A0A060YCA0_ONCMY Loading...

MOB kinase activator 3A

AlphaFold DB , UniProt , Accession A0A060YCA0, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene mob3a, Length 216 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.5	Very low	40.8	Very low	167 Å²	167	100.3 Å²	100.3	82%	0.823	51%	0.505	S	S	*	.				0	124.1	0	-97.4	-178.7	165	0	0	109	L5	M1-L5 HydrophobicContact CG-CD1 4.15Å
2	S	37.8	Very low	40.8	Very low	61 Å²	61	102.7 Å²	102.7	43%	0.427	52%	0.521	S	S	.	.			trans	-62.1	150.9	178.8	66.6	0	0	0	0	111.3	A4 L5 K6	S2-A4 PolarHBondContact O-N 3.14Å; S2-L5 PolarHBondContact O-N 2.75Å; S2-L5 VanDerWaalsContact O-N 3.12Å; S2-K6 PolarHBondContact O-N 2.96Å
3	M	34.4	Very low	40.6	Very low	167 Å²	167	112.2 Å²	112.2	82%	0.823	55%	0.546	S	S	*	.	H	α-helix	trans	-58.4	-27.5	178	-74.8	-167.4	-179.6	0	0	112.8	K6 Q7	M3-K6 PolarHBondContact O-N 3.17Å; M3-Q7 PolarHBondContact O-N 3.47Å; M3-Q7 VanDerWaalsContact O-N 3.15Å
4	A	39.8	Very low	40.7	Very low	52 Å²	52	113 Å²	113	43%	0.43	56%	0.562	S	S	.	*	H	α-helix	trans	-62.6	-42	175.6	0	0	0	0	0	112.4	S2 K6 Q7 V8	S2-A4 PolarHBondContact O-N 3.14Å; A4-K6 VanDerWaalsContact C-N 3.33Å; A4-K6 PolarHBondContact O-N 2.96Å; A4-Q7 PolarHBondContact O-N 2.89Å; A4-V8 WeakPolarHBondContact O-CG2 3.32Å; A4-V8 PolarHBondContact O-N 2.77Å; A4-V8 VanDerWaalsContact O-N 3.09Å
5	L	41.8	Very low	40.9	Very low	16 Å²	16	108.8 Å²	108.8	8%	0.084	54%	0.539	C	S	.	.	H	α-helix	trans	-63.9	-39.6	175.5	-69.1	164.9	0	0	0	111.1	M1 S2 Q7 V8 F9 M176	M1-L5 HydrophobicContact CG-CD1 4.15Å; S2-L5 PolarHBondContact O-N 2.75Å; S2-L5 VanDerWaalsContact O-N 3.12Å; L5-Q7 VanDerWaalsContact C-N 3.28Å; L5-Q7 PolarHBondContact O-N 2.76Å; L5-V8 PolarHBondContact O-N 2.81Å; L5-F9 HydrophobicContact CB-CD2 4.19Å; L5-F9 HydrophobicContact CB-CE2 4.28Å; L5-F9 HydrophobicContact CD2-CD2 4.49Å; L5-F9 HydrophobicContact CD2-CE2 3.77Å; L5-F9 WeakPolarHBondContact O-CB 3.33Å; L5-F9 WeakPolarHBondContact O-CD2 3.48Å; L5-F9 PolarHBondContact O-N 2.93Å; L5-M176 WeakPolarHBondContact CD2-O 3.5Å
6	K	40.8	Very low	41	Very low	149 Å²	149	114.8 Å²	114.8	65%	0.648	55%	0.553	S	S	*	*	H	α-helix	trans	-64.1	-30.8	176.2	-75.5	-173.6	177.3	-178	0	113.1	S2 M3 A4 N10	S2-K6 PolarHBondContact O-N 2.96Å; M3-K6 PolarHBondContact O-N 3.17Å; A4-K6 VanDerWaalsContact C-N 3.33Å; A4-K6 PolarHBondContact O-N 2.96Å; K6-N10 VanDerWaalsContact O-CB 3.31Å; K6-N10 WeakPolarHBondContact O-CB 3.48Å; K6-N10 PolarHBondContact O-N 2.88Å; K6-N10 VanDerWaalsContact O-N 3.13Å
7	Q	41.2	Very low	41.3	Very low	150 Å²	150	110.1 Å²	110.1	70%	0.701	53%	0.534	S	S	*	.	H	α-helix	trans	-75.3	-40.4	176.4	-104.5	176.9	-10.8	0	0	112.4	M3 A4 L5 N10	M3-Q7 PolarHBondContact O-N 3.47Å; M3-Q7 VanDerWaalsContact O-N 3.15Å; A4-Q7 PolarHBondContact O-N 2.89Å; L5-Q7 VanDerWaalsContact C-N 3.28Å; L5-Q7 PolarHBondContact O-N 2.76Å; Q7-N10 WeakPolarHBondContact O-CB 3.37Å; Q7-N10 PolarHBondContact O-N 2.86Å
8	V	45.2	Very low	41.6	Very low	41 Å²	41	112.9 Å²	112.9	25%	0.248	54%	0.544	C	S	.	.	H	α-helix	trans	-71	-35.4	177.7	175.9	0	0	0	0	111.8	A4 L5 N10 T77 M176	A4-V8 WeakPolarHBondContact O-CG2 3.32Å; A4-V8 PolarHBondContact O-N 2.77Å; A4-V8 VanDerWaalsContact O-N 3.09Å; L5-V8 PolarHBondContact O-N 2.81Å; V8-N10 VanDerWaalsContact C-N 3.33Å; V8-T77 HydrophobicContact CG1-CG2 3.47Å; V8-T77 VanDerWaalsContact CG1-CG2 3.47Å; V8-M176 HydrophobicContact CG2-CE 4.01Å
9	F	43.3	Very low	42.3	Very low	79 Å²	79	109.4 Å²	109.4	35%	0.346	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	12	173.9	-61.4	-63.2	0	0	0	113.6	L5 K11 L73	L5-F9 HydrophobicContact CB-CD2 4.19Å; L5-F9 HydrophobicContact CB-CE2 4.28Å; L5-F9 HydrophobicContact CD2-CD2 4.49Å; L5-F9 HydrophobicContact CD2-CE2 3.77Å; L5-F9 WeakPolarHBondContact O-CB 3.33Å; L5-F9 WeakPolarHBondContact O-CD2 3.48Å; L5-F9 PolarHBondContact O-N 2.93Å; F9-K11 PolarHBondContact O-N 2.85Å; F9-L73 HydrophobicContact CD1-CD1 4.09Å; F9-L73 HydrophobicContact CD1-CD2 3.85Å; F9-L73 HydrophobicContact CD1-CG 4.25Å; F9-L73 HydrophobicContact CE1-CD1 4.19Å; F9-L73 HydrophobicContact CE1-CD2 3.63Å; F9-L73 HydrophobicContact CE1-CG 3.92Å
10	N	37.7	Very low	43.3	Very low	68 Å²	68	111.7 Å²	111.7	36%	0.364	53%	0.532	S	S	.	.			trans	-72.8	103.6	177.2	-156.8	-22.8	0	0	0	109.7	K6 Q7 V8 D12 R13	K6-N10 VanDerWaalsContact O-CB 3.31Å; K6-N10 WeakPolarHBondContact O-CB 3.48Å; K6-N10 PolarHBondContact O-N 2.88Å; K6-N10 VanDerWaalsContact O-N 3.13Å; Q7-N10 WeakPolarHBondContact O-CB 3.37Å; Q7-N10 PolarHBondContact O-N 2.86Å; V8-N10 VanDerWaalsContact C-N 3.33Å; N10-D12 PolarHBondContact O-N 3.12Å; N10-R13 PolarHBondContact O-N 3.24Å
11	K	43.6	Very low	44.6	Very low	153 Å²	153	108 Å²	108	67%	0.665	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-18.2	-178.3	-77.8	178.9	175.2	173.9	0	114.3	F9	F9-K11 PolarHBondContact O-N 2.85Å
12	D	40.8	Very low	46.1	Very low	129 Å²	129	106.3 Å²	106.3	69%	0.69	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-6.1	-168.5	-62.9	-35.6	0	0	0	115.5	N10	N10-D12 PolarHBondContact O-N 3.12Å
13	R	37.9	Very low	48	Very low	226 Å²	226	108.6 Å²	108.6	85%	0.853	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.2	-21.6	-176.8	-72.1	-167.6	172.5	-171.1	-2	117.8	N10	N10-R13 PolarHBondContact O-N 3.24Å
14	T	42.6	Very low	49.9	Very low	124 Å²	124	104.1 Å²	104.1	76%	0.761	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-146.8	-7.9	-179.6	48.3	0	0	0	0	115.5
15	F	42.8	Very low	52	Low	50 Å²	50	103 Å²	103	22%	0.219	50%	0.501	C	S	.	.			trans	-129.1	103.1	-177.3	-179.2	-106.3	0	0	0	112	P17	F15-P17 HydrophobicContact CD1-CG 4.5Å; F15-P17 HydrophobicContact CE1-CB 4.28Å; F15-P17 VanDerWaalsContact CE1-CD 3.49Å; F15-P17 HydrophobicContact CE1-CG 3.76Å; F15-P17 HydrophobicContact CZ-CB 3.95Å; F15-P17 HydrophobicContact CZ-CG 3.95Å
16	R	42.4	Very low	53.9	Low	204 Å²	204	106 Å²	106	77%	0.77	52%	0.515	S	S	*	.			trans	-113.9	107.4	160.7	-70.2	-173.4	-178.6	-175.4	1.5	107.8	K18	R16-K18 VanDerWaalsContact C-N 3.34Å; R16-K18 PolarHBondContact O-N 3.18Å
17	P	46	Very low	55.9	Low	36 Å²	36	100.2 Å²	100.2	23%	0.234	49%	0.489	C	S	.	.			trans	-62.6	103.8	167	23.3	-25.3	0	0	0	106.2	F15 R19	F15-P17 HydrophobicContact CD1-CG 4.5Å; F15-P17 HydrophobicContact CE1-CB 4.28Å; F15-P17 VanDerWaalsContact CE1-CD 3.49Å; F15-P17 HydrophobicContact CE1-CG 3.76Å; F15-P17 HydrophobicContact CZ-CB 3.95Å; F15-P17 HydrophobicContact CZ-CG 3.95Å; P17-R19 PolarHBondContact O-N 3.08Å
18	K	46.9	Very low	57.9	Low	161 Å²	161	95.8 Å²	95.8	70%	0.7	47%	0.468	S	S	*	.	S	Bend	trans	-69.4	-28.4	-175.5	-70	-173.5	-164.3	148.8	0	111.3	R16 E126	R16-K18 VanDerWaalsContact C-N 3.34Å; R16-K18 PolarHBondContact O-N 3.18Å; K18-E126 IonicContact NZ-OE1 3.95Å; K18-E126 PolarHBondContact NZ-OE1 3.36Å
19	R	56.4	Low	59.8	Low	46 Å²	46	97.5 Å²	97.5	17%	0.174	47%	0.473	C	S	.	.			trans	-104.6	100.5	172.5	-141.3	178.5	-167.7	-158	6.5	109.8	P17 I129 F135	P17-R19 PolarHBondContact O-N 3.08Å; R19-I129 PolarHBondContact NH1-O 3.5Å; R19-F135 PolarHBondContact NH2-O 3.34Å
20	K	60.7	Low	61.6	Low	155 Å²	155	93.7 Å²	93.7	67%	0.674	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-94.7	138.1	163.1	-65.4	179.2	-177	175.8	0	106.5	E22	K20-E22 PolarHBondContact O-N 2.97Å
21	F	70.9	Confident	63.8	Low	34 Å²	34	91.9 Å²	91.9	15%	0.149	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-59.4	127.5	168.4	-57.7	-75.4	0	0	0	107.8	R27 F28 H31 V62 V65	F21-R27 HydrophobicContact CD1-CB 3.76Å; F21-R27 HydrophobicContact CE1-CB 4.23Å; F21-F28 HydrophobicContact CB-CB 3.81Å; F21-F28 HydrophobicContact CB-CD2 4.04Å; F21-F28 HydrophobicContact CB-CG 4.44Å; F21-F28 VanDerWaalsContact O-CD2 3.27Å; F21-F28 WeakPolarHBondContact O-CD2 3.36Å; F21-H31 HydrophobicContact CD2-CB 3.48Å; F21-H31 VanDerWaalsContact CD2-CB 3.48Å; F21-H31 AromaticContact CD2-CD2 3.54Å; F21-H31 AromaticContact CD2-CG 3.36Å; F21-H31 AromaticContact CD2-ND1 3.87Å; F21-H31 HydrophobicContact CE2-CB 3.69Å; F21-H31 AromaticContact CE2-CD2 3.9Å; F21-H31 AromaticContact CE2-CE1 3.87Å; F21-H31 AromaticContact CE2-CG 3.41Å; F21-H31 VanDerWaalsContact CE2-CG 3.41Å; F21-H31 AromaticContact CE2-ND1 3.42Å; F21-H31 WeakPolarHBondContact CE2-ND1 3.23Å; F21-H31 HydrophobicContact CG-CB 4.13Å; F21-H31 HydrophobicContact CZ-CB 4.46Å; F21-V62 HydrophobicContact CD1-CG2 4.48Å; F21-V62 HydrophobicContact CE1-CB 4.32Å; F21-V62 HydrophobicContact CE1-CG2 3.85Å; F21-V62 HydrophobicContact CE2-CG1 4.31Å; F21-V62 HydrophobicContact CZ-CB 4.11Å; F21-V62 HydrophobicContact CZ-CG1 3.95Å; F21-V62 HydrophobicContact CZ-CG2 4.11Å; F21-V65 HydrophobicContact CE1-CB 4.49Å; F21-V65 HydrophobicContact CE2-CG1 4.4Å; F21-V65 HydrophobicContact CZ-CB 3.89Å; F21-V65 HydrophobicContact CZ-CG1 3.95Å
22	E	76.3	Confident	65.8	Low	132 Å²	132	90.1 Å²	90.1	62%	0.617	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-70.9	128.4	-175.7	-67.6	-174.8	170.6	0	0	110	K20 G24 T25 F28	K20-E22 PolarHBondContact O-N 2.97Å; E22-G24 PolarHBondContact O-N 2.83Å; E22-T25 HydrophobicContact CB-CG2 3.84Å; E22-T25 WeakPolarHBondContact O-CB 3.37Å; E22-T25 WeakPolarHBondContact O-CG2 3.26Å; E22-T25 PolarHBondContact O-N 3Å; E22-T25 VanDerWaalsContact O-N 3.15Å; E22-T25 PolarHBondContact O-OG1 3.37Å; E22-F28 WeakPolarHBondContact O-CB 3.34Å
23	P	77.1	Confident	67.7	Low	108 Å²	108	88.4 Å²	88.4	70%	0.701	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	136.2	177.1	-27	35.3	0	0	0	112	F28	P23-F28 HydrophobicContact CB-CE1 4.4Å; P23-F28 HydrophobicContact CB-CZ 4.35Å; P23-F28 HydrophobicContact CG-CE2 4.23Å; P23-F28 HydrophobicContact CG-CZ 4.42Å
24	G	75.2	Confident	69.6	Low	73 Å²	73	78 Å²	78	75%	0.753	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.6	-1.1	-177.5	0	0	0	0	0	115.1	E22	E22-G24 PolarHBondContact O-N 2.83Å
25	T	82.4	Confident	71.4	Confident	28 Å²	28	76 Å²	76	17%	0.172	37%	0.368	C	S	.	.	S	Bend	trans	-89.9	153.9	172	65.1	0	0	0	0	112.2	E22 R27 F28 E29	E22-T25 HydrophobicContact CB-CG2 3.84Å; E22-T25 WeakPolarHBondContact O-CB 3.37Å; E22-T25 WeakPolarHBondContact O-CG2 3.26Å; E22-T25 PolarHBondContact O-N 3Å; E22-T25 VanDerWaalsContact O-N 3.15Å; E22-T25 PolarHBondContact O-OG1 3.37Å; T25-R27 VanDerWaalsContact C-N 3.25Å; T25-R27 PolarHBondContact O-N 3.28Å; T25-F28 WeakPolarHBondContact O-CB 3.15Å; T25-F28 PolarHBondContact O-N 3.34Å; T25-F28 VanDerWaalsContact O-N 3.1Å; T25-F28 WeakPolarHBondContact OG1-CB 3.28Å; T25-F28 PolarHBondContact OG1-N 3.05Å; T25-E29 PolarHBondContact O-N 2.89Å; T25-E29 VanDerWaalsContact O-N 3.13Å
26	Q	82.8	Confident	72.9	Confident	79 Å²	79	76.3 Å²	76.3	37%	0.369	38%	0.38	S	S	.	.	H	α-helix	trans	-55.6	-41.4	175.1	-176.7	179.3	1.4	0	0	111.9	F28 E29 L30 E54	Q26-F28 VanDerWaalsContact C-N 3.33Å; Q26-F28 PolarHBondContact O-N 3.49Å; Q26-E29 PolarHBondContact O-N 3.45Å; Q26-L30 HydrophobicContact CG-CD1 4.19Å; Q26-L30 HydrophobicContact CG-CG 4.48Å; Q26-L30 WeakPolarHBondContact O-CG 3.39Å; Q26-L30 PolarHBondContact O-N 3.22Å; Q26-E54 PolarHBondContact NE2-OE2 2.82Å
27	R	82.2	Confident	74.3	Confident	28 Å²	28	68.2 Å²	68.2	11%	0.106	36%	0.355	C	S	.	.	H	α-helix	trans	-67.5	-32.1	178.6	-68	-169.3	-169.8	141.9	15.5	113.6	F21 T25 H31 D58 V62 P136	F21-R27 HydrophobicContact CD1-CB 3.76Å; F21-R27 HydrophobicContact CE1-CB 4.23Å; T25-R27 VanDerWaalsContact C-N 3.25Å; T25-R27 PolarHBondContact O-N 3.28Å; R27-H31 WeakPolarHBondContact O-CB 3.2Å; R27-H31 PolarHBondContact O-N 3.46Å; R27-D58 IonicContact CZ-OD1 3.56Å; R27-D58 IonicContact NE-OD1 2.93Å; R27-D58 PolarHBondContact NE-OD1 3.25Å; R27-D58 IonicContact NH2-OD1 3.83Å; R27-D58 PolarHBondContact NH2-OD1 3.16Å; R27-D58 VanDerWaalsContact NH2-OD1 3.13Å; R27-V62 HydrophobicContact CB-CG2 3.79Å; R27-V62 HydrophobicContact CG-CG2 4Å; R27-P136 PolarHBondContact NH1-O 3.42Å; R27-P136 PolarHBondContact NH2-O 3.29Å
28	F	83.3	Confident	75.6	Confident	58 Å²	58	68.3 Å²	68.3	25%	0.254	35%	0.353	S	S	.	.	H	α-helix	trans	-65.1	-44.3	172.1	175.5	-95.4	0	0	0	111.3	F21 E22 P23 T25 Q26 H31 K32	F21-F28 HydrophobicContact CB-CB 3.81Å; F21-F28 HydrophobicContact CB-CD2 4.04Å; F21-F28 HydrophobicContact CB-CG 4.44Å; F21-F28 VanDerWaalsContact O-CD2 3.27Å; F21-F28 WeakPolarHBondContact O-CD2 3.36Å; E22-F28 WeakPolarHBondContact O-CB 3.34Å; P23-F28 HydrophobicContact CB-CE1 4.4Å; P23-F28 HydrophobicContact CB-CZ 4.35Å; P23-F28 HydrophobicContact CG-CE2 4.23Å; P23-F28 HydrophobicContact CG-CZ 4.42Å; T25-F28 WeakPolarHBondContact O-CB 3.15Å; T25-F28 PolarHBondContact O-N 3.34Å; T25-F28 VanDerWaalsContact O-N 3.1Å; T25-F28 WeakPolarHBondContact OG1-CB 3.28Å; T25-F28 PolarHBondContact OG1-N 3.05Å; Q26-F28 VanDerWaalsContact C-N 3.33Å; Q26-F28 PolarHBondContact O-N 3.49Å; F28-H31 PolarHBondContact O-N 3.12Å; F28-K32 WeakPolarHBondContact O-CB 3.35Å; F28-K32 PolarHBondContact O-N 3.34Å
29	E	84.2	Confident	76.9	Confident	76 Å²	76	67.2 Å²	67.2	36%	0.355	36%	0.355	S	S	.	.	H	α-helix	trans	-64.6	-40.7	175.7	-66.6	-54.7	139.7	0	0	112	T25 Q26 K32 K33	T25-E29 PolarHBondContact O-N 2.89Å; T25-E29 VanDerWaalsContact O-N 3.13Å; Q26-E29 PolarHBondContact O-N 3.45Å; E29-K32 PolarHBondContact O-N 2.96Å; E29-K33 VanDerWaalsContact O-CG 3.31Å; E29-K33 WeakPolarHBondContact O-CG 3.28Å; E29-K33 PolarHBondContact O-N 3.43Å
30	L	82.5	Confident	77.4	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-60.8	-45.5	173.4	-75.3	172.6	0	0	0	112.1	Q26 K32 K33 A34 E54 D58 W59 V62	Q26-L30 HydrophobicContact CG-CD1 4.19Å; Q26-L30 HydrophobicContact CG-CG 4.48Å; Q26-L30 WeakPolarHBondContact O-CG 3.39Å; Q26-L30 PolarHBondContact O-N 3.22Å; L30-K32 VanDerWaalsContact C-N 3.32Å; L30-K32 PolarHBondContact O-N 2.86Å; L30-K33 PolarHBondContact O-N 3.08Å; L30-A34 PolarHBondContact O-N 2.86Å; L30-E54 HydrophobicContact CD2-CB 4.2Å; L30-E54 VanDerWaalsContact CD2-CD 3.45Å; L30-E54 HydrophobicContact CD2-CG 3.69Å; L30-D58 HydrophobicContact CD1-CB 3.87Å; L30-W59 HydrophobicContact CB-CE3 4.31Å; L30-W59 HydrophobicContact CB-CZ3 4.31Å; L30-W59 HydrophobicContact CD2-CE3 3.9Å; L30-W59 HydrophobicContact CD2-CZ3 4.08Å; L30-V62 HydrophobicContact CB-CG2 4Å; L30-V62 HydrophobicContact CD1-CG2 4.46Å
31	H	83.9	Confident	77.6	Confident	30 Å²	30	64.4 Å²	64.4	14%	0.139	38%	0.377	C	S	.	.	H	α-helix	trans	-60.8	-42.7	176.1	-178.6	62.8	0	0	0	111.7	F21 R27 F28 A34 Q35 V62 D66	F21-H31 HydrophobicContact CD2-CB 3.48Å; F21-H31 VanDerWaalsContact CD2-CB 3.48Å; F21-H31 AromaticContact CD2-CD2 3.54Å; F21-H31 AromaticContact CD2-CG 3.36Å; F21-H31 AromaticContact CD2-ND1 3.87Å; F21-H31 HydrophobicContact CE2-CB 3.69Å; F21-H31 AromaticContact CE2-CD2 3.9Å; F21-H31 AromaticContact CE2-CE1 3.87Å; F21-H31 AromaticContact CE2-CG 3.41Å; F21-H31 VanDerWaalsContact CE2-CG 3.41Å; F21-H31 AromaticContact CE2-ND1 3.42Å; F21-H31 WeakPolarHBondContact CE2-ND1 3.23Å; F21-H31 HydrophobicContact CG-CB 4.13Å; F21-H31 HydrophobicContact CZ-CB 4.46Å; R27-H31 WeakPolarHBondContact O-CB 3.2Å; R27-H31 PolarHBondContact O-N 3.46Å; F28-H31 PolarHBondContact O-N 3.12Å; H31-A34 PolarHBondContact O-N 3.23Å; H31-Q35 PolarHBondContact CE1-NE2 3.07Å; H31-Q35 PolarHBondContact NE2-NE2 3.19Å; H31-Q35 WeakPolarHBondContact O-CG 3.47Å; H31-Q35 PolarHBondContact O-N 3.05Å; H31-V62 HydrophobicContact CB-CG1 3.8Å; H31-D66 IonicContact CE1-OD1 3.9Å
32	K	84.5	Confident	77.4	Confident	116 Å²	116	66.6 Å²	66.6	50%	0.504	39%	0.39	S	S	.	.	H	α-helix	trans	-63.6	-42.8	176.4	-175	-176.7	175	-170.5	0	111.8	F28 E29 L30 Q35 A36	F28-K32 WeakPolarHBondContact O-CB 3.35Å; F28-K32 PolarHBondContact O-N 3.34Å; E29-K32 PolarHBondContact O-N 2.96Å; L30-K32 VanDerWaalsContact C-N 3.32Å; L30-K32 PolarHBondContact O-N 2.86Å; K32-Q35 PolarHBondContact O-N 2.82Å; K32-A36 VanDerWaalsContact O-CB 3.31Å; K32-A36 WeakPolarHBondContact O-CB 3.28Å; K32-A36 PolarHBondContact O-N 3.11Å
33	K	81.3	Confident	77.8	Confident	93 Å²	93	64.2 Å²	64.2	40%	0.404	38%	0.381	S	S	.	.	H	α-helix	trans	-58.6	-49.1	173.5	-72.8	174.1	-172.4	-179.1	0	110.7	E29 L30 Q35 A36 S37 E54	E29-K33 VanDerWaalsContact O-CG 3.31Å; E29-K33 WeakPolarHBondContact O-CG 3.28Å; E29-K33 PolarHBondContact O-N 3.43Å; L30-K33 PolarHBondContact O-N 3.08Å; K33-Q35 PolarHBondContact O-N 3.31Å; K33-A36 PolarHBondContact O-N 3.27Å; K33-S37 PolarHBondContact O-N 3.44Å; K33-S37 PolarHBondContact O-OG 2.8Å; K33-E54 IonicContact NZ-OE1 2.71Å; K33-E54 PolarHBondContact NZ-OE1 2.92Å
34	A	76.9	Confident	78.1	Confident	7 Å²	7	60.6 Å²	60.6	6%	0.058	36%	0.356	C	S	.	.	H	α-helix	trans	-58.5	-46.6	178.2	0	0	0	0	0	111.9	L30 H31 S37 L38 W59	L30-A34 PolarHBondContact O-N 2.86Å; H31-A34 PolarHBondContact O-N 3.23Å; A34-S37 PolarHBondContact O-N 3.43Å; A34-L38 WeakPolarHBondContact O-CG 3.3Å; A34-L38 PolarHBondContact O-N 2.92Å; A34-L38 VanDerWaalsContact O-N 3.16Å; A34-W59 HydrophobicContact CB-CH2 3.78Å; A34-W59 HydrophobicContact CB-CZ3 4.1Å
35	Q	80.6	Confident	78.7	Confident	82 Å²	82	61.7 Å²	61.7	38%	0.383	34%	0.34	S	S	.	.	H	α-helix	trans	-65.2	-40.7	177.5	-75.1	-174.2	-20.6	0	0	113.1	H31 K32 K33 S37 L38 N39	H31-Q35 PolarHBondContact CE1-NE2 3.07Å; H31-Q35 PolarHBondContact NE2-NE2 3.19Å; H31-Q35 WeakPolarHBondContact O-CG 3.47Å; H31-Q35 PolarHBondContact O-N 3.05Å; K32-Q35 PolarHBondContact O-N 2.82Å; K33-Q35 PolarHBondContact O-N 3.31Å; Q35-S37 VanDerWaalsContact C-N 3.29Å; Q35-S37 PolarHBondContact O-N 2.93Å; Q35-L38 PolarHBondContact O-N 3.44Å; Q35-N39 WeakPolarHBondContact O-CB 3.39Å; Q35-N39 PolarHBondContact O-N 3.02Å; Q35-N39 PolarHBondContact O-ND2 3.08Å
36	A	74.1	Confident	78.9	Confident	56 Å²	56	66.7 Å²	66.7	46%	0.463	36%	0.361	S	S	.	.	H	α-helix	trans	-60.5	-42.7	177.2	0	0	0	0	0	110.7	K32 K33 N39 A40	K32-A36 VanDerWaalsContact O-CB 3.31Å; K32-A36 WeakPolarHBondContact O-CB 3.28Å; K32-A36 PolarHBondContact O-N 3.11Å; K33-A36 PolarHBondContact O-N 3.27Å; A36-N39 PolarHBondContact O-N 3.49Å; A36-A40 VanDerWaalsContact O-CB 3.3Å; A36-A40 WeakPolarHBondContact O-CB 3.38Å; A36-A40 PolarHBondContact O-N 2.92Å
37	S	72.4	Confident	79.1	Confident	34 Å²	34	63.2 Å²	63.2	24%	0.238	35%	0.346	C	S	.	.	H	α-helix	trans	-62.9	-44.8	178.5	-59.2	0	0	0	0	112.5	K33 A34 Q35 N39 A40 L42	K33-S37 PolarHBondContact O-N 3.44Å; K33-S37 PolarHBondContact O-OG 2.8Å; A34-S37 PolarHBondContact O-N 3.43Å; Q35-S37 VanDerWaalsContact C-N 3.29Å; Q35-S37 PolarHBondContact O-N 2.93Å; S37-N39 PolarHBondContact O-N 3.13Å; S37-A40 PolarHBondContact O-N 3.11Å; S37-L42 WeakPolarHBondContact O-CB 3.24Å; S37-L42 PolarHBondContact O-N 3.48Å
38	L	74.2	Confident	79.7	Confident	39 Å²	39	62 Å²	62	20%	0.204	34%	0.342	C	S	.	.	H	α-helix	trans	-62	-41.6	176.2	-67.8	172.8	0	0	0	112.1	A34 Q35 G41 L44 A47	A34-L38 WeakPolarHBondContact O-CG 3.3Å; A34-L38 PolarHBondContact O-N 2.92Å; A34-L38 VanDerWaalsContact O-N 3.16Å; Q35-L38 PolarHBondContact O-N 3.44Å; L38-G41 PolarHBondContact O-N 3.38Å; L38-L44 HydrophobicContact CD2-CD2 3.35Å; L38-A47 HydrophobicContact CD2-CB 4.26Å
39	N	72.5	Confident	80.2	Confident	137 Å²	137	61 Å²	61	73%	0.733	35%	0.345	S	S	*	.	H	α-helix	trans	-75	-25.6	-178.4	-68.3	-24.2	0	0	0	113.2	Q35 A36 S37 G41	Q35-N39 WeakPolarHBondContact O-CB 3.39Å; Q35-N39 PolarHBondContact O-N 3.02Å; Q35-N39 PolarHBondContact O-ND2 3.08Å; A36-N39 PolarHBondContact O-N 3.49Å; S37-N39 PolarHBondContact O-N 3.13Å; N39-G41 PolarHBondContact O-N 2.91Å
40	A	67.3	Low	80.7	Confident	76 Å²	76	60.5 Å²	60.5	63%	0.628	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-2.6	176.4	0	0	0	0	0	113.2	A36 S37 L42	A36-A40 VanDerWaalsContact O-CB 3.3Å; A36-A40 WeakPolarHBondContact O-CB 3.38Å; A36-A40 PolarHBondContact O-N 2.92Å; S37-A40 PolarHBondContact O-N 3.11Å; A40-L42 HydrophobicContact CB-CD1 4.47Å; A40-L42 HydrophobicContact CB-CG 4.48Å; A40-L42 PolarHBondContact O-N 3.13Å
41	G	65.4	Low	81.3	Confident	67 Å²	67	62.2 Å²	62.2	69%	0.691	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.5	22.5	-177.9	0	0	0	0	0	113.3	L38 N39	L38-G41 PolarHBondContact O-N 3.38Å; N39-G41 PolarHBondContact O-N 2.91Å
