	.	H	α-helix	trans	-64.9	-39.4	174.4	-75.4	172.8	178.3	178.4	0	112.7	I10 Y11 I12 L17 R18	I10-K14 HydrophobicContact CG2-CD 4.13Å; I10-K14 HydrophobicContact CG2-CG 4.44Å; I10-K14 WeakPolarHBondContact O-CB 3.45Å; I10-K14 VanDerWaalsContact O-CG 3.24Å; I10-K14 WeakPolarHBondContact O-CG 3.02Å; I10-K14 PolarHBondContact O-N 3.48Å; Y11-K14 WeakPolarHBondContact O-CB 3.45Å; Y11-K14 PolarHBondContact O-N 2.89Å; I12-K14 VanDerWaalsContact C-N 3.3Å; I12-K14 PolarHBondContact O-N 3.17Å; K14-L17 PolarHBondContact O-N 2.89Å; K14-R18 WeakPolarHBondContact O-CB 3.47Å; K14-R18 PolarHBondContact O-N 2.9Å
15	C	52.7	Low	51.3	Low	47 Å²	47	100.1 Å²	100.1	32%	0.318	49%	0.487	S	S	.	.	H	α-helix	trans	-64.8	-42.5	174.5	-76.3	0	0	0	0	111.8	Y11 I12 R18 L19	Y11-C15 VanDerWaalsContact CE1-SG 3.55Å; Y11-C15 PolarHBondContact O-N 3.34Å; Y11-C15 PolarHBondContact O-SG 3.05Å; I12-C15 WeakPolarHBondContact O-CB 3.44Å; I12-C15 PolarHBondContact O-N 2.93Å; I12-C15 VanDerWaalsContact O-N 3.14Å; C15-R18 WeakPolarHBondContact O-CB 3.46Å; C15-R18 PolarHBondContact O-N 3.46Å; C15-L19 PolarHBondContact O-N 3.37Å; C15-L19 VanDerWaalsContact O-N 3.14Å
16	L	52.6	Low	50.5	Low	88 Å²	88	102.5 Å²	102.5	46%	0.461	50%	0.502	S	S	.	.	H	α-helix	trans	-64.1	-42	175.9	-69.5	171.8	0	0	0	111.5	I12 L13 R18 L19 Y20	I12-L16 HydrophobicContact CG2-CD1 4.04Å; I12-L16 HydrophobicContact CG2-CG 4.4Å; I12-L16 WeakPolarHBondContact O-CG 3.43Å; I12-L16 PolarHBondContact O-N 3.45Å; L13-L16 PolarHBondContact O-N 3.02Å; L16-R18 VanDerWaalsContact C-N 3.3Å; L16-R18 PolarHBondContact O-N 3.47Å; L16-L19 WeakPolarHBondContact O-CB 3.45Å; L16-L19 PolarHBondContact O-N 3.07Å; L16-L19 VanDerWaalsContact O-N 3.16Å; L16-Y20 PolarHBondContact O-N 3.43Å
17	L	49.6	Very low	50	Low	40 Å²	40	101.5 Å²	101.5	21%	0.209	50%	0.502	C	S	.	.	H	α-helix	trans	-62.3	-36.4	174.2	-73.3	165.7	0	0	0	112.4	L13 K14 L19 Y20 M21 I56 F57	L13-L17 HydrophobicContact CG-CD1 4.27Å; L13-L17 WeakPolarHBondContact O-CB 3.37Å; L13-L17 WeakPolarHBondContact O-CD1 3.47Å; L13-L17 VanDerWaalsContact O-CG 3.22Å; L13-L17 WeakPolarHBondContact O-CG 3.42Å; L13-L17 PolarHBondContact O-N 3.23Å; K14-L17 PolarHBondContact O-N 2.89Å; L17-L19 VanDerWaalsContact C-N 3.3Å; L17-L19 PolarHBondContact O-N 3.43Å; L17-Y20 PolarHBondContact O-N 3.28Å; L17-M21 PolarHBondContact O-N 3Å; L17-M21 VanDerWaalsContact O-N 3.1Å; L17-I56 HydrophobicContact CD1-CD1 4.02Å; L17-I56 HydrophobicContact CD2-CD1 4.49Å; L17-I56 HydrophobicContact CD2-CG2 3.78Å; L17-F57 HydrophobicContact CD2-CZ 4.49Å
18	R	47.3	Very low	49.3	Very low	177 Å²	177	104.4 Å²	104.4	67%	0.668	51%	0.513	S	S	*	.	H	α-helix	trans	-65.2	-32.1	175	-163.7	-173.4	-102.5	-153	-3.1	112.6	K14 C15 L16	K14-R18 WeakPolarHBondContact O-CB 3.47Å; K14-R18 PolarHBondContact O-N 2.9Å; C15-R18 WeakPolarHBondContact O-CB 3.46Å; C15-R18 PolarHBondContact O-N 3.46Å; L16-R18 VanDerWaalsContact C-N 3.3Å; L16-R18 PolarHBondContact O-N 3.47Å
19	L	51.4	Low	49	Very low	139 Å²	139	103.2 Å²	103.2	73%	0.728	51%	0.506	S	S	*	.	H	α-helix	trans	-73.6	-38.7	177.9	-103.6	144.7	0	0	0	112.5	C15 L16 L17	C15-L19 PolarHBondContact O-N 3.37Å; C15-L19 VanDerWaalsContact O-N 3.14Å; L16-L19 WeakPolarHBondContact O-CB 3.45Å; L16-L19 PolarHBondContact O-N 3.07Å; L16-L19 VanDerWaalsContact O-N 3.16Å; L17-L19 VanDerWaalsContact C-N 3.3Å; L17-L19 PolarHBondContact O-N 3.43Å
20	Y	49.7	Very low	47.9	Very low	189 Å²	189	105.2 Å²	105.2	74%	0.741	52%	0.52	S	S	*	.	H	α-helix	trans	-90	-24.3	-174.7	-84.5	-86.9	0	0	0	114.8	L16 L17	L16-Y20 PolarHBondContact O-N 3.43Å; L17-Y20 PolarHBondContact O-N 3.28Å
21	M	50.4	Low	47.6	Very low	101 Å²	101	113.6 Å²	113.6	50%	0.498	55%	0.551	S	S	.	*			trans	-141	71.9	-170.6	-69.6	-85.8	136.8	0	0	113	L17 D23 V24	L17-M21 PolarHBondContact O-N 3Å; L17-M21 VanDerWaalsContact O-N 3.1Å; M21-D23 PolarHBondContact O-N 3.18Å; M21-V24 HydrophobicContact CB-CB 4.37Å; M21-V24 HydrophobicContact CB-CG2 4.04Å; M21-V24 PolarHBondContact O-N 3.2Å; M21-V24 HydrophobicContact SD-CG2 4.37Å
22	P	41.3	Very low	46.9	Very low	101 Å²	101	111.7 Å²	111.7	66%	0.656	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-67.3	-31.8	-173.3	25	-33.2	0	0	0	114.3	V24	P22-V24 VanDerWaalsContact C-N 3.26Å; P22-V24 PolarHBondContact O-N 3.07Å
23	D	46.6	Very low	46.3	Very low	158 Å²	158	114.7 Å²	114.7	85%	0.845	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-71.1	-18.5	-177.7	-75.6	-27.1	0	0	0	113.8	M21	M21-D23 PolarHBondContact O-N 3.18Å
24	V	45.9	Very low	45.9	Very low	49 Å²	49	115.3 Å²	115.3	30%	0.297	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-81.9	-16.6	-173.3	179.6	0	0	0	0	112.4	M21 P22 E60	M21-V24 HydrophobicContact CB-CB 4.37Å; M21-V24 HydrophobicContact CB-CG2 4.04Å; M21-V24 PolarHBondContact O-N 3.2Å; M21-V24 HydrophobicContact SD-CG2 4.37Å; P22-V24 VanDerWaalsContact C-N 3.26Å; P22-V24 PolarHBondContact O-N 3.07Å; V24-E60 VanDerWaalsContact CG2-OE1 3.3Å; V24-E60 WeakPolarHBondContact CG2-OE1 3.47Å
25	M	37.9	Very low	46	Very low	65 Å²	65	115.2 Å²	115.2	32%	0.32	59%	0.586	S	S	.	*			trans	-112	42.9	-170.9	-62.2	-126.3	92	0	0	115.3	I27 L29	M25-I27 HydrophobicContact CE-CB 4.43Å; M25-I27 PolarHBondContact O-N 3.42Å; M25-L29 HydrophobicContact CE-CD1 3.59Å; M25-L29 HydrophobicContact CE-CG 4.16Å; M25-L29 HydrophobicContact SD-CD1 3.37Å; M25-L29 WeakPolarHBondContact SD-CD1 3.46Å; M25-L29 HydrophobicContact SD-CG 4.5Å
26	M	37.1	Very low	46.2	Very low	176 Å²	176	115.4 Å²	115.4	87%	0.867	59%	0.587	S	S	*	*			trans	-67.4	-1.4	154.7	-82.4	-93	66.2	0	0	112.9	N28	M26-N28 PolarHBondContact O-N 3.3Å; M26-N28 VanDerWaalsContact O-N 3.15Å
27	I	38.1	Very low	47.2	Very low	119 Å²	119	122 Å²	122	61%	0.61	61%	0.606	S	S	*	*	S	Bend	trans	-71.8	102.2	164.8	-56.7	176.3	0	0	0	108.3	M25 L29	M25-I27 HydrophobicContact CE-CB 4.43Å; M25-I27 PolarHBondContact O-N 3.42Å; I27-L29 PolarHBondContact O-N 3.2Å
28	N	37.8	Very low	48.5	Very low	117 Å²	117	122.3 Å²	122.3	63%	0.626	61%	0.611	S	S	*	*			trans	-61.3	102.5	-178.3	-157.7	-17.9	0	0	0	111.1	M26 N30	M26-N28 PolarHBondContact O-N 3.3Å; M26-N28 VanDerWaalsContact O-N 3.15Å; N28-N30 VanDerWaalsContact C-N 3.3Å; N28-N30 PolarHBondContact O-N 3.08Å
29	L	44.9	Very low	50.1	Low	75 Å²	75	118.9 Å²	118.9	39%	0.393	61%	0.61	S	S	.	*			trans	-81	5.3	-172.7	-89.6	163.7	0	0	0	115	M25 I27 R31	M25-L29 HydrophobicContact CE-CD1 3.59Å; M25-L29 HydrophobicContact CE-CG 4.16Å; M25-L29 HydrophobicContact SD-CD1 3.37Å; M25-L29 WeakPolarHBondContact SD-CD1 3.46Å; M25-L29 HydrophobicContact SD-CG 4.5Å; I27-L29 PolarHBondContact O-N 3.2Å; L29-R31 PolarHBondContact O-N 3.33Å
30	N	39.2	Very low	51.2	Low	144 Å²	144	121.8 Å²	121.8	77%	0.77	61%	0.613	S	S	*	*			trans	-75.5	42.7	172.4	-86.2	0.8	0	0	0	112.9	N28 N32	N28-N30 VanDerWaalsContact C-N 3.3Å; N28-N30 PolarHBondContact O-N 3.08Å; N30-N32 PolarHBondContact O-N 3.13Å
31	R	49.9	Very low	52.4	Low	193 Å²	193	117.7 Å²	117.7	73%	0.728	60%	0.601	S	S	*	*			trans	-77.6	106.3	161.6	-77.9	-172.9	177.9	-178.5	0.9	106.7	L29 L33	L29-R31 PolarHBondContact O-N 3.33Å; R31-L33 PolarHBondContact O-N 3.34Å
32	N	42.3	Very low	53.6	Low	119 Å²	119	115.7 Å²	115.7	64%	0.636	60%	0.596	S	S	*	*			trans	-31.5	122.4	173.6	-72.3	-9.7	0	0	0	111.9	N30 S34	N30-N32 PolarHBondContact O-N 3.13Å; N32-S34 PolarHBondContact O-N 2.97Å
33	L	44.6	Very low	55.4	Low	154 Å²	154	115.2 Å²	115.2	81%	0.806	59%	0.587	S	S	*	*			trans	-68	46.2	175.4	-74.9	151.8	0	0	0	111.8	R31 P35	R31-L33 PolarHBondContact O-N 3.34Å; L33-P35 VanDerWaalsContact O-CD 3.3Å; L33-P35 WeakPolarHBondContact O-CD 3.24Å
34	S	52.2	Low	56.6	Low	80 Å²	80	109.1 Å²	109.1	56%	0.559	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-69.8	118.5	166.3	-48	0	0	0	0	107	N32	N32-S34 PolarHBondContact O-N 2.97Å
35	P	54.7	Low	58.2	Low	89 Å²	89	112.5 Å²	112.5	58%	0.578	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-57.5	140.5	174.9	22.6	-31.3	0	0	0	109.2	L33 R37	L33-P35 VanDerWaalsContact O-CD 3.3Å; L33-P35 WeakPolarHBondContact O-CD 3.24Å; P35-R37 PolarHBondContact O-N 3.49Å; P35-R37 VanDerWaalsContact O-N 3.17Å
36	P	57.3	Low	60.1	Low	51 Å²	51	114.8 Å²	114.8	33%	0.331	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-56.3	123	178.9	22.7	-32.3	0	0	0	109.5	Q41 C42	P36-Q41 HydrophobicContact CB-CB 3.45Å; P36-Q41 VanDerWaalsContact CB-CB 3.45Å; P36-C42 VanDerWaalsContact CG-SG 3.59Å
37	R	72.2	Confident	61.9	Low	226 Å²	226	111.4 Å²	111.4	85%	0.853	56%	0.562	S	S	*	*			trans	-88.7	-10.9	-175.7	-64.5	-173.5	179.9	-176.4	-1.4	113.3	P35	P35-R37 PolarHBondContact O-N 3.49Å; P35-R37 VanDerWaalsContact O-N 3.17Å
38	S	78.8	Confident	63.5	Low	46 Å²	46	110.1 Å²	110.1	32%	0.322	56%	0.556	S	S	.	*	S	Bend	trans	-136.9	156	-178.5	63.1	0	0	0	0	111.8	Y40 Q41 C42	S38-Y40 PolarHBondContact O-N 3.16Å; S38-Q41 WeakPolarHBondContact O-CA 3.38Å; S38-Q41 WeakPolarHBondContact O-CB 3.31Å; S38-Q41 PolarHBondContact O-N 2.87Å; S38-Q41 WeakPolarHBondContact OG-CG 3.42Å; S38-Q41 PolarHBondContact OG-N 2.01Å; S38-C42 PolarHBondContact O-N 3.34Å
39	T	80.1	Confident	65.5	Low	106 Å²	106	107.1 Å²	107.1	65%	0.65	54%	0.538	S	S	*	.	H	α-helix	trans	-53.2	-39.6	176.7	-45.3	0	0	0	0	112.1	Q41 C42 I43	T39-Q41 PolarHBondContact O-N 3.49Å; T39-C42 WeakPolarHBondContact O-CB 3.37Å; T39-C42 PolarHBondContact O-N 2.92Å; T39-I43 HydrophobicContact CG2-CD1 4.2Å; T39-I43 WeakPolarHBondContact O-CG1 3.39Å; T39-I43 PolarHBondContact O-N 2.69Å
40	Y	74.9	Confident	67	Low	200 Å²	200	107.3 Å²	107.3	78%	0.784	54%	0.538	S	S	*	.	H	α-helix	trans	-62.1	-39.8	175.4	-69.2	-77.3	0	0	0	113	S38 I43 G44	S38-Y40 PolarHBondContact O-N 3.16Å; Y40-I43 PolarHBondContact O-N 3.27Å; Y40-G44 PolarHBondContact O-N 2.94Å
41	Q	74.5	Confident	68.5	Low	103 Å²	103	103.6 Å²	103.6	48%	0.481	52%	0.524	S	S	.	.	H	α-helix	trans	-69.5	-35.1	175.8	-69.7	174.4	2.3	0	0	111.6	P36 S38 T39 W45	P36-Q41 HydrophobicContact CB-CB 3.45Å; P36-Q41 VanDerWaalsContact CB-CB 3.45Å; S38-Q41 WeakPolarHBondContact O-CA 3.38Å; S38-Q41 WeakPolarHBondContact O-CB 3.31Å; S38-Q41 PolarHBondContact O-N 2.87Å; S38-Q41 WeakPolarHBondContact OG-CG 3.42Å; S38-Q41 PolarHBondContact OG-N 2.01Å; T39-Q41 PolarHBondContact O-N 3.49Å; Q41-W45 VanDerWaalsContact O-CB 3.25Å; Q41-W45 WeakPolarHBondContact O-CB 3.33Å; Q41-W45 PolarHBondContact O-N 3.16Å
42	C	76.1	Confident	69.8	Low	59 Å²	59	97.8 Å²	97.8	40%	0.399	51%	0.51	S	S	.	.	H	α-helix	trans	-64.6	-45.8	173.5	-66.9	0	0	0	0	111.8	P36 S38 T39 W45 F46	P36-C42 VanDerWaalsContact CG-SG 3.59Å; S38-C42 PolarHBondContact O-N 3.34Å; T39-C42 WeakPolarHBondContact O-CB 3.37Å; T39-C42 PolarHBondContact O-N 2.92Å; C42-W45 PolarHBondContact O-N 3.41Å; C42-F46 WeakPolarHBondContact O-CB 3.47Å; C42-F46 PolarHBondContact O-N 3.19Å
43	I	78	Confident	71.5	Confident	90 Å²	90	95 Å²	95	46%	0.462	49%	0.494	S	S	.	.	H	α-helix	trans	-62.3	-48.3	176.7	-67.2	166.3	0	0	0	110.1	T39 Y40 W45 F46 L47	T39-I43 HydrophobicContact CG2-CD1 4.2Å; T39-I43 WeakPolarHBondContact O-CG1 3.39Å; T39-I43 PolarHBondContact O-N 2.69Å; Y40-I43 PolarHBondContact O-N 3.27Å; I43-W45 VanDerWaalsContact C-N 3.33Å; I43-W45 PolarHBondContact O-N 3.09Å; I43-F46 PolarHBondContact O-N 3.47Å; I43-L47 HydrophobicContact CG2-CD1 3.92Å; I43-L47 HydrophobicContact CG2-CG 4.3Å; I43-L47 WeakPolarHBondContact O-CG 3.42Å; I43-L47 PolarHBondContact O-N 3.2Å
44	G	72	Confident	73	Confident	30 Å²	30	93.7 Å²	93.7	31%	0.309	48%	0.479	S	S	.	.	H	α-helix	trans	-58.2	-44.5	177.3	0	0	0	0	0	112.4	Y40 F46 L47 D48	Y40-G44 PolarHBondContact O-N 2.94Å; G44-F46 PolarHBondContact O-N 3.1Å; G44-L47 PolarHBondContact O-N 3.39Å; G44-D48 WeakPolarHBondContact O-CB 3.45Å; G44-D48 PolarHBondContact O-N 3.19Å
45	W	79.1	Confident	74	Confident	121 Å²	121	92.6 Å²	92.6	46%	0.458	47%	0.469	S	S	.	.	H	α-helix	trans	-62.5	-41.1	175.5	-178.9	92.9	0	0	0	112.6	I10 Q41 C42 I43 D48 F49	I10-W45 HydrophobicContact CD1-CH2 3.48Å; I10-W45 VanDerWaalsContact CD1-CH2 3.48Å; I10-W45 HydrophobicContact CD1-CZ2 3.8Å; Q41-W45 VanDerWaalsContact O-CB 3.25Å; Q41-W45 WeakPolarHBondContact O-CB 3.33Å; Q41-W45 PolarHBondContact O-N 3.16Å; C42-W45 PolarHBondContact O-N 3.41Å; I43-W45 VanDerWaalsContact C-N 3.33Å; I43-W45 PolarHBondContact O-N 3.09Å; W45-D48 PolarHBondContact O-N 3.21Å; W45-F49 WeakPolarHBondContact O-CB 3.44Å; W45-F49 PolarHBondContact O-N 3.34Å
46	F	78.1	Confident	75	Confident	112 Å²	112	90 Å²	90	49%	0.491	45%	0.45	S	S	.	.	H	α-helix	trans	-66.4	-42.9	177.8	-178.9	-104.5	0	0	0	111.7	C42 I43 G44 F49 I50	C42-F46 WeakPolarHBondContact O-CB 3.47Å; C42-F46 PolarHBondContact O-N 3.19Å; I43-F46 PolarHBondContact O-N 3.47Å; G44-F46 PolarHBondContact O-N 3.1Å; F46-F49 WeakPolarHBondContact O-CB 3.34Å; F46-F49 PolarHBondContact O-N 3.49Å; F46-I50 HydrophobicContact CD1-CG1 4.27Å; F46-I50 HydrophobicContact CE1-CD1 4.47Å; F46-I50 HydrophobicContact CE1-CG1 3.86Å; F46-I50 HydrophobicContact CE2-CD1 4.19Å; F46-I50 HydrophobicContact CE2-CG1 4.13Å; F46-I50 HydrophobicContact CZ-CD1 3.93Å; F46-I50 HydrophobicContact CZ-CG1 3.79Å; F46-I50 WeakPolarHBondContact O-CG1 3.3Å; F46-I50 PolarHBondContact O-N 3.22Å
47	L	74.6	Confident	76	Confident	105 Å²	105	92.4 Å²	92.4	55%	0.55	46%	0.456	S	S	.	.	H	α-helix	trans	-63	-43.2	175	-68.7	174.6	0	0	0	111.7	I43 G44 F49 I50 S51	I43-L47 HydrophobicContact CG2-CD1 3.92Å; I43-L47 HydrophobicContact CG2-CG 4.3Å; I43-L47 WeakPolarHBondContact O-CG 3.42Å; I43-L47 PolarHBondContact O-N 3.2Å; G44-L47 PolarHBondContact O-N 3.39Å; L47-F49 VanDerWaalsContact C-N 3.31Å; L47-F49 PolarHBondContact O-N 3.47Å; L47-I50 PolarHBondContact O-N 3.36Å; L47-S51 VanDerWaalsContact O-CB 3.28Å; L47-S51 WeakPolarHBondContact O-CB 3.3Å; L47-S51 PolarHBondContact O-N 3.41Å
48	D	73.2	Confident	76.2	Confident	92 Å²	92	86.7 Å²	86.7	49%	0.492	44%	0.44	S	S	.	.	H	α-helix	trans	-60.5	-41.2	174.2	-81.4	-6.4	0	0	0	111.4	G44 W45 T52	G44-D48 WeakPolarHBondContact O-CB 3.45Å; G44-D48 PolarHBondContact O-N 3.19Å; W45-D48 PolarHBondContact O-N 3.21Å; D48-T52 WeakPolarHBondContact O-CB 3.45Å; D48-T52 PolarHBondContact O-N 2.86Å; D48-T52 PolarHBondContact O-OG1 2.86Å
49	F	79.7	Confident	76	Confident	54 Å²	54	87.6 Å²	87.6	24%	0.237	44%	0.441	C	S	.	.	H	α-helix	trans	-64.3	-49.2	177.3	176.7	-103.4	0	0	0	112.1	I10 W45 F46 L47 S51 T52 I53	I10-F49 HydrophobicContact CD1-CD2 4.31Å; I10-F49 HydrophobicContact CD1-CE2 3.82Å; I10-F49 HydrophobicContact CD1-CZ 4.22Å; I10-F49 HydrophobicContact CG1-CE2 3.99Å; I10-F49 HydrophobicContact CG1-CZ 4.41Å; I10-F49 HydrophobicContact CG2-CE2 4.38Å; W45-F49 WeakPolarHBondContact O-CB 3.44Å; W45-F49 PolarHBondContact O-N 3.34Å; F46-F49 WeakPolarHBondContact O-CB 3.34Å; F46-F49 PolarHBondContact O-N 3.49Å; L47-F49 VanDerWaalsContact C-N 3.31Å; L47-F49 PolarHBondContact O-N 3.47Å; F49-S51 VanDerWaalsContact C-N 3.35Å; F49-S51 PolarHBondContact O-N 3.44Å; F49-T52 WeakPolarHBondContact O-CB 3.18Å; F49-T52 PolarHBondContact O-N 3.45Å; F49-I53 HydrophobicContact CD1-CD1 4Å; F49-I53 HydrophobicContact CE1-CD1 3.35Å; F49-I53 HydrophobicContact CE1-CG1 4.41Å; F49-I53 HydrophobicContact CE2-CD1 3.96Å; F49-I53 HydrophobicContact CE2-CG1 4.44Å; F49-I53 HydrophobicContact CZ-CD1 3.35Å; F49-I53 HydrophobicContact CZ-CG1 4.28Å; F49-I53 PolarHBondContact O-N 3.42Å
50	I	75.4	Confident	75.7	Confident	79 Å²	79	85 Å²	85	41%	0.405	42%	0.421	S	S	.	.	H	α-helix	trans	-61.9	-43.4	176.3	-66.2	-63.4	0	0	0	110.8	F46 L47 T52 I53 Y54	F46-I50 HydrophobicContact CD1-CG1 4.27Å; F46-I50 HydrophobicContact CE1-CD1 4.47Å; F46-I50 HydrophobicContact CE1-CG1 3.86Å; F46-I50 HydrophobicContact CE2-CD1 4.19Å; F46-I50 HydrophobicContact CE2-CG1 4.13Å; F46-I50 HydrophobicContact CZ-CD1 3.93Å; F46-I50 HydrophobicContact CZ-CG1 3.79Å; F46-I50 WeakPolarHBondContact O-CG1 3.3Å; F46-I50 PolarHBondContact O-N 3.22Å; L47-I50 PolarHBondContact O-N 3.36Å; I50-T52 VanDerWaalsContact C-N 3.31Å; I50-T52 PolarHBondContact O-N 2.88Å; I50-I53 PolarHBondContact O-N 3.07Å; I50-Y54 WeakPolarHBondContact O-CB 3.33Å; I50-Y54 PolarHBondContact O-N 2.94Å
51	S	71.4	Confident	75.7	Confident	66 Å²	66	78 Å²	78	46%	0.462	40%	0.4	S	S	.	.	H	α-helix	trans	-59.4	-43.1	175.1	-175.1	0	0	0	0	111.3	L47 F49 Y54 T55	L47-S51 VanDerWaalsContact O-CB 3.28Å; L47-S51 WeakPolarHBondContact O-CB 3.3Å; L47-S51 PolarHBondContact O-N 3.41Å; F49-S51 VanDerWaalsContact C-N 3.35Å; F49-S51 PolarHBondContact O-N 3.44Å; S51-Y54 PolarHBondContact O-N 3.44Å; S51-T55 WeakPolarHBondContact O-CB 3.07Å; S51-T55 PolarHBondContact O-N 3.49Å; S51-T55 PolarHBondContact O-OG1 3.16Å
52	T	77.4	Confident	75.7	Confident	71 Å²	71	77.1 Å²	77.1	44%	0.436	40%	0.398	S	S	.	.	H	α-helix	trans	-64.2	-45.6	178.8	-58.4	0	0	0	0	111.2	D48 F49 I50 T55 I56	D48-T52 WeakPolarHBondContact O-CB 3.45Å; D48-T52 PolarHBondContact O-N 2.86Å; D48-T52 PolarHBondContact O-OG1 2.86Å; F49-T52 WeakPolarHBondContact O-CB 3.18Å; F49-T52 PolarHBondContact O-N 3.45Å; I50-T52 VanDerWaalsContact C-N 3.31Å; I50-T52 PolarHBondContact O-N 2.88Å; T52-T55 PolarHBondContact O-N 3.4Å; T52-I56 HydrophobicContact CG2-CD1 3.68Å; T52-I56 HydrophobicContact CG2-CG1 4.45Å; T52-I56 WeakPolarHBondContact O-CB 3.12Å; T52-I56 VanDerWaalsContact O-CG1 3.3Å; T52-I56 WeakPolarHBondContact O-CG1 3.31Å; T52-I56 PolarHBondContact O-N 2.97Å
53	I	78	Confident	75.6	Confident	60 Å²	60	77.7 Å²	77.7	31%	0.308	40%	0.397	S	S	.	.	H	α-helix	trans	-59.7	-48.5	175.3	-73.9	-177.9	0	0	0	110.4	F49 I50 T55 I56 F57	F49-I53 HydrophobicContact CD1-CD1 4Å; F49-I53 HydrophobicContact CE1-CD1 3.35Å; F49-I53 HydrophobicContact CE1-CG1 4.41Å; F49-I53 HydrophobicContact CE2-CD1 3.96Å; F49-I53 HydrophobicContact CE2-CG1 4.44Å; F49-I53 HydrophobicContact CZ-CD1 3.35Å; F49-I53 HydrophobicContact CZ-CG1 4.28Å; F49-I53 PolarHBondContact O-N 3.42Å; I50-I53 PolarHBondContact O-N 3.07Å; I53-T55 VanDerWaalsContact C-N 3.34Å; I53-T55 PolarHBondContact O-N 2.91Å; I53-I56 PolarHBondContact O-N 2.96Å; I53-F57 HydrophobicContact CB-CD2 4.31Å; I53-F57 HydrophobicContact CG2-CD2 3.83Å; I53-F57 HydrophobicContact CG2-CE2 4.49Å; I53-F57 WeakPolarHBondContact O-CB 3.31Å; I53-F57 WeakPolarHBondContact O-CD2 3.24Å; I53-F57 PolarHBondContact O-N 3.39Å
54	Y	75.5	Confident	75.5	Confident	128 Å²	128	76.6 Å²	76.6	50%	0.502	39%	0.392	S	S	.	.	H	α-helix	trans	-60.1	-44.3	179.1	177.6	-95.6	0	0	0	111.8	I50 S51 M58 L59	I50-Y54 WeakPolarHBondContact O-CB 3.33Å; I50-Y54 PolarHBondContact O-N 2.94Å; S51-Y54 PolarHBondContact O-N 3.44Å; Y54-M58 HydrophobicContact CD2-CB 3.93Å; Y54-M58 HydrophobicContact CD2-CG 4.13Å; Y54-M58 HydrophobicContact CE2-CB 3.94Å; Y54-M58 HydrophobicContact CE2-CG 4.39Å; Y54-M58 WeakPolarHBondContact O-CA 3.39Å; Y54-M58 VanDerWaalsContact O-CB 3.3Å; Y54-M58 WeakPolarHBondContact O-CB 3.34Å; Y54-M58 PolarHBondContact O-N 3.38Å; Y54-L59 HydrophobicContact CD1-CB 4.38Å; Y54-L59 HydrophobicContact CE1-CB 4.02Å; Y54-L59 HydrophobicContact CE1-CD2 4.49Å; Y54-L59 PolarHBondContact O-N 2.6Å
55	T	73.2	Confident	75.7	Confident	56 Å²	56	79.1 Å²	79.1	34%	0.344	40%	0.404	S	S	.	.	I	π-helix	trans	-61.3	-47.7	178.2	-59.4	0	0	0	0	111.6	S51 T52 I53 L59 E60	S51-T55 WeakPolarHBondContact O-CB 3.07Å; S51-T55 PolarHBondContact O-N 3.49Å; S51-T55 PolarHBondContact O-OG1 3.16Å; T52-T55 PolarHBondContact O-N 3.4Å; I53-T55 VanDerWaalsContact C-N 3.34Å; I53-T55 PolarHBondContact O-N 2.91Å; T55-L59 PolarHBondContact O-N 2.77Å; T55-E60 VanDerWaalsContact O-CB 3.25Å; T55-E60 WeakPolarHBondContact O-CB 3.46Å; T55-E60 PolarHBondContact O-N 3.1Å
56	I	76.3	Confident	75.4	Confident	36 Å²	36	78.9 Å²	78.9	19%	0.185	41%	0.406	C	S	.	.	I	π-helix	trans	-73.7	-45	-174.4	-67.9	174.2	0	0	0	112.2	L17 T52 I53 P61	L17-I56 HydrophobicContact CD1-CD1 4.02Å; L17-I56 HydrophobicContact CD2-CD1 4.49Å; L17-I56 HydrophobicContact CD2-CG2 3.78Å; T52-I56 HydrophobicContact CG2-CD1 3.68Å; T52-I56 HydrophobicContact CG2-CG1 4.45Å; T52-I56 WeakPolarHBondContact O-CB 3.12Å; T52-I56 VanDerWaalsContact O-CG1 3.3Å; T52-I56 WeakPolarHBondContact O-CG1 3.31Å; T52-I56 PolarHBondContact O-N 2.97Å; I53-I56 PolarHBondContact O-N 2.96Å; I56-P61 WeakPolarHBondContact O-CD 3.2Å; I56-P61 WeakPolarHBondContact O-CG 3.42Å
57	F	78.5	Confident	75.3	Confident	101 Å²	101	74.2 Å²	74.2	44%	0.443	39%	0.387	S	S	.	.	I	π-helix	trans	-94.6	-20.6	-170.3	-68.2	-75.7	0	0	0	113.7	L17 I53	L17-F57 HydrophobicContact CD2-CZ 4.49Å; I53-F57 HydrophobicContact CB-CD2 4.31Å; I53-F57 HydrophobicContact CG2-CD2 3.83Å; I53-F57 HydrophobicContact CG2-CE2 4.49Å; I53-F57 WeakPolarHBondContact O-CB 3.31Å; I53-F57 WeakPolarHBondContact O-CD2 3.24Å; I53-F57 PolarHBondContact O-N 3.39Å
58	M	74.9	Confident	75.4	Confident	105 Å²	105	75.7 Å²	75.7	52%	0.517	40%	0.395	S	S	.	.	I	π-helix	trans	-116.9	-63.7	-178.1	-59.9	-66.9	167.3	0	0	111.4	Y54 I62	Y54-M58 HydrophobicContact CD2-CB 3.93Å; Y54-M58 HydrophobicContact CD2-CG 4.13Å; Y54-M58 HydrophobicContact CE2-CB 3.94Å; Y54-M58 HydrophobicContact CE2-CG 4.39Å; Y54-M58 WeakPolarHBondContact O-CA 3.39Å; Y54-M58 VanDerWaalsContact O-CB 3.3Å; Y54-M58 WeakPolarHBondContact O-CB 3.34Å; Y54-M58 PolarHBondContact O-N 3.38Å; M58-I62 WeakPolarHBondContact O-CB 3.42Å; M58-I62 VanDerWaalsContact O-CD1 3.28Å; M58-I62 WeakPolarHBondContact O-CD1 3.45Å; M58-I62 WeakPolarHBondContact O-CG1 3.44Å; M58-I62 PolarHBondContact O-N 3.37Å
59	L	74.3	Confident	75.5	Confident	66 Å²	66	81.1 Å²	81.1	35%	0.346	41%	0.41	S	S	.	.	I	π-helix	trans	-66.7	-49.1	-167.9	-172.6	62.8	0	0	0	112.5	Y54 T55 I62 L63	Y54-L59 HydrophobicContact CD1-CB 4.38Å; Y54-L59 HydrophobicContact CE1-CB 4.02Å; Y54-L59 HydrophobicContact CE1-CD2 4.49Å; Y54-L59 PolarHBondContact O-N 2.6Å; T55-L59 PolarHBondContact O-N 2.77Å; L59-I62 PolarHBondContact O-N 3.01Å; L59-L63 HydrophobicContact CD1-CD1 4.13Å; L59-L63 HydrophobicContact CD1-CG 4.32Å; L59-L63 HydrophobicContact CG-CD1 3.89Å; L59-L63 HydrophobicContact CG-CG 4.44Å; L59-L63 WeakPolarHBondContact O-CB 3.19Å; L59-L63 VanDerWaalsContact O-CG 3.24Å; L59-L63 WeakPolarHBondContact O-CG 3.17Å; L59-L63 PolarHBondContact O-N 3.2Å
60	E	74.6	Confident	75.4	Confident	50 Å²	50	81 Å²	81	23%	0.234	41%	0.412	C	S	.	.	H	α-helix	trans	-66.1	-46.7	-176.8	177.6	168.7	-158.6	0	0	113	V24 T55 I62 L63 N64	V24-E60 VanDerWaalsContact CG2-OE1 3.3Å; V24-E60 WeakPolarHBondContact CG2-OE1 3.47Å; T55-E60 VanDerWaalsContact O-CB 3.25Å; T55-E60 WeakPolarHBondContact O-CB 3.46Å; T55-E60 PolarHBondContact O-N 3.1Å; E60-I62 VanDerWaalsContact C-N 3.34Å; E60-I62 PolarHBondContact O-N 3.27Å; E60-L63 PolarHBondContact O-N 3.45Å; E60-N64 WeakPolarHBondContact CG-ND2 3.11Å; E60-N64 VanDerWaalsContact O-CB 3.31Å; E60-N64 WeakPolarHBondContact O-CB 3.14Å; E60-N64 VanDerWaalsContact O-CG 3.27Å; E60-N64 PolarHBondContact O-N 3.37Å; E60-N64 PolarHBondContact O-ND2 3.13Å
61	P	75.2	Confident	75.5	Confident	54 Å²	54	80 Å²	80	35%	0.351	42%	0.422	S	S	.	.	H	α-helix	trans	-57.6	-44.4	173.5	-27.7	36.1	0	0	0	112.6	I56 L63 N64 C65	I56-P61 WeakPolarHBondContact O-CD 3.2Å; I56-P61 WeakPolarHBondContact O-CG 3.42Å; P61-L63 PolarHBondContact O-N 3.44Å; P61-N64 PolarHBondContact O-N 3.23Å; P61-C65 WeakPolarHBondContact O-CB 3.27Å; P61-C65 PolarHBondContact O-N 3.45Å; P61-C65 PolarHBondContact O-SG 3.06Å
62	I	75.1	Confident	75.7	Confident	84 Å²	84	78 Å²	78	43%	0.431	41%	0.411	S	S	.	.	H	α-helix	trans	-60.8	-48.7	178.2	-70.7	169.7	0	0	0	110.5	M58 L59 E60 N64 C65 F66	M58-I62 WeakPolarHBondContact O-CB 3.42Å; M58-I62 VanDerWaalsContact O-CD1 3.28Å; M58-I62 WeakPolarHBondContact O-CD1 3.45Å; M58-I62 WeakPolarHBondContact O-CG1 3.44Å; M58-I62 PolarHBondContact O-N 3.37Å; L59-I62 PolarHBondContact O-N 3.01Å; E60-I62 VanDerWaalsContact C-N 3.34Å; E60-I62 PolarHBondContact O-N 3.27Å; I62-N64 VanDerWaalsContact C-N 3.32Å; I62-N64 PolarHBondContact O-N 2.93Å; I62-C65 PolarHBondContact O-N 2.9Å; I62-F66 HydrophobicContact CG2-CD2 3.61Å; I62-F66 HydrophobicContact CG2-CE2 3.46Å; I62-F66 VanDerWaalsContact CG2-CE2 3.46Å; I62-F66 WeakPolarHBondContact O-CD2 3.36Å; I62-F66 PolarHBondContact O-N 3.34Å
63	L	73.5	Confident	75.7	Confident	71 Å²	71	82.7 Å²	82.7	37%	0.372	42%	0.421	S	S	.	.	H	α-helix	trans	-63.5	-38.1	178	-70.5	174.7	0	0	0	112.3	L59 E60 P61 S67 F76	L59-L63 HydrophobicContact CD1-CD1 4.13Å; L59-L63 HydrophobicContact CD1-CG 4.32Å; L59-L63 HydrophobicContact CG-CD1 3.89Å; L59-L63 HydrophobicContact CG-CG 4.44Å; L59-L63 WeakPolarHBondContact O-CB 3.19Å; L59-L63 VanDerWaalsContact O-CG 3.24Å; L59-L63 WeakPolarHBondContact O-CG 3.17Å; L59-L63 PolarHBondContact O-N 3.2Å; E60-L63 PolarHBondContact O-N 3.45Å; P61-L63 PolarHBondContact O-N 3.44Å; L63-S67 WeakPolarHBondContact O-CB 3.45Å; L63-S67 PolarHBondContact O-N 3.44Å; L63-F76 HydrophobicContact CD2-CE1 4.4Å; L63-F76 HydrophobicContact CD2-CE2 4.31Å; L63-F76 HydrophobicContact CD2-CZ 3.77Å
64	N	75.3	Confident	75.5	Confident	68 Å²	68	86.4 Å²	86.4	36%	0.364	43%	0.434	S	S	.	.	H	α-helix	trans	-68.5	-42	176.7	-76	-24.6	0	0	0	111.4	E60 P61 I62 S67 L68	E60-N64 WeakPolarHBondContact CG-ND2 3.11Å; E60-N64 VanDerWaalsContact O-CB 3.31Å; E60-N64 WeakPolarHBondContact O-CB 3.14Å; E60-N64 VanDerWaalsContact O-CG 3.27Å; E60-N64 PolarHBondContact O-N 3.37Å; E60-N64 PolarHBondContact O-ND2 3.13Å; P61-N64 PolarHBondContact O-N 3.23Å; I62-N64 VanDerWaalsContact C-N 3.32Å; I62-N64 PolarHBondContact O-N 2.93Å; N64-S67 PolarHBondContact O-N 2.79Å; N64-L68 VanDerWaalsContact O-CB 3.29Å; N64-L68 WeakPolarHBondContact O-CB 3.47Å; N64-L68 WeakPolarHBondContact O-CG 3.4Å; N64-L68 PolarHBondContact O-N 2.78Å
65	C	76.3	Confident	75.8	Confident	83 Å²	83	82.8 Å²	82.8	56%	0.561	42%	0.424	S	S	*	.	H	α-helix	trans	-60.7	-48	173.5	-73.3	0	0	0	0	111.4	P61 I62 L68 Y69	P61-C65 WeakPolarHBondContact O-CB 3.27Å; P61-C65 PolarHBondContact O-N 3.45Å; P61-C65 PolarHBondContact O-SG 3.06Å; I62-C65 PolarHBondContact O-N 2.9Å; C65-L68 PolarHBondContact O-N 3.15Å; C65-Y69 VanDerWaalsContact O-CB 3.26Å; C65-Y69 WeakPolarHBondContact O-CB 3.33Å; C65-Y69 PolarHBondContact O-N 3.5Å
66	F	73.9	Confident	76.4	Confident	116 Å²	116	82.3 Å²	82.3	51%	0.509	42%	0.417	S	S	.	.	H	α-helix	trans	-61.9	-45.1	175.3	-80.6	-62.7	0	0	0	111.9	I62 L68 Y69 L70 F76	I62-F66 HydrophobicContact CG2-CD2 3.61Å; I62-F66 HydrophobicContact CG2-CE2 3.46Å; I62-F66 VanDerWaalsContact CG2-CE2 3.46Å; I62-F66 WeakPolarHBondContact O-CD2 3.36Å; I62-F66 PolarHBondContact O-N 3.34Å; F66-L68 PolarHBondContact O-N 2.92Å; F66-Y69 PolarHBondContact O-N 3.11Å; F66-L70 VanDerWaalsContact O-CB 3.28Å; F66-L70 WeakPolarHBondContact O-CB 3.24Å; F66-L70 WeakPolarHBondContact O-CD1 3.34Å; F66-L70 WeakPolarHBondContact O-CG 3.44Å; F66-L70 PolarHBondContact O-N 3.37Å; F66-F76 HydrophobicContact CB-CD2 4.38Å; F66-F76 HydrophobicContact CB-CE2 4.45Å
67	S	74.9	Confident	76.9	Confident	13 Å²	13	80.7 Å²	80.7	9%	0.091	41%	0.409	C	S	.	.	H	α-helix	trans	-58.7	-47.8	175.7	169.6	0	0	0	0	110.7	L63 N64 L70 G71 G72 R73	L63-S67 WeakPolarHBondContact O-CB 3.45Å; L63-S67 PolarHBondContact O-N 3.44Å; N64-S67 PolarHBondContact O-N 2.79Å; S67-L70 PolarHBondContact O-N 3.39Å; S67-G71 PolarHBondContact O-N 3.36Å; S67-G71 VanDerWaalsContact O-N 3.1Å; S67-G72 VanDerWaalsContact O-CA 3.31Å; S67-G72 WeakPolarHBondContact O-CA 3.25Å; S67-G72 PolarHBondContact O-N 3.02Å; S67-G72 WeakPolarHBondContact OG-CA 3.37Å; S67-R73 PolarHBondContact OG-N 2.93Å
68	L	76	Confident	77.4	Confident	136 Å²	136	83.8 Å²	83.8	71%	0.712	42%	0.418	S	S	*	.	H	α-helix	trans	-63.4	-47.4	179.1	-75.7	165.9	0	0	0	111.8	N64 C65 F66 L70 G71	N64-L68 VanDerWaalsContact O-CB 3.29Å; N64-L68 WeakPolarHBondContact O-CB 3.47Å; N64-L68 WeakPolarHBondContact O-CG 3.4Å; N64-L68 PolarHBondContact O-N 2.78Å; C65-L68 PolarHBondContact O-N 3.15Å; F66-L68 PolarHBondContact O-N 2.92Å; L68-L70 PolarHBondContact O-N 3Å; L68-G71 PolarHBondContact O-N 3.34Å
69	Y	75.3	Confident	78.1	Confident	206 Å²	206	81.8 Å²	81.8	81%	0.808	41%	0.412	S	S	*	.	H	α-helix	trans	-59.7	-36.9	178.2	-175	-97.8	0	0	0	112.1	C65 F66 G71	C65-Y69 VanDerWaalsContact O-CB 3.26Å; C65-Y69 WeakPolarHBondContact O-CB 3.33Å; C65-Y69 PolarHBondContact O-N 3.5Å; F66-Y69 PolarHBondContact O-N 3.11Å; Y69-G71 VanDerWaalsContact C-N 3.33Å
70	L	77.6	Confident	78.9	Confident	52 Å²	52	79.6 Å²	79.6	27%	0.272	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-1.8	177.2	-63.5	169.6	0	0	0	113.4	F66 S67 L68 N75 F76 T79	F66-L70 VanDerWaalsContact O-CB 3.28Å; F66-L70 WeakPolarHBondContact O-CB 3.24Å; F66-L70 WeakPolarHBondContact O-CD1 3.34Å; F66-L70 WeakPolarHBondContact O-CG 3.44Å; F66-L70 PolarHBondContact O-N 3.37Å; S67-L70 PolarHBondContact O-N 3.39Å; L68-L70 PolarHBondContact O-N 3Å; L70-N75 HydrophobicContact CB-CB 4.24Å; L70-N75 WeakPolarHBondContact O-CB 3.36Å; L70-N75 PolarHBondContact O-ND2 3.35Å; L70-F76 HydrophobicContact CD1-CD2 4.15Å; L70-T79 HydrophobicContact CD1-CG2 4.17Å
71	G	77.9	Confident	79.8	Confident	59 Å²	59	78.3 Å²	78.3	61%	0.608	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.9	25.5	179.6	0	0	0	0	0	115.5	S67 L68 Y69 N75	S67-G71 PolarHBondContact O-N 3.36Å; S67-G71 VanDerWaalsContact O-N 3.1Å; L68-G71 PolarHBondContact O-N 3.34Å; Y69-G71 VanDerWaalsContact C-N 3.33Å; G71-N75 PolarHBondContact O-ND2 3.45Å
72	G	76.4	Confident	80.6	Confident	23 Å²	23	78.1 Å²	78.1	24%	0.237	40%	0.398	C	S	.	.	S	Bend	trans	120.1	170	168.3	0	0	0	0	0	115	S67 K74 N75 F76	S67-G72 VanDerWaalsContact O-CA 3.31Å; S67-G72 WeakPolarHBondContact O-CA 3.25Å; S67-G72 PolarHBondContact O-N 3.02Å; S67-G72 WeakPolarHBondContact OG-CA 3.37Å; G72-K74 PolarHBondContact O-N 2.97Å; G72-K74 VanDerWaalsContact O-N 3.11Å; G72-N75 PolarHBondContact O-N 3.03Å; G72-F76 PolarHBondContact O-N 2.79Å
73	R	76.3	Confident	81.4	Confident	170 Å²	170	78.5 Å²	78.5	64%	0.642	40%	0.4	S	S	*	.	H	α-helix	trans	-56.8	-30.3	-176.6	-74.1	-171.4	-91.5	-174.3	-11.1	114.1	S67 G77	S67-R73 PolarHBondContact OG-N 2.93Å; R73-G77 PolarHBondContact O-N 3.39Å
74	K	74.7	Confident	82.4	Confident	137 Å²	137	76.3 Å²	76.3	60%	0.596	39%	0.39	S	S	*	.	H	α-helix	trans	-67.6	-41.3	175.6	-71.8	-174	177.4	-179.2	0	112	G72 G77 R78	G72-K74 PolarHBondContact O-N 2.97Å; G72-K74 VanDerWaalsContact O-N 3.11Å; K74-G77 PolarHBondContact O-N 3.19Å; K74-R78 WeakPolarHBondContact O-CG 3.49Å; K74-R78 PolarHBondContact O-N 2.71Å; K74-R78 VanDerWaalsContact O-N 3.17Å
75	N	81.2	Confident	83.3	Confident	53 Å²	53	75.5 Å²	75.5	28%	0.283	39%	0.385	S	S	.	.	H	α-helix	trans	-74.6	-30.7	178.2	-69.2	-15.9	0	0	0	111.8	L70 G71 G72 R78 T79	L70-N75 HydrophobicContact CB-CB 4.24Å; L70-N75 WeakPolarHBondContact O-CB 3.36Å; L70-N75 PolarHBondContact O-ND2 3.35Å; G71-N75 PolarHBondContact O-ND2 3.45Å; G72-N75 PolarHBondContact O-N 3.03Å; N75-R78 PolarHBondContact O-N 3.01Å; N75-R78 PolarHBondContact OD1-NH1 3.49Å; N75-T79 PolarHBondContact O-N 3.36Å; N75-T79 PolarHBondContact O-OG1 3.44Å
76	F	85.9	Confident	84	Confident	45 Å²	45	76.1 Å²	76.1	20%	0.197	39%	0.386	C	S	.	.	H	α-helix	trans	-55.8	-50.4	168	177.4	-107.6	0	0	0	111.4	L63 F66 L70 G72 R78 T79 L80 P203	L63-F76 HydrophobicContact CD2-CE1 4.4Å; L63-F76 HydrophobicContact CD2-CE2 4.31Å; L63-F76 HydrophobicContact CD2-CZ 3.77Å; F66-F76 HydrophobicContact CB-CD2 4.38Å; F66-F76 HydrophobicContact CB-CE2 4.45Å; L70-F76 HydrophobicContact CD1-CD2 4.15Å; G72-F76 PolarHBondContact O-N 2.79Å; F76-R78 PolarHBondContact O-N 2.88Å; F76-T79 WeakPolarHBondContact O-CB 3.23Å; F76-T79 PolarHBondContact O-N 2.93Å; F76-L80 HydrophobicContact CD1-CD1 4.13Å; F76-L80 HydrophobicContact CE1-CD1 3.55Å; F76-L80 HydrophobicContact CE1-CG 4.33Å; F76-L80 HydrophobicContact CE2-CD1 4.49Å; F76-L80 HydrophobicContact CE2-CG 4.49Å; F76-L80 HydrophobicContact CZ-CD1 3.76Å; F76-L80 HydrophobicContact CZ-CD2 4.33Å; F76-L80 HydrophobicContact CZ-CG 4.21Å; F76-L80 PolarHBondContact O-N 2.88Å; F76-L80 VanDerWaalsContact O-N 3.07Å; F76-P203 HydrophobicContact CD1-CB 4.44Å; F76-P203 HydrophobicContact CE1-CB 4.11Å
