A0A3B3VSU1_9TELE Loading...

Transmembrane BAX inhibitor motif-containing protein 6

AlphaFold DB , UniProt , Accession A0A3B3VSU1, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 237 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	50.7	Low	64.9	Low	235 Å²	235	144.9 Å²	144.9	100%	1.158	72%	0.722	S	S	*	*				0	105.8	0	-145.8	156.8	82.7	0	0	106.6	V3	M1-V3 PolarHBondContact O-N 3.1Å
2	N	51.2	Low	65.4	Low	120 Å²	120	137.6 Å²	137.6	64%	0.642	70%	0.701	S	S	*	*			trans	-65.7	115.7	-176.1	-83.9	-24	0	0	0	109.4	F4 D5	N2-F4 PolarHBondContact O-N 3.22Å; N2-F4 VanDerWaalsContact O-N 3.1Å; N2-D5 PolarHBondContact O-N 3.41Å
3	V	60.8	Low	65.7	Low	123 Å²	123	132.8 Å²	132.8	75%	0.745	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-61.1	-18.5	176.3	177.5	0	0	0	0	111.5	M1	M1-V3 PolarHBondContact O-N 3.1Å
4	F	62.3	Low	66.1	Low	198 Å²	198	132.6 Å²	132.6	87%	0.868	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-87.5	-7.3	-177.1	-61.4	-73.1	0	0	0	115.3	N2 R6	N2-F4 PolarHBondContact O-N 3.22Å; N2-F4 VanDerWaalsContact O-N 3.1Å; F4-R6 VanDerWaalsContact C-N 3.27Å; F4-R6 PolarHBondContact O-N 3.29Å
5	D	61.1	Low	66.5	Low	130 Å²	130	135.2 Å²	135.2	70%	0.695	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-89.7	20.4	174.7	-78.9	-46.9	0	0	0	113.1	N2 N7	N2-D5 PolarHBondContact O-N 3.41Å; D5-N7 PolarHBondContact O-N 3.09Å; D5-N7 VanDerWaalsContact O-N 3.09Å
6	R	69.6	Low	67.1	Low	212 Å²	212	129.8 Å²	129.8	80%	0.8	64%	0.64	S	S	*	*			trans	-74.2	101.5	167.4	-91.3	-176.3	166.1	-172.2	-3.2	108.1	F4 I8	F4-R6 VanDerWaalsContact C-N 3.27Å; F4-R6 PolarHBondContact O-N 3.29Å; R6-I8 VanDerWaalsContact C-N 3.25Å; R6-I8 PolarHBondContact O-N 3.19Å
7	N	68.9	Low	67.1	Low	167 Å²	167	128.8 Å²	128.8	89%	0.893	65%	0.648	S	S	*	*			trans	-63.7	89.4	168.8	-148.5	20.7	0	0	0	108	D5 N9	D5-N7 PolarHBondContact O-N 3.09Å; D5-N7 VanDerWaalsContact O-N 3.09Å; N7-N9 PolarHBondContact O-N 3.25Å; N7-N9 VanDerWaalsContact O-N 3.13Å
8	I	70.3	Confident	67.7	Low	112 Å²	112	128.2 Å²	128.2	57%	0.574	64%	0.643	S	S	*	*			trans	-67.3	112.8	179.1	-61.5	175.3	0	0	0	106.3	R6 I10 I13	R6-I8 VanDerWaalsContact C-N 3.25Å; R6-I8 PolarHBondContact O-N 3.19Å; I8-I10 VanDerWaalsContact C-N 3.31Å; I8-I10 HydrophobicContact CB-CD1 4.42Å; I8-I10 HydrophobicContact CG2-CD1 3.89Å; I8-I10 PolarHBondContact O-N 2.72Å; I8-I13 HydrophobicContact CG2-CD1 3.55Å
9	N	75.2	Confident	68.7	Low	92 Å²	92	122.3 Å²	122.3	49%	0.492	61%	0.613	S	S	.	*			trans	-71.3	91.9	173.6	-173	-17.2	0	0	0	108.8	N7 D11 A12 I13	N7-N9 PolarHBondContact O-N 3.25Å; N7-N9 VanDerWaalsContact O-N 3.13Å; N9-D11 PolarHBondContact O-N 3.34Å; N9-D11 WeakPolarHBondContact OD1-CB 3.49Å; N9-D11 PolarHBondContact OD1-N 2.81Å; N9-D11 VanDerWaalsContact OD1-N 3.15Å; N9-A12 HydrophobicContact CB-CB 3.94Å; N9-A12 WeakPolarHBondContact O-CB 3.43Å; N9-A12 PolarHBondContact O-N 3.47Å; N9-A12 PolarHBondContact OD1-N 3.11Å; N9-A12 VanDerWaalsContact OD1-N 3.14Å; N9-I13 PolarHBondContact O-N 3.15Å
10	I	71.3	Confident	69.9	Low	95 Å²	95	118.5 Å²	118.5	49%	0.487	60%	0.599	S	S	.	*	H	α-helix	trans	-58.3	-34.5	179.6	-60.5	-61.7	0	0	0	110.8	I8 A12 I13 F14	I8-I10 VanDerWaalsContact C-N 3.31Å; I8-I10 HydrophobicContact CB-CD1 4.42Å; I8-I10 HydrophobicContact CG2-CD1 3.89Å; I8-I10 PolarHBondContact O-N 2.72Å; I10-A12 VanDerWaalsContact C-N 3.28Å; I10-A12 PolarHBondContact O-N 3.04Å; I10-I13 HydrophobicContact CD1-CD1 4.37Å; I10-I13 WeakPolarHBondContact O-CB 3.34Å; I10-I13 PolarHBondContact O-N 3.28Å; I10-I13 VanDerWaalsContact O-N 3.11Å; I10-F14 HydrophobicContact CG2-CD2 3.64Å; I10-F14 HydrophobicContact CG2-CE2 3.55Å; I10-F14 VanDerWaalsContact O-CD2 3.28Å; I10-F14 WeakPolarHBondContact O-CD2 3.26Å; I10-F14 PolarHBondContact O-N 3.09Å; I10-F14 VanDerWaalsContact O-N 3.08Å