42	L	66.6	Low	81.7	Confident	79 Å²	79	70.1 Å²	70.1	41%	0.414	39%	0.392	S	S	.	.			trans	-60.2	151.6	172.4	-79.6	160.7	0	0	0	110.4	S37 A40 L44	S37-L42 WeakPolarHBondContact O-CB 3.24Å; S37-L42 PolarHBondContact O-N 3.48Å; A40-L42 HydrophobicContact CB-CD1 4.47Å; A40-L42 HydrophobicContact CB-CG 4.48Å; A40-L42 PolarHBondContact O-N 3.13Å; L42-L44 PolarHBondContact O-N 3.36Å
43	D	84.1	Confident	82.1	Confident	82 Å²	82	68.2 Å²	68.2	44%	0.439	41%	0.405	S	S	.	.			trans	-55	127.2	171.7	-178.6	-85.5	0	0	0	109.6	K45 Q46 A47	D43-K45 PolarHBondContact O-N 3.29Å; D43-K45 VanDerWaalsContact O-N 3.14Å; D43-K45 WeakPolarHBondContact OD1-CA 3.44Å; D43-K45 WeakPolarHBondContact OD1-CB 3.46Å; D43-K45 PolarHBondContact OD1-N 3.01Å; D43-Q46 HydrophobicContact CB-CB 4.48Å; D43-Q46 HydrophobicContact CB-CG 4.21Å; D43-Q46 WeakPolarHBondContact O-CA 3.45Å; D43-Q46 WeakPolarHBondContact O-CB 3.46Å; D43-Q46 PolarHBondContact O-N 3.06Å; D43-Q46 PolarHBondContact OD1-N 3.36Å; D43-A47 PolarHBondContact O-N 3.01Å
44	L	84.9	Confident	82.7	Confident	32 Å²	32	65.6 Å²	65.6	17%	0.168	39%	0.394	C	S	.	.	H	α-helix	trans	-62.1	-25.3	-173.3	-69.7	175.5	0	0	0	112.6	L38 L42 A47 V48 K187 Y191	L38-L44 HydrophobicContact CD2-CD2 3.35Å; L42-L44 PolarHBondContact O-N 3.36Å; L44-A47 PolarHBondContact O-N 3.46Å; L44-V48 WeakPolarHBondContact O-CG1 2.94Å; L44-V48 PolarHBondContact O-N 3.32Å; L44-K187 HydrophobicContact CD1-CB 3.63Å; L44-K187 HydrophobicContact CD1-CD 4.33Å; L44-Y191 HydrophobicContact CB-CD2 3.56Å; L44-Y191 HydrophobicContact CB-CE2 3.74Å; L44-Y191 HydrophobicContact CD1-CE2 4.41Å
45	K	86.3	Confident	83.6	Confident	96 Å²	96	68.6 Å²	68.6	42%	0.417	41%	0.409	S	S	.	.	H	α-helix	trans	-70.5	-37.1	174.7	-58.8	177	176.7	171.9	0	110.9	D43 V48 Y191	D43-K45 PolarHBondContact O-N 3.29Å; D43-K45 VanDerWaalsContact O-N 3.14Å; D43-K45 WeakPolarHBondContact OD1-CA 3.44Å; D43-K45 WeakPolarHBondContact OD1-CB 3.46Å; D43-K45 PolarHBondContact OD1-N 3.01Å; K45-V48 WeakPolarHBondContact O-CG2 3.38Å; K45-Y191 HydrophobicContact CD-CE1 4.22Å; K45-Y191 VanDerWaalsContact CE-CZ 3.48Å; K45-Y191 WeakPolarHBondContact CE-OH 3.08Å; K45-Y191 HydrophobicContact CG-CD1 3.87Å; K45-Y191 HydrophobicContact CG-CD2 3.88Å; K45-Y191 HydrophobicContact CG-CE1 3.85Å; K45-Y191 HydrophobicContact CG-CE2 3.85Å; K45-Y191 HydrophobicContact CG-CG 3.89Å
46	Q	86.5	Confident	84.3	Confident	133 Å²	133	67.9 Å²	67.9	62%	0.621	41%	0.408	S	S	*	.	H	α-helix	trans	-70.6	-36.7	173.5	-62.8	-179.4	6.9	0	0	111.5	D43 V48 A49	D43-Q46 HydrophobicContact CB-CB 4.48Å; D43-Q46 HydrophobicContact CB-CG 4.21Å; D43-Q46 WeakPolarHBondContact O-CA 3.45Å; D43-Q46 WeakPolarHBondContact O-CB 3.46Å; D43-Q46 PolarHBondContact O-N 3.06Å; D43-Q46 PolarHBondContact OD1-N 3.36Å; Q46-V48 VanDerWaalsContact C-N 3.26Å; Q46-V48 PolarHBondContact O-N 3.29Å; Q46-A49 WeakPolarHBondContact O-CB 3.21Å; Q46-A49 PolarHBondContact O-N 3.01Å
47	A	88.1	Confident	85.4	Confident	7 Å²	7	67.5 Å²	67.5	6%	0.058	40%	0.398	C	S	.	.	H	α-helix	trans	-65	-26.3	-178.3	0	0	0	0	0	113.8	L38 D43 L44	L38-A47 HydrophobicContact CD2-CB 4.26Å; D43-A47 PolarHBondContact O-N 3.01Å; L44-A47 PolarHBondContact O-N 3.46Å
48	V	93.8	Very high	86.4	Confident	1 Å²	1	67 Å²	67	1%	0.006	39%	0.392	C	S	.	.	H	α-helix	trans	-87.6	-14.8	179.7	-63.9	0	0	0	0	114	L44 K45 Q46 W59 H188 F192 E195 F196	L44-V48 WeakPolarHBondContact O-CG1 2.94Å; L44-V48 PolarHBondContact O-N 3.32Å; K45-V48 WeakPolarHBondContact O-CG2 3.38Å; Q46-V48 VanDerWaalsContact C-N 3.26Å; Q46-V48 PolarHBondContact O-N 3.29Å; V48-W59 PolarHBondContact O-NE1 3.45Å; V48-H188 VanDerWaalsContact CG1-CD2 3.42Å; V48-H188 WeakPolarHBondContact CG1-CD2 3.33Å; V48-F192 HydrophobicContact CB-CB 4.27Å; V48-F192 HydrophobicContact CB-CD2 3.98Å; V48-F192 HydrophobicContact CG1-CB 3.87Å; V48-F192 HydrophobicContact CG1-CD2 4.16Å; V48-E195 HydrophobicContact CG2-CB 4.32Å; V48-E195 HydrophobicContact CG2-CG 4.49Å; V48-F196 WeakPolarHBondContact O-CE2 3.35Å; V48-F196 WeakPolarHBondContact O-CZ 3.29Å
49	A	94.3	Very high	87.5	Confident	39 Å²	39	65.3 Å²	65.3	32%	0.322	38%	0.383	S	S	.	.	S	Bend	trans	-60.4	143.9	-176.9	0	0	0	0	0	111.3	Q46 P51 W59	Q46-A49 WeakPolarHBondContact O-CB 3.21Å; Q46-A49 PolarHBondContact O-N 3.01Å; A49-P51 VanDerWaalsContact O-CD 3.31Å; A49-P51 WeakPolarHBondContact O-CD 3.42Å; A49-W59 WeakPolarHBondContact O-CZ2 3.35Å
50	L	95.5	Very high	88.7	Confident	64 Å²	64	58.8 Å²	58.8	34%	0.335	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-64.2	121.3	176.6	179.4	65.8	0	0	0	109.1	E54 L56 W59 F196	L50-E54 HydrophobicContact CD1-CB 4.13Å; L50-L56 HydrophobicContact CD2-CB 4.29Å; L50-L56 HydrophobicContact CD2-CD1 4.48Å; L50-W59 HydrophobicContact CD1-CB 3.48Å; L50-W59 VanDerWaalsContact CD1-CB 3.48Å; L50-W59 HydrophobicContact CD1-CD2 4.5Å; L50-W59 HydrophobicContact CD1-CG 3.68Å; L50-F196 HydrophobicContact CB-CE1 4.09Å; L50-F196 HydrophobicContact CB-CZ 4.05Å
51	P	93.7	Very high	90.1	Very high	37 Å²	37	55.2 Å²	55.2	24%	0.24	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-63.8	145.5	178.1	-18.6	30.7	0	0	0	111.2	A49 G53 E54 W59	A49-P51 VanDerWaalsContact O-CD 3.31Å; A49-P51 WeakPolarHBondContact O-CD 3.42Å; P51-G53 PolarHBondContact O-N 3.36Å; P51-E54 HydrophobicContact CB-CG 3.81Å; P51-E54 HydrophobicContact CG-CG 4.24Å; P51-E54 WeakPolarHBondContact O-CB 3.49Å; P51-E54 PolarHBondContact O-N 2.94Å; P51-E54 VanDerWaalsContact O-N 3.13Å; P51-W59 HydrophobicContact CG-CE3 4.45Å; P51-W59 HydrophobicContact CG-CH2 4.06Å; P51-W59 HydrophobicContact CG-CZ2 4.32Å; P51-W59 HydrophobicContact CG-CZ3 4.15Å
52	H	92.6	Very high	91.5	Very high	196 Å²	196	52 Å²	52	91%	0.907	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	125.8	-177.1	179.6	-82.4	0	0	0	111.7	E54	H52-E54 VanDerWaalsContact C-N 3.35Å
53	G	93	Very high	92.9	Very high	75 Å²	75	48.4 Å²	48.4	77%	0.773	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.3	2.7	177.9	0	0	0	0	0	115.3	P51	P51-G53 PolarHBondContact O-N 3.36Å
54	E	94.4	Very high	93.6	Very high	38 Å²	38	44.5 Å²	44.5	18%	0.178	25%	0.246	C	C	.	.			trans	-90.4	155.4	175.4	-60.4	-72.1	-176.5	0	0	111.9	Q26 L30 K33 L50 P51 H52	Q26-E54 PolarHBondContact NE2-OE2 2.82Å; L30-E54 HydrophobicContact CD2-CB 4.2Å; L30-E54 VanDerWaalsContact CD2-CD 3.45Å; L30-E54 HydrophobicContact CD2-CG 3.69Å; K33-E54 IonicContact NZ-OE1 2.71Å; K33-E54 PolarHBondContact NZ-OE1 2.92Å; L50-E54 HydrophobicContact CD1-CB 4.13Å; P51-E54 HydrophobicContact CB-CG 3.81Å; P51-E54 HydrophobicContact CG-CG 4.24Å; P51-E54 WeakPolarHBondContact O-CB 3.49Å; P51-E54 PolarHBondContact O-N 2.94Å; P51-E54 VanDerWaalsContact O-N 3.13Å; H52-E54 VanDerWaalsContact C-N 3.35Å
55	D	94.4	Very high	94	Very high	71 Å²	71	43 Å²	43	38%	0.38	24%	0.239	S	C	.	.			trans	-79.5	137	176	178.8	-96.8	0	0	0	111.8	N57 D58 W59	D55-N57 PolarHBondContact O-N 3.04Å; D55-N57 WeakPolarHBondContact OD1-CA 3.34Å; D55-N57 VanDerWaalsContact OD1-CB 3.24Å; D55-N57 WeakPolarHBondContact OD1-CB 3.36Å; D55-N57 PolarHBondContact OD1-N 3.07Å; D55-D58 HydrophobicContact CB-CB 4.29Å; D55-D58 PolarHBondContact O-N 3.37Å; D55-D58 PolarHBondContact OD1-N 3.29Å; D55-W59 PolarHBondContact O-N 3.13Å
56	L	96.3	Very high	94.4	Very high	67 Å²	67	39.4 Å²	39.4	35%	0.351	22%	0.224	S	C	.	.	H	α-helix	trans	-65	-39.6	-178.9	177.4	61.9	0	0	0	112.5	L50 W59 V60 M148 F196	L50-L56 HydrophobicContact CD2-CB 4.29Å; L50-L56 HydrophobicContact CD2-CD1 4.48Å; L56-W59 PolarHBondContact O-N 3.39Å; L56-V60 HydrophobicContact CD1-CG2 4.06Å; L56-V60 HydrophobicContact CG-CG2 4.44Å; L56-V60 WeakPolarHBondContact O-CB 3.45Å; L56-V60 VanDerWaalsContact O-CG2 3.3Å; L56-V60 WeakPolarHBondContact O-CG2 3.36Å; L56-V60 PolarHBondContact O-N 3.46Å; L56-M148 HydrophobicContact CG-CE 4.49Å; L56-F196 HydrophobicContact CD1-CD1 3.5Å; L56-F196 HydrophobicContact CD1-CE1 3.59Å; L56-F196 HydrophobicContact CD1-CG 4.2Å; L56-F196 HydrophobicContact CD1-CZ 4.36Å
57	N	96.8	Very high	94.9	Very high	47 Å²	47	33 Å²	33	25%	0.251	19%	0.194	S	C	.	.	H	α-helix	trans	-70.2	-39.1	-178.4	-64.1	-37.8	0	0	0	111.1	D55 W59 V60 A61 F143 F147 M148	D55-N57 PolarHBondContact O-N 3.04Å; D55-N57 WeakPolarHBondContact OD1-CA 3.34Å; D55-N57 VanDerWaalsContact OD1-CB 3.24Å; D55-N57 WeakPolarHBondContact OD1-CB 3.36Å; D55-N57 PolarHBondContact OD1-N 3.07Å; N57-W59 VanDerWaalsContact C-N 3.35Å; N57-V60 PolarHBondContact O-N 3.04Å; N57-A61 VanDerWaalsContact O-CB 3.24Å; N57-A61 WeakPolarHBondContact O-CB 3.24Å; N57-A61 PolarHBondContact O-N 3.31Å; N57-F143 HydrophobicContact CB-CB 4.3Å; N57-F143 HydrophobicContact CB-CD1 4.31Å; N57-F143 HydrophobicContact CB-CD2 3.38Å; N57-F143 HydrophobicContact CB-CE1 4.47Å; N57-F143 HydrophobicContact CB-CE2 3.59Å; N57-F143 HydrophobicContact CB-CG 3.75Å; N57-F143 HydrophobicContact CB-CZ 4.12Å; N57-F147 HydrophobicContact CB-CD1 3.72Å; N57-F147 HydrophobicContact CB-CE1 3.63Å; N57-F147 WeakPolarHBondContact O-CE1 3.45Å; N57-F147 WeakPolarHBondContact O-CZ 3.24Å; N57-F147 WeakPolarHBondContact OD1-CD1 3.25Å; N57-M148 VanDerWaalsContact OD1-CE 3.25Å; N57-M148 WeakPolarHBondContact OD1-CE 3.24Å
58	D	94.7	Very high	95.4	Very high	23 Å²	23	33.2 Å²	33.2	12%	0.123	19%	0.193	C	C	.	.	H	α-helix	trans	-62.1	-42.7	172.8	-79.6	-56.9	0	0	0	111.8	R27 L30 D55 A61 V62 F143	R27-D58 IonicContact CZ-OD1 3.56Å; R27-D58 IonicContact NE-OD1 2.93Å; R27-D58 PolarHBondContact NE-OD1 3.25Å; R27-D58 IonicContact NH2-OD1 3.83Å; R27-D58 PolarHBondContact NH2-OD1 3.16Å; R27-D58 VanDerWaalsContact NH2-OD1 3.13Å; L30-D58 HydrophobicContact CD1-CB 3.87Å; D55-D58 HydrophobicContact CB-CB 4.29Å; D55-D58 PolarHBondContact O-N 3.37Å; D55-D58 PolarHBondContact OD1-N 3.29Å; D58-A61 PolarHBondContact O-N 2.85Å; D58-V62 WeakPolarHBondContact O-CG2 3.4Å; D58-V62 PolarHBondContact O-N 2.94Å; D58-F143 HydrophobicContact CB-CE2 4.41Å; D58-F143 WeakPolarHBondContact OD1-CE2 3.13Å
59	W	96.4	Very high	95.3	Very high	4 Å²	4	34.4 Å²	34.4	2%	0.015	20%	0.2	C	C	.	.	H	α-helix	trans	-61.8	-46.3	176.2	-170.9	-125.4	0	0	0	112.4	L30 A34 V48 A49 L50 P51 D55 L56 N57 V62 H63 F192 F196	L30-W59 HydrophobicContact CB-CE3 4.31Å; L30-W59 HydrophobicContact CB-CZ3 4.31Å; L30-W59 HydrophobicContact CD2-CE3 3.9Å; L30-W59 HydrophobicContact CD2-CZ3 4.08Å; A34-W59 HydrophobicContact CB-CH2 3.78Å; A34-W59 HydrophobicContact CB-CZ3 4.1Å; V48-W59 PolarHBondContact O-NE1 3.45Å; A49-W59 WeakPolarHBondContact O-CZ2 3.35Å; L50-W59 HydrophobicContact CD1-CB 3.48Å; L50-W59 VanDerWaalsContact CD1-CB 3.48Å; L50-W59 HydrophobicContact CD1-CD2 4.5Å; L50-W59 HydrophobicContact CD1-CG 3.68Å; P51-W59 HydrophobicContact CG-CE3 4.45Å; P51-W59 HydrophobicContact CG-CH2 4.06Å; P51-W59 HydrophobicContact CG-CZ2 4.32Å; P51-W59 HydrophobicContact CG-CZ3 4.15Å; D55-W59 PolarHBondContact O-N 3.13Å; L56-W59 PolarHBondContact O-N 3.39Å; N57-W59 VanDerWaalsContact C-N 3.35Å; W59-V62 PolarHBondContact O-N 3.16Å; W59-H63 AromaticContact CD2-CE1 3.5Å; W59-H63 VanDerWaalsContact CD2-CE1 3.5Å; W59-H63 AromaticContact CD2-ND1 3.72Å; W59-H63 AromaticContact CE2-CE1 3.21Å; W59-H63 AromaticContact CE2-ND1 3.79Å; W59-H63 AromaticContact CE3-CE1 3.68Å; W59-H63 AromaticContact CH2-CE1 3.44Å; W59-H63 VanDerWaalsContact CH2-CE1 3.44Å; W59-H63 WeakPolarHBondContact CH2-CE1 3.26Å; W59-H63 AromaticContact CZ2-CE1 3.21Å; W59-H63 WeakPolarHBondContact CZ2-CE1 3.48Å; W59-H63 AromaticContact CZ2-NE2 3.82Å; W59-H63 AromaticContact CZ3-CE1 3.65Å; W59-H63 AromaticContact NE1-CE1 3.83Å; W59-H63 PolarHBondContact O-N 3.18Å; W59-H63 PolarHBondContact O-ND1 3.42Å; W59-F192 AromaticContact CD1-CE2 3.86Å; W59-F192 AromaticContact NE1-CE2 3.7Å; W59-F196 AromaticContact CD1-CE2 3.76Å; W59-F196 AromaticContact CD1-CZ 3.61Å; W59-F196 AromaticContact NE1-CE2 3.81Å; W59-F196 AromaticContact NE1-CZ 3.77Å
60	V	97.9	Very high	95.3	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-63.8	-41.2	175.6	171.5	0	0	0	0	111.6	L56 N57 V62 H63 V64 F147 M148 A151 F192 L198	L56-V60 HydrophobicContact CD1-CG2 4.06Å; L56-V60 HydrophobicContact CG-CG2 4.44Å; L56-V60 WeakPolarHBondContact O-CB 3.45Å; L56-V60 VanDerWaalsContact O-CG2 3.3Å; L56-V60 WeakPolarHBondContact O-CG2 3.36Å; L56-V60 PolarHBondContact O-N 3.46Å; N57-V60 PolarHBondContact O-N 3.04Å; V60-V62 VanDerWaalsContact C-N 3.34Å; V60-V62 PolarHBondContact O-N 2.92Å; V60-H63 PolarHBondContact O-N 3.15Å; V60-V64 HydrophobicContact CG1-CG2 4.04Å; V60-V64 WeakPolarHBondContact O-CB 3.42Å; V60-V64 VanDerWaalsContact O-CG2 3.26Å; V60-V64 WeakPolarHBondContact O-CG2 3.39Å; V60-V64 PolarHBondContact O-N 3.47Å; V60-F147 HydrophobicContact CB-CE1 4.14Å; V60-F147 HydrophobicContact CB-CZ 4.29Å; V60-F147 HydrophobicContact CG1-CE1 4.01Å; V60-F147 HydrophobicContact CG1-CZ 4Å; V60-M148 HydrophobicContact CB-CE 4.36Å; V60-M148 HydrophobicContact CG1-CE 4.36Å; V60-M148 HydrophobicContact CG1-SD 4.37Å; V60-M148 HydrophobicContact CG2-CE 4.1Å; V60-A151 HydrophobicContact CG1-CB 3.77Å; V60-F192 HydrophobicContact CB-CZ 4.48Å; V60-F192 HydrophobicContact CG2-CE1 4.41Å; V60-F192 HydrophobicContact CG2-CZ 4Å; V60-L198 HydrophobicContact CG1-CD1 4.35Å; V60-L198 HydrophobicContact CG2-CD1 4.2Å
61	A	96.1	Very high	95.4	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.008	18%	0.18	C	C	.	.	H	α-helix	trans	-61.6	-43.5	179	0	0	0	0	0	111.9	N57 D58 H63 V65 F135 F143 F147	N57-A61 VanDerWaalsContact O-CB 3.24Å; N57-A61 WeakPolarHBondContact O-CB 3.24Å; N57-A61 PolarHBondContact O-N 3.31Å; D58-A61 PolarHBondContact O-N 2.85Å; A61-H63 VanDerWaalsContact C-N 3.35Å; A61-H63 PolarHBondContact O-N 3.21Å; A61-V65 WeakPolarHBondContact O-CG2 3.48Å; A61-V65 PolarHBondContact O-N 3.2Å; A61-F135 HydrophobicContact CB-CD1 3.95Å; A61-F135 HydrophobicContact CB-CE1 4.12Å; A61-F143 HydrophobicContact CB-CE1 3.83Å; A61-F143 HydrophobicContact CB-CZ 3.69Å; A61-F147 HydrophobicContact CB-CE2 4.14Å; A61-F147 HydrophobicContact CB-CZ 3.82Å
62	V	94.3	Very high	95.3	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.006	18%	0.181	C	C	.	.	H	α-helix	trans	-60.2	-46.1	176.5	168.4	0	0	0	0	111	F21 R27 L30 H31 D58 W59 V60 V65 D66	F21-V62 HydrophobicContact CD1-CG2 4.48Å; F21-V62 HydrophobicContact CE1-CB 4.32Å; F21-V62 HydrophobicContact CE1-CG2 3.85Å; F21-V62 HydrophobicContact CE2-CG1 4.31Å; F21-V62 HydrophobicContact CZ-CB 4.11Å; F21-V62 HydrophobicContact CZ-CG1 3.95Å; F21-V62 HydrophobicContact CZ-CG2 4.11Å; R27-V62 HydrophobicContact CB-CG2 3.79Å; R27-V62 HydrophobicContact CG-CG2 4Å; L30-V62 HydrophobicContact CB-CG2 4Å; L30-V62 HydrophobicContact CD1-CG2 4.46Å; H31-V62 HydrophobicContact CB-CG1 3.8Å; D58-V62 WeakPolarHBondContact O-CG2 3.4Å; D58-V62 PolarHBondContact O-N 2.94Å; W59-V62 PolarHBondContact O-N 3.16Å; V60-V62 VanDerWaalsContact C-N 3.34Å; V60-V62 PolarHBondContact O-N 2.92Å; V62-V65 PolarHBondContact O-N 3.1Å; V62-D66 PolarHBondContact O-N 2.93Å
63	H	97.1	Very high	95.3	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.009	15%	0.149	C	C	.	.	H	α-helix	trans	-69.5	-40.7	-179	-77.2	76.3	0	0	0	113.1	W59 V60 A61 V65 D66 F67 H188 F192	W59-H63 AromaticContact CD2-CE1 3.5Å; W59-H63 VanDerWaalsContact CD2-CE1 3.5Å; W59-H63 AromaticContact CD2-ND1 3.72Å; W59-H63 AromaticContact CE2-CE1 3.21Å; W59-H63 AromaticContact CE2-ND1 3.79Å; W59-H63 AromaticContact CE3-CE1 3.68Å; W59-H63 AromaticContact CH2-CE1 3.44Å; W59-H63 VanDerWaalsContact CH2-CE1 3.44Å; W59-H63 WeakPolarHBondContact CH2-CE1 3.26Å; W59-H63 AromaticContact CZ2-CE1 3.21Å; W59-H63 WeakPolarHBondContact CZ2-CE1 3.48Å; W59-H63 AromaticContact CZ2-NE2 3.82Å; W59-H63 AromaticContact CZ3-CE1 3.65Å; W59-H63 AromaticContact NE1-CE1 3.83Å; W59-H63 PolarHBondContact O-N 3.18Å; W59-H63 PolarHBondContact O-ND1 3.42Å; V60-H63 PolarHBondContact O-N 3.15Å; A61-H63 VanDerWaalsContact C-N 3.35Å; A61-H63 PolarHBondContact O-N 3.21Å; H63-V65 VanDerWaalsContact C-N 3.28Å; H63-V65 PolarHBondContact O-N 2.83Å; H63-D66 PolarHBondContact O-N 3.45Å; H63-F67 HydrophobicContact CB-CD2 4.13Å; H63-F67 HydrophobicContact CB-CE2 3.87Å; H63-F67 WeakPolarHBondContact O-CB 3.2Å; H63-F67 WeakPolarHBondContact O-CD2 3.36Å; H63-F67 WeakPolarHBondContact O-CG 3.32Å; H63-F67 PolarHBondContact O-N 3.21Å; H63-H188 AromaticContact CD2-CE1 3.91Å; H63-H188 AromaticContact CD2-NE2 3.98Å; H63-H188 AromaticContact NE2-NE2 3.92Å; H63-F192 HydrophobicContact CB-CD1 4.07Å; H63-F192 HydrophobicContact CB-CD2 4.12Å; H63-F192 HydrophobicContact CB-CE1 3.55Å; H63-F192 HydrophobicContact CB-CE2 3.63Å; H63-F192 HydrophobicContact CB-CG 4.34Å; H63-F192 HydrophobicContact CB-CZ 3.35Å; H63-F192 AromaticContact CD2-CD2 3.37Å; H63-F192 WeakPolarHBondContact CD2-CD2 3.48Å; H63-F192 AromaticContact CD2-CE2 3.43Å; H63-F192 VanDerWaalsContact CD2-CE2 3.43Å; H63-F192 WeakPolarHBondContact CD2-CE2 3.21Å; H63-F192 AromaticContact CE1-CE2 3.86Å; H63-F192 AromaticContact CG-CD2 3.59Å; H63-F192 AromaticContact CG-CE2 3.15Å; H63-F192 AromaticContact CG-CZ 3.44Å; H63-F192 VanDerWaalsContact CG-CZ 3.44Å; H63-F192 AromaticContact ND1-CE2 3.43Å; H63-F192 WeakPolarHBondContact ND1-CE2 3.44Å; H63-F192 AromaticContact ND1-CZ 3.84Å; H63-F192 AromaticContact NE2-CD2 3.92Å; H63-F192 AromaticContact NE2-CE2 3.89Å
64	V	97.8	Very high	95.3	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-57.5	-43.9	176.5	168.2	0	0	0	0	110.9	V60 F68 I129 F135 A151 I154 L155	V60-V64 HydrophobicContact CG1-CG2 4.04Å; V60-V64 WeakPolarHBondContact O-CB 3.42Å; V60-V64 VanDerWaalsContact O-CG2 3.26Å; V60-V64 WeakPolarHBondContact O-CG2 3.39Å; V60-V64 PolarHBondContact O-N 3.47Å; V64-F68 WeakPolarHBondContact O-CB 3.35Å; V64-F68 PolarHBondContact O-N 3.35Å; V64-I129 HydrophobicContact CG1-CG2 4.17Å; V64-F135 HydrophobicContact CB-CE1 4.26Å; V64-F135 HydrophobicContact CB-CZ 4.45Å; V64-F135 HydrophobicContact CG1-CE1 4.08Å; V64-F135 HydrophobicContact CG1-CZ 3.87Å; V64-A151 HydrophobicContact CG2-CB 4.13Å; V64-I154 HydrophobicContact CG1-CB 4.39Å; V64-I154 HydrophobicContact CG1-CD1 4.14Å; V64-I154 HydrophobicContact CG1-CG2 3.76Å; V64-L155 HydrophobicContact CG2-CD1 4.01Å; V64-L155 HydrophobicContact CG2-CD2 4.13Å; V64-L155 HydrophobicContact CG2-CG 4.03Å
65	V	95	Very high	95.2	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.012	11%	0.113	C	C	.	.	H	α-helix	trans	-69.3	-42.3	178	174.5	0	0	0	0	111.5	F21 A61 V62 H63 F68 N69 I129	F21-V65 HydrophobicContact CE1-CB 4.49Å; F21-V65 HydrophobicContact CE2-CG1 4.4Å; F21-V65 HydrophobicContact CZ-CB 3.89Å; F21-V65 HydrophobicContact CZ-CG1 3.95Å; A61-V65 WeakPolarHBondContact O-CG2 3.48Å; A61-V65 PolarHBondContact O-N 3.2Å; V62-V65 PolarHBondContact O-N 3.1Å; H63-V65 VanDerWaalsContact C-N 3.28Å; H63-V65 PolarHBondContact O-N 2.83Å; V65-F68 PolarHBondContact O-N 2.9Å; V65-N69 PolarHBondContact O-N 3.03Å; V65-N69 PolarHBondContact O-ND2 3.34Å; V65-I129 HydrophobicContact CG2-CB 4.31Å; V65-I129 HydrophobicContact CG2-CG2 4.44Å
66	D	93.8	Very high	95.1	Very high	19 Å²	19	20.9 Å²	20.9	10%	0.102	11%	0.113	C	C	.	.	H	α-helix	trans	-60.1	-49.8	176	-173.8	62.1	0	0	0	111.7	H31 V62 H63 F68 N69 R70	H31-D66 IonicContact CE1-OD1 3.9Å; V62-D66 PolarHBondContact O-N 2.93Å; H63-D66 PolarHBondContact O-N 3.45Å; D66-F68 PolarHBondContact O-N 3.27Å; D66-N69 PolarHBondContact O-N 3Å; D66-R70 WeakPolarHBondContact O-CB 3.42Å; D66-R70 VanDerWaalsContact O-CG 3.31Å; D66-R70 WeakPolarHBondContact O-CG 3.34Å; D66-R70 PolarHBondContact O-N 3.02Å; D66-R70 WeakPolarHBondContact OD2-CD 3.35Å; D66-R70 IonicContact OD2-CZ 3.11Å; D66-R70 IonicContact OD2-NE 3.36Å; D66-R70 IonicContact OD2-NH1 2.91Å; D66-R70 PolarHBondContact OD2-NH1 3Å