77	G	88	Confident	85	Confident	2 Å²	2	72.5 Å²	72.5	2%	0.021	37%	0.37	C	S	.	.	H	α-helix	trans	-60	-42.1	176.3	0	0	0	0	0	113.6	R73 K74 T79 L80 I81 P203	R73-G77 PolarHBondContact O-N 3.39Å; K74-G77 PolarHBondContact O-N 3.19Å; G77-T79 VanDerWaalsContact C-N 3.3Å; G77-T79 PolarHBondContact O-N 3.29Å; G77-L80 PolarHBondContact O-N 3.41Å; G77-I81 WeakPolarHBondContact O-CG1 3.46Å; G77-I81 PolarHBondContact O-N 3.11Å; G77-P203 VanDerWaalsContact CA-O 3.27Å; G77-P203 WeakPolarHBondContact CA-O 3.49Å
78	R	88.9	Confident	85.9	Confident	166 Å²	166	72.8 Å²	72.8	63%	0.626	37%	0.37	S	S	*	.	H	α-helix	trans	-61.2	-37.6	175.6	-70.6	173.1	175	173.5	-8.2	112.8	K74 N75 F76 I81 A82	K74-R78 WeakPolarHBondContact O-CG 3.49Å; K74-R78 PolarHBondContact O-N 2.71Å; K74-R78 VanDerWaalsContact O-N 3.17Å; N75-R78 PolarHBondContact O-N 3.01Å; N75-R78 PolarHBondContact OD1-NH1 3.49Å; F76-R78 PolarHBondContact O-N 2.88Å; R78-I81 PolarHBondContact O-N 3.43Å; R78-A82 PolarHBondContact O-N 2.81Å
79	T	88.1	Confident	86.8	Confident	64 Å²	64	69.3 Å²	69.3	39%	0.393	36%	0.356	S	S	.	.	H	α-helix	trans	-66.1	-40.8	176.4	-55.6	0	0	0	0	111	L70 N75 F76 G77 A82 L83	L70-T79 HydrophobicContact CD1-CG2 4.17Å; N75-T79 PolarHBondContact O-N 3.36Å; N75-T79 PolarHBondContact O-OG1 3.44Å; F76-T79 WeakPolarHBondContact O-CB 3.23Å; F76-T79 PolarHBondContact O-N 2.93Å; G77-T79 VanDerWaalsContact C-N 3.3Å; G77-T79 PolarHBondContact O-N 3.29Å; T79-A82 PolarHBondContact O-N 3.04Å; T79-L83 PolarHBondContact O-N 2.98Å
80	L	91.3	Very high	87.5	Confident	20 Å²	20	61.2 Å²	61.2	11%	0.105	33%	0.327	C	S	.	.	H	α-helix	trans	-64.1	-39.7	174.5	-66.5	176.8	0	0	0	112.3	F76 G77 L83 V84 P203 W204	F76-L80 HydrophobicContact CD1-CD1 4.13Å; F76-L80 HydrophobicContact CE1-CD1 3.55Å; F76-L80 HydrophobicContact CE1-CG 4.33Å; F76-L80 HydrophobicContact CE2-CD1 4.49Å; F76-L80 HydrophobicContact CE2-CG 4.49Å; F76-L80 HydrophobicContact CZ-CD1 3.76Å; F76-L80 HydrophobicContact CZ-CD2 4.33Å; F76-L80 HydrophobicContact CZ-CG 4.21Å; F76-L80 PolarHBondContact O-N 2.88Å; F76-L80 VanDerWaalsContact O-N 3.07Å; G77-L80 PolarHBondContact O-N 3.41Å; L80-L83 WeakPolarHBondContact O-CB 3.26Å; L80-L83 PolarHBondContact O-N 3.36Å; L80-V84 WeakPolarHBondContact O-CG2 3.42Å; L80-V84 PolarHBondContact O-N 3.36Å; L80-P203 HydrophobicContact CD1-CB 3.73Å; L80-W204 HydrophobicContact CB-CE3 3.93Å; L80-W204 HydrophobicContact CB-CZ3 4.31Å; L80-W204 HydrophobicContact CD1-CD2 4.14Å; L80-W204 HydrophobicContact CD1-CE3 4.24Å; L80-W204 HydrophobicContact CD2-CE3 4.07Å; L80-W204 HydrophobicContact CD2-CH2 3.9Å; L80-W204 HydrophobicContact CD2-CZ2 4.48Å; L80-W204 HydrophobicContact CD2-CZ3 3.67Å; L80-W204 HydrophobicContact CG-CE3 4.3Å; L80-W204 HydrophobicContact CG-CZ3 4.4Å
81	I	93.8	Very high	88.3	Confident	23 Å²	23	60.3 Å²	60.3	12%	0.118	32%	0.322	C	S	.	.	H	α-helix	trans	-61.2	-47.4	173.8	-65.3	162.8	0	0	0	110.7	G77 R78 L83 V84 L85 Y148 V152 A206	G77-I81 WeakPolarHBondContact O-CG1 3.46Å; G77-I81 PolarHBondContact O-N 3.11Å; R78-I81 PolarHBondContact O-N 3.43Å; I81-L83 VanDerWaalsContact C-N 3.27Å; I81-L83 PolarHBondContact O-N 3.14Å; I81-V84 PolarHBondContact O-N 3.11Å; I81-L85 HydrophobicContact CG2-CD1 3.85Å; I81-L85 HydrophobicContact CG2-CG 4.18Å; I81-L85 WeakPolarHBondContact O-CG 3.42Å; I81-L85 PolarHBondContact O-N 2.88Å; I81-Y148 WeakPolarHBondContact CA-OH 3.43Å; I81-V152 HydrophobicContact CD1-CG1 3.79Å; I81-V152 HydrophobicContact CD1-CG2 4.36Å; I81-V152 HydrophobicContact CG1-CG2 4.32Å; I81-A206 HydrophobicContact CD1-CB 3.47Å; I81-A206 VanDerWaalsContact CD1-CB 3.47Å; I81-A206 HydrophobicContact CG1-CB 4.42Å
82	A	92.1	Very high	89.1	Confident	50 Å²	50	59.7 Å²	59.7	41%	0.413	31%	0.305	S	S	.	.	H	α-helix	trans	-59.1	-40.2	177.9	0	0	0	0	0	111.6	R78 T79 T86	R78-A82 PolarHBondContact O-N 2.81Å; T79-A82 PolarHBondContact O-N 3.04Å; A82-T86 VanDerWaalsContact O-CB 3.27Å; A82-T86 WeakPolarHBondContact O-CB 3.27Å; A82-T86 PolarHBondContact O-N 2.77Å; A82-T86 PolarHBondContact O-OG1 3.3Å
83	L	91.3	Very high	89.9	Confident	92 Å²	92	61.5 Å²	61.5	48%	0.482	31%	0.313	S	S	.	.	H	α-helix	trans	-62	-48.1	175.3	179	64.4	0	0	0	111.8	T79 L80 I81 T86 Y87	T79-L83 PolarHBondContact O-N 2.98Å; L80-L83 WeakPolarHBondContact O-CB 3.26Å; L80-L83 PolarHBondContact O-N 3.36Å; I81-L83 VanDerWaalsContact C-N 3.27Å; I81-L83 PolarHBondContact O-N 3.14Å; L83-T86 PolarHBondContact O-N 3.15Å; L83-Y87 WeakPolarHBondContact O-CB 3.46Å; L83-Y87 PolarHBondContact O-N 2.93Å
84	V	94.6	Very high	90.7	Very high	25 Å²	25	53.4 Å²	53.4	15%	0.152	28%	0.282	C	S	.	.	H	α-helix	trans	-61.6	-47.8	178.1	173.3	0	0	0	0	110.8	L80 I81 T86 Y87 L88 Y148 W204	L80-V84 WeakPolarHBondContact O-CG2 3.42Å; L80-V84 PolarHBondContact O-N 3.36Å; I81-V84 PolarHBondContact O-N 3.11Å; V84-T86 PolarHBondContact O-N 3.32Å; V84-Y87 WeakPolarHBondContact O-CB 3.43Å; V84-Y87 PolarHBondContact O-N 2.97Å; V84-L88 HydrophobicContact CG1-CD1 4.08Å; V84-L88 HydrophobicContact CG1-CG 4.35Å; V84-L88 WeakPolarHBondContact O-CG 3.38Å; V84-L88 PolarHBondContact O-N 3.04Å; V84-Y148 HydrophobicContact CB-CE1 4.1Å; V84-Y148 WeakPolarHBondContact CB-OH 3.2Å; V84-Y148 HydrophobicContact CG1-CD1 4.15Å; V84-Y148 HydrophobicContact CG1-CE1 3.55Å; V84-Y148 HydrophobicContact CG1-CE2 4.04Å; V84-Y148 VanDerWaalsContact CG1-CZ 3.5Å; V84-W204 HydrophobicContact CG2-CE3 3.94Å; V84-W204 HydrophobicContact CG2-CZ3 4.32Å
85	L	94.7	Very high	91.6	Very high	51 Å²	51	48 Å²	48	27%	0.267	26%	0.26	S	S	.	.	H	α-helix	trans	-64.6	-40.5	179.6	-66.9	179.1	0	0	0	112.2	I81 Y87 L88 C89 Y145 Y148 L149	I81-L85 HydrophobicContact CG2-CD1 3.85Å; I81-L85 HydrophobicContact CG2-CG 4.18Å; I81-L85 WeakPolarHBondContact O-CG 3.42Å; I81-L85 PolarHBondContact O-N 2.88Å; L85-Y87 VanDerWaalsContact C-N 3.3Å; L85-Y87 PolarHBondContact O-N 3.34Å; L85-L88 HydrophobicContact CD2-CD1 4.48Å; L85-L88 PolarHBondContact O-N 3.39Å; L85-C89 WeakPolarHBondContact O-CB 3.32Å; L85-C89 PolarHBondContact O-N 2.87Å; L85-C89 PolarHBondContact O-SG 3.45Å; L85-Y145 HydrophobicContact CD2-CE1 4.5Å; L85-Y148 HydrophobicContact CD2-CD1 4.12Å; L85-Y148 HydrophobicContact CD2-CE1 3.93Å; L85-Y148 HydrophobicContact CG-CE1 4.31Å; L85-L149 HydrophobicContact CD2-CD2 4.04Å
86	T	91.1	Very high	92.1	Very high	95 Å²	95	51.3 Å²	51.3	58%	0.583	27%	0.269	S	S	*	.	H	α-helix	trans	-59.7	-44.2	174	-59.9	0	0	0	0	110.7	A82 L83 V84 C89 L90	A82-T86 VanDerWaalsContact O-CB 3.27Å; A82-T86 WeakPolarHBondContact O-CB 3.27Å; A82-T86 PolarHBondContact O-N 2.77Å; A82-T86 PolarHBondContact O-OG1 3.3Å; L83-T86 PolarHBondContact O-N 3.15Å; V84-T86 PolarHBondContact O-N 3.32Å; T86-C89 PolarHBondContact O-N 3.28Å; T86-L90 WeakPolarHBondContact O-CB 3.33Å; T86-L90 PolarHBondContact O-N 3.16Å
87	Y	94.1	Very high	92.3	Very high	40 Å²	40	51.8 Å²	51.8	16%	0.157	28%	0.276	C	S	.	.	H	α-helix	trans	-64.9	-43.2	177.9	-178.5	-113.3	0	0	0	112.6	L83 V84 L85 C89 L90 I91 C281 F284 S285	L83-Y87 WeakPolarHBondContact O-CB 3.46Å; L83-Y87 PolarHBondContact O-N 2.93Å; V84-Y87 WeakPolarHBondContact O-CB 3.43Å; V84-Y87 PolarHBondContact O-N 2.97Å; L85-Y87 VanDerWaalsContact C-N 3.3Å; L85-Y87 PolarHBondContact O-N 3.34Å; Y87-C89 PolarHBondContact O-N 3.42Å; Y87-L90 WeakPolarHBondContact O-CB 3.42Å; Y87-L90 PolarHBondContact O-N 3.15Å; Y87-L90 VanDerWaalsContact O-N 3.15Å; Y87-I91 HydrophobicContact CD1-CD1 3.92Å; Y87-I91 HydrophobicContact CE1-CD1 3.4Å; Y87-I91 HydrophobicContact CE1-CG1 4.28Å; Y87-I91 HydrophobicContact CE2-CD1 4.39Å; Y87-I91 HydrophobicContact CE2-CG1 4.44Å; Y87-I91 PolarHBondContact O-N 3.11Å; Y87-C281 HydrophobicContact CE2-CB 4.33Å; Y87-C281 PolarHBondContact OH-O 2.98Å; Y87-C281 VanDerWaalsContact OH-O 3.05Å; Y87-F284 HydrophobicContact CD1-CD1 4.23Å; Y87-F284 AromaticContact CD1-CE1 3.94Å; Y87-F284 HydrophobicContact CD1-CE1 3.94Å; Y87-F284 AromaticContact CD2-CD1 3.85Å; Y87-F284 HydrophobicContact CD2-CD1 3.85Å; Y87-F284 HydrophobicContact CD2-CE1 4.12Å; Y87-F284 AromaticContact CE1-CD1 3.79Å; Y87-F284 HydrophobicContact CE1-CD1 3.79Å; Y87-F284 AromaticContact CE1-CE1 3.84Å; Y87-F284 HydrophobicContact CE1-CE1 3.84Å; Y87-F284 HydrophobicContact CE2-CB 4.3Å; Y87-F284 AromaticContact CE2-CD1 3.4Å; Y87-F284 HydrophobicContact CE2-CD1 3.4Å; Y87-F284 HydrophobicContact CE2-CE1 4.05Å; Y87-F284 HydrophobicContact CE2-CG 4.19Å; Y87-F284 HydrophobicContact CG-CD1 4.24Å; Y87-F284 HydrophobicContact CG-CE1 4.07Å; Y87-F284 AromaticContact CZ-CD1 3.36Å; Y87-F284 AromaticContact CZ-CE1 3.91Å; Y87-S285 PolarHBondContact OH-N 3.01Å; Y87-S285 PolarHBondContact OH-OG 3.41Å
88	L	95.2	Very high	92.4	Very high	19 Å²	19	51.9 Å²	51.9	10%	0.099	28%	0.276	C	S	.	.	H	α-helix	trans	-62.4	-42.2	175.2	-68	176	0	0	0	111.7	V84 L85 L90 I91 L92 V144 Y145 Y148	V84-L88 HydrophobicContact CG1-CD1 4.08Å; V84-L88 HydrophobicContact CG1-CG 4.35Å; V84-L88 WeakPolarHBondContact O-CG 3.38Å; V84-L88 PolarHBondContact O-N 3.04Å; L85-L88 HydrophobicContact CD2-CD1 4.48Å; L85-L88 PolarHBondContact O-N 3.39Å; L88-L90 VanDerWaalsContact C-N 3.28Å; L88-L90 PolarHBondContact O-N 2.97Å; L88-I91 PolarHBondContact O-N 2.92Å; L88-L92 PolarHBondContact O-N 3.06Å; L88-V144 HydrophobicContact CD1-CG1 4.1Å; L88-V144 HydrophobicContact CD2-CG1 3.79Å; L88-Y145 HydrophobicContact CB-CE1 4.2Å; L88-Y145 HydrophobicContact CB-CE2 4.04Å; L88-Y145 VanDerWaalsContact CB-OH 3.25Å; L88-Y145 WeakPolarHBondContact CB-OH 3.3Å; L88-Y145 HydrophobicContact CD1-CD1 4.5Å; L88-Y145 HydrophobicContact CD1-CE1 4.23Å; L88-Y145 HydrophobicContact CD1-CE2 4.49Å; L88-Y145 PolarHBondContact O-OH 3.28Å; L88-Y148 HydrophobicContact CD1-CD1 4.48Å
89	C	93.1	Very high	92.6	Very high	63 Å²	63	44.7 Å²	44.7	43%	0.426	25%	0.25	S	C	.	.	H	α-helix	trans	-61.3	-38	173.5	-71.9	0	0	0	0	111.7	L85 T86 Y87 L92 C93 Y145	L85-C89 WeakPolarHBondContact O-CB 3.32Å; L85-C89 PolarHBondContact O-N 2.87Å; L85-C89 PolarHBondContact O-SG 3.45Å; T86-C89 PolarHBondContact O-N 3.28Å; Y87-C89 PolarHBondContact O-N 3.42Å; C89-L92 WeakPolarHBondContact O-CB 3.48Å; C89-L92 PolarHBondContact O-N 2.92Å; C89-C93 PolarHBondContact O-N 3.16Å; C89-C93 PolarHBondContact O-SG 3.43Å; C89-Y145 PolarHBondContact N-OH 3.48Å
90	L	91.4	Very high	92.8	Very high	36 Å²	36	42.6 Å²	42.6	19%	0.188	24%	0.236	C	C	.	.	H	α-helix	trans	-68	-36.7	177.7	-175.9	58.1	0	0	0	112.5	T86 Y87 L88 C93 L94 L277 Y278 C281	T86-L90 WeakPolarHBondContact O-CB 3.33Å; T86-L90 PolarHBondContact O-N 3.16Å; Y87-L90 WeakPolarHBondContact O-CB 3.42Å; Y87-L90 PolarHBondContact O-N 3.15Å; Y87-L90 VanDerWaalsContact O-N 3.15Å; L88-L90 VanDerWaalsContact C-N 3.28Å; L88-L90 PolarHBondContact O-N 2.97Å; L90-C93 PolarHBondContact O-N 3.38Å; L90-L94 PolarHBondContact O-N 3.11Å; L90-L277 HydrophobicContact CD1-CD1 4.49Å; L90-L277 HydrophobicContact CD1-CD2 3.52Å; L90-L277 HydrophobicContact CD1-CG 3.78Å; L90-L277 HydrophobicContact CD2-CD1 3.88Å; L90-L277 HydrophobicContact CD2-CD2 4.42Å; L90-L277 HydrophobicContact CD2-CG 3.96Å; L90-L277 HydrophobicContact CG-CG 4.48Å; L90-Y278 HydrophobicContact CD1-CD1 4.16Å; L90-Y278 HydrophobicContact CD1-CE1 3.81Å; L90-C281 WeakPolarHBondContact CD2-SG 3.15Å; L90-C281 WeakPolarHBondContact CG-SG 3.24Å
91	I	94.6	Very high	92.8	Very high	34 Å²	34	44 Å²	44	17%	0.174	25%	0.247	C	C	.	.	H	α-helix	trans	-62.9	-42.8	170.4	-69	168.7	0	0	0	110.7	Y87 L88 L94 L95 L231	Y87-I91 HydrophobicContact CD1-CD1 3.92Å; Y87-I91 HydrophobicContact CE1-CD1 3.4Å; Y87-I91 HydrophobicContact CE1-CG1 4.28Å; Y87-I91 HydrophobicContact CE2-CD1 4.39Å; Y87-I91 HydrophobicContact CE2-CG1 4.44Å; Y87-I91 PolarHBondContact O-N 3.11Å; L88-I91 PolarHBondContact O-N 2.92Å; I91-L94 WeakPolarHBondContact O-CB 3.35Å; I91-L94 PolarHBondContact O-N 3.22Å; I91-L95 WeakPolarHBondContact O-CB 3.47Å; I91-L95 PolarHBondContact O-N 3.48Å; I91-L231 HydrophobicContact CD1-CD2 4.01Å; I91-L231 HydrophobicContact CG1-CD2 4.05Å; I91-L231 HydrophobicContact CG2-CD2 4.39Å
92	L	95.1	Very high	92.5	Very high	46 Å²	46	44.2 Å²	44.2	24%	0.241	25%	0.246	C	C	.	.	H	α-helix	trans	-60.8	-45.4	174.4	-74	-179.3	0	0	0	111.4	L88 C89 L94 L95 Y96 V141 Y145	L88-L92 PolarHBondContact O-N 3.06Å; C89-L92 WeakPolarHBondContact O-CB 3.48Å; C89-L92 PolarHBondContact O-N 2.92Å; L92-L94 PolarHBondContact O-N 3.41Å; L92-L95 WeakPolarHBondContact O-CB 3.17Å; L92-L95 PolarHBondContact O-N 3.42Å; L92-Y96 HydrophobicContact CD2-CE2 4.38Å; L92-Y96 WeakPolarHBondContact O-CD2 3.28Å; L92-Y96 PolarHBondContact O-N 2.94Å; L92-V141 HydrophobicContact CD2-CG1 3.66Å; L92-V141 HydrophobicContact CD2-CG2 4.25Å; L92-Y145 HydrophobicContact CD1-CE2 3.77Å; L92-Y145 VanDerWaalsContact CD1-OH 3.28Å; L92-Y145 WeakPolarHBondContact CD1-OH 3.31Å; L92-Y145 HydrophobicContact CG-CE2 4.23Å
93	C	91.8	Very high	92.5	Very high	60 Å²	60	43.6 Å²	43.6	41%	0.405	23%	0.233	S	C	.	.	H	α-helix	trans	-56.7	-50.6	174.7	-70	0	0	0	0	110.9	C89 L90 L95 Y96 T97 Y278	C89-C93 PolarHBondContact O-N 3.16Å; C89-C93 PolarHBondContact O-SG 3.43Å; L90-C93 PolarHBondContact O-N 3.38Å; C93-L95 VanDerWaalsContact C-N 3.3Å; C93-L95 PolarHBondContact O-N 3Å; C93-Y96 PolarHBondContact O-N 2.74Å; C93-T97 WeakPolarHBondContact O-CB 3.49Å; C93-T97 VanDerWaalsContact O-CG2 3.3Å; C93-T97 WeakPolarHBondContact O-CG2 3.21Å; C93-T97 PolarHBondContact O-N 2.73Å; C93-T97 PolarHBondContact O-OG1 3.45Å; C93-Y278 HydrophobicContact CB-CE1 4.35Å
94	L	93	Very high	92.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-54.3	-45.5	175.9	169	60.6	0	0	0	112.5	L90 I91 L92 Y96 V98 L99 L231 F239 Y278 F282	L90-L94 PolarHBondContact O-N 3.11Å; I91-L94 WeakPolarHBondContact O-CB 3.35Å; I91-L94 PolarHBondContact O-N 3.22Å; L92-L94 PolarHBondContact O-N 3.41Å; L94-Y96 PolarHBondContact O-N 2.95Å; L94-V98 HydrophobicContact CD1-CB 4.1Å; L94-V98 HydrophobicContact CD1-CG2 4.39Å; L94-V98 PolarHBondContact O-N 3.15Å; L94-V98 VanDerWaalsContact O-N 3.11Å; L94-L99 HydrophobicContact CD1-CD2 4.32Å; L94-L99 HydrophobicContact CD1-CG 4.16Å; L94-L99 HydrophobicContact CG-CD1 4.09Å; L94-L99 HydrophobicContact CG-CG 4.13Å; L94-L99 PolarHBondContact O-N 3.21Å; L94-L99 VanDerWaalsContact O-N 3.14Å; L94-L231 HydrophobicContact CD2-CD1 4.08Å; L94-F239 HydrophobicContact CD1-CD2 4.07Å; L94-F239 HydrophobicContact CD1-CE2 4.31Å; L94-Y278 HydrophobicContact CB-CD1 3.69Å; L94-Y278 HydrophobicContact CB-CE1 3.77Å; L94-Y278 HydrophobicContact CB-CG 4.27Å; L94-Y278 HydrophobicContact CD1-CD1 4.06Å; L94-Y278 HydrophobicContact CD1-CD2 3.99Å; L94-Y278 HydrophobicContact CD1-CG 3.73Å; L94-Y278 HydrophobicContact CG-CD1 4.34Å; L94-Y278 HydrophobicContact CG-CG 4.49Å; L94-F282 HydrophobicContact CD1-CE2 4.3Å; L94-F282 HydrophobicContact CD2-CD2 4.47Å; L94-F282 HydrophobicContact CD2-CE2 3.63Å; L94-F282 HydrophobicContact CD2-CZ 3.68Å
95	L	94	Very high	92.1	Very high	23 Å²	23	44.7 Å²	44.7	12%	0.12	24%	0.235	C	C	.	.	I	π-helix	trans	-59	-48	179.9	179.9	63.7	0	0	0	111.3	I91 L92 C93 L99 I100	I91-L95 WeakPolarHBondContact O-CB 3.47Å; I91-L95 PolarHBondContact O-N 3.48Å; L92-L95 WeakPolarHBondContact O-CB 3.17Å; L92-L95 PolarHBondContact O-N 3.42Å; C93-L95 VanDerWaalsContact C-N 3.3Å; C93-L95 PolarHBondContact O-N 3Å; L95-L99 HydrophobicContact CD1-CB 4.28Å; L95-L99 HydrophobicContact CD1-CD1 4.32Å; L95-L99 PolarHBondContact O-N 2.9Å; L95-I100 HydrophobicContact CD1-CD1 4.04Å; L95-I100 HydrophobicContact CD1-CG1 3.97Å; L95-I100 HydrophobicContact CD2-CD1 4.39Å; L95-I100 HydrophobicContact CG-CD1 3.78Å; L95-I100 HydrophobicContact CG-CG1 4.19Å; L95-I100 WeakPolarHBondContact O-CB 3.15Å; L95-I100 WeakPolarHBondContact O-CG1 3.33Å; L95-I100 PolarHBondContact O-N 3.49Å
96	Y	92.5	Very high	91.8	Very high	123 Å²	123	44 Å²	44	48%	0.482	23%	0.231	S	C	.	.	I	π-helix	trans	-86.8	-26.5	-173.6	-78.5	-80.2	0	0	0	114.8	L92 C93 L94 I100 P101 H138	L92-Y96 HydrophobicContact CD2-CE2 4.38Å; L92-Y96 WeakPolarHBondContact O-CD2 3.28Å; L92-Y96 PolarHBondContact O-N 2.94Å; C93-Y96 PolarHBondContact O-N 2.74Å; L94-Y96 PolarHBondContact O-N 2.95Å; Y96-I100 HydrophobicContact CD1-CD1 3.93Å; Y96-I100 HydrophobicContact CE1-CD1 4Å; Y96-I100 HydrophobicContact CG-CD1 4.42Å; Y96-P101 VanDerWaalsContact O-CD 3.27Å; Y96-P101 WeakPolarHBondContact O-CD 3.44Å; Y96-P101 WeakPolarHBondContact O-CG 3.46Å; Y96-H138 AromaticContact CZ-NE2 3.54Å; Y96-H138 PolarHBondContact OH-CD2 3.15Å; Y96-H138 PolarHBondContact OH-NE2 3.3Å
97	T	88.9	Confident	91.7	Very high	56 Å²	56	41.3 Å²	41.3	34%	0.344	21%	0.213	S	C	.	.	I	π-helix	trans	-93.2	-22.8	-179	67.1	0	0	0	0	113.5	C93 Y278	C93-T97 WeakPolarHBondContact O-CB 3.49Å; C93-T97 VanDerWaalsContact O-CG2 3.3Å; C93-T97 WeakPolarHBondContact O-CG2 3.21Å; C93-T97 PolarHBondContact O-N 2.73Å; C93-T97 PolarHBondContact O-OG1 3.45Å; T97-Y278 PolarHBondContact OG1-OH 3.25Å
98	V	91.1	Very high	91.4	Very high	4 Å²	4	43.6 Å²	43.6	2%	0.024	23%	0.228	C	C	.	.	I	π-helix	trans	-126.6	-57.8	-176.6	-177.2	0	0	0	0	112.4	L94 R102 F239 Y242 Y278	L94-V98 HydrophobicContact CD1-CB 4.1Å; L94-V98 HydrophobicContact CD1-CG2 4.39Å; L94-V98 PolarHBondContact O-N 3.15Å; L94-V98 VanDerWaalsContact O-N 3.11Å; V98-R102 WeakPolarHBondContact O-CB 3.44Å; V98-R102 PolarHBondContact O-N 2.84Å; V98-F239 HydrophobicContact CG1-CD2 3.97Å; V98-F239 HydrophobicContact CG1-CE2 4.39Å; V98-Y242 HydrophobicContact CG1-CD1 3.87Å; V98-Y242 HydrophobicContact CG1-CD2 3.74Å; V98-Y242 HydrophobicContact CG1-CE1 4.06Å; V98-Y242 HydrophobicContact CG1-CE2 3.91Å; V98-Y242 HydrophobicContact CG1-CG 3.73Å; V98-Y278 HydrophobicContact CG2-CD2 3.86Å; V98-Y278 HydrophobicContact CG2-CE2 3.64Å
99	L	92.9	Very high	90.9	Very high	14 Å²	14	44 Å²	44	7%	0.073	23%	0.233	C	C	.	.	I	π-helix	trans	-68.4	-50.8	-167.1	-56.8	-178.6	0	0	0	112.6	L94 L95 R102 R103 L231 G235 D238 F239	L94-L99 HydrophobicContact CD1-CD2 4.32Å; L94-L99 HydrophobicContact CD1-CG 4.16Å; L94-L99 HydrophobicContact CG-CD1 4.09Å; L94-L99 HydrophobicContact CG-CG 4.13Å; L94-L99 PolarHBondContact O-N 3.21Å; L94-L99 VanDerWaalsContact O-N 3.14Å; L95-L99 HydrophobicContact CD1-CB 4.28Å; L95-L99 HydrophobicContact CD1-CD1 4.32Å; L95-L99 PolarHBondContact O-N 2.9Å; L99-R102 PolarHBondContact O-N 3.34Å; L99-R103 PolarHBondContact O-N 3.02Å; L99-R103 VanDerWaalsContact O-N 3.13Å; L99-L231 HydrophobicContact CD1-CD1 4.49Å; L99-G235 WeakPolarHBondContact CD2-O 3.15Å; L99-D238 HydrophobicContact CD2-CB 3.98Å; L99-F239 HydrophobicContact CD2-CB 4.11Å
100	I	92.7	Very high	90.7	Very high	21 Å²	21	41.3 Å²	41.3	11%	0.108	21%	0.214	C	C	.	.	H	α-helix	trans	-64.5	-51.3	177.9	-70.2	169.3	0	0	0	111.2	L95 Y96 R102 R103 L104 F130 F134	L95-I100 HydrophobicContact CD1-CD1 4.04Å; L95-I100 HydrophobicContact CD1-CG1 3.97Å; L95-I100 HydrophobicContact CD2-CD1 4.39Å; L95-I100 HydrophobicContact CG-CD1 3.78Å; L95-I100 HydrophobicContact CG-CG1 4.19Å; L95-I100 WeakPolarHBondContact O-CB 3.15Å; L95-I100 WeakPolarHBondContact O-CG1 3.33Å; L95-I100 PolarHBondContact O-N 3.49Å; Y96-I100 HydrophobicContact CD1-CD1 3.93Å; Y96-I100 HydrophobicContact CE1-CD1 4Å; Y96-I100 HydrophobicContact CG-CD1 4.42Å; I100-R102 VanDerWaalsContact C-N 3.28Å; I100-R102 PolarHBondContact O-N 3.26Å; I100-R103 PolarHBondContact O-N 2.83Å; I100-L104 HydrophobicContact CG2-CD1 3.91Å; I100-L104 HydrophobicContact CG2-CG 4.3Å; I100-L104 WeakPolarHBondContact O-CG 3.49Å; I100-L104 PolarHBondContact O-N 2.84Å; I100-F130 HydrophobicContact CG2-CE2 4.34Å; I100-F134 HydrophobicContact CD1-CD2 4.18Å; I100-F134 HydrophobicContact CD1-CE2 4.03Å
101	P	90.6	Very high	90.5	Very high	50 Å²	50	45.5 Å²	45.5	33%	0.325	23%	0.229	S	C	.	.	H	α-helix	trans	-56.2	-40.4	177.2	-29.1	36.8	0	0	0	113.4	Y96 R103 L104 F105	Y96-P101 VanDerWaalsContact O-CD 3.27Å; Y96-P101 WeakPolarHBondContact O-CD 3.44Å; Y96-P101 WeakPolarHBondContact O-CG 3.46Å; P101-R103 VanDerWaalsContact C-N 3.34Å; P101-R103 PolarHBondContact O-N 2.89Å; P101-L104 PolarHBondContact O-N 3.46Å; P101-F105 WeakPolarHBondContact O-CB 3.29Å; P101-F105 PolarHBondContact O-N 3.39Å
102	R	88.4	Confident	90	Very high	26 Å²	26	48.3 Å²	48.3	10%	0.098	24%	0.243	C	C	.	.	H	α-helix	trans	-60.7	-43.6	175.6	172.6	156.4	-179.6	76.3	6.5	112.1	V98 L99 I100 F105 I106 D238 E245	V98-R102 WeakPolarHBondContact O-CB 3.44Å; V98-R102 PolarHBondContact O-N 2.84Å; L99-R102 PolarHBondContact O-N 3.34Å; I100-R102 VanDerWaalsContact C-N 3.28Å; I100-R102 PolarHBondContact O-N 3.26Å; R102-F105 WeakPolarHBondContact O-CB 3.39Å; R102-F105 PolarHBondContact O-N 2.84Å; R102-I106 HydrophobicContact CG-CD1 4.22Å; R102-I106 WeakPolarHBondContact O-CG1 3.37Å; R102-I106 PolarHBondContact O-N 2.83Å; R102-D238 VanDerWaalsContact CD-O 3.3Å; R102-D238 WeakPolarHBondContact CD-O 3.19Å; R102-D238 PolarHBondContact NE-O 3.3Å; R102-E245 IonicContact CZ-OE2 3.59Å; R102-E245 IonicContact NH1-OE2 3.12Å; R102-E245 PolarHBondContact NH1-OE2 3.1Å; R102-E245 IonicContact NH2-OE2 3.34Å
103	R	91	Very high	89.4	Confident	38 Å²	38	51.5 Å²	51.5	14%	0.143	25%	0.253	C	S	.	.	H	α-helix	trans	-69.8	-36	179.6	-73.9	-69.5	-177.9	172.8	6	112.6	L99 I100 P101 F105 I106 L107 E126 W129 F130 D238	L99-R103 PolarHBondContact O-N 3.02Å; L99-R103 VanDerWaalsContact O-N 3.13Å; I100-R103 PolarHBondContact O-N 2.83Å; P101-R103 VanDerWaalsContact C-N 3.34Å; P101-R103 PolarHBondContact O-N 2.89Å; R103-F105 VanDerWaalsContact C-N 3.32Å; R103-F105 PolarHBondContact O-N 3.35Å; R103-I106 PolarHBondContact O-N 3.41Å; R103-L107 WeakPolarHBondContact O-CB 3.5Å; R103-L107 PolarHBondContact O-N 2.86Å; R103-E126 IonicContact NH1-OE2 2.67Å; R103-E126 PolarHBondContact NH1-OE2 3.17Å; R103-W129 HydrophobicContact CG-CH2 4.33Å; R103-W129 HydrophobicContact CG-CZ3 3.73Å; R103-W129 VanDerWaalsContact CZ-CZ3 3.44Å; R103-W129 VanDerWaalsContact NH2-CH2 3.33Å; R103-W129 VanDerWaalsContact NH2-CZ2 3.3Å; R103-F130 HydrophobicContact CB-CD2 3.94Å; R103-F130 HydrophobicContact CB-CE2 4.37Å; R103-D238 WeakPolarHBondContact CG-OD2 3.45Å; R103-D238 IonicContact CZ-OD1 3.76Å; R103-D238 IonicContact CZ-OD2 3.99Å; R103-D238 IonicContact NE-OD1 3.6Å; R103-D238 PolarHBondContact NE-OD1 2.95Å; R103-D238 VanDerWaalsContact NE-OD1 3.1Å; R103-D238 IonicContact NE-OD2 3.19Å; R103-D238 PolarHBondContact NE-OD2 3.37Å; R103-D238 IonicContact NH2-OD1 3.61Å; R103-D238 PolarHBondContact NH2-OD1 3.4Å; R103-D238 IonicContact NH2-OD2 2.69Å
104	L	91.1	Very high	88.7	Confident	81 Å²	81	52.7 Å²	52.7	42%	0.424	26%	0.256	S	S	.	.	H	α-helix	trans	-62.5	-39	170.2	-68.8	173.5	0	0	0	112	I100 P101 L107 N108 F130	I100-L104 HydrophobicContact CG2-CD1 3.91Å; I100-L104 HydrophobicContact CG2-CG 4.3Å; I100-L104 WeakPolarHBondContact O-CG 3.49Å; I100-L104 PolarHBondContact O-N 2.84Å; P101-L104 PolarHBondContact O-N 3.46Å; L104-L107 PolarHBondContact O-N 2.92Å; L104-N108 WeakPolarHBondContact O-CB 3.34Å; L104-N108 PolarHBondContact O-N 2.88Å; L104-F130 HydrophobicContact CD2-CE1 4.13Å; L104-F130 HydrophobicContact CD2-CE2 3.99Å; L104-F130 HydrophobicContact CD2-CZ 3.67Å; L104-F130 HydrophobicContact CG-CE2 4.2Å; L104-F130 HydrophobicContact CG-CZ 4.24Å
105	F	86.7	Confident	87.9	Confident	59 Å²	59	59 Å²	59	26%	0.259	29%	0.285	S	S	.	.	H	α-helix	trans	-63.9	-44.1	175.3	175.8	-96.9	0	0	0	112.7	P101 R102 R103 N108 S109 T266	P101-F105 WeakPolarHBondContact O-CB 3.29Å; P101-F105 PolarHBondContact O-N 3.39Å; R102-F105 WeakPolarHBondContact O-CB 3.39Å; R102-F105 PolarHBondContact O-N 2.84Å; R103-F105 VanDerWaalsContact C-N 3.32Å; R103-F105 PolarHBondContact O-N 3.35Å; F105-N108 PolarHBondContact O-N 3.25Å; F105-S109 WeakPolarHBondContact O-CB 3.42Å; F105-S109 PolarHBondContact O-N 2.9Å; F105-S109 PolarHBondContact O-OG 3Å; F105-T266 WeakPolarHBondContact CD2-OG1 3.43Å
106	I	87.9	Confident	87.2	Confident	36 Å²	36	67.5 Å²	67.5	19%	0.185	32%	0.317	C	S	.	.	H	α-helix	trans	-60.8	-47.1	174.8	-68.2	168.9	0	0	0	109.9	R102 R103 N108 S109 C110 E126	R102-I106 HydrophobicContact CG-CD1 4.22Å; R102-I106 WeakPolarHBondContact O-CG1 3.37Å; R102-I106 PolarHBondContact O-N 2.83Å; R103-I106 PolarHBondContact O-N 3.41Å; I106-N108 VanDerWaalsContact C-N 3.35Å; I106-N108 PolarHBondContact O-N 3.31Å; I106-S109 WeakPolarHBondContact O-CB 3.41Å; I106-S109 PolarHBondContact O-N 3.35Å; I106-S109 VanDerWaalsContact O-N 3.16Å; I106-C110 PolarHBondContact O-N 2.62Å; I106-C110 PolarHBondContact O-SG 3.05Å; I106-E126 HydrophobicContact CG2-CG 4.35Å
107	L	90.3	Very high	86.4	Confident	39 Å²	39	69.2 Å²	69.2	20%	0.204	33%	0.334	C	S	.	.	H	α-helix	trans	-58.8	-45.5	178.6	-172.6	67.2	0	0	0	112	R103 L104 S109 C110 Y111 L123 E126	R103-L107 WeakPolarHBondContact O-CB 3.5Å; R103-L107 PolarHBondContact O-N 2.86Å; L104-L107 PolarHBondContact O-N 2.92Å; L107-S109 VanDerWaalsContact C-N 3.35Å; L107-S109 PolarHBondContact O-N 3.16Å; L107-C110 PolarHBondContact O-N 3.26Å; L107-Y111 PolarHBondContact O-N 2.85Å; L107-L123 HydrophobicContact CD1-CD1 3.68Å; L107-L123 HydrophobicContact CG-CD1 4.24Å; L107-E126 HydrophobicContact CD1-CB 3.95Å
108	N	87.7	Confident	85.6	Confident	88 Å²	88	68.3 Å²	68.3	47%	0.471	33%	0.33	S	S	.	.	H	α-helix	trans	-63.9	-39	176.7	-174.7	72.5	0	0	0	112.2	L104 F105 I106 C110 Y111 L112	L104-N108 WeakPolarHBondContact O-CB 3.34Å; L104-N108 PolarHBondContact O-N 2.88Å; F105-N108 PolarHBondContact O-N 3.25Å; I106-N108 VanDerWaalsContact C-N 3.35Å; I106-N108 PolarHBondContact O-N 3.31Å; N108-C110 VanDerWaalsContact C-N 3.33Å; N108-C110 PolarHBondContact O-N 3.31Å; N108-Y111 WeakPolarHBondContact O-CB 3.29Å; N108-Y111 PolarHBondContact O-N 3.42Å; N108-L112 WeakPolarHBondContact O-CG 3.46Å; N108-L112 PolarHBondContact O-N 3.44Å; N108-L112 VanDerWaalsContact O-N 3.13Å
109	S	85.3	Confident	84.5	Confident	28 Å²	28	74.2 Å²	74.2	20%	0.196	37%	0.372	C	S	.	.	H	α-helix	trans	-63.4	-41.1	175.4	-58.8	0	0	0	0	111.4	F105 I106 L107 L112 Y113	F105-S109 WeakPolarHBondContact O-CB 3.42Å; F105-S109 PolarHBondContact O-N 2.9Å; F105-S109 PolarHBondContact O-OG 3Å; I106-S109 WeakPolarHBondContact O-CB 3.41Å; I106-S109 PolarHBondContact O-N 3.35Å; I106-S109 VanDerWaalsContact O-N 3.16Å; L107-S109 VanDerWaalsContact C-N 3.35Å; L107-S109 PolarHBondContact O-N 3.16Å; S109-L112 PolarHBondContact O-N 3.2Å; S109-Y113 WeakPolarHBondContact O-CD2 3.3Å; S109-Y113 PolarHBondContact O-N 3.04Å
110	C	88.3	Confident	83.8	Confident	5 Å²	5	81.8 Å²	81.8	3%	0.034	40%	0.404	C	S	.	.	H	α-helix	trans	-66.9	-36.7	176.9	-61.7	0	0	0	0	112.6	I106 L107 N108 Y113 D114 C121	I106-C110 PolarHBondContact O-N 2.62Å; I106-C110 PolarHBondContact O-SG 3.05Å; L107-C110 PolarHBondContact O-N 3.26Å; N108-C110 VanDerWaalsContact C-N 3.33Å; N108-C110 PolarHBondContact O-N 3.31Å; C110-Y113 PolarHBondContact O-N 3.34Å; C110-D114 VanDerWaalsContact O-CB 3.32Å; C110-D114 WeakPolarHBondContact O-CB 3.26Å; C110-D114 PolarHBondContact O-N 3.47Å; C110-C121 HydrophobicContact CB-CB 3.75Å; C110-C121 WeakPolarHBondContact CB-SG 3.39Å; C110-C121 WeakPolarHBondContact SG-CB 3.35Å; C110-C121 CovalentContact SG-SG 2.01Å; C110-C121 PolarHBondContact SG-SG 3.46Å
111	Y	86.3	Confident	83.3	Confident	125 Å²	125	82.1 Å²	82.1	49%	0.49	41%	0.408	S	S	.	.	H	α-helix	trans	-57.8	-48	171.7	173.9	-93.7	0	0	0	111.5	L107 N108 Y113 D114 E115 L123	L107-Y111 PolarHBondContact O-N 2.85Å; N108-Y111 WeakPolarHBondContact O-CB 3.29Å; N108-Y111 PolarHBondContact O-N 3.42Å; Y111-Y113 PolarHBondContact O-N 3.19Å; Y111-D114 PolarHBondContact O-N 2.9Å; Y111-E115 WeakPolarHBondContact O-CB 3.42Å; Y111-E115 PolarHBondContact O-N 3.21Å; Y111-L123 HydrophobicContact CD2-CD2 3.9Å
112	L	84.4	Confident	83.1	Confident	93 Å²	93	82.5 Å²	82.5	49%	0.487	41%	0.412	S	S	.	.	H	α-helix	trans	-66.1	-34.5	178.1	-65.6	173.1	0	0	0	113.2	N108 S109 Y116	N108-L112 WeakPolarHBondContact O-CG 3.46Å; N108-L112 PolarHBondContact O-N 3.44Å; N108-L112 VanDerWaalsContact O-N 3.13Å; S109-L112 PolarHBondContact O-N 3.2Å; L112-Y116 PolarHBondContact O-N 2.83Å
113	Y	81.9	Confident	83.1	Confident	112 Å²	112	83.6 Å²	83.6	44%	0.439	42%	0.419	S	S	.	.	H	α-helix	trans	-73.4	-36.9	176.6	-79.2	-59.8	0	0	0	113.3	S109 C110 Y111 Y116 N117 S118	S109-Y113 WeakPolarHBondContact O-CD2 3.3Å; S109-Y113 PolarHBondContact O-N 3.04Å; C110-Y113 PolarHBondContact O-N 3.34Å; Y111-Y113 PolarHBondContact O-N 3.19Å; Y113-Y116 CarbonylContact O-C 3.5Å; Y113-Y116 PolarHBondContact O-N 3.19Å; Y113-N117 PolarHBondContact O-N 3.21Å; Y113-S118 PolarHBondContact O-N 2.88Å
114	D	78.5	Confident	83.1	Confident	86 Å²	86	91.8 Å²	91.8	46%	0.46	45%	0.45	S	S	.	.	H	α-helix	trans	-64.5	-42.9	175.4	-165.3	57.5	0	0	0	110.2	C110 Y111 Y116 N117	C110-D114 VanDerWaalsContact O-CB 3.32Å; C110-D114 WeakPolarHBondContact O-CB 3.26Å; C110-D114 PolarHBondContact O-N 3.47Å; Y111-D114 PolarHBondContact O-N 2.9Å; D114-Y116 PolarHBondContact O-N 3.39Å; D114-N117 PolarHBondContact O-N 3.49Å
115	E	76.2	Confident	83.1	Confident	133 Å²	133	91.8 Å²	91.8	62%	0.621	45%	0.454	S	S	*	.	H	α-helix	trans	-56.6	-32.8	172.4	-172.4	175.9	-176.2	0	0	112.6	Y111	Y111-E115 WeakPolarHBondContact O-CB 3.42Å; Y111-E115 PolarHBondContact O-N 3.21Å
116	Y	79	Confident	83.3	Confident	201 Å²	201	91.1 Å²	91.1	79%	0.788	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	14.2	177.1	-154.4	-97.4	0	0	0	114.1	L112 Y113 D114 S118	L112-Y116 PolarHBondContact O-N 2.83Å; Y113-Y116 CarbonylContact O-C 3.5Å; Y113-Y116 PolarHBondContact O-N 3.19Å; D114-Y116 PolarHBondContact O-N 3.39Å; Y116-S118 VanDerWaalsContact C-N 3.32Å; Y116-S118 PolarHBondContact O-N 3.39Å
117	N	74.5	Confident	83.6	Confident	158 Å²	158	90.1 Å²	90.1	85%	0.845	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	38.9	-179.3	-70.2	-48.8	0	0	0	114.6	Y113 D114	Y113-N117 PolarHBondContact O-N 3.21Å; D114-N117 PolarHBondContact O-N 3.49Å
118	S	72.7	Confident	83.9	Confident	37 Å²	37	92.2 Å²	92.2	26%	0.259	47%	0.465	S	S	.	.			trans	-103.1	119.4	178.6	-179.3	0	0	0	0	112	Y113 Y116 K120	Y113-S118 PolarHBondContact O-N 2.88Å; Y116-S118 VanDerWaalsContact C-N 3.32Å; Y116-S118 PolarHBondContact O-N 3.39Å; S118-K120 PolarHBondContact O-N 2.93Å
119	S	69.5	Low	84.1	Confident	128 Å²	128	91 Å²	91	90%	0.895	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	19	-175.1	67.9	0	0	0	0	115.6
120	K	76.3	Confident	84.6	Confident	173 Å²	173	91.4 Å²	91.4	75%	0.752	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-24.6	-177.7	-75.5	-175	-179.5	176.5	0	113.5	S118	S118-K120 PolarHBondContact O-N 2.93Å
121	C	82.1	Confident	85	Confident	29 Å²	29	96.4 Å²	96.4	20%	0.196	48%	0.478	C	S	.	.			trans	-146.7	144.4	179.8	-174	0	0	0	0	111.1	C110 E126	C110-C121 HydrophobicContact CB-CB 3.75Å; C110-C121 WeakPolarHBondContact CB-SG 3.39Å; C110-C121 WeakPolarHBondContact SG-CB 3.35Å; C110-C121 CovalentContact SG-SG 2.01Å; C110-C121 PolarHBondContact SG-SG 3.46Å; C121-E126 VanDerWaalsContact SG-CG 3.56Å
122	S	86.6	Confident	85.4	Confident	57 Å²	57	95.7 Å²	95.7	40%	0.399	48%	0.482	S	S	.	.			trans	-103.6	114	172.2	179.3	0	0	0	0	110.5	R124 T125 E126	S122-R124 VanDerWaalsContact C-N 3.26Å; S122-R124 PolarHBondContact O-N 2.96Å; S122-T125 PolarHBondContact O-N 3.48Å; S122-T125 PolarHBondContact OG-OG1 2.9Å; S122-E126 PolarHBondContact O-N 3.46Å; S122-E126 VanDerWaalsContact O-N 3.08Å
123	L	89.5	Confident	85.9	Confident	50 Å²	50	93 Å²	93	26%	0.262	47%	0.466	S	S	.	.	H	α-helix	trans	-55	-41.4	176.9	177.5	62.4	0	0	0	112.2	L107 Y111 G127	L107-L123 HydrophobicContact CD1-CD1 3.68Å; L107-L123 HydrophobicContact CG-CD1 4.24Å; Y111-L123 HydrophobicContact CD2-CD2 3.9Å; L123-G127 PolarHBondContact O-N 3.41Å
124	R	90.7	Very high	86.6	Confident	209 Å²	209	91.2 Å²	91.2	79%	0.789	46%	0.461	S	S	*	.	H	α-helix	trans	-62.7	-47.1	178.8	-175.8	-179.7	178.6	-145.1	0.2	111.7	S122 G127 T128	S122-R124 VanDerWaalsContact C-N 3.26Å; S122-R124 PolarHBondContact O-N 2.96Å; R124-G127 PolarHBondContact O-N 2.88Å; R124-T128 VanDerWaalsContact O-CG2 3.31Å; R124-T128 WeakPolarHBondContact O-CG2 3.41Å; R124-T128 PolarHBondContact O-N 2.91Å; R124-T128 PolarHBondContact O-OG1 3.47Å; R124-T128 VanDerWaalsContact O-OG1 3.07Å