11	D	72.9	Confident	70.9	Confident	110 Å²	110	119.6 Å²	119.6	59%	0.588	60%	0.602	S	S	*	*	H	α-helix	trans	-65.7	-32.2	176.1	-59.2	-44.1	0	0	0	112.1	N9 I13 F14 R15	N9-D11 PolarHBondContact O-N 3.34Å; N9-D11 WeakPolarHBondContact OD1-CB 3.49Å; N9-D11 PolarHBondContact OD1-N 2.81Å; N9-D11 VanDerWaalsContact OD1-N 3.15Å; D11-I13 VanDerWaalsContact C-N 3.3Å; D11-F14 PolarHBondContact O-N 3.24Å; D11-R15 WeakPolarHBondContact O-CD 3.34Å; D11-R15 WeakPolarHBondContact O-CG 3.45Å; D11-R15 PolarHBondContact O-N 3.15Å
12	A	70.8	Confident	73	Confident	57 Å²	57	111.6 Å²	111.6	47%	0.471	57%	0.569	S	S	.	*	H	α-helix	trans	-69	-32	174.9	0	0	0	0	0	112	N9 I10	N9-A12 HydrophobicContact CB-CB 3.94Å; N9-A12 WeakPolarHBondContact O-CB 3.43Å; N9-A12 PolarHBondContact O-N 3.47Å; N9-A12 PolarHBondContact OD1-N 3.11Å; N9-A12 VanDerWaalsContact OD1-N 3.14Å; I10-A12 VanDerWaalsContact C-N 3.28Å; I10-A12 PolarHBondContact O-N 3.04Å
13	I	68.7	Low	75.1	Confident	75 Å²	75	105.9 Å²	105.9	39%	0.385	54%	0.538	S	S	.	.	H	α-helix	trans	-67.5	-48.8	174.2	-61.6	174.8	0	0	0	108.9	I8 N9 I10 D11 R15 Y134	I8-I13 HydrophobicContact CG2-CD1 3.55Å; N9-I13 PolarHBondContact O-N 3.15Å; I10-I13 HydrophobicContact CD1-CD1 4.37Å; I10-I13 WeakPolarHBondContact O-CB 3.34Å; I10-I13 PolarHBondContact O-N 3.28Å; I10-I13 VanDerWaalsContact O-N 3.11Å; D11-I13 VanDerWaalsContact C-N 3.3Å; I13-R15 PolarHBondContact O-N 3.48Å; I13-R15 VanDerWaalsContact O-N 3.16Å; I13-Y134 WeakPolarHBondContact CG2-OH 3.5Å; I13-Y134 WeakPolarHBondContact O-CE1 3.45Å; I13-Y134 VanDerWaalsContact O-CZ 3.24Å; I13-Y134 PolarHBondContact O-OH 3.49Å
14	F	71.1	Confident	76.7	Confident	131 Å²	131	103.4 Å²	103.4	58%	0.575	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	11.2	-177.2	-66.5	-71.8	0	0	0	115.5	I10 D11 F16	I10-F14 HydrophobicContact CG2-CD2 3.64Å; I10-F14 HydrophobicContact CG2-CE2 3.55Å; I10-F14 VanDerWaalsContact O-CD2 3.28Å; I10-F14 WeakPolarHBondContact O-CD2 3.26Å; I10-F14 PolarHBondContact O-N 3.09Å; I10-F14 VanDerWaalsContact O-N 3.08Å; D11-F14 PolarHBondContact O-N 3.24Å; F14-F16 WeakPolarHBondContact O-CD2 3.44Å; F14-F16 PolarHBondContact O-N 2.87Å
15	R	72.6	Confident	78.2	Confident	171 Å²	171	97.1 Å²	97.1	65%	0.645	50%	0.496	S	S	*	.			trans	-85.9	94.4	177.4	-90.3	171	-165.9	-148.1	3.3	111.7	D11 I13 S17	D11-R15 WeakPolarHBondContact O-CD 3.34Å; D11-R15 WeakPolarHBondContact O-CG 3.45Å; D11-R15 PolarHBondContact O-N 3.15Å; I13-R15 PolarHBondContact O-N 3.48Å; I13-R15 VanDerWaalsContact O-N 3.16Å; R15-S17 PolarHBondContact O-N 3.43Å
16	F	75.5	Confident	79.9	Confident	49 Å²	49	91.3 Å²	91.3	22%	0.215	47%	0.465	C	S	.	.			trans	-81.6	51.5	170.2	-54.4	-71.4	0	0	0	112.3	F14 Q18 I19 Q24 L133 Y134	F14-F16 WeakPolarHBondContact O-CD2 3.44Å; F14-F16 PolarHBondContact O-N 2.87Å; F16-Q18 PolarHBondContact O-N 3.12Å; F16-I19 HydrophobicContact CB-CB 4.36Å; F16-I19 HydrophobicContact CB-CD1 4.27Å; F16-I19 HydrophobicContact CB-CG1 4.47Å; F16-I19 HydrophobicContact CD1-CD1 4.5Å; F16-I19 PolarHBondContact O-N 3.18Å; F16-Q24 PolarHBondContact O-NE2 3.44Å; F16-L133 HydrophobicContact CD1-CB 4.24Å; F16-L133 HydrophobicContact CE1-CB 3.79Å; F16-Y134 HydrophobicContact CD1-CE1 4.21Å; F16-Y134 HydrophobicContact CE1-CD1 4.2Å; F16-Y134 AromaticContact CE1-CE1 3.64Å; F16-Y134 HydrophobicContact CE1-CE1 3.64Å; F16-Y134 AromaticContact CE1-CZ 3.85Å; F16-Y134 HydrophobicContact CZ-CE1 4.34Å
17	S	68.2	Low	81.2	Confident	112 Å²	112	81.7 Å²	81.7	78%	0.783	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-15.6	-174	64.7	0	0	0	0	114.2	R15	R15-S17 PolarHBondContact O-N 3.43Å
18	Q	78.1	Confident	82.5	Confident	118 Å²	118	80.6 Å²	80.6	55%	0.551	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-13.6	176.4	-57.9	-169.4	-1.2	0	0	113.4	F16	F16-Q18 PolarHBondContact O-N 3.12Å
19	I	86.9	Confident	83.9	Confident	16 Å²	16	78.3 Å²	78.3	8%	0.082	41%	0.406	C	S	.	.	S	Bend	trans	-108.6	130.5	-177.8	-56.3	178.3	0	0	0	108	F16 T23 Q24 L27 L133 I193	F16-I19 HydrophobicContact CB-CB 4.36Å; F16-I19 HydrophobicContact CB-CD1 4.27Å; F16-I19 HydrophobicContact CB-CG1 4.47Å; F16-I19 HydrophobicContact CD1-CD1 4.5Å; F16-I19 PolarHBondContact O-N 3.18Å; I19-T23 HydrophobicContact CG2-CG2 3.51Å; I19-Q24 HydrophobicContact CB-CG 4.39Å; I19-Q24 HydrophobicContact CG2-CG 4.02Å; I19-Q24 PolarHBondContact O-NE2 3.32Å; I19-L27 HydrophobicContact CD1-CD1 4.48Å; I19-L133 HydrophobicContact CD1-CD2 4.04Å; I19-I193 HydrophobicContact CD1-CD1 3.98Å; I19-I193 HydrophobicContact CD1-CG1 4.43Å; I19-I193 HydrophobicContact CG1-CG2 4.45Å