67	F	97.6	Very high	94.8	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-62.3	-44.4	178.4	-71	-51	0	0	0	112.1	H63 N69 R70 I71 L155 L158 H188 F189 F192	H63-F67 HydrophobicContact CB-CD2 4.13Å; H63-F67 HydrophobicContact CB-CE2 3.87Å; H63-F67 WeakPolarHBondContact O-CB 3.2Å; H63-F67 WeakPolarHBondContact O-CD2 3.36Å; H63-F67 WeakPolarHBondContact O-CG 3.32Å; H63-F67 PolarHBondContact O-N 3.21Å; F67-N69 VanDerWaalsContact C-N 3.34Å; F67-N69 PolarHBondContact O-N 3.16Å; F67-R70 PolarHBondContact O-N 3.3Å; F67-I71 HydrophobicContact CB-CD1 4.14Å; F67-I71 VanDerWaalsContact O-CB 3.22Å; F67-I71 WeakPolarHBondContact O-CB 3.36Å; F67-I71 WeakPolarHBondContact O-CD1 3.29Å; F67-I71 WeakPolarHBondContact O-CG1 3.48Å; F67-I71 PolarHBondContact O-N 2.84Å; F67-L155 HydrophobicContact CD2-CD2 4.07Å; F67-L158 HydrophobicContact CB-CD1 4.35Å; F67-H188 HydrophobicContact CE1-CB 4.24Å; F67-H188 AromaticContact CE1-CE1 3.84Å; F67-H188 AromaticContact CE1-CG 3.84Å; F67-H188 AromaticContact CE1-ND1 3.25Å; F67-H188 VanDerWaalsContact CE1-ND1 3.25Å; F67-H188 WeakPolarHBondContact CE1-ND1 3.28Å; F67-H188 AromaticContact CZ-CE1 3.67Å; F67-H188 AromaticContact CZ-CG 3.94Å; F67-H188 AromaticContact CZ-ND1 3.5Å; F67-F189 HydrophobicContact CB-CD2 4.2Å; F67-F189 HydrophobicContact CD1-CB 3.99Å; F67-F189 AromaticContact CD1-CD2 3.91Å; F67-F189 HydrophobicContact CD1-CD2 3.91Å; F67-F189 HydrophobicContact CD1-CG 4.47Å; F67-F189 AromaticContact CD2-CD2 3.98Å; F67-F189 HydrophobicContact CD2-CD2 3.98Å; F67-F189 VanDerWaalsContact CE1-CA 3.41Å; F67-F189 HydrophobicContact CE1-CB 3.7Å; F67-F189 HydrophobicContact CE1-CD2 4.29Å; F67-F189 HydrophobicContact CE1-CG 4.49Å; F67-F189 HydrophobicContact CE2-CD2 4.36Å; F67-F189 AromaticContact CG-CD2 3.78Å; F67-F189 HydrophobicContact CG-CD2 3.78Å; F67-F189 VanDerWaalsContact CZ-CA 3.44Å; F67-F189 HydrophobicContact CZ-CB 4.15Å; F67-F192 HydrophobicContact CE2-CB 3.81Å; F67-F192 AromaticContact CE2-CD1 3.67Å; F67-F192 HydrophobicContact CE2-CD1 3.67Å; F67-F192 HydrophobicContact CE2-CE1 4.44Å; F67-F192 AromaticContact CE2-CG 3.73Å; F67-F192 HydrophobicContact CE2-CG 3.73Å; F67-F192 HydrophobicContact CZ-CB 3.83Å; F67-F192 HydrophobicContact CZ-CG 4.19Å
68	F	97.1	Very high	94.6	Very high	10 Å²	10	16 Å²	16	4%	0.044	9%	0.087	C	C	.	.	H	α-helix	trans	-54.8	-51	175.1	168.8	-106.7	0	0	0	111.3	V64 V65 D66 R70 I71 N72 M122 I125 E126 I129 L158	V64-F68 WeakPolarHBondContact O-CB 3.35Å; V64-F68 PolarHBondContact O-N 3.35Å; V65-F68 PolarHBondContact O-N 2.9Å; D66-F68 PolarHBondContact O-N 3.27Å; F68-R70 PolarHBondContact O-N 3.49Å; F68-I71 PolarHBondContact O-N 2.93Å; F68-N72 WeakPolarHBondContact O-CB 3.31Å; F68-N72 PolarHBondContact O-N 3.25Å; F68-M122 HydrophobicContact CD2-SD 4.28Å; F68-M122 HydrophobicContact CE2-CB 4.36Å; F68-M122 HydrophobicContact CE2-SD 3.87Å; F68-I125 HydrophobicContact CB-CG2 4.22Å; F68-I125 HydrophobicContact CD2-CB 3.87Å; F68-I125 HydrophobicContact CD2-CD1 4.29Å; F68-I125 HydrophobicContact CD2-CG2 3.36Å; F68-I125 HydrophobicContact CE2-CB 3.89Å; F68-I125 HydrophobicContact CE2-CG2 3.83Å; F68-I125 HydrophobicContact CG-CG2 3.83Å; F68-E126 HydrophobicContact CZ-CB 4.09Å; F68-I129 HydrophobicContact CD1-CD1 3.32Å; F68-I129 HydrophobicContact CE1-CD1 3.56Å; F68-I129 HydrophobicContact CG-CD1 4.03Å; F68-I129 HydrophobicContact CZ-CD1 4.42Å; F68-L158 HydrophobicContact CB-CD1 4.4Å; F68-L158 HydrophobicContact CD2-CD2 4.45Å
69	N	92.4	Very high	94.5	Very high	27 Å²	27	17.5 Å²	17.5	14%	0.144	10%	0.1	C	C	.	.	H	α-helix	trans	-61.6	-43.9	-178.6	-73.6	-41.1	0	0	0	112.3	V65 D66 F67 L73	V65-N69 PolarHBondContact O-N 3.03Å; V65-N69 PolarHBondContact O-ND2 3.34Å; D66-N69 PolarHBondContact O-N 3Å; F67-N69 VanDerWaalsContact C-N 3.34Å; F67-N69 PolarHBondContact O-N 3.16Å; N69-L73 WeakPolarHBondContact O-CB 3.32Å; N69-L73 PolarHBondContact O-N 2.94Å; N69-L73 VanDerWaalsContact O-N 3.11Å
70	R	95.1	Very high	94.2	Very high	59 Å²	59	22.3 Å²	22.3	22%	0.223	13%	0.126	C	C	.	.	H	α-helix	trans	-70.7	-42.2	-178.7	-68.9	166.9	64.3	177.9	4.6	112.3	D66 F67 F68 L73 I74 C185 H188	D66-R70 WeakPolarHBondContact O-CB 3.42Å; D66-R70 VanDerWaalsContact O-CG 3.31Å; D66-R70 WeakPolarHBondContact O-CG 3.34Å; D66-R70 PolarHBondContact O-N 3.02Å; D66-R70 WeakPolarHBondContact OD2-CD 3.35Å; D66-R70 IonicContact OD2-CZ 3.11Å; D66-R70 IonicContact OD2-NE 3.36Å; D66-R70 IonicContact OD2-NH1 2.91Å; D66-R70 PolarHBondContact OD2-NH1 3Å; F67-R70 PolarHBondContact O-N 3.3Å; F68-R70 PolarHBondContact O-N 3.49Å; R70-L73 WeakPolarHBondContact O-CB 3.38Å; R70-L73 PolarHBondContact O-N 2.79Å; R70-I74 WeakPolarHBondContact O-CG1 3.32Å; R70-I74 PolarHBondContact O-N 2.92Å; R70-C185 PolarHBondContact NE-SG 3.43Å; R70-H188 PolarHBondContact NH1-ND1 2.87Å
71	I	96.3	Very high	93.9	Very high	1 Å²	1	24 Å²	24	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-69.9	-38.7	178.9	-65.9	167.8	0	0	0	110.6	F67 F68 L73 I74 Y75 M122 L158 V161 F162 F189	F67-I71 HydrophobicContact CB-CD1 4.14Å; F67-I71 VanDerWaalsContact O-CB 3.22Å; F67-I71 WeakPolarHBondContact O-CB 3.36Å; F67-I71 WeakPolarHBondContact O-CD1 3.29Å; F67-I71 WeakPolarHBondContact O-CG1 3.48Å; F67-I71 PolarHBondContact O-N 2.84Å; F68-I71 PolarHBondContact O-N 2.93Å; I71-L73 VanDerWaalsContact C-N 3.29Å; I71-L73 PolarHBondContact O-N 3.47Å; I71-I74 PolarHBondContact O-N 2.95Å; I71-Y75 PolarHBondContact O-N 3.01Å; I71-M122 HydrophobicContact CG2-CE 4.35Å; I71-L158 HydrophobicContact CB-CD2 4.2Å; I71-L158 HydrophobicContact CD1-CB 3.84Å; I71-L158 HydrophobicContact CD1-CD1 4.21Å; I71-L158 HydrophobicContact CD1-CD2 4.06Å; I71-L158 HydrophobicContact CD1-CG 4.26Å; I71-L158 HydrophobicContact CG2-CD2 4.01Å; I71-V161 HydrophobicContact CG2-CB 3.62Å; I71-V161 HydrophobicContact CG2-CG1 3.6Å; I71-V161 HydrophobicContact CG2-CG2 4.01Å; I71-F162 HydrophobicContact CD1-CD2 4.18Å; I71-F162 HydrophobicContact CD1-CE2 3.39Å; I71-F162 HydrophobicContact CD1-CZ 3.82Å; I71-F162 HydrophobicContact CG1-CE1 4.4Å; I71-F162 HydrophobicContact CG1-CE2 3.74Å; I71-F162 HydrophobicContact CG1-CZ 3.62Å; I71-F189 HydrophobicContact CD1-CD2 4.11Å; I71-F189 HydrophobicContact CD1-CE2 4.33Å
72	N	93	Very high	94	Very high	52 Å²	52	24.2 Å²	24.2	28%	0.278	14%	0.139	S	C	.	.	H	α-helix	trans	-60.8	-40.7	173.6	-169.7	33.8	0	0	0	111.3	F68 Y75 G76 M122	F68-N72 WeakPolarHBondContact O-CB 3.31Å; F68-N72 PolarHBondContact O-N 3.25Å; N72-Y75 PolarHBondContact O-N 3.2Å; N72-G76 PolarHBondContact O-N 3.45Å; N72-M122 HydrophobicContact CB-CE 4.4Å; N72-M122 HydrophobicContact CB-SD 4.17Å
73	L	91.6	Very high	94.1	Very high	44 Å²	44	26.2 Å²	26.2	23%	0.23	15%	0.151	C	C	.	.	H	α-helix	trans	-64.2	-43.2	174.1	-177.4	62	0	0	0	112.3	F9 N69 R70 I71 Y75 G76 T77	F9-L73 HydrophobicContact CD1-CD1 4.09Å; F9-L73 HydrophobicContact CD1-CD2 3.85Å; F9-L73 HydrophobicContact CD1-CG 4.25Å; F9-L73 HydrophobicContact CE1-CD1 4.19Å; F9-L73 HydrophobicContact CE1-CD2 3.63Å; F9-L73 HydrophobicContact CE1-CG 3.92Å; N69-L73 WeakPolarHBondContact O-CB 3.32Å; N69-L73 PolarHBondContact O-N 2.94Å; N69-L73 VanDerWaalsContact O-N 3.11Å; R70-L73 WeakPolarHBondContact O-CB 3.38Å; R70-L73 PolarHBondContact O-N 2.79Å; I71-L73 VanDerWaalsContact C-N 3.29Å; I71-L73 PolarHBondContact O-N 3.47Å; L73-Y75 PolarHBondContact O-N 3.13Å; L73-G76 PolarHBondContact O-N 3.23Å; L73-T77 WeakPolarHBondContact O-CG2 3.43Å; L73-T77 PolarHBondContact O-N 3.35Å
74	I	92.5	Very high	94.1	Very high	18 Å²	18	30.2 Å²	30.2	9%	0.092	17%	0.173	C	C	.	.	H	α-helix	trans	-57.7	-49.8	175.6	-70.9	166.1	0	0	0	110.2	R70 I71 G76 T77 F162 V165 V182 C185	R70-I74 WeakPolarHBondContact O-CG1 3.32Å; R70-I74 PolarHBondContact O-N 2.92Å; I71-I74 PolarHBondContact O-N 2.95Å; I74-G76 VanDerWaalsContact C-N 3.31Å; I74-G76 PolarHBondContact O-N 2.8Å; I74-T77 WeakPolarHBondContact O-CB 3.43Å; I74-T77 PolarHBondContact O-N 3.44Å; I74-T77 VanDerWaalsContact O-N 3.11Å; I74-T77 PolarHBondContact O-OG1 3.45Å; I74-F162 HydrophobicContact CD1-CE1 4.15Å; I74-V165 HydrophobicContact CG2-CG1 4.23Å; I74-V165 HydrophobicContact CG2-CG2 4.33Å; I74-V182 HydrophobicContact CD1-CG1 4.48Å; I74-V182 HydrophobicContact CD1-CG2 4.3Å; I74-V182 HydrophobicContact CG1-CG2 4.17Å; I74-V182 HydrophobicContact CG2-CG1 4.35Å; I74-V182 HydrophobicContact CG2-CG2 3.87Å; I74-C185 HydrophobicContact CD1-CB 3.8Å
75	Y	93.6	Very high	94	Very high	24 Å²	24	37.7 Å²	37.7	9%	0.094	21%	0.208	C	C	.	.	H	α-helix	trans	-61.5	-40	177.8	-179.9	-104.4	0	0	0	112.1	I71 N72 L73 T77 I78 S79 C82 P115 M118 V161	I71-Y75 PolarHBondContact O-N 3.01Å; N72-Y75 PolarHBondContact O-N 3.2Å; L73-Y75 PolarHBondContact O-N 3.13Å; Y75-T77 PolarHBondContact O-N 3.1Å; Y75-T77 VanDerWaalsContact O-N 3.1Å; Y75-I78 HydrophobicContact CD2-CD1 3.51Å; Y75-I78 HydrophobicContact CD2-CG1 4.37Å; Y75-I78 HydrophobicContact CE2-CD1 3.5Å; Y75-I78 HydrophobicContact CG-CD1 4.45Å; Y75-I78 WeakPolarHBondContact O-CG1 3.25Å; Y75-I78 PolarHBondContact O-N 2.87Å; Y75-S79 PolarHBondContact O-N 3.09Å; Y75-C82 HydrophobicContact CE2-CB 4.44Å; Y75-P115 WeakPolarHBondContact OH-CA 3.4Å; Y75-M118 HydrophobicContact CD1-CB 4.33Å; Y75-M118 HydrophobicContact CD2-CB 4.36Å; Y75-M118 HydrophobicContact CD2-CE 4.31Å; Y75-M118 HydrophobicContact CD2-CG 4.02Å; Y75-M118 HydrophobicContact CD2-SD 4.31Å; Y75-M118 HydrophobicContact CE1-CB 3.72Å; Y75-M118 HydrophobicContact CE1-CG 4.33Å; Y75-M118 HydrophobicContact CE2-CB 3.77Å; Y75-M118 HydrophobicContact CE2-CE 4.24Å; Y75-M118 HydrophobicContact CE2-CG 3.43Å; Y75-M118 VanDerWaalsContact CE2-CG 3.43Å; Y75-M118 HydrophobicContact CE2-SD 4.28Å; Y75-M118 VanDerWaalsContact CZ-CB 3.4Å; Y75-V161 HydrophobicContact CD2-CG1 4.48Å
76	G	92.1	Very high	94.1	Very high	37 Å²	37	41.6 Å²	41.6	38%	0.381	23%	0.232	S	C	.	.	H	α-helix	trans	-54.2	-30.9	175.3	0	0	0	0	0	113.4	N72 L73 I74 I78 S79	N72-G76 PolarHBondContact O-N 3.45Å; L73-G76 PolarHBondContact O-N 3.23Å; I74-G76 VanDerWaalsContact C-N 3.31Å; I74-G76 PolarHBondContact O-N 2.8Å; G76-I78 VanDerWaalsContact C-N 3.31Å; G76-I78 PolarHBondContact O-N 3.3Å; G76-S79 PolarHBondContact O-OG 2.68Å
77	T	89.1	Confident	94.3	Very high	11 Å²	11	41 Å²	41	7%	0.067	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-21.7	179.9	77.2	0	0	0	0	114.3	V8 L73 I74 Y75	V8-T77 HydrophobicContact CG1-CG2 3.47Å; V8-T77 VanDerWaalsContact CG1-CG2 3.47Å; L73-T77 WeakPolarHBondContact O-CG2 3.43Å; L73-T77 PolarHBondContact O-N 3.35Å; I74-T77 WeakPolarHBondContact O-CB 3.43Å; I74-T77 PolarHBondContact O-N 3.44Å; I74-T77 VanDerWaalsContact O-N 3.11Å; I74-T77 PolarHBondContact O-OG1 3.45Å; Y75-T77 PolarHBondContact O-N 3.1Å; Y75-T77 VanDerWaalsContact O-N 3.1Å
78	I	92.4	Very high	94.3	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	-5.5	-178.6	62.5	75.5	0	0	0	113.4	Y75 G76 D80 S81 C82 V165 H169 R172 V173	Y75-I78 HydrophobicContact CD2-CD1 3.51Å; Y75-I78 HydrophobicContact CD2-CG1 4.37Å; Y75-I78 HydrophobicContact CE2-CD1 3.5Å; Y75-I78 HydrophobicContact CG-CD1 4.45Å; Y75-I78 WeakPolarHBondContact O-CG1 3.25Å; Y75-I78 PolarHBondContact O-N 2.87Å; G76-I78 VanDerWaalsContact C-N 3.31Å; G76-I78 PolarHBondContact O-N 3.3Å; I78-D80 PolarHBondContact O-N 2.9Å; I78-D80 VanDerWaalsContact O-N 3.14Å; I78-S81 PolarHBondContact O-N 2.81Å; I78-S81 PolarHBondContact O-OG 3.45Å; I78-C82 HydrophobicContact CD1-CB 3.96Å; I78-C82 PolarHBondContact O-N 2.94Å; I78-C82 VanDerWaalsContact O-N 3.1Å; I78-V165 HydrophobicContact CG1-CG2 4.34Å; I78-H169 HydrophobicContact CB-CB 4.12Å; I78-H169 HydrophobicContact CG1-CB 4.19Å; I78-H169 HydrophobicContact CG2-CB 4.11Å; I78-R172 HydrophobicContact CG2-CB 4.36Å; I78-R172 HydrophobicContact CG2-CG 4.02Å; I78-V173 HydrophobicContact CG2-CG2 3.92Å
79	S	92.7	Very high	94.3	Very high	56 Å²	56	47 Å²	47	39%	0.392	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-23.8	-173.2	64	0	0	0	0	114.7	Y75 G76 S81	Y75-S79 PolarHBondContact O-N 3.09Å; G76-S79 PolarHBondContact O-OG 2.68Å; S79-S81 VanDerWaalsContact C-N 3.31Å
80	D	90.3	Very high	94.6	Very high	105 Å²	105	45.8 Å²	45.8	56%	0.561	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-24.6	174.1	63.2	-23.6	0	0	0	113.2	I78 R172	I78-D80 PolarHBondContact O-N 2.9Å; I78-D80 VanDerWaalsContact O-N 3.14Å; D80-R172 IonicContact OD2-NH2 2.76Å; D80-R172 PolarHBondContact OD2-NH2 3.47Å
81	S	92.8	Very high	94.6	Very high	36 Å²	36	43.9 Å²	43.9	25%	0.252	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-13.2	-178.5	68.3	0	0	0	0	114.2	I78 S79 T83 T86	I78-S81 PolarHBondContact O-N 2.81Å; I78-S81 PolarHBondContact O-OG 3.45Å; S79-S81 VanDerWaalsContact C-N 3.31Å; S81-T83 PolarHBondContact O-N 2.95Å; S81-T86 PolarHBondContact O-OG1 3.03Å
82	C	96.7	Very high	94.3	Very high	4 Å²	4	44 Å²	44	3%	0.027	26%	0.259	C	S	.	.			trans	-87.2	98.3	172	-169.5	0	0	0	0	109.2	Y75 I78 P115 H164	Y75-C82 HydrophobicContact CE2-CB 4.44Å; I78-C82 HydrophobicContact CD1-CB 3.96Å; I78-C82 PolarHBondContact O-N 2.94Å; I78-C82 VanDerWaalsContact O-N 3.1Å; C82-P115 WeakPolarHBondContact O-CB 3.37Å; C82-H164 PolarHBondContact SG-NE2 3.01Å; C82-H164 VanDerWaalsContact SG-NE2 3.35Å
83	T	96.8	Very high	94.1	Very high	43 Å²	43	42.1 Å²	42.1	26%	0.264	25%	0.252	S	S	.	.			trans	-123.5	168.3	-176.3	76.3	0	0	0	0	111	S81 Q85 T86 C87	S81-T83 PolarHBondContact O-N 2.95Å; T83-Q85 PolarHBondContact O-N 3.3Å; T83-Q85 PolarHBondContact OG1-N 3.12Å; T83-Q85 PolarHBondContact OG1-OE1 3.49Å; T83-Q85 VanDerWaalsContact OG1-OE1 3.07Å; T83-T86 PolarHBondContact N-OG1 3.34Å; T83-T86 PolarHBondContact O-N 3.21Å; T83-T86 PolarHBondContact O-OG1 2.82Å; T83-T86 PolarHBondContact OG1-N 3.16Å; T83-T86 PolarHBondContact OG1-OG1 3.22Å; T83-C87 CarbonylContact O-C 3.48Å; T83-C87 WeakPolarHBondContact O-CA 3.4Å; T83-C87 PolarHBondContact O-N 2.88Å
84	D	97.1	Very high	93.9	Very high	86 Å²	86	47.2 Å²	47.2	46%	0.46	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-22.3	175	-70.9	12.5	0	0	0	112.2	P88 P113 P115	D84-P88 VanDerWaalsContact O-CA 3.26Å; D84-P88 WeakPolarHBondContact O-CA 3.22Å; D84-P88 WeakPolarHBondContact O-CB 3.46Å; D84-P113 HydrophobicContact CB-CB 4.36Å; D84-P113 HydrophobicContact CB-CG 4.44Å; D84-P113 WeakPolarHBondContact OD1-CB 3.29Å; D84-P115 VanDerWaalsContact OD1-CG 3.23Å; D84-P115 WeakPolarHBondContact OD1-CG 3.4Å
85	Q	97	Very high	93.8	Very high	158 Å²	158	53.8 Å²	53.8	74%	0.738	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-43.8	176.5	-63	75.2	30.3	0	0	112.1	T83	T83-Q85 PolarHBondContact O-N 3.3Å; T83-Q85 PolarHBondContact OG1-N 3.12Å; T83-Q85 PolarHBondContact OG1-OE1 3.49Å; T83-Q85 VanDerWaalsContact OG1-OE1 3.07Å
86	T	96.7	Very high	93.8	Very high	84 Å²	84	55.3 Å²	55.3	52%	0.515	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-31.6	-179.4	57.4	0	0	0	0	111.9	S81 T83	S81-T86 PolarHBondContact O-OG1 3.03Å; T83-T86 PolarHBondContact N-OG1 3.34Å; T83-T86 PolarHBondContact O-N 3.21Å; T83-T86 PolarHBondContact O-OG1 2.82Å; T83-T86 PolarHBondContact OG1-N 3.16Å; T83-T86 PolarHBondContact OG1-OG1 3.22Å
87	C	97.8	Very high	94	Very high	6 Å²	6	58 Å²	58	4%	0.041	32%	0.324	C	S	.	.			trans	-136	66.3	-176.5	-56	0	0	0	0	111.6	T83 V89 A114 H169	T83-C87 CarbonylContact O-C 3.48Å; T83-C87 WeakPolarHBondContact O-CA 3.4Å; T83-C87 PolarHBondContact O-N 2.88Å; C87-V89 PolarHBondContact O-N 3.14Å; C87-V89 VanDerWaalsContact O-N 3.08Å; C87-A114 HydrophobicContact CB-CB 3.48Å; C87-A114 VanDerWaalsContact CB-CB 3.48Å; C87-A114 PolarHBondContact O-N 2.93Å; C87-H169 PolarHBondContact SG-NE2 2.89Å; C87-H169 VanDerWaalsContact SG-NE2 3.43Å
88	P	97.7	Very high	94.4	Very high	78 Å²	78	58.3 Å²	58.3	51%	0.506	32%	0.324	S	S	.	.	S	Bend	trans	-64.9	-14.9	-178.1	27	-36.1	0	0	0	113.7	D84 P113	D84-P88 VanDerWaalsContact O-CA 3.26Å; D84-P88 WeakPolarHBondContact O-CA 3.22Å; D84-P88 WeakPolarHBondContact O-CB 3.46Å; P88-P113 WeakPolarHBondContact O-CA 3.46Å
89	V	96.8	Very high	94.6	Very high	59 Å²	59	64.3 Å²	64.3	36%	0.358	35%	0.347	S	S	.	.	S	Bend	trans	-134.4	135.4	178.7	-179	0	0	0	0	108.8	C87 S91 E97	C87-V89 PolarHBondContact O-N 3.14Å; C87-V89 VanDerWaalsContact O-N 3.08Å; V89-S91 PolarHBondContact O-N 2.99Å; V89-E97 HydrophobicContact CG1-CG 3.63Å
90	M	97.9	Very high	94.9	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.328	C	S	.	.			trans	-71.9	107.8	168.5	-177.9	64.3	-173.2	0	0	110.1	Y98 V112 A114 Y117 M118 R160 H164	M90-Y98 HydrophobicContact CE-CD2 4.07Å; M90-Y98 HydrophobicContact CG-CD2 4.04Å; M90-Y98 HydrophobicContact CG-CG 4.4Å; M90-Y98 PolarHBondContact O-N 3.46Å; M90-V112 PolarHBondContact N-O 3.25Å; M90-A114 HydrophobicContact CB-CB 4.35Å; M90-A114 HydrophobicContact SD-CB 3.89Å; M90-Y117 HydrophobicContact CB-CD1 4.5Å; M90-Y117 HydrophobicContact CB-CD2 3.91Å; M90-Y117 HydrophobicContact CB-CG 3.82Å; M90-Y117 HydrophobicContact CE-CD1 3.99Å; M90-Y117 HydrophobicContact CE-CE1 4.12Å; M90-Y117 HydrophobicContact CG-CD1 3.68Å; M90-Y117 HydrophobicContact CG-CD2 3.77Å; M90-Y117 HydrophobicContact CG-CE1 4.16Å; M90-Y117 HydrophobicContact CG-CE2 4.23Å; M90-Y117 HydrophobicContact CG-CG 3.48Å; M90-Y117 VanDerWaalsContact CG-CG 3.48Å; M90-Y117 HydrophobicContact SD-CD1 3.95Å; M90-Y117 HydrophobicContact SD-CG 4.17Å; M90-M118 HydrophobicContact CE-CE 3.45Å; M90-M118 VanDerWaalsContact CE-CE 3.45Å; M90-M118 HydrophobicContact CE-SD 4.13Å; M90-M118 HydrophobicContact SD-CE 3.7Å; M90-M118 HydrophobicContact SD-SD 4.4Å; M90-R160 HydrophobicContact CE-CB 4.08Å; M90-R160 WeakPolarHBondContact CE-O 3.31Å; M90-H164 HydrophobicContact CE-CB 3.78Å; M90-H164 HydrophobicContact SD-CB 4.29Å
91	S	95.9	Very high	95.1	Very high	19 Å²	19	61.1 Å²	61.1	13%	0.133	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-139.3	157.9	-175.8	70	0	0	0	0	113.6	V89 Y96 H168	V89-S91 PolarHBondContact O-N 2.99Å; S91-Y96 CarbonylContact C-O 3.24Å; S91-Y96 WeakPolarHBondContact CA-O 3.37Å; S91-Y96 WeakPolarHBondContact CB-O 3.3Å; S91-H168 PolarHBondContact O-CD2 2.87Å; S91-H168 PolarHBondContact O-NE2 2.94Å; S91-H168 VanDerWaalsContact O-NE2 3.11Å; S91-H168 PolarHBondContact OG-CE1 3.42Å; S91-H168 PolarHBondContact OG-NE2 3.36Å
92	G	90.4	Very high	95	Very high	4 Å²	4	61 Å²	61	4%	0.041	32%	0.318	C	S	.	.	S	Bend	trans	-104.8	64.3	163.7	0	0	0	0	0	110.8	Y96 I167	G92-Y96 PolarHBondContact N-O 2.91Å; G92-Y96 WeakPolarHBondContact O-CD2 3.39Å; G92-I167 WeakPolarHBondContact O-CD1 3.38Å
93	G	87.5	Confident	94.6	Very high	13 Å²	13	68.8 Å²	68.8	13%	0.134	35%	0.354	C	S	.	.	S	Bend	trans	74.8	-164.2	-172.6	0	0	0	0	0	112.4	K95	G93-K95 PolarHBondContact O-N 2.84Å
94	P	87.5	Confident	94.2	Very high	150 Å²	150	74.4 Å²	74.4	97%	0.974	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-17.8	-172.6	27.8	-34.8	0	0	0	113.8
95	K	90.8	Very high	94	Very high	156 Å²	156	77.9 Å²	77.9	68%	0.678	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-26.7	-172.4	-173.1	175.9	176.3	-170.4	0	113.9	G93	G93-K95 PolarHBondContact O-N 2.84Å
96	Y	93.8	Very high	93.8	Very high	56 Å²	56	72 Å²	72	22%	0.22	36%	0.36	C	S	.	.			trans	-124.9	117.5	-170.6	-56.7	-76.6	0	0	0	110.7	S91 G92 E205 P206	S91-Y96 CarbonylContact C-O 3.24Å; S91-Y96 WeakPolarHBondContact CA-O 3.37Å; S91-Y96 WeakPolarHBondContact CB-O 3.3Å; G92-Y96 PolarHBondContact N-O 2.91Å; G92-Y96 WeakPolarHBondContact O-CD2 3.39Å; Y96-E205 WeakPolarHBondContact OH-CG 3.33Å; Y96-P206 HydrophobicContact CD1-CG 4.08Å; Y96-P206 HydrophobicContact CD2-CB 3.76Å; Y96-P206 HydrophobicContact CD2-CG 3.74Å; Y96-P206 HydrophobicContact CE1-CG 4.1Å; Y96-P206 HydrophobicContact CE2-CB 3.77Å; Y96-P206 HydrophobicContact CE2-CG 3.75Å; Y96-P206 HydrophobicContact CG-CB 4.37Å; Y96-P206 HydrophobicContact CG-CG 3.91Å
97	E	96.8	Very high	93.7	Very high	93 Å²	93	75.4 Å²	75.4	44%	0.435	37%	0.367	S	S	.	.	B	Isolated β-bridge	trans	-110.1	129.7	172	-174.4	-174.6	131.4	0	0	109.8	V89 R99	V89-E97 HydrophobicContact CG1-CG 3.63Å; E97-R99 IonicContact OE1-CZ 3.13Å; E97-R99 IonicContact OE1-NE 2.76Å; E97-R99 PolarHBondContact OE1-NE 3.43Å; E97-R99 IonicContact OE1-NH2 2.77Å; E97-R99 PolarHBondContact OE1-NH2 3.22Å; E97-R99 IonicContact OE2-NH2 3.77Å
98	Y	97.3	Very high	93.6	Very high	19 Å²	19	83 Å²	83	8%	0.075	40%	0.4	C	S	.	.			trans	-104.9	117.8	178.3	-55.1	-70.4	0	0	0	110.7	M90 R160 V163	M90-Y98 HydrophobicContact CE-CD2 4.07Å; M90-Y98 HydrophobicContact CG-CD2 4.04Å; M90-Y98 HydrophobicContact CG-CG 4.4Å; M90-Y98 PolarHBondContact O-N 3.46Å; Y98-R160 HydrophobicContact CD1-CG 3.93Å; Y98-R160 HydrophobicContact CD2-CB 4.45Å; Y98-R160 HydrophobicContact CE1-CG 3.73Å; Y98-R160 HydrophobicContact CE2-CB 4.32Å; Y98-R160 HydrophobicContact CE2-CG 4.38Å; Y98-R160 HydrophobicContact CG-CG 4.33Å; Y98-V163 HydrophobicContact CE2-CG1 4.31Å