125	T	91.3	Very high	87.5	Confident	81 Å²	81	91.5 Å²	91.5	50%	0.497	47%	0.466	S	S	.	.	H	α-helix	trans	-63	-49.2	-179.9	-58.2	0	0	0	0	110.9	S122 G127 T128 W129	S122-T125 PolarHBondContact O-N 3.48Å; S122-T125 PolarHBondContact OG-OG1 2.9Å; T125-G127 PolarHBondContact O-N 3.04Å; T125-T128 PolarHBondContact O-N 3.39Å; T125-T128 PolarHBondContact O-OG1 2.98Å; T125-W129 WeakPolarHBondContact O-CB 3.39Å; T125-W129 PolarHBondContact O-N 3.4Å
126	E	91.2	Very high	88.4	Confident	45 Å²	45	88.4 Å²	88.4	21%	0.21	45%	0.454	C	S	.	.	H	α-helix	trans	-65.3	-37.3	178.4	-68.6	-57.1	133.8	0	0	112.6	R103 I106 L107 C121 S122 W129 F130	R103-E126 IonicContact NH1-OE2 2.67Å; R103-E126 PolarHBondContact NH1-OE2 3.17Å; I106-E126 HydrophobicContact CG2-CG 4.35Å; L107-E126 HydrophobicContact CD1-CB 3.95Å; C121-E126 VanDerWaalsContact SG-CG 3.56Å; S122-E126 PolarHBondContact O-N 3.46Å; S122-E126 VanDerWaalsContact O-N 3.08Å; E126-W129 PolarHBondContact O-N 3.34Å; E126-F130 WeakPolarHBondContact O-CB 3.33Å; E126-F130 PolarHBondContact O-N 3.22Å
127	G	94.4	Very high	89.3	Confident	16 Å²	16	79.4 Å²	79.4	17%	0.165	42%	0.42	C	S	.	.	H	α-helix	trans	-64.7	-46	176.5	0	0	0	0	0	112.6	L123 R124 T125 F130 L131	L123-G127 PolarHBondContact O-N 3.41Å; R124-G127 PolarHBondContact O-N 2.88Å; T125-G127 PolarHBondContact O-N 3.04Å; G127-F130 PolarHBondContact O-N 2.92Å; G127-L131 WeakPolarHBondContact O-CG 3.33Å; G127-L131 PolarHBondContact O-N 3.21Å
128	T	95.1	Very high	90.3	Very high	82 Å²	82	74.1 Å²	74.1	50%	0.503	39%	0.39	S	S	.	.	H	α-helix	trans	-64.4	-40.4	176	56	0	0	0	0	112.2	R124 T125 L132	R124-T128 VanDerWaalsContact O-CG2 3.31Å; R124-T128 WeakPolarHBondContact O-CG2 3.41Å; R124-T128 PolarHBondContact O-N 2.91Å; R124-T128 PolarHBondContact O-OG1 3.47Å; R124-T128 VanDerWaalsContact O-OG1 3.07Å; T125-T128 PolarHBondContact O-N 3.39Å; T125-T128 PolarHBondContact O-OG1 2.98Å; T128-L132 WeakPolarHBondContact O-CB 3.49Å; T128-L132 PolarHBondContact O-N 3Å
129	W	93	Very high	91.5	Very high	64 Å²	64	75.3 Å²	75.3	24%	0.242	39%	0.394	C	S	.	.	H	α-helix	trans	-59.1	-50.6	173.7	-171.5	97.8	0	0	0	110.6	R103 T125 E126 L131 L132 H133 V234	R103-W129 HydrophobicContact CG-CH2 4.33Å; R103-W129 HydrophobicContact CG-CZ3 3.73Å; R103-W129 VanDerWaalsContact CZ-CZ3 3.44Å; R103-W129 VanDerWaalsContact NH2-CH2 3.33Å; R103-W129 VanDerWaalsContact NH2-CZ2 3.3Å; T125-W129 WeakPolarHBondContact O-CB 3.39Å; T125-W129 PolarHBondContact O-N 3.4Å; E126-W129 PolarHBondContact O-N 3.34Å; W129-L131 PolarHBondContact O-N 2.84Å; W129-L132 PolarHBondContact O-N 3.48Å; W129-H133 AromaticContact CD1-CD2 3.67Å; W129-H133 AromaticContact CD1-NE2 3.67Å; W129-H133 AromaticContact CD2-CD2 3.35Å; W129-H133 AromaticContact CD2-NE2 4Å; W129-H133 AromaticContact CE2-CD2 3.15Å; W129-H133 AromaticContact CE2-CG 3.92Å; W129-H133 AromaticContact CE2-NE2 3.36Å; W129-H133 HydrophobicContact CE3-CB 4.32Å; W129-H133 AromaticContact CE3-CD2 3.89Å; W129-H133 AromaticContact CG-CD2 3.68Å; W129-H133 HydrophobicContact CH2-CB 4.15Å; W129-H133 AromaticContact CH2-CG 3.95Å; W129-H133 AromaticContact CZ2-CD2 3.54Å; W129-H133 AromaticContact CZ2-CG 3.84Å; W129-H133 AromaticContact CZ2-NE2 3.72Å; W129-H133 HydrophobicContact CZ3-CB 4.03Å; W129-H133 AromaticContact NE1-CD2 3.37Å; W129-H133 PolarHBondContact NE1-CD2 2.89Å; W129-H133 AromaticContact NE1-NE2 3.16Å; W129-H133 PolarHBondContact NE1-NE2 3.45Å; W129-H133 VanDerWaalsContact NE1-NE2 3.16Å; W129-H133 WeakPolarHBondContact O-CB 3.33Å; W129-H133 PolarHBondContact O-CD2 3.44Å; W129-H133 PolarHBondContact O-N 3.46Å; W129-V234 HydrophobicContact CH2-CG1 3.75Å; W129-V234 HydrophobicContact CZ2-CG1 3.71Å
130	F	95	Very high	92.9	Very high	35 Å²	35	69.7 Å²	69.7	15%	0.154	35%	0.353	C	S	.	.	H	α-helix	trans	-57.7	-51	179.6	174.7	-101.4	0	0	0	111.7	I100 R103 L104 E126 G127 L132 H133 F134	I100-F130 HydrophobicContact CG2-CE2 4.34Å; R103-F130 HydrophobicContact CB-CD2 3.94Å; R103-F130 HydrophobicContact CB-CE2 4.37Å; L104-F130 HydrophobicContact CD2-CE1 4.13Å; L104-F130 HydrophobicContact CD2-CE2 3.99Å; L104-F130 HydrophobicContact CD2-CZ 3.67Å; L104-F130 HydrophobicContact CG-CE2 4.2Å; L104-F130 HydrophobicContact CG-CZ 4.24Å; E126-F130 WeakPolarHBondContact O-CB 3.33Å; E126-F130 PolarHBondContact O-N 3.22Å; G127-F130 PolarHBondContact O-N 2.92Å; F130-L132 PolarHBondContact O-N 2.86Å; F130-H133 PolarHBondContact O-N 2.84Å; F130-F134 HydrophobicContact CE1-CD2 4.5Å; F130-F134 HydrophobicContact CE2-CD2 4.36Å; F130-F134 HydrophobicContact CZ-CB 4.45Å; F130-F134 AromaticContact CZ-CD2 3.9Å; F130-F134 HydrophobicContact CZ-CD2 3.9Å; F130-F134 HydrophobicContact CZ-CG 4.39Å; F130-F134 WeakPolarHBondContact O-CB 3.43Å; F130-F134 PolarHBondContact O-N 2.94Å
131	L	96.4	Very high	93.9	Very high	110 Å²	110	63.2 Å²	63.2	58%	0.576	33%	0.328	S	S	*	.	H	α-helix	trans	-59.8	-46.6	-179.7	-70.5	173.5	0	0	0	111.9	G127 W129 F134 T135	G127-L131 WeakPolarHBondContact O-CG 3.33Å; G127-L131 PolarHBondContact O-N 3.21Å; W129-L131 PolarHBondContact O-N 2.84Å; L131-F134 PolarHBondContact O-N 2.71Å; L131-T135 WeakPolarHBondContact O-CB 3.39Å; L131-T135 PolarHBondContact O-N 3.24Å; L131-T135 PolarHBondContact O-OG1 3.41Å; L131-T135 VanDerWaalsContact O-OG1 3.11Å
132	L	96	Very high	94.7	Very high	111 Å²	111	63.8 Å²	63.8	58%	0.581	34%	0.335	S	S	*	.	H	α-helix	trans	-58.8	-52.3	178.6	177.5	67.2	0	0	0	111.4	T128 W129 F130 T135 L136	T128-L132 WeakPolarHBondContact O-CB 3.49Å; T128-L132 PolarHBondContact O-N 3Å; W129-L132 PolarHBondContact O-N 3.48Å; F130-L132 PolarHBondContact O-N 2.86Å; L132-T135 PolarHBondContact O-N 3.21Å; L132-L136 VanDerWaalsContact O-CB 3.23Å; L132-L136 WeakPolarHBondContact O-CB 3.32Å; L132-L136 PolarHBondContact O-N 2.88Å
133	H	95.2	Very high	95.2	Very high	35 Å²	35	61.1 Å²	61.1	16%	0.162	32%	0.316	C	S	.	.	H	α-helix	trans	-72.5	-30.3	-175.5	-77.1	-79.8	0	0	0	112.6	W129 F130 S137 Y230	W129-H133 AromaticContact CD1-CD2 3.67Å; W129-H133 AromaticContact CD1-NE2 3.67Å; W129-H133 AromaticContact CD2-CD2 3.35Å; W129-H133 AromaticContact CD2-NE2 4Å; W129-H133 AromaticContact CE2-CD2 3.15Å; W129-H133 AromaticContact CE2-CG 3.92Å; W129-H133 AromaticContact CE2-NE2 3.36Å; W129-H133 HydrophobicContact CE3-CB 4.32Å; W129-H133 AromaticContact CE3-CD2 3.89Å; W129-H133 AromaticContact CG-CD2 3.68Å; W129-H133 HydrophobicContact CH2-CB 4.15Å; W129-H133 AromaticContact CH2-CG 3.95Å; W129-H133 AromaticContact CZ2-CD2 3.54Å; W129-H133 AromaticContact CZ2-CG 3.84Å; W129-H133 AromaticContact CZ2-NE2 3.72Å; W129-H133 HydrophobicContact CZ3-CB 4.03Å; W129-H133 AromaticContact NE1-CD2 3.37Å; W129-H133 PolarHBondContact NE1-CD2 2.89Å; W129-H133 AromaticContact NE1-NE2 3.16Å; W129-H133 PolarHBondContact NE1-NE2 3.45Å; W129-H133 VanDerWaalsContact NE1-NE2 3.16Å; W129-H133 WeakPolarHBondContact O-CB 3.33Å; W129-H133 PolarHBondContact O-CD2 3.44Å; W129-H133 PolarHBondContact O-N 3.46Å; F130-H133 PolarHBondContact O-N 2.84Å; H133-S137 WeakPolarHBondContact O-CB 3.39Å; H133-S137 PolarHBondContact O-N 3.24Å; H133-S137 PolarHBondContact O-OG 2.97Å; H133-Y230 WeakPolarHBondContact CA-OH 3.2Å; H133-Y230 WeakPolarHBondContact CB-OH 3.28Å; H133-Y230 VanDerWaalsContact CG-OH 3.26Å; H133-Y230 AromaticContact ND1-CE2 3.47Å; H133-Y230 WeakPolarHBondContact ND1-CE2 3.48Å; H133-Y230 AromaticContact ND1-CZ 3.32Å; H133-Y230 VanDerWaalsContact ND1-CZ 3.32Å; H133-Y230 PolarHBondContact ND1-OH 3.43Å; H133-Y230 PolarHBondContact O-OH 3.43Å
134	F	96	Very high	95.7	Very high	75 Å²	75	59.1 Å²	59.1	33%	0.329	31%	0.306	S	S	.	.	H	α-helix	trans	-64.2	-55.5	170.8	-176.9	-89	0	0	0	110.1	I100 F130 L131 L136 S137 H138	I100-F134 HydrophobicContact CD1-CD2 4.18Å; I100-F134 HydrophobicContact CD1-CE2 4.03Å; F130-F134 HydrophobicContact CE1-CD2 4.5Å; F130-F134 HydrophobicContact CE2-CD2 4.36Å; F130-F134 HydrophobicContact CZ-CB 4.45Å; F130-F134 AromaticContact CZ-CD2 3.9Å; F130-F134 HydrophobicContact CZ-CD2 3.9Å; F130-F134 HydrophobicContact CZ-CG 4.39Å; F130-F134 WeakPolarHBondContact O-CB 3.43Å; F130-F134 PolarHBondContact O-N 2.94Å; L131-F134 PolarHBondContact O-N 2.71Å; F134-L136 PolarHBondContact O-N 3.5Å; F134-S137 PolarHBondContact O-N 2.98Å; F134-S137 PolarHBondContact O-OG 3.36Å; F134-H138 AromaticContact CD2-CE1 3.55Å; F134-H138 AromaticContact CE1-CE1 3.92Å; F134-H138 AromaticContact CE2-CE1 3.26Å; F134-H138 WeakPolarHBondContact CE2-CE1 3.41Å; F134-H138 AromaticContact CE2-NE2 3.86Å; F134-H138 AromaticContact CG-CE1 3.99Å; F134-H138 AromaticContact CZ-CE1 3.46Å; F134-H138 VanDerWaalsContact CZ-CE1 3.46Å; F134-H138 WeakPolarHBondContact CZ-CE1 3.21Å; F134-H138 AromaticContact CZ-NE2 3.75Å; F134-H138 PolarHBondContact O-N 2.91Å; F134-H138 VanDerWaalsContact O-N 3.15Å; F134-H138 PolarHBondContact O-ND1 3.05Å
135	T	96.9	Very high	96	Very high	92 Å²	92	51.4 Å²	51.4	56%	0.564	28%	0.277	S	S	*	.	H	α-helix	trans	-61.5	-44.7	-179.5	-58.8	0	0	0	0	111.8	L131 L132 H138 L139	L131-T135 WeakPolarHBondContact O-CB 3.39Å; L131-T135 PolarHBondContact O-N 3.24Å; L131-T135 PolarHBondContact O-OG1 3.41Å; L131-T135 VanDerWaalsContact O-OG1 3.11Å; L132-T135 PolarHBondContact O-N 3.21Å; T135-H138 PolarHBondContact O-N 2.87Å; T135-L139 WeakPolarHBondContact O-CB 3.43Å; T135-L139 PolarHBondContact O-N 3.48Å
136	L	96.2	Very high	96.3	Very high	68 Å²	68	50.4 Å²	50.4	36%	0.356	27%	0.266	S	S	.	.	H	α-helix	trans	-64	-45.8	-179.7	-179.4	58.1	0	0	0	112.3	L132 F134 H138 L139 I140 Y230	L132-L136 VanDerWaalsContact O-CB 3.23Å; L132-L136 WeakPolarHBondContact O-CB 3.32Å; L132-L136 PolarHBondContact O-N 2.88Å; F134-L136 PolarHBondContact O-N 3.5Å; L136-H138 VanDerWaalsContact C-N 3.35Å; L136-H138 PolarHBondContact O-N 2.92Å; L136-L139 PolarHBondContact O-N 2.86Å; L136-I140 HydrophobicContact CD1-CD1 3.87Å; L136-I140 HydrophobicContact CD1-CG1 4.19Å; L136-I140 HydrophobicContact CG-CD1 3.85Å; L136-I140 VanDerWaalsContact O-CG1 3.29Å; L136-I140 WeakPolarHBondContact O-CG1 3.26Å; L136-I140 PolarHBondContact O-N 3.25Å; L136-Y230 HydrophobicContact CD2-CD2 4.25Å; L136-Y230 HydrophobicContact CD2-CE2 3.64Å; L136-Y230 HydrophobicContact CG-CE2 4.23Å
137	S	96.3	Very high	96.7	Very high	13 Å²	13	48.2 Å²	48.2	9%	0.091	26%	0.256	C	S	.	.	H	α-helix	trans	-62.2	-41.8	179.3	57.2	0	0	0	0	112.1	H133 F134 I140 V141	H133-S137 WeakPolarHBondContact O-CB 3.39Å; H133-S137 PolarHBondContact O-N 3.24Å; H133-S137 PolarHBondContact O-OG 2.97Å; F134-S137 PolarHBondContact O-N 2.98Å; F134-S137 PolarHBondContact O-OG 3.36Å; S137-I140 PolarHBondContact O-N 3Å; S137-V141 WeakPolarHBondContact O-CB 3.5Å; S137-V141 VanDerWaalsContact O-CG2 3.26Å; S137-V141 WeakPolarHBondContact O-CG2 3.4Å; S137-V141 PolarHBondContact O-N 3.25Å
138	H	97.3	Very high	96.9	Very high	46 Å²	46	47.9 Å²	47.9	21%	0.213	25%	0.25	C	C	.	.	H	α-helix	trans	-67.6	-39.5	178	-72.4	74.7	0	0	0	112.4	Y96 F134 T135 L136 V141 A142	Y96-H138 AromaticContact CZ-NE2 3.54Å; Y96-H138 PolarHBondContact OH-CD2 3.15Å; Y96-H138 PolarHBondContact OH-NE2 3.3Å; F134-H138 AromaticContact CD2-CE1 3.55Å; F134-H138 AromaticContact CE1-CE1 3.92Å; F134-H138 AromaticContact CE2-CE1 3.26Å; F134-H138 WeakPolarHBondContact CE2-CE1 3.41Å; F134-H138 AromaticContact CE2-NE2 3.86Å; F134-H138 AromaticContact CG-CE1 3.99Å; F134-H138 AromaticContact CZ-CE1 3.46Å; F134-H138 VanDerWaalsContact CZ-CE1 3.46Å; F134-H138 WeakPolarHBondContact CZ-CE1 3.21Å; F134-H138 AromaticContact CZ-NE2 3.75Å; F134-H138 PolarHBondContact O-N 2.91Å; F134-H138 VanDerWaalsContact O-N 3.15Å; F134-H138 PolarHBondContact O-ND1 3.05Å; T135-H138 PolarHBondContact O-N 2.87Å; L136-H138 VanDerWaalsContact C-N 3.35Å; L136-H138 PolarHBondContact O-N 2.92Å; H138-V141 PolarHBondContact O-N 3.4Å; H138-A142 VanDerWaalsContact O-CB 3.3Å; H138-A142 WeakPolarHBondContact O-CB 3.45Å; H138-A142 PolarHBondContact O-N 2.92Å
139	L	97.6	Very high	97.1	Very high	63 Å²	63	46.8 Å²	46.8	33%	0.33	24%	0.241	S	C	.	.	H	α-helix	trans	-63.1	-43.7	175.5	-176.6	63.1	0	0	0	111.6	T135 L136 A142 N143 L378 L379	T135-L139 WeakPolarHBondContact O-CB 3.43Å; T135-L139 PolarHBondContact O-N 3.48Å; L136-L139 PolarHBondContact O-N 2.86Å; L139-A142 PolarHBondContact O-N 3.46Å; L139-N143 WeakPolarHBondContact O-CB 3.41Å; L139-N143 PolarHBondContact O-N 3.48Å; L139-N143 PolarHBondContact O-ND2 3.4Å; L139-L378 WeakPolarHBondContact CD1-O 3.49Å; L139-L379 HydrophobicContact CD1-CD2 4.08Å
140	I	98.2	Very high	97.3	Very high	10 Å²	10	44.4 Å²	44.4	5%	0.051	23%	0.234	C	C	.	.	H	α-helix	trans	-62.1	-50.5	176.6	-69.9	164.2	0	0	0	110.3	L136 S137 A142 N143 V144 I226	L136-I140 HydrophobicContact CD1-CD1 3.87Å; L136-I140 HydrophobicContact CD1-CG1 4.19Å; L136-I140 HydrophobicContact CG-CD1 3.85Å; L136-I140 VanDerWaalsContact O-CG1 3.29Å; L136-I140 WeakPolarHBondContact O-CG1 3.26Å; L136-I140 PolarHBondContact O-N 3.25Å; S137-I140 PolarHBondContact O-N 3Å; I140-A142 VanDerWaalsContact C-N 3.34Å; I140-A142 PolarHBondContact O-N 3.46Å; I140-N143 PolarHBondContact O-N 3.33Å; I140-V144 HydrophobicContact CG2-CG2 4.28Å; I140-V144 WeakPolarHBondContact O-CG2 3.45Å; I140-V144 PolarHBondContact O-N 2.95Å; I140-I226 HydrophobicContact CD1-CG2 3.88Å; I140-I226 HydrophobicContact CG1-CG2 4.3Å
141	V	97.1	Very high	97.5	Very high	36 Å²	36	42.8 Å²	42.8	22%	0.218	23%	0.227	C	C	.	.	H	α-helix	trans	-55.6	-49.6	178.3	162.9	0	0	0	0	110.7	L92 S137 H138 N143 V144 Y145	L92-V141 HydrophobicContact CD2-CG1 3.66Å; L92-V141 HydrophobicContact CD2-CG2 4.25Å; S137-V141 WeakPolarHBondContact O-CB 3.5Å; S137-V141 VanDerWaalsContact O-CG2 3.26Å; S137-V141 WeakPolarHBondContact O-CG2 3.4Å; S137-V141 PolarHBondContact O-N 3.25Å; H138-V141 PolarHBondContact O-N 3.4Å; V141-N143 VanDerWaalsContact C-N 3.3Å; V141-N143 PolarHBondContact O-N 2.81Å; V141-V144 PolarHBondContact O-N 3.41Å; V141-Y145 HydrophobicContact CG1-CD2 3.83Å; V141-Y145 HydrophobicContact CG1-CE2 4Å; V141-Y145 WeakPolarHBondContact O-CD2 3.35Å; V141-Y145 PolarHBondContact O-N 3.35Å
142	A	98	Very high	97.5	Very high	42 Å²	42	38.7 Å²	38.7	35%	0.347	21%	0.207	S	C	.	.	H	α-helix	trans	-58.5	-43.5	180	0	0	0	0	0	111.6	H138 L139 I140 F146 P380	H138-A142 VanDerWaalsContact O-CB 3.3Å; H138-A142 WeakPolarHBondContact O-CB 3.45Å; H138-A142 PolarHBondContact O-N 2.92Å; L139-A142 PolarHBondContact O-N 3.46Å; I140-A142 VanDerWaalsContact C-N 3.34Å; I140-A142 PolarHBondContact O-N 3.46Å; A142-F146 WeakPolarHBondContact O-CB 3.43Å; A142-F146 PolarHBondContact O-N 3.39Å; A142-P380 HydrophobicContact CB-CG 3.9Å
143	N	98.5	Very high	97.6	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-66.9	-42.2	176.8	-83.3	-72.9	0	0	0	112.9	L139 I140 V141 F146 H147 F223 L378	L139-N143 WeakPolarHBondContact O-CB 3.41Å; L139-N143 PolarHBondContact O-N 3.48Å; L139-N143 PolarHBondContact O-ND2 3.4Å; I140-N143 PolarHBondContact O-N 3.33Å; V141-N143 VanDerWaalsContact C-N 3.3Å; V141-N143 PolarHBondContact O-N 2.81Å; N143-F146 PolarHBondContact O-N 3.22Å; N143-H147 WeakPolarHBondContact O-CB 3.28Å; N143-H147 PolarHBondContact O-CD2 3.46Å; N143-H147 VanDerWaalsContact O-CD2 3.3Å; N143-H147 PolarHBondContact O-N 2.82Å; N143-F223 HydrophobicContact CB-CB 4.25Å; N143-F223 HydrophobicContact CB-CD1 3.69Å; N143-F223 HydrophobicContact CB-CD2 3.57Å; N143-F223 HydrophobicContact CB-CE1 3.81Å; N143-F223 HydrophobicContact CB-CE2 3.69Å; N143-F223 HydrophobicContact CB-CG 3.57Å; N143-F223 HydrophobicContact CB-CZ 3.81Å; N143-L378 PolarHBondContact ND2-O 3Å
144	V	98.6	Very high	97.7	Very high	9 Å²	9	40 Å²	40	6%	0.055	21%	0.214	C	C	.	.	H	α-helix	trans	-57.1	-53.8	175.6	169.1	0	0	0	0	110.1	L88 I140 V141 Y148 F223 M224	L88-V144 HydrophobicContact CD1-CG1 4.1Å; L88-V144 HydrophobicContact CD2-CG1 3.79Å; I140-V144 HydrophobicContact CG2-CG2 4.28Å; I140-V144 WeakPolarHBondContact O-CG2 3.45Å; I140-V144 PolarHBondContact O-N 2.95Å; V141-V144 PolarHBondContact O-N 3.41Å; V144-Y148 WeakPolarHBondContact O-CB 3.39Å; V144-Y148 PolarHBondContact O-N 3.02Å; V144-F223 HydrophobicContact CG2-CB 3.7Å; V144-M224 HydrophobicContact CG1-CG 3.81Å; V144-M224 HydrophobicContact CG2-CG 4.14Å
145	Y	97.9	Very high	97.8	Very high	46 Å²	46	40.7 Å²	40.7	18%	0.18	22%	0.221	C	C	.	.	H	α-helix	trans	-61.3	-49.4	-179.9	-88.1	-84.5	0	0	0	111.7	L85 L88 C89 L92 V141 L149	L85-Y145 HydrophobicContact CD2-CE1 4.5Å; L88-Y145 HydrophobicContact CB-CE1 4.2Å; L88-Y145 HydrophobicContact CB-CE2 4.04Å; L88-Y145 VanDerWaalsContact CB-OH 3.25Å; L88-Y145 WeakPolarHBondContact CB-OH 3.3Å; L88-Y145 HydrophobicContact CD1-CD1 4.5Å; L88-Y145 HydrophobicContact CD1-CE1 4.23Å; L88-Y145 HydrophobicContact CD1-CE2 4.49Å; L88-Y145 PolarHBondContact O-OH 3.28Å; C89-Y145 PolarHBondContact N-OH 3.48Å; L92-Y145 HydrophobicContact CD1-CE2 3.77Å; L92-Y145 VanDerWaalsContact CD1-OH 3.28Å; L92-Y145 WeakPolarHBondContact CD1-OH 3.31Å; L92-Y145 HydrophobicContact CG-CE2 4.23Å; V141-Y145 HydrophobicContact CG1-CD2 3.83Å; V141-Y145 HydrophobicContact CG1-CE2 4Å; V141-Y145 WeakPolarHBondContact O-CD2 3.35Å; V141-Y145 PolarHBondContact O-N 3.35Å; Y145-L149 HydrophobicContact CD1-CD1 4.41Å; Y145-L149 WeakPolarHBondContact O-CB 3.25Å; Y145-L149 WeakPolarHBondContact O-CG 3.35Å; Y145-L149 PolarHBondContact O-N 2.96Å
146	F	98.6	Very high	97.8	Very high	60 Å²	60	36.6 Å²	36.6	26%	0.263	20%	0.196	S	C	.	.	H	α-helix	trans	-59.8	-51.4	-178	176.4	-95.2	0	0	0	112.3	A142 N143 S150 H216 P380 S381	A142-F146 WeakPolarHBondContact O-CB 3.43Å; A142-F146 PolarHBondContact O-N 3.39Å; N143-F146 PolarHBondContact O-N 3.22Å; F146-S150 WeakPolarHBondContact O-CB 3.47Å; F146-S150 PolarHBondContact O-N 3.4Å; F146-S150 PolarHBondContact O-OG 2.92Å; F146-H216 AromaticContact CE1-CE1 3.81Å; F146-H216 AromaticContact CE1-ND1 3.95Å; F146-P380 HydrophobicContact CB-CB 3.69Å; F146-P380 HydrophobicContact CD1-CB 3.91Å; F146-P380 HydrophobicContact CD2-CB 3.98Å; F146-P380 HydrophobicContact CG-CB 3.57Å; F146-S381 VanDerWaalsContact CE1-C 3.43Å; F146-S381 WeakPolarHBondContact CE1-O 3.44Å; F146-S381 VanDerWaalsContact CZ-C 3.45Å
147	H	98.7	Very high	97.9	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-72.4	-38	-176.8	-74.7	-61.8	0	0	0	112.5	N143 S150 A151 H216 L219 A220 F223	N143-H147 WeakPolarHBondContact O-CB 3.28Å; N143-H147 PolarHBondContact O-CD2 3.46Å; N143-H147 VanDerWaalsContact O-CD2 3.3Å; N143-H147 PolarHBondContact O-N 2.82Å; H147-S150 PolarHBondContact O-N 2.84Å; H147-A151 PolarHBondContact O-N 3.49Å; H147-H216 WeakPolarHBondContact CB-O 3.18Å; H147-H216 AromaticContact CE1-ND1 3.8Å; H147-H216 AromaticContact ND1-CE1 3.89Å; H147-H216 AromaticContact ND1-CG 3.88Å; H147-H216 AromaticContact ND1-ND1 3.1Å; H147-H216 PolarHBondContact ND1-ND1 3.44Å; H147-H216 VanDerWaalsContact ND1-ND1 3.1Å; H147-L219 HydrophobicContact CB-CB 4.22Å; H147-L219 WeakPolarHBondContact CE1-CD1 3.45Å; H147-A220 HydrophobicContact CB-CB 3.99Å; H147-F223 AromaticContact CD2-CD2 3.95Å
148	Y	98.6	Very high	97.9	Very high	8 Å²	8	36 Å²	36	3%	0.031	19%	0.193	C	C	.	.	H	α-helix	trans	-64.3	-50	175.4	180	-111.2	0	0	0	111.4	I81 V84 L85 L88 V144 S150 A151 V152 W204 T205	I81-Y148 WeakPolarHBondContact CA-OH 3.43Å; V84-Y148 HydrophobicContact CB-CE1 4.1Å; V84-Y148 WeakPolarHBondContact CB-OH 3.2Å; V84-Y148 HydrophobicContact CG1-CD1 4.15Å; V84-Y148 HydrophobicContact CG1-CE1 3.55Å; V84-Y148 HydrophobicContact CG1-CE2 4.04Å; V84-Y148 VanDerWaalsContact CG1-CZ 3.5Å; L85-Y148 HydrophobicContact CD2-CD1 4.12Å; L85-Y148 HydrophobicContact CD2-CE1 3.93Å; L85-Y148 HydrophobicContact CG-CE1 4.31Å; L88-Y148 HydrophobicContact CD1-CD1 4.48Å; V144-Y148 WeakPolarHBondContact O-CB 3.39Å; V144-Y148 PolarHBondContact O-N 3.02Å; Y148-S150 VanDerWaalsContact C-N 3.28Å; Y148-S150 PolarHBondContact O-N 3.41Å; Y148-A151 PolarHBondContact O-N 3.44Å; Y148-A151 VanDerWaalsContact O-N 3.11Å; Y148-V152 HydrophobicContact CD1-CG2 4.49Å; Y148-V152 HydrophobicContact CE1-CG2 4.11Å; Y148-V152 HydrophobicContact CE2-CG2 4.23Å; Y148-V152 WeakPolarHBondContact O-CG2 3.45Å; Y148-V152 PolarHBondContact O-N 3.17Å; Y148-W204 PolarHBondContact OH-O 2.97Å; Y148-T205 HydrophobicContact CE2-CG2 4.2Å
149	L	98.3	Very high	97.7	Very high	60 Å²	60	34.3 Å²	34.3	31%	0.314	19%	0.186	S	C	.	.	H	α-helix	trans	-63.2	-35.8	177.1	-68.5	175	0	0	0	111.8	L85 Y145 A151 V152 L153	L85-L149 HydrophobicContact CD2-CD2 4.04Å; Y145-L149 HydrophobicContact CD1-CD1 4.41Å; Y145-L149 WeakPolarHBondContact O-CB 3.25Å; Y145-L149 WeakPolarHBondContact O-CG 3.35Å; Y145-L149 PolarHBondContact O-N 2.96Å; L149-A151 PolarHBondContact O-N 2.91Å; L149-V152 PolarHBondContact O-N 3.25Å; L149-L153 HydrophobicContact CB-CD1 4.29Å; L149-L153 VanDerWaalsContact O-CB 3.28Å; L149-L153 WeakPolarHBondContact O-CB 3.35Å; L149-L153 VanDerWaalsContact O-CG 3.29Å; L149-L153 WeakPolarHBondContact O-CG 3.4Å; L149-L153 PolarHBondContact O-N 3.33Å
150	S	98.6	Very high	97.3	Very high	13 Å²	13	33.9 Å²	33.9	9%	0.091	19%	0.187	C	C	.	.	H	α-helix	trans	-60.3	-44.5	172.5	-65.2	0	0	0	0	111.8	F146 H147 Y148 V152 L153 I154 H216	F146-S150 WeakPolarHBondContact O-CB 3.47Å; F146-S150 PolarHBondContact O-N 3.4Å; F146-S150 PolarHBondContact O-OG 2.92Å; H147-S150 PolarHBondContact O-N 2.84Å; Y148-S150 VanDerWaalsContact C-N 3.28Å; Y148-S150 PolarHBondContact O-N 3.41Å; S150-V152 PolarHBondContact O-N 2.87Å; S150-L153 PolarHBondContact O-N 3.42Å; S150-I154 WeakPolarHBondContact O-CB 3.39Å; S150-I154 VanDerWaalsContact O-CG1 3.27Å; S150-I154 WeakPolarHBondContact O-CG1 3.2Å; S150-I154 PolarHBondContact O-N 2.91Å; S150-H216 VanDerWaalsContact CB-CG 3.45Å; S150-H216 WeakPolarHBondContact CB-ND1 3.11Å; S150-H216 PolarHBondContact OG-ND1 2.99Å
151	A	98.5	Very high	96.5	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.008	23%	0.226	C	C	.	.	H	α-helix	trans	-65.9	-28	177.5	0	0	0	0	0	113	H147 Y148 L149 T205 N207 H216 F217	H147-A151 PolarHBondContact O-N 3.49Å; Y148-A151 PolarHBondContact O-N 3.44Å; Y148-A151 VanDerWaalsContact O-N 3.11Å; L149-A151 PolarHBondContact O-N 2.91Å; A151-T205 HydrophobicContact CB-CG2 3.95Å; A151-N207 WeakPolarHBondContact O-CB 3.42Å; A151-N207 PolarHBondContact O-ND2 2.91Å; A151-H216 HydrophobicContact CB-CB 4.46Å; A151-F217 HydrophobicContact CB-CB 4.24Å
152	V	97.4	Very high	95.2	Very high	25 Å²	25	44.3 Å²	44.3	15%	0.152	23%	0.234	C	C	.	.	H	α-helix	trans	-78.9	-46.3	176.5	173.7	0	0	0	0	112	I81 Y148 L149 S150 T205 N207	I81-V152 HydrophobicContact CD1-CG1 3.79Å; I81-V152 HydrophobicContact CD1-CG2 4.36Å; I81-V152 HydrophobicContact CG1-CG2 4.32Å; Y148-V152 HydrophobicContact CD1-CG2 4.49Å; Y148-V152 HydrophobicContact CE1-CG2 4.11Å; Y148-V152 HydrophobicContact CE2-CG2 4.23Å; Y148-V152 WeakPolarHBondContact O-CG2 3.45Å; Y148-V152 PolarHBondContact O-N 3.17Å; L149-V152 PolarHBondContact O-N 3.25Å; S150-V152 PolarHBondContact O-N 2.87Å; V152-T205 HydrophobicContact CG2-CG2 4.36Å; V152-N207 PolarHBondContact O-ND2 3.46Å
153	L	97.5	Very high	93.3	Very high	134 Å²	134	47.1 Å²	47.1	70%	0.702	25%	0.249	S	C	*	.	H	α-helix	trans	-98.8	-27	-164.2	-61	174.3	0	0	0	114.1	L149 S150	L149-L153 HydrophobicContact CB-CD1 4.29Å; L149-L153 VanDerWaalsContact O-CB 3.28Å; L149-L153 WeakPolarHBondContact O-CB 3.35Å; L149-L153 VanDerWaalsContact O-CG 3.29Å; L149-L153 WeakPolarHBondContact O-CG 3.4Å; L149-L153 PolarHBondContact O-N 3.33Å; S150-L153 PolarHBondContact O-N 3.42Å
154	I	97.8	Very high	91.3	Very high	40 Å²	40	54.5 Å²	54.5	21%	0.205	28%	0.278	C	S	.	.	S	Bend	trans	-74.6	138.7	-177.5	-64.1	178.2	0	0	0	110	S150 N207 T213 Y382	S150-I154 WeakPolarHBondContact O-CB 3.39Å; S150-I154 VanDerWaalsContact O-CG1 3.27Å; S150-I154 WeakPolarHBondContact O-CG1 3.2Å; S150-I154 PolarHBondContact O-N 2.91Å; I154-N207 PolarHBondContact O-ND2 3.35Å; I154-T213 HydrophobicContact CB-CG2 4.02Å; I154-T213 HydrophobicContact CG2-CG2 4.21Å; I154-T213 WeakPolarHBondContact O-CG2 3.15Å; I154-Y382 HydrophobicContact CD1-CD2 3.7Å; I154-Y382 HydrophobicContact CD1-CE2 3.73Å
155	N	97.7	Very high	89.1	Confident	88 Å²	88	61.3 Å²	61.3	47%	0.471	31%	0.314	S	S	.	.			trans	-58.6	124.6	171.1	-175.8	-61.9	0	0	0	109.3	G157 N158 Y212	N155-G157 PolarHBondContact O-N 3.32Å; N155-G157 WeakPolarHBondContact OD1-CA 3.44Å; N155-G157 PolarHBondContact OD1-N 3.13Å; N155-N158 PolarHBondContact OD1-N 3.45Å; N155-N158 PolarHBondContact OD1-OD1 3.42Å; N155-Y212 WeakPolarHBondContact O-CB 3.3Å
156	P	97.5	Very high	87.2	Confident	6 Å²	6	64.3 Å²	64.3	4%	0.039	34%	0.337	C	S	.	.			trans	-66.6	-11.1	-174.2	30	-39	0	0	0	114.2	I195 N207 C208 G210 L211 Y212 T213	P156-I195 HydrophobicContact CB-CG2 3.99Å; P156-I195 HydrophobicContact CG-CD1 3.82Å; P156-I195 HydrophobicContact CG-CG2 4.34Å; P156-N207 WeakPolarHBondContact CD-OD1 3.39Å; P156-C208 HydrophobicContact CB-CB 3.73Å; P156-C208 VanDerWaalsContact CB-O 3.28Å; P156-C208 WeakPolarHBondContact CB-O 3.45Å; P156-C208 HydrophobicContact CG-CB 3.89Å; P156-G210 CarbonylContact O-C 3.6Å; P156-G210 VanDerWaalsContact O-C 3.27Å; P156-G210 WeakPolarHBondContact O-CA 3.41Å; P156-L211 PolarHBondContact O-N 3.26Å; P156-Y212 PolarHBondContact O-N 2.89Å; P156-T213 HydrophobicContact CB-CG2 4.33Å
157	G	96.8	Very high	85.1	Confident	2 Å²	2	63.4 Å²	63.4	2%	0.021	34%	0.339	C	S	.	.			trans	107.3	70.4	-176.5	0	0	0	0	0	110.4	N155 I195 L196	N155-G157 PolarHBondContact O-N 3.32Å; N155-G157 WeakPolarHBondContact OD1-CA 3.44Å; N155-G157 PolarHBondContact OD1-N 3.13Å; G157-I195 CarbonylContact O-C 3.57Å; G157-I195 WeakPolarHBondContact O-CA 3.47Å; G157-L196 WeakPolarHBondContact O-CB 3.47Å; G157-L196 VanDerWaalsContact O-CG 3.3Å; G157-L196 WeakPolarHBondContact O-CG 3.27Å; G157-L196 PolarHBondContact O-N 3.22Å
158	N	96.1	Very high	83.1	Confident	68 Å²	68	66.4 Å²	66.4	36%	0.364	36%	0.36	S	S	.	.	B	Isolated β-bridge	trans	-65.2	138	175.5	-66.2	20	0	0	0	110.4	N155 P160	N155-N158 PolarHBondContact OD1-N 3.45Å; N155-N158 PolarHBondContact OD1-OD1 3.42Å; N158-P160 WeakPolarHBondContact O-CD 3.35Å
159	V	93.8	Very high	81.2	Confident	9 Å²	9	74.4 Å²	74.4	6%	0.055	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-67	123.3	169.7	-178	0	0	0	0	108	L179 P182 A185 C194 L196	V159-L179 HydrophobicContact CB-CD1 4.37Å; V159-L179 HydrophobicContact CG1-CD1 3.79Å; V159-P182 HydrophobicContact CG1-CG 4.37Å; V159-A185 HydrophobicContact CG2-CB 4.03Å; V159-C194 HydrophobicContact CB-CB 3.88Å; V159-C194 HydrophobicContact CG2-CB 3.57Å; V159-C194 PolarHBondContact N-O 3.46Å; V159-L196 HydrophobicContact CG2-CD2 3.75Å; V159-L196 HydrophobicContact CG2-CG 4.01Å
160	P	89.7	Confident	79.8	Confident	55 Å²	55	75.1 Å²	75.1	36%	0.357	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-63.6	149.8	178	27	-34.2	0	0	0	110.6	N158 I162 F390	N158-P160 WeakPolarHBondContact O-CD 3.35Å; P160-I162 HydrophobicContact CB-CD1 4.37Å; P160-I162 HydrophobicContact CB-CG1 4.07Å; P160-I162 HydrophobicContact CG-CD1 3.76Å; P160-I162 HydrophobicContact CG-CG1 3.93Å; P160-I162 PolarHBondContact O-N 2.81Å; P160-F390 HydrophobicContact CG-CE1 4.04Å; P160-F390 HydrophobicContact CG-CZ 3.76Å
161	Q	80.6	Confident	78.6	Confident	186 Å²	186	76.7 Å²	76.7	87%	0.869	42%	0.417	S	S	*	.			trans	-74.2	73.1	174.1	-68.8	-177.1	-17.6	0	0	109.9
162	I	70.5	Confident	77.9	Confident	78 Å²	78	79.9 Å²	79.9	40%	0.4	44%	0.437	S	S	.	.			trans	-93.1	125.2	171.8	-54	175.2	0	0	0	107.6	P160 T166	P160-I162 HydrophobicContact CB-CD1 4.37Å; P160-I162 HydrophobicContact CB-CG1 4.07Å; P160-I162 HydrophobicContact CG-CD1 3.76Å; P160-I162 HydrophobicContact CG-CG1 3.93Å; P160-I162 PolarHBondContact O-N 2.81Å; I162-T166 HydrophobicContact CG2-CG2 4.38Å; I162-T166 WeakPolarHBondContact CG2-OG1 3.23Å
163	P	57.8	Low	77.4	Confident	102 Å²	102	82.8 Å²	82.8	66%	0.662	46%	0.455	S	S	*	.			trans	-56.3	146.7	176.4	-23.5	32.4	0	0	0	112.2	N165 T166	P163-N165 PolarHBondContact O-N 3.11Å; P163-T166 PolarHBondContact O-OG1 2.99Å
164	Y	56.8	Low	77.1	Confident	155 Å²	155	76.7 Å²	76.7	61%	0.608	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-42.1	-35.6	-176	176	-99.8	0	0	0	115.3	T166 S167	Y164-T166 PolarHBondContact O-N 3.29Å; Y164-S167 PolarHBondContact O-N 3.21Å; Y164-S167 PolarHBondContact O-OG 3.05Å
165	N	53	Low	76.7	Confident	151 Å²	151	79.3 Å²	79.3	81%	0.807	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-69.8	3.4	-168.8	-77	2.4	0	0	0	117	P163	P163-N165 PolarHBondContact O-N 3.11Å
166	T	56.8	Low	76.4	Confident	109 Å²	109	82.7 Å²	82.7	67%	0.669	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-108.8	9.7	179.1	54.4	0	0	0	0	113.8	I162 P163 Y164	I162-T166 HydrophobicContact CG2-CG2 4.38Å; I162-T166 WeakPolarHBondContact CG2-OG1 3.23Å; P163-T166 PolarHBondContact O-OG1 2.99Å; Y164-T166 PolarHBondContact O-N 3.29Å
167	S	54	Low	76	Confident	42 Å²	42	84 Å²	84	29%	0.294	46%	0.461	S	S	.	.			trans	-90.6	138.8	-164.4	-47.7	0	0	0	0	114.4	Y164 S180	Y164-S167 PolarHBondContact O-N 3.21Å; Y164-S167 PolarHBondContact O-OG 3.05Å; S167-S180 WeakPolarHBondContact CB-OG 3.37Å; S167-S180 WeakPolarHBondContact OG-CB 3.17Å; S167-S180 PolarHBondContact OG-OG 3.01Å
168	S	57.9	Low	75.7	Confident	63 Å²	63	92.5 Å²	92.5	44%	0.441	50%	0.497	S	S	.	.			trans	-60.7	151.9	160.3	70.4	0	0	0	0	111.5	T170 N171	S168-T170 PolarHBondContact O-N 3.43Å; S168-N171 PolarHBondContact O-N 3.18Å
169	N	58.5	Low	75.2	Confident	176 Å²	176	89.8 Å²	89.8	94%	0.941	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-1.7	-178.7	-92.5	-3.5	0	0	0	116.1
170	T	67.7	Low	74.9	Confident	74 Å²	74	90.1 Å²	90.1	45%	0.454	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	2.1	-170.1	72.7	0	0	0	0	115.1	S168 K183	S168-T170 PolarHBondContact O-N 3.43Å; T170-K183 VanDerWaalsContact CB-CE 3.43Å; T170-K183 WeakPolarHBondContact OG1-CE 3.29Å; T170-K183 PolarHBondContact OG1-NZ 3.4Å
171	N	75.1	Confident	74.9	Confident	46 Å²	46	90.2 Å²	90.2	25%	0.246	48%	0.479	C	S	.	.	P	Polyproline II helix	trans	-82.7	150.3	178.2	-73.7	-5.1	0	0	0	112	S168 S180	S168-N171 PolarHBondContact O-N 3.18Å; N171-S180 VanDerWaalsContact CB-OG 3.31Å; N171-S180 WeakPolarHBondContact CB-OG 3.44Å; N171-S180 PolarHBondContact ND2-OG 3.11Å
172	T	83.2	Confident	75.3	Confident	68 Å²	68	81.5 Å²	81.5	42%	0.417	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	151	174.8	56.4	0	0	0	0	110.2	R181	T172-R181 PolarHBondContact N-O 3.18Å; T172-R181 VanDerWaalsContact N-O 3.12Å; T172-R181 WeakPolarHBondContact O-CA 3.28Å; T172-R181 WeakPolarHBondContact O-CB 3.31Å; T172-R181 PolarHBondContact O-N 3.45Å; T172-R181 PolarHBondContact OG1-NE 2.76Å; T172-R181 PolarHBondContact OG1-NH2 3.44Å
173	T	85.8	Confident	76.2	Confident	87 Å²	87	81.8 Å²	81.8	53%	0.534	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	133.8	175.9	-54.4	0	0	0	0	110.8
174	C	91.1	Very high	77.9	Confident	5 Å²	5	78.2 Å²	78.2	3%	0.034	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	116	170.3	-177.7	0	0	0	0	110.6	R176 C177 F178 L179 C194	C174-R176 PolarHBondContact O-N 3.32Å; C174-C177 HydrophobicContact CB-CB 4.13Å; C174-C177 PolarHBondContact SG-N 3.22Å; C174-C177 VanDerWaalsContact SG-N 3.43Å; C174-F178 WeakPolarHBondContact O-CA 3.18Å; C174-F178 PolarHBondContact O-N 3.01Å; C174-L179 PolarHBondContact N-O 3.4Å; C174-C194 PolarHBondContact SG-SG 3.02Å
175	S	90	Very high	79.7	Confident	96 Å²	96	71 Å²	71	67%	0.671	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-16.7	178.7	56.9	0	0	0	0	115.1	F178	S175-F178 WeakPolarHBondContact O-CE1 3.35Å; S175-F178 WeakPolarHBondContact O-CZ 3.5Å
176	R	91.3	Very high	81.7	Confident	158 Å²	158	65.4 Å²	65.4	60%	0.596	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-31.8	179.7	-66.6	-179	179.8	177.2	1.1	113.4	C174 H187	C174-R176 PolarHBondContact O-N 3.32Å; R176-H187 VanDerWaalsContact CD-NE2 3.33Å; R176-H187 WeakPolarHBondContact CD-NE2 3.25Å
177	C	90.3	Very high	83.6	Confident	35 Å²	35	61.9 Å²	61.9	24%	0.236	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-11.1	-179.8	-64.6	0	0	0	0	112.7	C174 L179 H187	C174-C177 HydrophobicContact CB-CB 4.13Å; C174-C177 PolarHBondContact SG-N 3.22Å; C174-C177 VanDerWaalsContact SG-N 3.43Å; C177-L179 HydrophobicContact CB-CD1 4.49Å; C177-L179 HydrophobicContact CB-CD2 3.66Å; C177-L179 HydrophobicContact CB-CG 3.63Å; C177-L179 PolarHBondContact O-N 3.41Å; C177-H187 VanDerWaalsContact SG-CE1 3.57Å; C177-H187 PolarHBondContact SG-ND1 2.87Å