20	S	91.8	Very high	85	Confident	46 Å²	46	74 Å²	74	32%	0.322	38%	0.382	S	S	.	.			trans	-63.6	151.1	178.9	72.2	0	0	0	0	111.5	S22 T23 Q24 E197	S20-S22 PolarHBondContact O-N 3.3Å; S20-T23 PolarHBondContact O-N 3.05Å; S20-T23 PolarHBondContact OG-N 2.94Å; S20-T23 PolarHBondContact OG-OG1 2.84Å; S20-T23 VanDerWaalsContact OG-OG1 3.09Å; S20-Q24 WeakPolarHBondContact O-CG 3.46Å; S20-Q24 PolarHBondContact O-N 3.18Å; S20-E197 WeakPolarHBondContact CB-OE1 3.47Å; S20-E197 PolarHBondContact N-OE1 2.95Å; S20-E197 PolarHBondContact OG-OE1 2.8Å
21	H	91.6	Very high	86.2	Confident	143 Å²	143	72 Å²	72	66%	0.662	37%	0.369	S	S	*	.	H	α-helix	trans	-56.6	-38	177.6	-178.6	-91.7	0	0	0	112.3	T23 Q24 V25	H21-T23 VanDerWaalsContact C-N 3.33Å; H21-T23 PolarHBondContact O-N 3.13Å; H21-Q24 WeakPolarHBondContact O-CB 3.41Å; H21-Q24 PolarHBondContact O-N 3.39Å; H21-V25 WeakPolarHBondContact O-CG2 3.48Å; H21-V25 PolarHBondContact O-N 3Å
22	S	94.1	Very high	87.4	Confident	67 Å²	67	69.6 Å²	69.6	47%	0.469	36%	0.361	S	S	.	.	H	α-helix	trans	-58.8	-42.9	174.8	175.9	0	0	0	0	112	S20 V25 H26 K201	S20-S22 PolarHBondContact O-N 3.3Å; S22-V25 PolarHBondContact O-N 3.29Å; S22-H26 PolarHBondContact O-N 3.31Å; S22-K201 VanDerWaalsContact OG-CE 3.28Å; S22-K201 WeakPolarHBondContact OG-CE 3.44Å; S22-K201 PolarHBondContact OG-NZ 2.89Å
23	T	95.4	Very high	88.7	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-71.4	-32.8	176.9	-59.6	0	0	0	0	112.4	I19 S20 H21 H26 L27 I193 A196 E197 K201	I19-T23 HydrophobicContact CG2-CG2 3.51Å; S20-T23 PolarHBondContact O-N 3.05Å; S20-T23 PolarHBondContact OG-N 2.94Å; S20-T23 PolarHBondContact OG-OG1 2.84Å; S20-T23 VanDerWaalsContact OG-OG1 3.09Å; H21-T23 VanDerWaalsContact C-N 3.33Å; H21-T23 PolarHBondContact O-N 3.13Å; T23-H26 WeakPolarHBondContact O-CB 3.29Å; T23-H26 PolarHBondContact O-N 3.45Å; T23-L27 HydrophobicContact CG2-CD1 4.33Å; T23-L27 HydrophobicContact CG2-CG 4.41Å; T23-L27 WeakPolarHBondContact O-CG 3.45Å; T23-L27 PolarHBondContact O-N 3.5Å; T23-I193 HydrophobicContact CG2-CG2 4.27Å; T23-A196 HydrophobicContact CG2-CB 3.8Å; T23-E197 WeakPolarHBondContact CB-OE1 3.38Å; T23-E197 HydrophobicContact CG2-CG 4.42Å; T23-E197 PolarHBondContact OG1-OE1 3.27Å; T23-K201 PolarHBondContact OG1-NZ 2.8Å
24	Q	93.6	Very high	90.1	Very high	70 Å²	70	64.6 Å²	64.6	33%	0.327	33%	0.328	S	S	.	.	H	α-helix	trans	-62.4	-43.7	172.9	-65.8	174.1	2.9	0	0	111.9	F16 I19 S20 H21 H26 L27 K28	F16-Q24 PolarHBondContact O-NE2 3.44Å; I19-Q24 HydrophobicContact CB-CG 4.39Å; I19-Q24 HydrophobicContact CG2-CG 4.02Å; I19-Q24 PolarHBondContact O-NE2 3.32Å; S20-Q24 WeakPolarHBondContact O-CG 3.46Å; S20-Q24 PolarHBondContact O-N 3.18Å; H21-Q24 WeakPolarHBondContact O-CB 3.41Å; H21-Q24 PolarHBondContact O-N 3.39Å; Q24-H26 VanDerWaalsContact C-N 3.33Å; Q24-L27 PolarHBondContact O-N 2.97Å; Q24-K28 PolarHBondContact O-N 3.44Å
25	V	95.4	Very high	91.4	Very high	66 Å²	66	60.6 Å²	60.6	40%	0.4	32%	0.319	S	S	.	.	H	α-helix	trans	-63.2	-41.8	174.5	175.5	0	0	0	0	111	H21 S22 K28 N29	H21-V25 WeakPolarHBondContact O-CG2 3.48Å; H21-V25 PolarHBondContact O-N 3Å; S22-V25 PolarHBondContact O-N 3.29Å; V25-K28 WeakPolarHBondContact O-CB 3.47Å; V25-K28 PolarHBondContact O-N 3.04Å; V25-N29 PolarHBondContact O-N 3.32Å; V25-N29 VanDerWaalsContact O-N 3.12Å