99	R	97.4	Very high	93.6	Very high	126 Å²	126	82.9 Å²	82.9	48%	0.475	40%	0.399	S	S	.	.			trans	-99.1	140	177	-64.4	-176.1	175.6	-136.8	-6.1	110.7	E97 P109 T110	E97-R99 IonicContact OE1-CZ 3.13Å; E97-R99 IonicContact OE1-NE 2.76Å; E97-R99 PolarHBondContact OE1-NE 3.43Å; E97-R99 IonicContact OE1-NH2 2.77Å; E97-R99 PolarHBondContact OE1-NH2 3.22Å; E97-R99 IonicContact OE2-NH2 3.77Å; R99-P109 HydrophobicContact CB-CB 3.93Å; R99-T110 WeakPolarHBondContact CA-O 3.35Å
100	W	97.5	Very high	93.6	Very high	3 Å²	3	82.4 Å²	82.4	1%	0.011	40%	0.396	C	S	.	.	B	Isolated β-bridge	trans	-84.2	141.4	177.8	-174.4	-101.4	0	0	0	110.8	D102 Y106 T110 V112 Y117 L120 L121 W124 R157	W100-D102 PolarHBondContact NE1-OD2 3.1Å; W100-Y106 AromaticContact CD1-CD2 3.45Å; W100-Y106 VanDerWaalsContact CD1-CD2 3.45Å; W100-Y106 AromaticContact CD1-CG 3.65Å; W100-Y106 AromaticContact NE1-CD2 3.85Å; W100-T110 PolarHBondContact N-O 3.08Å; W100-T110 PolarHBondContact O-N 2.93Å; W100-V112 HydrophobicContact CB-CG2 3.98Å; W100-Y117 HydrophobicContact CB-CD2 4.03Å; W100-Y117 HydrophobicContact CB-CE2 4.2Å; W100-Y117 HydrophobicContact CE3-CD2 4.15Å; W100-Y117 HydrophobicContact CE3-CE1 4.41Å; W100-Y117 AromaticContact CE3-CE2 3.85Å; W100-Y117 HydrophobicContact CE3-CE2 3.85Å; W100-Y117 AromaticContact CE3-CZ 3.98Å; W100-L120 HydrophobicContact CD2-CB 3.98Å; W100-L120 HydrophobicContact CD2-CD1 4.25Å; W100-L120 HydrophobicContact CE3-CB 4.32Å; W100-L120 HydrophobicContact CG-CD1 3.92Å; W100-L120 HydrophobicContact CH2-CB 4.18Å; W100-L120 WeakPolarHBondContact CH2-O 3.35Å; W100-L120 HydrophobicContact CZ2-CB 3.83Å; W100-L120 HydrophobicContact CZ3-CB 4.42Å; W100-L121 HydrophobicContact CH2-CB 4.39Å; W100-L121 HydrophobicContact CZ3-CB 3.93Å; W100-L121 HydrophobicContact CZ3-CD1 4.14Å; W100-W124 HydrophobicContact CH2-CB 3.84Å; W100-W124 HydrophobicContact CH2-CG 4.21Å; W100-W124 HydrophobicContact CZ2-CB 4.12Å; W100-W124 HydrophobicContact CZ2-CG 4.47Å; W100-R157 VanDerWaalsContact CH2-NH1 3.27Å
101	Q	94.3	Very high	93.6	Very high	91 Å²	91	84.9 Å²	84.9	43%	0.425	42%	0.417	S	S	.	.			trans	-147.1	134.9	171.6	-170.8	-175.4	-2.1	0	0	109.5	Y106 K107 R157	Q101-Y106 WeakPolarHBondContact CA-O 3.31Å; Q101-Y106 VanDerWaalsContact CG-O 3.32Å; Q101-Y106 WeakPolarHBondContact CG-O 3.47Å; Q101-K107 PolarHBondContact NE2-O 3.11Å; Q101-K107 VanDerWaalsContact NE2-O 3.14Å; Q101-R157 PolarHBondContact O-NH2 3.41Å; Q101-R157 VanDerWaalsContact O-NH2 3.12Å
102	D	91.4	Very high	93.7	Very high	32 Å²	32	84.6 Å²	84.6	17%	0.171	41%	0.414	C	S	.	.			trans	-141	175.4	171.5	62.4	50	0	0	0	111.1	W100 H104 K105 Y106 K107	W100-D102 PolarHBondContact NE1-OD2 3.1Å; D102-H104 VanDerWaalsContact C-N 3.3Å; D102-H104 WeakPolarHBondContact OD1-CA 3.19Å; D102-H104 PolarHBondContact OD1-N 2.99Å; D102-K105 PolarHBondContact OD1-N 3.02Å; D102-Y106 PolarHBondContact N-O 3.49Å; D102-Y106 CarbonylContact O-C 3.4Å; D102-Y106 PolarHBondContact OD1-N 3.23Å; D102-Y106 WeakPolarHBondContact OD2-CD2 3.48Å; D102-K107 WeakPolarHBondContact O-CA 3.28Å
103	E	88.6	Confident	94	Very high	168 Å²	168	86 Å²	86	79%	0.785	42%	0.422	S	S	*	.	S	Bend	trans	-85.8	-4	-177.4	-63.4	-178.6	-178.4	0	0	112.9
104	H	88.8	Confident	94.6	Very high	161 Å²	161	85.4 Å²	85.4	75%	0.745	42%	0.416	S	S	*	.	S	Bend	trans	-108	-82.7	-172.3	-56.9	-62.4	0	0	0	111.3	D102	D102-H104 VanDerWaalsContact C-N 3.3Å; D102-H104 WeakPolarHBondContact OD1-CA 3.19Å; D102-H104 PolarHBondContact OD1-N 2.99Å
105	K	92.1	Very high	95	Very high	160 Å²	160	79.3 Å²	79.3	70%	0.696	38%	0.377	S	S	*	.	S	Bend	trans	-89.6	-38.5	-171.3	-176.1	176.1	179.1	-179.5	0	111.7	D102	D102-K105 PolarHBondContact OD1-N 3.02Å
106	Y	93.6	Very high	95.3	Very high	34 Å²	34	75.8 Å²	75.8	13%	0.133	36%	0.361	C	S	.	.			trans	-110.3	67.7	-173.7	-62.4	-85.8	0	0	0	110.7	W100 Q101 D102 K108 T110 V112 L120	W100-Y106 AromaticContact CD1-CD2 3.45Å; W100-Y106 VanDerWaalsContact CD1-CD2 3.45Å; W100-Y106 AromaticContact CD1-CG 3.65Å; W100-Y106 AromaticContact NE1-CD2 3.85Å; Q101-Y106 WeakPolarHBondContact CA-O 3.31Å; Q101-Y106 VanDerWaalsContact CG-O 3.32Å; Q101-Y106 WeakPolarHBondContact CG-O 3.47Å; D102-Y106 PolarHBondContact N-O 3.49Å; D102-Y106 CarbonylContact O-C 3.4Å; D102-Y106 PolarHBondContact OD1-N 3.23Å; D102-Y106 WeakPolarHBondContact OD2-CD2 3.48Å; Y106-K108 PolarHBondContact O-N 2.69Å; Y106-K108 VanDerWaalsContact O-N 3.17Å; Y106-T110 HydrophobicContact CD1-CG2 3.84Å; Y106-T110 HydrophobicContact CE1-CG2 4.07Å; Y106-V112 HydrophobicContact CE1-CG1 3.78Å; Y106-L120 HydrophobicContact CD2-CD1 4.38Å; Y106-L120 HydrophobicContact CE2-CD1 3.74Å; Y106-L120 HydrophobicContact CE2-CD2 4.26Å
107	K	93.9	Very high	95.5	Very high	156 Å²	156	73.1 Å²	73.1	68%	0.678	35%	0.351	S	S	*	.			trans	-63.4	-21.8	-175.2	-62.3	-174.2	178.7	-177	0	114.4	Q101 D102	Q101-K107 PolarHBondContact NE2-O 3.11Å; Q101-K107 VanDerWaalsContact NE2-O 3.14Å; D102-K107 WeakPolarHBondContact O-CA 3.28Å
108	K	95.9	Very high	95.6	Very high	165 Å²	165	68.7 Å²	68.7	72%	0.717	33%	0.33	S	S	*	.	S	Bend	trans	-120.4	152.4	175.9	-63.8	-178.1	-179.3	180	0	109.7	Y106 T110	Y106-K108 PolarHBondContact O-N 2.69Å; Y106-K108 VanDerWaalsContact O-N 3.17Å; K108-T110 PolarHBondContact O-N 3.07Å; K108-T110 PolarHBondContact O-OG1 3.15Å
109	P	97.1	Very high	95.5	Very high	75 Å²	75	70.1 Å²	70.1	49%	0.487	34%	0.343	S	S	.	.			trans	-52	109.5	173.4	-26.5	34.8	0	0	0	111.6	R99	R99-P109 HydrophobicContact CB-CB 3.93Å
110	T	97.7	Very high	95.4	Very high	50 Å²	50	65.4 Å²	65.4	31%	0.307	33%	0.327	S	S	.	.	B	Isolated β-bridge	trans	-117	130.9	-172.6	-57.3	0	0	0	0	109.9	R99 W100 Y106 K108 V112	R99-T110 WeakPolarHBondContact CA-O 3.35Å; W100-T110 PolarHBondContact N-O 3.08Å; W100-T110 PolarHBondContact O-N 2.93Å; Y106-T110 HydrophobicContact CD1-CG2 3.84Å; Y106-T110 HydrophobicContact CE1-CG2 4.07Å; K108-T110 PolarHBondContact O-N 3.07Å; K108-T110 PolarHBondContact O-OG1 3.15Å; T110-V112 HydrophobicContact CG2-CG1 4.34Å; T110-V112 PolarHBondContact O-N 3.41Å
111	A	97.3	Very high	95.4	Very high	52 Å²	52	65.2 Å²	65.2	43%	0.43	33%	0.326	S	S	.	.			trans	-69.6	128.3	171.2	0	0	0	0	0	109.2
112	V	97.4	Very high	95.4	Very high	12 Å²	12	61.5 Å²	61.5	7%	0.073	31%	0.309	C	S	.	.			trans	-136.3	153.9	174.2	-64.1	0	0	0	0	108.7	M90 W100 Y106 T110 K116 Y117	M90-V112 PolarHBondContact N-O 3.25Å; W100-V112 HydrophobicContact CB-CG2 3.98Å; Y106-V112 HydrophobicContact CE1-CG1 3.78Å; T110-V112 HydrophobicContact CG2-CG1 4.34Å; T110-V112 PolarHBondContact O-N 3.41Å; V112-K116 HydrophobicContact CB-CB 4.45Å; V112-K116 HydrophobicContact CB-CG 4.34Å; V112-Y117 HydrophobicContact CG2-CD2 4.12Å; V112-Y117 HydrophobicContact CG2-CG 4.5Å
113	P	98.3	Very high	95.5	Very high	34 Å²	34	64 Å²	64	22%	0.221	32%	0.323	C	S	.	.			trans	-55.9	150.8	173.4	-25.8	35.1	0	0	0	112.4	D84 P88 P115 K116 Y117	D84-P113 HydrophobicContact CB-CB 4.36Å; D84-P113 HydrophobicContact CB-CG 4.44Å; D84-P113 WeakPolarHBondContact OD1-CB 3.29Å; P88-P113 WeakPolarHBondContact O-CA 3.46Å; P113-P115 HydrophobicContact CB-CG 4.33Å; P113-K116 PolarHBondContact O-N 2.83Å; P113-K116 VanDerWaalsContact O-N 3.12Å; P113-Y117 PolarHBondContact O-N 3.45Å
114	A	98.3	Very high	95.9	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-54.3	-49	-179.9	0	0	0	0	0	113.5	C87 M90 K116 Y117 M118 H164	C87-A114 HydrophobicContact CB-CB 3.48Å; C87-A114 VanDerWaalsContact CB-CB 3.48Å; C87-A114 PolarHBondContact O-N 2.93Å; M90-A114 HydrophobicContact CB-CB 4.35Å; M90-A114 HydrophobicContact SD-CB 3.89Å; A114-K116 PolarHBondContact O-N 3.19Å; A114-Y117 WeakPolarHBondContact O-CB 3.47Å; A114-Y117 PolarHBondContact O-N 2.97Å; A114-Y117 VanDerWaalsContact O-N 3.08Å; A114-M118 VanDerWaalsContact O-CG 3.24Å; A114-M118 WeakPolarHBondContact O-CG 3.24Å; A114-M118 PolarHBondContact O-N 2.82Å; A114-H164 WeakPolarHBondContact CB-CE1 3.39Å
115	P	97.7	Very high	96.2	Very high	23 Å²	23	50.5 Å²	50.5	15%	0.149	26%	0.258	C	S	.	.	H	α-helix	trans	-61.9	-34.4	179.4	25	-36.3	0	0	0	112.5	Y75 C82 D84 P113 M118 S119	Y75-P115 WeakPolarHBondContact OH-CA 3.4Å; C82-P115 WeakPolarHBondContact O-CB 3.37Å; D84-P115 VanDerWaalsContact OD1-CG 3.23Å; D84-P115 WeakPolarHBondContact OD1-CG 3.4Å; P113-P115 HydrophobicContact CB-CG 4.33Å; P115-M118 PolarHBondContact O-N 2.89Å; P115-S119 PolarHBondContact O-N 3.3Å
116	K	96.8	Very high	96.2	Very high	81 Å²	81	45.4 Å²	45.4	35%	0.352	24%	0.237	S	C	.	.	H	α-helix	trans	-68.4	-42.5	174.8	-175.3	56.1	179.2	171.1	0	111.9	V112 P113 A114 M118 S119 L120	V112-K116 HydrophobicContact CB-CB 4.45Å; V112-K116 HydrophobicContact CB-CG 4.34Å; P113-K116 PolarHBondContact O-N 2.83Å; P113-K116 VanDerWaalsContact O-N 3.12Å; A114-K116 PolarHBondContact O-N 3.19Å; K116-M118 VanDerWaalsContact C-N 3.32Å; K116-M118 PolarHBondContact O-N 3.39Å; K116-S119 PolarHBondContact O-N 3.32Å; K116-L120 HydrophobicContact CD-CD1 4.36Å; K116-L120 HydrophobicContact CD-CG 4.36Å; K116-L120 HydrophobicContact CG-CD1 4.09Å; K116-L120 VanDerWaalsContact O-CG 3.28Å; K116-L120 WeakPolarHBondContact O-CG 3.44Å; K116-L120 PolarHBondContact O-N 3.33Å
117	Y	98.3	Very high	96.2	Very high	1 Å²	1	48.2 Å²	48.2	0%	0.004	26%	0.257	C	S	.	.	H	α-helix	trans	-57.8	-46.3	174.2	-172.6	-79	0	0	0	110.9	M90 W100 V112 P113 A114 L120 L121 R160	M90-Y117 HydrophobicContact CB-CD1 4.5Å; M90-Y117 HydrophobicContact CB-CD2 3.91Å; M90-Y117 HydrophobicContact CB-CG 3.82Å; M90-Y117 HydrophobicContact CE-CD1 3.99Å; M90-Y117 HydrophobicContact CE-CE1 4.12Å; M90-Y117 HydrophobicContact CG-CD1 3.68Å; M90-Y117 HydrophobicContact CG-CD2 3.77Å; M90-Y117 HydrophobicContact CG-CE1 4.16Å; M90-Y117 HydrophobicContact CG-CE2 4.23Å; M90-Y117 HydrophobicContact CG-CG 3.48Å; M90-Y117 VanDerWaalsContact CG-CG 3.48Å; M90-Y117 HydrophobicContact SD-CD1 3.95Å; M90-Y117 HydrophobicContact SD-CG 4.17Å; W100-Y117 HydrophobicContact CB-CD2 4.03Å; W100-Y117 HydrophobicContact CB-CE2 4.2Å; W100-Y117 HydrophobicContact CE3-CD2 4.15Å; W100-Y117 HydrophobicContact CE3-CE1 4.41Å; W100-Y117 AromaticContact CE3-CE2 3.85Å; W100-Y117 HydrophobicContact CE3-CE2 3.85Å; W100-Y117 AromaticContact CE3-CZ 3.98Å; V112-Y117 HydrophobicContact CG2-CD2 4.12Å; V112-Y117 HydrophobicContact CG2-CG 4.5Å; P113-Y117 PolarHBondContact O-N 3.45Å; A114-Y117 WeakPolarHBondContact O-CB 3.47Å; A114-Y117 PolarHBondContact O-N 2.97Å; A114-Y117 VanDerWaalsContact O-N 3.08Å; Y117-L120 PolarHBondContact O-N 2.84Å; Y117-L121 HydrophobicContact CD1-CB 4.42Å; Y117-L121 HydrophobicContact CE1-CB 4.34Å; Y117-L121 HydrophobicContact CE1-CD2 4.14Å; Y117-L121 VanDerWaalsContact O-CB 3.28Å; Y117-L121 WeakPolarHBondContact O-CB 3.38Å; Y117-L121 PolarHBondContact O-N 3.45Å; Y117-R160 VanDerWaalsContact OH-CD 3.28Å; Y117-R160 WeakPolarHBondContact OH-CD 3.35Å; Y117-R160 PolarHBondContact OH-NH1 3.07Å
118	M	97.3	Very high	96.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-63.6	-44.2	-178.9	-64.4	-63	-166.2	0	0	112	Y75 M90 A114 P115 K116 L121 M122 V161 H164	Y75-M118 HydrophobicContact CD1-CB 4.33Å; Y75-M118 HydrophobicContact CD2-CB 4.36Å; Y75-M118 HydrophobicContact CD2-CE 4.31Å; Y75-M118 HydrophobicContact CD2-CG 4.02Å; Y75-M118 HydrophobicContact CD2-SD 4.31Å; Y75-M118 HydrophobicContact CE1-CB 3.72Å; Y75-M118 HydrophobicContact CE1-CG 4.33Å; Y75-M118 HydrophobicContact CE2-CB 3.77Å; Y75-M118 HydrophobicContact CE2-CE 4.24Å; Y75-M118 HydrophobicContact CE2-CG 3.43Å; Y75-M118 VanDerWaalsContact CE2-CG 3.43Å; Y75-M118 HydrophobicContact CE2-SD 4.28Å; Y75-M118 VanDerWaalsContact CZ-CB 3.4Å; M90-M118 HydrophobicContact CE-CE 3.45Å; M90-M118 VanDerWaalsContact CE-CE 3.45Å; M90-M118 HydrophobicContact CE-SD 4.13Å; M90-M118 HydrophobicContact SD-CE 3.7Å; M90-M118 HydrophobicContact SD-SD 4.4Å; A114-M118 VanDerWaalsContact O-CG 3.24Å; A114-M118 WeakPolarHBondContact O-CG 3.24Å; A114-M118 PolarHBondContact O-N 2.82Å; P115-M118 PolarHBondContact O-N 2.89Å; K116-M118 VanDerWaalsContact C-N 3.32Å; K116-M118 PolarHBondContact O-N 3.39Å; M118-L121 PolarHBondContact O-N 3.2Å; M118-M122 WeakPolarHBondContact O-CG 3.22Å; M118-M122 PolarHBondContact O-N 3.36Å; M118-V161 HydrophobicContact CE-CB 4.49Å; M118-V161 HydrophobicContact CE-CG1 4.21Å; M118-V161 HydrophobicContact SD-CB 4.38Å; M118-V161 HydrophobicContact SD-CG1 4.17Å; M118-V161 HydrophobicContact SD-CG2 3.88Å; M118-H164 HydrophobicContact CE-CB 3.53Å; M118-H164 WeakPolarHBondContact CE-CD2 3.48Å
119	S	95.6	Very high	96.2	Very high	49 Å²	49	34.7 Å²	34.7	34%	0.343	20%	0.199	S	C	.	.	H	α-helix	trans	-57.3	-52.5	173.2	159.2	0	0	0	0	111.5	P115 K116 L121 M122 D123	P115-S119 PolarHBondContact O-N 3.3Å; K116-S119 PolarHBondContact O-N 3.32Å; S119-L121 VanDerWaalsContact C-N 3.25Å; S119-L121 PolarHBondContact O-N 2.73Å; S119-M122 PolarHBondContact O-N 3.43Å; S119-D123 WeakPolarHBondContact O-CB 3.4Å; S119-D123 PolarHBondContact O-N 3.16Å
120	L	96.3	Very high	95.9	Very high	26 Å²	26	34.2 Å²	34.2	14%	0.136	19%	0.192	C	C	.	.	H	α-helix	trans	-60.2	-37.5	179.4	-68.4	168.3	0	0	0	112.1	W100 Y106 K116 Y117 W124	W100-L120 HydrophobicContact CD2-CB 3.98Å; W100-L120 HydrophobicContact CD2-CD1 4.25Å; W100-L120 HydrophobicContact CE3-CB 4.32Å; W100-L120 HydrophobicContact CG-CD1 3.92Å; W100-L120 HydrophobicContact CH2-CB 4.18Å; W100-L120 WeakPolarHBondContact CH2-O 3.35Å; W100-L120 HydrophobicContact CZ2-CB 3.83Å; W100-L120 HydrophobicContact CZ3-CB 4.42Å; Y106-L120 HydrophobicContact CD2-CD1 4.38Å; Y106-L120 HydrophobicContact CE2-CD1 3.74Å; Y106-L120 HydrophobicContact CE2-CD2 4.26Å; K116-L120 HydrophobicContact CD-CD1 4.36Å; K116-L120 HydrophobicContact CD-CG 4.36Å; K116-L120 HydrophobicContact CG-CD1 4.09Å; K116-L120 VanDerWaalsContact O-CG 3.28Å; K116-L120 WeakPolarHBondContact O-CG 3.44Å; K116-L120 PolarHBondContact O-N 3.33Å; Y117-L120 PolarHBondContact O-N 2.84Å; L120-W124 WeakPolarHBondContact O-CB 3.42Å; L120-W124 PolarHBondContact O-N 3.14Å
121	L	96.8	Very high	95.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-65.5	-52.4	177.6	175.5	59.5	0	0	0	112	W100 Y117 M118 S119 D123 W124 I125 R157 V161	W100-L121 HydrophobicContact CH2-CB 4.39Å; W100-L121 HydrophobicContact CZ3-CB 3.93Å; W100-L121 HydrophobicContact CZ3-CD1 4.14Å; Y117-L121 HydrophobicContact CD1-CB 4.42Å; Y117-L121 HydrophobicContact CE1-CB 4.34Å; Y117-L121 HydrophobicContact CE1-CD2 4.14Å; Y117-L121 VanDerWaalsContact O-CB 3.28Å; Y117-L121 WeakPolarHBondContact O-CB 3.38Å; Y117-L121 PolarHBondContact O-N 3.45Å; M118-L121 PolarHBondContact O-N 3.2Å; S119-L121 VanDerWaalsContact C-N 3.25Å; S119-L121 PolarHBondContact O-N 2.73Å; L121-D123 VanDerWaalsContact C-N 3.35Å; L121-W124 HydrophobicContact CD1-CE3 4.34Å; L121-W124 PolarHBondContact O-N 3Å; L121-I125 HydrophobicContact CD1-CD1 3.66Å; L121-I125 HydrophobicContact CD1-CG1 3.99Å; L121-I125 HydrophobicContact CG-CD1 3.96Å; L121-I125 WeakPolarHBondContact O-CG1 3.44Å; L121-I125 PolarHBondContact O-N 3.47Å; L121-R157 HydrophobicContact CD1-CB 3.43Å; L121-R157 VanDerWaalsContact CD1-CB 3.43Å; L121-R157 HydrophobicContact CD1-CG 4.17Å; L121-R157 HydrophobicContact CD2-CB 4.37Å; L121-R157 WeakPolarHBondContact CD2-O 3.49Å; L121-V161 HydrophobicContact CD2-CG2 3.62Å
122	M	94.8	Very high	95.4	Very high	13 Å²	13	37.2 Å²	37.2	6%	0.064	20%	0.195	C	C	.	.	H	α-helix	trans	-64	-42.6	-177.5	-63.4	-54	179.5	0	0	110.9	F68 I71 N72 M118 S119 W124 I125 E126 V161	F68-M122 HydrophobicContact CD2-SD 4.28Å; F68-M122 HydrophobicContact CE2-CB 4.36Å; F68-M122 HydrophobicContact CE2-SD 3.87Å; I71-M122 HydrophobicContact CG2-CE 4.35Å; N72-M122 HydrophobicContact CB-CE 4.4Å; N72-M122 HydrophobicContact CB-SD 4.17Å; M118-M122 WeakPolarHBondContact O-CG 3.22Å; M118-M122 PolarHBondContact O-N 3.36Å; S119-M122 PolarHBondContact O-N 3.43Å; M122-W124 PolarHBondContact O-N 2.95Å; M122-I125 PolarHBondContact O-N 2.78Å; M122-E126 WeakPolarHBondContact O-CB 3.47Å; M122-E126 PolarHBondContact O-N 2.63Å; M122-V161 HydrophobicContact CE-CG1 4.23Å; M122-V161 HydrophobicContact CE-CG2 3.95Å
123	D	93.8	Very high	95.2	Very high	85 Å²	85	44.2 Å²	44.2	46%	0.455	23%	0.227	S	C	.	.	H	α-helix	trans	-59.9	-45.7	175.5	-67.3	-18.6	0	0	0	111.1	S119 L121 E126 V127	S119-D123 WeakPolarHBondContact O-CB 3.4Å; S119-D123 PolarHBondContact O-N 3.16Å; L121-D123 VanDerWaalsContact C-N 3.35Å; D123-E126 PolarHBondContact O-N 3.12Å; D123-V127 WeakPolarHBondContact O-CG2 3.29Å; D123-V127 PolarHBondContact O-N 3.38Å
124	W	96	Very high	95	Very high	45 Å²	45	43.5 Å²	43.5	17%	0.17	22%	0.221	C	C	.	.	H	α-helix	trans	-63.1	-45.9	179.2	175.5	77.9	0	0	0	111.9	W100 L120 L121 M122 V127 Q128 K153 I154 R157	W100-W124 HydrophobicContact CH2-CB 3.84Å; W100-W124 HydrophobicContact CH2-CG 4.21Å; W100-W124 HydrophobicContact CZ2-CB 4.12Å; W100-W124 HydrophobicContact CZ2-CG 4.47Å; L120-W124 WeakPolarHBondContact O-CB 3.42Å; L120-W124 PolarHBondContact O-N 3.14Å; L121-W124 HydrophobicContact CD1-CE3 4.34Å; L121-W124 PolarHBondContact O-N 3Å; M122-W124 PolarHBondContact O-N 2.95Å; W124-V127 PolarHBondContact O-N 3.35Å; W124-Q128 HydrophobicContact CD2-CG 4.19Å; W124-Q128 HydrophobicContact CH2-CG 4.06Å; W124-Q128 HydrophobicContact CZ2-CG 3.7Å; W124-Q128 HydrophobicContact CZ3-CG 4.47Å; W124-Q128 WeakPolarHBondContact O-CG 3.43Å; W124-Q128 PolarHBondContact O-N 2.82Å; W124-Q128 VanDerWaalsContact O-N 3.13Å; W124-K153 HydrophobicContact CH2-CB 4.29Å; W124-K153 HydrophobicContact CH2-CD 3.88Å; W124-K153 HydrophobicContact CH2-CG 3.77Å; W124-K153 HydrophobicContact CZ2-CD 3.94Å; W124-K153 HydrophobicContact CZ2-CG 4.34Å; W124-I154 HydrophobicContact CH2-CG1 3.81Å; W124-I154 HydrophobicContact CZ3-CG1 3.77Å; W124-R157 VanDerWaalsContact CD2-NH1 3.28Å; W124-R157 VanDerWaalsContact CE3-NH1 3.35Å
125	I	96.3	Very high	94.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.3	-43.4	177.4	-63.8	171.1	0	0	0	110.1	F68 L121 M122 V127 Q128 I129 I154 L158	F68-I125 HydrophobicContact CB-CG2 4.22Å; F68-I125 HydrophobicContact CD2-CB 3.87Å; F68-I125 HydrophobicContact CD2-CD1 4.29Å; F68-I125 HydrophobicContact CD2-CG2 3.36Å; F68-I125 HydrophobicContact CE2-CB 3.89Å; F68-I125 HydrophobicContact CE2-CG2 3.83Å; F68-I125 HydrophobicContact CG-CG2 3.83Å; L121-I125 HydrophobicContact CD1-CD1 3.66Å; L121-I125 HydrophobicContact CD1-CG1 3.99Å; L121-I125 HydrophobicContact CG-CD1 3.96Å; L121-I125 WeakPolarHBondContact O-CG1 3.44Å; L121-I125 PolarHBondContact O-N 3.47Å; M122-I125 PolarHBondContact O-N 2.78Å; I125-V127 VanDerWaalsContact C-N 3.28Å; I125-V127 PolarHBondContact O-N 3.43Å; I125-Q128 PolarHBondContact O-N 3.42Å; I125-I129 HydrophobicContact CG2-CG2 3.92Å; I125-I129 WeakPolarHBondContact O-CG1 3.31Å; I125-I129 PolarHBondContact O-N 2.79Å; I125-I154 HydrophobicContact CD1-CG2 4.06Å; I125-I154 HydrophobicContact CG1-CG1 4.49Å; I125-I154 HydrophobicContact CG1-CG2 4.07Å; I125-I154 HydrophobicContact CG2-CG2 3.77Å; I125-L158 HydrophobicContact CD1-CD1 4.38Å; I125-L158 HydrophobicContact CD1-CD2 3.51Å; I125-L158 HydrophobicContact CD1-CG 3.63Å
126	E	92.2	Very high	94.6	Very high	53 Å²	53	42.7 Å²	42.7	25%	0.248	22%	0.216	C	C	.	.	H	α-helix	trans	-56.8	-43.1	178.3	-172.9	175.7	-178.5	0	0	111	K18 F68 M122 D123 Q128 I129 N130	K18-E126 IonicContact NZ-OE1 3.95Å; K18-E126 PolarHBondContact NZ-OE1 3.36Å; F68-E126 HydrophobicContact CZ-CB 4.09Å; M122-E126 WeakPolarHBondContact O-CB 3.47Å; M122-E126 PolarHBondContact O-N 2.63Å; D123-E126 PolarHBondContact O-N 3.12Å; E126-Q128 PolarHBondContact O-N 2.81Å; E126-I129 WeakPolarHBondContact O-CG1 3.33Å; E126-N130 VanDerWaalsContact CG-ND2 3.29Å; E126-N130 WeakPolarHBondContact CG-ND2 3.47Å; E126-N130 WeakPolarHBondContact O-CB 3.48Å; E126-N130 PolarHBondContact O-N 3.23Å; E126-N130 VanDerWaalsContact O-N 3.12Å; E126-N130 PolarHBondContact O-ND2 2.91Å
127	V	93.8	Very high	93.9	Very high	93 Å²	93	41 Å²	41	56%	0.564	21%	0.212	S	C	*	.	H	α-helix	trans	-62.5	-42.3	174.7	172.3	0	0	0	0	111.7	D123 W124 I125 N131	D123-V127 WeakPolarHBondContact O-CG2 3.29Å; D123-V127 PolarHBondContact O-N 3.38Å; W124-V127 PolarHBondContact O-N 3.35Å; I125-V127 VanDerWaalsContact C-N 3.28Å; I125-V127 PolarHBondContact O-N 3.43Å; V127-N131 WeakPolarHBondContact O-CB 3.39Å; V127-N131 PolarHBondContact O-N 3.27Å