178	F	88.9	Confident	85.6	Confident	179 Å²	179	60 Å²	60	79%	0.785	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	38.2	-177.1	-54.5	-79.2	0	0	0	113.6	C174 S175	C174-F178 WeakPolarHBondContact O-CA 3.18Å; C174-F178 PolarHBondContact O-N 3.01Å; S175-F178 WeakPolarHBondContact O-CE1 3.35Å; S175-F178 WeakPolarHBondContact O-CZ 3.5Å
179	L	87	Confident	87.2	Confident	12 Å²	12	59.2 Å²	59.2	6%	0.063	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	159	-179.8	61.6	78.8	0	0	0	111.7	V159 C174 C177 R181 C194	V159-L179 HydrophobicContact CB-CD1 4.37Å; V159-L179 HydrophobicContact CG1-CD1 3.79Å; C174-L179 PolarHBondContact N-O 3.4Å; C177-L179 HydrophobicContact CB-CD1 4.49Å; C177-L179 HydrophobicContact CB-CD2 3.66Å; C177-L179 HydrophobicContact CB-CG 3.63Å; C177-L179 PolarHBondContact O-N 3.41Å; L179-R181 HydrophobicContact CD1-CB 4.48Å; L179-R181 PolarHBondContact O-N 3.3Å; L179-C194 HydrophobicContact CD1-CB 4.4Å
180	S	87.4	Confident	88.7	Confident	16 Å²	16	53 Å²	53	11%	0.112	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	117.2	170	-173.1	0	0	0	0	109.2	S167 N171 P182	S167-S180 WeakPolarHBondContact CB-OG 3.37Å; S167-S180 WeakPolarHBondContact OG-CB 3.17Å; S167-S180 PolarHBondContact OG-OG 3.01Å; N171-S180 VanDerWaalsContact CB-OG 3.31Å; N171-S180 WeakPolarHBondContact CB-OG 3.44Å; N171-S180 PolarHBondContact ND2-OG 3.11Å; S180-P182 WeakPolarHBondContact O-CD 3.4Å
181	R	88.4	Confident	89.9	Confident	56 Å²	56	51.5 Å²	51.5	21%	0.211	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	115.8	-178.8	-174.6	176.7	68.9	-172.9	-3.2	108.8	T172 L179 A185	T172-R181 PolarHBondContact N-O 3.18Å; T172-R181 VanDerWaalsContact N-O 3.12Å; T172-R181 WeakPolarHBondContact O-CA 3.28Å; T172-R181 WeakPolarHBondContact O-CB 3.31Å; T172-R181 PolarHBondContact O-N 3.45Å; T172-R181 PolarHBondContact OG1-NE 2.76Å; T172-R181 PolarHBondContact OG1-NH2 3.44Å; L179-R181 HydrophobicContact CD1-CB 4.48Å; L179-R181 PolarHBondContact O-N 3.3Å; R181-A185 WeakPolarHBondContact CD-O 3.09Å; R181-A185 HydrophobicContact CG-CB 3.69Å; R181-A185 PolarHBondContact NE-O 3.31Å
182	P	90	Very high	90.8	Very high	4 Å²	4	56.3 Å²	56.3	3%	0.026	29%	0.288	C	S	.	.			trans	-56.1	161.2	174.5	-24.2	34.2	0	0	0	112.3	V159 S180 A185 L196 F390	V159-P182 HydrophobicContact CG1-CG 4.37Å; S180-P182 WeakPolarHBondContact O-CD 3.4Å; P182-A185 WeakPolarHBondContact O-CB 3.14Å; P182-A185 PolarHBondContact O-N 3.49Å; P182-L196 HydrophobicContact CG-CD2 4.11Å; P182-F390 HydrophobicContact CB-CD1 4.31Å; P182-F390 HydrophobicContact CG-CD1 3.56Å; P182-F390 HydrophobicContact CG-CE1 3.97Å; P182-F390 HydrophobicContact CG-CG 4.47Å
183	K	89.3	Confident	91.4	Very high	83 Å²	83	54.4 Å²	54.4	36%	0.361	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	148.4	171.4	-74.5	179.7	173.6	167.9	0	110.6	T170 A185 Y392	T170-K183 VanDerWaalsContact CB-CE 3.43Å; T170-K183 WeakPolarHBondContact OG1-CE 3.29Å; T170-K183 PolarHBondContact OG1-NZ 3.4Å; K183-A185 PolarHBondContact O-N 3.22Å; K183-Y392 HydrophobicContact CB-CD2 4.16Å; K183-Y392 HydrophobicContact CB-CE2 4.45Å; K183-Y392 WeakPolarHBondContact O-CE2 3.43Å
184	R	93.5	Very high	91.9	Very high	28 Å²	28	50.3 Å²	50.3	11%	0.106	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.6	0.6	-179.8	-44.1	179.5	78.1	171.6	15	116	H186 Y197 M198 G306 E311 Y392	R184-H186 PolarHBondContact O-CD2 3.05Å; R184-Y197 HydrophobicContact CB-CD2 4.24Å; R184-Y197 VanDerWaalsContact NH2-CE2 3.28Å; R184-Y197 WeakPolarHBondContact O-CA 3.17Å; R184-M198 PolarHBondContact O-N 3.33Å; R184-G306 PolarHBondContact NH2-O 3.4Å; R184-G306 VanDerWaalsContact NH2-O 3.09Å; R184-E311 WeakPolarHBondContact CB-OE1 3.41Å; R184-E311 VanDerWaalsContact CG-OE1 3.28Å; R184-E311 WeakPolarHBondContact CG-OE1 3.49Å; R184-E311 IonicContact CZ-OE1 3.26Å; R184-E311 IonicContact CZ-OE2 3.28Å; R184-E311 IonicContact NE-OE1 2.67Å; R184-E311 PolarHBondContact NE-OE1 3.06Å; R184-E311 IonicContact NE-OE2 3.4Å; R184-E311 IonicContact NH2-OE1 3.47Å; R184-E311 PolarHBondContact NH2-OE1 3.45Å; R184-E311 IonicContact NH2-OE2 3.63Å; R184-E311 PolarHBondContact NH2-OE2 2.71Å; R184-Y392 HydrophobicContact CB-CE1 4.47Å; R184-Y392 HydrophobicContact CB-CE2 4.03Å; R184-Y392 VanDerWaalsContact CD-CD1 3.43Å; R184-Y392 VanDerWaalsContact CD-CG 3.47Å; R184-Y392 HydrophobicContact CG-CD2 4.03Å; R184-Y392 HydrophobicContact CG-CE1 4.47Å; R184-Y392 HydrophobicContact CG-CE2 4.05Å; R184-Y392 HydrophobicContact CG-CG 4.26Å
185	A	94.7	Very high	92.2	Very high	2 Å²	2	50 Å²	50	2%	0.017	25%	0.25	C	C	.	.			trans	-86.6	144.9	171.7	0	0	0	0	0	110.7	V159 R181 P182 K183 I195	V159-A185 HydrophobicContact CG2-CB 4.03Å; R181-A185 WeakPolarHBondContact CD-O 3.09Å; R181-A185 HydrophobicContact CG-CB 3.69Å; R181-A185 PolarHBondContact NE-O 3.31Å; P182-A185 WeakPolarHBondContact O-CB 3.14Å; P182-A185 PolarHBondContact O-N 3.49Å; K183-A185 PolarHBondContact O-N 3.22Å; A185-I195 CarbonylContact C-O 3.05Å; A185-I195 WeakPolarHBondContact CA-O 3.45Å; A185-I195 VanDerWaalsContact CB-O 3.3Å; A185-I195 WeakPolarHBondContact CB-O 3.37Å
186	H	95.5	Very high	92.5	Very high	35 Å²	35	45.7 Å²	45.7	16%	0.162	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	151	179.3	-63.6	-84.1	0	0	0	111.8	R184 C194 I195 M198 I310	R184-H186 PolarHBondContact O-CD2 3.05Å; H186-C194 WeakPolarHBondContact O-CA 3.34Å; H186-I195 PolarHBondContact N-O 2.97Å; H186-I195 PolarHBondContact O-N 3.48Å; H186-M198 HydrophobicContact CB-CB 3.99Å; H186-M198 HydrophobicContact CB-CG 4.35Å; H186-M198 HydrophobicContact CB-SD 3.78Å; H186-I310 HydrophobicContact CB-CD1 3.98Å; H186-I310 VanDerWaalsContact CE1-CG2 3.43Å; H186-I310 WeakPolarHBondContact CE1-CG2 3.35Å; H186-I310 WeakPolarHBondContact NE2-CG2 3.49Å
187	H	95.9	Very high	92.8	Very high	35 Å²	35	39.5 Å²	39.5	16%	0.162	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	119.4	176.9	179	95.9	0	0	0	109.9	R176 C177 A189	R176-H187 VanDerWaalsContact CD-NE2 3.33Å; R176-H187 WeakPolarHBondContact CD-NE2 3.25Å; C177-H187 VanDerWaalsContact SG-CE1 3.57Å; C177-H187 PolarHBondContact SG-ND1 2.87Å; H187-A189 PolarHBondContact O-N 3.06Å
188	C	95.9	Very high	93.1	Very high	3 Å²	3	38.5 Å²	38.5	2%	0.02	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	115	172.6	-179.3	0	0	0	0	110.4	I190 C191 K192 T193 I195 M198 C208	C188-I190 PolarHBondContact O-N 3.41Å; C188-I190 PolarHBondContact SG-N 2.86Å; C188-C191 HydrophobicContact CB-CB 4Å; C188-C191 PolarHBondContact O-N 3.3Å; C188-C191 PolarHBondContact SG-N 2.85Å; C188-K192 WeakPolarHBondContact O-CA 3.43Å; C188-K192 PolarHBondContact O-N 2.91Å; C188-T193 PolarHBondContact N-O 3.4Å; C188-I195 HydrophobicContact CB-CG1 4.18Å; C188-M198 HydrophobicContact CB-CE 3.79Å; C188-M198 HydrophobicContact CB-SD 4.05Å; C188-C208 VanDerWaalsContact CB-SG 3.6Å; C188-C208 PolarHBondContact SG-SG 3.07Å
189	A	92.4	Very high	93.6	Very high	46 Å²	46	30 Å²	30	38%	0.38	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-20.5	178.4	0	0	0	0	0	114.1	H187 K192	H187-A189 PolarHBondContact O-N 3.06Å; A189-K192 VanDerWaalsContact O-CD 3.25Å; A189-K192 WeakPolarHBondContact O-CD 3.38Å; A189-K192 WeakPolarHBondContact O-CE 3.26Å; A189-K192 PolarHBondContact O-NZ 3.49Å
190	I	90	Very high	94.1	Very high	46 Å²	46	31.7 Å²	31.7	24%	0.236	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-47.9	179.5	-60.7	168.5	0	0	0	110.3	C188 K192 H201	C188-I190 PolarHBondContact O-N 3.41Å; C188-I190 PolarHBondContact SG-N 2.86Å; I190-K192 VanDerWaalsContact C-N 3.3Å; I190-H201 HydrophobicContact CD1-CB 4.1Å; I190-H201 WeakPolarHBondContact CD1-CD2 3.13Å
191	C	92.7	Very high	94.5	Very high	42 Å²	42	32.7 Å²	32.7	28%	0.284	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-14.9	177	-60.4	0	0	0	0	113.5	C188 T193 H201	C188-C191 HydrophobicContact CB-CB 4Å; C188-C191 PolarHBondContact O-N 3.3Å; C188-C191 PolarHBondContact SG-N 2.85Å; C191-T193 VanDerWaalsContact C-N 3.25Å; C191-T193 HydrophobicContact CB-CG2 3.96Å; C191-T193 PolarHBondContact O-N 3.19Å; C191-H201 VanDerWaalsContact SG-CE1 3.52Å; C191-H201 PolarHBondContact SG-ND1 3.19Å
192	K	93.8	Very high	94.9	Very high	146 Å²	146	30.2 Å²	30.2	64%	0.635	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.8	33	-177.6	-55	-63.5	-175.4	-167.8	0	113.6	C188 A189 I190	C188-K192 WeakPolarHBondContact O-CA 3.43Å; C188-K192 PolarHBondContact O-N 2.91Å; A189-K192 VanDerWaalsContact O-CD 3.25Å; A189-K192 WeakPolarHBondContact O-CD 3.38Å; A189-K192 WeakPolarHBondContact O-CE 3.26Å; A189-K192 PolarHBondContact O-NZ 3.49Å; I190-K192 VanDerWaalsContact C-N 3.3Å
193	T	95.3	Very high	95	Very high	29 Å²	29	32.7 Å²	32.7	18%	0.178	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	158.9	179.4	-172.1	0	0	0	0	111.3	C188 C191 I195	C188-T193 PolarHBondContact N-O 3.4Å; C191-T193 VanDerWaalsContact C-N 3.25Å; C191-T193 HydrophobicContact CB-CG2 3.96Å; C191-T193 PolarHBondContact O-N 3.19Å; T193-I195 HydrophobicContact CG2-CD1 3.55Å
194	C	96.1	Very high	95.2	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	133.3	170.7	-68.6	0	0	0	0	110.2	V159 C174 L179 H186	V159-C194 HydrophobicContact CB-CB 3.88Å; V159-C194 HydrophobicContact CG2-CB 3.57Å; V159-C194 PolarHBondContact N-O 3.46Å; C174-C194 PolarHBondContact SG-SG 3.02Å; L179-C194 HydrophobicContact CD1-CB 4.4Å; H186-C194 WeakPolarHBondContact O-CA 3.34Å
195	I	97.6	Very high	95.3	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	129.1	179.7	-54.1	-53.9	0	0	0	108.8	P156 G157 A185 H186 C188 T193 M198 C208	P156-I195 HydrophobicContact CB-CG2 3.99Å; P156-I195 HydrophobicContact CG-CD1 3.82Å; P156-I195 HydrophobicContact CG-CG2 4.34Å; G157-I195 CarbonylContact O-C 3.57Å; G157-I195 WeakPolarHBondContact O-CA 3.47Å; A185-I195 CarbonylContact C-O 3.05Å; A185-I195 WeakPolarHBondContact CA-O 3.45Å; A185-I195 VanDerWaalsContact CB-O 3.3Å; A185-I195 WeakPolarHBondContact CB-O 3.37Å; H186-I195 PolarHBondContact N-O 2.97Å; H186-I195 PolarHBondContact O-N 3.48Å; C188-I195 HydrophobicContact CB-CG1 4.18Å; T193-I195 HydrophobicContact CG2-CD1 3.55Å; I195-M198 HydrophobicContact CB-CB 3.95Å; I195-M198 HydrophobicContact CB-CG 4.07Å; I195-M198 HydrophobicContact CB-SD 4.1Å; I195-M198 HydrophobicContact CG1-SD 4.3Å; I195-M198 HydrophobicContact CG2-CB 4.1Å; I195-M198 HydrophobicContact CG2-CG 4.3Å; I195-C208 HydrophobicContact CD1-CB 4.45Å; I195-C208 HydrophobicContact CG1-CB 3.95Å; I195-C208 HydrophobicContact CG2-CB 4.17Å
196	L	97.2	Very high	95.4	Very high	5 Å²	5	35.2 Å²	35.2	3%	0.026	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	136.9	172.6	-62.7	167.1	0	0	0	109.6	G157 V159 P182 M198 L211 G389 F390	G157-L196 WeakPolarHBondContact O-CB 3.47Å; G157-L196 VanDerWaalsContact O-CG 3.3Å; G157-L196 WeakPolarHBondContact O-CG 3.27Å; G157-L196 PolarHBondContact O-N 3.22Å; V159-L196 HydrophobicContact CG2-CD2 3.75Å; V159-L196 HydrophobicContact CG2-CG 4.01Å; P182-L196 HydrophobicContact CG-CD2 4.11Å; L196-M198 PolarHBondContact O-N 2.93Å; L196-L211 HydrophobicContact CB-CB 4.04Å; L196-L211 HydrophobicContact CB-CD2 4.21Å; L196-L211 HydrophobicContact CD1-CD2 4.25Å; L196-L211 PolarHBondContact O-N 3.38Å; L196-G389 WeakPolarHBondContact CD2-O 3.4Å; L196-F390 HydrophobicContact CD1-CE2 4.36Å; L196-F390 HydrophobicContact CD1-CZ 4.37Å; L196-F390 HydrophobicContact CD2-CE1 4.33Å; L196-F390 HydrophobicContact CD2-CZ 4.32Å
197	Y	96.5	Very high	95.4	Very high	28 Å²	28	34.4 Å²	34.4	11%	0.11	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.8	48.4	-179.9	-167.3	-128.8	0	0	0	113.1	R184 D199 G210 L211 H214 T308 Y392	R184-Y197 HydrophobicContact CB-CD2 4.24Å; R184-Y197 VanDerWaalsContact NH2-CE2 3.28Å; R184-Y197 WeakPolarHBondContact O-CA 3.17Å; Y197-D199 PolarHBondContact O-N 3.47Å; Y197-G210 CarbonylContact O-C 3.55Å; Y197-G210 WeakPolarHBondContact O-CA 3.48Å; Y197-L211 HydrophobicContact CD1-CD1 4.27Å; Y197-L211 HydrophobicContact CG-CD1 4.41Å; Y197-H214 AromaticContact CE1-ND1 3.57Å; Y197-T308 HydrophobicContact CD2-CG2 3.95Å; Y197-T308 HydrophobicContact CE1-CG2 4.48Å; Y197-T308 HydrophobicContact CE2-CG2 3.37Å; Y197-Y392 HydrophobicContact CD2-CE1 4.19Å; Y197-Y392 PolarHBondContact N-OH 2.89Å
198	M	97.9	Very high	95.5	Very high	13 Å²	13	32.8 Å²	32.8	6%	0.064	17%	0.172	C	C	.	.			trans	-73.1	128.1	-172.1	-174	177.3	167.5	0	0	110.9	R184 H186 C188 I195 L196 T308 I310	R184-M198 PolarHBondContact O-N 3.33Å; H186-M198 HydrophobicContact CB-CB 3.99Å; H186-M198 HydrophobicContact CB-CG 4.35Å; H186-M198 HydrophobicContact CB-SD 3.78Å; C188-M198 HydrophobicContact CB-CE 3.79Å; C188-M198 HydrophobicContact CB-SD 4.05Å; I195-M198 HydrophobicContact CB-CB 3.95Å; I195-M198 HydrophobicContact CB-CG 4.07Å; I195-M198 HydrophobicContact CB-SD 4.1Å; I195-M198 HydrophobicContact CG1-SD 4.3Å; I195-M198 HydrophobicContact CG2-CB 4.1Å; I195-M198 HydrophobicContact CG2-CG 4.3Å; L196-M198 PolarHBondContact O-N 2.93Å; M198-T308 PolarHBondContact O-OG1 3.11Å; M198-I310 HydrophobicContact CB-CD1 4.42Å; M198-I310 HydrophobicContact CE-CD1 4.38Å; M198-I310 HydrophobicContact CG-CD1 4.05Å; M198-I310 HydrophobicContact SD-CD1 4.31Å
199	D	98.4	Very high	95.6	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	17%	0.171	C	C	.	.			trans	-96.3	-61.5	171.7	178.7	58.5	0	0	0	111	Y197 I209 H299 T308 S309 I310	Y197-D199 PolarHBondContact O-N 3.47Å; D199-I209 HydrophobicContact CB-CB 4.25Å; D199-I209 HydrophobicContact CB-CG2 4.08Å; D199-I209 PolarHBondContact N-O 3.3Å; D199-H299 IonicContact OD2-CE1 3.1Å; D199-H299 PolarHBondContact OD2-CE1 3.07Å; D199-H299 VanDerWaalsContact OD2-CE1 3.26Å; D199-H299 IonicContact OD2-ND1 2.77Å; D199-T308 HydrophobicContact CB-CG2 4.39Å; D199-S309 VanDerWaalsContact OD1-CB 3.22Å; D199-S309 WeakPolarHBondContact OD1-CB 3.3Å; D199-S309 PolarHBondContact OD1-N 3.35Å; D199-S309 PolarHBondContact OD1-OG 2.92Å; D199-I310 WeakPolarHBondContact O-CD1 3.47Å; D199-I310 VanDerWaalsContact O-CG1 3.31Å; D199-I310 WeakPolarHBondContact O-CG1 3.33Å
200	H	97.2	Very high	95.9	Very high	48 Å²	48	30.4 Å²	30.4	22%	0.222	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	177.5	173.5	67	-78.8	0	0	0	111.7	C202 C208 I209 F217 H299	H200-C202 WeakPolarHBondContact NE2-CB 3.42Å; H200-C208 WeakPolarHBondContact O-CA 3.3Å; H200-I209 PolarHBondContact N-O 2.93Å; H200-I209 PolarHBondContact O-N 2.84Å; H200-F217 AromaticContact CE1-CE1 3.98Å; H200-F217 AromaticContact CE1-CZ 3.82Å; H200-H299 AromaticContact CE1-CE1 3.98Å
201	H	96.2	Very high	96.3	Very high	36 Å²	36	28.7 Å²	28.7	17%	0.167	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	119.3	164	-176.5	92.1	0	0	0	108.7	I190 C191 P203 C208	I190-H201 HydrophobicContact CD1-CB 4.1Å; I190-H201 WeakPolarHBondContact CD1-CD2 3.13Å; C191-H201 VanDerWaalsContact SG-CE1 3.52Å; C191-H201 PolarHBondContact SG-ND1 3.19Å; H201-P203 WeakPolarHBondContact O-CD 3.28Å; H201-C208 PolarHBondContact ND1-SG 3.28Å
202	C	96.1	Very high	96.6	Very high	5 Å²	5	29.7 Å²	29.7	3%	0.034	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	118.1	-175.1	-174.1	0	0	0	0	110.5	H200 W204 T205 A206 N207 I209	H200-C202 WeakPolarHBondContact NE2-CB 3.42Å; C202-W204 VanDerWaalsContact C-N 3.27Å; C202-W204 PolarHBondContact O-N 2.87Å; C202-T205 WeakPolarHBondContact CB-OG1 3.35Å; C202-T205 PolarHBondContact O-N 2.69Å; C202-T205 PolarHBondContact O-OG1 3.37Å; C202-A206 WeakPolarHBondContact O-CA 3.36Å; C202-A206 PolarHBondContact O-N 3.08Å; C202-N207 PolarHBondContact N-O 3.29Å; C202-N207 PolarHBondContact O-N 3.29Å; C202-I209 HydrophobicContact CB-CD1 3.89Å; C202-I209 HydrophobicContact CB-CG1 3.81Å
203	P	92.3	Very high	96.8	Very high	56 Å²	56	22.8 Å²	22.8	36%	0.364	11%	0.112	S	C	.	.	G	3₁₀ helix	trans	-62	-34.1	175.6	-24.3	35.4	0	0	0	113.1	F76 G77 L80 H201 T205 A206	F76-P203 HydrophobicContact CD1-CB 4.44Å; F76-P203 HydrophobicContact CE1-CB 4.11Å; G77-P203 VanDerWaalsContact CA-O 3.27Å; G77-P203 WeakPolarHBondContact CA-O 3.49Å; L80-P203 HydrophobicContact CD1-CB 3.73Å; H201-P203 WeakPolarHBondContact O-CD 3.28Å; P203-T205 VanDerWaalsContact C-N 3.26Å; P203-T205 PolarHBondContact O-N 3.01Å; P203-A206 PolarHBondContact O-N 3.43Å
204	W	95	Very high	96.9	Very high	126 Å²	126	21.5 Å²	21.5	48%	0.477	11%	0.105	S	C	.	.	G	3₁₀ helix	trans	-71.5	-16.6	-178.4	-62.2	99.9	0	0	0	114.3	L80 V84 Y148 C202	L80-W204 HydrophobicContact CB-CE3 3.93Å; L80-W204 HydrophobicContact CB-CZ3 4.31Å; L80-W204 HydrophobicContact CD1-CD2 4.14Å; L80-W204 HydrophobicContact CD1-CE3 4.24Å; L80-W204 HydrophobicContact CD2-CE3 4.07Å; L80-W204 HydrophobicContact CD2-CH2 3.9Å; L80-W204 HydrophobicContact CD2-CZ2 4.48Å; L80-W204 HydrophobicContact CD2-CZ3 3.67Å; L80-W204 HydrophobicContact CG-CE3 4.3Å; L80-W204 HydrophobicContact CG-CZ3 4.4Å; V84-W204 HydrophobicContact CG2-CE3 3.94Å; V84-W204 HydrophobicContact CG2-CZ3 4.32Å; Y148-W204 PolarHBondContact OH-O 2.97Å; C202-W204 VanDerWaalsContact C-N 3.27Å; C202-W204 PolarHBondContact O-N 2.87Å
205	T	95.7	Very high	97	Very high	4 Å²	4	22 Å²	22	3%	0.025	11%	0.107	C	C	.	.	G	3₁₀ helix	trans	-111.8	-1.9	171.1	66	0	0	0	0	112.5	Y148 A151 V152 C202 P203 N207 F217	Y148-T205 HydrophobicContact CE2-CG2 4.2Å; A151-T205 HydrophobicContact CB-CG2 3.95Å; V152-T205 HydrophobicContact CG2-CG2 4.36Å; C202-T205 WeakPolarHBondContact CB-OG1 3.35Å; C202-T205 PolarHBondContact O-N 2.69Å; C202-T205 PolarHBondContact O-OG1 3.37Å; P203-T205 VanDerWaalsContact C-N 3.26Å; P203-T205 PolarHBondContact O-N 3.01Å; T205-N207 WeakPolarHBondContact O-CB 3.34Å; T205-N207 PolarHBondContact O-N 3.37Å; T205-N207 PolarHBondContact OG1-N 3.02Å; T205-N207 PolarHBondContact OG1-O 3.14Å; T205-F217 HydrophobicContact CG2-CD2 4.49Å
206	A	95.1	Very high	97.1	Very high	35 Å²	35	22.1 Å²	22.1	29%	0.289	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.2	29.7	-169.3	0	0	0	0	0	113.9	I81 C202 P203	I81-A206 HydrophobicContact CD1-CB 3.47Å; I81-A206 VanDerWaalsContact CD1-CB 3.47Å; I81-A206 HydrophobicContact CG1-CB 4.42Å; C202-A206 WeakPolarHBondContact O-CA 3.36Å; C202-A206 PolarHBondContact O-N 3.08Å; P203-A206 PolarHBondContact O-N 3.43Å
207	N	96.1	Very high	97.1	Very high	19 Å²	19	22.3 Å²	22.3	10%	0.102	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	159.5	-171.9	-165.5	13.1	0	0	0	110.4	A151 V152 I154 P156 C202 T205	A151-N207 WeakPolarHBondContact O-CB 3.42Å; A151-N207 PolarHBondContact O-ND2 2.91Å; V152-N207 PolarHBondContact O-ND2 3.46Å; I154-N207 PolarHBondContact O-ND2 3.35Å; P156-N207 WeakPolarHBondContact CD-OD1 3.39Å; C202-N207 PolarHBondContact N-O 3.29Å; C202-N207 PolarHBondContact O-N 3.29Å; T205-N207 WeakPolarHBondContact O-CB 3.34Å; T205-N207 PolarHBondContact O-N 3.37Å; T205-N207 PolarHBondContact OG1-N 3.02Å; T205-N207 PolarHBondContact OG1-O 3.14Å
208	C	98.4	Very high	97.2	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	142	169	-77	0	0	0	0	111	P156 C188 I195 H200 H201 T213	P156-C208 HydrophobicContact CB-CB 3.73Å; P156-C208 VanDerWaalsContact CB-O 3.28Å; P156-C208 WeakPolarHBondContact CB-O 3.45Å; P156-C208 HydrophobicContact CG-CB 3.89Å; C188-C208 VanDerWaalsContact CB-SG 3.6Å; C188-C208 PolarHBondContact SG-SG 3.07Å; I195-C208 HydrophobicContact CD1-CB 4.45Å; I195-C208 HydrophobicContact CG1-CB 3.95Å; I195-C208 HydrophobicContact CG2-CB 4.17Å; H200-C208 WeakPolarHBondContact O-CA 3.3Å; H201-C208 PolarHBondContact ND1-SG 3.28Å; C208-T213 PolarHBondContact O-OG1 2.79Å
209	I	98.6	Very high	97.3	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	105.1	165.2	-52.1	-44.7	0	0	0	105.2	D199 H200 C202 T213 H214 F217	D199-I209 HydrophobicContact CB-CB 4.25Å; D199-I209 HydrophobicContact CB-CG2 4.08Å; D199-I209 PolarHBondContact N-O 3.3Å; H200-I209 PolarHBondContact N-O 2.93Å; H200-I209 PolarHBondContact O-N 2.84Å; C202-I209 HydrophobicContact CB-CD1 3.89Å; C202-I209 HydrophobicContact CB-CG1 3.81Å; I209-T213 WeakPolarHBondContact CA-OG1 3.37Å; I209-H214 HydrophobicContact CG2-CB 3.91Å; I209-F217 HydrophobicContact CD1-CB 3.82Å; I209-F217 HydrophobicContact CD1-CD2 3.7Å; I209-F217 HydrophobicContact CD1-CE2 4.45Å; I209-F217 HydrophobicContact CD1-CG 3.79Å; I209-F217 HydrophobicContact CG1-CB 4.38Å; I209-F217 HydrophobicContact CG1-CD1 4.37Å; I209-F217 HydrophobicContact CG1-CD2 4.06Å; I209-F217 HydrophobicContact CG1-CE2 4.46Å; I209-F217 HydrophobicContact CG1-CG 4Å; I209-F217 HydrophobicContact CG2-CB 4.02Å; I209-F217 HydrophobicContact CG2-CD1 3.93Å; I209-F217 HydrophobicContact CG2-CG 4.04Å
210	G	98.2	Very high	97.3	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.104	C	C	.	.			trans	-139.1	-164.5	-174.5	0	0	0	0	0	111.3	P156 Y197 Y212 T213 H214	P156-G210 CarbonylContact O-C 3.6Å; P156-G210 VanDerWaalsContact O-C 3.27Å; P156-G210 WeakPolarHBondContact O-CA 3.41Å; Y197-G210 CarbonylContact O-C 3.55Å; Y197-G210 WeakPolarHBondContact O-CA 3.48Å; G210-Y212 VanDerWaalsContact C-N 3.31Å; G210-Y212 PolarHBondContact O-N 3.25Å; G210-Y212 VanDerWaalsContact O-N 3.11Å; G210-T213 PolarHBondContact N-OG1 3.22Å; G210-T213 PolarHBondContact O-N 3.49Å; G210-T213 VanDerWaalsContact O-N 3.1Å; G210-H214 WeakPolarHBondContact O-CB 3.41Å; G210-H214 PolarHBondContact O-N 3.05Å
211	L	98	Very high	97.4	Very high	9 Å²	9	19.3 Å²	19.3	5%	0.047	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44.2	-49.8	-174	-175	62.6	0	0	0	114.6	P156 L196 Y197 P385 D387	P156-L211 PolarHBondContact O-N 3.26Å; L196-L211 HydrophobicContact CB-CB 4.04Å; L196-L211 HydrophobicContact CB-CD2 4.21Å; L196-L211 HydrophobicContact CD1-CD2 4.25Å; L196-L211 PolarHBondContact O-N 3.38Å; Y197-L211 HydrophobicContact CD1-CD1 4.27Å; Y197-L211 HydrophobicContact CG-CD1 4.41Å; L211-P385 HydrophobicContact CD1-CB 3.78Å; L211-P385 HydrophobicContact CD1-CG 4.24Å; L211-P385 HydrophobicContact CG-CB 4.11Å; L211-P385 HydrophobicContact CG-CG 4.05Å; L211-P385 WeakPolarHBondContact O-CG 3.44Å; L211-D387 HydrophobicContact CD1-CB 4.34Å
212	Y	98.1	Very high	97.5	Very high	64 Å²	64	19.9 Å²	19.9	25%	0.251	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-15.9	-175.1	-60.3	-71	0	0	0	114.1	N155 P156 G210 H216 Y382 P385	N155-Y212 WeakPolarHBondContact O-CB 3.3Å; P156-Y212 PolarHBondContact O-N 2.89Å; G210-Y212 VanDerWaalsContact C-N 3.31Å; G210-Y212 PolarHBondContact O-N 3.25Å; G210-Y212 VanDerWaalsContact O-N 3.11Å; Y212-H216 PolarHBondContact O-CD2 3.34Å; Y212-Y382 WeakPolarHBondContact CD1-OH 3.29Å; Y212-P385 HydrophobicContact CD1-CG 3.63Å; Y212-P385 HydrophobicContact CE1-CG 4.01Å; Y212-P385 HydrophobicContact CG-CG 4.46Å
213	T	98.3	Very high	97.6	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-20.8	-175.9	51	0	0	0	0	113.3	I154 P156 C208 I209 G210 R215 H216 F217	I154-T213 HydrophobicContact CB-CG2 4.02Å; I154-T213 HydrophobicContact CG2-CG2 4.21Å; I154-T213 WeakPolarHBondContact O-CG2 3.15Å; P156-T213 HydrophobicContact CB-CG2 4.33Å; C208-T213 PolarHBondContact O-OG1 2.79Å; I209-T213 WeakPolarHBondContact CA-OG1 3.37Å; G210-T213 PolarHBondContact N-OG1 3.22Å; G210-T213 PolarHBondContact O-N 3.49Å; G210-T213 VanDerWaalsContact O-N 3.1Å; T213-R215 PolarHBondContact O-N 3.19Å; T213-H216 PolarHBondContact O-N 2.82Å; T213-H216 VanDerWaalsContact O-N 3.14Å; T213-F217 WeakPolarHBondContact O-CB 3.32Å; T213-F217 PolarHBondContact O-N 3.25Å
214	H	98.4	Very high	97.9	Very high	3 Å²	3	19.8 Å²	19.8	1%	0.014	9%	0.093	C	C	.	.	H	α-helix	trans	-60.3	-45.2	-173.7	-166.3	179.3	0	0	0	113.1	Y197 I209 G210 H216 F217 Y218 F344	Y197-H214 AromaticContact CE1-ND1 3.57Å; I209-H214 HydrophobicContact CG2-CB 3.91Å; G210-H214 WeakPolarHBondContact O-CB 3.41Å; G210-H214 PolarHBondContact O-N 3.05Å; H214-H216 PolarHBondContact O-N 2.88Å; H214-F217 PolarHBondContact O-N 3.4Å; H214-Y218 PolarHBondContact O-N 2.89Å; H214-F344 HydrophobicContact CB-CE2 4.41Å; H214-F344 AromaticContact CD2-CE2 3.81Å; H214-F344 AromaticContact CE1-CE2 3.91Å; H214-F344 AromaticContact CG-CE2 3.74Å; H214-F344 AromaticContact ND1-CE2 3.82Å; H214-F344 AromaticContact NE2-CE2 3.91Å
215	R	98.2	Very high	98.1	Very high	11 Å²	11	14.2 Å²	14.2	4%	0.042	7%	0.073	C	C	.	.	H	α-helix	trans	-58.3	-47.3	174	177.5	-178.1	177.1	-87.5	-3.7	112.1	T213 Y218 L219 L345 R376 S381	T213-R215 PolarHBondContact O-N 3.19Å; R215-Y218 PolarHBondContact O-N 3.33Å; R215-L219 HydrophobicContact CG-CD1 3.97Å; R215-L219 WeakPolarHBondContact O-CB 3.3Å; R215-L219 WeakPolarHBondContact O-CG 3.4Å; R215-L219 PolarHBondContact O-N 2.95Å; R215-L345 PolarHBondContact NE-O 3.2Å; R215-R376 PolarHBondContact NH2-O 2.98Å; R215-S381 PolarHBondContact NH1-O 3.43Å
216	H	98.6	Very high	98.2	Very high	1 Å²	1	18 Å²	18	1%	0.005	9%	0.092	C	C	.	.	H	α-helix	trans	-68.2	-40	-177.7	-68.9	-88.4	0	0	0	111.7	F146 H147 S150 A151 Y212 T213 H214 Y218 L219 A220 Y382	F146-H216 AromaticContact CE1-CE1 3.81Å; F146-H216 AromaticContact CE1-ND1 3.95Å; H147-H216 WeakPolarHBondContact CB-O 3.18Å; H147-H216 AromaticContact CE1-ND1 3.8Å; H147-H216 AromaticContact ND1-CE1 3.89Å; H147-H216 AromaticContact ND1-CG 3.88Å; H147-H216 AromaticContact ND1-ND1 3.1Å; H147-H216 PolarHBondContact ND1-ND1 3.44Å; H147-H216 VanDerWaalsContact ND1-ND1 3.1Å; S150-H216 VanDerWaalsContact CB-CG 3.45Å; S150-H216 WeakPolarHBondContact CB-ND1 3.11Å; S150-H216 PolarHBondContact OG-ND1 2.99Å; A151-H216 HydrophobicContact CB-CB 4.46Å; Y212-H216 PolarHBondContact O-CD2 3.34Å; T213-H216 PolarHBondContact O-N 2.82Å; T213-H216 VanDerWaalsContact O-N 3.14Å; H214-H216 PolarHBondContact O-N 2.88Å; H216-Y218 PolarHBondContact O-N 2.9Å; H216-L219 PolarHBondContact O-N 2.72Å; H216-A220 WeakPolarHBondContact O-CB 3.48Å; H216-A220 PolarHBondContact O-N 3.42Å; H216-Y382 AromaticContact CE1-CD2 3.76Å; H216-Y382 AromaticContact NE2-CD2 3.28Å; H216-Y382 VanDerWaalsContact NE2-CD2 3.28Å; H216-Y382 WeakPolarHBondContact NE2-CD2 3.14Å; H216-Y382 AromaticContact NE2-CE2 3.78Å
217	F	98.7	Very high	98.4	Very high	10 Å²	10	17.1 Å²	17.1	4%	0.044	9%	0.087	C	C	.	.	H	α-helix	trans	-58.2	-49.1	173.4	169.8	-98.9	0	0	0	111.7	A151 H200 T205 I209 T213 H214 L219 A220 L221 L295 H299	A151-F217 HydrophobicContact CB-CB 4.24Å; H200-F217 AromaticContact CE1-CE1 3.98Å; H200-F217 AromaticContact CE1-CZ 3.82Å; T205-F217 HydrophobicContact CG2-CD2 4.49Å; I209-F217 HydrophobicContact CD1-CB 3.82Å; I209-F217 HydrophobicContact CD1-CD2 3.7Å; I209-F217 HydrophobicContact CD1-CE2 4.45Å; I209-F217 HydrophobicContact CD1-CG 3.79Å; I209-F217 HydrophobicContact CG1-CB 4.38Å; I209-F217 HydrophobicContact CG1-CD1 4.37Å; I209-F217 HydrophobicContact CG1-CD2 4.06Å; I209-F217 HydrophobicContact CG1-CE2 4.46Å; I209-F217 HydrophobicContact CG1-CG 4Å; I209-F217 HydrophobicContact CG2-CB 4.02Å; I209-F217 HydrophobicContact CG2-CD1 3.93Å; I209-F217 HydrophobicContact CG2-CG 4.04Å; T213-F217 WeakPolarHBondContact O-CB 3.32Å; T213-F217 PolarHBondContact O-N 3.25Å; H214-F217 PolarHBondContact O-N 3.4Å; F217-L219 PolarHBondContact O-N 2.88Å; F217-A220 WeakPolarHBondContact O-CB 3.04Å; F217-A220 PolarHBondContact O-N 2.82Å; F217-L221 HydrophobicContact CD1-CD1 4.3Å; F217-L221 HydrophobicContact CE1-CD1 3.64Å; F217-L221 HydrophobicContact CE1-CG 4.4Å; F217-L221 HydrophobicContact CE2-CD1 4.47Å; F217-L221 HydrophobicContact CZ-CD1 3.75Å; F217-L221 HydrophobicContact CZ-CD2 4.43Å; F217-L221 HydrophobicContact CZ-CG 4.28Å; F217-L221 WeakPolarHBondContact O-CG 3.3Å; F217-L221 PolarHBondContact O-N 2.85Å; F217-L221 VanDerWaalsContact O-N 3.07Å; F217-L295 HydrophobicContact CZ-CD2 4.17Å; F217-H299 AromaticContact CE1-CD2 3.67Å; F217-H299 AromaticContact CE1-CE1 3.62Å; F217-H299 AromaticContact CE1-ND1 3.97Å; F217-H299 AromaticContact CE1-NE2 3.41Å; F217-H299 WeakPolarHBondContact CE1-NE2 3.44Å; F217-H299 AromaticContact CZ-NE2 3.82Å
218	Y	98.7	Very high	98.5	Very high	16 Å²	16	16.6 Å²	16.6	6%	0.063	9%	0.086	C	C	.	.	H	α-helix	trans	-62.4	-45.1	178.2	179.3	-100.3	0	0	0	112.6	H214 R215 H216 A220 L221 I222 H299 T300 I303 W341 F344	H214-Y218 PolarHBondContact O-N 2.89Å; R215-Y218 PolarHBondContact O-N 3.33Å; H216-Y218 PolarHBondContact O-N 2.9Å; Y218-A220 VanDerWaalsContact C-N 3.31Å; Y218-A220 PolarHBondContact O-N 3.22Å; Y218-L221 WeakPolarHBondContact O-CB 3.37Å; Y218-L221 PolarHBondContact O-N 3.48Å; Y218-L221 VanDerWaalsContact O-N 3.14Å; Y218-I222 HydrophobicContact CD1-CG1 4.21Å; Y218-I222 HydrophobicContact CE1-CD1 4.21Å; Y218-I222 HydrophobicContact CE1-CG1 3.6Å; Y218-I222 HydrophobicContact CE2-CG1 4.33Å; Y218-I222 PolarHBondContact O-N 3.45Å; Y218-I222 WeakPolarHBondContact OH-CD1 3.3Å; Y218-H299 HydrophobicContact CD2-CB 3.84Å; Y218-H299 HydrophobicContact CE2-CB 4.21Å; Y218-T300 WeakPolarHBondContact CE2-OG1 3.23Å; Y218-T300 PolarHBondContact OH-OG1 3.3Å; Y218-I303 HydrophobicContact CD1-CD1 4.2Å; Y218-I303 HydrophobicContact CD2-CD1 3.49Å; Y218-I303 VanDerWaalsContact CD2-CD1 3.49Å; Y218-I303 HydrophobicContact CE1-CD1 4.45Å; Y218-I303 HydrophobicContact CE2-CD1 3.79Å; Y218-I303 HydrophobicContact CG-CD1 3.72Å; Y218-W341 HydrophobicContact CD1-CZ3 4.25Å; Y218-W341 AromaticContact CE1-CH2 3.66Å; Y218-W341 HydrophobicContact CE1-CH2 3.66Å; Y218-W341 AromaticContact CE1-CZ3 3.49Å; Y218-W341 HydrophobicContact CE1-CZ3 3.49Å; Y218-W341 VanDerWaalsContact CE1-CZ3 3.49Å; Y218-W341 HydrophobicContact CE2-CH2 4.04Å; Y218-W341 AromaticContact CZ-CH2 3.36Å; Y218-W341 AromaticContact CZ-CZ3 3.74Å; Y218-W341 WeakPolarHBondContact OH-CH2 3.31Å; Y218-F344 AromaticContact CD1-CE1 3.77Å; Y218-F344 HydrophobicContact CD1-CE1 3.77Å; Y218-F344 HydrophobicContact CD1-CZ 4.47Å; Y218-F344 AromaticContact CG-CE1 3.89Å; Y218-F344 HydrophobicContact CG-CE1 3.89Å; Y218-F344 HydrophobicContact CG-CZ 4.15Å
219	L	98.7	Very high	98.4	Very high	3 Å²	3	20.5 Å²	20.5	2%	0.016	11%	0.106	C	C	.	.	H	α-helix	trans	-64.7	-35.9	177.7	-69.5	175.7	0	0	0	111.9	H147 R215 H216 F217 L221 I222 F223 L345 I377	H147-L219 HydrophobicContact CB-CB 4.22Å; H147-L219 WeakPolarHBondContact CE1-CD1 3.45Å; R215-L219 HydrophobicContact CG-CD1 3.97Å; R215-L219 WeakPolarHBondContact O-CB 3.3Å; R215-L219 WeakPolarHBondContact O-CG 3.4Å; R215-L219 PolarHBondContact O-N 2.95Å; H216-L219 PolarHBondContact O-N 2.72Å; F217-L219 PolarHBondContact O-N 2.88Å; L219-L221 VanDerWaalsContact C-N 3.33Å; L219-L221 PolarHBondContact O-N 2.96Å; L219-I222 PolarHBondContact O-N 2.96Å; L219-F223 HydrophobicContact CB-CD2 4.4Å; L219-F223 WeakPolarHBondContact O-CD2 3.37Å; L219-F223 PolarHBondContact O-N 2.88Å; L219-L345 HydrophobicContact CD2-CD2 4.27Å; L219-I377 HydrophobicContact CD1-CD1 4.27Å; L219-I377 HydrophobicContact CD2-CD1 4.41Å; L219-I377 HydrophobicContact CD2-CG2 3.88Å
220	A	98.7	Very high	98.4	Very high	2 Å²	2	22.5 Å²	22.5	2%	0.017	11%	0.114	C	C	.	.	H	α-helix	trans	-59.6	-44.4	171.9	0	0	0	0	0	111	H147 H216 F217 Y218 F223 M224	H147-A220 HydrophobicContact CB-CB 3.99Å; H216-A220 WeakPolarHBondContact O-CB 3.48Å; H216-A220 PolarHBondContact O-N 3.42Å; F217-A220 WeakPolarHBondContact O-CB 3.04Å; F217-A220 PolarHBondContact O-N 2.82Å; Y218-A220 VanDerWaalsContact C-N 3.31Å; Y218-A220 PolarHBondContact O-N 3.22Å; A220-F223 PolarHBondContact O-N 3.42Å; A220-M224 HydrophobicContact CB-CE 4.08Å; A220-M224 WeakPolarHBondContact O-CB 3.34Å; A220-M224 VanDerWaalsContact O-CE 3.29Å; A220-M224 WeakPolarHBondContact O-CE 3.15Å; A220-M224 WeakPolarHBondContact O-CG 3.2Å; A220-M224 PolarHBondContact O-N 3.36Å