26	H	96.8	Very high	92.6	Very high	8 Å²	8	56.4 Å²	56.4	4%	0.037	31%	0.313	C	S	.	.	H	α-helix	trans	-57.6	-51.3	174.6	-178.9	89.1	0	0	0	111.9	S22 T23 Q24 K28 N29 V30 A196 K201 Y203 H206	S22-H26 PolarHBondContact O-N 3.31Å; T23-H26 WeakPolarHBondContact O-CB 3.29Å; T23-H26 PolarHBondContact O-N 3.45Å; Q24-H26 VanDerWaalsContact C-N 3.33Å; H26-K28 VanDerWaalsContact C-N 3.3Å; H26-K28 PolarHBondContact O-N 3.24Å; H26-N29 WeakPolarHBondContact O-CB 3.35Å; H26-N29 PolarHBondContact O-N 3.46Å; H26-N29 VanDerWaalsContact O-N 3.08Å; H26-V30 WeakPolarHBondContact NE2-CG2 3.45Å; H26-V30 WeakPolarHBondContact O-CG2 3.44Å; H26-V30 PolarHBondContact O-N 3.17Å; H26-A196 HydrophobicContact CB-CB 4.41Å; H26-K201 HydrophobicContact CB-CD 4.26Å; H26-K201 PolarHBondContact CE1-O 3.1Å; H26-Y203 VanDerWaalsContact CE1-CA 3.41Å; H26-Y203 WeakPolarHBondContact CE1-CA 3.44Å; H26-Y203 VanDerWaalsContact CE1-CB 3.49Å; H26-Y203 WeakPolarHBondContact CE1-CB 3.22Å; H26-Y203 PolarHBondContact CE1-N 2.74Å; H26-Y203 VanDerWaalsContact CE1-N 3.31Å; H26-H206 AromaticContact CE1-ND1 3.57Å; H26-H206 AromaticContact NE2-CE1 4Å; H26-H206 AromaticContact NE2-CG 3.94Å; H26-H206 AromaticContact NE2-ND1 3.03Å; H26-H206 PolarHBondContact NE2-ND1 3Å
27	L	96.8	Very high	93.7	Very high	11 Å²	11	54.2 Å²	54.2	6%	0.058	30%	0.303	C	S	.	.	H	α-helix	trans	-60	-40.3	177.9	-72.2	170.6	0	0	0	111.8	I19 T23 Q24 N29 V30 Y31 L133 I192 I193	I19-L27 HydrophobicContact CD1-CD1 4.48Å; T23-L27 HydrophobicContact CG2-CD1 4.33Å; T23-L27 HydrophobicContact CG2-CG 4.41Å; T23-L27 WeakPolarHBondContact O-CG 3.45Å; T23-L27 PolarHBondContact O-N 3.5Å; Q24-L27 PolarHBondContact O-N 2.97Å; L27-N29 VanDerWaalsContact C-N 3.27Å; L27-N29 PolarHBondContact O-N 3.42Å; L27-V30 PolarHBondContact O-N 3.33Å; L27-Y31 HydrophobicContact CB-CD2 4.3Å; L27-Y31 HydrophobicContact CB-CE2 4.27Å; L27-Y31 HydrophobicContact CD2-CE2 4.06Å; L27-Y31 WeakPolarHBondContact O-CD2 3.35Å; L27-Y31 PolarHBondContact O-N 3.33Å; L27-L133 HydrophobicContact CD1-CD2 3.68Å; L27-I192 HydrophobicContact CD2-CG2 3.73Å; L27-I193 HydrophobicContact CD1-CG1 4.04Å; L27-I193 HydrophobicContact CD2-CG1 4.27Å
28	K	96.6	Very high	95.1	Very high	144 Å²	144	50.3 Å²	50.3	63%	0.626	27%	0.273	S	S	*	.	H	α-helix	trans	-55.6	-44.2	174.2	-179.6	-176.1	174.7	-176.6	0	111.2	Q24 V25 H26 S32	Q24-K28 PolarHBondContact O-N 3.44Å; V25-K28 WeakPolarHBondContact O-CB 3.47Å; V25-K28 PolarHBondContact O-N 3.04Å; H26-K28 VanDerWaalsContact C-N 3.3Å; H26-K28 PolarHBondContact O-N 3.24Å; K28-S32 VanDerWaalsContact O-CB 3.23Å; K28-S32 WeakPolarHBondContact O-CB 3.23Å; K28-S32 PolarHBondContact O-N 3.42Å; K28-S32 PolarHBondContact O-OG 3Å
29	N	97.7	Very high	96.1	Very high	64 Å²	64	52.3 Å²	52.3	34%	0.342	28%	0.28	S	S	.	.	H	α-helix	trans	-66.3	-44.9	177.4	-66.6	-12.9	0	0	0	111.4	V25 H26 L27 Y31 S32 S33 Y203	V25-N29 PolarHBondContact O-N 3.32Å; V25-N29 VanDerWaalsContact O-N 3.12Å; H26-N29 WeakPolarHBondContact O-CB 3.35Å; H26-N29 PolarHBondContact O-N 3.46Å; H26-N29 VanDerWaalsContact O-N 3.08Å; L27-N29 VanDerWaalsContact C-N 3.27Å; L27-N29 PolarHBondContact O-N 3.42Å; N29-Y31 PolarHBondContact O-N 3.36Å; N29-S32 PolarHBondContact O-N 3.42Å; N29-S33 WeakPolarHBondContact O-CB 3.43Å; N29-S33 PolarHBondContact O-N 3.15Å; N29-S33 PolarHBondContact O-OG 2.98Å; N29-Y203 HydrophobicContact CB-CD1 4.25Å; N29-Y203 HydrophobicContact CB-CD2 3.77Å; N29-Y203 HydrophobicContact CB-CE2 4.24Å; N29-Y203 HydrophobicContact CB-CG 3.77Å
30	V	98.3	Very high	96.6	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-54.3	-54.5	175.5	175.6	0	0	0	0	111.2	H26 L27 S32 S33 L34 I192 H206 C207 L210	H26-V30 WeakPolarHBondContact NE2-CG2 3.45Å; H26-V30 WeakPolarHBondContact O-CG2 3.44Å; H26-V30 PolarHBondContact O-N 3.17Å; L27-V30 PolarHBondContact O-N 3.33Å; V30-S32 PolarHBondContact O-N 2.8Å; V30-S33 PolarHBondContact O-N 3.29Å; V30-L34 WeakPolarHBondContact O-CB 3.28Å; V30-L34 PolarHBondContact O-N 3Å; V30-I192 HydrophobicContact CG2-CG2 4.4Å; V30-H206 HydrophobicContact CG1-CB 4.35Å; V30-H206 HydrophobicContact CG2-CB 3.78Å; V30-C207 HydrophobicContact CG1-CB 4.4Å; V30-L210 HydrophobicContact CG1-CD1 3.7Å