128	Q	94.8	Very high	93.2	Very high	32 Å²	32	45.9 Å²	45.9	15%	0.15	24%	0.239	C	C	.	.	H	α-helix	trans	-65.4	-50.2	179.7	-59.1	-42.9	-72.1	0	0	111.8	W124 I125 E126 N130 N131 I134 F135 V150 I154	W124-Q128 HydrophobicContact CD2-CG 4.19Å; W124-Q128 HydrophobicContact CH2-CG 4.06Å; W124-Q128 HydrophobicContact CZ2-CG 3.7Å; W124-Q128 HydrophobicContact CZ3-CG 4.47Å; W124-Q128 WeakPolarHBondContact O-CG 3.43Å; W124-Q128 PolarHBondContact O-N 2.82Å; W124-Q128 VanDerWaalsContact O-N 3.13Å; I125-Q128 PolarHBondContact O-N 3.42Å; E126-Q128 PolarHBondContact O-N 2.81Å; Q128-N130 PolarHBondContact O-N 3.49Å; Q128-N131 WeakPolarHBondContact O-CB 3.31Å; Q128-N131 PolarHBondContact O-N 3.44Å; Q128-N131 VanDerWaalsContact O-N 3.16Å; Q128-I134 VanDerWaalsContact OE1-CD1 3.31Å; Q128-F135 VanDerWaalsContact O-CD2 3.28Å; Q128-F135 WeakPolarHBondContact O-CD2 3.48Å; Q128-V150 HydrophobicContact CB-CG1 4.43Å; Q128-V150 HydrophobicContact CG-CG1 4.42Å; Q128-I154 HydrophobicContact CB-CD1 3.87Å; Q128-I154 HydrophobicContact CG-CD1 4.37Å
129	I	93.6	Very high	92.2	Very high	4 Å²	4	51.4 Å²	51.4	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-70.1	-20.2	-175.6	68.9	178	0	0	0	112.4	R19 V64 V65 F68 I125 E126 F135 I154	R19-I129 PolarHBondContact NH1-O 3.5Å; V64-I129 HydrophobicContact CG1-CG2 4.17Å; V65-I129 HydrophobicContact CG2-CB 4.31Å; V65-I129 HydrophobicContact CG2-CG2 4.44Å; F68-I129 HydrophobicContact CD1-CD1 3.32Å; F68-I129 HydrophobicContact CE1-CD1 3.56Å; F68-I129 HydrophobicContact CG-CD1 4.03Å; F68-I129 HydrophobicContact CZ-CD1 4.42Å; I125-I129 HydrophobicContact CG2-CG2 3.92Å; I125-I129 WeakPolarHBondContact O-CG1 3.31Å; I125-I129 PolarHBondContact O-N 2.79Å; E126-I129 WeakPolarHBondContact O-CG1 3.33Å; I129-F135 HydrophobicContact CG2-CE1 4.43Å; I129-F135 HydrophobicContact CG2-CE2 4.17Å; I129-F135 HydrophobicContact CG2-CZ 4.03Å; I129-I154 HydrophobicContact CG2-CD1 4.33Å
130	N	90.8	Very high	91.5	Very high	65 Å²	65	52.7 Å²	52.7	35%	0.348	29%	0.293	S	S	.	.	H	α-helix	trans	-94.1	-4.4	175.4	-69.1	-50.5	0	0	0	113.3	E126 Q128 E132	E126-N130 VanDerWaalsContact CG-ND2 3.29Å; E126-N130 WeakPolarHBondContact CG-ND2 3.47Å; E126-N130 WeakPolarHBondContact O-CB 3.48Å; E126-N130 PolarHBondContact O-N 3.23Å; E126-N130 VanDerWaalsContact O-N 3.12Å; E126-N130 PolarHBondContact O-ND2 2.91Å; Q128-N130 PolarHBondContact O-N 3.49Å; N130-E132 PolarHBondContact O-N 3.32Å
131	N	92.2	Very high	91.2	Very high	55 Å²	55	54.7 Å²	54.7	29%	0.294	31%	0.307	S	S	.	.			trans	-79.9	109.9	175.7	-175.4	-16.1	0	0	0	110.2	V127 Q128 H133 I134 F135	V127-N131 WeakPolarHBondContact O-CB 3.39Å; V127-N131 PolarHBondContact O-N 3.27Å; Q128-N131 WeakPolarHBondContact O-CB 3.31Å; Q128-N131 PolarHBondContact O-N 3.44Å; Q128-N131 VanDerWaalsContact O-N 3.16Å; N131-H133 PolarHBondContact O-N 3.35Å; N131-H133 VanDerWaalsContact OD1-CB 3.31Å; N131-H133 WeakPolarHBondContact OD1-CB 3.47Å; N131-H133 PolarHBondContact OD1-CD2 2.97Å; N131-H133 PolarHBondContact OD1-N 3.47Å; N131-I134 HydrophobicContact CB-CB 4.37Å; N131-I134 HydrophobicContact CB-CD1 4.13Å; N131-I134 HydrophobicContact CB-CG1 4.19Å; N131-I134 PolarHBondContact O-N 3.24Å; N131-F135 PolarHBondContact O-N 3.42Å
132	E	92.4	Very high	91	Very high	110 Å²	110	59.9 Å²	59.9	51%	0.514	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-19.8	-179.3	-60.9	-166.5	150.1	0	0	113.7	N130 I134 P136 T137	N130-E132 PolarHBondContact O-N 3.32Å; E132-I134 PolarHBondContact O-N 2.83Å; E132-P136 WeakPolarHBondContact O-CA 3.33Å; E132-T137 HydrophobicContact CG-CG2 4.38Å; E132-T137 PolarHBondContact OE1-OG1 2.87Å
133	H	93.9	Very high	91	Very high	159 Å²	159	60.6 Å²	60.6	74%	0.736	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-18.1	172	-58.9	-63.6	0	0	0	112.9	N131 P144	N131-H133 PolarHBondContact O-N 3.35Å; N131-H133 VanDerWaalsContact OD1-CB 3.31Å; N131-H133 WeakPolarHBondContact OD1-CB 3.47Å; N131-H133 PolarHBondContact OD1-CD2 2.97Å; N131-H133 PolarHBondContact OD1-N 3.47Å; H133-P144 WeakPolarHBondContact O-CD 3.43Å; H133-P144 WeakPolarHBondContact O-CG 3.38Å
134	I	94.6	Very high	91.2	Very high	19 Å²	19	58.4 Å²	58.4	10%	0.097	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103	-47	176.9	-56.1	177.5	0	0	0	110.2	Q128 N131 E132 P136 F147 V150	Q128-I134 VanDerWaalsContact OE1-CD1 3.31Å; N131-I134 HydrophobicContact CB-CB 4.37Å; N131-I134 HydrophobicContact CB-CD1 4.13Å; N131-I134 HydrophobicContact CB-CG1 4.19Å; N131-I134 PolarHBondContact O-N 3.24Å; E132-I134 PolarHBondContact O-N 2.83Å; I134-P136 WeakPolarHBondContact O-CD 3.14Å; I134-F147 WeakPolarHBondContact O-CD2 3.41Å; I134-V150 HydrophobicContact CG2-CB 4.15Å; I134-V150 HydrophobicContact CG2-CG1 3.88Å; I134-V150 HydrophobicContact CG2-CG2 4.34Å
135	F	94.5	Very high	91.2	Very high	1 Å²	1	66.8 Å²	66.8	0%	0.004	37%	0.371	C	S	.	.	S	Bend	trans	-118.2	78	178.9	-69.5	-105.5	0	0	0	110.1	R19 A61 V64 Q128 I129 N131 T137 F147 I154	R19-F135 PolarHBondContact NH2-O 3.34Å; A61-F135 HydrophobicContact CB-CD1 3.95Å; A61-F135 HydrophobicContact CB-CE1 4.12Å; V64-F135 HydrophobicContact CB-CE1 4.26Å; V64-F135 HydrophobicContact CB-CZ 4.45Å; V64-F135 HydrophobicContact CG1-CE1 4.08Å; V64-F135 HydrophobicContact CG1-CZ 3.87Å; Q128-F135 VanDerWaalsContact O-CD2 3.28Å; Q128-F135 WeakPolarHBondContact O-CD2 3.48Å; I129-F135 HydrophobicContact CG2-CE1 4.43Å; I129-F135 HydrophobicContact CG2-CE2 4.17Å; I129-F135 HydrophobicContact CG2-CZ 4.03Å; N131-F135 PolarHBondContact O-N 3.42Å; F135-T137 PolarHBondContact O-N 2.98Å; F135-F147 HydrophobicContact CD1-CE2 4.04Å; F135-F147 AromaticContact CE1-CE2 3.76Å; F135-F147 HydrophobicContact CE1-CE2 3.76Å; F135-F147 HydrophobicContact CE1-CZ 4.46Å; F135-F147 HydrophobicContact CE2-CE2 4.43Å; F135-F147 HydrophobicContact CG-CE2 4.49Å; F135-F147 AromaticContact CZ-CE2 3.95Å; F135-F147 HydrophobicContact CZ-CE2 3.95Å; F135-I154 HydrophobicContact CE2-CD1 4.11Å; F135-I154 HydrophobicContact CZ-CD1 4.03Å
136	P	91.8	Very high	91.3	Very high	5 Å²	5	70.2 Å²	70.2	3%	0.032	39%	0.392	C	S	.	.			trans	-63.3	130.8	-173.5	24.7	-34	0	0	0	112.1	R27 E132 I134 T141 F143	R27-P136 PolarHBondContact NH1-O 3.42Å; R27-P136 PolarHBondContact NH2-O 3.29Å; E132-P136 WeakPolarHBondContact O-CA 3.33Å; I134-P136 WeakPolarHBondContact O-CD 3.14Å; P136-T141 HydrophobicContact CB-CG2 3.59Å; P136-T141 HydrophobicContact CG-CG2 4.39Å; P136-F143 HydrophobicContact CG-CD1 4.09Å; P136-F143 HydrophobicContact CG-CE1 4.31Å; P136-F143 HydrophobicContact CG-CG 4.24Å
137	T	83.3	Confident	91.5	Very high	45 Å²	45	67.7 Å²	67.7	28%	0.276	38%	0.38	S	S	.	.			trans	-83.3	-31.1	-176.9	42.4	0	0	0	0	113.6	E132 F135	E132-T137 HydrophobicContact CG-CG2 4.38Å; E132-T137 PolarHBondContact OE1-OG1 2.87Å; F135-T137 PolarHBondContact O-N 2.98Å
138	N	82.3	Confident	91.7	Very high	105 Å²	105	65.4 Å²	65.4	56%	0.561	36%	0.364	S	S	*	.	S	Bend	trans	-79.4	132.8	-173	-64.9	-37.5	0	0	0	112.5	G140 T141	N138-G140 PolarHBondContact O-N 3.07Å; N138-T141 WeakPolarHBondContact O-CB 3.43Å; N138-T141 PolarHBondContact O-N 2.88Å; N138-T141 VanDerWaalsContact O-N 3.11Å; N138-T141 PolarHBondContact O-OG1 3.49Å
139	V	77.4	Confident	91.9	Very high	116 Å²	116	70.8 Å²	70.8	70%	0.703	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	131.6	172.6	-178.5	0	0	0	0	109.5	T141	V139-T141 VanDerWaalsContact C-N 3.33Å
140	G	81	Confident	92.1	Very high	76 Å²	76	71.6 Å²	71.6	78%	0.784	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.7	-5.7	-178.9	0	0	0	0	0	115.3	N138 P142	N138-G140 PolarHBondContact O-N 3.07Å; G140-P142 WeakPolarHBondContact O-CD 3.33Å
141	T	88.8	Confident	92.4	Very high	68 Å²	68	68.5 Å²	68.5	42%	0.417	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-81.3	118	170.5	-58.1	0	0	0	0	109.6	P136 N138 V139	P136-T141 HydrophobicContact CB-CG2 3.59Å; P136-T141 HydrophobicContact CG-CG2 4.39Å; N138-T141 WeakPolarHBondContact O-CB 3.43Å; N138-T141 PolarHBondContact O-N 2.88Å; N138-T141 VanDerWaalsContact O-N 3.11Å; N138-T141 PolarHBondContact O-OG1 3.49Å; V139-T141 VanDerWaalsContact C-N 3.33Å
142	P	92.8	Very high	92.7	Very high	109 Å²	109	69.5 Å²	69.5	71%	0.708	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-70	147.7	-178.9	29.1	-34.5	0	0	0	111.3	G140	G140-P142 WeakPolarHBondContact O-CD 3.33Å
143	F	95.9	Very high	93	Very high	27 Å²	27	68.9 Å²	68.9	12%	0.118	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-63.2	148.5	168.9	-74.3	-91.2	0	0	0	111.3	N57 D58 A61 P136 F147	N57-F143 HydrophobicContact CB-CB 4.3Å; N57-F143 HydrophobicContact CB-CD1 4.31Å; N57-F143 HydrophobicContact CB-CD2 3.38Å; N57-F143 HydrophobicContact CB-CE1 4.47Å; N57-F143 HydrophobicContact CB-CE2 3.59Å; N57-F143 HydrophobicContact CB-CG 3.75Å; N57-F143 HydrophobicContact CB-CZ 4.12Å; D58-F143 HydrophobicContact CB-CE2 4.41Å; D58-F143 WeakPolarHBondContact OD1-CE2 3.13Å; A61-F143 HydrophobicContact CB-CE1 3.83Å; A61-F143 HydrophobicContact CB-CZ 3.69Å; P136-F143 HydrophobicContact CG-CD1 4.09Å; P136-F143 HydrophobicContact CG-CE1 4.31Å; P136-F143 HydrophobicContact CG-CG 4.24Å; F143-F147 HydrophobicContact CB-CB 3.95Å; F143-F147 HydrophobicContact CB-CD1 4.5Å; F143-F147 HydrophobicContact CB-CG 4.15Å; F143-F147 HydrophobicContact CD1-CB 4.07Å; F143-F147 AromaticContact CD1-CD1 3.94Å; F143-F147 HydrophobicContact CD1-CD1 3.94Å; F143-F147 AromaticContact CD1-CD2 3.34Å; F143-F147 HydrophobicContact CD1-CD2 3.34Å; F143-F147 HydrophobicContact CD1-CE1 4.24Å; F143-F147 AromaticContact CD1-CE2 3.67Å; F143-F147 HydrophobicContact CD1-CE2 3.67Å; F143-F147 AromaticContact CD1-CG 3.47Å; F143-F147 HydrophobicContact CD1-CG 3.47Å; F143-F147 VanDerWaalsContact CD1-CG 3.47Å; F143-F147 HydrophobicContact CD1-CZ 4.11Å; F143-F147 HydrophobicContact CE1-CD1 4.4Å; F143-F147 AromaticContact CE1-CD2 3.69Å; F143-F147 HydrophobicContact CE1-CD2 3.69Å; F143-F147 HydrophobicContact CE1-CE1 4.25Å; F143-F147 AromaticContact CE1-CE2 3.47Å; F143-F147 HydrophobicContact CE1-CE2 3.47Å; F143-F147 VanDerWaalsContact CE1-CE2 3.47Å; F143-F147 HydrophobicContact CE1-CG 4.14Å; F143-F147 AromaticContact CE1-CZ 3.78Å; F143-F147 HydrophobicContact CE1-CZ 3.78Å; F143-F147 HydrophobicContact CG-CB 4.41Å; F143-F147 HydrophobicContact CG-CD1 4.3Å; F143-F147 HydrophobicContact CG-CD2 4.36Å; F143-F147 HydrophobicContact CG-CG 4.08Å; F143-F147 HydrophobicContact CZ-CZ 4.45Å
144	P	97.1	Very high	93.2	Very high	39 Å²	39	61.3 Å²	61.3	25%	0.253	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-64.9	153.6	171.7	32.5	-39.6	0	0	0	110.6	H133 T146 F147	H133-P144 WeakPolarHBondContact O-CD 3.43Å; H133-P144 WeakPolarHBondContact O-CG 3.38Å; P144-T146 PolarHBondContact O-N 3.48Å; P144-F147 HydrophobicContact CG-CB 4.02Å; P144-F147 VanDerWaalsContact O-CB 3.24Å; P144-F147 WeakPolarHBondContact O-CB 3.42Å; P144-F147 PolarHBondContact O-N 3.49Å
145	K	97	Very high	93.4	Very high	222 Å²	222	60.4 Å²	60.4	97%	0.965	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-23.7	176.2	-64.2	-176.4	179.1	-179.3	0	113.4
146	T	96.8	Very high	93.5	Very high	71 Å²	71	61.4 Å²	61.4	44%	0.436	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-6.3	179.2	52.2	0	0	0	0	113.7	P144 M148 Q149 V150	P144-T146 PolarHBondContact O-N 3.48Å; T146-M148 VanDerWaalsContact C-N 3.33Å; T146-M148 PolarHBondContact O-N 2.83Å; T146-Q149 WeakPolarHBondContact O-CB 3.26Å; T146-Q149 PolarHBondContact O-N 3.3Å; T146-V150 PolarHBondContact O-N 3.49Å
147	F	97.9	Very high	93.8	Very high	1 Å²	1	62.3 Å²	62.3	0%	0.004	35%	0.345	C	S	.	.	H	α-helix	trans	-51.2	-51	-174.2	167.4	-103.4	0	0	0	112.3	N57 V60 A61 I134 F135 F143 P144 Q149 V150 A151	N57-F147 HydrophobicContact CB-CD1 3.72Å; N57-F147 HydrophobicContact CB-CE1 3.63Å; N57-F147 WeakPolarHBondContact O-CE1 3.45Å; N57-F147 WeakPolarHBondContact O-CZ 3.24Å; N57-F147 WeakPolarHBondContact OD1-CD1 3.25Å; V60-F147 HydrophobicContact CB-CE1 4.14Å; V60-F147 HydrophobicContact CB-CZ 4.29Å; V60-F147 HydrophobicContact CG1-CE1 4.01Å; V60-F147 HydrophobicContact CG1-CZ 4Å; A61-F147 HydrophobicContact CB-CE2 4.14Å; A61-F147 HydrophobicContact CB-CZ 3.82Å; I134-F147 WeakPolarHBondContact O-CD2 3.41Å; F135-F147 HydrophobicContact CD1-CE2 4.04Å; F135-F147 AromaticContact CE1-CE2 3.76Å; F135-F147 HydrophobicContact CE1-CE2 3.76Å; F135-F147 HydrophobicContact CE1-CZ 4.46Å; F135-F147 HydrophobicContact CE2-CE2 4.43Å; F135-F147 HydrophobicContact CG-CE2 4.49Å; F135-F147 AromaticContact CZ-CE2 3.95Å; F135-F147 HydrophobicContact CZ-CE2 3.95Å; F143-F147 HydrophobicContact CB-CB 3.95Å; F143-F147 HydrophobicContact CB-CD1 4.5Å; F143-F147 HydrophobicContact CB-CG 4.15Å; F143-F147 HydrophobicContact CD1-CB 4.07Å; F143-F147 AromaticContact CD1-CD1 3.94Å; F143-F147 HydrophobicContact CD1-CD1 3.94Å; F143-F147 AromaticContact CD1-CD2 3.34Å; F143-F147 HydrophobicContact CD1-CD2 3.34Å; F143-F147 HydrophobicContact CD1-CE1 4.24Å; F143-F147 AromaticContact CD1-CE2 3.67Å; F143-F147 HydrophobicContact CD1-CE2 3.67Å; F143-F147 AromaticContact CD1-CG 3.47Å; F143-F147 HydrophobicContact CD1-CG 3.47Å; F143-F147 VanDerWaalsContact CD1-CG 3.47Å; F143-F147 HydrophobicContact CD1-CZ 4.11Å; F143-F147 HydrophobicContact CE1-CD1 4.4Å; F143-F147 AromaticContact CE1-CD2 3.69Å; F143-F147 HydrophobicContact CE1-CD2 3.69Å; F143-F147 HydrophobicContact CE1-CE1 4.25Å; F143-F147 AromaticContact CE1-CE2 3.47Å; F143-F147 HydrophobicContact CE1-CE2 3.47Å; F143-F147 VanDerWaalsContact CE1-CE2 3.47Å; F143-F147 HydrophobicContact CE1-CG 4.14Å; F143-F147 AromaticContact CE1-CZ 3.78Å; F143-F147 HydrophobicContact CE1-CZ 3.78Å; F143-F147 HydrophobicContact CG-CB 4.41Å; F143-F147 HydrophobicContact CG-CD1 4.3Å; F143-F147 HydrophobicContact CG-CD2 4.36Å; F143-F147 HydrophobicContact CG-CG 4.08Å; F143-F147 HydrophobicContact CZ-CZ 4.45Å; P144-F147 HydrophobicContact CG-CB 4.02Å; P144-F147 VanDerWaalsContact O-CB 3.24Å; P144-F147 WeakPolarHBondContact O-CB 3.42Å; P144-F147 PolarHBondContact O-N 3.49Å; F147-Q149 VanDerWaalsContact C-N 3.28Å; F147-Q149 PolarHBondContact O-N 2.92Å; F147-V150 PolarHBondContact O-N 3.17Å; F147-V150 VanDerWaalsContact O-N 3.07Å; F147-A151 HydrophobicContact CZ-CB 4.34Å; F147-A151 PolarHBondContact O-N 3.33Å
148	M	98.1	Very high	94.5	Very high	45 Å²	45	60.1 Å²	60.1	22%	0.222	33%	0.332	C	S	.	.	H	α-helix	trans	-62.7	-37.8	-177.4	-165.2	54.6	60.1	0	0	111.7	L56 N57 V60 T146 V150 A151 K152 L198	L56-M148 HydrophobicContact CG-CE 4.49Å; N57-M148 VanDerWaalsContact OD1-CE 3.25Å; N57-M148 WeakPolarHBondContact OD1-CE 3.24Å; V60-M148 HydrophobicContact CB-CE 4.36Å; V60-M148 HydrophobicContact CG1-CE 4.36Å; V60-M148 HydrophobicContact CG1-SD 4.37Å; V60-M148 HydrophobicContact CG2-CE 4.1Å; T146-M148 VanDerWaalsContact C-N 3.33Å; T146-M148 PolarHBondContact O-N 2.83Å; M148-V150 VanDerWaalsContact C-N 3.34Å; M148-V150 PolarHBondContact O-N 3.12Å; M148-A151 PolarHBondContact O-N 3.11Å; M148-K152 VanDerWaalsContact O-CG 3.26Å; M148-K152 WeakPolarHBondContact O-CG 3.24Å; M148-K152 PolarHBondContact O-N 2.97Å; M148-L198 HydrophobicContact SD-CD2 3.4Å; M148-L198 WeakPolarHBondContact SD-CD2 3.32Å
149	Q	97.8	Very high	95.3	Very high	144 Å²	144	55.2 Å²	55.2	67%	0.673	31%	0.305	S	S	*	.	H	α-helix	trans	-62.5	-41.8	175.2	-173	-175.8	17.1	0	0	111.6	T146 F147 K153	T146-Q149 WeakPolarHBondContact O-CB 3.26Å; T146-Q149 PolarHBondContact O-N 3.3Å; F147-Q149 VanDerWaalsContact C-N 3.28Å; F147-Q149 PolarHBondContact O-N 2.92Å; Q149-K153 PolarHBondContact O-N 3.37Å; Q149-K153 VanDerWaalsContact O-N 3.13Å
150	V	97.8	Very high	96.2	Very high	22 Å²	22	51.7 Å²	51.7	13%	0.133	28%	0.279	C	S	.	.	H	α-helix	trans	-66.8	-45.3	176.8	179.2	0	0	0	0	110.8	Q128 I134 T146 F147 M148 K152 K153 I154	Q128-V150 HydrophobicContact CB-CG1 4.43Å; Q128-V150 HydrophobicContact CG-CG1 4.42Å; I134-V150 HydrophobicContact CG2-CB 4.15Å; I134-V150 HydrophobicContact CG2-CG1 3.88Å; I134-V150 HydrophobicContact CG2-CG2 4.34Å; T146-V150 PolarHBondContact O-N 3.49Å; F147-V150 PolarHBondContact O-N 3.17Å; F147-V150 VanDerWaalsContact O-N 3.07Å; M148-V150 VanDerWaalsContact C-N 3.34Å; M148-V150 PolarHBondContact O-N 3.12Å; V150-K152 PolarHBondContact O-N 2.99Å; V150-K153 WeakPolarHBondContact O-CB 3.45Å; V150-K153 PolarHBondContact O-N 3.4Å; V150-K153 VanDerWaalsContact O-N 3.16Å; V150-I154 HydrophobicContact CG1-CD1 3.91Å; V150-I154 HydrophobicContact CG1-CG1 4.41Å; V150-I154 WeakPolarHBondContact O-CG1 3.47Å; V150-I154 PolarHBondContact O-N 3.32Å
151	A	98.3	Very high	97	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-58.2	-46.6	177.2	0	0	0	0	0	111.9	V60 V64 F147 M148 K153 I154 L155	V60-A151 HydrophobicContact CG1-CB 3.77Å; V64-A151 HydrophobicContact CG2-CB 4.13Å; F147-A151 HydrophobicContact CZ-CB 4.34Å; F147-A151 PolarHBondContact O-N 3.33Å; M148-A151 PolarHBondContact O-N 3.11Å; A151-K153 VanDerWaalsContact C-N 3.32Å; A151-K153 PolarHBondContact O-N 3.34Å; A151-I154 PolarHBondContact O-N 3.29Å; A151-L155 WeakPolarHBondContact O-CG 3.03Å; A151-L155 PolarHBondContact O-N 3.36Å
152	K	98.3	Very high	97.5	Very high	75 Å²	75	45 Å²	45	33%	0.326	22%	0.223	S	C	.	.	H	α-helix	trans	-57.9	-43.2	174.6	-69.5	-166.8	-172.5	-154.2	0	112.4	M148 V150 L155 S156 N197 L198	M148-K152 VanDerWaalsContact O-CG 3.26Å; M148-K152 WeakPolarHBondContact O-CG 3.24Å; M148-K152 PolarHBondContact O-N 2.97Å; V150-K152 PolarHBondContact O-N 2.99Å; K152-L155 PolarHBondContact O-N 3.07Å; K152-S156 VanDerWaalsContact O-CB 3.31Å; K152-S156 WeakPolarHBondContact O-CB 3.38Å; K152-S156 PolarHBondContact O-N 3.08Å; K152-S156 PolarHBondContact O-OG 3.22Å; K152-N197 WeakPolarHBondContact CE-O 3.4Å; K152-N197 PolarHBondContact NZ-O 3.3Å; K152-L198 WeakPolarHBondContact CA-O 3.16Å; K152-L198 WeakPolarHBondContact CB-O 3.43Å; K152-L198 HydrophobicContact CG-CB 4.35Å; K152-L198 HydrophobicContact CG-CD2 4.08Å; K152-L198 WeakPolarHBondContact CG-O 3.37Å
153	K	97.3	Very high	97.7	Very high	98 Å²	98	39.8 Å²	39.8	43%	0.426	19%	0.189	S	C	.	.	H	α-helix	trans	-64.7	-40.2	177.6	-171.7	176.7	179.2	177.2	0	111.9	W124 Q149 V150 A151 R157	W124-K153 HydrophobicContact CH2-CB 4.29Å; W124-K153 HydrophobicContact CH2-CD 3.88Å; W124-K153 HydrophobicContact CH2-CG 3.77Å; W124-K153 HydrophobicContact CZ2-CD 3.94Å; W124-K153 HydrophobicContact CZ2-CG 4.34Å; Q149-K153 PolarHBondContact O-N 3.37Å; Q149-K153 VanDerWaalsContact O-N 3.13Å; V150-K153 WeakPolarHBondContact O-CB 3.45Å; V150-K153 PolarHBondContact O-N 3.4Å; V150-K153 VanDerWaalsContact O-N 3.16Å; A151-K153 VanDerWaalsContact C-N 3.32Å; A151-K153 PolarHBondContact O-N 3.34Å; K153-R157 VanDerWaalsContact O-CG 3.3Å; K153-R157 WeakPolarHBondContact O-CG 3.46Å; K153-R157 PolarHBondContact O-N 3.48Å
154	I	98.2	Very high	97.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-63.1	-53.1	175.3	-68.6	166.7	0	0	0	110.1	V64 W124 I125 Q128 I129 F135 V150 A151 S156 R157 L158	V64-I154 HydrophobicContact CG1-CB 4.39Å; V64-I154 HydrophobicContact CG1-CD1 4.14Å; V64-I154 HydrophobicContact CG1-CG2 3.76Å; W124-I154 HydrophobicContact CH2-CG1 3.81Å; W124-I154 HydrophobicContact CZ3-CG1 3.77Å; I125-I154 HydrophobicContact CD1-CG2 4.06Å; I125-I154 HydrophobicContact CG1-CG1 4.49Å; I125-I154 HydrophobicContact CG1-CG2 4.07Å; I125-I154 HydrophobicContact CG2-CG2 3.77Å; Q128-I154 HydrophobicContact CB-CD1 3.87Å; Q128-I154 HydrophobicContact CG-CD1 4.37Å; I129-I154 HydrophobicContact CG2-CD1 4.33Å; F135-I154 HydrophobicContact CE2-CD1 4.11Å; F135-I154 HydrophobicContact CZ-CD1 4.03Å; V150-I154 HydrophobicContact CG1-CD1 3.91Å; V150-I154 HydrophobicContact CG1-CG1 4.41Å; V150-I154 WeakPolarHBondContact O-CG1 3.47Å; V150-I154 PolarHBondContact O-N 3.32Å; A151-I154 PolarHBondContact O-N 3.29Å; I154-S156 PolarHBondContact O-N 2.92Å; I154-R157 PolarHBondContact O-N 3.34Å; I154-R157 VanDerWaalsContact O-N 3.15Å; I154-L158 HydrophobicContact CG2-CD1 3.81Å; I154-L158 HydrophobicContact CG2-CG 4.27Å; I154-L158 WeakPolarHBondContact O-CG 3.15Å; I154-L158 PolarHBondContact O-N 3.27Å