221	L	98.7	Very high	98.3	Very high	6 Å²	6	23.2 Å²	23.2	3%	0.031	12%	0.118	C	C	.	.	H	α-helix	trans	-59.2	-48	175.1	-63	177.2	0	0	0	111.8	F217 Y218 L219 M224 S225 V292 L295 C296	F217-L221 HydrophobicContact CD1-CD1 4.3Å; F217-L221 HydrophobicContact CE1-CD1 3.64Å; F217-L221 HydrophobicContact CE1-CG 4.4Å; F217-L221 HydrophobicContact CE2-CD1 4.47Å; F217-L221 HydrophobicContact CZ-CD1 3.75Å; F217-L221 HydrophobicContact CZ-CD2 4.43Å; F217-L221 HydrophobicContact CZ-CG 4.28Å; F217-L221 WeakPolarHBondContact O-CG 3.3Å; F217-L221 PolarHBondContact O-N 2.85Å; F217-L221 VanDerWaalsContact O-N 3.07Å; Y218-L221 WeakPolarHBondContact O-CB 3.37Å; Y218-L221 PolarHBondContact O-N 3.48Å; Y218-L221 VanDerWaalsContact O-N 3.14Å; L219-L221 VanDerWaalsContact C-N 3.33Å; L219-L221 PolarHBondContact O-N 2.96Å; L221-M224 HydrophobicContact CD2-CE 4.08Å; L221-M224 PolarHBondContact O-N 3.39Å; L221-S225 WeakPolarHBondContact O-CB 3.05Å; L221-S225 PolarHBondContact O-N 3.49Å; L221-S225 PolarHBondContact O-OG 2.7Å; L221-S225 VanDerWaalsContact O-OG 3.05Å; L221-V292 HydrophobicContact CB-CG1 4.48Å; L221-V292 HydrophobicContact CD2-CG1 3.98Å; L221-L295 HydrophobicContact CD1-CD2 4.21Å; L221-L295 HydrophobicContact CD1-CG 3.88Å; L221-L295 HydrophobicContact CD2-CD2 3.8Å; L221-L295 HydrophobicContact CD2-CG 4.23Å; L221-C296 HydrophobicContact CB-CB 3.99Å
222	I	98.5	Very high	98.3	Very high	47 Å²	47	25 Å²	25	24%	0.241	13%	0.127	C	C	.	.	H	α-helix	trans	-58.2	-52.7	178.9	-73.5	-73.6	0	0	0	111.4	Y218 L219 M224 S225 I226 C296	Y218-I222 HydrophobicContact CD1-CG1 4.21Å; Y218-I222 HydrophobicContact CE1-CD1 4.21Å; Y218-I222 HydrophobicContact CE1-CG1 3.6Å; Y218-I222 HydrophobicContact CE2-CG1 4.33Å; Y218-I222 PolarHBondContact O-N 3.45Å; Y218-I222 WeakPolarHBondContact OH-CD1 3.3Å; L219-I222 PolarHBondContact O-N 2.96Å; I222-M224 PolarHBondContact O-N 2.95Å; I222-S225 WeakPolarHBondContact O-CB 3.49Å; I222-S225 PolarHBondContact O-N 3Å; I222-I226 HydrophobicContact CG2-CD1 3.76Å; I222-I226 WeakPolarHBondContact O-CG1 3.4Å; I222-I226 PolarHBondContact O-N 3.2Å; I222-C296 WeakPolarHBondContact CD1-SG 3.47Å
223	F	98.7	Very high	98.2	Very high	13 Å²	13	27 Å²	27	6%	0.057	14%	0.142	C	C	.	.	H	α-helix	trans	-70.6	-31.8	-177	-75.3	-69.4	0	0	0	112.6	N143 V144 H147 L219 A220 G227 I377	N143-F223 HydrophobicContact CB-CB 4.25Å; N143-F223 HydrophobicContact CB-CD1 3.69Å; N143-F223 HydrophobicContact CB-CD2 3.57Å; N143-F223 HydrophobicContact CB-CE1 3.81Å; N143-F223 HydrophobicContact CB-CE2 3.69Å; N143-F223 HydrophobicContact CB-CG 3.57Å; N143-F223 HydrophobicContact CB-CZ 3.81Å; V144-F223 HydrophobicContact CG2-CB 3.7Å; H147-F223 AromaticContact CD2-CD2 3.95Å; L219-F223 HydrophobicContact CB-CD2 4.4Å; L219-F223 WeakPolarHBondContact O-CD2 3.37Å; L219-F223 PolarHBondContact O-N 2.88Å; A220-F223 PolarHBondContact O-N 3.42Å; F223-G227 PolarHBondContact O-N 2.86Å; F223-I377 WeakPolarHBondContact CE2-O 3.47Å; F223-I377 VanDerWaalsContact CZ-O 3.23Å; F223-I377 WeakPolarHBondContact CZ-O 3.47Å
224	M	98.5	Very high	98.1	Very high	46 Å²	46	28.6 Å²	28.6	23%	0.227	15%	0.152	C	C	.	.	H	α-helix	trans	-67.1	-39.1	171	-75	-173.4	-67.1	0	0	111.7	V144 A220 L221 I222 G228 V292	V144-M224 HydrophobicContact CG1-CG 3.81Å; V144-M224 HydrophobicContact CG2-CG 4.14Å; A220-M224 HydrophobicContact CB-CE 4.08Å; A220-M224 WeakPolarHBondContact O-CB 3.34Å; A220-M224 VanDerWaalsContact O-CE 3.29Å; A220-M224 WeakPolarHBondContact O-CE 3.15Å; A220-M224 WeakPolarHBondContact O-CG 3.2Å; A220-M224 PolarHBondContact O-N 3.36Å; L221-M224 HydrophobicContact CD2-CE 4.08Å; L221-M224 PolarHBondContact O-N 3.39Å; I222-M224 PolarHBondContact O-N 2.95Å; M224-G228 WeakPolarHBondContact O-CA 3.28Å; M224-G228 PolarHBondContact O-N 3Å; M224-V292 HydrophobicContact CB-CG1 4.02Å; M224-V292 HydrophobicContact CE-CG1 4.47Å
225	S	98.6	Very high	97.9	Very high	10 Å²	10	28.7 Å²	28.7	7%	0.07	15%	0.153	C	C	.	.	H	α-helix	trans	-63.6	-49.8	173.9	-67.7	0	0	0	0	111.7	L221 I222 G228 I229 I293	L221-S225 WeakPolarHBondContact O-CB 3.05Å; L221-S225 PolarHBondContact O-N 3.49Å; L221-S225 PolarHBondContact O-OG 2.7Å; L221-S225 VanDerWaalsContact O-OG 3.05Å; I222-S225 WeakPolarHBondContact O-CB 3.49Å; I222-S225 PolarHBondContact O-N 3Å; S225-G228 PolarHBondContact O-N 3.2Å; S225-I229 WeakPolarHBondContact O-CG1 3.46Å; S225-I229 PolarHBondContact O-N 2.8Å; S225-I293 WeakPolarHBondContact OG-CG1 3.38Å
226	I	98.4	Very high	97.9	Very high	82 Å²	82	33.1 Å²	33.1	42%	0.421	17%	0.17	S	C	.	.	H	α-helix	trans	-61.4	-50	178.3	-67.4	169.1	0	0	0	110.4	I140 I222 G228 I229 Y230	I140-I226 HydrophobicContact CD1-CG2 3.88Å; I140-I226 HydrophobicContact CG1-CG2 4.3Å; I222-I226 HydrophobicContact CG2-CD1 3.76Å; I222-I226 WeakPolarHBondContact O-CG1 3.4Å; I222-I226 PolarHBondContact O-N 3.2Å; I226-G228 VanDerWaalsContact C-N 3.31Å; I226-G228 PolarHBondContact O-N 2.87Å; I226-I229 PolarHBondContact O-N 2.93Å; I226-Y230 VanDerWaalsContact O-CB 3.27Å; I226-Y230 WeakPolarHBondContact O-CB 3.29Å; I226-Y230 PolarHBondContact O-N 3.34Å
227	G	98.4	Very high	97.7	Very high	17 Å²	17	36 Å²	36	18%	0.175	19%	0.19	C	C	.	.	H	α-helix	trans	-62.6	-37.7	179	0	0	0	0	0	113	F223 Y230 L231	F223-G227 PolarHBondContact O-N 2.86Å; G227-Y230 PolarHBondContact O-N 3.13Å; G227-L231 VanDerWaalsContact O-CB 3.31Å; G227-L231 WeakPolarHBondContact O-CB 3.46Å; G227-L231 PolarHBondContact O-N 2.95Å
228	G	98.1	Very high	97.3	Very high	9 Å²	9	35.9 Å²	35.9	9%	0.093	19%	0.19	C	C	.	.	H	α-helix	trans	-65.1	-46.6	175.2	0	0	0	0	0	113.3	M224 S225 I226 Y230 L231 L232 V289	M224-G228 WeakPolarHBondContact O-CA 3.28Å; M224-G228 PolarHBondContact O-N 3Å; S225-G228 PolarHBondContact O-N 3.2Å; I226-G228 VanDerWaalsContact C-N 3.31Å; I226-G228 PolarHBondContact O-N 2.87Å; G228-Y230 VanDerWaalsContact C-N 3.29Å; G228-Y230 PolarHBondContact O-N 3.02Å; G228-L231 PolarHBondContact O-N 2.99Å; G228-L232 WeakPolarHBondContact O-CB 3.36Å; G228-L232 WeakPolarHBondContact O-CG 3.46Å; G228-L232 PolarHBondContact O-N 3.43Å; G228-V289 VanDerWaalsContact CA-CG2 3.46Å
229	I	98.1	Very high	97.1	Very high	81 Å²	81	35.1 Å²	35.1	42%	0.415	19%	0.187	S	C	.	.	H	α-helix	trans	-59.7	-44.9	173.3	-70.6	162.4	0	0	0	110	S225 I226 L232 N233 V289 I293	S225-I229 WeakPolarHBondContact O-CG1 3.46Å; S225-I229 PolarHBondContact O-N 2.8Å; I226-I229 PolarHBondContact O-N 2.93Å; I229-L232 PolarHBondContact O-N 3.37Å; I229-N233 PolarHBondContact O-N 2.77Å; I229-N233 PolarHBondContact O-ND2 2.93Å; I229-V289 HydrophobicContact CG1-CG1 4.23Å; I229-I293 HydrophobicContact CD1-CD1 3.96Å; I229-I293 HydrophobicContact CG1-CD1 4.22Å
230	Y	97.3	Very high	97	Very high	42 Å²	42	42.2 Å²	42.2	17%	0.165	21%	0.214	C	C	.	.	H	α-helix	trans	-62.5	-45	-179.8	-171.6	-91.5	0	0	0	112.2	H133 L136 I226 G227 G228 N233 V234 G235	H133-Y230 WeakPolarHBondContact CA-OH 3.2Å; H133-Y230 WeakPolarHBondContact CB-OH 3.28Å; H133-Y230 VanDerWaalsContact CG-OH 3.26Å; H133-Y230 AromaticContact ND1-CE2 3.47Å; H133-Y230 WeakPolarHBondContact ND1-CE2 3.48Å; H133-Y230 AromaticContact ND1-CZ 3.32Å; H133-Y230 VanDerWaalsContact ND1-CZ 3.32Å; H133-Y230 PolarHBondContact ND1-OH 3.43Å; H133-Y230 PolarHBondContact O-OH 3.43Å; L136-Y230 HydrophobicContact CD2-CD2 4.25Å; L136-Y230 HydrophobicContact CD2-CE2 3.64Å; L136-Y230 HydrophobicContact CG-CE2 4.23Å; I226-Y230 VanDerWaalsContact O-CB 3.27Å; I226-Y230 WeakPolarHBondContact O-CB 3.29Å; I226-Y230 PolarHBondContact O-N 3.34Å; G227-Y230 PolarHBondContact O-N 3.13Å; G228-Y230 VanDerWaalsContact C-N 3.29Å; G228-Y230 PolarHBondContact O-N 3.02Å; Y230-N233 PolarHBondContact O-N 3.47Å; Y230-V234 HydrophobicContact CD1-CB 4.47Å; Y230-V234 HydrophobicContact CD2-CG2 4.11Å; Y230-V234 HydrophobicContact CE1-CB 4.32Å; Y230-V234 HydrophobicContact CE1-CG1 4.42Å; Y230-V234 HydrophobicContact CE2-CG2 3.98Å; Y230-V234 WeakPolarHBondContact O-CB 3.5Å; Y230-V234 PolarHBondContact O-N 2.93Å; Y230-G235 PolarHBondContact O-N 3.23Å
231	L	97.6	Very high	96.5	Very high	15 Å²	15	44.2 Å²	44.2	8%	0.079	23%	0.228	C	C	.	.	I	π-helix	trans	-59.8	-47.1	174.4	178.5	61.5	0	0	0	111.3	I91 L94 L99 G227 G228 N233 G235 W236 F282 S285	I91-L231 HydrophobicContact CD1-CD2 4.01Å; I91-L231 HydrophobicContact CG1-CD2 4.05Å; I91-L231 HydrophobicContact CG2-CD2 4.39Å; L94-L231 HydrophobicContact CD2-CD1 4.08Å; L99-L231 HydrophobicContact CD1-CD1 4.49Å; G227-L231 VanDerWaalsContact O-CB 3.31Å; G227-L231 WeakPolarHBondContact O-CB 3.46Å; G227-L231 PolarHBondContact O-N 2.95Å; G228-L231 PolarHBondContact O-N 2.99Å; L231-N233 VanDerWaalsContact C-N 3.3Å; L231-N233 PolarHBondContact O-N 3.18Å; L231-G235 CarbonylContact O-C 3.58Å; L231-G235 WeakPolarHBondContact O-CA 3.5Å; L231-G235 PolarHBondContact O-N 2.78Å; L231-G235 VanDerWaalsContact O-N 3.11Å; L231-W236 PolarHBondContact O-N 2.75Å; L231-F282 HydrophobicContact CD1-CD1 4.44Å; L231-F282 HydrophobicContact CD1-CE1 3.66Å; L231-F282 HydrophobicContact CD1-CZ 4.07Å; L231-F282 HydrophobicContact CG-CD1 4.29Å; L231-F282 HydrophobicContact CG-CE1 3.94Å; L231-F282 WeakPolarHBondContact O-CE1 3.45Å; L231-S285 WeakPolarHBondContact CD2-OG 3.34Å
232	L	97.8	Very high	96.1	Very high	46 Å²	46	44 Å²	44	24%	0.241	23%	0.227	C	C	.	.	I	π-helix	trans	-68.8	-22.7	-178	-74.7	172.5	0	0	0	114.6	G228 I229 W236 A286 V289	G228-L232 WeakPolarHBondContact O-CB 3.36Å; G228-L232 WeakPolarHBondContact O-CG 3.46Å; G228-L232 PolarHBondContact O-N 3.43Å; I229-L232 PolarHBondContact O-N 3.37Å; L232-W236 WeakPolarHBondContact O-CB 3.21Å; L232-A286 HydrophobicContact CD2-CB 4.2Å; L232-V289 HydrophobicContact CD1-CB 4.19Å; L232-V289 HydrophobicContact CD1-CG1 4.43Å; L232-V289 HydrophobicContact CD1-CG2 4.21Å
233	N	96.1	Very high	95.7	Very high	107 Å²	107	43 Å²	43	57%	0.572	22%	0.222	S	C	*	.	I	π-helix	trans	-99.5	-66	178.4	-72.5	-85	0	0	0	110.9	I229 Y230 L231 S237	I229-N233 PolarHBondContact O-N 2.77Å; I229-N233 PolarHBondContact O-ND2 2.93Å; Y230-N233 PolarHBondContact O-N 3.47Å; L231-N233 VanDerWaalsContact C-N 3.3Å; L231-N233 PolarHBondContact O-N 3.18Å; N233-S237 VanDerWaalsContact O-CB 3.3Å; N233-S237 WeakPolarHBondContact O-CB 3.2Å; N233-S237 PolarHBondContact O-N 2.98Å; N233-S237 VanDerWaalsContact O-N 3.11Å
234	V	94.7	Very high	95.3	Very high	33 Å²	33	47.3 Å²	47.3	20%	0.2	25%	0.245	C	C	.	.	I	π-helix	trans	-72	-51.7	-175.2	-179.6	0	0	0	0	110.3	W129 Y230 W236 S237 D238	W129-V234 HydrophobicContact CH2-CG1 3.75Å; W129-V234 HydrophobicContact CZ2-CG1 3.71Å; Y230-V234 HydrophobicContact CD1-CB 4.47Å; Y230-V234 HydrophobicContact CD2-CG2 4.11Å; Y230-V234 HydrophobicContact CE1-CB 4.32Å; Y230-V234 HydrophobicContact CE1-CG1 4.42Å; Y230-V234 HydrophobicContact CE2-CG2 3.98Å; Y230-V234 WeakPolarHBondContact O-CB 3.5Å; Y230-V234 PolarHBondContact O-N 2.93Å; V234-W236 PolarHBondContact O-N 2.79Å; V234-S237 PolarHBondContact O-N 3.24Å; V234-D238 PolarHBondContact O-N 3.5Å
235	G	95.8	Very high	94.6	Very high	5 Å²	5	47.2 Å²	47.2	5%	0.052	24%	0.244	C	C	.	.	I	π-helix	trans	-63.5	-40.6	-179	0	0	0	0	0	112.8	L99 Y230 L231 D238 F239	L99-G235 WeakPolarHBondContact CD2-O 3.15Å; Y230-G235 PolarHBondContact O-N 3.23Å; L231-G235 CarbonylContact O-C 3.58Å; L231-G235 WeakPolarHBondContact O-CA 3.5Å; L231-G235 PolarHBondContact O-N 2.78Å; L231-G235 VanDerWaalsContact O-N 3.11Å; G235-D238 PolarHBondContact O-N 3.15Å; G235-F239 VanDerWaalsContact O-CB 3.24Å; G235-F239 WeakPolarHBondContact O-CB 3.35Å; G235-F239 PolarHBondContact O-N 2.94Å
236	W	96.8	Very high	93.9	Very high	104 Å²	104	47.6 Å²	47.6	39%	0.394	25%	0.245	S	C	.	.	H	α-helix	trans	-68	-40.5	178.3	178.7	-115.9	0	0	0	112.4	L231 L232 V234 D238 F239 R240 F282	L231-W236 PolarHBondContact O-N 2.75Å; L232-W236 WeakPolarHBondContact O-CB 3.21Å; V234-W236 PolarHBondContact O-N 2.79Å; W236-D238 VanDerWaalsContact C-N 3.31Å; W236-D238 PolarHBondContact O-N 3.14Å; W236-F239 AromaticContact CE3-CD1 3.98Å; W236-F239 HydrophobicContact CE3-CD1 3.98Å; W236-F239 AromaticContact CZ3-CD1 3.77Å; W236-F239 HydrophobicContact CZ3-CD1 3.77Å; W236-F239 HydrophobicContact CZ3-CE1 4.22Å; W236-F239 PolarHBondContact O-N 3.07Å; W236-R240 VanDerWaalsContact O-CB 3.24Å; W236-R240 WeakPolarHBondContact O-CB 3.2Å; W236-R240 PolarHBondContact O-N 2.85Å; W236-F282 HydrophobicContact CB-CD1 4.04Å; W236-F282 HydrophobicContact CB-CE1 3.9Å; W236-F282 HydrophobicContact CD2-CD1 4.47Å; W236-F282 HydrophobicContact CE3-CB 3.84Å; W236-F282 AromaticContact CE3-CD1 3.75Å; W236-F282 HydrophobicContact CE3-CD1 3.75Å; W236-F282 AromaticContact CE3-CD2 3.72Å; W236-F282 HydrophobicContact CE3-CD2 3.72Å; W236-F282 HydrophobicContact CE3-CE1 4.18Å; W236-F282 HydrophobicContact CE3-CE2 4.18Å; W236-F282 AromaticContact CE3-CG 3.49Å; W236-F282 HydrophobicContact CE3-CG 3.49Å; W236-F282 VanDerWaalsContact CE3-CG 3.49Å; W236-F282 HydrophobicContact CE3-CZ 4.38Å; W236-F282 HydrophobicContact CZ3-CB 3.96Å; W236-F282 AromaticContact CZ3-CD2 3.93Å; W236-F282 HydrophobicContact CZ3-CD2 3.93Å; W236-F282 AromaticContact CZ3-CG 3.93Å; W236-F282 HydrophobicContact CZ3-CG 3.93Å
237	S	94.1	Very high	93.1	Very high	61 Å²	61	48.1 Å²	48.1	43%	0.427	25%	0.248	S	C	.	.	H	α-helix	trans	-56	-49.4	175.2	-179.1	0	0	0	0	110.6	N233 V234 R240 S241	N233-S237 VanDerWaalsContact O-CB 3.3Å; N233-S237 WeakPolarHBondContact O-CB 3.2Å; N233-S237 PolarHBondContact O-N 2.98Å; N233-S237 VanDerWaalsContact O-N 3.11Å; V234-S237 PolarHBondContact O-N 3.24Å; S237-R240 PolarHBondContact O-N 3.37Å; S237-S241 PolarHBondContact O-N 3.47Å; S237-S241 VanDerWaalsContact O-N 3.09Å; S237-S241 PolarHBondContact O-OG 3.14Å
238	D	92	Very high	92.2	Very high	8 Å²	8	53 Å²	53	4%	0.043	27%	0.266	C	S	.	.	H	α-helix	trans	-66.1	-43.9	-179.3	-71.2	-0.6	0	0	0	112.2	L99 R102 R103 V234 G235 W236 R240 S241 Y242	L99-D238 HydrophobicContact CD2-CB 3.98Å; R102-D238 VanDerWaalsContact CD-O 3.3Å; R102-D238 WeakPolarHBondContact CD-O 3.19Å; R102-D238 PolarHBondContact NE-O 3.3Å; R103-D238 WeakPolarHBondContact CG-OD2 3.45Å; R103-D238 IonicContact CZ-OD1 3.76Å; R103-D238 IonicContact CZ-OD2 3.99Å; R103-D238 IonicContact NE-OD1 3.6Å; R103-D238 PolarHBondContact NE-OD1 2.95Å; R103-D238 VanDerWaalsContact NE-OD1 3.1Å; R103-D238 IonicContact NE-OD2 3.19Å; R103-D238 PolarHBondContact NE-OD2 3.37Å; R103-D238 IonicContact NH2-OD1 3.61Å; R103-D238 PolarHBondContact NH2-OD1 3.4Å; R103-D238 IonicContact NH2-OD2 2.69Å; V234-D238 PolarHBondContact O-N 3.5Å; G235-D238 PolarHBondContact O-N 3.15Å; W236-D238 VanDerWaalsContact C-N 3.31Å; W236-D238 PolarHBondContact O-N 3.14Å; D238-R240 VanDerWaalsContact C-N 3.35Å; D238-R240 PolarHBondContact O-N 2.59Å; D238-S241 PolarHBondContact O-N 2.99Å; D238-Y242 WeakPolarHBondContact O-CB 3.5Å; D238-Y242 PolarHBondContact O-N 3.01Å
239	F	94.6	Very high	90.9	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-65.2	-37.8	178	-173.4	-111.5	0	0	0	112.2	L94 V98 L99 G235 W236 Y242 L243 Y278 K279 F282	L94-F239 HydrophobicContact CD1-CD2 4.07Å; L94-F239 HydrophobicContact CD1-CE2 4.31Å; V98-F239 HydrophobicContact CG1-CD2 3.97Å; V98-F239 HydrophobicContact CG1-CE2 4.39Å; L99-F239 HydrophobicContact CD2-CB 4.11Å; G235-F239 VanDerWaalsContact O-CB 3.24Å; G235-F239 WeakPolarHBondContact O-CB 3.35Å; G235-F239 PolarHBondContact O-N 2.94Å; W236-F239 AromaticContact CE3-CD1 3.98Å; W236-F239 HydrophobicContact CE3-CD1 3.98Å; W236-F239 AromaticContact CZ3-CD1 3.77Å; W236-F239 HydrophobicContact CZ3-CD1 3.77Å; W236-F239 HydrophobicContact CZ3-CE1 4.22Å; W236-F239 PolarHBondContact O-N 3.07Å; F239-Y242 HydrophobicContact CD2-CD1 4.12Å; F239-Y242 HydrophobicContact CE2-CD1 4.06Å; F239-Y242 HydrophobicContact CE2-CE1 4.3Å; F239-Y242 VanDerWaalsContact O-CB 3.31Å; F239-Y242 WeakPolarHBondContact O-CB 3.44Å; F239-Y242 PolarHBondContact O-N 3.02Å; F239-L243 HydrophobicContact CD1-CD1 3.98Å; F239-L243 HydrophobicContact CD1-CG 4.41Å; F239-L243 HydrophobicContact CE1-CD1 3.67Å; F239-L243 HydrophobicContact CE1-CD2 4.4Å; F239-L243 HydrophobicContact CE1-CG 4.15Å; F239-L243 HydrophobicContact CZ-CD1 4.23Å; F239-L243 HydrophobicContact CZ-CD2 4.12Å; F239-L243 HydrophobicContact CZ-CG 4.29Å; F239-L243 VanDerWaalsContact O-CG 3.31Å; F239-L243 WeakPolarHBondContact O-CG 3.32Å; F239-L243 PolarHBondContact O-N 2.9Å; F239-Y278 HydrophobicContact CE2-CD2 4.39Å; F239-K279 HydrophobicContact CE1-CG 3.69Å; F239-K279 HydrophobicContact CZ-CG 4.06Å; F239-F282 HydrophobicContact CB-CE2 3.65Å; F239-F282 HydrophobicContact CB-CZ 3.67Å; F239-F282 AromaticContact CD1-CD2 3.68Å; F239-F282 HydrophobicContact CD1-CD2 3.68Å; F239-F282 AromaticContact CD1-CE2 3.32Å; F239-F282 HydrophobicContact CD1-CE2 3.32Å; F239-F282 HydrophobicContact CD1-CZ 4.19Å; F239-F282 HydrophobicContact CD2-CE2 4.06Å; F239-F282 AromaticContact CE1-CD2 3.98Å; F239-F282 HydrophobicContact CE1-CD2 3.98Å; F239-F282 AromaticContact CE1-CE2 3.91Å; F239-F282 HydrophobicContact CE1-CE2 3.91Å; F239-F282 HydrophobicContact CG-CD2 4.23Å; F239-F282 AromaticContact CG-CE2 3.4Å; F239-F282 HydrophobicContact CG-CE2 3.4Å; F239-F282 AromaticContact CG-CZ 3.98Å; F239-F282 HydrophobicContact CG-CZ 3.98Å
240	R	94.7	Very high	89.4	Confident	152 Å²	152	57 Å²	57	57%	0.574	28%	0.284	S	S	*	.	H	α-helix	trans	-63.5	-45.5	175	-179.3	-178.7	171.3	-166	-2.5	110.9	W236 S237 D238 Y242 L243 L244	W236-R240 VanDerWaalsContact O-CB 3.24Å; W236-R240 WeakPolarHBondContact O-CB 3.2Å; W236-R240 PolarHBondContact O-N 2.85Å; S237-R240 PolarHBondContact O-N 3.37Å; D238-R240 VanDerWaalsContact C-N 3.35Å; D238-R240 PolarHBondContact O-N 2.59Å; R240-Y242 VanDerWaalsContact C-N 3.31Å; R240-Y242 PolarHBondContact O-N 2.85Å; R240-L243 PolarHBondContact O-N 2.94Å; R240-L244 WeakPolarHBondContact O-CG 3.46Å; R240-L244 PolarHBondContact O-N 3.02Å; R240-L244 VanDerWaalsContact O-N 3.1Å
241	S	90	Very high	87.8	Confident	44 Å²	44	60 Å²	60	31%	0.308	30%	0.301	S	S	.	.	H	α-helix	trans	-65.5	-36.1	177.9	-55.5	0	0	0	0	112.1	S237 D238 L243 L244 E245	S237-S241 PolarHBondContact O-N 3.47Å; S237-S241 VanDerWaalsContact O-N 3.09Å; S237-S241 PolarHBondContact O-OG 3.14Å; D238-S241 PolarHBondContact O-N 2.99Å; S241-L243 PolarHBondContact O-N 3.44Å; S241-L244 PolarHBondContact O-N 3.33Å; S241-E245 PolarHBondContact O-N 3.45Å
242	Y	89	Confident	85.9	Confident	2 Å²	2	62.8 Å²	62.8	1%	0.008	32%	0.316	C	S	.	.	H	α-helix	trans	-55.6	-47.5	169.7	168.9	-98.4	0	0	0	112.3	V98 D238 F239 R240 L244 E245 I246 L268 P269 I275	V98-Y242 HydrophobicContact CG1-CD1 3.87Å; V98-Y242 HydrophobicContact CG1-CD2 3.74Å; V98-Y242 HydrophobicContact CG1-CE1 4.06Å; V98-Y242 HydrophobicContact CG1-CE2 3.91Å; V98-Y242 HydrophobicContact CG1-CG 3.73Å; D238-Y242 WeakPolarHBondContact O-CB 3.5Å; D238-Y242 PolarHBondContact O-N 3.01Å; F239-Y242 HydrophobicContact CD2-CD1 4.12Å; F239-Y242 HydrophobicContact CE2-CD1 4.06Å; F239-Y242 HydrophobicContact CE2-CE1 4.3Å; F239-Y242 VanDerWaalsContact O-CB 3.31Å; F239-Y242 WeakPolarHBondContact O-CB 3.44Å; F239-Y242 PolarHBondContact O-N 3.02Å; R240-Y242 VanDerWaalsContact C-N 3.31Å; R240-Y242 PolarHBondContact O-N 2.85Å; Y242-L244 PolarHBondContact O-N 3.38Å; Y242-E245 PolarHBondContact O-N 2.87Å; Y242-I246 HydrophobicContact CD1-CD1 4.14Å; Y242-I246 HydrophobicContact CD2-CD1 4.4Å; Y242-I246 HydrophobicContact CE1-CD1 3.46Å; Y242-I246 VanDerWaalsContact CE1-CD1 3.46Å; Y242-I246 HydrophobicContact CE2-CD1 3.78Å; Y242-I246 PolarHBondContact O-N 3.33Å; Y242-I246 WeakPolarHBondContact OH-CD1 3.46Å; Y242-L268 HydrophobicContact CD2-CD2 3.26Å; Y242-L268 HydrophobicContact CD2-CG 3.9Å; Y242-L268 HydrophobicContact CE2-CB 3.73Å; Y242-L268 HydrophobicContact CE2-CD2 3.32Å; Y242-L268 HydrophobicContact CE2-CG 3.52Å; Y242-L268 HydrophobicContact CG-CD2 4.44Å; Y242-P269 PolarHBondContact OH-O 3.26Å; Y242-I275 HydrophobicContact CE1-CG1 4.29Å
243	L	90.9	Very high	83.9	Confident	27 Å²	27	65.8 Å²	65.8	14%	0.141	33%	0.332	C	S	.	.	H	α-helix	trans	-64.6	-38.2	179.8	-68	174.8	0	0	0	112.8	F239 R240 S241 N247 I275 K279	F239-L243 HydrophobicContact CD1-CD1 3.98Å; F239-L243 HydrophobicContact CD1-CG 4.41Å; F239-L243 HydrophobicContact CE1-CD1 3.67Å; F239-L243 HydrophobicContact CE1-CD2 4.4Å; F239-L243 HydrophobicContact CE1-CG 4.15Å; F239-L243 HydrophobicContact CZ-CD1 4.23Å; F239-L243 HydrophobicContact CZ-CD2 4.12Å; F239-L243 HydrophobicContact CZ-CG 4.29Å; F239-L243 VanDerWaalsContact O-CG 3.31Å; F239-L243 WeakPolarHBondContact O-CG 3.32Å; F239-L243 PolarHBondContact O-N 2.9Å; R240-L243 PolarHBondContact O-N 2.94Å; S241-L243 PolarHBondContact O-N 3.44Å; L243-N247 PolarHBondContact O-N 2.67Å; L243-I275 HydrophobicContact CD2-CG2 3.62Å; L243-K279 HydrophobicContact CD1-CG 4.48Å
244	L	89.6	Confident	82	Confident	102 Å²	102	66 Å²	66	53%	0.534	34%	0.336	S	S	.	.	H	α-helix	trans	-64.3	-41.4	178.3	-70	173.1	0	0	0	111.7	R240 S241 Y242 N247 Q248	R240-L244 WeakPolarHBondContact O-CG 3.46Å; R240-L244 PolarHBondContact O-N 3.02Å; R240-L244 VanDerWaalsContact O-N 3.1Å; S241-L244 PolarHBondContact O-N 3.33Å; Y242-L244 PolarHBondContact O-N 3.38Å; L244-N247 PolarHBondContact O-N 2.89Å; L244-Q248 PolarHBondContact O-N 2.84Å
245	E	83.8	Confident	80.2	Confident	45 Å²	45	70 Å²	70	21%	0.21	36%	0.361	C	S	.	.	H	α-helix	trans	-67.1	-41.4	-179.9	-173.1	173.5	167.9	0	0	112.4	R102 S241 Y242 N247 Q248 N249	R102-E245 IonicContact CZ-OE2 3.59Å; R102-E245 IonicContact NH1-OE2 3.12Å; R102-E245 PolarHBondContact NH1-OE2 3.1Å; R102-E245 IonicContact NH2-OE2 3.34Å; S241-E245 PolarHBondContact O-N 3.45Å; Y242-E245 PolarHBondContact O-N 2.87Å; E245-N247 VanDerWaalsContact C-N 3.32Å; E245-N247 PolarHBondContact O-N 2.9Å; E245-Q248 PolarHBondContact O-N 2.88Å; E245-N249 WeakPolarHBondContact O-CB 3.34Å; E245-N249 PolarHBondContact O-N 3.02Å
246	I	83.2	Confident	77.7	Confident	18 Å²	18	75.9 Å²	75.9	9%	0.092	39%	0.385	C	S	.	.	H	α-helix	trans	-59.4	-44.6	174.1	-73.4	178	0	0	0	111.1	Y242 N249 Q250 I275	Y242-I246 HydrophobicContact CD1-CD1 4.14Å; Y242-I246 HydrophobicContact CD2-CD1 4.4Å; Y242-I246 HydrophobicContact CE1-CD1 3.46Å; Y242-I246 VanDerWaalsContact CE1-CD1 3.46Å; Y242-I246 HydrophobicContact CE2-CD1 3.78Å; Y242-I246 PolarHBondContact O-N 3.33Å; Y242-I246 WeakPolarHBondContact OH-CD1 3.46Å; I246-N249 PolarHBondContact O-N 2.98Å; I246-Q250 WeakPolarHBondContact O-CG 3.33Å; I246-Q250 PolarHBondContact O-N 3.49Å; I246-I275 HydrophobicContact CD1-CD1 4.05Å
247	N	82.1	Confident	75.2	Confident	92 Å²	92	81 Å²	81	49%	0.492	41%	0.406	S	S	.	.	H	α-helix	trans	-64.6	-41.3	179	-74.1	-1.6	0	0	0	111.6	L243 L244 E245 Q250 I251	L243-N247 PolarHBondContact O-N 2.67Å; L244-N247 PolarHBondContact O-N 2.89Å; E245-N247 VanDerWaalsContact C-N 3.32Å; E245-N247 PolarHBondContact O-N 2.9Å; N247-Q250 PolarHBondContact O-N 3.4Å; N247-I251 WeakPolarHBondContact O-CG1 3.26Å; N247-I251 PolarHBondContact O-N 2.91Å
248	Q	80	Confident	72.8	Confident	119 Å²	119	82.6 Å²	82.6	56%	0.556	42%	0.417	S	S	*	.	H	α-helix	trans	-67.7	-41.5	178.3	-173.1	175.8	0.1	0	0	112.4	L244 E245 Q250 I251 N252	L244-Q248 PolarHBondContact O-N 2.84Å; E245-Q248 PolarHBondContact O-N 2.88Å; Q248-Q250 VanDerWaalsContact C-N 3.3Å; Q248-Q250 PolarHBondContact O-N 2.73Å; Q248-I251 PolarHBondContact O-N 3.34Å; Q248-I251 VanDerWaalsContact O-N 3.17Å; Q248-N252 PolarHBondContact O-N 3.18Å
249	N	71.4	Confident	70.4	Confident	75 Å²	75	86 Å²	86	40%	0.401	44%	0.442	S	S	.	.	H	α-helix	trans	-64.1	-36.1	176.7	-74	-17.1	0	0	0	111.8	E245 I246 N252 I253	E245-N249 WeakPolarHBondContact O-CB 3.34Å; E245-N249 PolarHBondContact O-N 3.02Å; I246-N249 PolarHBondContact O-N 2.98Å; N249-N252 PolarHBondContact O-N 3.46Å; N249-I253 WeakPolarHBondContact O-CB 3.44Å; N249-I253 WeakPolarHBondContact O-CD1 3.27Å; N249-I253 WeakPolarHBondContact O-CG1 3.41Å; N249-I253 PolarHBondContact O-N 2.86Å
250	Q	66.8	Low	68.1	Low	101 Å²	101	93 Å²	93	47%	0.472	48%	0.477	S	S	.	.	H	α-helix	trans	-60.8	-45	171.5	-75.7	179.6	-12.7	0	0	112	I246 N247 Q248 I253 T254	I246-Q250 WeakPolarHBondContact O-CG 3.33Å; I246-Q250 PolarHBondContact O-N 3.49Å; N247-Q250 PolarHBondContact O-N 3.4Å; Q248-Q250 VanDerWaalsContact C-N 3.3Å; Q248-Q250 PolarHBondContact O-N 2.73Å; Q250-I253 PolarHBondContact O-N 2.99Å; Q250-T254 WeakPolarHBondContact O-CG2 3.48Å; Q250-T254 PolarHBondContact O-N 3.41Å; Q250-T254 VanDerWaalsContact O-N 3.07Å; Q250-T254 PolarHBondContact O-OG1 3.06Å
251	I	62.4	Low	65.5	Low	103 Å²	103	96.3 Å²	96.3	53%	0.528	49%	0.49	S	S	.	.	H	α-helix	trans	-61.7	-46	176.2	-64.7	163.9	0	0	0	110.5	N247 Q248 I253 T254 V255	N247-I251 WeakPolarHBondContact O-CG1 3.26Å; N247-I251 PolarHBondContact O-N 2.91Å; Q248-I251 PolarHBondContact O-N 3.34Å; Q248-I251 VanDerWaalsContact O-N 3.17Å; I251-I253 PolarHBondContact O-N 3.42Å; I251-T254 WeakPolarHBondContact CA-OG1 3.38Å; I251-T254 PolarHBondContact O-N 3.03Å; I251-T254 PolarHBondContact O-OG1 3.5Å; I251-V255 WeakPolarHBondContact O-CG2 3.26Å; I251-V255 PolarHBondContact O-N 3.11Å; I251-V255 VanDerWaalsContact O-N 3.11Å
252	N	57.2	Low	63.1	Low	75 Å²	75	104.4 Å²	104.4	40%	0.401	52%	0.52	S	S	.	.	H	α-helix	trans	-66.1	-38	-179.4	-72.8	-16.7	0	0	0	113	Q248 N249 V255 K256	Q248-N252 PolarHBondContact O-N 3.18Å; N249-N252 PolarHBondContact O-N 3.46Å; N252-V255 PolarHBondContact O-N 3.14Å; N252-K256 WeakPolarHBondContact O-CB 3.46Å; N252-K256 PolarHBondContact O-N 3.42Å
253	I	57.2	Low	61	Low	109 Å²	109	108.9 Å²	108.9	56%	0.559	55%	0.552	S	S	*	*	H	α-helix	trans	-65.4	-41	174.9	-69.4	163.8	0	0	0	110.3	N249 Q250 I251 V255 K256	N249-I253 WeakPolarHBondContact O-CB 3.44Å; N249-I253 WeakPolarHBondContact O-CD1 3.27Å; N249-I253 WeakPolarHBondContact O-CG1 3.41Å; N249-I253 PolarHBondContact O-N 2.86Å; Q250-I253 PolarHBondContact O-N 2.99Å; I251-I253 PolarHBondContact O-N 3.42Å; I253-V255 PolarHBondContact O-N 3.36Å; I253-K256 PolarHBondContact O-N 3.05Å
254	T	55.1	Low	58.7	Low	110 Å²	110	114.5 Å²	114.5	68%	0.675	58%	0.577	S	S	*	*	H	α-helix	trans	-63.6	-26.4	175	51.5	0	0	0	0	113.5	Q250 I251	Q250-T254 WeakPolarHBondContact O-CG2 3.48Å; Q250-T254 PolarHBondContact O-N 3.41Å; Q250-T254 VanDerWaalsContact O-N 3.07Å; Q250-T254 PolarHBondContact O-OG1 3.06Å; I251-T254 WeakPolarHBondContact CA-OG1 3.38Å; I251-T254 PolarHBondContact O-N 3.03Å; I251-T254 PolarHBondContact O-OG1 3.5Å
255	V	56.6	Low	56.4	Low	117 Å²	117	116.8 Å²	116.8	71%	0.709	59%	0.59	S	S	*	*	H	α-helix	trans	-91.1	-27.2	178.7	174.1	0	0	0	0	112.5	I251 N252 I253	I251-V255 WeakPolarHBondContact O-CG2 3.26Å; I251-V255 PolarHBondContact O-N 3.11Å; I251-V255 VanDerWaalsContact O-N 3.11Å; N252-V255 PolarHBondContact O-N 3.14Å; I253-V255 PolarHBondContact O-N 3.36Å
256	K	43.6	Very low	54.7	Low	130 Å²	130	119 Å²	119	57%	0.565	61%	0.607	S	S	*	*			trans	-127.4	64.5	-164.3	-149	-179.2	-170.9	-172.7	0	112.3	N252 I253 S258 S259	N252-K256 WeakPolarHBondContact O-CB 3.46Å; N252-K256 PolarHBondContact O-N 3.42Å; I253-K256 PolarHBondContact O-N 3.05Å; K256-S258 PolarHBondContact O-N 2.8Å; K256-S258 VanDerWaalsContact O-N 3.11Å; K256-S259 WeakPolarHBondContact CE-OG 3.3Å
257	Y	45	Very low	53.2	Low	210 Å²	210	126.8 Å²	126.8	82%	0.824	64%	0.636	S	S	*	*			trans	-67.9	6.1	164.3	-101.5	-85.4	0	0	0	113.7
258	S	44.3	Very low	52	Low	96 Å²	96	124.1 Å²	124.1	67%	0.671	62%	0.622	S	S	*	*	S	Bend	trans	-123.8	75.6	178.6	59.5	0	0	0	0	112.5	K256	K256-S258 PolarHBondContact O-N 2.8Å; K256-S258 VanDerWaalsContact O-N 3.11Å
259	S	41.6	Very low	51.1	Low	79 Å²	79	121.2 Å²	121.2	55%	0.552	61%	0.613	S	S	*	*			trans	173.1	97.9	145.8	37.2	0	0	0	0	110.2	K256 W261	K256-S259 WeakPolarHBondContact CE-OG 3.3Å; S259-W261 VanDerWaalsContact C-N 3.33Å; S259-W261 PolarHBondContact O-N 2.82Å
260	I	45.9	Very low	51.1	Low	147 Å²	147	121.2 Å²	121.2	75%	0.754	62%	0.619	S	S	*	*			trans	-77.8	7.8	-165.9	-83	162.8	0	0	0	115.4
261	W	39.4	Very low	51.8	Low	222 Å²	222	120.5 Å²	120.5	84%	0.841	62%	0.618	S	S	*	*	S	Bend	trans	-121	12.8	-158.8	-78.9	74.8	0	0	0	119.6	S259	S259-W261 VanDerWaalsContact C-N 3.33Å; S259-W261 PolarHBondContact O-N 2.82Å
262	F	40.1	Very low	52.9	Low	213 Å²	213	123.4 Å²	123.4	93%	0.934	63%	0.627	S	S	*	*	S	Bend	trans	-120.5	3.4	177.8	-80.9	-72.9	0	0	0	117.6
263	S	45	Very low	54.2	Low	97 Å²	97	126.1 Å²	126.1	68%	0.678	64%	0.636	S	S	*	*			trans	-107.2	37.2	-167.1	-173.5	0	0	0	0	116.3
264	H	41.5	Very low	55.6	Low	145 Å²	145	125 Å²	125	67%	0.671	63%	0.627	S	S	*	*			trans	-104.6	-4.6	-177.4	-92.2	66.4	0	0	0	116.8
265	N	42.9	Very low	57.2	Low	150 Å²	150	120.7 Å²	120.7	80%	0.802	60%	0.6	S	S	*	*	S	Bend	trans	-116.5	109.7	-176.6	-70.3	-26.9	0	0	0	111.4
266	T	48.5	Very low	58.7	Low	92 Å²	92	120.8 Å²	120.8	56%	0.564	59%	0.592	S	S	*	*			trans	78.7	80.5	178.3	67.5	0	0	0	0	116	F105 L268	F105-T266 WeakPolarHBondContact CD2-OG1 3.43Å; T266-L268 PolarHBondContact O-N 3.36Å
267	Y	50.5	Low	60.8	Low	180 Å²	180	117.5 Å²	117.5	71%	0.706	58%	0.581	S	S	*	*			trans	-60.9	98.4	160.7	-69.2	-88.1	0	0	0	109.1
268	L	57.4	Low	63	Low	36 Å²	36	108 Å²	108	19%	0.188	54%	0.543	C	S	.	.			trans	-57	125.2	161.7	-95.6	65.3	0	0	0	107.1	Y242 T266 S270	Y242-L268 HydrophobicContact CD2-CD2 3.26Å; Y242-L268 HydrophobicContact CD2-CG 3.9Å; Y242-L268 HydrophobicContact CE2-CB 3.73Å; Y242-L268 HydrophobicContact CE2-CD2 3.32Å; Y242-L268 HydrophobicContact CE2-CG 3.52Å; Y242-L268 HydrophobicContact CG-CD2 4.44Å; T266-L268 PolarHBondContact O-N 3.36Å; L268-S270 PolarHBondContact O-N 3.06Å
269	P	60.7	Low	65.2	Low	58 Å²	58	106.7 Å²	106.7	38%	0.377	53%	0.525	S	S	.	.			trans	-64.3	93.8	-175.8	22.4	-31.1	0	0	0	111.2	Y242 N271	Y242-P269 PolarHBondContact OH-O 3.26Å; P269-N271 PolarHBondContact O-N 2.7Å; P269-N271 VanDerWaalsContact O-N 3.15Å
270	S	71.3	Confident	67.5	Low	76 Å²	76	104.6 Å²	104.6	53%	0.531	52%	0.516	S	S	.	.			trans	-83.6	17.6	-174.3	63.9	0	0	0	0	113.8	L268 K272	L268-S270 PolarHBondContact O-N 3.06Å; S270-K272 PolarHBondContact O-N 3.22Å; S270-K272 VanDerWaalsContact O-N 3.15Å
271	N	81	Confident	69.7	Low	85 Å²	85	97.8 Å²	97.8	46%	0.455	48%	0.482	S	S	.	.			trans	-67.7	116.3	179.5	-177.5	-24	0	0	0	109.7	P269 F273 F274 I275	P269-N271 PolarHBondContact O-N 2.7Å; P269-N271 VanDerWaalsContact O-N 3.15Å; N271-F273 PolarHBondContact O-N 3.36Å; N271-F273 VanDerWaalsContact O-N 3.15Å; N271-F273 WeakPolarHBondContact OD1-CB 3.3Å; N271-F273 PolarHBondContact OD1-N 3.34Å; N271-F274 HydrophobicContact CB-CD2 3.95Å; N271-F274 PolarHBondContact O-N 2.89Å; N271-F274 VanDerWaalsContact O-N 3.16Å; N271-I275 PolarHBondContact O-N 2.98Å; N271-I275 VanDerWaalsContact O-N 3.16Å
272	K	85.9	Confident	72.4	Confident	164 Å²	164	87.5 Å²	87.5	71%	0.713	44%	0.443	S	S	*	.	H	α-helix	trans	-53.4	-36	-177.6	-68.8	-175.9	178.7	179.1	0	112.7	S270 I275 Q276	S270-K272 PolarHBondContact O-N 3.22Å; S270-K272 VanDerWaalsContact O-N 3.15Å; K272-I275 PolarHBondContact O-N 3.35Å; K272-Q276 WeakPolarHBondContact O-CG 3.44Å; K272-Q276 PolarHBondContact O-N 3.31Å
273	F	84.9	Confident	74.9	Confident	132 Å²	132	82.8 Å²	82.8	58%	0.579	43%	0.426	S	S	*	.	H	α-helix	trans	-59.8	-53	178.8	173.4	-100.8	0	0	0	111.7	N271 I275 Q276 L277	N271-F273 PolarHBondContact O-N 3.36Å; N271-F273 VanDerWaalsContact O-N 3.15Å; N271-F273 WeakPolarHBondContact OD1-CB 3.3Å; N271-F273 PolarHBondContact OD1-N 3.34Å; F273-I275 VanDerWaalsContact C-N 3.34Å; F273-I275 PolarHBondContact O-N 3.01Å; F273-Q276 PolarHBondContact O-N 3.2Å; F273-L277 HydrophobicContact CE1-CD2 4.2Å; F273-L277 WeakPolarHBondContact O-CB 3.43Å; F273-L277 PolarHBondContact O-N 3.07Å
274	F	86.3	Confident	77.1	Confident	87 Å²	87	82.6 Å²	82.6	38%	0.382	41%	0.414	S	S	.	.	H	α-helix	trans	-65.5	-37.1	-179.9	-71.9	-71	0	0	0	112.2	N271 Q276 L277 Y278	N271-F274 HydrophobicContact CB-CD2 3.95Å; N271-F274 PolarHBondContact O-N 2.89Å; N271-F274 VanDerWaalsContact O-N 3.16Å; F274-Q276 VanDerWaalsContact C-N 3.33Å; F274-Q276 PolarHBondContact O-N 3.33Å; F274-L277 HydrophobicContact CD1-CD2 4.34Å; F274-L277 PolarHBondContact O-N 3.37Å; F274-Y278 HydrophobicContact CB-CD2 4.42Å; F274-Y278 HydrophobicContact CB-CE2 4.01Å; F274-Y278 WeakPolarHBondContact O-CB 3.46Å; F274-Y278 WeakPolarHBondContact O-CD2 3.44Å; F274-Y278 VanDerWaalsContact O-CG 3.25Å; F274-Y278 PolarHBondContact O-N 3.31Å
275	I	88.9	Confident	79.8	Confident	18 Å²	18	75.8 Å²	75.8	9%	0.092	38%	0.382	C	S	.	.	H	α-helix	trans	-57.9	-46.3	174.3	-70.6	172.1	0	0	0	111.1	Y242 L243 I246 N271 K272 F273 K279	Y242-I275 HydrophobicContact CE1-CG1 4.29Å; L243-I275 HydrophobicContact CD2-CG2 3.62Å; I246-I275 HydrophobicContact CD1-CD1 4.05Å; N271-I275 PolarHBondContact O-N 2.98Å; N271-I275 VanDerWaalsContact O-N 3.16Å; K272-I275 PolarHBondContact O-N 3.35Å; F273-I275 VanDerWaalsContact C-N 3.34Å; F273-I275 PolarHBondContact O-N 3.01Å; I275-K279 HydrophobicContact CG2-CD 4.33Å; I275-K279 WeakPolarHBondContact O-CG 3.37Å; I275-K279 PolarHBondContact O-N 2.95Å