31	Y	97.9	Very high	96.9	Very high	54 Å²	54	51.2 Å²	51.2	21%	0.212	27%	0.273	C	S	.	.	H	α-helix	trans	-70.8	-30.1	-177.2	-71.7	-68.6	0	0	0	113	L27 N29 L34 A35 F125 T129 T189 L210	L27-Y31 HydrophobicContact CB-CD2 4.3Å; L27-Y31 HydrophobicContact CB-CE2 4.27Å; L27-Y31 HydrophobicContact CD2-CE2 4.06Å; L27-Y31 WeakPolarHBondContact O-CD2 3.35Å; L27-Y31 PolarHBondContact O-N 3.33Å; N29-Y31 PolarHBondContact O-N 3.36Å; Y31-L34 HydrophobicContact CD1-CD2 4.05Å; Y31-L34 HydrophobicContact CE1-CD2 4.46Å; Y31-L34 PolarHBondContact O-N 3.15Å; Y31-A35 PolarHBondContact O-N 3.21Å; Y31-F125 HydrophobicContact CE1-CE1 4.06Å; Y31-T129 HydrophobicContact CE1-CG2 3.87Å; Y31-T129 HydrophobicContact CE2-CG2 4.37Å; Y31-T129 WeakPolarHBondContact OH-CG2 3.48Å; Y31-T189 WeakPolarHBondContact OH-CG2 3.43Å; Y31-L210 HydrophobicContact CD1-CD1 4.32Å; Y31-L210 HydrophobicContact CE1-CD1 3.63Å
32	S	98	Very high	97.2	Very high	60 Å²	60	47.2 Å²	47.2	42%	0.42	26%	0.264	S	S	.	.	H	α-helix	trans	-67.3	-44.6	173.4	-59.2	0	0	0	0	111.1	K28 N29 V30 L34 A35 V36	K28-S32 VanDerWaalsContact O-CB 3.23Å; K28-S32 WeakPolarHBondContact O-CB 3.23Å; K28-S32 PolarHBondContact O-N 3.42Å; K28-S32 PolarHBondContact O-OG 3Å; N29-S32 PolarHBondContact O-N 3.42Å; V30-S32 PolarHBondContact O-N 2.8Å; S32-L34 VanDerWaalsContact C-N 3.31Å; S32-L34 PolarHBondContact O-N 3.44Å; S32-A35 PolarHBondContact O-N 3.14Å; S32-V36 PolarHBondContact O-N 3.38Å; S32-V36 VanDerWaalsContact O-N 3.14Å
33	S	98.2	Very high	97.3	Very high	16 Å²	16	46.3 Å²	46.3	11%	0.112	26%	0.261	C	S	.	.	H	α-helix	trans	-62.7	-38.9	173.2	-66.8	0	0	0	0	111.9	N29 V30 A35 V36 C37 Y203 C207	N29-S33 WeakPolarHBondContact O-CB 3.43Å; N29-S33 PolarHBondContact O-N 3.15Å; N29-S33 PolarHBondContact O-OG 2.98Å; V30-S33 PolarHBondContact O-N 3.29Å; S33-A35 PolarHBondContact O-N 3.08Å; S33-V36 PolarHBondContact O-N 3.46Å; S33-C37 PolarHBondContact O-N 3.47Å; S33-C37 PolarHBondContact O-SG 2.81Å; S33-Y203 WeakPolarHBondContact OG-CE2 3.44Å; S33-C207 VanDerWaalsContact C-SG 3.52Å; S33-C207 VanDerWaalsContact CB-SG 3.6Å
34	L	98.4	Very high	97.3	Very high	11 Å²	11	46.3 Å²	46.3	6%	0.058	26%	0.261	C	S	.	.	H	α-helix	trans	-60.3	-45.7	176.1	-179.8	65.2	0	0	0	111.1	V30 Y31 S32 V36 C37 M38 F125 C207 L210 F211	V30-L34 WeakPolarHBondContact O-CB 3.28Å; V30-L34 PolarHBondContact O-N 3Å; Y31-L34 HydrophobicContact CD1-CD2 4.05Å; Y31-L34 HydrophobicContact CE1-CD2 4.46Å; Y31-L34 PolarHBondContact O-N 3.15Å; S32-L34 VanDerWaalsContact C-N 3.31Å; S32-L34 PolarHBondContact O-N 3.44Å; L34-V36 VanDerWaalsContact C-N 3.34Å; L34-V36 PolarHBondContact O-N 3.38Å; L34-C37 WeakPolarHBondContact O-CB 3.4Å; L34-C37 PolarHBondContact O-N 3.46Å; L34-C37 VanDerWaalsContact O-N 3.14Å; L34-M38 HydrophobicContact CD1-CE 3.97Å; L34-M38 WeakPolarHBondContact O-CG 3.26Å; L34-M38 PolarHBondContact O-N 2.96Å; L34-F125 HydrophobicContact CD2-CE1 3.74Å; L34-F125 HydrophobicContact CD2-CZ 3.78Å; L34-C207 VanDerWaalsContact CA-SG 3.55Å; L34-C207 PolarHBondContact N-SG 2.83Å; L34-L210 HydrophobicContact CD1-CB 4.42Å; L34-L210 HydrophobicContact CD2-CB 4.21Å; L34-F211 VanDerWaalsContact CD1-CA 3.49Å; L34-F211 HydrophobicContact CD1-CB 3.75Å; L34-F211 HydrophobicContact CD1-CD2 4.26Å
35	A	97.9	Very high	97.3	Very high	46 Å²	46	43.6 Å²	43.6	38%	0.38	25%	0.25	S	C	.	.	H	α-helix	trans	-59.5	-43.7	176.7	0	0	0	0	0	111.8	Y31 S32 S33 C37 M38 F39	Y31-A35 PolarHBondContact O-N 3.21Å; S32-A35 PolarHBondContact O-N 3.14Å; S33-A35 PolarHBondContact O-N 3.08Å; A35-C37 VanDerWaalsContact C-N 3.35Å; A35-C37 PolarHBondContact O-N 3.11Å; A35-M38 WeakPolarHBondContact O-CB 3.4Å; A35-M38 PolarHBondContact O-N 3.34Å; A35-F39 WeakPolarHBondContact O-CD2 3.22Å; A35-F39 PolarHBondContact O-N 2.94Å
36	V	98.3	Very high	97.2	Very high	84 Å²	84	48.2 Å²	48.2	51%	0.509	26%	0.261	S	S	.	.	H	α-helix	trans	-61.4	-43.9	174.1	175	0	0	0	0	110.9	S32 S33 L34 M38 F39 V40	S32-V36 PolarHBondContact O-N 3.38Å; S32-V36 VanDerWaalsContact O-N 3.14Å; S33-V36 PolarHBondContact O-N 3.46Å; L34-V36 VanDerWaalsContact C-N 3.34Å; L34-V36 PolarHBondContact O-N 3.38Å; V36-M38 VanDerWaalsContact C-N 3.26Å; V36-M38 PolarHBondContact O-N 3.23Å; V36-F39 PolarHBondContact O-N 2.9Å; V36-F39 VanDerWaalsContact O-N 3.15Å; V36-V40 HydrophobicContact CG1-CG2 4.17Å; V36-V40 WeakPolarHBondContact O-CG2 3.32Å; V36-V40 PolarHBondContact O-N 2.98Å