155	L	98.6	Very high	97.8	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.3	-45.2	-176.9	-68.1	164.7	0	0	0	111.5	V64 F67 A151 K152 R157 L158 F159 F189 V193 L198	V64-L155 HydrophobicContact CG2-CD1 4.01Å; V64-L155 HydrophobicContact CG2-CD2 4.13Å; V64-L155 HydrophobicContact CG2-CG 4.03Å; F67-L155 HydrophobicContact CD2-CD2 4.07Å; A151-L155 WeakPolarHBondContact O-CG 3.03Å; A151-L155 PolarHBondContact O-N 3.36Å; K152-L155 PolarHBondContact O-N 3.07Å; L155-R157 VanDerWaalsContact C-N 3.26Å; L155-R157 PolarHBondContact O-N 3.34Å; L155-L158 PolarHBondContact O-N 3.2Å; L155-L158 VanDerWaalsContact O-N 3.16Å; L155-F159 PolarHBondContact O-N 2.98Å; L155-F189 HydrophobicContact CB-CE2 4.35Å; L155-F189 HydrophobicContact CB-CZ 4.24Å; L155-F189 HydrophobicContact CD2-CD2 4.36Å; L155-F189 HydrophobicContact CD2-CE2 3.61Å; L155-F189 HydrophobicContact CD2-CZ 4.3Å; L155-F189 VanDerWaalsContact O-CZ 3.32Å; L155-F189 WeakPolarHBondContact O-CZ 3.31Å; L155-V193 HydrophobicContact CB-CG1 4.15Å; L155-V193 HydrophobicContact CD1-CG1 4.24Å; L155-V193 HydrophobicContact CD2-CG1 4.25Å; L155-V193 HydrophobicContact CG-CG1 4.44Å; L155-L198 HydrophobicContact CD1-CB 3.69Å; L155-L198 HydrophobicContact CD1-CD1 3.5Å; L155-L198 VanDerWaalsContact CD1-CD1 3.5Å; L155-L198 HydrophobicContact CD1-CG 4.14Å
156	S	97.4	Very high	97.8	Very high	21 Å²	21	27.1 Å²	27.1	15%	0.147	13%	0.13	C	C	.	.	H	α-helix	trans	-59.3	-36.9	176.2	-59.2	0	0	0	0	112.3	K152 I154	K152-S156 VanDerWaalsContact O-CB 3.31Å; K152-S156 WeakPolarHBondContact O-CB 3.38Å; K152-S156 PolarHBondContact O-N 3.08Å; K152-S156 PolarHBondContact O-OG 3.22Å; I154-S156 PolarHBondContact O-N 2.92Å
157	R	97.4	Very high	97.7	Very high	24 Å²	24	27.1 Å²	27.1	9%	0.091	13%	0.126	C	C	.	.	H	α-helix	trans	-76.3	-36.3	176.3	-69.1	176.3	165.4	-160.5	-8.9	112.7	W100 Q101 L121 W124 K153 I154 L155 F159 R160	W100-R157 VanDerWaalsContact CH2-NH1 3.27Å; Q101-R157 PolarHBondContact O-NH2 3.41Å; Q101-R157 VanDerWaalsContact O-NH2 3.12Å; L121-R157 HydrophobicContact CD1-CB 3.43Å; L121-R157 VanDerWaalsContact CD1-CB 3.43Å; L121-R157 HydrophobicContact CD1-CG 4.17Å; L121-R157 HydrophobicContact CD2-CB 4.37Å; L121-R157 WeakPolarHBondContact CD2-O 3.49Å; W124-R157 VanDerWaalsContact CD2-NH1 3.28Å; W124-R157 VanDerWaalsContact CE3-NH1 3.35Å; K153-R157 VanDerWaalsContact O-CG 3.3Å; K153-R157 WeakPolarHBondContact O-CG 3.46Å; K153-R157 PolarHBondContact O-N 3.48Å; I154-R157 PolarHBondContact O-N 3.34Å; I154-R157 VanDerWaalsContact O-N 3.15Å; L155-R157 VanDerWaalsContact C-N 3.26Å; L155-R157 PolarHBondContact O-N 3.34Å; R157-F159 VanDerWaalsContact C-N 3.28Å; R157-F159 PolarHBondContact O-N 2.77Å; R157-R160 WeakPolarHBondContact O-CB 3.47Å; R157-R160 PolarHBondContact O-N 3.47Å
158	L	98.4	Very high	97.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61.4	-36.2	173	-79.1	174.4	0	0	0	112	F67 F68 I71 I125 I154 L155 R160 V161 F189	F67-L158 HydrophobicContact CB-CD1 4.35Å; F68-L158 HydrophobicContact CB-CD1 4.4Å; F68-L158 HydrophobicContact CD2-CD2 4.45Å; I71-L158 HydrophobicContact CB-CD2 4.2Å; I71-L158 HydrophobicContact CD1-CB 3.84Å; I71-L158 HydrophobicContact CD1-CD1 4.21Å; I71-L158 HydrophobicContact CD1-CD2 4.06Å; I71-L158 HydrophobicContact CD1-CG 4.26Å; I71-L158 HydrophobicContact CG2-CD2 4.01Å; I125-L158 HydrophobicContact CD1-CD1 4.38Å; I125-L158 HydrophobicContact CD1-CD2 3.51Å; I125-L158 HydrophobicContact CD1-CG 3.63Å; I154-L158 HydrophobicContact CG2-CD1 3.81Å; I154-L158 HydrophobicContact CG2-CG 4.27Å; I154-L158 WeakPolarHBondContact O-CG 3.15Å; I154-L158 PolarHBondContact O-N 3.27Å; L155-L158 PolarHBondContact O-N 3.2Å; L155-L158 VanDerWaalsContact O-N 3.16Å; L158-R160 PolarHBondContact O-N 2.98Å; L158-V161 VanDerWaalsContact O-CB 3.29Å; L158-V161 WeakPolarHBondContact O-CB 3.46Å; L158-V161 WeakPolarHBondContact O-CG2 3.37Å; L158-V161 PolarHBondContact O-N 2.9Å; L158-F189 HydrophobicContact CB-CE2 4.18Å
159	F	98.4	Very high	97.5	Very high	1 Å²	1	29.1 Å²	29.1	0%	0.004	14%	0.135	C	C	.	.	H	α-helix	trans	-55.7	-37.9	174.4	179	-100.9	0	0	0	112.4	L155 R157 V161 F162 V163 Y186 F189 E203 L204 P206 L207	L155-F159 PolarHBondContact O-N 2.98Å; R157-F159 VanDerWaalsContact C-N 3.28Å; R157-F159 PolarHBondContact O-N 2.77Å; F159-V161 PolarHBondContact O-N 2.94Å; F159-V161 VanDerWaalsContact O-N 3.16Å; F159-F162 WeakPolarHBondContact O-CB 3.32Å; F159-F162 PolarHBondContact O-N 3.42Å; F159-V163 HydrophobicContact CD1-CG2 3.63Å; F159-V163 HydrophobicContact CE1-CG2 3.21Å; F159-V163 HydrophobicContact CG-CG2 4.43Å; F159-V163 HydrophobicContact CZ-CG2 3.76Å; F159-V163 WeakPolarHBondContact O-CG2 3.19Å; F159-V163 PolarHBondContact O-N 3.05Å; F159-Y186 HydrophobicContact CD2-CE2 4.28Å; F159-Y186 AromaticContact CE2-CE2 3.8Å; F159-Y186 HydrophobicContact CE2-CE2 3.8Å; F159-F189 HydrophobicContact CB-CE1 3.97Å; F159-F189 HydrophobicContact CB-CZ 4.08Å; F159-F189 AromaticContact CD2-CE1 3.94Å; F159-F189 HydrophobicContact CD2-CE1 3.94Å; F159-F189 HydrophobicContact CG-CE1 4.44Å; F159-E203 WeakPolarHBondContact CD1-O 3.27Å; F159-E203 WeakPolarHBondContact CE1-O 3.37Å; F159-L204 HydrophobicContact CD1-CD2 4.38Å; F159-L204 HydrophobicContact CD2-CD2 3.65Å; F159-L204 HydrophobicContact CE1-CD2 4.31Å; F159-L204 HydrophobicContact CE2-CD2 3.51Å; F159-L204 HydrophobicContact CG-CD2 4.08Å; F159-L204 HydrophobicContact CZ-CB 4.4Å; F159-L204 HydrophobicContact CZ-CD2 3.88Å; F159-P206 HydrophobicContact CE1-CG 4.48Å; F159-L207 HydrophobicContact CE2-CB 4.49Å; F159-L207 HydrophobicContact CE2-CD1 3.92Å; F159-L207 HydrophobicContact CZ-CB 4.01Å; F159-L207 HydrophobicContact CZ-CD1 3.84Å; F159-L207 HydrophobicContact CZ-CG 4.08Å
160	R	98.1	Very high	97.2	Very high	42 Å²	42	24.7 Å²	24.7	16%	0.158	11%	0.113	C	C	.	.	H	α-helix	trans	-61.3	-26.3	178.3	-56.9	173.3	-176.7	-170.7	-6.2	112.7	M90 Y98 Y117 R157 L158 H164 E203	M90-R160 HydrophobicContact CE-CB 4.08Å; M90-R160 WeakPolarHBondContact CE-O 3.31Å; Y98-R160 HydrophobicContact CD1-CG 3.93Å; Y98-R160 HydrophobicContact CD2-CB 4.45Å; Y98-R160 HydrophobicContact CE1-CG 3.73Å; Y98-R160 HydrophobicContact CE2-CB 4.32Å; Y98-R160 HydrophobicContact CE2-CG 4.38Å; Y98-R160 HydrophobicContact CG-CG 4.33Å; Y117-R160 VanDerWaalsContact OH-CD 3.28Å; Y117-R160 WeakPolarHBondContact OH-CD 3.35Å; Y117-R160 PolarHBondContact OH-NH1 3.07Å; R157-R160 WeakPolarHBondContact O-CB 3.47Å; R157-R160 PolarHBondContact O-N 3.47Å; L158-R160 PolarHBondContact O-N 2.98Å; R160-H164 WeakPolarHBondContact O-CB 3.3Å; R160-H164 PolarHBondContact O-N 3.44Å; R160-E203 IonicContact CZ-OE2 3.39Å; R160-E203 IonicContact NE-OE2 3.13Å; R160-E203 IonicContact NH2-OE1 3.02Å; R160-E203 IonicContact NH2-OE2 2.82Å; R160-E203 PolarHBondContact NH2-OE2 3.35Å
161	V	98	Very high	97	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.006	14%	0.14	C	C	.	.	H	α-helix	trans	-67.9	-45.5	173.9	-170.1	0	0	0	0	110.2	I71 Y75 M118 L121 M122 L158 F159 V163 H164 V165	I71-V161 HydrophobicContact CG2-CB 3.62Å; I71-V161 HydrophobicContact CG2-CG1 3.6Å; I71-V161 HydrophobicContact CG2-CG2 4.01Å; Y75-V161 HydrophobicContact CD2-CG1 4.48Å; M118-V161 HydrophobicContact CE-CB 4.49Å; M118-V161 HydrophobicContact CE-CG1 4.21Å; M118-V161 HydrophobicContact SD-CB 4.38Å; M118-V161 HydrophobicContact SD-CG1 4.17Å; M118-V161 HydrophobicContact SD-CG2 3.88Å; L121-V161 HydrophobicContact CD2-CG2 3.62Å; M122-V161 HydrophobicContact CE-CG1 4.23Å; M122-V161 HydrophobicContact CE-CG2 3.95Å; L158-V161 VanDerWaalsContact O-CB 3.29Å; L158-V161 WeakPolarHBondContact O-CB 3.46Å; L158-V161 WeakPolarHBondContact O-CG2 3.37Å; L158-V161 PolarHBondContact O-N 2.9Å; F159-V161 PolarHBondContact O-N 2.94Å; F159-V161 VanDerWaalsContact O-N 3.16Å; V161-V163 PolarHBondContact O-N 3.36Å; V161-H164 PolarHBondContact O-N 2.64Å; V161-V165 HydrophobicContact CG1-CG2 4.33Å; V161-V165 WeakPolarHBondContact O-CB 3.43Å; V161-V165 VanDerWaalsContact O-CG2 3.25Å; V161-V165 WeakPolarHBondContact O-CG2 3.43Å; V161-V165 PolarHBondContact O-N 2.81Å
162	F	97.9	Very high	96.6	Very high	2 Å²	2	34 Å²	34	1%	0.009	16%	0.156	C	C	.	.	H	α-helix	trans	-58.6	-48.8	172.9	-73.9	-65.6	0	0	0	111.3	I71 I74 F159 H164 V165 Y166 V182 C185 Y186 F189 L207	I71-F162 HydrophobicContact CD1-CD2 4.18Å; I71-F162 HydrophobicContact CD1-CE2 3.39Å; I71-F162 HydrophobicContact CD1-CZ 3.82Å; I71-F162 HydrophobicContact CG1-CE1 4.4Å; I71-F162 HydrophobicContact CG1-CE2 3.74Å; I71-F162 HydrophobicContact CG1-CZ 3.62Å; I74-F162 HydrophobicContact CD1-CE1 4.15Å; F159-F162 WeakPolarHBondContact O-CB 3.32Å; F159-F162 PolarHBondContact O-N 3.42Å; F162-H164 VanDerWaalsContact C-N 3.28Å; F162-H164 PolarHBondContact O-N 2.81Å; F162-V165 PolarHBondContact O-N 3.49Å; F162-Y166 HydrophobicContact CB-CD2 4.19Å; F162-Y166 HydrophobicContact CB-CE2 4.34Å; F162-Y166 HydrophobicContact CD1-CE2 4.05Å; F162-Y166 WeakPolarHBondContact O-CB 3.25Å; F162-Y166 WeakPolarHBondContact O-CD2 3.34Å; F162-Y166 PolarHBondContact O-N 3.2Å; F162-V182 HydrophobicContact CD1-CG1 4.48Å; F162-C185 HydrophobicContact CE1-CB 4.36Å; F162-C185 HydrophobicContact CZ-CB 4.27Å; F162-Y186 HydrophobicContact CB-CD2 3.94Å; F162-Y186 HydrophobicContact CB-CE2 4.25Å; F162-Y186 AromaticContact CD1-CD2 3.88Å; F162-Y186 HydrophobicContact CD1-CD2 3.88Å; F162-Y186 HydrophobicContact CD1-CG 4.42Å; F162-Y186 AromaticContact CD2-CD2 3.89Å; F162-Y186 HydrophobicContact CD2-CD2 3.89Å; F162-Y186 HydrophobicContact CE1-CD2 4.3Å; F162-Y186 HydrophobicContact CE2-CD2 4.29Å; F162-Y186 AromaticContact CG-CD2 3.66Å; F162-Y186 HydrophobicContact CG-CD2 3.66Å; F162-Y186 HydrophobicContact CG-CE2 4.36Å; F162-Y186 HydrophobicContact CZ-CD2 4.48Å; F162-F189 HydrophobicContact CD2-CD1 4.34Å; F162-F189 HydrophobicContact CD2-CG 4.42Å; F162-F189 HydrophobicContact CE2-CB 3.84Å; F162-F189 HydrophobicContact CE2-CD1 4.06Å; F162-F189 HydrophobicContact CE2-CD2 4.04Å; F162-F189 AromaticContact CE2-CG 3.7Å; F162-F189 HydrophobicContact CE2-CG 3.7Å; F162-F189 HydrophobicContact CZ-CB 4.26Å; F162-L207 HydrophobicContact CB-CD1 4.05Å
163	V	97.8	Very high	96.2	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-53.2	-49.1	179.1	-178.9	0	0	0	0	110.8	Y98 F159 V161 I167 P206 L207	Y98-V163 HydrophobicContact CE2-CG1 4.31Å; F159-V163 HydrophobicContact CD1-CG2 3.63Å; F159-V163 HydrophobicContact CE1-CG2 3.21Å; F159-V163 HydrophobicContact CG-CG2 4.43Å; F159-V163 HydrophobicContact CZ-CG2 3.76Å; F159-V163 WeakPolarHBondContact O-CG2 3.19Å; F159-V163 PolarHBondContact O-N 3.05Å; V161-V163 PolarHBondContact O-N 3.36Å; V163-I167 HydrophobicContact CG1-CD1 3.71Å; V163-I167 WeakPolarHBondContact O-CB 3.33Å; V163-I167 VanDerWaalsContact O-CG1 3.31Å; V163-I167 WeakPolarHBondContact O-CG1 3.43Å; V163-I167 PolarHBondContact O-N 3.46Å; V163-I167 VanDerWaalsContact O-N 3.09Å; V163-P206 HydrophobicContact CG1-CB 3.73Å; V163-P206 HydrophobicContact CG2-CB 3.98Å; V163-P206 HydrophobicContact CG2-CG 4.47Å; V163-L207 HydrophobicContact CB-CD1 4.4Å; V163-L207 HydrophobicContact CB-CG 4.46Å; V163-L207 HydrophobicContact CG2-CD1 3.85Å; V163-L207 HydrophobicContact CG2-CG 3.95Å
164	H	97.7	Very high	95.9	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-65.9	-44.2	-179.1	-176.5	71.3	0	0	0	112.5	C82 M90 A114 M118 R160 V161 F162 I167 H168 H169	C82-H164 PolarHBondContact SG-NE2 3.01Å; C82-H164 VanDerWaalsContact SG-NE2 3.35Å; M90-H164 HydrophobicContact CE-CB 3.78Å; M90-H164 HydrophobicContact SD-CB 4.29Å; A114-H164 WeakPolarHBondContact CB-CE1 3.39Å; M118-H164 HydrophobicContact CE-CB 3.53Å; M118-H164 WeakPolarHBondContact CE-CD2 3.48Å; R160-H164 WeakPolarHBondContact O-CB 3.3Å; R160-H164 PolarHBondContact O-N 3.44Å; V161-H164 PolarHBondContact O-N 2.64Å; F162-H164 VanDerWaalsContact C-N 3.28Å; F162-H164 PolarHBondContact O-N 2.81Å; H164-I167 PolarHBondContact O-N 3.16Å; H164-H168 AromaticContact CE1-CD2 3.68Å; H164-H168 AromaticContact ND1-CD2 3.27Å; H164-H168 PolarHBondContact ND1-CD2 3.44Å; H164-H168 VanDerWaalsContact ND1-CD2 3.27Å; H164-H168 AromaticContact ND1-NE2 3.99Å; H164-H168 WeakPolarHBondContact O-CB 3.33Å; H164-H168 PolarHBondContact O-N 2.89Å; H164-H169 AromaticContact CD2-CD2 3.72Å; H164-H169 AromaticContact CD2-NE2 3.98Å; H164-H169 AromaticContact CE1-NE2 3.91Å; H164-H169 AromaticContact NE2-CD2 3.42Å; H164-H169 PolarHBondContact NE2-CD2 3.36Å; H164-H169 AromaticContact NE2-NE2 3.21Å; H164-H169 PolarHBondContact NE2-NE2 3.04Å
165	V	96.8	Very high	95.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61.9	-47.8	178.6	169.6	0	0	0	0	111.1	I74 I78 V161 F162 I167 H169 F170 V173 V182	I74-V165 HydrophobicContact CG2-CG1 4.23Å; I74-V165 HydrophobicContact CG2-CG2 4.33Å; I78-V165 HydrophobicContact CG1-CG2 4.34Å; V161-V165 HydrophobicContact CG1-CG2 4.33Å; V161-V165 WeakPolarHBondContact O-CB 3.43Å; V161-V165 VanDerWaalsContact O-CG2 3.25Å; V161-V165 WeakPolarHBondContact O-CG2 3.43Å; V161-V165 PolarHBondContact O-N 2.81Å; F162-V165 PolarHBondContact O-N 3.49Å; V165-I167 PolarHBondContact O-N 3.11Å; V165-H169 CarbonylContact O-C 3.52Å; V165-H169 VanDerWaalsContact O-C 3.24Å; V165-H169 WeakPolarHBondContact O-CA 3.39Å; V165-H169 PolarHBondContact O-N 3.38Å; V165-F170 PolarHBondContact O-N 2.74Å; V165-V173 HydrophobicContact CG1-CG2 3.86Å; V165-V182 HydrophobicContact CG1-CG1 4.45Å
166	Y	96.3	Very high	95	Very high	22 Å²	22	35.9 Å²	35.9	9%	0.086	17%	0.173	C	C	.	.	H	α-helix	trans	-66.2	-35.1	-179.3	-83.5	-68.4	0	0	0	113.4	F162 F170 V182 N183 Y186 L207 M210	F162-Y166 HydrophobicContact CB-CD2 4.19Å; F162-Y166 HydrophobicContact CB-CE2 4.34Å; F162-Y166 HydrophobicContact CD1-CE2 4.05Å; F162-Y166 WeakPolarHBondContact O-CB 3.25Å; F162-Y166 WeakPolarHBondContact O-CD2 3.34Å; F162-Y166 PolarHBondContact O-N 3.2Å; Y166-F170 AromaticContact CD1-CD2 3.45Å; Y166-F170 HydrophobicContact CD1-CD2 3.45Å; Y166-F170 VanDerWaalsContact CD1-CD2 3.45Å; Y166-F170 AromaticContact CD1-CE2 3.56Å; Y166-F170 HydrophobicContact CD1-CE2 3.56Å; Y166-F170 HydrophobicContact CD1-CG 4.28Å; Y166-F170 HydrophobicContact CD1-CZ 4.44Å; Y166-F170 AromaticContact CE1-CD2 3.77Å; Y166-F170 HydrophobicContact CE1-CD2 3.77Å; Y166-F170 AromaticContact CE1-CE2 3.38Å; Y166-F170 HydrophobicContact CE1-CE2 3.38Å; Y166-F170 HydrophobicContact CE1-CZ 4.22Å; Y166-F170 HydrophobicContact CG-CD2 4.47Å; Y166-F170 VanDerWaalsContact O-CB 3.3Å; Y166-F170 WeakPolarHBondContact O-CB 3.49Å; Y166-V182 HydrophobicContact CE1-CG1 4.43Å; Y166-V182 HydrophobicContact CE2-CG1 4.13Å; Y166-N183 WeakPolarHBondContact CE1-OD1 3.22Å; Y166-N183 WeakPolarHBondContact OH-CA 3.33Å; Y166-N183 PolarHBondContact OH-OD1 2.61Å; Y166-Y186 HydrophobicContact CE2-CD1 4.39Å; Y166-Y186 HydrophobicContact CE2-CD2 4.06Å; Y166-Y186 AromaticContact CE2-CG 3.87Å; Y166-Y186 HydrophobicContact CE2-CG 3.87Å; Y166-Y186 WeakPolarHBondContact OH-CB 2.96Å; Y166-L207 HydrophobicContact CD2-CD1 4.03Å; Y166-L207 HydrophobicContact CD2-CD2 4.36Å; Y166-L207 HydrophobicContact CG-CD2 4.39Å; Y166-M210 HydrophobicContact CD1-CE 4.09Å; Y166-M210 HydrophobicContact CD1-SD 3.29Å; Y166-M210 WeakPolarHBondContact CD1-SD 3.31Å; Y166-M210 HydrophobicContact CD2-CE 3.57Å; Y166-M210 HydrophobicContact CD2-SD 3.84Å; Y166-M210 HydrophobicContact CE1-CE 3.96Å; Y166-M210 HydrophobicContact CE1-SD 3.47Å; Y166-M210 WeakPolarHBondContact CE1-SD 3.49Å; Y166-M210 HydrophobicContact CE2-CE 3.44Å; Y166-M210 VanDerWaalsContact CE2-CE 3.44Å; Y166-M210 HydrophobicContact CE2-SD 4.02Å; Y166-M210 HydrophobicContact CG-CE 3.9Å; Y166-M210 HydrophobicContact CG-SD 3.48Å
167	I	95.1	Very high	94.6	Very high	71 Å²	71	37.4 Å²	37.4	36%	0.364	19%	0.192	S	C	.	.	H	α-helix	trans	-86.4	-39.3	-175.1	-67.1	174.8	0	0	0	112.2	G92 V163 H164 V165	G92-I167 WeakPolarHBondContact O-CD1 3.38Å; V163-I167 HydrophobicContact CG1-CD1 3.71Å; V163-I167 WeakPolarHBondContact O-CB 3.33Å; V163-I167 VanDerWaalsContact O-CG1 3.31Å; V163-I167 WeakPolarHBondContact O-CG1 3.43Å; V163-I167 PolarHBondContact O-N 3.46Å; V163-I167 VanDerWaalsContact O-N 3.09Å; H164-I167 PolarHBondContact O-N 3.16Å; V165-I167 PolarHBondContact O-N 3.11Å
168	H	95.5	Very high	94.2	Very high	76 Å²	76	36.5 Å²	36.5	35%	0.352	19%	0.189	S	C	.	.	H	α-helix	trans	-109	-23	-170.2	-61.7	-78.2	0	0	0	114.2	S91 H164	S91-H168 PolarHBondContact O-CD2 2.87Å; S91-H168 PolarHBondContact O-NE2 2.94Å; S91-H168 VanDerWaalsContact O-NE2 3.11Å; S91-H168 PolarHBondContact OG-CE1 3.42Å; S91-H168 PolarHBondContact OG-NE2 3.36Å; H164-H168 AromaticContact CE1-CD2 3.68Å; H164-H168 AromaticContact ND1-CD2 3.27Å; H164-H168 PolarHBondContact ND1-CD2 3.44Å; H164-H168 VanDerWaalsContact ND1-CD2 3.27Å; H164-H168 AromaticContact ND1-NE2 3.99Å; H164-H168 WeakPolarHBondContact O-CB 3.33Å; H164-H168 PolarHBondContact O-N 2.89Å
169	H	96.1	Very high	93.7	Very high	12 Å²	12	40.3 Å²	40.3	6%	0.056	21%	0.207	C	C	.	.	S	Bend	trans	-128.8	10.3	-170	-62.4	-70.3	0	0	0	114	I78 C87 H164 V165 D171 R172 V173	I78-H169 HydrophobicContact CB-CB 4.12Å; I78-H169 HydrophobicContact CG1-CB 4.19Å; I78-H169 HydrophobicContact CG2-CB 4.11Å; C87-H169 PolarHBondContact SG-NE2 2.89Å; C87-H169 VanDerWaalsContact SG-NE2 3.43Å; H164-H169 AromaticContact CD2-CD2 3.72Å; H164-H169 AromaticContact CD2-NE2 3.98Å; H164-H169 AromaticContact CE1-NE2 3.91Å; H164-H169 AromaticContact NE2-CD2 3.42Å; H164-H169 PolarHBondContact NE2-CD2 3.36Å; H164-H169 AromaticContact NE2-NE2 3.21Å; H164-H169 PolarHBondContact NE2-NE2 3.04Å; V165-H169 CarbonylContact O-C 3.52Å; V165-H169 VanDerWaalsContact O-C 3.24Å; V165-H169 WeakPolarHBondContact O-CA 3.39Å; V165-H169 PolarHBondContact O-N 3.38Å; H169-D171 VanDerWaalsContact C-N 3.33Å; H169-D171 PolarHBondContact O-N 3.13Å; H169-R172 WeakPolarHBondContact O-CB 3.39Å; H169-R172 PolarHBondContact O-N 2.76Å; H169-R172 VanDerWaalsContact O-N 3.15Å; H169-V173 PolarHBondContact O-N 3.2Å; H169-V173 VanDerWaalsContact O-N 3.07Å
170	F	92.5	Very high	93.3	Very high	51 Å²	51	43.3 Å²	43.3	22%	0.224	23%	0.232	C	C	.	.	H	α-helix	trans	-66.4	-36.3	-176.1	-164.8	-108.6	0	0	0	112.3	V165 Y166 R172 V173 S174 E179	V165-F170 PolarHBondContact O-N 2.74Å; Y166-F170 AromaticContact CD1-CD2 3.45Å; Y166-F170 HydrophobicContact CD1-CD2 3.45Å; Y166-F170 VanDerWaalsContact CD1-CD2 3.45Å; Y166-F170 AromaticContact CD1-CE2 3.56Å; Y166-F170 HydrophobicContact CD1-CE2 3.56Å; Y166-F170 HydrophobicContact CD1-CG 4.28Å; Y166-F170 HydrophobicContact CD1-CZ 4.44Å; Y166-F170 AromaticContact CE1-CD2 3.77Å; Y166-F170 HydrophobicContact CE1-CD2 3.77Å; Y166-F170 AromaticContact CE1-CE2 3.38Å; Y166-F170 HydrophobicContact CE1-CE2 3.38Å; Y166-F170 HydrophobicContact CE1-CZ 4.22Å; Y166-F170 HydrophobicContact CG-CD2 4.47Å; Y166-F170 VanDerWaalsContact O-CB 3.3Å; Y166-F170 WeakPolarHBondContact O-CB 3.49Å; F170-R172 PolarHBondContact O-N 3.36Å; F170-V173 HydrophobicContact CD2-CB 4.48Å; F170-V173 HydrophobicContact CD2-CG1 4.47Å; F170-V173 CarbonylContact O-C 3.59Å; F170-V173 WeakPolarHBondContact O-CA 3.31Å; F170-V173 WeakPolarHBondContact O-CB 3.37Å; F170-V173 PolarHBondContact O-N 3.35Å; F170-V173 VanDerWaalsContact O-N 3.08Å; F170-S174 WeakPolarHBondContact O-CB 3.47Å; F170-S174 PolarHBondContact O-N 3.03Å; F170-S174 PolarHBondContact O-OG 3.32Å; F170-S174 VanDerWaalsContact O-OG 3.07Å; F170-E179 HydrophobicContact CE1-CG 4.49Å; F170-E179 HydrophobicContact CE2-CG 4.07Å; F170-E179 HydrophobicContact CZ-CB 4.4Å; F170-E179 HydrophobicContact CZ-CG 3.58Å; F170-E179 WeakPolarHBondContact CZ-OE1 3.28Å
171	D	92.4	Very high	92.8	Very high	128 Å²	128	46 Å²	46	68%	0.684	25%	0.246	S	C	*	.	H	α-helix	trans	-56.3	-40.2	173.8	-69	-16.9	0	0	0	112	H169 S174 Q175	H169-D171 VanDerWaalsContact C-N 3.33Å; H169-D171 PolarHBondContact O-N 3.13Å; D171-S174 PolarHBondContact O-N 3.13Å; D171-Q175 WeakPolarHBondContact O-CB 3.38Å; D171-Q175 VanDerWaalsContact O-CG 3.22Å; D171-Q175 WeakPolarHBondContact O-CG 3.46Å; D171-Q175 PolarHBondContact O-N 2.92Å