276	Q	88.7	Confident	82.3	Confident	120 Å²	120	71.2 Å²	71.2	56%	0.561	37%	0.365	S	S	*	.	H	α-helix	trans	-68.9	-39.8	178.4	-64.3	-63	3.3	0	0	111.9	K272 F273 F274 Y278 K279 G280	K272-Q276 WeakPolarHBondContact O-CG 3.44Å; K272-Q276 PolarHBondContact O-N 3.31Å; F273-Q276 PolarHBondContact O-N 3.2Å; F274-Q276 VanDerWaalsContact C-N 3.33Å; F274-Q276 PolarHBondContact O-N 3.33Å; Q276-Y278 PolarHBondContact O-N 3.31Å; Q276-K279 PolarHBondContact O-N 3.21Å; Q276-G280 PolarHBondContact O-N 3.28Å
277	L	86.3	Confident	84.5	Confident	61 Å²	61	72 Å²	72	32%	0.319	37%	0.365	S	S	.	.	H	α-helix	trans	-59.2	-46.5	176.2	-175.5	63.2	0	0	0	111.6	L90 F273 F274 G280 C281	L90-L277 HydrophobicContact CD1-CD1 4.49Å; L90-L277 HydrophobicContact CD1-CD2 3.52Å; L90-L277 HydrophobicContact CD1-CG 3.78Å; L90-L277 HydrophobicContact CD2-CD1 3.88Å; L90-L277 HydrophobicContact CD2-CD2 4.42Å; L90-L277 HydrophobicContact CD2-CG 3.96Å; L90-L277 HydrophobicContact CG-CG 4.48Å; F273-L277 HydrophobicContact CE1-CD2 4.2Å; F273-L277 WeakPolarHBondContact O-CB 3.43Å; F273-L277 PolarHBondContact O-N 3.07Å; F274-L277 HydrophobicContact CD1-CD2 4.34Å; F274-L277 PolarHBondContact O-N 3.37Å; L277-G280 WeakPolarHBondContact O-CA 3.13Å; L277-G280 PolarHBondContact O-N 2.94Å; L277-C281 PolarHBondContact O-N 3.28Å; L277-C281 PolarHBondContact O-SG 3.28Å
278	Y	91.2	Very high	86.6	Confident	10 Å²	10	64.5 Å²	64.5	4%	0.039	34%	0.34	C	S	.	.	H	α-helix	trans	-68.6	-38	177.6	-64.2	-33.7	0	0	0	113	L90 C93 L94 T97 V98 F239 F274 Q276 G280 C281 F282	L90-Y278 HydrophobicContact CD1-CD1 4.16Å; L90-Y278 HydrophobicContact CD1-CE1 3.81Å; C93-Y278 HydrophobicContact CB-CE1 4.35Å; L94-Y278 HydrophobicContact CB-CD1 3.69Å; L94-Y278 HydrophobicContact CB-CE1 3.77Å; L94-Y278 HydrophobicContact CB-CG 4.27Å; L94-Y278 HydrophobicContact CD1-CD1 4.06Å; L94-Y278 HydrophobicContact CD1-CD2 3.99Å; L94-Y278 HydrophobicContact CD1-CG 3.73Å; L94-Y278 HydrophobicContact CG-CD1 4.34Å; L94-Y278 HydrophobicContact CG-CG 4.49Å; T97-Y278 PolarHBondContact OG1-OH 3.25Å; V98-Y278 HydrophobicContact CG2-CD2 3.86Å; V98-Y278 HydrophobicContact CG2-CE2 3.64Å; F239-Y278 HydrophobicContact CE2-CD2 4.39Å; F274-Y278 HydrophobicContact CB-CD2 4.42Å; F274-Y278 HydrophobicContact CB-CE2 4.01Å; F274-Y278 WeakPolarHBondContact O-CB 3.46Å; F274-Y278 WeakPolarHBondContact O-CD2 3.44Å; F274-Y278 VanDerWaalsContact O-CG 3.25Å; F274-Y278 PolarHBondContact O-N 3.31Å; Q276-Y278 PolarHBondContact O-N 3.31Å; Y278-G280 VanDerWaalsContact C-N 3.26Å; Y278-G280 PolarHBondContact O-N 2.88Å; Y278-C281 VanDerWaalsContact O-CB 3.24Å; Y278-C281 WeakPolarHBondContact O-CB 3.27Å; Y278-C281 PolarHBondContact O-N 3.24Å; Y278-F282 WeakPolarHBondContact O-CD2 3.14Å; Y278-F282 PolarHBondContact O-N 3.19Å
279	K	91.2	Very high	88.5	Confident	68 Å²	68	63.4 Å²	63.4	30%	0.296	34%	0.335	S	S	.	.	H	α-helix	trans	-55.8	-44.3	168.2	-76.3	174.3	179.3	-178.2	0	111.3	F239 L243 I275 Q276 C281 F282 I283	F239-K279 HydrophobicContact CE1-CG 3.69Å; F239-K279 HydrophobicContact CZ-CG 4.06Å; L243-K279 HydrophobicContact CD1-CG 4.48Å; I275-K279 HydrophobicContact CG2-CD 4.33Å; I275-K279 WeakPolarHBondContact O-CG 3.37Å; I275-K279 PolarHBondContact O-N 2.95Å; Q276-K279 PolarHBondContact O-N 3.21Å; K279-C281 VanDerWaalsContact C-N 3.26Å; K279-C281 PolarHBondContact O-N 2.94Å; K279-F282 PolarHBondContact O-N 3.37Å; K279-I283 WeakPolarHBondContact O-CG1 3.25Å; K279-I283 PolarHBondContact O-N 3.27Å; K279-I283 VanDerWaalsContact O-N 3.11Å
280	G	90.3	Very high	90.2	Very high	35 Å²	35	64.1 Å²	64.1	36%	0.361	34%	0.339	S	S	.	.	H	α-helix	trans	-58	-36.2	174	0	0	0	0	0	113.1	Q276 L277 Y278 I283 F284	Q276-G280 PolarHBondContact O-N 3.28Å; L277-G280 WeakPolarHBondContact O-CA 3.13Å; L277-G280 PolarHBondContact O-N 2.94Å; Y278-G280 VanDerWaalsContact C-N 3.26Å; Y278-G280 PolarHBondContact O-N 2.88Å; G280-I283 PolarHBondContact O-N 2.83Å; G280-F284 WeakPolarHBondContact O-CB 3.39Å; G280-F284 PolarHBondContact O-N 3.44Å
281	C	91.6	Very high	91.4	Very high	4 Å²	4	66.1 Å²	66.1	3%	0.027	34%	0.344	C	S	.	.	H	α-helix	trans	-61.7	-45.8	176.9	-60	0	0	0	0	112.6	Y87 L90 L277 Y278 K279 F284 S285	Y87-C281 HydrophobicContact CE2-CB 4.33Å; Y87-C281 PolarHBondContact OH-O 2.98Å; Y87-C281 VanDerWaalsContact OH-O 3.05Å; L90-C281 WeakPolarHBondContact CD2-SG 3.15Å; L90-C281 WeakPolarHBondContact CG-SG 3.24Å; L277-C281 PolarHBondContact O-N 3.28Å; L277-C281 PolarHBondContact O-SG 3.28Å; Y278-C281 VanDerWaalsContact O-CB 3.24Å; Y278-C281 WeakPolarHBondContact O-CB 3.27Å; Y278-C281 PolarHBondContact O-N 3.24Å; K279-C281 VanDerWaalsContact C-N 3.26Å; K279-C281 PolarHBondContact O-N 2.94Å; C281-F284 PolarHBondContact O-N 3.46Å; C281-S285 PolarHBondContact O-N 3.28Å; C281-S285 PolarHBondContact O-OG 3.44Å
282	F	95.5	Very high	92.2	Very high	6 Å²	6	63.7 Å²	63.7	3%	0.026	33%	0.332	C	S	.	.	H	α-helix	trans	-66.8	-40.4	178.4	-72.3	-76	0	0	0	111.8	L94 L231 W236 F239 Y278 K279 S285 A286	L94-F282 HydrophobicContact CD1-CE2 4.3Å; L94-F282 HydrophobicContact CD2-CD2 4.47Å; L94-F282 HydrophobicContact CD2-CE2 3.63Å; L94-F282 HydrophobicContact CD2-CZ 3.68Å; L231-F282 HydrophobicContact CD1-CD1 4.44Å; L231-F282 HydrophobicContact CD1-CE1 3.66Å; L231-F282 HydrophobicContact CD1-CZ 4.07Å; L231-F282 HydrophobicContact CG-CD1 4.29Å; L231-F282 HydrophobicContact CG-CE1 3.94Å; L231-F282 WeakPolarHBondContact O-CE1 3.45Å; W236-F282 HydrophobicContact CB-CD1 4.04Å; W236-F282 HydrophobicContact CB-CE1 3.9Å; W236-F282 HydrophobicContact CD2-CD1 4.47Å; W236-F282 HydrophobicContact CE3-CB 3.84Å; W236-F282 AromaticContact CE3-CD1 3.75Å; W236-F282 HydrophobicContact CE3-CD1 3.75Å; W236-F282 AromaticContact CE3-CD2 3.72Å; W236-F282 HydrophobicContact CE3-CD2 3.72Å; W236-F282 HydrophobicContact CE3-CE1 4.18Å; W236-F282 HydrophobicContact CE3-CE2 4.18Å; W236-F282 AromaticContact CE3-CG 3.49Å; W236-F282 HydrophobicContact CE3-CG 3.49Å; W236-F282 VanDerWaalsContact CE3-CG 3.49Å; W236-F282 HydrophobicContact CE3-CZ 4.38Å; W236-F282 HydrophobicContact CZ3-CB 3.96Å; W236-F282 AromaticContact CZ3-CD2 3.93Å; W236-F282 HydrophobicContact CZ3-CD2 3.93Å; W236-F282 AromaticContact CZ3-CG 3.93Å; W236-F282 HydrophobicContact CZ3-CG 3.93Å; F239-F282 HydrophobicContact CB-CE2 3.65Å; F239-F282 HydrophobicContact CB-CZ 3.67Å; F239-F282 AromaticContact CD1-CD2 3.68Å; F239-F282 HydrophobicContact CD1-CD2 3.68Å; F239-F282 AromaticContact CD1-CE2 3.32Å; F239-F282 HydrophobicContact CD1-CE2 3.32Å; F239-F282 HydrophobicContact CD1-CZ 4.19Å; F239-F282 HydrophobicContact CD2-CE2 4.06Å; F239-F282 AromaticContact CE1-CD2 3.98Å; F239-F282 HydrophobicContact CE1-CD2 3.98Å; F239-F282 AromaticContact CE1-CE2 3.91Å; F239-F282 HydrophobicContact CE1-CE2 3.91Å; F239-F282 HydrophobicContact CG-CD2 4.23Å; F239-F282 AromaticContact CG-CE2 3.4Å; F239-F282 HydrophobicContact CG-CE2 3.4Å; F239-F282 AromaticContact CG-CZ 3.98Å; F239-F282 HydrophobicContact CG-CZ 3.98Å; Y278-F282 WeakPolarHBondContact O-CD2 3.14Å; Y278-F282 PolarHBondContact O-N 3.19Å; K279-F282 PolarHBondContact O-N 3.37Å; F282-S285 WeakPolarHBondContact O-CB 3.43Å; F282-S285 PolarHBondContact O-N 2.82Å; F282-A286 PolarHBondContact O-N 2.87Å
283	I	93.7	Very high	92.8	Very high	114 Å²	114	59 Å²	59	59%	0.585	31%	0.314	S	S	*	.	H	α-helix	trans	-61.7	-46.7	174.9	-65.8	167.3	0	0	0	110.2	K279 G280 S285 A286 I287	K279-I283 WeakPolarHBondContact O-CG1 3.25Å; K279-I283 PolarHBondContact O-N 3.27Å; K279-I283 VanDerWaalsContact O-N 3.11Å; G280-I283 PolarHBondContact O-N 2.83Å; I283-S285 PolarHBondContact O-N 3.49Å; I283-A286 WeakPolarHBondContact O-CB 3.15Å; I283-A286 PolarHBondContact O-N 2.81Å; I283-I287 PolarHBondContact O-N 3.36Å
284	F	92	Very high	93.4	Very high	94 Å²	94	55.6 Å²	55.6	41%	0.412	31%	0.31	S	S	.	.	H	α-helix	trans	-63.1	-41.4	176.4	-177.6	-94.1	0	0	0	111.7	Y87 G280 C281 A286 I287 A288	Y87-F284 HydrophobicContact CD1-CD1 4.23Å; Y87-F284 AromaticContact CD1-CE1 3.94Å; Y87-F284 HydrophobicContact CD1-CE1 3.94Å; Y87-F284 AromaticContact CD2-CD1 3.85Å; Y87-F284 HydrophobicContact CD2-CD1 3.85Å; Y87-F284 HydrophobicContact CD2-CE1 4.12Å; Y87-F284 AromaticContact CE1-CD1 3.79Å; Y87-F284 HydrophobicContact CE1-CD1 3.79Å; Y87-F284 AromaticContact CE1-CE1 3.84Å; Y87-F284 HydrophobicContact CE1-CE1 3.84Å; Y87-F284 HydrophobicContact CE2-CB 4.3Å; Y87-F284 AromaticContact CE2-CD1 3.4Å; Y87-F284 HydrophobicContact CE2-CD1 3.4Å; Y87-F284 HydrophobicContact CE2-CE1 4.05Å; Y87-F284 HydrophobicContact CE2-CG 4.19Å; Y87-F284 HydrophobicContact CG-CD1 4.24Å; Y87-F284 HydrophobicContact CG-CE1 4.07Å; Y87-F284 AromaticContact CZ-CD1 3.36Å; Y87-F284 AromaticContact CZ-CE1 3.91Å; G280-F284 WeakPolarHBondContact O-CB 3.39Å; G280-F284 PolarHBondContact O-N 3.44Å; C281-F284 PolarHBondContact O-N 3.46Å; F284-A286 VanDerWaalsContact C-N 3.3Å; F284-A286 PolarHBondContact O-N 3.27Å; F284-I287 PolarHBondContact O-N 2.94Å; F284-A288 HydrophobicContact CD1-CB 4.11Å; F284-A288 HydrophobicContact CE1-CB 3.81Å; F284-A288 HydrophobicContact CZ-CB 4.18Å; F284-A288 VanDerWaalsContact O-CB 3.29Å; F284-A288 WeakPolarHBondContact O-CB 3.31Å; F284-A288 PolarHBondContact O-N 3.34Å
285	S	96.5	Very high	93.9	Very high	2 Å²	2	54.6 Å²	54.6	1%	0.014	31%	0.309	C	S	.	.	H	α-helix	trans	-57.1	-43.5	173.1	-61.1	0	0	0	0	111.7	Y87 L231 C281 F282 I283 I287 A288 V289	Y87-S285 PolarHBondContact OH-N 3.01Å; Y87-S285 PolarHBondContact OH-OG 3.41Å; L231-S285 WeakPolarHBondContact CD2-OG 3.34Å; C281-S285 PolarHBondContact O-N 3.28Å; C281-S285 PolarHBondContact O-OG 3.44Å; F282-S285 WeakPolarHBondContact O-CB 3.43Å; F282-S285 PolarHBondContact O-N 2.82Å; I283-S285 PolarHBondContact O-N 3.49Å; S285-I287 PolarHBondContact O-N 3.3Å; S285-I287 VanDerWaalsContact O-N 3.16Å; S285-A288 PolarHBondContact O-N 2.95Å; S285-V289 WeakPolarHBondContact O-CB 3.46Å; S285-V289 WeakPolarHBondContact O-CG2 3.44Å; S285-V289 PolarHBondContact O-N 3.23Å
286	A	96	Very high	94.3	Very high	54 Å²	54	54.2 Å²	54.2	45%	0.446	31%	0.307	S	S	.	.	H	α-helix	trans	-61.3	-25.7	-178.1	0	0	0	0	0	112.8	L232 F282 I283 F284 P290	L232-A286 HydrophobicContact CD2-CB 4.2Å; F282-A286 PolarHBondContact O-N 2.87Å; I283-A286 WeakPolarHBondContact O-CB 3.15Å; I283-A286 PolarHBondContact O-N 2.81Å; F284-A286 VanDerWaalsContact C-N 3.3Å; F284-A286 PolarHBondContact O-N 3.27Å; A286-P290 VanDerWaalsContact O-CD 3.25Å; A286-P290 WeakPolarHBondContact O-CD 3.24Å; A286-P290 WeakPolarHBondContact O-CG 3.39Å
287	I	94.7	Very high	94.8	Very high	108 Å²	108	51.2 Å²	51.2	55%	0.554	30%	0.303	S	S	*	.	H	α-helix	trans	-92.1	-47.5	175.7	-59.4	170.8	0	0	0	111.1	I283 F284 S285 P290 L291	I283-I287 PolarHBondContact O-N 3.36Å; F284-I287 PolarHBondContact O-N 2.94Å; S285-I287 PolarHBondContact O-N 3.3Å; S285-I287 VanDerWaalsContact O-N 3.16Å; I287-P290 WeakPolarHBondContact O-CD 3.22Å; I287-L291 HydrophobicContact CG2-CD1 4.45Å; I287-L291 WeakPolarHBondContact O-CG 3.4Å
288	A	94	Very high	95.4	Very high	23 Å²	23	53.6 Å²	53.6	19%	0.19	31%	0.308	C	S	.	.	H	α-helix	trans	-69	-38.4	-173.9	0	0	0	0	0	112.5	F284 S285 L291 V292	F284-A288 HydrophobicContact CD1-CB 4.11Å; F284-A288 HydrophobicContact CE1-CB 3.81Å; F284-A288 HydrophobicContact CZ-CB 4.18Å; F284-A288 VanDerWaalsContact O-CB 3.29Å; F284-A288 WeakPolarHBondContact O-CB 3.31Å; F284-A288 PolarHBondContact O-N 3.34Å; S285-A288 PolarHBondContact O-N 2.95Å; A288-L291 WeakPolarHBondContact O-CB 3.38Å; A288-L291 PolarHBondContact O-N 3.4Å; A288-V292 WeakPolarHBondContact O-CG2 3.47Å; A288-V292 PolarHBondContact O-N 2.93Å
289	V	97.2	Very high	95.7	Very high	13 Å²	13	53.3 Å²	53.3	8%	0.079	31%	0.307	C	S	.	.	H	α-helix	trans	-63.9	-48	-174.9	172	0	0	0	0	112.3	G228 I229 L232 S285 L291 V292 I293	G228-V289 VanDerWaalsContact CA-CG2 3.46Å; I229-V289 HydrophobicContact CG1-CG1 4.23Å; L232-V289 HydrophobicContact CD1-CB 4.19Å; L232-V289 HydrophobicContact CD1-CG1 4.43Å; L232-V289 HydrophobicContact CD1-CG2 4.21Å; S285-V289 WeakPolarHBondContact O-CB 3.46Å; S285-V289 WeakPolarHBondContact O-CG2 3.44Å; S285-V289 PolarHBondContact O-N 3.23Å; V289-L291 VanDerWaalsContact C-N 3.27Å; V289-L291 PolarHBondContact O-N 2.88Å; V289-V292 PolarHBondContact O-N 3.37Å; V289-I293 HydrophobicContact CG1-CD1 3.65Å; V289-I293 HydrophobicContact CG1-CG1 4.3Å; V289-I293 WeakPolarHBondContact O-CB 3.47Å; V289-I293 VanDerWaalsContact O-CG1 3.28Å; V289-I293 WeakPolarHBondContact O-CG1 3.36Å; V289-I293 PolarHBondContact O-N 2.9Å
290	P	97.7	Very high	96.1	Very high	72 Å²	72	52.1 Å²	52.1	47%	0.468	31%	0.305	S	S	.	.	H	α-helix	trans	-55.9	-38.6	172.7	-28.3	35.6	0	0	0	114	A286 I287 I293 A294	A286-P290 VanDerWaalsContact O-CD 3.25Å; A286-P290 WeakPolarHBondContact O-CD 3.24Å; A286-P290 WeakPolarHBondContact O-CG 3.39Å; I287-P290 WeakPolarHBondContact O-CD 3.22Å; P290-I293 PolarHBondContact O-N 3.45Å; P290-A294 WeakPolarHBondContact O-CB 3.47Å; P290-A294 PolarHBondContact O-N 3.21Å
291	L	96.1	Very high	96.5	Very high	119 Å²	119	55.1 Å²	55.1	62%	0.623	31%	0.306	S	S	*	.	H	α-helix	trans	-67.2	-43.8	178.3	-64.1	174.3	0	0	0	111.8	I287 A288 V289 I293 A294 L295	I287-L291 HydrophobicContact CG2-CD1 4.45Å; I287-L291 WeakPolarHBondContact O-CG 3.4Å; A288-L291 WeakPolarHBondContact O-CB 3.38Å; A288-L291 PolarHBondContact O-N 3.4Å; V289-L291 VanDerWaalsContact C-N 3.27Å; V289-L291 PolarHBondContact O-N 2.88Å; L291-I293 VanDerWaalsContact C-N 3.34Å; L291-A294 PolarHBondContact O-N 3.48Å; L291-L295 PolarHBondContact O-N 3.18Å
292	V	97.5	Very high	96.8	Very high	33 Å²	33	55 Å²	55	20%	0.2	31%	0.305	C	S	.	.	H	α-helix	trans	-64.4	-40.2	175.5	176	0	0	0	0	110.7	L221 M224 A288 V289 L295 C296	L221-V292 HydrophobicContact CB-CG1 4.48Å; L221-V292 HydrophobicContact CD2-CG1 3.98Å; M224-V292 HydrophobicContact CB-CG1 4.02Å; M224-V292 HydrophobicContact CE-CG1 4.47Å; A288-V292 WeakPolarHBondContact O-CG2 3.47Å; A288-V292 PolarHBondContact O-N 2.93Å; V289-V292 PolarHBondContact O-N 3.37Å; V292-L295 PolarHBondContact O-N 3.02Å; V292-C296 VanDerWaalsContact O-CB 3.26Å; V292-C296 WeakPolarHBondContact O-CB 3.32Å; V292-C296 PolarHBondContact O-N 3.42Å
293	I	98.4	Very high	96.9	Very high	66 Å²	66	55 Å²	55	34%	0.338	31%	0.305	S	S	.	.	H	α-helix	trans	-63.1	-44.2	175.5	-70.3	167.7	0	0	0	111	S225 I229 V289 P290 L291 L295 C296 A297	S225-I293 WeakPolarHBondContact OG-CG1 3.38Å; I229-I293 HydrophobicContact CD1-CD1 3.96Å; I229-I293 HydrophobicContact CG1-CD1 4.22Å; V289-I293 HydrophobicContact CG1-CD1 3.65Å; V289-I293 HydrophobicContact CG1-CG1 4.3Å; V289-I293 WeakPolarHBondContact O-CB 3.47Å; V289-I293 VanDerWaalsContact O-CG1 3.28Å; V289-I293 WeakPolarHBondContact O-CG1 3.36Å; V289-I293 PolarHBondContact O-N 2.9Å; P290-I293 PolarHBondContact O-N 3.45Å; L291-I293 VanDerWaalsContact C-N 3.34Å; I293-L295 VanDerWaalsContact C-N 3.34Å; I293-L295 PolarHBondContact O-N 2.86Å; I293-C296 WeakPolarHBondContact O-CB 3.14Å; I293-C296 PolarHBondContact O-N 2.89Å; I293-A297 WeakPolarHBondContact O-CB 3.35Å; I293-A297 PolarHBondContact O-N 3.14Å
294	A	97.8	Very high	97.1	Very high	61 Å²	61	50.5 Å²	50.5	50%	0.504	29%	0.285	S	S	.	.	H	α-helix	trans	-61.6	-43.3	177.7	0	0	0	0	0	111.7	P290 L291 A297 W298	P290-A294 WeakPolarHBondContact O-CB 3.47Å; P290-A294 PolarHBondContact O-N 3.21Å; L291-A294 PolarHBondContact O-N 3.48Å; A294-A297 PolarHBondContact O-N 3.46Å; A294-W298 PolarHBondContact O-N 2.94Å
295	L	96.5	Very high	97.4	Very high	66 Å²	66	48.1 Å²	48.1	35%	0.346	28%	0.276	S	S	.	.	H	α-helix	trans	-63.8	-43.4	174.1	-176.8	59.3	0	0	0	111.4	F217 L221 L291 V292 I293 A297 W298 H299	F217-L295 HydrophobicContact CZ-CD2 4.17Å; L221-L295 HydrophobicContact CD1-CD2 4.21Å; L221-L295 HydrophobicContact CD1-CG 3.88Å; L221-L295 HydrophobicContact CD2-CD2 3.8Å; L221-L295 HydrophobicContact CD2-CG 4.23Å; L291-L295 PolarHBondContact O-N 3.18Å; V292-L295 PolarHBondContact O-N 3.02Å; I293-L295 VanDerWaalsContact C-N 3.34Å; I293-L295 PolarHBondContact O-N 2.86Å; L295-A297 VanDerWaalsContact C-N 3.35Å; L295-A297 PolarHBondContact O-N 3.47Å; L295-W298 WeakPolarHBondContact O-CB 3.46Å; L295-W298 PolarHBondContact O-N 3.18Å; L295-H299 PolarHBondContact O-CD2 3.09Å; L295-H299 VanDerWaalsContact O-CD2 3.25Å; L295-H299 PolarHBondContact O-N 3.39Å
296	C	98.3	Very high	97.4	Very high	9 Å²	9	48.4 Å²	48.4	6%	0.061	28%	0.279	C	S	.	.	H	α-helix	trans	-59.8	-44.1	175.9	-172.4	0	0	0	0	111.9	L221 I222 V292 I293 W298 H299 T300	L221-C296 HydrophobicContact CB-CB 3.99Å; I222-C296 WeakPolarHBondContact CD1-SG 3.47Å; V292-C296 VanDerWaalsContact O-CB 3.26Å; V292-C296 WeakPolarHBondContact O-CB 3.32Å; V292-C296 PolarHBondContact O-N 3.42Å; I293-C296 WeakPolarHBondContact O-CB 3.14Å; I293-C296 PolarHBondContact O-N 2.89Å; C296-W298 VanDerWaalsContact C-N 3.34Å; C296-W298 PolarHBondContact O-N 3.09Å; C296-H299 PolarHBondContact O-N 2.92Å; C296-T300 WeakPolarHBondContact O-CB 3.29Å; C296-T300 PolarHBondContact O-N 2.62Å; C296-T300 PolarHBondContact O-OG1 2.76Å
297	A	98.5	Very high	97.4	Very high	57 Å²	57	46.3 Å²	46.3	47%	0.471	26%	0.26	S	S	.	.	H	α-helix	trans	-62.8	-41	176.9	0	0	0	0	0	111.6	I293 A294 L295 T300 Y301	I293-A297 WeakPolarHBondContact O-CB 3.35Å; I293-A297 PolarHBondContact O-N 3.14Å; A294-A297 PolarHBondContact O-N 3.46Å; L295-A297 VanDerWaalsContact C-N 3.35Å; L295-A297 PolarHBondContact O-N 3.47Å; A297-T300 WeakPolarHBondContact O-CB 3.28Å; A297-T300 PolarHBondContact O-N 2.67Å; A297-Y301 PolarHBondContact O-N 3.12Å
298	W	98.3	Very high	97.5	Very high	112 Å²	112	41.1 Å²	41.1	42%	0.424	23%	0.234	S	C	.	.	H	α-helix	trans	-60.3	-49.6	174.1	176.4	-105.8	0	0	0	112.2	A294 L295 C296 T300 Y301 L302	A294-W298 PolarHBondContact O-N 2.94Å; L295-W298 WeakPolarHBondContact O-CB 3.46Å; L295-W298 PolarHBondContact O-N 3.18Å; C296-W298 VanDerWaalsContact C-N 3.34Å; C296-W298 PolarHBondContact O-N 3.09Å; W298-T300 VanDerWaalsContact C-N 3.32Å; W298-T300 PolarHBondContact O-N 2.68Å; W298-Y301 HydrophobicContact CZ3-CD1 4.36Å; W298-Y301 WeakPolarHBondContact O-CB 3.45Å; W298-Y301 PolarHBondContact O-N 3.07Å; W298-L302 HydrophobicContact CZ2-CD1 4.36Å; W298-L302 HydrophobicContact CZ2-CD2 4.03Å; W298-L302 HydrophobicContact CZ2-CG 4.38Å; W298-L302 WeakPolarHBondContact O-CG 3.37Å; W298-L302 PolarHBondContact O-N 3.37Å
299	H	98.5	Very high	97.7	Very high	3 Å²	3	41 Å²	41	1%	0.014	23%	0.232	C	C	.	.	H	α-helix	trans	-66	-35.2	176.9	-77.4	-79.6	0	0	0	112.4	D199 H200 F217 Y218 L295 C296 Y301 L302 I303	D199-H299 IonicContact OD2-CE1 3.1Å; D199-H299 PolarHBondContact OD2-CE1 3.07Å; D199-H299 VanDerWaalsContact OD2-CE1 3.26Å; D199-H299 IonicContact OD2-ND1 2.77Å; H200-H299 AromaticContact CE1-CE1 3.98Å; F217-H299 AromaticContact CE1-CD2 3.67Å; F217-H299 AromaticContact CE1-CE1 3.62Å; F217-H299 AromaticContact CE1-ND1 3.97Å; F217-H299 AromaticContact CE1-NE2 3.41Å; F217-H299 WeakPolarHBondContact CE1-NE2 3.44Å; F217-H299 AromaticContact CZ-NE2 3.82Å; Y218-H299 HydrophobicContact CD2-CB 3.84Å; Y218-H299 HydrophobicContact CE2-CB 4.21Å; L295-H299 PolarHBondContact O-CD2 3.09Å; L295-H299 VanDerWaalsContact O-CD2 3.25Å; L295-H299 PolarHBondContact O-N 3.39Å; C296-H299 PolarHBondContact O-N 2.92Å; H299-Y301 VanDerWaalsContact C-N 3.28Å; H299-Y301 PolarHBondContact O-N 3.48Å; H299-L302 PolarHBondContact O-N 3.45Å; H299-I303 HydrophobicContact CB-CD1 4.5Å; H299-I303 WeakPolarHBondContact O-CB 3.34Å; H299-I303 WeakPolarHBondContact O-CD1 3.46Å; H299-I303 WeakPolarHBondContact O-CG1 3.36Å; H299-I303 PolarHBondContact O-N 3.46Å
300	T	98.7	Very high	97.6	Very high	44 Å²	44	42.4 Å²	42.4	27%	0.27	24%	0.238	S	C	.	.	H	α-helix	trans	-58.1	-43.1	173.2	-59.8	0	0	0	0	110.7	Y218 C296 A297 W298 S304 W341	Y218-T300 WeakPolarHBondContact CE2-OG1 3.23Å; Y218-T300 PolarHBondContact OH-OG1 3.3Å; C296-T300 WeakPolarHBondContact O-CB 3.29Å; C296-T300 PolarHBondContact O-N 2.62Å; C296-T300 PolarHBondContact O-OG1 2.76Å; A297-T300 WeakPolarHBondContact O-CB 3.28Å; A297-T300 PolarHBondContact O-N 2.67Å; W298-T300 VanDerWaalsContact C-N 3.32Å; W298-T300 PolarHBondContact O-N 2.68Å; T300-S304 VanDerWaalsContact O-CB 3.31Å; T300-S304 WeakPolarHBondContact O-CB 3.17Å; T300-S304 PolarHBondContact O-N 3.07Å; T300-S304 PolarHBondContact O-OG 3.19Å; T300-W341 HydrophobicContact CG2-CH2 4.2Å; T300-W341 HydrophobicContact CG2-CZ2 3.66Å
301	Y	98.5	Very high	97.5	Very high	97 Å²	97	39.6 Å²	39.6	38%	0.38	22%	0.219	S	C	.	.	H	α-helix	trans	-63.1	-46.6	175.1	173.6	-100.1	0	0	0	112.2	A297 W298 H299 S304 N305 R312	A297-Y301 PolarHBondContact O-N 3.12Å; W298-Y301 HydrophobicContact CZ3-CD1 4.36Å; W298-Y301 WeakPolarHBondContact O-CB 3.45Å; W298-Y301 PolarHBondContact O-N 3.07Å; H299-Y301 VanDerWaalsContact C-N 3.28Å; H299-Y301 PolarHBondContact O-N 3.48Å; Y301-S304 PolarHBondContact O-N 3.09Å; Y301-N305 VanDerWaalsContact CE2-ND2 3.26Å; Y301-N305 WeakPolarHBondContact CE2-ND2 3.41Å; Y301-N305 PolarHBondContact O-N 3.12Å; Y301-N305 PolarHBondContact O-ND2 3.23Å; Y301-R312 VanDerWaalsContact CE1-CZ 3.44Å; Y301-R312 VanDerWaalsContact CE1-NH1 3.27Å; Y301-R312 VanDerWaalsContact OH-CZ 3.23Å; Y301-R312 PolarHBondContact OH-NH1 3.5Å; Y301-R312 PolarHBondContact OH-NH2 3.09Å
302	L	98.5	Very high	97.5	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-61.6	-48.8	178.6	-66.9	179.4	0	0	0	112.4	W298 H299 S304 N305 G306 E307 S309 R312	W298-L302 HydrophobicContact CZ2-CD1 4.36Å; W298-L302 HydrophobicContact CZ2-CD2 4.03Å; W298-L302 HydrophobicContact CZ2-CG 4.38Å; W298-L302 WeakPolarHBondContact O-CG 3.37Å; W298-L302 PolarHBondContact O-N 3.37Å; H299-L302 PolarHBondContact O-N 3.45Å; L302-S304 VanDerWaalsContact C-N 3.29Å; L302-S304 PolarHBondContact O-N 3.17Å; L302-N305 CarbonylContact O-C 3.38Å; L302-N305 PolarHBondContact O-N 3.28Å; L302-N305 VanDerWaalsContact O-N 3.08Å; L302-G306 PolarHBondContact O-N 3.03Å; L302-E307 CarbonylContact C-O 3.4Å; L302-E307 PolarHBondContact O-N 2.83Å; L302-S309 VanDerWaalsContact CD1-OG 3.3Å; L302-S309 WeakPolarHBondContact CD1-OG 3.35Å; L302-R312 HydrophobicContact CD2-CB 3.74Å; L302-R312 HydrophobicContact CD2-CG 3.88Å
303	I	98.4	Very high	97.3	Very high	6 Å²	6	42.4 Å²	42.4	3%	0.031	22%	0.223	C	C	.	.	H	α-helix	trans	-59.9	-42.3	178.4	-65.8	158.2	0	0	0	110.4	Y218 H299 N305 G306 N340 W341 F344	Y218-I303 HydrophobicContact CD1-CD1 4.2Å; Y218-I303 HydrophobicContact CD2-CD1 3.49Å; Y218-I303 VanDerWaalsContact CD2-CD1 3.49Å; Y218-I303 HydrophobicContact CE1-CD1 4.45Å; Y218-I303 HydrophobicContact CE2-CD1 3.79Å; Y218-I303 HydrophobicContact CG-CD1 3.72Å; H299-I303 HydrophobicContact CB-CD1 4.5Å; H299-I303 WeakPolarHBondContact O-CB 3.34Å; H299-I303 WeakPolarHBondContact O-CD1 3.46Å; H299-I303 WeakPolarHBondContact O-CG1 3.36Å; H299-I303 PolarHBondContact O-N 3.46Å; I303-N305 PolarHBondContact O-N 3.38Å; I303-G306 PolarHBondContact O-N 3.23Å; I303-N340 WeakPolarHBondContact O-CB 3.31Å; I303-W341 HydrophobicContact CB-CH2 3.96Å; I303-W341 HydrophobicContact CB-CZ2 3.94Å; I303-W341 HydrophobicContact CB-CZ3 4.49Å; I303-W341 HydrophobicContact CD1-CH2 3.79Å; I303-W341 HydrophobicContact CD1-CZ3 4.16Å; I303-W341 HydrophobicContact CG2-CD2 3.84Å; I303-W341 HydrophobicContact CG2-CE3 3.87Å; I303-W341 HydrophobicContact CG2-CH2 3.76Å; I303-W341 HydrophobicContact CG2-CZ2 3.78Å; I303-W341 HydrophobicContact CG2-CZ3 3.84Å; I303-F344 HydrophobicContact CD1-CD1 3.86Å; I303-F344 HydrophobicContact CD1-CD2 4.38Å; I303-F344 HydrophobicContact CD1-CE1 3.39Å; I303-F344 HydrophobicContact CD1-CE2 3.95Å; I303-F344 HydrophobicContact CD1-CG 4.34Å; I303-F344 HydrophobicContact CD1-CZ 3.43Å; I303-F344 VanDerWaalsContact CD1-CZ 3.43Å; I303-F344 HydrophobicContact CG1-CD1 4.19Å; I303-F344 HydrophobicContact CG1-CD2 4.03Å; I303-F344 HydrophobicContact CG1-CE1 4.08Å; I303-F344 HydrophobicContact CG1-CE2 3.89Å; I303-F344 HydrophobicContact CG1-CG 4.18Å; I303-F344 HydrophobicContact CG1-CZ 3.93Å; I303-F344 HydrophobicContact CG2-CB 3.8Å; I303-F344 HydrophobicContact CG2-CD1 3.77Å; I303-F344 HydrophobicContact CG2-CD2 4.2Å; I303-F344 HydrophobicContact CG2-CE1 4.45Å; I303-F344 HydrophobicContact CG2-CG 3.64Å
304	S	98.4	Very high	96.9	Very high	21 Å²	21	42.3 Å²	42.3	15%	0.147	22%	0.223	C	C	.	.	H	α-helix	trans	-61.5	-26.8	179.3	-60.8	0	0	0	0	113.1	T300 Y301 L302 N340 W341	T300-S304 VanDerWaalsContact O-CB 3.31Å; T300-S304 WeakPolarHBondContact O-CB 3.17Å; T300-S304 PolarHBondContact O-N 3.07Å; T300-S304 PolarHBondContact O-OG 3.19Å; Y301-S304 PolarHBondContact O-N 3.09Å; L302-S304 VanDerWaalsContact C-N 3.29Å; L302-S304 PolarHBondContact O-N 3.17Å; S304-N340 PolarHBondContact O-ND2 3.24Å; S304-W341 PolarHBondContact OG-NE1 2.8Å
305	N	96.7	Very high	96.7	Very high	43 Å²	43	40 Å²	40	23%	0.23	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	7.3	177.3	-66.7	-69.4	0	0	0	113.3	Y301 L302 I303 E307 N331 D334	Y301-N305 VanDerWaalsContact CE2-ND2 3.26Å; Y301-N305 WeakPolarHBondContact CE2-ND2 3.41Å; Y301-N305 PolarHBondContact O-N 3.12Å; Y301-N305 PolarHBondContact O-ND2 3.23Å; L302-N305 CarbonylContact O-C 3.38Å; L302-N305 PolarHBondContact O-N 3.28Å; L302-N305 VanDerWaalsContact O-N 3.08Å; I303-N305 PolarHBondContact O-N 3.38Å; N305-E307 VanDerWaalsContact C-N 3.29Å; N305-E307 HydrophobicContact CB-CG 3.63Å; N305-E307 VanDerWaalsContact CB-OE1 3.27Å; N305-E307 WeakPolarHBondContact CB-OE1 3.28Å; N305-E307 VanDerWaalsContact O-CG 3.26Å; N305-E307 WeakPolarHBondContact O-CG 3.19Å; N305-E307 PolarHBondContact O-N 2.81Å; N305-N331 PolarHBondContact O-ND2 2.83Å; N305-D334 WeakPolarHBondContact O-CB 3.49Å
306	G	96.6	Very high	96.5	Very high	8 Å²	8	39.5 Å²	39.5	8%	0.082	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	25.9	179.1	0	0	0	0	0	114.3	R184 L302 I303 N331 N340	R184-G306 PolarHBondContact NH2-O 3.4Å; R184-G306 VanDerWaalsContact NH2-O 3.09Å; L302-G306 PolarHBondContact O-N 3.03Å; I303-G306 PolarHBondContact O-N 3.23Å; G306-N331 PolarHBondContact O-ND2 3.19Å; G306-N340 PolarHBondContact N-ND2 3.42Å
307	E	96.5	Very high	96.2	Very high	10 Å²	10	45.1 Å²	45.1	5%	0.047	23%	0.231	C	C	.	.			trans	-115.3	151.2	-174.9	-21.1	-177.2	-134.4	0	0	112.1	L302 N305 E311 R312 N315	L302-E307 CarbonylContact C-O 3.4Å; L302-E307 PolarHBondContact O-N 2.83Å; N305-E307 VanDerWaalsContact C-N 3.29Å; N305-E307 HydrophobicContact CB-CG 3.63Å; N305-E307 VanDerWaalsContact CB-OE1 3.27Å; N305-E307 WeakPolarHBondContact CB-OE1 3.28Å; N305-E307 VanDerWaalsContact O-CG 3.26Å; N305-E307 WeakPolarHBondContact O-CG 3.19Å; N305-E307 PolarHBondContact O-N 2.81Å; E307-E311 WeakPolarHBondContact CA-OE2 3.46Å; E307-E311 HydrophobicContact CB-CB 4.23Å; E307-R312 IonicContact OE1-CZ 3.26Å; E307-R312 IonicContact OE1-NH1 2.62Å; E307-R312 PolarHBondContact OE1-NH1 2.89Å; E307-R312 VanDerWaalsContact OE2-CA 3.3Å; E307-R312 WeakPolarHBondContact OE2-CA 3.29Å; E307-R312 VanDerWaalsContact OE2-CD 3.26Å; E307-R312 WeakPolarHBondContact OE2-CD 3.45Å; E307-N315 PolarHBondContact OE2-ND2 2.77Å
308	T	97.5	Very high	95.7	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.229	C	C	.	.			trans	-88.5	170.3	154.7	76.2	0	0	0	0	111.6	Y197 M198 D199 I310 E311 R312	Y197-T308 HydrophobicContact CD2-CG2 3.95Å; Y197-T308 HydrophobicContact CE1-CG2 4.48Å; Y197-T308 HydrophobicContact CE2-CG2 3.37Å; M198-T308 PolarHBondContact O-OG1 3.11Å; D199-T308 HydrophobicContact CB-CG2 4.39Å; T308-I310 VanDerWaalsContact C-N 3.3Å; T308-I310 PolarHBondContact O-N 3.1Å; T308-I310 PolarHBondContact OG1-N 3.49Å; T308-E311 PolarHBondContact N-OE2 3.07Å; T308-E311 PolarHBondContact O-N 3.5Å; T308-E311 WeakPolarHBondContact OG1-CG 3.22Å; T308-E311 PolarHBondContact OG1-N 3Å; T308-R312 WeakPolarHBondContact O-CB 3.43Å; T308-R312 PolarHBondContact O-N 3.41Å
309	S	96.3	Very high	95.4	Very high	21 Å²	21	44.7 Å²	44.7	15%	0.147	23%	0.227	C	C	.	.	H	α-helix	trans	-60.1	-39.1	175.6	-55.4	0	0	0	0	111.9	D199 L302 H313	D199-S309 VanDerWaalsContact OD1-CB 3.22Å; D199-S309 WeakPolarHBondContact OD1-CB 3.3Å; D199-S309 PolarHBondContact OD1-N 3.35Å; D199-S309 PolarHBondContact OD1-OG 2.92Å; L302-S309 VanDerWaalsContact CD1-OG 3.3Å; L302-S309 WeakPolarHBondContact CD1-OG 3.35Å; S309-H313 PolarHBondContact O-N 2.82Å
310	I	96.1	Very high	95	Very high	42 Å²	42	49.5 Å²	49.5	22%	0.215	25%	0.247	C	C	.	.	H	α-helix	trans	-67.7	-46.2	174.8	-69.9	165.6	0	0	0	110.3	H186 M198 D199 T308 R312 H313 I314	H186-I310 HydrophobicContact CB-CD1 3.98Å; H186-I310 VanDerWaalsContact CE1-CG2 3.43Å; H186-I310 WeakPolarHBondContact CE1-CG2 3.35Å; H186-I310 WeakPolarHBondContact NE2-CG2 3.49Å; M198-I310 HydrophobicContact CB-CD1 4.42Å; M198-I310 HydrophobicContact CE-CD1 4.38Å; M198-I310 HydrophobicContact CG-CD1 4.05Å; M198-I310 HydrophobicContact SD-CD1 4.31Å; D199-I310 WeakPolarHBondContact O-CD1 3.47Å; D199-I310 VanDerWaalsContact O-CG1 3.31Å; D199-I310 WeakPolarHBondContact O-CG1 3.33Å; T308-I310 VanDerWaalsContact C-N 3.3Å; T308-I310 PolarHBondContact O-N 3.1Å; T308-I310 PolarHBondContact OG1-N 3.49Å; I310-R312 VanDerWaalsContact C-N 3.27Å; I310-R312 PolarHBondContact O-N 2.79Å; I310-H313 PolarHBondContact O-N 3.35Å; I310-H313 VanDerWaalsContact O-N 3.15Å; I310-I314 HydrophobicContact CG2-CD1 3.79Å; I310-I314 HydrophobicContact CG2-CG1 4.47Å; I310-I314 WeakPolarHBondContact O-CG1 3.35Å; I310-I314 PolarHBondContact O-N 3.22Å; I310-I314 VanDerWaalsContact O-N 3.11Å
311	E	95.1	Very high	94.6	Very high	12 Å²	12	50.1 Å²	50.1	6%	0.056	25%	0.248	C	C	.	.	H	α-helix	trans	-60.9	-39.4	178.7	-72.1	169.5	173.6	0	0	111.2	R184 E307 T308 H313 I314 N315	R184-E311 WeakPolarHBondContact CB-OE1 3.41Å; R184-E311 VanDerWaalsContact CG-OE1 3.28Å; R184-E311 WeakPolarHBondContact CG-OE1 3.49Å; R184-E311 IonicContact CZ-OE1 3.26Å; R184-E311 IonicContact CZ-OE2 3.28Å; R184-E311 IonicContact NE-OE1 2.67Å; R184-E311 PolarHBondContact NE-OE1 3.06Å; R184-E311 IonicContact NE-OE2 3.4Å; R184-E311 IonicContact NH2-OE1 3.47Å; R184-E311 PolarHBondContact NH2-OE1 3.45Å; R184-E311 IonicContact NH2-OE2 3.63Å; R184-E311 PolarHBondContact NH2-OE2 2.71Å; E307-E311 WeakPolarHBondContact CA-OE2 3.46Å; E307-E311 HydrophobicContact CB-CB 4.23Å; T308-E311 PolarHBondContact N-OE2 3.07Å; T308-E311 PolarHBondContact O-N 3.5Å; T308-E311 WeakPolarHBondContact OG1-CG 3.22Å; T308-E311 PolarHBondContact OG1-N 3Å; E311-H313 VanDerWaalsContact C-N 3.27Å; E311-H313 PolarHBondContact O-N 3.21Å; E311-I314 CarbonylContact O-C 3.52Å; E311-I314 WeakPolarHBondContact O-CA 3.33Å; E311-I314 WeakPolarHBondContact O-CB 3.49Å; E311-I314 PolarHBondContact O-N 3.19Å; E311-N315 VanDerWaalsContact O-CB 3.25Å; E311-N315 WeakPolarHBondContact O-CB 3.32Å; E311-N315 PolarHBondContact O-N 2.91Å; E311-N315 PolarHBondContact O-ND2 3.4Å; E311-N315 PolarHBondContact O-OD1 2.74Å
312	R	95.8	Very high	94.1	Very high	69 Å²	69	46.2 Å²	46.2	26%	0.26	23%	0.234	S	C	.	.	H	α-helix	trans	-55.9	-42.3	175.5	-179.8	58.4	179.3	-147.9	-3.8	112.9	Y301 L302 E307 T308 I310 A316	Y301-R312 VanDerWaalsContact CE1-CZ 3.44Å; Y301-R312 VanDerWaalsContact CE1-NH1 3.27Å; Y301-R312 VanDerWaalsContact OH-CZ 3.23Å; Y301-R312 PolarHBondContact OH-NH1 3.5Å; Y301-R312 PolarHBondContact OH-NH2 3.09Å; L302-R312 HydrophobicContact CD2-CB 3.74Å; L302-R312 HydrophobicContact CD2-CG 3.88Å; E307-R312 IonicContact OE1-CZ 3.26Å; E307-R312 IonicContact OE1-NH1 2.62Å; E307-R312 PolarHBondContact OE1-NH1 2.89Å; E307-R312 VanDerWaalsContact OE2-CA 3.3Å; E307-R312 WeakPolarHBondContact OE2-CA 3.29Å; E307-R312 VanDerWaalsContact OE2-CD 3.26Å; E307-R312 WeakPolarHBondContact OE2-CD 3.45Å; T308-R312 WeakPolarHBondContact O-CB 3.43Å; T308-R312 PolarHBondContact O-N 3.41Å; I310-R312 VanDerWaalsContact C-N 3.27Å; I310-R312 PolarHBondContact O-N 2.79Å; R312-A316 VanDerWaalsContact O-CB 3.27Å; R312-A316 WeakPolarHBondContact O-CB 3.5Å; R312-A316 PolarHBondContact O-N 2.69Å