37	C	98.4	Very high	97	Very high	3 Å²	3	50.1 Å²	50.1	2%	0.02	27%	0.273	C	S	.	.	H	α-helix	trans	-59.2	-36.6	176.1	-66	0	0	0	0	112.2	S33 L34 A35 V40 A41 L88 A92 F211	S33-C37 PolarHBondContact O-N 3.47Å; S33-C37 PolarHBondContact O-SG 2.81Å; L34-C37 WeakPolarHBondContact O-CB 3.4Å; L34-C37 PolarHBondContact O-N 3.46Å; L34-C37 VanDerWaalsContact O-N 3.14Å; A35-C37 VanDerWaalsContact C-N 3.35Å; A35-C37 PolarHBondContact O-N 3.11Å; C37-V40 PolarHBondContact O-N 2.67Å; C37-A41 WeakPolarHBondContact O-CB 3.5Å; C37-A41 PolarHBondContact O-N 3.23Å; C37-L88 VanDerWaalsContact SG-CG 3.57Å; C37-A92 HydrophobicContact CB-CB 3.86Å; C37-F211 HydrophobicContact CB-CD2 3.44Å; C37-F211 VanDerWaalsContact CB-CD2 3.44Å; C37-F211 HydrophobicContact CB-CE2 3.65Å; C37-F211 HydrophobicContact CB-CG 4.34Å
38	M	98	Very high	96.7	Very high	29 Å²	29	49.7 Å²	49.7	14%	0.143	27%	0.271	C	S	.	.	H	α-helix	trans	-61.7	-45.6	175	-66.7	-60.1	103.7	0	0	111.9	L34 A35 V36 A41 A42 F211 F214 I215	L34-M38 HydrophobicContact CD1-CE 3.97Å; L34-M38 WeakPolarHBondContact O-CG 3.26Å; L34-M38 PolarHBondContact O-N 2.96Å; A35-M38 WeakPolarHBondContact O-CB 3.4Å; A35-M38 PolarHBondContact O-N 3.34Å; V36-M38 VanDerWaalsContact C-N 3.26Å; V36-M38 PolarHBondContact O-N 3.23Å; M38-A41 PolarHBondContact O-N 3.37Å; M38-A42 WeakPolarHBondContact O-CB 3.4Å; M38-A42 PolarHBondContact O-N 2.89Å; M38-F211 HydrophobicContact CE-CD2 3.11Å; M38-F211 HydrophobicContact CE-CE2 3.32Å; M38-F211 HydrophobicContact CE-CG 4.24Å; M38-F214 HydrophobicContact CE-CB 4.39Å; M38-F214 HydrophobicContact CE-CD1 3.91Å; M38-F214 HydrophobicContact CE-CG 4.21Å; M38-F214 HydrophobicContact SD-CD1 3.29Å; M38-F214 WeakPolarHBondContact SD-CD1 3.32Å; M38-F214 HydrophobicContact SD-CD2 4.37Å; M38-F214 HydrophobicContact SD-CE1 3.33Å; M38-F214 WeakPolarHBondContact SD-CE1 3.49Å; M38-F214 HydrophobicContact SD-CE2 4.38Å; M38-F214 HydrophobicContact SD-CG 3.87Å; M38-F214 HydrophobicContact SD-CZ 3.9Å; M38-I215 HydrophobicContact CE-CD1 4.42Å
39	F	97.9	Very high	96.4	Very high	161 Å²	161	45.5 Å²	45.5	71%	0.706	26%	0.257	S	S	*	.	H	α-helix	trans	-64.1	-42.1	176.3	-74.1	-70.8	0	0	0	112.2	A35 V36 A42 A43	A35-F39 WeakPolarHBondContact O-CD2 3.22Å; A35-F39 PolarHBondContact O-N 2.94Å; V36-F39 PolarHBondContact O-N 2.9Å; V36-F39 VanDerWaalsContact O-N 3.15Å; F39-A42 PolarHBondContact O-N 3Å; F39-A43 PolarHBondContact O-N 2.78Å
40	V	98.4	Very high	96	Very high	35 Å²	35	46.7 Å²	46.7	21%	0.212	27%	0.267	C	S	.	.	H	α-helix	trans	-68	-40.7	179.7	175.8	0	0	0	0	111.4	V36 C37 A43 G44 A89 A92 F93	V36-V40 HydrophobicContact CG1-CG2 4.17Å; V36-V40 WeakPolarHBondContact O-CG2 3.32Å; V36-V40 PolarHBondContact O-N 2.98Å; C37-V40 PolarHBondContact O-N 2.67Å; V40-A43 WeakPolarHBondContact O-CB 3.32Å; V40-A43 PolarHBondContact O-N 3.38Å; V40-G44 PolarHBondContact O-N 3.28Å; V40-A89 HydrophobicContact CG1-CB 4.46Å; V40-A89 WeakPolarHBondContact CG1-O 3.26Å; V40-A92 HydrophobicContact CB-CB 4.31Å; V40-A92 HydrophobicContact CG1-CB 4.16Å; V40-F93 HydrophobicContact CG1-CB 3.7Å; V40-F93 HydrophobicContact CG1-CD2 4.47Å
41	A	97.8	Very high	95.3	Very high	4 Å²	4	50.1 Å²	50.1	3%	0.033	29%	0.287	C	S	.	.	H	α-helix	trans	-64.3	-41.5	173.6	0	0	0	0	0	111.5	C37 M38 A43 G44 S45 A92 G96 F211 I215	C37-A41 WeakPolarHBondContact O-CB 3.5Å; C37-A41 PolarHBondContact O-N 3.23Å; M38-A41 PolarHBondContact O-N 3.37Å; A41-A43 VanDerWaalsContact C-N 3.32Å; A41-A43 PolarHBondContact O-N 3.47Å; A41-G44 PolarHBondContact O-N 3.46Å; A41-S45 PolarHBondContact O-N 3.27Å; A41-S45 PolarHBondContact O-OG 2.95Å; A41-A92 WeakPolarHBondContact CA-O 3.25Å; A41-A92 WeakPolarHBondContact CB-O 3.44Å; A41-G96 VanDerWaalsContact O-CA 3.26Å; A41-G96 WeakPolarHBondContact O-CA 3.46Å; A41-F211 HydrophobicContact CB-CE2 4.01Å; A41-F211 HydrophobicContact CB-CZ 4.01Å; A41-I215 HydrophobicContact CB-CD1 4.44Å