172	R	90.8	Very high	92.6	Very high	89 Å²	89	46.1 Å²	46.1	34%	0.336	25%	0.247	S	C	.	.	H	α-helix	trans	-67.9	-44.5	176.3	-178.5	59.5	169.3	-178.7	-5.6	111.3	I78 D80 H169 F170 S174 Q175 M176	I78-R172 HydrophobicContact CG2-CB 4.36Å; I78-R172 HydrophobicContact CG2-CG 4.02Å; D80-R172 IonicContact OD2-NH2 2.76Å; D80-R172 PolarHBondContact OD2-NH2 3.47Å; H169-R172 WeakPolarHBondContact O-CB 3.39Å; H169-R172 PolarHBondContact O-N 2.76Å; H169-R172 VanDerWaalsContact O-N 3.15Å; F170-R172 PolarHBondContact O-N 3.36Å; R172-S174 VanDerWaalsContact C-N 3.25Å; R172-S174 PolarHBondContact O-N 3.09Å; R172-Q175 PolarHBondContact O-N 3.15Å; R172-M176 HydrophobicContact CG-SD 4.29Å; R172-M176 VanDerWaalsContact O-CG 3.31Å; R172-M176 WeakPolarHBondContact O-CG 3.32Å; R172-M176 PolarHBondContact O-N 3.38Å; R172-M176 VanDerWaalsContact O-N 3.08Å
173	V	90.3	Very high	92.3	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-56.4	-42.6	174.1	169.4	0	0	0	0	110.9	I78 V165 H169 F170 M176 G177 A178 E179 V182	I78-V173 HydrophobicContact CG2-CG2 3.92Å; V165-V173 HydrophobicContact CG1-CG2 3.86Å; H169-V173 PolarHBondContact O-N 3.2Å; H169-V173 VanDerWaalsContact O-N 3.07Å; F170-V173 HydrophobicContact CD2-CB 4.48Å; F170-V173 HydrophobicContact CD2-CG1 4.47Å; F170-V173 CarbonylContact O-C 3.59Å; F170-V173 WeakPolarHBondContact O-CA 3.31Å; F170-V173 WeakPolarHBondContact O-CB 3.37Å; F170-V173 PolarHBondContact O-N 3.35Å; F170-V173 VanDerWaalsContact O-N 3.08Å; V173-M176 PolarHBondContact O-N 3.26Å; V173-G177 PolarHBondContact O-N 3.01Å; V173-A178 HydrophobicContact CG1-CB 4.17Å; V173-A178 PolarHBondContact O-N 3.05Å; V173-E179 HydrophobicContact CG1-CB 4.41Å; V173-V182 HydrophobicContact CG1-CB 4.31Å; V173-V182 HydrophobicContact CG1-CG2 3.65Å; V173-V182 HydrophobicContact CG2-CG2 4.44Å
174	S	89.3	Confident	92.1	Very high	45 Å²	45	50.6 Å²	50.6	32%	0.315	27%	0.273	S	S	.	.	H	α-helix	trans	-67.8	-44.2	178.1	-61.9	0	0	0	0	112.3	F170 D171 R172 M176 G177	F170-S174 WeakPolarHBondContact O-CB 3.47Å; F170-S174 PolarHBondContact O-N 3.03Å; F170-S174 PolarHBondContact O-OG 3.32Å; F170-S174 VanDerWaalsContact O-OG 3.07Å; D171-S174 PolarHBondContact O-N 3.13Å; R172-S174 VanDerWaalsContact C-N 3.25Å; R172-S174 PolarHBondContact O-N 3.09Å; S174-M176 PolarHBondContact O-N 3.03Å; S174-G177 PolarHBondContact O-N 3.48Å
175	Q	90.6	Very high	92	Very high	145 Å²	145	50.7 Å²	50.7	68%	0.678	27%	0.274	S	S	*	.	H	α-helix	trans	-58.5	-31.9	174.4	-74.7	168	17	0	0	112.8	D171 R172 G177	D171-Q175 WeakPolarHBondContact O-CB 3.38Å; D171-Q175 VanDerWaalsContact O-CG 3.22Å; D171-Q175 WeakPolarHBondContact O-CG 3.46Å; D171-Q175 PolarHBondContact O-N 2.92Å; R172-Q175 PolarHBondContact O-N 3.15Å; Q175-G177 VanDerWaalsContact C-N 3.3Å
176	M	88.9	Confident	91.9	Very high	23 Å²	23	50.7 Å²	50.7	11%	0.113	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-8.3	176.7	-65.8	176.8	69.2	0	0	113.3	L5 V8 R172 V173 S174 A178	L5-M176 WeakPolarHBondContact CD2-O 3.5Å; V8-M176 HydrophobicContact CG2-CE 4.01Å; R172-M176 HydrophobicContact CG-SD 4.29Å; R172-M176 VanDerWaalsContact O-CG 3.31Å; R172-M176 WeakPolarHBondContact O-CG 3.32Å; R172-M176 PolarHBondContact O-N 3.38Å; R172-M176 VanDerWaalsContact O-N 3.08Å; V173-M176 PolarHBondContact O-N 3.26Å; S174-M176 PolarHBondContact O-N 3.03Å; M176-A178 HydrophobicContact CB-CB 4.3Å; M176-A178 PolarHBondContact O-N 3.18Å
177	G	88	Confident	91.9	Very high	53 Å²	53	52.7 Å²	52.7	55%	0.546	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.3	24.7	-172.4	0	0	0	0	0	113.1	V173 S174 Q175	V173-G177 PolarHBondContact O-N 3.01Å; S174-G177 PolarHBondContact O-N 3.48Å; Q175-G177 VanDerWaalsContact C-N 3.3Å
178	A	88.9	Confident	91.9	Very high	5 Å²	5	49.4 Å²	49.4	4%	0.041	27%	0.266	C	S	.	.			trans	-94.6	-5	-176	0	0	0	0	0	113.3	V173 M176 A180 H181 V182	V173-A178 HydrophobicContact CG1-CB 4.17Å; V173-A178 PolarHBondContact O-N 3.05Å; M176-A178 HydrophobicContact CB-CB 4.3Å; M176-A178 PolarHBondContact O-N 3.18Å; A178-A180 PolarHBondContact O-N 3.43Å; A178-H181 WeakPolarHBondContact O-CB 3.5Å; A178-H181 PolarHBondContact O-N 3.01Å; A178-V182 PolarHBondContact O-N 3.18Å
179	E	89.1	Confident	92	Very high	81 Å²	81	45.8 Å²	45.8	38%	0.379	25%	0.25	S	C	.	.	H	α-helix	trans	-47.8	-52.1	-177	174.1	177.8	-177.9	0	0	113.3	F170 V173 H181 V182 N183	F170-E179 HydrophobicContact CE1-CG 4.49Å; F170-E179 HydrophobicContact CE2-CG 4.07Å; F170-E179 HydrophobicContact CZ-CB 4.4Å; F170-E179 HydrophobicContact CZ-CG 3.58Å; F170-E179 WeakPolarHBondContact CZ-OE1 3.28Å; V173-E179 HydrophobicContact CG1-CB 4.41Å; E179-H181 PolarHBondContact O-N 3.12Å; E179-H181 VanDerWaalsContact O-N 3.16Å; E179-V182 PolarHBondContact O-N 2.84Å; E179-V182 VanDerWaalsContact O-N 3.12Å; E179-N183 VanDerWaalsContact CG-ND2 3.32Å; E179-N183 WeakPolarHBondContact CG-ND2 3.33Å; E179-N183 WeakPolarHBondContact O-CB 3.32Å; E179-N183 VanDerWaalsContact O-CG 3.3Å; E179-N183 PolarHBondContact O-N 2.93Å; E179-N183 PolarHBondContact OE1-ND2 2.98Å
180	A	88.4	Confident	92	Very high	63 Å²	63	47 Å²	47	52%	0.521	25%	0.254	S	S	.	.	H	α-helix	trans	-58.4	-33.3	-178.2	0	0	0	0	0	112.8	A178 T184	A178-A180 PolarHBondContact O-N 3.43Å; A180-T184 VanDerWaalsContact O-CB 3.29Å; A180-T184 WeakPolarHBondContact O-CB 3.26Å; A180-T184 PolarHBondContact O-N 2.99Å; A180-T184 PolarHBondContact O-OG1 3.26Å
181	H	88.1	Confident	92.2	Very high	100 Å²	100	45.8 Å²	45.8	46%	0.463	25%	0.248	S	C	.	.	H	α-helix	trans	-73.1	-43.2	178.4	-59.6	86.7	0	0	0	111.3	A178 E179 C185	A178-H181 WeakPolarHBondContact O-CB 3.5Å; A178-H181 PolarHBondContact O-N 3.01Å; E179-H181 PolarHBondContact O-N 3.12Å; E179-H181 VanDerWaalsContact O-N 3.16Å; H181-C185 WeakPolarHBondContact O-CB 3.31Å; H181-C185 PolarHBondContact O-N 3.45Å
182	V	93.3	Very high	92.5	Very high	3 Å²	3	39.7 Å²	39.7	2%	0.018	22%	0.216	C	C	.	.	H	α-helix	trans	-63.4	-47.2	175.6	-178.1	0	0	0	0	109.8	I74 F162 V165 Y166 V173 A178 E179 T184 C185 Y186	I74-V182 HydrophobicContact CD1-CG1 4.48Å; I74-V182 HydrophobicContact CD1-CG2 4.3Å; I74-V182 HydrophobicContact CG1-CG2 4.17Å; I74-V182 HydrophobicContact CG2-CG1 4.35Å; I74-V182 HydrophobicContact CG2-CG2 3.87Å; F162-V182 HydrophobicContact CD1-CG1 4.48Å; V165-V182 HydrophobicContact CG1-CG1 4.45Å; Y166-V182 HydrophobicContact CE1-CG1 4.43Å; Y166-V182 HydrophobicContact CE2-CG1 4.13Å; V173-V182 HydrophobicContact CG1-CB 4.31Å; V173-V182 HydrophobicContact CG1-CG2 3.65Å; V173-V182 HydrophobicContact CG2-CG2 4.44Å; A178-V182 PolarHBondContact O-N 3.18Å; E179-V182 PolarHBondContact O-N 2.84Å; E179-V182 VanDerWaalsContact O-N 3.12Å; V182-T184 PolarHBondContact O-N 2.92Å; V182-C185 PolarHBondContact O-N 3.06Å; V182-Y186 WeakPolarHBondContact O-CB 3.42Å; V182-Y186 PolarHBondContact O-N 2.92Å
183	N	92.9	Very high	92.8	Very high	27 Å²	27	35.5 Å²	35.5	14%	0.144	20%	0.2	C	C	.	.	H	α-helix	trans	-59.9	-45.2	178.5	-73.5	-6.2	0	0	0	112.6	Y166 E179 Y186 K187 M214	Y166-N183 WeakPolarHBondContact CE1-OD1 3.22Å; Y166-N183 WeakPolarHBondContact OH-CA 3.33Å; Y166-N183 PolarHBondContact OH-OD1 2.61Å; E179-N183 VanDerWaalsContact CG-ND2 3.32Å; E179-N183 WeakPolarHBondContact CG-ND2 3.33Å; E179-N183 WeakPolarHBondContact O-CB 3.32Å; E179-N183 VanDerWaalsContact O-CG 3.3Å; E179-N183 PolarHBondContact O-N 2.93Å; E179-N183 PolarHBondContact OE1-ND2 2.98Å; N183-Y186 PolarHBondContact O-N 3.3Å; N183-K187 WeakPolarHBondContact O-CG 3.21Å; N183-K187 PolarHBondContact O-N 3.34Å; N183-M214 HydrophobicContact CB-CE 3.46Å; N183-M214 VanDerWaalsContact CB-CE 3.46Å; N183-M214 VanDerWaalsContact CG-CE 3.48Å; N183-M214 WeakPolarHBondContact OD1-CE 3.44Å
184	T	92.7	Very high	93.1	Very high	68 Å²	68	37.9 Å²	37.9	42%	0.417	21%	0.214	S	C	.	.	H	α-helix	trans	-65.8	-41.3	177	-57.9	0	0	0	0	111.3	A180 V182 Y186 H188	A180-T184 VanDerWaalsContact O-CB 3.29Å; A180-T184 WeakPolarHBondContact O-CB 3.26Å; A180-T184 PolarHBondContact O-N 2.99Å; A180-T184 PolarHBondContact O-OG1 3.26Å; V182-T184 PolarHBondContact O-N 2.92Å; T184-Y186 VanDerWaalsContact C-N 3.34Å; T184-H188 WeakPolarHBondContact O-CB 3.31Å; T184-H188 PolarHBondContact O-N 2.96Å
185	C	95.2	Very high	93.4	Very high	3 Å²	3	40.9 Å²	40.9	2%	0.02	22%	0.223	C	C	.	.	H	α-helix	trans	-63.5	-41.3	175.9	-164.7	0	0	0	0	112	R70 I74 F162 H181 V182 F189	R70-C185 PolarHBondContact NE-SG 3.43Å; I74-C185 HydrophobicContact CD1-CB 3.8Å; F162-C185 HydrophobicContact CE1-CB 4.36Å; F162-C185 HydrophobicContact CZ-CB 4.27Å; H181-C185 WeakPolarHBondContact O-CB 3.31Å; H181-C185 PolarHBondContact O-N 3.45Å; V182-C185 PolarHBondContact O-N 3.06Å; C185-F189 VanDerWaalsContact O-CB 3.28Å; C185-F189 WeakPolarHBondContact O-CB 3.42Å; C185-F189 PolarHBondContact O-N 3.43Å
186	Y	96.6	Very high	93.7	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-65.4	-48.4	177.5	178.4	-106.5	0	0	0	112.1	F159 F162 Y166 V182 N183 T184 H188 F189 Y190 L207 M210 T211 M214	F159-Y186 HydrophobicContact CD2-CE2 4.28Å; F159-Y186 AromaticContact CE2-CE2 3.8Å; F159-Y186 HydrophobicContact CE2-CE2 3.8Å; F162-Y186 HydrophobicContact CB-CD2 3.94Å; F162-Y186 HydrophobicContact CB-CE2 4.25Å; F162-Y186 AromaticContact CD1-CD2 3.88Å; F162-Y186 HydrophobicContact CD1-CD2 3.88Å; F162-Y186 HydrophobicContact CD1-CG 4.42Å; F162-Y186 AromaticContact CD2-CD2 3.89Å; F162-Y186 HydrophobicContact CD2-CD2 3.89Å; F162-Y186 HydrophobicContact CE1-CD2 4.3Å; F162-Y186 HydrophobicContact CE2-CD2 4.29Å; F162-Y186 AromaticContact CG-CD2 3.66Å; F162-Y186 HydrophobicContact CG-CD2 3.66Å; F162-Y186 HydrophobicContact CG-CE2 4.36Å; F162-Y186 HydrophobicContact CZ-CD2 4.48Å; Y166-Y186 HydrophobicContact CE2-CD1 4.39Å; Y166-Y186 HydrophobicContact CE2-CD2 4.06Å; Y166-Y186 AromaticContact CE2-CG 3.87Å; Y166-Y186 HydrophobicContact CE2-CG 3.87Å; Y166-Y186 WeakPolarHBondContact OH-CB 2.96Å; V182-Y186 WeakPolarHBondContact O-CB 3.42Å; V182-Y186 PolarHBondContact O-N 2.92Å; N183-Y186 PolarHBondContact O-N 3.3Å; T184-Y186 VanDerWaalsContact C-N 3.34Å; Y186-H188 VanDerWaalsContact C-N 3.33Å; Y186-H188 PolarHBondContact O-N 3.14Å; Y186-F189 WeakPolarHBondContact O-CB 3.41Å; Y186-F189 PolarHBondContact O-N 2.73Å; Y186-Y190 WeakPolarHBondContact O-CB 3.36Å; Y186-Y190 PolarHBondContact O-N 3.42Å; Y186-L207 HydrophobicContact CD2-CD1 4.47Å; Y186-L207 HydrophobicContact CE2-CD1 3.66Å; Y186-L207 WeakPolarHBondContact OH-CB 3.31Å; Y186-M210 HydrophobicContact CD1-CE 3.7Å; Y186-M210 HydrophobicContact CE1-CE 3.38Å; Y186-M210 HydrophobicContact CE2-CE 4.26Å; Y186-M210 HydrophobicContact CG-CE 4.26Å; Y186-T211 PolarHBondContact OH-OG1 3.3Å; Y186-M214 HydrophobicContact CD1-CE 4Å; Y186-M214 HydrophobicContact CD1-SD 4.26Å
187	K	94.9	Very high	94.1	Very high	64 Å²	64	39.3 Å²	39.3	28%	0.278	22%	0.218	S	C	.	.	H	α-helix	trans	-57.4	-47.3	176.7	-72.7	-178.1	-175.4	-160.7	0	111.5	L44 N183 F189 Y190 Y191 M214	L44-K187 HydrophobicContact CD1-CB 3.63Å; L44-K187 HydrophobicContact CD1-CD 4.33Å; N183-K187 WeakPolarHBondContact O-CG 3.21Å; N183-K187 PolarHBondContact O-N 3.34Å; K187-F189 VanDerWaalsContact C-N 3.34Å; K187-F189 PolarHBondContact O-N 3.15Å; K187-Y190 PolarHBondContact O-N 2.71Å; K187-Y191 HydrophobicContact CB-CE2 4.48Å; K187-Y191 VanDerWaalsContact O-CD2 3.31Å; K187-Y191 WeakPolarHBondContact O-CD2 3.49Å; K187-Y191 PolarHBondContact O-N 3.3Å; K187-M214 WeakPolarHBondContact CE-O 3.43Å; K187-M214 HydrophobicContact CG-CE 4.02Å; K187-M214 PolarHBondContact NZ-O 2.72Å
188	H	95.7	Very high	94.5	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.009	19%	0.193	C	C	.	.	H	α-helix	trans	-60	-45.6	177.2	-177.3	-136.5	0	0	0	111.5	V48 H63 F67 R70 T184 Y186 F192	V48-H188 VanDerWaalsContact CG1-CD2 3.42Å; V48-H188 WeakPolarHBondContact CG1-CD2 3.33Å; H63-H188 AromaticContact CD2-CE1 3.91Å; H63-H188 AromaticContact CD2-NE2 3.98Å; H63-H188 AromaticContact NE2-NE2 3.92Å; F67-H188 HydrophobicContact CE1-CB 4.24Å; F67-H188 AromaticContact CE1-CE1 3.84Å; F67-H188 AromaticContact CE1-CG 3.84Å; F67-H188 AromaticContact CE1-ND1 3.25Å; F67-H188 VanDerWaalsContact CE1-ND1 3.25Å; F67-H188 WeakPolarHBondContact CE1-ND1 3.28Å; F67-H188 AromaticContact CZ-CE1 3.67Å; F67-H188 AromaticContact CZ-CG 3.94Å; F67-H188 AromaticContact CZ-ND1 3.5Å; R70-H188 PolarHBondContact NH1-ND1 2.87Å; T184-H188 WeakPolarHBondContact O-CB 3.31Å; T184-H188 PolarHBondContact O-N 2.96Å; Y186-H188 VanDerWaalsContact C-N 3.33Å; Y186-H188 PolarHBondContact O-N 3.14Å; H188-F192 WeakPolarHBondContact O-CB 3.03Å; H188-F192 PolarHBondContact O-N 3.07Å; H188-F192 VanDerWaalsContact O-N 3.07Å
189	F	97.4	Very high	94.8	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-60	-49.9	175.7	178	-84.6	0	0	0	111.8	F67 I71 L155 L158 F159 F162 C185 Y186 K187 F192 V193	F67-F189 HydrophobicContact CB-CD2 4.2Å; F67-F189 HydrophobicContact CD1-CB 3.99Å; F67-F189 AromaticContact CD1-CD2 3.91Å; F67-F189 HydrophobicContact CD1-CD2 3.91Å; F67-F189 HydrophobicContact CD1-CG 4.47Å; F67-F189 AromaticContact CD2-CD2 3.98Å; F67-F189 HydrophobicContact CD2-CD2 3.98Å; F67-F189 VanDerWaalsContact CE1-CA 3.41Å; F67-F189 HydrophobicContact CE1-CB 3.7Å; F67-F189 HydrophobicContact CE1-CD2 4.29Å; F67-F189 HydrophobicContact CE1-CG 4.49Å; F67-F189 HydrophobicContact CE2-CD2 4.36Å; F67-F189 AromaticContact CG-CD2 3.78Å; F67-F189 HydrophobicContact CG-CD2 3.78Å; F67-F189 VanDerWaalsContact CZ-CA 3.44Å; F67-F189 HydrophobicContact CZ-CB 4.15Å; I71-F189 HydrophobicContact CD1-CD2 4.11Å; I71-F189 HydrophobicContact CD1-CE2 4.33Å; L155-F189 HydrophobicContact CB-CE2 4.35Å; L155-F189 HydrophobicContact CB-CZ 4.24Å; L155-F189 HydrophobicContact CD2-CD2 4.36Å; L155-F189 HydrophobicContact CD2-CE2 3.61Å; L155-F189 HydrophobicContact CD2-CZ 4.3Å; L155-F189 VanDerWaalsContact O-CZ 3.32Å; L155-F189 WeakPolarHBondContact O-CZ 3.31Å; L158-F189 HydrophobicContact CB-CE2 4.18Å; F159-F189 HydrophobicContact CB-CE1 3.97Å; F159-F189 HydrophobicContact CB-CZ 4.08Å; F159-F189 AromaticContact CD2-CE1 3.94Å; F159-F189 HydrophobicContact CD2-CE1 3.94Å; F159-F189 HydrophobicContact CG-CE1 4.44Å; F162-F189 HydrophobicContact CD2-CD1 4.34Å; F162-F189 HydrophobicContact CD2-CG 4.42Å; F162-F189 HydrophobicContact CE2-CB 3.84Å; F162-F189 HydrophobicContact CE2-CD1 4.06Å; F162-F189 HydrophobicContact CE2-CD2 4.04Å; F162-F189 AromaticContact CE2-CG 3.7Å; F162-F189 HydrophobicContact CE2-CG 3.7Å; F162-F189 HydrophobicContact CZ-CB 4.26Å; C185-F189 VanDerWaalsContact O-CB 3.28Å; C185-F189 WeakPolarHBondContact O-CB 3.42Å; C185-F189 PolarHBondContact O-N 3.43Å; Y186-F189 WeakPolarHBondContact O-CB 3.41Å; Y186-F189 PolarHBondContact O-N 2.73Å; K187-F189 VanDerWaalsContact C-N 3.34Å; K187-F189 PolarHBondContact O-N 3.15Å; F189-F192 PolarHBondContact O-N 3.29Å; F189-V193 HydrophobicContact CD1-CG1 4.17Å; F189-V193 HydrophobicContact CD1-CG2 4.27Å; F189-V193 HydrophobicContact CD2-CG1 4.43Å; F189-V193 HydrophobicContact CE1-CB 4.49Å; F189-V193 HydrophobicContact CE1-CG1 3.7Å; F189-V193 HydrophobicContact CE1-CG2 3.98Å; F189-V193 HydrophobicContact CE2-CG1 4.02Å; F189-V193 HydrophobicContact CG-CG1 4.5Å; F189-V193 HydrophobicContact CZ-CG1 3.61Å; F189-V193 WeakPolarHBondContact O-CG1 3.5Å; F189-V193 WeakPolarHBondContact O-CG2 3.38Å; F189-V193 PolarHBondContact O-N 3.44Å
190	Y	97	Very high	94.9	Very high	37 Å²	37	37.3 Å²	37.3	15%	0.145	20%	0.197	C	C	.	.	H	α-helix	trans	-58.7	-52.6	-177.9	177.5	-102.1	0	0	0	111	Y186 K187 F192 V193 T194 L204 T211 C215	Y186-Y190 WeakPolarHBondContact O-CB 3.36Å; Y186-Y190 PolarHBondContact O-N 3.42Å; K187-Y190 PolarHBondContact O-N 2.71Å; Y190-F192 VanDerWaalsContact C-N 3.3Å; Y190-F192 PolarHBondContact O-N 3.23Å; Y190-V193 VanDerWaalsContact O-CG2 3.31Å; Y190-V193 WeakPolarHBondContact O-CG2 3.49Å; Y190-V193 PolarHBondContact O-N 2.94Å; Y190-T194 HydrophobicContact CD1-CG2 4.49Å; Y190-T194 HydrophobicContact CD2-CG2 4.16Å; Y190-T194 HydrophobicContact CE1-CG2 4.1Å; Y190-T194 HydrophobicContact CE2-CG2 3.74Å; Y190-T194 WeakPolarHBondContact O-CG2 3.37Å; Y190-T194 PolarHBondContact O-N 2.88Å; Y190-T194 PolarHBondContact O-OG1 3.25Å; Y190-L204 HydrophobicContact CD2-CD1 4.41Å; Y190-L204 HydrophobicContact CE2-CD1 3.99Å; Y190-T211 HydrophobicContact CD1-CG2 3.81Å; Y190-T211 HydrophobicContact CD2-CG2 3.8Å; Y190-T211 HydrophobicContact CE1-CG2 3.5Å; Y190-T211 VanDerWaalsContact CE1-CG2 3.5Å; Y190-T211 HydrophobicContact CE2-CG2 3.49Å; Y190-T211 VanDerWaalsContact CE2-CG2 3.49Å; Y190-T211 HydrophobicContact CG-CG2 3.95Å; Y190-C215 HydrophobicContact CD1-CB 4.37Å; Y190-C215 HydrophobicContact CE1-CB 4.41Å
191	Y	96.2	Very high	95	Very high	26 Å²	26	40.4 Å²	40.4	10%	0.102	20%	0.2	C	C	.	.	H	α-helix	trans	-59.8	-41.3	178.4	-66	-36.1	0	0	0	112.4	L44 K45 K187 T194 E195 C215	L44-Y191 HydrophobicContact CB-CD2 3.56Å; L44-Y191 HydrophobicContact CB-CE2 3.74Å; L44-Y191 HydrophobicContact CD1-CE2 4.41Å; K45-Y191 HydrophobicContact CD-CE1 4.22Å; K45-Y191 VanDerWaalsContact CE-CZ 3.48Å; K45-Y191 WeakPolarHBondContact CE-OH 3.08Å; K45-Y191 HydrophobicContact CG-CD1 3.87Å; K45-Y191 HydrophobicContact CG-CD2 3.88Å; K45-Y191 HydrophobicContact CG-CE1 3.85Å; K45-Y191 HydrophobicContact CG-CE2 3.85Å; K45-Y191 HydrophobicContact CG-CG 3.89Å; K187-Y191 HydrophobicContact CB-CE2 4.48Å; K187-Y191 VanDerWaalsContact O-CD2 3.31Å; K187-Y191 WeakPolarHBondContact O-CD2 3.49Å; K187-Y191 PolarHBondContact O-N 3.3Å; Y191-T194 WeakPolarHBondContact CA-OG1 3.19Å; Y191-T194 PolarHBondContact O-N 2.88Å; Y191-T194 PolarHBondContact O-OG1 3.29Å; Y191-E195 WeakPolarHBondContact O-CB 3.42Å; Y191-E195 PolarHBondContact O-N 2.92Å; Y191-C215 HydrophobicContact CE1-CB 3.77Å; Y191-C215 WeakPolarHBondContact OH-CA 3.3Å; Y191-C215 WeakPolarHBondContact OH-CB 3.48Å; Y191-C215 PolarHBondContact OH-O 3.41Å
192	F	97.8	Very high	95.1	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.3	-47.4	178.1	-172.2	-94	0	0	0	112.5	V48 W59 V60 H63 F67 H188 F189 Y190 T194 E195 F196 L198	V48-F192 HydrophobicContact CB-CB 4.27Å; V48-F192 HydrophobicContact CB-CD2 3.98Å; V48-F192 HydrophobicContact CG1-CB 3.87Å; V48-F192 HydrophobicContact CG1-CD2 4.16Å; W59-F192 AromaticContact CD1-CE2 3.86Å; W59-F192 AromaticContact NE1-CE2 3.7Å; V60-F192 HydrophobicContact CB-CZ 4.48Å; V60-F192 HydrophobicContact CG2-CE1 4.41Å; V60-F192 HydrophobicContact CG2-CZ 4Å; H63-F192 HydrophobicContact CB-CD1 4.07Å; H63-F192 HydrophobicContact CB-CD2 4.12Å; H63-F192 HydrophobicContact CB-CE1 3.55Å; H63-F192 HydrophobicContact CB-CE2 3.63Å; H63-F192 HydrophobicContact CB-CG 4.34Å; H63-F192 HydrophobicContact CB-CZ 3.35Å; H63-F192 AromaticContact CD2-CD2 3.37Å; H63-F192 WeakPolarHBondContact CD2-CD2 3.48Å; H63-F192 AromaticContact CD2-CE2 3.43Å; H63-F192 VanDerWaalsContact CD2-CE2 3.43Å; H63-F192 WeakPolarHBondContact CD2-CE2 3.21Å; H63-F192 AromaticContact CE1-CE2 3.86Å; H63-F192 AromaticContact CG-CD2 3.59Å; H63-F192 AromaticContact CG-CE2 3.15Å; H63-F192 AromaticContact CG-CZ 3.44Å; H63-F192 VanDerWaalsContact CG-CZ 3.44Å; H63-F192 AromaticContact ND1-CE2 3.43Å; H63-F192 WeakPolarHBondContact ND1-CE2 3.44Å; H63-F192 AromaticContact ND1-CZ 3.84Å; H63-F192 AromaticContact NE2-CD2 3.92Å; H63-F192 AromaticContact NE2-CE2 3.89Å; F67-F192 HydrophobicContact CE2-CB 3.81Å; F67-F192 AromaticContact CE2-CD1 3.67Å; F67-F192 HydrophobicContact CE2-CD1 3.67Å; F67-F192 HydrophobicContact CE2-CE1 4.44Å; F67-F192 AromaticContact CE2-CG 3.73Å; F67-F192 HydrophobicContact CE2-CG 3.73Å; F67-F192 HydrophobicContact CZ-CB 3.83Å; F67-F192 HydrophobicContact CZ-CG 4.19Å; H188-F192 WeakPolarHBondContact O-CB 3.03Å; H188-F192 PolarHBondContact O-N 3.07Å; H188-F192 VanDerWaalsContact O-N 3.07Å; F189-F192 PolarHBondContact O-N 3.29Å; Y190-F192 VanDerWaalsContact C-N 3.3Å; Y190-F192 PolarHBondContact O-N 3.23Å; F192-T194 VanDerWaalsContact C-N 3.31Å; F192-T194 PolarHBondContact O-N 3.33Å; F192-E195 PolarHBondContact O-N 3.1Å; F192-F196 HydrophobicContact CD2-CD2 4.06Å; F192-F196 AromaticContact CD2-CE2 3.83Å; F192-F196 HydrophobicContact CD2-CE2 3.83Å; F192-F196 HydrophobicContact CE1-CD2 4.23Å; F192-F196 AromaticContact CE2-CD2 3.72Å; F192-F196 HydrophobicContact CE2-CD2 3.72Å; F192-F196 AromaticContact CE2-CE2 3.41Å; F192-F196 HydrophobicContact CE2-CE2 3.41Å; F192-F196 VanDerWaalsContact CE2-CE2 3.41Å; F192-F196 HydrophobicContact CG-CD2 4.43Å; F192-F196 AromaticContact CZ-CD2 3.78Å; F192-F196 HydrophobicContact CZ-CD2 3.78Å; F192-F196 AromaticContact CZ-CE2 3.9Å; F192-F196 HydrophobicContact CZ-CE2 3.9Å; F192-F196 WeakPolarHBondContact O-CD2 3.46Å; F192-F196 PolarHBondContact O-N 3.44Å; F192-L198 HydrophobicContact CD1-CD1 3.85Å; F192-L198 HydrophobicContact CE1-CD1 3.39Å; F192-L198 HydrophobicContact CZ-CD1 4.25Å