313	H	93.4	Very high	93.6	Very high	142 Å²	142	56 Å²	56	66%	0.657	27%	0.271	S	S	*	.	H	α-helix	trans	-67.8	-38.9	175.8	-71.7	-17	0	0	0	112.5	S309 I310 E311 K317	S309-H313 PolarHBondContact O-N 2.82Å; I310-H313 PolarHBondContact O-N 3.35Å; I310-H313 VanDerWaalsContact O-N 3.15Å; E311-H313 VanDerWaalsContact C-N 3.27Å; E311-H313 PolarHBondContact O-N 3.21Å; H313-K317 PolarHBondContact O-N 2.83Å
314	I	91.1	Very high	93.2	Very high	64 Å²	64	62 Å²	62	33%	0.328	30%	0.299	S	S	.	.	H	α-helix	trans	-65.8	-50	176.9	-67.5	170.4	0	0	0	110.5	I310 E311 A316 K317 F318	I310-I314 HydrophobicContact CG2-CD1 3.79Å; I310-I314 HydrophobicContact CG2-CG1 4.47Å; I310-I314 WeakPolarHBondContact O-CG1 3.35Å; I310-I314 PolarHBondContact O-N 3.22Å; I310-I314 VanDerWaalsContact O-N 3.11Å; E311-I314 CarbonylContact O-C 3.52Å; E311-I314 WeakPolarHBondContact O-CA 3.33Å; E311-I314 WeakPolarHBondContact O-CB 3.49Å; E311-I314 PolarHBondContact O-N 3.19Å; I314-A316 PolarHBondContact O-N 3.45Å; I314-K317 WeakPolarHBondContact O-CB 3.45Å; I314-K317 PolarHBondContact O-N 3.48Å; I314-K317 VanDerWaalsContact O-N 3.1Å; I314-F318 HydrophobicContact CG2-CD2 3.55Å; I314-F318 HydrophobicContact CG2-CE2 3.35Å; I314-F318 VanDerWaalsContact O-CD2 3.31Å; I314-F318 WeakPolarHBondContact O-CD2 3.4Å; I314-F318 PolarHBondContact O-N 3.44Å
315	N	92.7	Very high	92.7	Very high	13 Å²	13	67.5 Å²	67.5	7%	0.07	32%	0.316	C	S	.	.	H	α-helix	trans	-58.4	-47.5	178.7	-67.5	-7.5	0	0	0	110.6	E307 E311 K317 F318 T319 Y329	E307-N315 PolarHBondContact OE2-ND2 2.77Å; E311-N315 VanDerWaalsContact O-CB 3.25Å; E311-N315 WeakPolarHBondContact O-CB 3.32Å; E311-N315 PolarHBondContact O-N 2.91Å; E311-N315 PolarHBondContact O-ND2 3.4Å; E311-N315 PolarHBondContact O-OD1 2.74Å; N315-K317 PolarHBondContact O-N 2.78Å; N315-F318 PolarHBondContact O-N 3.43Å; N315-F318 VanDerWaalsContact O-N 3.13Å; N315-T319 WeakPolarHBondContact O-CB 3.2Å; N315-T319 PolarHBondContact O-N 2.97Å; N315-T319 PolarHBondContact O-OG1 2.99Å; N315-Y329 HydrophobicContact CB-CE1 3.76Å; N315-Y329 PolarHBondContact OD1-OH 3.38Å
316	A	93	Very high	92.2	Very high	55 Å²	55	68.8 Å²	68.8	46%	0.455	34%	0.34	S	S	.	.	H	α-helix	trans	-57.8	-37.6	176.5	0	0	0	0	0	112.8	R312 I314 K320	R312-A316 VanDerWaalsContact O-CB 3.27Å; R312-A316 WeakPolarHBondContact O-CB 3.5Å; R312-A316 PolarHBondContact O-N 2.69Å; I314-A316 PolarHBondContact O-N 3.45Å; A316-K320 PolarHBondContact O-N 2.83Å
317	K	90.9	Very high	91.7	Very high	128 Å²	128	68.6 Å²	68.6	56%	0.557	34%	0.337	S	S	*	.	H	α-helix	trans	-67.7	-46.7	175.3	-174	-175.1	177.5	-171.5	0	111.3	H313 I314 N315 K320 I321	H313-K317 PolarHBondContact O-N 2.83Å; I314-K317 WeakPolarHBondContact O-CB 3.45Å; I314-K317 PolarHBondContact O-N 3.48Å; I314-K317 VanDerWaalsContact O-N 3.1Å; N315-K317 PolarHBondContact O-N 2.78Å; K317-K320 PolarHBondContact O-N 2.86Å; K317-I321 HydrophobicContact CG-CD1 4.07Å; K317-I321 WeakPolarHBondContact O-CG1 3.47Å; K317-I321 PolarHBondContact O-N 2.8Å; K317-I321 VanDerWaalsContact O-N 3.1Å
318	F	89.3	Confident	91.3	Very high	100 Å²	100	74.1 Å²	74.1	44%	0.439	37%	0.366	S	S	.	.	H	α-helix	trans	-63.4	-43.5	177.6	-78.7	-62.4	0	0	0	112.4	I314 N315 K320 I321 L322 Y329	I314-F318 HydrophobicContact CG2-CD2 3.55Å; I314-F318 HydrophobicContact CG2-CE2 3.35Å; I314-F318 VanDerWaalsContact O-CD2 3.31Å; I314-F318 WeakPolarHBondContact O-CD2 3.4Å; I314-F318 PolarHBondContact O-N 3.44Å; N315-F318 PolarHBondContact O-N 3.43Å; N315-F318 VanDerWaalsContact O-N 3.13Å; F318-K320 VanDerWaalsContact C-N 3.25Å; F318-K320 PolarHBondContact O-N 3.07Å; F318-I321 PolarHBondContact O-N 3.44Å; F318-I321 VanDerWaalsContact O-N 3.12Å; F318-L322 WeakPolarHBondContact O-CB 3.21Å; F318-L322 WeakPolarHBondContact O-CG 3.48Å; F318-L322 PolarHBondContact O-N 2.65Å; F318-Y329 HydrophobicContact CB-CD2 4.07Å; F318-Y329 HydrophobicContact CB-CE2 4.09Å; F318-Y329 HydrophobicContact CB-CG 4.4Å
319	T	91.1	Very high	90.8	Very high	60 Å²	60	76.3 Å²	76.3	37%	0.368	37%	0.374	S	S	.	.	H	α-helix	trans	-54	-43.6	173.9	-58.2	0	0	0	0	111.5	N315 R323 Y329	N315-T319 WeakPolarHBondContact O-CB 3.2Å; N315-T319 PolarHBondContact O-N 2.97Å; N315-T319 PolarHBondContact O-OG1 2.99Å; T319-R323 WeakPolarHBondContact O-CB 3.36Å; T319-R323 PolarHBondContact O-N 3.19Å; T319-Y329 WeakPolarHBondContact OG1-CD1 3.48Å
320	K	91.2	Very high	90.5	Very high	103 Å²	103	81.3 Å²	81.3	45%	0.448	39%	0.39	S	S	.	.	H	α-helix	trans	-64.6	-45.6	177.5	-175.4	178.6	177.4	-177.4	0	112.1	A316 K317 F318 Q324	A316-K320 PolarHBondContact O-N 2.83Å; K317-K320 PolarHBondContact O-N 2.86Å; F318-K320 VanDerWaalsContact C-N 3.25Å; F318-K320 PolarHBondContact O-N 3.07Å; K320-Q324 WeakPolarHBondContact O-CG 3.31Å; K320-Q324 PolarHBondContact O-N 2.97Å
321	I	89.1	Confident	90.3	Very high	57 Å²	57	80.1 Å²	80.1	29%	0.292	38%	0.384	S	S	.	.	H	α-helix	trans	-65.1	-45.5	-179.1	-68	167.2	0	0	0	110.8	K317 F318 Q324	K317-I321 HydrophobicContact CG-CD1 4.07Å; K317-I321 WeakPolarHBondContact O-CG1 3.47Å; K317-I321 PolarHBondContact O-N 2.8Å; K317-I321 VanDerWaalsContact O-N 3.1Å; F318-I321 PolarHBondContact O-N 3.44Å; F318-I321 VanDerWaalsContact O-N 3.12Å; I321-Q324 WeakPolarHBondContact O-CB 3.43Å; I321-Q324 PolarHBondContact O-N 2.91Å
322	L	87.9	Confident	90.1	Very high	16 Å²	16	81 Å²	81	8%	0.084	39%	0.391	C	S	.	.	H	α-helix	trans	-70.8	-37.9	-178.6	-72.7	172.1	0	0	0	111.8	F318 Q324 R325 G326 V327 Y329 L406	F318-L322 WeakPolarHBondContact O-CB 3.21Å; F318-L322 WeakPolarHBondContact O-CG 3.48Å; F318-L322 PolarHBondContact O-N 2.65Å; L322-Q324 VanDerWaalsContact C-N 3.25Å; L322-Q324 PolarHBondContact O-N 3Å; L322-R325 CarbonylContact O-C 3.27Å; L322-R325 WeakPolarHBondContact O-CA 3.25Å; L322-R325 WeakPolarHBondContact O-CB 3.46Å; L322-R325 PolarHBondContact O-N 3.31Å; L322-G326 PolarHBondContact O-N 3.32Å; L322-V327 CarbonylContact C-O 3.59Å; L322-V327 HydrophobicContact CB-CB 3.97Å; L322-V327 HydrophobicContact CB-CG1 4.04Å; L322-V327 WeakPolarHBondContact CB-O 3.37Å; L322-V327 HydrophobicContact CD1-CG1 4.34Å; L322-V327 HydrophobicContact CD2-CB 4.04Å; L322-V327 HydrophobicContact CD2-CG1 3.86Å; L322-V327 HydrophobicContact CG-CG1 4.29Å; L322-V327 PolarHBondContact O-N 2.72Å; L322-Y329 HydrophobicContact CD1-CD2 3.57Å; L322-Y329 HydrophobicContact CD1-CG 4.1Å; L322-L406 HydrophobicContact CD2-CD2 4Å
323	R	89.6	Confident	89.9	Confident	207 Å²	207	79 Å²	79	78%	0.781	38%	0.384	S	S	*	.	H	α-helix	trans	-59.9	-35.4	174.3	-176.2	176.4	-179.1	173.3	2.5	112.8	T319 R325 G326 V327	T319-R323 WeakPolarHBondContact O-CB 3.36Å; T319-R323 PolarHBondContact O-N 3.19Å; R323-R325 PolarHBondContact O-N 3.01Å; R323-G326 PolarHBondContact O-N 3.42Å; R323-V327 PolarHBondContact N-O 3.26Å
324	Q	88.9	Confident	90	Very high	132 Å²	132	74.4 Å²	74.4	62%	0.617	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-20.5	174.1	-72.1	172.6	-22.8	0	0	112.8	K320 I321 L322	K320-Q324 WeakPolarHBondContact O-CG 3.31Å; K320-Q324 PolarHBondContact O-N 2.97Å; I321-Q324 WeakPolarHBondContact O-CB 3.43Å; I321-Q324 PolarHBondContact O-N 2.91Å; L322-Q324 VanDerWaalsContact C-N 3.25Å; L322-Q324 PolarHBondContact O-N 3Å
325	R	87.1	Confident	90.1	Very high	135 Å²	135	73.1 Å²	73.1	51%	0.509	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	10.3	178.6	-63.3	167.9	170.2	-159.2	-0.6	112.5	L322 R323 V327 I411	L322-R325 CarbonylContact O-C 3.27Å; L322-R325 WeakPolarHBondContact O-CA 3.25Å; L322-R325 WeakPolarHBondContact O-CB 3.46Å; L322-R325 PolarHBondContact O-N 3.31Å; R323-R325 PolarHBondContact O-N 3.01Å; R325-V327 HydrophobicContact CB-CG2 4.5Å; R325-V327 PolarHBondContact O-N 3.02Å; R325-I411 HydrophobicContact CB-CD1 3.96Å; R325-I411 HydrophobicContact CG-CD1 4.11Å
326	G	87.3	Confident	90.2	Very high	71 Å²	71	74 Å²	74	73%	0.732	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	74	5.4	-175.8	0	0	0	0	0	114.7	L322 R323	L322-G326 PolarHBondContact O-N 3.32Å; R323-G326 PolarHBondContact O-N 3.42Å
327	V	85.4	Confident	90.4	Very high	3 Å²	3	76.9 Å²	76.9	2%	0.018	38%	0.376	C	S	.	.			trans	-97.7	133.7	-175.2	173.8	0	0	0	0	111.4	L322 R323 R325 S405 L406 S409	L322-V327 CarbonylContact C-O 3.59Å; L322-V327 HydrophobicContact CB-CB 3.97Å; L322-V327 HydrophobicContact CB-CG1 4.04Å; L322-V327 WeakPolarHBondContact CB-O 3.37Å; L322-V327 HydrophobicContact CD1-CG1 4.34Å; L322-V327 HydrophobicContact CD2-CB 4.04Å; L322-V327 HydrophobicContact CD2-CG1 3.86Å; L322-V327 HydrophobicContact CG-CG1 4.29Å; L322-V327 PolarHBondContact O-N 2.72Å; R323-V327 PolarHBondContact N-O 3.26Å; R325-V327 HydrophobicContact CB-CG2 4.5Å; R325-V327 PolarHBondContact O-N 3.02Å; V327-S405 WeakPolarHBondContact CG1-OG 3.47Å; V327-S405 VanDerWaalsContact CG2-O 3.32Å; V327-S405 WeakPolarHBondContact CG2-O 3.5Å; V327-L406 HydrophobicContact CG2-CD2 4.49Å; V327-S409 WeakPolarHBondContact CG2-OG 3.45Å
328	I	87.7	Confident	90.6	Very high	126 Å²	126	75.1 Å²	75.1	65%	0.646	37%	0.369	S	S	*	.			trans	-87.7	115.2	174.8	-59.4	175.9	0	0	0	109.1
329	Y	87.3	Confident	90.8	Very high	46 Å²	46	72 Å²	72	18%	0.18	36%	0.356	C	S	.	.			trans	-73.1	133.4	171.9	180	-104.5	0	0	0	111.2	N315 F318 T319 L322 P332	N315-Y329 HydrophobicContact CB-CE1 3.76Å; N315-Y329 PolarHBondContact OD1-OH 3.38Å; F318-Y329 HydrophobicContact CB-CD2 4.07Å; F318-Y329 HydrophobicContact CB-CE2 4.09Å; F318-Y329 HydrophobicContact CB-CG 4.4Å; T319-Y329 WeakPolarHBondContact OG1-CD1 3.48Å; L322-Y329 HydrophobicContact CD1-CD2 3.57Å; L322-Y329 HydrophobicContact CD1-CG 4.1Å; Y329-P332 WeakPolarHBondContact OH-CD 3.45Å
330	R	89.8	Confident	91.1	Very high	126 Å²	126	69.6 Å²	69.6	48%	0.475	34%	0.341	S	S	.	.			trans	-122.9	136.4	169.1	-63.1	-172.6	-177.9	160	-6.1	109.4	P332 T398 S401 V402	R330-P332 WeakPolarHBondContact O-CD 3.27Å; R330-T398 HydrophobicContact CB-CG2 4.02Å; R330-S401 WeakPolarHBondContact CD-OG 3.37Å; R330-S401 PolarHBondContact NH1-OG 2.82Å; R330-V402 HydrophobicContact CB-CG2 4.43Å
331	N	91.6	Very high	91.4	Very high	18 Å²	18	66.8 Å²	66.8	10%	0.096	33%	0.328	C	S	.	.			trans	-66.7	119.2	177.8	178	15.7	0	0	0	109.6	N305 G306 H333 D334	N305-N331 PolarHBondContact O-ND2 2.83Å; G306-N331 PolarHBondContact O-ND2 3.19Å; N331-H333 PolarHBondContact O-N 3.22Å; N331-H333 PolarHBondContact OD1-N 3.15Å; N331-D334 HydrophobicContact CB-CB 3.99Å; N331-D334 PolarHBondContact O-N 3.11Å
332	P	91.5	Very high	91.8	Very high	31 Å²	31	64.4 Å²	64.4	20%	0.201	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-12	179.1	30.8	-37.4	0	0	0	113.6	Y329 R330 L394 N395 T398	Y329-P332 WeakPolarHBondContact OH-CD 3.45Å; R330-P332 WeakPolarHBondContact O-CD 3.27Å; P332-L394 HydrophobicContact CB-CD2 4.29Å; P332-N395 PolarHBondContact O-N 3.19Å; P332-T398 WeakPolarHBondContact CA-OG1 3.3Å
333	H	92.8	Very high	92.2	Very high	25 Å²	25	64.5 Å²	64.5	12%	0.116	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	2.1	176.6	-62.1	-59.9	0	0	0	113.6	N331 F335 L394	N331-H333 PolarHBondContact O-N 3.22Å; N331-H333 PolarHBondContact OD1-N 3.15Å; H333-F335 VanDerWaalsContact O-CD2 3.29Å; H333-F335 WeakPolarHBondContact O-CD2 3.44Å; H333-L394 WeakPolarHBondContact CE1-CD2 3.34Å
334	D	94.6	Very high	92.5	Very high	46 Å²	46	55.9 Å²	55.9	25%	0.246	28%	0.283	C	S	.	.			trans	-87.9	114.1	174.2	-174.7	8.8	0	0	0	110.4	N305 N331 G336 N340 N395	N305-D334 WeakPolarHBondContact O-CB 3.49Å; N331-D334 HydrophobicContact CB-CB 3.99Å; N331-D334 PolarHBondContact O-N 3.11Å; D334-G336 WeakPolarHBondContact OD1-CA 3.32Å; D334-G336 PolarHBondContact OD1-N 3.41Å; D334-N340 PolarHBondContact OD1-ND2 2.86Å; D334-N395 PolarHBondContact O-ND2 3.43Å
335	F	93.7	Very high	92.9	Very high	37 Å²	37	50.4 Å²	50.4	16%	0.162	26%	0.258	C	S	.	.			trans	-102.9	10.7	175.3	-61.3	-89.5	0	0	0	112.3	H333 L339 N340 K343 E393 N395	H333-F335 VanDerWaalsContact O-CD2 3.29Å; H333-F335 WeakPolarHBondContact O-CD2 3.44Å; F335-L339 HydrophobicContact CB-CB 3.66Å; F335-L339 HydrophobicContact CB-CD1 4.06Å; F335-N340 PolarHBondContact N-OD1 3.27Å; F335-K343 HydrophobicContact CD2-CD 4.35Å; F335-E393 HydrophobicContact CE1-CG 4Å; F335-E393 WeakPolarHBondContact CE1-OE1 3.38Å; F335-E393 HydrophobicContact CZ-CB 3.94Å; F335-E393 HydrophobicContact CZ-CG 3.85Å; F335-E393 WeakPolarHBondContact CZ-O 3.37Å; F335-N395 HydrophobicContact CD1-CB 4.01Å; F335-N395 HydrophobicContact CE1-CB 3.89Å; F335-N395 HydrophobicContact CZ-CB 4.43Å
336	G	94.3	Very high	93.3	Very high	33 Å²	33	44.2 Å²	44.2	34%	0.34	24%	0.236	S	C	.	.			trans	85.7	154.7	-170.6	0	0	0	0	0	112.6	D334 F338 L339 N340	D334-G336 WeakPolarHBondContact OD1-CA 3.32Å; D334-G336 PolarHBondContact OD1-N 3.41Å; G336-F338 PolarHBondContact O-N 3.01Å; G336-L339 PolarHBondContact O-N 3.17Å; G336-L339 VanDerWaalsContact O-N 3.14Å; G336-N340 WeakPolarHBondContact O-CB 3.5Å; G336-N340 PolarHBondContact O-N 3.31Å; G336-N340 PolarHBondContact O-ND2 3.48Å
337	I	96.7	Very high	93.8	Very high	115 Å²	115	41.4 Å²	41.4	59%	0.59	20%	0.204	S	C	*	.	H	α-helix	trans	-46.7	-55.5	-170	-61.4	174	0	0	0	111.6	L339 N340 W341	I337-L339 PolarHBondContact O-N 3.41Å; I337-N340 PolarHBondContact O-N 2.93Å; I337-W341 PolarHBondContact O-N 3.4Å
338	F	95.3	Very high	94.1	Very high	91 Å²	91	41.5 Å²	41.5	40%	0.399	20%	0.204	S	C	.	.	H	α-helix	trans	-60	-49.5	-176	-178.6	-103	0	0	0	112.9	G336 W341 I342 Y356 Y366 L369	G336-F338 PolarHBondContact O-N 3.01Å; F338-W341 PolarHBondContact O-N 3.18Å; F338-I342 HydrophobicContact CD1-CD1 4.32Å; F338-I342 HydrophobicContact CD2-CG2 4.47Å; F338-I342 HydrophobicContact CE1-CD1 3.93Å; F338-I342 HydrophobicContact CE1-CG2 4.23Å; F338-I342 HydrophobicContact CE2-CG2 4.09Å; F338-I342 HydrophobicContact CZ-CG2 3.98Å; F338-I342 WeakPolarHBondContact O-CG2 3.28Å; F338-I342 PolarHBondContact O-N 3.39Å; F338-Y356 HydrophobicContact CE1-CE2 4.21Å; F338-Y356 WeakPolarHBondContact CE1-OH 3.41Å; F338-Y366 HydrophobicContact CZ-CE1 4.36Å; F338-L369 HydrophobicContact CE1-CD1 4.5Å; F338-L369 HydrophobicContact CZ-CD1 3.75Å
339	L	94.6	Very high	94.2	Very high	34 Å²	34	38.4 Å²	38.4	18%	0.178	19%	0.189	C	C	.	.	H	α-helix	trans	-66.5	-40.1	-178.5	-71.8	-176.8	0	0	0	111.8	F335 G336 I337 W341 I342 K343 M353 Y356	F335-L339 HydrophobicContact CB-CB 3.66Å; F335-L339 HydrophobicContact CB-CD1 4.06Å; G336-L339 PolarHBondContact O-N 3.17Å; G336-L339 VanDerWaalsContact O-N 3.14Å; I337-L339 PolarHBondContact O-N 3.41Å; L339-W341 VanDerWaalsContact C-N 3.33Å; L339-W341 PolarHBondContact O-N 2.95Å; L339-I342 HydrophobicContact CD2-CD1 3.69Å; L339-I342 HydrophobicContact CD2-CG1 4.35Å; L339-I342 WeakPolarHBondContact O-CG1 3.18Å; L339-I342 PolarHBondContact O-N 3.17Å; L339-K343 WeakPolarHBondContact O-CB 3.39Å; L339-K343 VanDerWaalsContact O-CG 3.28Å; L339-K343 WeakPolarHBondContact O-CG 3.36Å; L339-K343 PolarHBondContact O-N 3.41Å; L339-M353 HydrophobicContact CD2-CE 4.29Å; L339-M353 HydrophobicContact CD2-SD 4.27Å; L339-Y356 HydrophobicContact CD1-CE1 4.47Å; L339-Y356 HydrophobicContact CD2-CD1 4.24Å; L339-Y356 HydrophobicContact CD2-CD2 4.46Å; L339-Y356 HydrophobicContact CD2-CE1 3.76Å; L339-Y356 HydrophobicContact CD2-CE2 3.99Å
340	N	97.1	Very high	94.3	Very high	9 Å²	9	40.5 Å²	40.5	5%	0.048	20%	0.199	C	C	.	.	H	α-helix	trans	-58.9	-46	175.8	-65.3	-17.3	0	0	0	111	I303 S304 G306 D334 F335 G336 I337 F344	I303-N340 WeakPolarHBondContact O-CB 3.31Å; S304-N340 PolarHBondContact O-ND2 3.24Å; G306-N340 PolarHBondContact N-ND2 3.42Å; D334-N340 PolarHBondContact OD1-ND2 2.86Å; F335-N340 PolarHBondContact N-OD1 3.27Å; G336-N340 WeakPolarHBondContact O-CB 3.5Å; G336-N340 PolarHBondContact O-N 3.31Å; G336-N340 PolarHBondContact O-ND2 3.48Å; I337-N340 PolarHBondContact O-N 2.93Å; N340-F344 WeakPolarHBondContact O-CB 3.48Å; N340-F344 PolarHBondContact O-N 3.1Å
341	W	97.9	Very high	94.2	Very high	45 Å²	45	41.1 Å²	41.1	17%	0.17	21%	0.207	C	C	.	.	H	α-helix	trans	-66.4	-45.7	179.3	-83.3	104.7	0	0	0	113.3	Y218 T300 I303 S304 I337 F338 L339 K343 F344 L345	Y218-W341 HydrophobicContact CD1-CZ3 4.25Å; Y218-W341 AromaticContact CE1-CH2 3.66Å; Y218-W341 HydrophobicContact CE1-CH2 3.66Å; Y218-W341 AromaticContact CE1-CZ3 3.49Å; Y218-W341 HydrophobicContact CE1-CZ3 3.49Å; Y218-W341 VanDerWaalsContact CE1-CZ3 3.49Å; Y218-W341 HydrophobicContact CE2-CH2 4.04Å; Y218-W341 AromaticContact CZ-CH2 3.36Å; Y218-W341 AromaticContact CZ-CZ3 3.74Å; Y218-W341 WeakPolarHBondContact OH-CH2 3.31Å; T300-W341 HydrophobicContact CG2-CH2 4.2Å; T300-W341 HydrophobicContact CG2-CZ2 3.66Å; I303-W341 HydrophobicContact CB-CH2 3.96Å; I303-W341 HydrophobicContact CB-CZ2 3.94Å; I303-W341 HydrophobicContact CB-CZ3 4.49Å; I303-W341 HydrophobicContact CD1-CH2 3.79Å; I303-W341 HydrophobicContact CD1-CZ3 4.16Å; I303-W341 HydrophobicContact CG2-CD2 3.84Å; I303-W341 HydrophobicContact CG2-CE3 3.87Å; I303-W341 HydrophobicContact CG2-CH2 3.76Å; I303-W341 HydrophobicContact CG2-CZ2 3.78Å; I303-W341 HydrophobicContact CG2-CZ3 3.84Å; S304-W341 PolarHBondContact OG-NE1 2.8Å; I337-W341 PolarHBondContact O-N 3.4Å; F338-W341 PolarHBondContact O-N 3.18Å; L339-W341 VanDerWaalsContact C-N 3.33Å; L339-W341 PolarHBondContact O-N 2.95Å; W341-K343 VanDerWaalsContact C-N 3.33Å; W341-K343 PolarHBondContact O-N 2.97Å; W341-F344 HydrophobicContact CE3-CD1 4.42Å; W341-F344 HydrophobicContact CZ3-CD1 4.22Å; W341-F344 PolarHBondContact O-N 3.26Å; W341-L345 HydrophobicContact CE3-CD1 3.79Å; W341-L345 HydrophobicContact CE3-CD2 4.39Å; W341-L345 HydrophobicContact CE3-CG 3.89Å; W341-L345 HydrophobicContact CZ3-CD1 4.37Å; W341-L345 HydrophobicContact CZ3-CD2 4.33Å; W341-L345 HydrophobicContact CZ3-CG 4.33Å; W341-L345 VanDerWaalsContact O-CB 3.29Å; W341-L345 WeakPolarHBondContact O-CB 3.49Å; W341-L345 WeakPolarHBondContact O-CG 3.47Å; W341-L345 PolarHBondContact O-N 2.83Å
342	I	96.2	Very high	94	Very high	6 Å²	6	42.4 Å²	42.4	3%	0.031	21%	0.213	C	C	.	.	H	α-helix	trans	-68.2	-33	-179.9	67	175.3	0	0	0	112.1	F338 L339 C346 L347 I348 M353 Y356 L369	F338-I342 HydrophobicContact CD1-CD1 4.32Å; F338-I342 HydrophobicContact CD2-CG2 4.47Å; F338-I342 HydrophobicContact CE1-CD1 3.93Å; F338-I342 HydrophobicContact CE1-CG2 4.23Å; F338-I342 HydrophobicContact CE2-CG2 4.09Å; F338-I342 HydrophobicContact CZ-CG2 3.98Å; F338-I342 WeakPolarHBondContact O-CG2 3.28Å; F338-I342 PolarHBondContact O-N 3.39Å; L339-I342 HydrophobicContact CD2-CD1 3.69Å; L339-I342 HydrophobicContact CD2-CG1 4.35Å; L339-I342 WeakPolarHBondContact O-CG1 3.18Å; L339-I342 PolarHBondContact O-N 3.17Å; I342-C346 PolarHBondContact O-N 3.12Å; I342-L347 HydrophobicContact CB-CB 4.17Å; I342-L347 HydrophobicContact CG2-CD1 4.34Å; I342-L347 PolarHBondContact O-N 3.13Å; I342-I348 HydrophobicContact CB-CG2 4.24Å; I342-I348 HydrophobicContact CD1-CB 4.37Å; I342-I348 HydrophobicContact CD1-CD1 4.21Å; I342-I348 HydrophobicContact CD1-CG2 3.9Å; I342-I348 HydrophobicContact CG1-CG2 3.83Å; I342-M353 HydrophobicContact CD1-CE 4.16Å; I342-Y356 HydrophobicContact CD1-CE2 4.41Å; I342-L369 HydrophobicContact CG2-CD2 4.46Å
343	K	95.9	Very high	93.9	Very high	18 Å²	18	41.9 Å²	41.9	8%	0.078	21%	0.208	C	C	.	.	H	α-helix	trans	-67.3	-51.4	172.4	-72	-178.5	-177.2	-170.6	0	110	F335 L339 W341 C346 M353 Y386 E393	F335-K343 HydrophobicContact CD2-CD 4.35Å; L339-K343 WeakPolarHBondContact O-CB 3.39Å; L339-K343 VanDerWaalsContact O-CG 3.28Å; L339-K343 WeakPolarHBondContact O-CG 3.36Å; L339-K343 PolarHBondContact O-N 3.41Å; W341-K343 VanDerWaalsContact C-N 3.33Å; W341-K343 PolarHBondContact O-N 2.97Å; K343-C346 PolarHBondContact O-N 3.4Å; K343-C346 VanDerWaalsContact O-N 3.14Å; K343-M353 HydrophobicContact CD-CE 4.36Å; K343-M353 HydrophobicContact CG-CE 3.88Å; K343-Y386 HydrophobicContact CB-CD1 4.23Å; K343-Y386 HydrophobicContact CB-CG 4.2Å; K343-Y386 HydrophobicContact CD-CD1 4.11Å; K343-Y386 HydrophobicContact CD-CE1 3.79Å; K343-Y386 HydrophobicContact CG-CD1 4.05Å; K343-Y386 HydrophobicContact CG-CD2 4.27Å; K343-Y386 HydrophobicContact CG-CE1 4.07Å; K343-Y386 HydrophobicContact CG-CE2 4.29Å; K343-Y386 HydrophobicContact CG-CG 4.16Å; K343-E393 IonicContact NZ-OE1 3.89Å; K343-E393 PolarHBondContact NZ-OE1 3.1Å; K343-E393 VanDerWaalsContact NZ-OE1 3.07Å; K343-E393 IonicContact NZ-OE2 2.8Å; K343-E393 PolarHBondContact NZ-OE2 3.24Å
344	F	97.5	Very high	93.6	Very high	26 Å²	26	44.8 Å²	44.8	11%	0.114	24%	0.236	C	C	.	.	H	α-helix	trans	-60.6	-49.3	-178.7	177.4	-97.9	0	0	0	113.2	H214 Y218 I303 N340 W341 C346	H214-F344 HydrophobicContact CB-CE2 4.41Å; H214-F344 AromaticContact CD2-CE2 3.81Å; H214-F344 AromaticContact CE1-CE2 3.91Å; H214-F344 AromaticContact CG-CE2 3.74Å; H214-F344 AromaticContact ND1-CE2 3.82Å; H214-F344 AromaticContact NE2-CE2 3.91Å; Y218-F344 AromaticContact CD1-CE1 3.77Å; Y218-F344 HydrophobicContact CD1-CE1 3.77Å; Y218-F344 HydrophobicContact CD1-CZ 4.47Å; Y218-F344 AromaticContact CG-CE1 3.89Å; Y218-F344 HydrophobicContact CG-CE1 3.89Å; Y218-F344 HydrophobicContact CG-CZ 4.15Å; I303-F344 HydrophobicContact CD1-CD1 3.86Å; I303-F344 HydrophobicContact CD1-CD2 4.38Å; I303-F344 HydrophobicContact CD1-CE1 3.39Å; I303-F344 HydrophobicContact CD1-CE2 3.95Å; I303-F344 HydrophobicContact CD1-CG 4.34Å; I303-F344 HydrophobicContact CD1-CZ 3.43Å; I303-F344 VanDerWaalsContact CD1-CZ 3.43Å; I303-F344 HydrophobicContact CG1-CD1 4.19Å; I303-F344 HydrophobicContact CG1-CD2 4.03Å; I303-F344 HydrophobicContact CG1-CE1 4.08Å; I303-F344 HydrophobicContact CG1-CE2 3.89Å; I303-F344 HydrophobicContact CG1-CG 4.18Å; I303-F344 HydrophobicContact CG1-CZ 3.93Å; I303-F344 HydrophobicContact CG2-CB 3.8Å; I303-F344 HydrophobicContact CG2-CD1 3.77Å; I303-F344 HydrophobicContact CG2-CD2 4.2Å; I303-F344 HydrophobicContact CG2-CE1 4.45Å; I303-F344 HydrophobicContact CG2-CG 3.64Å; N340-F344 WeakPolarHBondContact O-CB 3.48Å; N340-F344 PolarHBondContact O-N 3.1Å; W341-F344 HydrophobicContact CE3-CD1 4.42Å; W341-F344 HydrophobicContact CZ3-CD1 4.22Å; W341-F344 PolarHBondContact O-N 3.26Å; F344-C346 PolarHBondContact O-N 3.04Å; F344-C346 VanDerWaalsContact O-N 3.15Å; F344-C346 PolarHBondContact O-SG 2.85Å
345	L	97.4	Very high	93.2	Very high	17 Å²	17	45 Å²	45	9%	0.089	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-1	179.9	-68.9	-179	0	0	0	113.3	R215 L219 W341 L347 I377	R215-L345 PolarHBondContact NE-O 3.2Å; L219-L345 HydrophobicContact CD2-CD2 4.27Å; W341-L345 HydrophobicContact CE3-CD1 3.79Å; W341-L345 HydrophobicContact CE3-CD2 4.39Å; W341-L345 HydrophobicContact CE3-CG 3.89Å; W341-L345 HydrophobicContact CZ3-CD1 4.37Å; W341-L345 HydrophobicContact CZ3-CD2 4.33Å; W341-L345 HydrophobicContact CZ3-CG 4.33Å; W341-L345 VanDerWaalsContact O-CB 3.29Å; W341-L345 WeakPolarHBondContact O-CB 3.49Å; W341-L345 WeakPolarHBondContact O-CG 3.47Å; W341-L345 PolarHBondContact O-N 2.83Å; L345-L347 VanDerWaalsContact C-N 3.33Å; L345-L347 HydrophobicContact CB-CD1 4.23Å; L345-L347 HydrophobicContact CB-CG 3.91Å; L345-L347 HydrophobicContact CD1-CD1 4.4Å; L345-L347 PolarHBondContact O-N 3.03Å; L345-I377 HydrophobicContact CB-CD1 3.98Å; L345-I377 HydrophobicContact CD1-CD1 4.37Å; L345-I377 HydrophobicContact CD2-CD1 3.99Å; L345-I377 HydrophobicContact CG-CD1 4.33Å
346	C	95.6	Very high	93	Very high	6 Å²	6	44.7 Å²	44.7	4%	0.041	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	45.4	-178.5	-51.6	0	0	0	0	110.9	I342 K343 F344 R376 H383	I342-C346 PolarHBondContact O-N 3.12Å; K343-C346 PolarHBondContact O-N 3.4Å; K343-C346 VanDerWaalsContact O-N 3.14Å; F344-C346 PolarHBondContact O-N 3.04Å; F344-C346 VanDerWaalsContact O-N 3.15Å; F344-C346 PolarHBondContact O-SG 2.85Å; C346-R376 WeakPolarHBondContact O-CD 3.28Å; C346-R376 PolarHBondContact O-NH1 3.37Å; C346-H383 HydrophobicContact CB-CB 4.25Å
347	L	95.9	Very high	92.6	Very high	11 Å²	11	48.4 Å²	48.4	6%	0.058	25%	0.247	C	C	.	.			trans	-89.4	-12.8	177.5	-62.2	179.8	0	0	0	112.7	I342 L345 L369 R372 R376 I377	I342-L347 HydrophobicContact CB-CB 4.17Å; I342-L347 HydrophobicContact CG2-CD1 4.34Å; I342-L347 PolarHBondContact O-N 3.13Å; L345-L347 VanDerWaalsContact C-N 3.33Å; L345-L347 HydrophobicContact CB-CD1 4.23Å; L345-L347 HydrophobicContact CB-CG 3.91Å; L345-L347 HydrophobicContact CD1-CD1 4.4Å; L345-L347 PolarHBondContact O-N 3.03Å; L347-L369 HydrophobicContact CB-CD2 3.98Å; L347-R372 HydrophobicContact CD2-CB 4.04Å; L347-R372 WeakPolarHBondContact O-CD 3.45Å; L347-R372 PolarHBondContact O-NH1 2.68Å; L347-R376 HydrophobicContact CD2-CB 4.37Å; L347-I377 HydrophobicContact CD2-CD1 4.46Å; L347-I377 HydrophobicContact CD2-CG1 4.16Å
348	I	93.4	Very high	92.1	Very high	5 Å²	5	49.7 Å²	49.7	3%	0.026	25%	0.254	C	S	.	.	S	Bend	trans	-135.6	147.8	179.2	-165.8	161.5	0	0	0	109.8	I342 E352 M353 Y356 Y386	I342-I348 HydrophobicContact CB-CG2 4.24Å; I342-I348 HydrophobicContact CD1-CB 4.37Å; I342-I348 HydrophobicContact CD1-CD1 4.21Å; I342-I348 HydrophobicContact CD1-CG2 3.9Å; I342-I348 HydrophobicContact CG1-CG2 3.83Å; I348-E352 HydrophobicContact CD1-CB 4.11Å; I348-E352 HydrophobicContact CG1-CB 3.62Å; I348-M353 HydrophobicContact CB-CE 4.39Å; I348-M353 HydrophobicContact CD1-CE 3.77Å; I348-M353 HydrophobicContact CD1-SD 4.34Å; I348-M353 HydrophobicContact CG1-CE 4.22Å; I348-M353 HydrophobicContact CG2-CE 3.39Å; I348-Y356 HydrophobicContact CD1-CD2 4.12Å; I348-Y386 HydrophobicContact CG2-CD2 4.49Å
349	D	89.8	Confident	91.7	Very high	62 Å²	62	50 Å²	50	33%	0.332	26%	0.255	S	S	.	.			trans	-102.4	167.3	173.2	61.4	60.5	0	0	0	112.3	H351 E352 M353 R372	D349-H351 VanDerWaalsContact C-N 3.28Å; D349-H351 PolarHBondContact O-N 3.1Å; D349-H351 WeakPolarHBondContact OD1-CB 3.3Å; D349-H351 PolarHBondContact OD1-N 3.38Å; D349-H351 VanDerWaalsContact OD1-N 3.15Å; D349-E352 VanDerWaalsContact CG-OE2 3.27Å; D349-E352 PolarHBondContact N-OE2 3.35Å; D349-E352 VanDerWaalsContact N-OE2 3.07Å; D349-E352 PolarHBondContact O-N 3.36Å; D349-E352 WeakPolarHBondContact OD1-CB 3.21Å; D349-E352 VanDerWaalsContact OD1-CG 3.32Å; D349-E352 WeakPolarHBondContact OD1-CG 3.29Å; D349-E352 PolarHBondContact OD1-N 3.48Å; D349-M353 PolarHBondContact O-N 2.98Å; D349-R372 IonicContact OD2-NH2 2.79Å
350	K	88.7	Confident	91.3	Very high	90 Å²	90	52.5 Å²	52.5	39%	0.391	26%	0.264	S	S	.	.	H	α-helix	trans	-59.7	-36.2	-177.6	-71.4	-170.2	177	-171.1	0	112.6	M353 A354 Y386 D388	K350-M353 PolarHBondContact O-N 3.21Å; K350-A354 PolarHBondContact O-N 2.76Å; K350-A354 VanDerWaalsContact O-N 3.12Å; K350-Y386 HydrophobicContact CB-CE2 4.44Å; K350-Y386 WeakPolarHBondContact CE-O 3.39Å; K350-Y386 HydrophobicContact CG-CD2 4.31Å; K350-Y386 HydrophobicContact CG-CE1 4.45Å; K350-Y386 HydrophobicContact CG-CE2 3.87Å; K350-D388 IonicContact NZ-OD2 2.91Å; K350-D388 PolarHBondContact NZ-OD2 2.91Å
351	H	87	Confident	90.8	Very high	138 Å²	138	61.4 Å²	61.4	64%	0.639	30%	0.303	S	S	*	.	H	α-helix	trans	-70.7	-40	-179.8	170.9	-83.8	0	0	0	111.7	D349 N355	D349-H351 VanDerWaalsContact C-N 3.28Å; D349-H351 PolarHBondContact O-N 3.1Å; D349-H351 WeakPolarHBondContact OD1-CB 3.3Å; D349-H351 PolarHBondContact OD1-N 3.38Å; D349-H351 VanDerWaalsContact OD1-N 3.15Å; H351-N355 PolarHBondContact O-ND2 3Å; H351-N355 VanDerWaalsContact O-ND2 3.14Å
352	E	88.5	Confident	90.3	Very high	46 Å²	46	61.5 Å²	61.5	22%	0.215	31%	0.31	C	S	.	.	H	α-helix	trans	-66.6	-38.2	172.5	-71.1	171.6	143.9	0	0	112	I348 D349 A354 N355 Y356 R372	I348-E352 HydrophobicContact CD1-CB 4.11Å; I348-E352 HydrophobicContact CG1-CB 3.62Å; D349-E352 VanDerWaalsContact CG-OE2 3.27Å; D349-E352 PolarHBondContact N-OE2 3.35Å; D349-E352 VanDerWaalsContact N-OE2 3.07Å; D349-E352 PolarHBondContact O-N 3.36Å; D349-E352 WeakPolarHBondContact OD1-CB 3.21Å; D349-E352 VanDerWaalsContact OD1-CG 3.32Å; D349-E352 WeakPolarHBondContact OD1-CG 3.29Å; D349-E352 PolarHBondContact OD1-N 3.48Å; E352-A354 VanDerWaalsContact C-N 3.33Å; E352-A354 PolarHBondContact O-N 3.45Å; E352-N355 CarbonylContact O-C 3.58Å; E352-N355 PolarHBondContact O-N 2.94Å; E352-N355 VanDerWaalsContact O-N 3.09Å; E352-Y356 PolarHBondContact O-N 3.24Å; E352-R372 IonicContact OE1-CZ 2.76Å; E352-R372 VanDerWaalsContact OE1-CZ 3.28Å; E352-R372 IonicContact OE1-NH1 3.07Å; E352-R372 PolarHBondContact OE1-NH1 3.32Å; E352-R372 IonicContact OE1-NH2 3.47Å; E352-R372 PolarHBondContact OE1-NH2 3.28Å; E352-R372 IonicContact OE2-CZ 3.65Å; E352-R372 VanDerWaalsContact OE2-CZ 3.26Å; E352-R372 IonicContact OE2-NH1 2.78Å; E352-R372 PolarHBondContact OE2-NH1 3.15Å; E352-R372 IonicContact OE2-NH2 3.87Å; E352-R372 PolarHBondContact OE2-NH2 3.4Å; E352-R372 VanDerWaalsContact OE2-NH2 3.12Å
353	M	88.9	Confident	90	Very high	20 Å²	20	69.8 Å²	69.8	10%	0.099	34%	0.343	C	S	.	.	H	α-helix	trans	-62	-39.6	177.5	-169.1	61.3	66.7	0	0	112.1	L339 I342 K343 I348 D349 K350 N355 Y356 Y386	L339-M353 HydrophobicContact CD2-CE 4.29Å; L339-M353 HydrophobicContact CD2-SD 4.27Å; I342-M353 HydrophobicContact CD1-CE 4.16Å; K343-M353 HydrophobicContact CD-CE 4.36Å; K343-M353 HydrophobicContact CG-CE 3.88Å; I348-M353 HydrophobicContact CB-CE 4.39Å; I348-M353 HydrophobicContact CD1-CE 3.77Å; I348-M353 HydrophobicContact CD1-SD 4.34Å; I348-M353 HydrophobicContact CG1-CE 4.22Å; I348-M353 HydrophobicContact CG2-CE 3.39Å; D349-M353 PolarHBondContact O-N 2.98Å; K350-M353 PolarHBondContact O-N 3.21Å; M353-N355 PolarHBondContact O-N 3.32Å; M353-N355 VanDerWaalsContact O-N 3.09Å; M353-Y356 WeakPolarHBondContact O-CB 3.37Å; M353-Y356 PolarHBondContact O-N 3.41Å; M353-Y356 HydrophobicContact SD-CG 4.11Å; M353-Y386 HydrophobicContact CB-CE2 4.08Å; M353-Y386 HydrophobicContact CE-CE2 4.38Å; M353-Y386 HydrophobicContact CG-CE2 4.48Å; M353-Y386 WeakPolarHBondContact CG-OH 3.26Å
354	A	86.8	Confident	89.7	Confident	86 Å²	86	78.2 Å²	78.2	71%	0.711	37%	0.374	S	S	*	.	H	α-helix	trans	-58.4	-24.7	175.6	0	0	0	0	0	113.3	K350 E352	K350-A354 PolarHBondContact O-N 2.76Å; K350-A354 VanDerWaalsContact O-N 3.12Å; E352-A354 VanDerWaalsContact C-N 3.33Å; E352-A354 PolarHBondContact O-N 3.45Å
355	N	86.7	Confident	89.3	Confident	51 Å²	51	77.9 Å²	77.9	27%	0.273	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	8.8	177.7	-66.4	-70.6	0	0	0	113	H351 E352 M353 I358 K359	H351-N355 PolarHBondContact O-ND2 3Å; H351-N355 VanDerWaalsContact O-ND2 3.14Å; E352-N355 CarbonylContact O-C 3.58Å; E352-N355 PolarHBondContact O-N 2.94Å; E352-N355 VanDerWaalsContact O-N 3.09Å; M353-N355 PolarHBondContact O-N 3.32Å; M353-N355 VanDerWaalsContact O-N 3.09Å; N355-I358 PolarHBondContact O-N 2.84Å; N355-K359 HydrophobicContact CB-CD 4.27Å; N355-K359 WeakPolarHBondContact O-CG 3.42Å; N355-K359 PolarHBondContact O-N 3.1Å
356	Y	88.6	Confident	89	Confident	29 Å²	29	82.2 Å²	82.2	11%	0.114	39%	0.389	C	S	.	.	H	α-helix	trans	-63	-46.6	-171.1	176.3	-97	0	0	0	112.1	F338 L339 I342 I348 E352 M353 I358 K359 K360 L365	F338-Y356 HydrophobicContact CE1-CE2 4.21Å; F338-Y356 WeakPolarHBondContact CE1-OH 3.41Å; L339-Y356 HydrophobicContact CD1-CE1 4.47Å; L339-Y356 HydrophobicContact CD2-CD1 4.24Å; L339-Y356 HydrophobicContact CD2-CD2 4.46Å; L339-Y356 HydrophobicContact CD2-CE1 3.76Å; L339-Y356 HydrophobicContact CD2-CE2 3.99Å; I342-Y356 HydrophobicContact CD1-CE2 4.41Å; I348-Y356 HydrophobicContact CD1-CD2 4.12Å; E352-Y356 PolarHBondContact O-N 3.24Å; M353-Y356 WeakPolarHBondContact O-CB 3.37Å; M353-Y356 PolarHBondContact O-N 3.41Å; M353-Y356 HydrophobicContact SD-CG 4.11Å; Y356-I358 VanDerWaalsContact C-N 3.26Å; Y356-I358 PolarHBondContact O-N 3.48Å; Y356-K359 CarbonylContact O-C 3.55Å; Y356-K359 PolarHBondContact O-N 3.45Å; Y356-K360 HydrophobicContact CE1-CB 4.07Å; Y356-K360 WeakPolarHBondContact O-CB 3.5Å; Y356-K360 PolarHBondContact O-N 3.45Å; Y356-L365 HydrophobicContact CD2-CD2 3.9Å; Y356-L365 HydrophobicContact CE2-CD2 3.76Å
357	D	86	Confident	88.9	Confident	111 Å²	111	87.5 Å²	87.5	59%	0.594	41%	0.411	S	S	*	.	H	α-helix	trans	-62.1	-33.3	-176.4	-86.6	-51.3	0	0	0	113.8	K360	D357-K360 WeakPolarHBondContact O-CG 3.46Å; D357-K360 IonicContact OD1-NZ 2.6Å; D357-K360 PolarHBondContact OD1-NZ 3.12Å