42	A	96.7	Very high	94.3	Very high	58 Å²	58	56.9 Å²	56.9	48%	0.479	31%	0.313	S	S	.	.	H	α-helix	trans	-60.7	-41	173.9	0	0	0	0	0	111.9	M38 F39 S45 Y46	M38-A42 WeakPolarHBondContact O-CB 3.4Å; M38-A42 PolarHBondContact O-N 2.89Å; F39-A42 PolarHBondContact O-N 3Å; A42-S45 PolarHBondContact O-N 3.46Å; A42-Y46 WeakPolarHBondContact O-CB 3.46Å; A42-Y46 PolarHBondContact O-N 2.95Å
43	A	96.4	Very high	92.3	Very high	48 Å²	48	58.5 Å²	58.5	40%	0.397	32%	0.316	S	S	.	.	H	α-helix	trans	-62	-43.7	173.2	0	0	0	0	0	111.8	F39 V40 A41 Y46 V47	F39-A43 PolarHBondContact O-N 2.78Å; V40-A43 WeakPolarHBondContact O-CB 3.32Å; V40-A43 PolarHBondContact O-N 3.38Å; A41-A43 VanDerWaalsContact C-N 3.32Å; A41-A43 PolarHBondContact O-N 3.47Å; A43-Y46 PolarHBondContact O-N 3.49Å; A43-V47 WeakPolarHBondContact O-CG2 3.49Å; A43-V47 PolarHBondContact O-N 3.33Å
44	G	95	Very high	90.4	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-60.1	-45.3	174.4	0	0	0	0	0	113	V40 A41 Y46 V47 H48 F93 V97	V40-G44 PolarHBondContact O-N 3.28Å; A41-G44 PolarHBondContact O-N 3.46Å; G44-Y46 PolarHBondContact O-N 2.91Å; G44-V47 PolarHBondContact O-N 3.15Å; G44-H48 PolarHBondContact O-N 3.48Å; G44-F93 VanDerWaalsContact CA-CE2 3.41Å; G44-V97 WeakPolarHBondContact O-CG2 3.38Å
45	S	94.3	Very high	88.6	Confident	14 Å²	14	70.6 Å²	70.6	10%	0.098	37%	0.373	C	S	.	.	H	α-helix	trans	-60.6	-42.6	174.3	-69.4	0	0	0	0	112.5	A41 A42 H48 V49 G96 L103	A41-S45 PolarHBondContact O-N 3.27Å; A41-S45 PolarHBondContact O-OG 2.95Å; A42-S45 PolarHBondContact O-N 3.46Å; S45-H48 PolarHBondContact O-N 3.39Å; S45-V49 WeakPolarHBondContact O-CG2 3.48Å; S45-V49 PolarHBondContact O-N 3.47Å; S45-G96 WeakPolarHBondContact CA-O 3.31Å; S45-G96 PolarHBondContact N-O 2.98Å; S45-G96 PolarHBondContact OG-O 3.35Å; S45-L103 VanDerWaalsContact CB-CD1 3.49Å
46	Y	93.3	Very high	86.6	Confident	163 Å²	163	68.5 Å²	68.5	64%	0.639	36%	0.355	S	S	*	.	H	α-helix	trans	-63.8	-44.6	176.5	177.8	-100.8	0	0	0	112.1	A42 A43 G44 H48 V49 V50	A42-Y46 WeakPolarHBondContact O-CB 3.46Å; A42-Y46 PolarHBondContact O-N 2.95Å; A43-Y46 PolarHBondContact O-N 3.49Å; G44-Y46 PolarHBondContact O-N 2.91Å; Y46-H48 VanDerWaalsContact C-N 3.31Å; Y46-H48 PolarHBondContact O-N 2.88Å; Y46-V49 PolarHBondContact O-N 3.11Å; Y46-V49 VanDerWaalsContact O-N 3.17Å; Y46-V50 HydrophobicContact CD1-CG2 4.31Å; Y46-V50 HydrophobicContact CD2-CG2 4.28Å; Y46-V50 HydrophobicContact CE1-CG2 3.83Å; Y46-V50 HydrophobicContact CE2-CG2 3.8Å; Y46-V50 WeakPolarHBondContact O-CG2 3.19Å; Y46-V50 PolarHBondContact O-N 3.3Å
47	V	92.7	Very high	85.3	Confident	48 Å²	48	65.9 Å²	65.9	29%	0.291	35%	0.345	S	S	.	.	H	α-helix	trans	-56.1	-48	175.4	168.6	0	0	0	0	110.2	A43 G44 V49 V50 T51 L53 F93	A43-V47 WeakPolarHBondContact O-CG2 3.49Å; A43-V47 PolarHBondContact O-N 3.33Å; G44-V47 PolarHBondContact O-N 3.15Å; V47-V49 PolarHBondContact O-N 3.21Å; V47-V50 PolarHBondContact O-N 2.98Å; V47-T51 HydrophobicContact CG1-CG2 4.41Å; V47-T51 WeakPolarHBondContact O-CB 3.48Å; V47-T51 PolarHBondContact O-N 3.32Å; V47-T51 PolarHBondContact O-OG1 3.49Å; V47-L53 HydrophobicContact CG1-CD1 4.33Å; V47-F93 HydrophobicContact CB-CZ 4.2Å; V47-F93 HydrophobicContact CG1-CZ 4.32Å; V47-F93 HydrophobicContact CG2-CE2 4.17Å; V47-F93 HydrophobicContact CG2-CZ 4.06Å
48	H	91.3	Very high	84.4	Confident	2 Å²	2	70.8 Å²	70.8	1%	0.009	38%	0.375	C	S	.	.	H	α-helix	trans	-55	-50.9	175.2	177.1	88.4	0	0	0	111.8	G44 S45 Y46 V50 R52 L54 V97 G100 D104	G44-H48 PolarHBondContact O-N 3.48Å; S45-H48 PolarHBondContact O-N 3.39Å; Y46-H48 VanDerWaalsContact C-N 3.31Å; Y46-H48 PolarHBondContact O-N 2.88Å; H48-V50 VanDerWaalsContact C-N 3.32Å; H48-V50 PolarHBondContact O-N 3.4Å; H48-R52 WeakPolarHBondContact O-CA 3.32Å; H48-R52 PolarHBondContact O-N 2.98Å; H48-L54 PolarHBondContact CE1-O 3.15Å; H48-V97 HydrophobicContact CB-CG1 4.35Å; H48-G100 WeakPolarHBondContact CD2-CA 3.24Å; H48-G100 VanDerWaalsContact CG-CA 3.44Å; H48-G100 VanDerWaalsContact NE2-CA 3.32Å; H48-G100 WeakPolarHBondContact NE2-CA 3.31Å; H48-D104 IonicContact CD2-OD2 2.9Å; H48-D104 IonicContact CE1-OD2 3.87Å; H48-D104 IonicContact NE2-OD1 2.77Å; H48-D104 IonicContact NE2-OD2 2.74Å; H48-D104 PolarHBondContact NE2-OD2 3.46Å