193	V	97.8	Very high	95	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.006	23%	0.228	C	C	.	.	H	α-helix	trans	-70.4	-29.3	-178.7	-59.2	0	0	0	0	112.5	L155 F189 Y190 N197 L198 L204	L155-V193 HydrophobicContact CB-CG1 4.15Å; L155-V193 HydrophobicContact CD1-CG1 4.24Å; L155-V193 HydrophobicContact CD2-CG1 4.25Å; L155-V193 HydrophobicContact CG-CG1 4.44Å; F189-V193 HydrophobicContact CD1-CG1 4.17Å; F189-V193 HydrophobicContact CD1-CG2 4.27Å; F189-V193 HydrophobicContact CD2-CG1 4.43Å; F189-V193 HydrophobicContact CE1-CB 4.49Å; F189-V193 HydrophobicContact CE1-CG1 3.7Å; F189-V193 HydrophobicContact CE1-CG2 3.98Å; F189-V193 HydrophobicContact CE2-CG1 4.02Å; F189-V193 HydrophobicContact CG-CG1 4.5Å; F189-V193 HydrophobicContact CZ-CG1 3.61Å; F189-V193 WeakPolarHBondContact O-CG1 3.5Å; F189-V193 WeakPolarHBondContact O-CG2 3.38Å; F189-V193 PolarHBondContact O-N 3.44Å; Y190-V193 VanDerWaalsContact O-CG2 3.31Å; Y190-V193 WeakPolarHBondContact O-CG2 3.49Å; Y190-V193 PolarHBondContact O-N 2.94Å; V193-N197 CarbonylContact O-C 3.59Å; V193-N197 WeakPolarHBondContact O-CA 3.48Å; V193-N197 PolarHBondContact O-N 2.92Å; V193-L198 HydrophobicContact CB-CB 4.23Å; V193-L198 HydrophobicContact CG1-CB 4.39Å; V193-L198 PolarHBondContact O-N 2.93Å; V193-L204 HydrophobicContact CG2-CD2 4.49Å
194	T	95.9	Very high	95.1	Very high	49 Å²	49	46 Å²	46	30%	0.301	22%	0.224	S	C	.	.	H	α-helix	trans	-76.4	-40	175.1	54.8	0	0	0	0	112.5	Y190 Y191 F192 F196 N197 L204	Y190-T194 HydrophobicContact CD1-CG2 4.49Å; Y190-T194 HydrophobicContact CD2-CG2 4.16Å; Y190-T194 HydrophobicContact CE1-CG2 4.1Å; Y190-T194 HydrophobicContact CE2-CG2 3.74Å; Y190-T194 WeakPolarHBondContact O-CG2 3.37Å; Y190-T194 PolarHBondContact O-N 2.88Å; Y190-T194 PolarHBondContact O-OG1 3.25Å; Y191-T194 WeakPolarHBondContact CA-OG1 3.19Å; Y191-T194 PolarHBondContact O-N 2.88Å; Y191-T194 PolarHBondContact O-OG1 3.29Å; F192-T194 VanDerWaalsContact C-N 3.31Å; F192-T194 PolarHBondContact O-N 3.33Å; T194-F196 VanDerWaalsContact C-N 3.29Å; T194-F196 PolarHBondContact O-N 3.3Å; T194-N197 PolarHBondContact O-N 3.24Å; T194-L204 HydrophobicContact CG2-CD1 4.27Å
195	E	96.2	Very high	95.2	Very high	109 Å²	109	46.4 Å²	46.4	51%	0.509	22%	0.221	S	C	.	.	H	α-helix	trans	-56.5	-44.2	179.8	179.8	65.4	-169.1	0	0	111.3	V48 Y191 F192	V48-E195 HydrophobicContact CG2-CB 4.32Å; V48-E195 HydrophobicContact CG2-CG 4.49Å; Y191-E195 WeakPolarHBondContact O-CB 3.42Å; Y191-E195 PolarHBondContact O-N 2.92Å; F192-E195 PolarHBondContact O-N 3.1Å
196	F	97.3	Very high	95.2	Very high	38 Å²	38	47.4 Å²	47.4	17%	0.167	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	11.6	-175.9	-57.7	-67.5	0	0	0	113.9	V48 L50 L56 W59 F192 T194 L198	V48-F196 WeakPolarHBondContact O-CE2 3.35Å; V48-F196 WeakPolarHBondContact O-CZ 3.29Å; L50-F196 HydrophobicContact CB-CE1 4.09Å; L50-F196 HydrophobicContact CB-CZ 4.05Å; L56-F196 HydrophobicContact CD1-CD1 3.5Å; L56-F196 HydrophobicContact CD1-CE1 3.59Å; L56-F196 HydrophobicContact CD1-CG 4.2Å; L56-F196 HydrophobicContact CD1-CZ 4.36Å; W59-F196 AromaticContact CD1-CE2 3.76Å; W59-F196 AromaticContact CD1-CZ 3.61Å; W59-F196 AromaticContact NE1-CE2 3.81Å; W59-F196 AromaticContact NE1-CZ 3.77Å; F192-F196 HydrophobicContact CD2-CD2 4.06Å; F192-F196 AromaticContact CD2-CE2 3.83Å; F192-F196 HydrophobicContact CD2-CE2 3.83Å; F192-F196 HydrophobicContact CE1-CD2 4.23Å; F192-F196 AromaticContact CE2-CD2 3.72Å; F192-F196 HydrophobicContact CE2-CD2 3.72Å; F192-F196 AromaticContact CE2-CE2 3.41Å; F192-F196 HydrophobicContact CE2-CE2 3.41Å; F192-F196 VanDerWaalsContact CE2-CE2 3.41Å; F192-F196 HydrophobicContact CG-CD2 4.43Å; F192-F196 AromaticContact CZ-CD2 3.78Å; F192-F196 HydrophobicContact CZ-CD2 3.78Å; F192-F196 AromaticContact CZ-CE2 3.9Å; F192-F196 HydrophobicContact CZ-CE2 3.9Å; F192-F196 WeakPolarHBondContact O-CD2 3.46Å; F192-F196 PolarHBondContact O-N 3.44Å; T194-F196 VanDerWaalsContact C-N 3.29Å; T194-F196 PolarHBondContact O-N 3.3Å; F196-L198 VanDerWaalsContact C-N 3.32Å; F196-L198 HydrophobicContact CB-CD1 3.82Å; F196-L198 HydrophobicContact CB-CD2 4.08Å; F196-L198 HydrophobicContact CB-CG 3.67Å; F196-L198 HydrophobicContact CD2-CD1 4.5Å; F196-L198 PolarHBondContact O-N 2.92Å
197	N	96.4	Very high	95.1	Very high	96 Å²	96	47.7 Å²	47.7	51%	0.513	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.6	50.6	-178.6	-171.9	21.1	0	0	0	112.9	K152 V193 T194	K152-N197 WeakPolarHBondContact CE-O 3.4Å; K152-N197 PolarHBondContact NZ-O 3.3Å; V193-N197 CarbonylContact O-C 3.59Å; V193-N197 WeakPolarHBondContact O-CA 3.48Å; V193-N197 PolarHBondContact O-N 2.92Å; T194-N197 PolarHBondContact O-N 3.24Å
198	L	97.1	Very high	95	Very high	3 Å²	3	50 Å²	50	2%	0.016	24%	0.238	C	C	.	.			trans	-91.9	-11	-173.6	-59.5	174.7	0	0	0	113.7	V60 M148 K152 L155 F192 V193 F196	V60-L198 HydrophobicContact CG1-CD1 4.35Å; V60-L198 HydrophobicContact CG2-CD1 4.2Å; M148-L198 HydrophobicContact SD-CD2 3.4Å; M148-L198 WeakPolarHBondContact SD-CD2 3.32Å; K152-L198 WeakPolarHBondContact CA-O 3.16Å; K152-L198 WeakPolarHBondContact CB-O 3.43Å; K152-L198 HydrophobicContact CG-CB 4.35Å; K152-L198 HydrophobicContact CG-CD2 4.08Å; K152-L198 WeakPolarHBondContact CG-O 3.37Å; L155-L198 HydrophobicContact CD1-CB 3.69Å; L155-L198 HydrophobicContact CD1-CD1 3.5Å; L155-L198 VanDerWaalsContact CD1-CD1 3.5Å; L155-L198 HydrophobicContact CD1-CG 4.14Å; F192-L198 HydrophobicContact CD1-CD1 3.85Å; F192-L198 HydrophobicContact CE1-CD1 3.39Å; F192-L198 HydrophobicContact CZ-CD1 4.25Å; V193-L198 HydrophobicContact CB-CB 4.23Å; V193-L198 HydrophobicContact CG1-CB 4.39Å; V193-L198 PolarHBondContact O-N 2.93Å; F196-L198 VanDerWaalsContact C-N 3.32Å; F196-L198 HydrophobicContact CB-CD1 3.82Å; F196-L198 HydrophobicContact CB-CD2 4.08Å; F196-L198 HydrophobicContact CB-CG 3.67Å; F196-L198 HydrophobicContact CD2-CD1 4.5Å; F196-L198 PolarHBondContact O-N 2.92Å
199	T	94.6	Very high	94.7	Very high	6 Å²	6	57.5 Å²	57.5	4%	0.037	27%	0.274	C	S	.	.	S	Bend	trans	-137.3	134.9	177.1	-57.1	0	0	0	0	108.6	E203 L204	T199-E203 HydrophobicContact CG2-CB 3.83Å; T199-L204 HydrophobicContact CG2-CD2 3.74Å; T199-L204 HydrophobicContact CG2-CG 3.94Å
200	D	91.8	Very high	94.3	Very high	89 Å²	89	59.2 Å²	59.2	48%	0.476	28%	0.282	S	S	.	.			trans	-63.2	136.5	174.9	-171.7	-30.3	0	0	0	109.8	K202 E203 L204	D200-K202 PolarHBondContact O-N 3.34Å; D200-K202 VanDerWaalsContact O-N 3.1Å; D200-K202 PolarHBondContact OD1-N 3.48Å; D200-E203 HydrophobicContact CB-CG 4.39Å; D200-E203 WeakPolarHBondContact O-CB 3.11Å; D200-E203 PolarHBondContact O-N 3.43Å; D200-L204 PolarHBondContact O-N 3.16Å
201	H	89.9	Confident	94	Very high	127 Å²	127	57.7 Å²	57.7	59%	0.588	28%	0.277	S	S	*	.	H	α-helix	trans	-51.4	-33.4	175.1	-74.6	-74.5	0	0	0	113.1	E203 L204 E205	H201-E203 VanDerWaalsContact C-N 3.32Å; H201-E203 PolarHBondContact O-N 3.41Å; H201-L204 PolarHBondContact O-N 3.24Å; H201-L204 VanDerWaalsContact O-N 3.13Å; H201-E205 PolarHBondContact O-N 3.13Å
202	K	90.7	Very high	93.7	Very high	169 Å²	169	59.6 Å²	59.6	74%	0.735	29%	0.294	S	S	*	.	H	α-helix	trans	-64	-35.4	176.4	-67	178.7	-177.4	174.4	0	113	D200 L204 E205	D200-K202 PolarHBondContact O-N 3.34Å; D200-K202 VanDerWaalsContact O-N 3.1Å; D200-K202 PolarHBondContact OD1-N 3.48Å; K202-L204 PolarHBondContact O-N 3.41Å; K202-E205 WeakPolarHBondContact O-CB 3.41Å; K202-E205 PolarHBondContact O-N 2.71Å
203	E	91	Very high	93.1	Very high	69 Å²	69	67.1 Å²	67.1	32%	0.322	33%	0.329	S	S	.	.	H	α-helix	trans	-70.9	-23.6	176.6	-66.3	-78.7	139.8	0	0	111.2	F159 R160 T199 D200 H201 P206	F159-E203 WeakPolarHBondContact CD1-O 3.27Å; F159-E203 WeakPolarHBondContact CE1-O 3.37Å; R160-E203 IonicContact CZ-OE2 3.39Å; R160-E203 IonicContact NE-OE2 3.13Å; R160-E203 IonicContact NH2-OE1 3.02Å; R160-E203 IonicContact NH2-OE2 2.82Å; R160-E203 PolarHBondContact NH2-OE2 3.35Å; T199-E203 HydrophobicContact CG2-CB 3.83Å; D200-E203 HydrophobicContact CB-CG 4.39Å; D200-E203 WeakPolarHBondContact O-CB 3.11Å; D200-E203 PolarHBondContact O-N 3.43Å; H201-E203 VanDerWaalsContact C-N 3.32Å; H201-E203 PolarHBondContact O-N 3.41Å; E203-P206 WeakPolarHBondContact O-CD 3.44Å
204	L	94.6	Very high	92.4	Very high	11 Å²	11	68.5 Å²	68.5	6%	0.058	34%	0.336	C	S	.	.	H	α-helix	trans	-83.5	-14.2	179.7	-59.9	175.7	0	0	0	113.8	F159 Y190 V193 T194 T199 D200 H201 K202 P206 L207	F159-L204 HydrophobicContact CD1-CD2 4.38Å; F159-L204 HydrophobicContact CD2-CD2 3.65Å; F159-L204 HydrophobicContact CE1-CD2 4.31Å; F159-L204 HydrophobicContact CE2-CD2 3.51Å; F159-L204 HydrophobicContact CG-CD2 4.08Å; F159-L204 HydrophobicContact CZ-CB 4.4Å; F159-L204 HydrophobicContact CZ-CD2 3.88Å; Y190-L204 HydrophobicContact CD2-CD1 4.41Å; Y190-L204 HydrophobicContact CE2-CD1 3.99Å; V193-L204 HydrophobicContact CG2-CD2 4.49Å; T194-L204 HydrophobicContact CG2-CD1 4.27Å; T199-L204 HydrophobicContact CG2-CD2 3.74Å; T199-L204 HydrophobicContact CG2-CG 3.94Å; D200-L204 PolarHBondContact O-N 3.16Å; H201-L204 PolarHBondContact O-N 3.24Å; H201-L204 VanDerWaalsContact O-N 3.13Å; K202-L204 PolarHBondContact O-N 3.41Å; L204-P206 VanDerWaalsContact C-N 3.33Å; L204-L207 PolarHBondContact O-N 2.95Å
205	E	94.7	Very high	91.6	Very high	76 Å²	76	66.6 Å²	66.6	36%	0.355	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-52.3	-37.2	-177.9	-164.5	69	-165.9	0	0	114.8	Y96 H201 K202 L207 K208	Y96-E205 WeakPolarHBondContact OH-CG 3.33Å; H201-E205 PolarHBondContact O-N 3.13Å; K202-E205 WeakPolarHBondContact O-CB 3.41Å; K202-E205 PolarHBondContact O-N 2.71Å; E205-L207 PolarHBondContact O-N 2.96Å; E205-L207 VanDerWaalsContact O-N 3.08Å; E205-K208 VanDerWaalsContact CD-CD 3.45Å; E205-K208 WeakPolarHBondContact O-CB 3.38Å; E205-K208 PolarHBondContact O-N 3.47Å; E205-K208 VanDerWaalsContact O-N 3.13Å; E205-K208 VanDerWaalsContact OE1-CD 3.24Å; E205-K208 WeakPolarHBondContact OE1-CD 3.42Å; E205-K208 IonicContact OE1-NZ 3.72Å; E205-K208 PolarHBondContact OE1-NZ 3.44Å; E205-K208 VanDerWaalsContact OE2-CD 3.24Å; E205-K208 WeakPolarHBondContact OE2-CD 3.48Å; E205-K208 IonicContact OE2-NZ 3.84Å; E205-K208 PolarHBondContact OE2-NZ 3.28Å; E205-K208 VanDerWaalsContact OE2-NZ 3.11Å
206	P	94.8	Very high	90.3	Very high	23 Å²	23	69.1 Å²	69.1	15%	0.149	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-58	-24.4	-179.1	-25.4	34.3	0	0	0	115.5	Y96 F159 V163 E203 L204	Y96-P206 HydrophobicContact CD1-CG 4.08Å; Y96-P206 HydrophobicContact CD2-CB 3.76Å; Y96-P206 HydrophobicContact CD2-CG 3.74Å; Y96-P206 HydrophobicContact CE1-CG 4.1Å; Y96-P206 HydrophobicContact CE2-CB 3.77Å; Y96-P206 HydrophobicContact CE2-CG 3.75Å; Y96-P206 HydrophobicContact CG-CB 4.37Å; Y96-P206 HydrophobicContact CG-CG 3.91Å; F159-P206 HydrophobicContact CE1-CG 4.48Å; V163-P206 HydrophobicContact CG1-CB 3.73Å; V163-P206 HydrophobicContact CG2-CB 3.98Å; V163-P206 HydrophobicContact CG2-CG 4.47Å; E203-P206 WeakPolarHBondContact O-CD 3.44Å; L204-P206 VanDerWaalsContact C-N 3.33Å
207	L	94.3	Very high	90	Very high	7 Å²	7	70.7 Å²	70.7	4%	0.037	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-117.4	15.5	179.1	-66	174.9	0	0	0	112.8	F159 F162 V163 Y166 Y186 L204 E205 E209 M210 T211	F159-L207 HydrophobicContact CE2-CB 4.49Å; F159-L207 HydrophobicContact CE2-CD1 3.92Å; F159-L207 HydrophobicContact CZ-CB 4.01Å; F159-L207 HydrophobicContact CZ-CD1 3.84Å; F159-L207 HydrophobicContact CZ-CG 4.08Å; F162-L207 HydrophobicContact CB-CD1 4.05Å; V163-L207 HydrophobicContact CB-CD1 4.4Å; V163-L207 HydrophobicContact CB-CG 4.46Å; V163-L207 HydrophobicContact CG2-CD1 3.85Å; V163-L207 HydrophobicContact CG2-CG 3.95Å; Y166-L207 HydrophobicContact CD2-CD1 4.03Å; Y166-L207 HydrophobicContact CD2-CD2 4.36Å; Y166-L207 HydrophobicContact CG-CD2 4.39Å; Y186-L207 HydrophobicContact CD2-CD1 4.47Å; Y186-L207 HydrophobicContact CE2-CD1 3.66Å; Y186-L207 WeakPolarHBondContact OH-CB 3.31Å; L204-L207 PolarHBondContact O-N 2.95Å; E205-L207 PolarHBondContact O-N 2.96Å; E205-L207 VanDerWaalsContact O-N 3.08Å; L207-E209 PolarHBondContact O-N 3.24Å; L207-M210 HydrophobicContact CB-CE 4.07Å; L207-M210 HydrophobicContact CD1-CE 3.93Å; L207-M210 HydrophobicContact CD2-CE 3.95Å; L207-M210 HydrophobicContact CD2-SD 4.1Å; L207-M210 HydrophobicContact CG-CE 4.2Å; L207-M210 PolarHBondContact O-N 3.13Å; L207-T211 WeakPolarHBondContact O-CB 3.37Å; L207-T211 PolarHBondContact O-N 3.23Å; L207-T211 PolarHBondContact O-OG1 2.86Å
208	K	93.2	Very high	89.7	Confident	111 Å²	111	69.4 Å²	69.4	48%	0.483	34%	0.336	S	S	.	.	H	α-helix	trans	-56.2	-46.8	-173.6	177.2	175.3	178.5	176.6	0	114.2	E205 T211 S212	E205-K208 VanDerWaalsContact CD-CD 3.45Å; E205-K208 WeakPolarHBondContact O-CB 3.38Å; E205-K208 PolarHBondContact O-N 3.47Å; E205-K208 VanDerWaalsContact O-N 3.13Å; E205-K208 VanDerWaalsContact OE1-CD 3.24Å; E205-K208 WeakPolarHBondContact OE1-CD 3.42Å; E205-K208 IonicContact OE1-NZ 3.72Å; E205-K208 PolarHBondContact OE1-NZ 3.44Å; E205-K208 VanDerWaalsContact OE2-CD 3.24Å; E205-K208 WeakPolarHBondContact OE2-CD 3.48Å; E205-K208 IonicContact OE2-NZ 3.84Å; E205-K208 PolarHBondContact OE2-NZ 3.28Å; E205-K208 VanDerWaalsContact OE2-NZ 3.11Å; K208-T211 WeakPolarHBondContact O-CB 3.44Å; K208-T211 PolarHBondContact O-N 3.14Å; K208-S212 PolarHBondContact O-N 3.03Å
209	E	89.9	Confident	89.3	Confident	160 Å²	160	73.1 Å²	73.1	75%	0.748	35%	0.353	S	S	*	.	H	α-helix	trans	-63.4	-47.5	-179.5	-66.9	178.8	-177.2	0	0	111.1	L207 T211 S212 Q213	L207-E209 PolarHBondContact O-N 3.24Å; E209-T211 VanDerWaalsContact C-N 3.33Å; E209-T211 PolarHBondContact O-N 3.17Å; E209-S212 WeakPolarHBondContact O-CB 3.31Å; E209-S212 PolarHBondContact O-N 3.32Å; E209-S212 VanDerWaalsContact O-N 3.14Å; E209-Q213 PolarHBondContact O-N 3.48Å; E209-Q213 VanDerWaalsContact O-N 3.12Å
210	M	89.6	Confident	88.9	Confident	37 Å²	37	77 Å²	77	18%	0.182	37%	0.372	C	S	.	.	H	α-helix	trans	-60.5	-43	175.6	-174.3	-167.4	81.2	0	0	111.6	Y166 Y186 L207 S212 Q213 M214	Y166-M210 HydrophobicContact CD1-CE 4.09Å; Y166-M210 HydrophobicContact CD1-SD 3.29Å; Y166-M210 WeakPolarHBondContact CD1-SD 3.31Å; Y166-M210 HydrophobicContact CD2-CE 3.57Å; Y166-M210 HydrophobicContact CD2-SD 3.84Å; Y166-M210 HydrophobicContact CE1-CE 3.96Å; Y166-M210 HydrophobicContact CE1-SD 3.47Å; Y166-M210 WeakPolarHBondContact CE1-SD 3.49Å; Y166-M210 HydrophobicContact CE2-CE 3.44Å; Y166-M210 VanDerWaalsContact CE2-CE 3.44Å; Y166-M210 HydrophobicContact CE2-SD 4.02Å; Y166-M210 HydrophobicContact CG-CE 3.9Å; Y166-M210 HydrophobicContact CG-SD 3.48Å; Y186-M210 HydrophobicContact CD1-CE 3.7Å; Y186-M210 HydrophobicContact CE1-CE 3.38Å; Y186-M210 HydrophobicContact CE2-CE 4.26Å; Y186-M210 HydrophobicContact CG-CE 4.26Å; L207-M210 HydrophobicContact CB-CE 4.07Å; L207-M210 HydrophobicContact CD1-CE 3.93Å; L207-M210 HydrophobicContact CD2-CE 3.95Å; L207-M210 HydrophobicContact CD2-SD 4.1Å; L207-M210 HydrophobicContact CG-CE 4.2Å; L207-M210 PolarHBondContact O-N 3.13Å; M210-S212 VanDerWaalsContact C-N 3.28Å; M210-S212 PolarHBondContact O-N 3.4Å; M210-Q213 PolarHBondContact O-N 3.44Å; M210-Q213 VanDerWaalsContact O-N 3.16Å; M210-M214 HydrophobicContact CE-SD 3.93Å; M210-M214 HydrophobicContact CG-CG 4.37Å; M210-M214 HydrophobicContact CG-SD 3.63Å; M210-M214 VanDerWaalsContact O-CB 3.31Å; M210-M214 WeakPolarHBondContact O-CB 3.31Å; M210-M214 VanDerWaalsContact O-CG 3.26Å; M210-M214 WeakPolarHBondContact O-CG 3.38Å; M210-M214 PolarHBondContact O-N 2.87Å; M210-M214 HydrophobicContact SD-SD 4.09Å
211	T	91.3	Very high	88.8	Confident	4 Å²	4	76.3 Å²	76.3	3%	0.025	37%	0.365	C	S	.	.	H	α-helix	trans	-57.6	-44.6	175	-53.7	0	0	0	0	110.7	Y186 Y190 L207 K208 E209 Q213 M214 C215	Y186-T211 PolarHBondContact OH-OG1 3.3Å; Y190-T211 HydrophobicContact CD1-CG2 3.81Å; Y190-T211 HydrophobicContact CD2-CG2 3.8Å; Y190-T211 HydrophobicContact CE1-CG2 3.5Å; Y190-T211 VanDerWaalsContact CE1-CG2 3.5Å; Y190-T211 HydrophobicContact CE2-CG2 3.49Å; Y190-T211 VanDerWaalsContact CE2-CG2 3.49Å; Y190-T211 HydrophobicContact CG-CG2 3.95Å; L207-T211 WeakPolarHBondContact O-CB 3.37Å; L207-T211 PolarHBondContact O-N 3.23Å; L207-T211 PolarHBondContact O-OG1 2.86Å; K208-T211 WeakPolarHBondContact O-CB 3.44Å; K208-T211 PolarHBondContact O-N 3.14Å; E209-T211 VanDerWaalsContact C-N 3.33Å; E209-T211 PolarHBondContact O-N 3.17Å; T211-Q213 VanDerWaalsContact C-N 3.27Å; T211-Q213 PolarHBondContact O-N 2.95Å; T211-M214 PolarHBondContact O-N 3.36Å; T211-C215 HydrophobicContact CG2-CB 4.32Å; T211-C215 VanDerWaalsContact O-CB 3.31Å; T211-C215 WeakPolarHBondContact O-CB 3.49Å; T211-C215 PolarHBondContact O-N 2.92Å
212	S	89.4	Confident	88.7	Confident	67 Å²	67	72.9 Å²	72.9	47%	0.469	35%	0.351	S	S	.	.	H	α-helix	trans	-62.8	-32.4	179.1	-168.3	0	0	0	0	113	K208 E209 M210 H216	K208-S212 PolarHBondContact O-N 3.03Å; E209-S212 WeakPolarHBondContact O-CB 3.31Å; E209-S212 PolarHBondContact O-N 3.32Å; E209-S212 VanDerWaalsContact O-N 3.14Å; M210-S212 VanDerWaalsContact C-N 3.28Å; M210-S212 PolarHBondContact O-N 3.4Å; S212-H216 WeakPolarHBondContact O-CB 3.4Å
213	Q	85.2	Confident	88.5	Confident	158 Å²	158	66 Å²	66	74%	0.738	32%	0.323	S	S	*	.	H	α-helix	trans	-81.2	-26.1	177.3	-66.6	173.8	-0.6	0	0	112.7	E209 M210 T211	E209-Q213 PolarHBondContact O-N 3.48Å; E209-Q213 VanDerWaalsContact O-N 3.12Å; M210-Q213 PolarHBondContact O-N 3.44Å; M210-Q213 VanDerWaalsContact O-N 3.16Å; T211-Q213 VanDerWaalsContact C-N 3.27Å; T211-Q213 PolarHBondContact O-N 2.95Å
214	M	82.9	Confident	88.4	Confident	29 Å²	29	65.8 Å²	65.8	14%	0.143	32%	0.323	C	S	.	.	H	α-helix	trans	-93.4	-35.6	-173.3	-76.1	-177.5	66	0	0	113.2	N183 Y186 K187 M210 T211	N183-M214 HydrophobicContact CB-CE 3.46Å; N183-M214 VanDerWaalsContact CB-CE 3.46Å; N183-M214 VanDerWaalsContact CG-CE 3.48Å; N183-M214 WeakPolarHBondContact OD1-CE 3.44Å; Y186-M214 HydrophobicContact CD1-CE 4Å; Y186-M214 HydrophobicContact CD1-SD 4.26Å; K187-M214 WeakPolarHBondContact CE-O 3.43Å; K187-M214 HydrophobicContact CG-CE 4.02Å; K187-M214 PolarHBondContact NZ-O 2.72Å; M210-M214 HydrophobicContact CE-SD 3.93Å; M210-M214 HydrophobicContact CG-CG 4.37Å; M210-M214 HydrophobicContact CG-SD 3.63Å; M210-M214 VanDerWaalsContact O-CB 3.31Å; M210-M214 WeakPolarHBondContact O-CB 3.31Å; M210-M214 VanDerWaalsContact O-CG 3.26Å; M210-M214 WeakPolarHBondContact O-CG 3.38Å; M210-M214 PolarHBondContact O-N 2.87Å; M210-M214 HydrophobicContact SD-SD 4.09Å; T211-M214 PolarHBondContact O-N 3.36Å
215	C	79.1	Confident	87.8	Confident	9 Å²	9	70.3 Å²	70.3	6%	0.061	35%	0.345	C	S	.	.	H	α-helix	trans	-111.2	-8	-168.3	-57.6	0	0	0	0	113.9	Y190 Y191 T211	Y190-C215 HydrophobicContact CD1-CB 4.37Å; Y190-C215 HydrophobicContact CE1-CB 4.41Å; Y191-C215 HydrophobicContact CE1-CB 3.77Å; Y191-C215 WeakPolarHBondContact OH-CA 3.3Å; Y191-C215 WeakPolarHBondContact OH-CB 3.48Å; Y191-C215 PolarHBondContact OH-O 3.41Å; T211-C215 HydrophobicContact CG2-CB 4.32Å; T211-C215 VanDerWaalsContact O-CB 3.31Å; T211-C215 WeakPolarHBondContact O-CB 3.49Å; T211-C215 PolarHBondContact O-N 2.92Å
216	H	69.6	Low	87.2	Confident	163 Å²	163	69.8 Å²	69.8	76%	0.755	34%	0.344	S	S	*	.			trans	-132.6	0	-179.5	-60.6	-67.6	0	0	0	109.2	S212	S212-H216 WeakPolarHBondContact O-CB 3.4Å

Retrieved 216 of 216 residues in 1635.6 ms (Link to these results)

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