358	I	86.2	Confident	88.8	Confident	142 Å²	142	89 Å²	89	73%	0.728	42%	0.421	S	S	*	.	H	α-helix	trans	-70.9	-39.4	174.7	-59.8	172.4	0	0	0	110	N355 Y356	N355-I358 PolarHBondContact O-N 2.84Å; Y356-I358 VanDerWaalsContact C-N 3.26Å; Y356-I358 PolarHBondContact O-N 3.48Å
359	K	86	Confident	88.8	Confident	99 Å²	99	89.4 Å²	89.4	43%	0.43	42%	0.423	S	S	.	.	H	α-helix	trans	-94	-6.1	-172.3	-66.8	-179.7	-178.1	173.6	0	114.5	N355 Y356 K361 S362	N355-K359 HydrophobicContact CB-CD 4.27Å; N355-K359 WeakPolarHBondContact O-CG 3.42Å; N355-K359 PolarHBondContact O-N 3.1Å; Y356-K359 CarbonylContact O-C 3.55Å; Y356-K359 PolarHBondContact O-N 3.45Å; K359-K361 PolarHBondContact O-N 2.82Å; K359-K361 VanDerWaalsContact O-N 3.11Å; K359-S362 WeakPolarHBondContact O-CA 3.18Å; K359-S362 WeakPolarHBondContact O-CB 3.38Å; K359-S362 PolarHBondContact O-N 3.3Å
360	K	86.6	Confident	89.1	Confident	86 Å²	86	90.7 Å²	90.7	37%	0.374	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-25.7	-174.8	70	-172.6	167.3	-163.8	0	114.1	Y356 D357 Y366	Y356-K360 HydrophobicContact CE1-CB 4.07Å; Y356-K360 WeakPolarHBondContact O-CB 3.5Å; Y356-K360 PolarHBondContact O-N 3.45Å; D357-K360 WeakPolarHBondContact O-CG 3.46Å; D357-K360 IonicContact OD1-NZ 2.6Å; D357-K360 PolarHBondContact OD1-NZ 3.12Å; K360-Y366 WeakPolarHBondContact O-CE2 3.12Å; K360-Y366 PolarHBondContact O-OH 3.14Å
361	K	86.3	Confident	89.4	Confident	195 Å²	195	92.6 Å²	92.6	85%	0.848	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-3.2	173.6	-64.2	-175.5	178.3	-179.2	0	113.6	K359	K359-K361 PolarHBondContact O-N 2.82Å; K359-K361 VanDerWaalsContact O-N 3.11Å
362	S	87.7	Confident	89.8	Confident	48 Å²	48	87.9 Å²	87.9	34%	0.336	42%	0.421	S	S	.	.			trans	-85.4	123.3	-175.3	-171.9	0	0	0	0	111.5	K359 R364 L365	K359-S362 WeakPolarHBondContact O-CA 3.18Å; K359-S362 WeakPolarHBondContact O-CB 3.38Å; K359-S362 PolarHBondContact O-N 3.3Å; S362-R364 PolarHBondContact O-N 2.74Å; S362-R364 VanDerWaalsContact O-N 3.13Å; S362-R364 PolarHBondContact OG-N 2.97Å; S362-L365 WeakPolarHBondContact O-CB 3.39Å; S362-L365 PolarHBondContact O-N 3.15Å
363	Y	90.3	Very high	90.2	Very high	180 Å²	180	90.1 Å²	90.1	71%	0.706	43%	0.43	S	S	*	.	H	α-helix	trans	-51.5	-34.8	169.8	173.3	-96.7	0	0	0	112.6	L365 Y366 F367	Y363-L365 VanDerWaalsContact C-N 3.27Å; Y363-L365 PolarHBondContact O-N 3.33Å; Y363-Y366 PolarHBondContact O-N 2.79Å; Y363-F367 HydrophobicContact CE1-CB 4.24Å; Y363-F367 PolarHBondContact O-N 3.08Å
364	R	89.9	Confident	90.5	Very high	194 Å²	194	94.4 Å²	94.4	73%	0.732	45%	0.448	S	S	*	.	H	α-helix	trans	-59.2	-36.5	179.1	-175.6	175.1	176.7	165.3	0.2	112.5	S362 V368	S362-R364 PolarHBondContact O-N 2.74Å; S362-R364 VanDerWaalsContact O-N 3.13Å; S362-R364 PolarHBondContact OG-N 2.97Å; R364-V368 VanDerWaalsContact O-CG2 3.3Å; R364-V368 WeakPolarHBondContact O-CG2 3.28Å; R364-V368 PolarHBondContact O-N 2.89Å; R364-V368 VanDerWaalsContact O-N 3.11Å
365	L	89.6	Confident	90.8	Very high	20 Å²	20	93.8 Å²	93.8	11%	0.105	43%	0.433	C	S	.	.	H	α-helix	trans	-63.3	-50.8	177.4	176.7	63.7	0	0	0	110.5	Y356 S362 Y363 F367 V368 L369	Y356-L365 HydrophobicContact CD2-CD2 3.9Å; Y356-L365 HydrophobicContact CE2-CD2 3.76Å; S362-L365 WeakPolarHBondContact O-CB 3.39Å; S362-L365 PolarHBondContact O-N 3.15Å; Y363-L365 VanDerWaalsContact C-N 3.27Å; Y363-L365 PolarHBondContact O-N 3.33Å; L365-F367 PolarHBondContact O-N 2.94Å; L365-V368 PolarHBondContact O-N 2.75Å; L365-L369 HydrophobicContact CD1-CD1 4.45Å; L365-L369 HydrophobicContact CD1-CG 4.43Å; L365-L369 HydrophobicContact CG-CD1 4.21Å; L365-L369 WeakPolarHBondContact O-CG 3.27Å; L365-L369 PolarHBondContact O-N 2.67Å
366	Y	90.9	Very high	91.2	Very high	108 Å²	108	93.7 Å²	93.7	42%	0.424	43%	0.429	S	S	.	.	H	α-helix	trans	-63.4	-39.8	-179.8	-66.2	-76.3	0	0	0	112.4	F338 K360 Y363 V368 L369 C370	F338-Y366 HydrophobicContact CZ-CE1 4.36Å; K360-Y366 WeakPolarHBondContact O-CE2 3.12Å; K360-Y366 PolarHBondContact O-OH 3.14Å; Y363-Y366 PolarHBondContact O-N 2.79Å; Y366-V368 VanDerWaalsContact C-N 3.34Å; Y366-V368 PolarHBondContact O-N 2.99Å; Y366-L369 PolarHBondContact O-N 3.5Å; Y366-C370 PolarHBondContact O-N 3.37Å; Y366-C370 PolarHBondContact O-SG 3.01Å
367	F	93.3	Very high	91.6	Very high	116 Å²	116	92.9 Å²	92.9	51%	0.509	43%	0.427	S	S	.	.	H	α-helix	trans	-58.5	-44.7	173.5	-179.4	-96.9	0	0	0	112.3	Y363 L365 C370 K371	Y363-F367 HydrophobicContact CE1-CB 4.24Å; Y363-F367 PolarHBondContact O-N 3.08Å; L365-F367 PolarHBondContact O-N 2.94Å; F367-C370 PolarHBondContact O-N 3.02Å; F367-K371 PolarHBondContact O-N 3.49Å
368	V	92.5	Very high	92.1	Very high	43 Å²	43	90.4 Å²	90.4	26%	0.261	41%	0.413	S	S	.	.	H	α-helix	trans	-63.4	-42.8	175.8	170.2	0	0	0	0	111.2	R364 L365 Y366 K371 R372	R364-V368 VanDerWaalsContact O-CG2 3.3Å; R364-V368 WeakPolarHBondContact O-CG2 3.28Å; R364-V368 PolarHBondContact O-N 2.89Å; R364-V368 VanDerWaalsContact O-N 3.11Å; L365-V368 PolarHBondContact O-N 2.75Å; Y366-V368 VanDerWaalsContact C-N 3.34Å; Y366-V368 PolarHBondContact O-N 2.99Å; V368-K371 PolarHBondContact O-N 3.02Å; V368-R372 HydrophobicContact CG1-CG 4.42Å; V368-R372 WeakPolarHBondContact O-CB 3.34Å; V368-R372 VanDerWaalsContact O-CG 3.3Å; V368-R372 WeakPolarHBondContact O-CG 3.32Å; V368-R372 PolarHBondContact O-N 2.96Å
369	L	94.5	Very high	92.5	Very high	14 Å²	14	86.7 Å²	86.7	7%	0.073	39%	0.394	C	S	.	.	H	α-helix	trans	-62.5	-43.2	176.9	-68.4	176.1	0	0	0	111.9	F338 I342 L347 L365 Y366 R372 F373	F338-L369 HydrophobicContact CE1-CD1 4.5Å; F338-L369 HydrophobicContact CZ-CD1 3.75Å; I342-L369 HydrophobicContact CG2-CD2 4.46Å; L347-L369 HydrophobicContact CB-CD2 3.98Å; L365-L369 HydrophobicContact CD1-CD1 4.45Å; L365-L369 HydrophobicContact CD1-CG 4.43Å; L365-L369 HydrophobicContact CG-CD1 4.21Å; L365-L369 WeakPolarHBondContact O-CG 3.27Å; L365-L369 PolarHBondContact O-N 2.67Å; Y366-L369 PolarHBondContact O-N 3.5Å; L369-R372 CarbonylContact O-C 3.46Å; L369-R372 PolarHBondContact O-N 3.48Å; L369-F373 WeakPolarHBondContact O-CB 3.45Å; L369-F373 PolarHBondContact O-N 3.07Å
370	C	95	Very high	93.1	Very high	88 Å²	88	84.3 Å²	84.3	60%	0.595	39%	0.389	S	S	*	.	H	α-helix	trans	-62.8	-45.7	176	-70	0	0	0	0	112.1	Y366 F367 R372 F373 F374	Y366-C370 PolarHBondContact O-N 3.37Å; Y366-C370 PolarHBondContact O-SG 3.01Å; F367-C370 PolarHBondContact O-N 3.02Å; C370-R372 VanDerWaalsContact C-N 3.3Å; C370-R372 PolarHBondContact O-N 3.29Å; C370-F373 WeakPolarHBondContact O-CB 3.34Å; C370-F373 PolarHBondContact O-N 3.01Å; C370-F374 PolarHBondContact O-N 3.21Å
371	K	95.4	Very high	93.5	Very high	131 Å²	131	81.1 Å²	81.1	57%	0.57	38%	0.378	S	S	*	.	H	α-helix	trans	-60	-42.1	175.9	-176.7	177.4	-179.5	177.1	0	111.6	F367 V368 F374 N375	F367-K371 PolarHBondContact O-N 3.49Å; V368-K371 PolarHBondContact O-N 3.02Å; K371-F374 PolarHBondContact O-N 3.36Å; K371-N375 PolarHBondContact O-N 2.87Å
372	R	96	Very high	93.9	Very high	38 Å²	38	76.9 Å²	76.9	14%	0.143	36%	0.357	C	S	.	.	H	α-helix	trans	-70.5	-33.9	176.3	-71.9	175.5	176.4	-166.5	1.3	111.9	L347 D349 E352 V368 L369 C370 F374 N375 R376	L347-R372 HydrophobicContact CD2-CB 4.04Å; L347-R372 WeakPolarHBondContact O-CD 3.45Å; L347-R372 PolarHBondContact O-NH1 2.68Å; D349-R372 IonicContact OD2-NH2 2.79Å; E352-R372 IonicContact OE1-CZ 2.76Å; E352-R372 VanDerWaalsContact OE1-CZ 3.28Å; E352-R372 IonicContact OE1-NH1 3.07Å; E352-R372 PolarHBondContact OE1-NH1 3.32Å; E352-R372 IonicContact OE1-NH2 3.47Å; E352-R372 PolarHBondContact OE1-NH2 3.28Å; E352-R372 IonicContact OE2-CZ 3.65Å; E352-R372 VanDerWaalsContact OE2-CZ 3.26Å; E352-R372 IonicContact OE2-NH1 2.78Å; E352-R372 PolarHBondContact OE2-NH1 3.15Å; E352-R372 IonicContact OE2-NH2 3.87Å; E352-R372 PolarHBondContact OE2-NH2 3.4Å; E352-R372 VanDerWaalsContact OE2-NH2 3.12Å; V368-R372 HydrophobicContact CG1-CG 4.42Å; V368-R372 WeakPolarHBondContact O-CB 3.34Å; V368-R372 VanDerWaalsContact O-CG 3.3Å; V368-R372 WeakPolarHBondContact O-CG 3.32Å; V368-R372 PolarHBondContact O-N 2.96Å; L369-R372 CarbonylContact O-C 3.46Å; L369-R372 PolarHBondContact O-N 3.48Å; C370-R372 VanDerWaalsContact C-N 3.3Å; C370-R372 PolarHBondContact O-N 3.29Å; R372-F374 VanDerWaalsContact C-N 3.33Å; R372-F374 PolarHBondContact O-N 3.32Å; R372-N375 PolarHBondContact O-N 3.47Å; R372-R376 HydrophobicContact CB-CG 4.2Å; R372-R376 WeakPolarHBondContact O-CA 3.28Å; R372-R376 WeakPolarHBondContact O-CB 3.28Å; R372-R376 WeakPolarHBondContact O-CG 3.43Å; R372-R376 PolarHBondContact O-N 3.11Å
373	F	96.4	Very high	94.2	Very high	93 Å²	93	77 Å²	77	41%	0.408	35%	0.352	S	S	.	.	I	π-helix	trans	-58.8	-48.2	172.8	-177.8	-89.4	0	0	0	110.4	L369 C370 I377 L378	L369-F373 WeakPolarHBondContact O-CB 3.45Å; L369-F373 PolarHBondContact O-N 3.07Å; C370-F373 WeakPolarHBondContact O-CB 3.34Å; C370-F373 PolarHBondContact O-N 3.01Å; F373-I377 HydrophobicContact CD2-CB 4.34Å; F373-I377 HydrophobicContact CD2-CG1 4.06Å; F373-I377 HydrophobicContact CE2-CB 4.36Å; F373-I377 HydrophobicContact CE2-CG1 4.37Å; F373-I377 HydrophobicContact CE2-CG2 4.28Å; F373-I377 HydrophobicContact CZ-CG2 4.43Å; F373-I377 WeakPolarHBondContact O-CA 3.45Å; F373-I377 WeakPolarHBondContact O-CB 3.5Å; F373-I377 PolarHBondContact O-N 3.45Å; F373-L378 HydrophobicContact CD1-CD1 4.24Å; F373-L378 HydrophobicContact CD1-CG 4.23Å; F373-L378 HydrophobicContact CE1-CD1 4.03Å; F373-L378 HydrophobicContact CE1-CD2 3.98Å; F373-L378 HydrophobicContact CE1-CG 3.91Å; F373-L378 PolarHBondContact O-N 3.38Å
374	F	94.7	Very high	94.3	Very high	111 Å²	111	75.5 Å²	75.5	49%	0.487	35%	0.349	S	S	.	.	I	π-helix	trans	-60.5	-54.2	176.1	-172.8	-91.3	0	0	0	112	C370 K371 R372 R376 L378 L379	C370-F374 PolarHBondContact O-N 3.21Å; K371-F374 PolarHBondContact O-N 3.36Å; R372-F374 VanDerWaalsContact C-N 3.33Å; R372-F374 PolarHBondContact O-N 3.32Å; F374-R376 PolarHBondContact O-N 3.33Å; F374-L378 HydrophobicContact CD2-CD1 3.68Å; F374-L378 HydrophobicContact CE2-CD1 4.29Å; F374-L378 HydrophobicContact CG-CD1 4.44Å; F374-L378 WeakPolarHBondContact O-CB 3.48Å; F374-L378 PolarHBondContact O-N 3.48Å; F374-L379 HydrophobicContact CD1-CD1 4.42Å; F374-L379 HydrophobicContact CE1-CD1 4.06Å; F374-L379 HydrophobicContact CE1-CG 4.34Å; F374-L379 PolarHBondContact O-N 3.41Å
375	N	94.3	Very high	94.5	Very high	73 Å²	73	67.3 Å²	67.3	39%	0.39	32%	0.321	S	S	.	.	I	π-helix	trans	-71.8	-33.5	-174.1	-71.2	-10.9	0	0	0	114.3	K371 R372 S381	K371-N375 PolarHBondContact O-N 2.87Å; R372-N375 PolarHBondContact O-N 3.47Å; N375-S381 PolarHBondContact O-OG 3.23Å; N375-S381 VanDerWaalsContact O-OG 3.07Å
376	R	95.4	Very high	94.8	Very high	49 Å²	49	67.4 Å²	67.4	19%	0.185	32%	0.32	C	S	.	.	I	π-helix	trans	-94.5	-33.4	-173.5	-51.7	-165.9	174.8	171.4	-1.2	111.6	R215 C346 L347 R372 F374 S381 H383	R215-R376 PolarHBondContact NH2-O 2.98Å; C346-R376 WeakPolarHBondContact O-CD 3.28Å; C346-R376 PolarHBondContact O-NH1 3.37Å; L347-R376 HydrophobicContact CD2-CB 4.37Å; R372-R376 HydrophobicContact CB-CG 4.2Å; R372-R376 WeakPolarHBondContact O-CA 3.28Å; R372-R376 WeakPolarHBondContact O-CB 3.28Å; R372-R376 WeakPolarHBondContact O-CG 3.43Å; R372-R376 PolarHBondContact O-N 3.11Å; F374-R376 PolarHBondContact O-N 3.33Å; R376-S381 WeakPolarHBondContact CA-OG 3.38Å; R376-S381 PolarHBondContact O-OG 2.83Å; R376-H383 VanDerWaalsContact CG-NE2 3.3Å; R376-H383 WeakPolarHBondContact CG-NE2 3.37Å
377	I	96.7	Very high	94.8	Very high	12 Å²	12	63.4 Å²	63.4	6%	0.062	31%	0.306	C	S	.	.	I	π-helix	trans	-105.4	-47.4	-172.7	-50.9	-55	0	0	0	112.1	L219 F223 L345 L347 F373	L219-I377 HydrophobicContact CD1-CD1 4.27Å; L219-I377 HydrophobicContact CD2-CD1 4.41Å; L219-I377 HydrophobicContact CD2-CG2 3.88Å; F223-I377 WeakPolarHBondContact CE2-O 3.47Å; F223-I377 VanDerWaalsContact CZ-O 3.23Å; F223-I377 WeakPolarHBondContact CZ-O 3.47Å; L345-I377 HydrophobicContact CB-CD1 3.98Å; L345-I377 HydrophobicContact CD1-CD1 4.37Å; L345-I377 HydrophobicContact CD2-CD1 3.99Å; L345-I377 HydrophobicContact CG-CD1 4.33Å; L347-I377 HydrophobicContact CD2-CD1 4.46Å; L347-I377 HydrophobicContact CD2-CG1 4.16Å; F373-I377 HydrophobicContact CD2-CB 4.34Å; F373-I377 HydrophobicContact CD2-CG1 4.06Å; F373-I377 HydrophobicContact CE2-CB 4.36Å; F373-I377 HydrophobicContact CE2-CG1 4.37Å; F373-I377 HydrophobicContact CE2-CG2 4.28Å; F373-I377 HydrophobicContact CZ-CG2 4.43Å; F373-I377 WeakPolarHBondContact O-CA 3.45Å; F373-I377 WeakPolarHBondContact O-CB 3.5Å; F373-I377 PolarHBondContact O-N 3.45Å
378	L	95.8	Very high	94.7	Very high	59 Å²	59	60.3 Å²	60.3	31%	0.309	30%	0.295	S	S	.	.	I	π-helix	trans	-77.9	-25.4	-175.8	-60.7	-179.1	0	0	0	112.7	L139 N143 F373 F374	L139-L378 WeakPolarHBondContact CD1-O 3.49Å; N143-L378 PolarHBondContact ND2-O 3Å; F373-L378 HydrophobicContact CD1-CD1 4.24Å; F373-L378 HydrophobicContact CD1-CG 4.23Å; F373-L378 HydrophobicContact CE1-CD1 4.03Å; F373-L378 HydrophobicContact CE1-CD2 3.98Å; F373-L378 HydrophobicContact CE1-CG 3.91Å; F373-L378 PolarHBondContact O-N 3.38Å; F374-L378 HydrophobicContact CD2-CD1 3.68Å; F374-L378 HydrophobicContact CE2-CD1 4.29Å; F374-L378 HydrophobicContact CG-CD1 4.44Å; F374-L378 WeakPolarHBondContact O-CB 3.48Å; F374-L378 PolarHBondContact O-N 3.48Å
379	L	96.1	Very high	94.7	Very high	63 Å²	63	58.2 Å²	58.2	33%	0.33	28%	0.282	S	S	.	.	S	Bend	trans	-102.1	142.6	176.2	-59.8	-178.3	0	0	0	111.7	L139 F374 S381	L139-L379 HydrophobicContact CD1-CD2 4.08Å; F374-L379 HydrophobicContact CD1-CD1 4.42Å; F374-L379 HydrophobicContact CE1-CD1 4.06Å; F374-L379 HydrophobicContact CE1-CG 4.34Å; F374-L379 PolarHBondContact O-N 3.41Å; L379-S381 PolarHBondContact O-N 3.33Å; L379-S381 PolarHBondContact O-OG 3.43Å
380	P	96.7	Very high	94.5	Very high	50 Å²	50	61.3 Å²	61.3	33%	0.325	30%	0.295	S	S	.	.			trans	-57.9	101.4	173.5	-23.3	33.5	0	0	0	111.4	A142 F146	A142-P380 HydrophobicContact CB-CG 3.9Å; F146-P380 HydrophobicContact CB-CB 3.69Å; F146-P380 HydrophobicContact CD1-CB 3.91Å; F146-P380 HydrophobicContact CD2-CB 3.98Å; F146-P380 HydrophobicContact CG-CB 3.57Å
381	S	95.7	Very high	94.1	Very high	19 Å²	19	62.2 Å²	62.2	13%	0.133	29%	0.294	C	S	.	.			trans	-150.2	138.9	-172.6	58.5	0	0	0	0	113.4	F146 R215 N375 R376 L379 H383	F146-S381 VanDerWaalsContact CE1-C 3.43Å; F146-S381 WeakPolarHBondContact CE1-O 3.44Å; F146-S381 VanDerWaalsContact CZ-C 3.45Å; R215-S381 PolarHBondContact NH1-O 3.43Å; N375-S381 PolarHBondContact O-OG 3.23Å; N375-S381 VanDerWaalsContact O-OG 3.07Å; R376-S381 WeakPolarHBondContact CA-OG 3.38Å; R376-S381 PolarHBondContact O-OG 2.83Å; L379-S381 PolarHBondContact O-N 3.33Å; L379-S381 PolarHBondContact O-OG 3.43Å; S381-H383 PolarHBondContact OG-NE2 3.39Å
382	Y	94.8	Very high	93.7	Very high	105 Å²	105	57.1 Å²	57.1	41%	0.412	27%	0.272	S	S	.	.			trans	-95.2	135.4	174.3	178.7	-92.8	0	0	0	110.2	I154 Y212 H216	I154-Y382 HydrophobicContact CD1-CD2 3.7Å; I154-Y382 HydrophobicContact CD1-CE2 3.73Å; Y212-Y382 WeakPolarHBondContact CD1-OH 3.29Å; H216-Y382 AromaticContact CE1-CD2 3.76Å; H216-Y382 AromaticContact NE2-CD2 3.28Å; H216-Y382 VanDerWaalsContact NE2-CD2 3.28Å; H216-Y382 WeakPolarHBondContact NE2-CD2 3.14Å; H216-Y382 AromaticContact NE2-CE2 3.78Å
383	H	93.8	Very high	93.3	Very high	50 Å²	50	59.1 Å²	59.1	23%	0.231	28%	0.283	C	S	.	.			trans	-138	141.6	176	-67.1	-68.5	0	0	0	110.1	C346 R376 S381	C346-H383 HydrophobicContact CB-CB 4.25Å; R376-H383 VanDerWaalsContact CG-NE2 3.3Å; R376-H383 WeakPolarHBondContact CG-NE2 3.37Å; S381-H383 PolarHBondContact OG-NE2 3.39Å
384	K	92.5	Very high	92.9	Very high	149 Å²	149	57.6 Å²	57.6	65%	0.648	28%	0.279	S	S	*	.			trans	-62.3	135.9	175.7	-170.9	179.3	177.7	-179.4	0	109.7
385	P	95.3	Very high	92.6	Very high	22 Å²	22	53.9 Å²	53.9	14%	0.143	26%	0.264	C	S	.	.			trans	-53.8	151.3	172.6	-28.5	37.6	0	0	0	113.1	L211 Y212	L211-P385 HydrophobicContact CD1-CB 3.78Å; L211-P385 HydrophobicContact CD1-CG 4.24Å; L211-P385 HydrophobicContact CG-CB 4.11Å; L211-P385 HydrophobicContact CG-CG 4.05Å; L211-P385 WeakPolarHBondContact O-CG 3.44Å; Y212-P385 HydrophobicContact CD1-CG 3.63Å; Y212-P385 HydrophobicContact CE1-CG 4.01Å; Y212-P385 HydrophobicContact CG-CG 4.46Å
386	Y	94.5	Very high	91.7	Very high	22 Å²	22	55.6 Å²	55.6	9%	0.086	27%	0.272	C	S	.	.	S	Bend	trans	-59.8	-45.6	174.9	174.8	-97	0	0	0	111.7	K343 I348 K350 M353 E393	K343-Y386 HydrophobicContact CB-CD1 4.23Å; K343-Y386 HydrophobicContact CB-CG 4.2Å; K343-Y386 HydrophobicContact CD-CD1 4.11Å; K343-Y386 HydrophobicContact CD-CE1 3.79Å; K343-Y386 HydrophobicContact CG-CD1 4.05Å; K343-Y386 HydrophobicContact CG-CD2 4.27Å; K343-Y386 HydrophobicContact CG-CE1 4.07Å; K343-Y386 HydrophobicContact CG-CE2 4.29Å; K343-Y386 HydrophobicContact CG-CG 4.16Å; I348-Y386 HydrophobicContact CG2-CD2 4.49Å; K350-Y386 HydrophobicContact CB-CE2 4.44Å; K350-Y386 WeakPolarHBondContact CE-O 3.39Å; K350-Y386 HydrophobicContact CG-CD2 4.31Å; K350-Y386 HydrophobicContact CG-CE1 4.45Å; K350-Y386 HydrophobicContact CG-CE2 3.87Å; M353-Y386 HydrophobicContact CB-CE2 4.08Å; M353-Y386 HydrophobicContact CE-CE2 4.38Å; M353-Y386 HydrophobicContact CG-CE2 4.48Å; M353-Y386 WeakPolarHBondContact CG-OH 3.26Å; Y386-E393 PolarHBondContact OH-OE2 3.2Å
387	D	92.1	Very high	90.7	Very high	25 Å²	25	59 Å²	59	13%	0.134	29%	0.294	C	S	.	.	S	Bend	trans	-85	151.3	177.5	-64.2	-61.4	0	0	0	112.1	L211 G389 Y392	L211-D387 HydrophobicContact CD1-CB 4.34Å; D387-G389 VanDerWaalsContact C-N 3.35Å; D387-Y392 HydrophobicContact CB-CD1 3.94Å; D387-Y392 HydrophobicContact CB-CE1 3.83Å
388	D	91.3	Very high	89.4	Confident	50 Å²	50	59.2 Å²	59.2	27%	0.267	30%	0.296	S	S	.	.			trans	-86.3	-9	175	51.8	45.1	0	0	0	113.1	K350 F390 N391	K350-D388 IonicContact NZ-OD2 2.91Å; K350-D388 PolarHBondContact NZ-OD2 2.91Å; D388-F390 VanDerWaalsContact O-CD2 3.31Å; D388-F390 WeakPolarHBondContact O-CD2 3.42Å; D388-F390 PolarHBondContact OD1-N 3.16Å; D388-N391 PolarHBondContact OD1-N 3.14Å
389	G	91.8	Very high	88.1	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.292	C	S	.	.	S	Bend	trans	93.3	-14.7	-179	0	0	0	0	0	114.9	L196 D387 Y392	L196-G389 WeakPolarHBondContact CD2-O 3.4Å; D387-G389 VanDerWaalsContact C-N 3.35Å; G389-Y392 VanDerWaalsContact CA-OH 3.28Å; G389-Y392 WeakPolarHBondContact CA-OH 3.31Å; G389-Y392 WeakPolarHBondContact O-CE2 2.96Å; G389-Y392 PolarHBondContact O-OH 2.84Å
390	F	90	Very high	86.8	Confident	78 Å²	78	60 Å²	60	34%	0.342	30%	0.301	S	S	.	.	S	Bend	trans	-107.3	-44.3	-174.6	-61.5	-87.8	0	0	0	111.9	P160 P182 L196 D388	P160-F390 HydrophobicContact CG-CE1 4.04Å; P160-F390 HydrophobicContact CG-CZ 3.76Å; P182-F390 HydrophobicContact CB-CD1 4.31Å; P182-F390 HydrophobicContact CG-CD1 3.56Å; P182-F390 HydrophobicContact CG-CE1 3.97Å; P182-F390 HydrophobicContact CG-CG 4.47Å; L196-F390 HydrophobicContact CD1-CE2 4.36Å; L196-F390 HydrophobicContact CD1-CZ 4.37Å; L196-F390 HydrophobicContact CD2-CE1 4.33Å; L196-F390 HydrophobicContact CD2-CZ 4.32Å; D388-F390 VanDerWaalsContact O-CD2 3.31Å; D388-F390 WeakPolarHBondContact O-CD2 3.42Å; D388-F390 PolarHBondContact OD1-N 3.16Å
391	N	85.9	Confident	85.2	Confident	108 Å²	108	58.5 Å²	58.5	58%	0.578	29%	0.291	S	S	*	.			trans	-118.6	121.4	-179.4	-64.6	-49.5	0	0	0	109.8	D388	D388-N391 PolarHBondContact OD1-N 3.14Å
392	Y	88.6	Confident	83.8	Confident	23 Å²	23	58.8 Å²	58.8	9%	0.09	29%	0.292	C	S	.	.			trans	-113	131.3	178.2	-59.3	-89.2	0	0	0	109.4	K183 R184 Y197 D387 G389	K183-Y392 HydrophobicContact CB-CD2 4.16Å; K183-Y392 HydrophobicContact CB-CE2 4.45Å; K183-Y392 WeakPolarHBondContact O-CE2 3.43Å; R184-Y392 HydrophobicContact CB-CE1 4.47Å; R184-Y392 HydrophobicContact CB-CE2 4.03Å; R184-Y392 VanDerWaalsContact CD-CD1 3.43Å; R184-Y392 VanDerWaalsContact CD-CG 3.47Å; R184-Y392 HydrophobicContact CG-CD2 4.03Å; R184-Y392 HydrophobicContact CG-CE1 4.47Å; R184-Y392 HydrophobicContact CG-CE2 4.05Å; R184-Y392 HydrophobicContact CG-CG 4.26Å; Y197-Y392 HydrophobicContact CD2-CE1 4.19Å; Y197-Y392 PolarHBondContact N-OH 2.89Å; D387-Y392 HydrophobicContact CB-CD1 3.94Å; D387-Y392 HydrophobicContact CB-CE1 3.83Å; G389-Y392 VanDerWaalsContact CA-OH 3.28Å; G389-Y392 WeakPolarHBondContact CA-OH 3.31Å; G389-Y392 WeakPolarHBondContact O-CE2 2.96Å; G389-Y392 PolarHBondContact O-OH 2.84Å
393	E	86.8	Confident	82.7	Confident	81 Å²	81	58.4 Å²	58.4	38%	0.379	30%	0.297	S	S	.	.			trans	-59.2	138.9	168.2	-166.3	-172.1	148.3	0	0	109.1	F335 K343 Y386	F335-E393 HydrophobicContact CE1-CG 4Å; F335-E393 WeakPolarHBondContact CE1-OE1 3.38Å; F335-E393 HydrophobicContact CZ-CB 3.94Å; F335-E393 HydrophobicContact CZ-CG 3.85Å; F335-E393 WeakPolarHBondContact CZ-O 3.37Å; K343-E393 IonicContact NZ-OE1 3.89Å; K343-E393 PolarHBondContact NZ-OE1 3.1Å; K343-E393 VanDerWaalsContact NZ-OE1 3.07Å; K343-E393 IonicContact NZ-OE2 2.8Å; K343-E393 PolarHBondContact NZ-OE2 3.24Å; Y386-E393 PolarHBondContact OH-OE2 3.2Å
394	L	88.5	Confident	81.6	Confident	61 Å²	61	61.5 Å²	61.5	32%	0.319	31%	0.312	S	S	.	.			trans	-111.1	140.6	172.9	-56.3	-179.9	0	0	0	108	P332 H333 L396	P332-L394 HydrophobicContact CB-CD2 4.29Å; H333-L394 WeakPolarHBondContact CE1-CD2 3.34Å; L394-L396 PolarHBondContact O-N 2.82Å; L394-L396 VanDerWaalsContact O-N 3.08Å
395	N	87	Confident	80.3	Confident	33 Å²	33	55.1 Å²	55.1	18%	0.176	29%	0.286	C	S	.	.			trans	-70.9	101.6	165.9	-179.1	-11.5	0	0	0	107.8	P332 D334 F335 N397 T398 A399	P332-N395 PolarHBondContact O-N 3.19Å; D334-N395 PolarHBondContact O-ND2 3.43Å; F335-N395 HydrophobicContact CD1-CB 4.01Å; F335-N395 HydrophobicContact CE1-CB 3.89Å; F335-N395 HydrophobicContact CZ-CB 4.43Å; N395-N397 VanDerWaalsContact C-N 3.28Å; N395-N397 PolarHBondContact O-N 3.3Å; N395-N397 PolarHBondContact OD1-N 2.92Å; N395-T398 HydrophobicContact CB-CG2 4.43Å; N395-T398 WeakPolarHBondContact CB-OG1 3.32Å; N395-T398 PolarHBondContact O-N 3.06Å; N395-T398 VanDerWaalsContact O-N 3.17Å; N395-T398 PolarHBondContact O-OG1 3.07Å; N395-A399 PolarHBondContact O-N 3.27Å
396	L	76.5	Confident	79	Confident	109 Å²	109	55.5 Å²	55.5	57%	0.571	29%	0.287	S	S	*	.	H	α-helix	trans	-62.5	-36.4	-175.8	-68.1	175.4	0	0	0	111.7	L394 T398 A399 E400	L394-L396 PolarHBondContact O-N 2.82Å; L394-L396 VanDerWaalsContact O-N 3.08Å; L396-T398 PolarHBondContact O-N 2.9Å; L396-A399 CarbonylContact O-C 3.52Å; L396-A399 PolarHBondContact O-N 3.06Å; L396-A399 VanDerWaalsContact O-N 3.09Å; L396-E400 VanDerWaalsContact O-CB 3.32Å; L396-E400 WeakPolarHBondContact O-CB 3.39Å; L396-E400 WeakPolarHBondContact O-CG 3.2Å; L396-E400 PolarHBondContact O-N 2.87Å
397	N	73.3	Confident	78	Confident	119 Å²	119	57.3 Å²	57.3	64%	0.636	30%	0.303	S	S	*	.	H	α-helix	trans	-60.2	-35.4	177.3	-61.2	-15.5	0	0	0	111.9	N395 S401	N395-N397 VanDerWaalsContact C-N 3.28Å; N395-N397 PolarHBondContact O-N 3.3Å; N395-N397 PolarHBondContact OD1-N 2.92Å; N397-S401 WeakPolarHBondContact O-CB 3.04Å; N397-S401 PolarHBondContact O-N 3.27Å; N397-S401 VanDerWaalsContact O-N 3.12Å; N397-S401 PolarHBondContact O-OG 2.74Å
398	T	71.2	Confident	77	Confident	18 Å²	18	63.4 Å²	63.4	11%	0.11	33%	0.33	C	S	.	.	H	α-helix	trans	-76.2	-40.4	175	54.6	0	0	0	0	111.4	R330 P332 N395 L396 S401 V402	R330-T398 HydrophobicContact CB-CG2 4.02Å; P332-T398 WeakPolarHBondContact CA-OG1 3.3Å; N395-T398 HydrophobicContact CB-CG2 4.43Å; N395-T398 WeakPolarHBondContact CB-OG1 3.32Å; N395-T398 PolarHBondContact O-N 3.06Å; N395-T398 VanDerWaalsContact O-N 3.17Å; N395-T398 PolarHBondContact O-OG1 3.07Å; L396-T398 PolarHBondContact O-N 2.9Å; T398-S401 WeakPolarHBondContact CA-OG 3.34Å; T398-S401 PolarHBondContact O-N 2.88Å; T398-S401 PolarHBondContact O-OG 2.83Å; T398-V402 WeakPolarHBondContact O-CG2 3.48Å; T398-V402 PolarHBondContact O-N 3.5Å
399	A	68.1	Low	75.9	Confident	27 Å²	27	63.2 Å²	63.2	22%	0.223	33%	0.332	C	S	.	.	H	α-helix	trans	-62	-46	175.8	0	0	0	0	0	112.6	N395 L396 V402 L403	N395-A399 PolarHBondContact O-N 3.27Å; L396-A399 CarbonylContact O-C 3.52Å; L396-A399 PolarHBondContact O-N 3.06Å; L396-A399 VanDerWaalsContact O-N 3.09Å; A399-V402 WeakPolarHBondContact O-CB 3.17Å; A399-V402 PolarHBondContact O-N 2.9Å; A399-L403 WeakPolarHBondContact O-CG 3.36Å; A399-L403 PolarHBondContact O-N 2.82Å
400	E	69.1	Low	74.7	Confident	112 Å²	112	66.1 Å²	66.1	52%	0.523	36%	0.363	S	S	.	.	H	α-helix	trans	-61.5	-45.8	175.3	-74.3	173.1	-173.8	0	0	110.8	L396 V402 L403 E404	L396-E400 VanDerWaalsContact O-CB 3.32Å; L396-E400 WeakPolarHBondContact O-CB 3.39Å; L396-E400 WeakPolarHBondContact O-CG 3.2Å; L396-E400 PolarHBondContact O-N 2.87Å; E400-V402 PolarHBondContact O-N 3.47Å; E400-L403 CarbonylContact O-C 3.59Å; E400-L403 WeakPolarHBondContact O-CA 3.11Å; E400-L403 WeakPolarHBondContact O-CB 3.42Å; E400-L403 PolarHBondContact O-N 3.12Å; E400-E404 WeakPolarHBondContact O-CB 3.33Å; E400-E404 PolarHBondContact O-N 3.22Å
401	S	62.5	Low	73.3	Confident	17 Å²	17	66.1 Å²	66.1	12%	0.119	37%	0.365	C	S	.	.	H	α-helix	trans	-62.8	-28.7	176.3	68.6	0	0	0	0	113.5	R330 N397 T398 S405	R330-S401 WeakPolarHBondContact CD-OG 3.37Å; R330-S401 PolarHBondContact NH1-OG 2.82Å; N397-S401 WeakPolarHBondContact O-CB 3.04Å; N397-S401 PolarHBondContact O-N 3.27Å; N397-S401 VanDerWaalsContact O-N 3.12Å; N397-S401 PolarHBondContact O-OG 2.74Å; T398-S401 WeakPolarHBondContact CA-OG 3.34Å; T398-S401 PolarHBondContact O-N 2.88Å; T398-S401 PolarHBondContact O-OG 2.83Å; S401-S405 WeakPolarHBondContact O-CB 3.4Å; S401-S405 PolarHBondContact O-N 3.36Å; S401-S405 PolarHBondContact O-OG 3.49Å
402	V	66.1	Low	71.7	Confident	25 Å²	25	68 Å²	68	15%	0.152	38%	0.375	C	S	.	.	H	α-helix	trans	-73	-39.1	172.2	172.7	0	0	0	0	110.7	R330 T398 A399 E400 S405 L406	R330-V402 HydrophobicContact CB-CG2 4.43Å; T398-V402 WeakPolarHBondContact O-CG2 3.48Å; T398-V402 PolarHBondContact O-N 3.5Å; A399-V402 WeakPolarHBondContact O-CB 3.17Å; A399-V402 PolarHBondContact O-N 2.9Å; E400-V402 PolarHBondContact O-N 3.47Å; V402-S405 WeakPolarHBondContact CA-OG 3.3Å; V402-S405 PolarHBondContact O-OG 3.25Å; V402-L406 HydrophobicContact CG1-CD1 4.08Å; V402-L406 WeakPolarHBondContact O-CB 3.35Å; V402-L406 WeakPolarHBondContact O-CD1 3.15Å; V402-L406 WeakPolarHBondContact O-CG 3.43Å; V402-L406 PolarHBondContact O-N 3.43Å
403	L	72.7	Confident	70.9	Confident	97 Å²	97	70.3 Å²	70.3	51%	0.508	39%	0.389	S	S	.	.	H	α-helix	trans	-67.8	-43	175.2	-68.9	171.3	0	0	0	112.1	A399 E400 L406 S407 L412	A399-L403 WeakPolarHBondContact O-CG 3.36Å; A399-L403 PolarHBondContact O-N 2.82Å; E400-L403 CarbonylContact O-C 3.59Å; E400-L403 WeakPolarHBondContact O-CA 3.11Å; E400-L403 WeakPolarHBondContact O-CB 3.42Å; E400-L403 PolarHBondContact O-N 3.12Å; L403-L406 WeakPolarHBondContact O-CB 3.1Å; L403-L406 PolarHBondContact O-N 2.74Å; L403-S407 PolarHBondContact O-N 3.01Å; L403-L412 HydrophobicContact CD2-CD1 4.05Å
404	E	70.5	Confident	70	Confident	115 Å²	115	69.7 Å²	69.7	54%	0.537	39%	0.39	S	S	.	.	H	α-helix	trans	-59.3	-50.9	176.1	-174.9	176.7	-155.4	0	0	110.2	E400 L406 S407 E408	E400-E404 WeakPolarHBondContact O-CB 3.33Å; E400-E404 PolarHBondContact O-N 3.22Å; E404-L406 VanDerWaalsContact C-N 3.29Å; E404-L406 PolarHBondContact O-N 2.74Å; E404-S407 CarbonylContact O-C 3.44Å; E404-S407 WeakPolarHBondContact O-CA 3.25Å; E404-S407 WeakPolarHBondContact O-CB 3.11Å; E404-S407 PolarHBondContact O-N 3.36Å; E404-S407 PolarHBondContact O-OG 2.92Å; E404-E408 WeakPolarHBondContact O-CG 3.35Å; E404-E408 PolarHBondContact O-N 3.38Å
405	S	63.6	Low	69	Low	16 Å²	16	70.2 Å²	70.2	11%	0.112	39%	0.394	C	S	.	.	H	α-helix	trans	-63.3	-31.7	175.4	53.8	0	0	0	0	113.7	V327 S401 V402 S409	V327-S405 WeakPolarHBondContact CG1-OG 3.47Å; V327-S405 VanDerWaalsContact CG2-O 3.32Å; V327-S405 WeakPolarHBondContact CG2-O 3.5Å; S401-S405 WeakPolarHBondContact O-CB 3.4Å; S401-S405 PolarHBondContact O-N 3.36Å; S401-S405 PolarHBondContact O-OG 3.49Å; V402-S405 WeakPolarHBondContact CA-OG 3.3Å; V402-S405 PolarHBondContact O-OG 3.25Å; S405-S409 WeakPolarHBondContact O-CB 3.31Å; S405-S409 PolarHBondContact O-N 3.48Å; S405-S409 VanDerWaalsContact O-N 3.07Å; S405-S409 PolarHBondContact O-OG 3.18Å
406	L	68.9	Low	67.9	Low	30 Å²	30	72.4 Å²	72.4	16%	0.157	41%	0.407	C	S	.	.	H	α-helix	trans	-67.8	-36	170.6	-74.4	168.6	0	0	0	112.4	L322 V327 V402 L403 E404 S409 I411 L412	L322-L406 HydrophobicContact CD2-CD2 4Å; V327-L406 HydrophobicContact CG2-CD2 4.49Å; V402-L406 HydrophobicContact CG1-CD1 4.08Å; V402-L406 WeakPolarHBondContact O-CB 3.35Å; V402-L406 WeakPolarHBondContact O-CD1 3.15Å; V402-L406 WeakPolarHBondContact O-CG 3.43Å; V402-L406 PolarHBondContact O-N 3.43Å; L403-L406 WeakPolarHBondContact O-CB 3.1Å; L403-L406 PolarHBondContact O-N 2.74Å; E404-L406 VanDerWaalsContact C-N 3.29Å; E404-L406 PolarHBondContact O-N 2.74Å; L406-S409 WeakPolarHBondContact CA-OG 3.17Å; L406-S409 PolarHBondContact O-OG 2.75Å; L406-I411 HydrophobicContact CD2-CB 4.33Å; L406-I411 HydrophobicContact CD2-CD1 4.12Å; L406-I411 HydrophobicContact CD2-CG2 4.2Å; L406-I411 PolarHBondContact O-N 3.44Å; L406-I411 VanDerWaalsContact O-N 3.07Å; L406-L412 HydrophobicContact CB-CD1 3.69Å; L406-L412 HydrophobicContact CB-CG 4.05Å; L406-L412 HydrophobicContact CD1-CD1 4.44Å; L406-L412 PolarHBondContact O-N 2.84Å
407	S	72.7	Confident	67.4	Low	60 Å²	60	70.1 Å²	70.1	42%	0.42	40%	0.396	S	S	.	.	H	α-helix	trans	-71.5	-41.7	174.5	71.6	0	0	0	0	112.4	L403 E404 S409 G410	L403-S407 PolarHBondContact O-N 3.01Å; E404-S407 CarbonylContact O-C 3.44Å; E404-S407 WeakPolarHBondContact O-CA 3.25Å; E404-S407 WeakPolarHBondContact O-CB 3.11Å; E404-S407 PolarHBondContact O-N 3.36Å; E404-S407 PolarHBondContact O-OG 2.92Å; S407-S409 VanDerWaalsContact C-N 3.28Å; S407-S409 PolarHBondContact O-N 3.23Å; S407-G410 PolarHBondContact O-N 2.87Å
408	E	72.9	Confident	67	Low	153 Å²	153	66.9 Å²	66.9	72%	0.715	38%	0.38	S	S	*	.	H	α-helix	trans	-64.9	-32	176.4	-71.1	-178.9	159.4	0	0	112.5	E404 G410	E404-E408 WeakPolarHBondContact O-CG 3.35Å; E404-E408 PolarHBondContact O-N 3.38Å; E408-G410 PolarHBondContact O-N 3.01Å
409	S	67	Low	66.7	Low	45 Å²	45	70.4 Å²	70.4	32%	0.315	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-2.2	174.4	57.1	0	0	0	0	113.8	V327 S405 L406 S407 I411	V327-S409 WeakPolarHBondContact CG2-OG 3.45Å; S405-S409 WeakPolarHBondContact O-CB 3.31Å; S405-S409 PolarHBondContact O-N 3.48Å; S405-S409 VanDerWaalsContact O-N 3.07Å; S405-S409 PolarHBondContact O-OG 3.18Å; L406-S409 WeakPolarHBondContact CA-OG 3.17Å; L406-S409 PolarHBondContact O-OG 2.75Å; S407-S409 VanDerWaalsContact C-N 3.28Å; S407-S409 PolarHBondContact O-N 3.23Å; S409-I411 VanDerWaalsContact C-N 3.31Å; S409-I411 PolarHBondContact O-N 2.93Å; S409-I411 WeakPolarHBondContact OG-CD1 3.42Å
410	G	66.6	Low	66.6	Low	62 Å²	62	73.7 Å²	73.7	64%	0.639	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	23.5	179.9	0	0	0	0	0	114.3	S407 E408	S407-G410 PolarHBondContact O-N 2.87Å; E408-G410 PolarHBondContact O-N 3.01Å
411	I	60.5	Low	66.4	Low	77 Å²	77	70.5 Å²	70.5	40%	0.395	40%	0.404	S	S	.	.			trans	-89.5	-34.3	-179.7	-64.7	176.1	0	0	0	111.6	R325 L406 S409	R325-I411 HydrophobicContact CB-CD1 3.96Å; R325-I411 HydrophobicContact CG-CD1 4.11Å; L406-I411 HydrophobicContact CD2-CB 4.33Å; L406-I411 HydrophobicContact CD2-CD1 4.12Å; L406-I411 HydrophobicContact CD2-CG2 4.2Å; L406-I411 PolarHBondContact O-N 3.44Å; L406-I411 VanDerWaalsContact O-N 3.07Å; S409-I411 VanDerWaalsContact C-N 3.31Å; S409-I411 PolarHBondContact O-N 2.93Å; S409-I411 WeakPolarHBondContact OG-CD1 3.42Å
412	L	52.9	Low	66.8	Low	149 Å²	149	75.4 Å²	75.4	78%	0.78	43%	0.43	S	S	*	.			trans	-95.3	0	164.4	-68.9	169.6	0	0	0	107.9	L403 L406	L403-L412 HydrophobicContact CD2-CD1 4.05Å; L406-L412 HydrophobicContact CB-CD1 3.69Å; L406-L412 HydrophobicContact CB-CG 4.05Å; L406-L412 HydrophobicContact CD1-CD1 4.44Å; L406-L412 PolarHBondContact O-N 2.84Å

Retrieved 412 of 412 residues in 157.8 ms (Link to these results)

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