49	V	89.6	Confident	83.9	Confident	56 Å²	56	74.2 Å²	74.2	34%	0.339	39%	0.393	S	S	.	.	H	α-helix	trans	-59.9	-40.8	-176.7	170.3	0	0	0	0	112.2	S45 Y46 V47 I107	S45-V49 WeakPolarHBondContact O-CG2 3.48Å; S45-V49 PolarHBondContact O-N 3.47Å; Y46-V49 PolarHBondContact O-N 3.11Å; Y46-V49 VanDerWaalsContact O-N 3.17Å; V47-V49 PolarHBondContact O-N 3.21Å; V49-I107 HydrophobicContact CG1-CD1 4.24Å; V49-I107 HydrophobicContact CG2-CD1 4.13Å
50	V	88.8	Confident	83.5	Confident	89 Å²	89	66.7 Å²	66.7	54%	0.539	36%	0.361	S	S	.	.	H	α-helix	trans	-77	-48	-177.3	173.6	0	0	0	0	112	Y46 V47 H48	Y46-V50 HydrophobicContact CD1-CG2 4.31Å; Y46-V50 HydrophobicContact CD2-CG2 4.28Å; Y46-V50 HydrophobicContact CE1-CG2 3.83Å; Y46-V50 HydrophobicContact CE2-CG2 3.8Å; Y46-V50 WeakPolarHBondContact O-CG2 3.19Å; Y46-V50 PolarHBondContact O-N 3.3Å; V47-V50 PolarHBondContact O-N 2.98Å; H48-V50 VanDerWaalsContact C-N 3.32Å; H48-V50 PolarHBondContact O-N 3.4Å
51	T	84.7	Confident	83	Confident	71 Å²	71	69.2 Å²	69.2	44%	0.436	38%	0.376	S	S	.	.	H	α-helix	trans	-89.5	-17.1	-170.8	59.4	0	0	0	0	112.5	V47 L53	V47-T51 HydrophobicContact CG1-CG2 4.41Å; V47-T51 WeakPolarHBondContact O-CB 3.48Å; V47-T51 PolarHBondContact O-N 3.32Å; V47-T51 PolarHBondContact O-OG1 3.49Å; T51-L53 HydrophobicContact CG2-CD1 4.07Å; T51-L53 PolarHBondContact O-N 3.41Å; T51-L53 VanDerWaalsContact O-N 3.09Å; T51-L53 WeakPolarHBondContact OG1-CB 3.37Å; T51-L53 WeakPolarHBondContact OG1-CD1 3.28Å; T51-L53 PolarHBondContact OG1-N 3.47Å
52	R	76.3	Confident	82.8	Confident	197 Å²	197	73.6 Å²	73.6	74%	0.743	40%	0.398	S	S	*	.			trans	46.4	31.7	-161.9	-57.5	-173.2	-179.4	-151.8	0.9	111.2	H48 L54	H48-R52 WeakPolarHBondContact O-CA 3.32Å; H48-R52 PolarHBondContact O-N 2.98Å; R52-L54 PolarHBondContact O-N 2.77Å
53	L	56.8	Low	82.7	Confident	93 Å²	93	71.7 Å²	71.7	49%	0.487	38%	0.384	S	S	.	.			trans	-59.9	110.9	-176.2	-116	150.2	0	0	0	108.3	V47 T51	V47-L53 HydrophobicContact CG1-CD1 4.33Å; T51-L53 HydrophobicContact CG2-CD1 4.07Å; T51-L53 PolarHBondContact O-N 3.41Å; T51-L53 VanDerWaalsContact O-N 3.09Å; T51-L53 WeakPolarHBondContact OG1-CB 3.37Å; T51-L53 WeakPolarHBondContact OG1-CD1 3.28Å; T51-L53 PolarHBondContact OG1-N 3.47Å
54	L	56.5	Low	82.6	Confident	86 Å²	86	70.2 Å²	70.2	45%	0.45	37%	0.371	S	S	.	.	S	Bend	trans	63	138	-175.2	-51.7	146.3	0	0	0	108.9	H48 R52 G56 L59	H48-L54 PolarHBondContact CE1-O 3.15Å; R52-L54 PolarHBondContact O-N 2.77Å; L54-G56 WeakPolarHBondContact O-CA 3.42Å; L54-G56 PolarHBondContact O-N 2.84Å; L54-L59 HydrophobicContact CD1-CB 4.37Å; L54-L59 HydrophobicContact CD1-CD2 3.63Å; L54-L59 HydrophobicContact CD1-CG 4.31Å; L54-L59 HydrophobicContact CD2-CB 4.47Å; L54-L59 HydrophobicContact CD2-CD2 3.5Å; L54-L59 VanDerWaalsContact CD2-CD2 3.5Å; L54-L59 HydrophobicContact CG-CD2 4.16Å
55	Q	60.5	Low	82.5	Confident	196 Å²	196	75.7 Å²	75.7	92%	0.916	40%	0.399	S	S	*	.			trans	-62	92.1	160.5	-74	171.2	-26.3	0	0	105.6	G57	Q55-G57 PolarHBondContact O-N 3.5Å
56	G	56	Low	82.6	Confident	1 Å²	1	77.4 Å²	77.4	1%	0.01	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	39.6	-155.6	0	0	0	0	0	116	L54 S60 G98 P101	L54-G56 WeakPolarHBondContact O-CA 3.42Å; L54-G56 PolarHBondContact O-N 2.84Å; G56-S60 VanDerWaalsContact C-OG 3.25Å; G56-S60 PolarHBondContact O-OG 3.28Å; G56-G98 WeakPolarHBondContact O-CA 3.46Å; G56-P101 WeakPolarHBondContact O-CD 3.37Å
57	G	71.9	Confident	82.8	Confident	29 Å²	29	71.8 Å²	71.8	30%	0.299	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-75.3	174.5	0	0	0	0	0	111.3	Q55 S60 V61	Q55-G57 PolarHBondContact O-N 3.5Å; G57-S60 PolarHBondContact O-OG 3.46Å; G57-V61 WeakPolarHBondContact O-CB 3.48Å; G57-V61 WeakPolarHBondContact O-CG2 3.48Å; G57-V61 PolarHBondContact O-N 3.35Å
58	V	80.3	Confident	83	Confident	107 Å²	107	71.8 Å²	71.8	65%	0.648	39%	0.392	S	S	*	.	H	α-helix	trans	-80.6	-43.4	-161.4	-177.3	0	0	0	0	113	V61 I62	V58-V61 PolarHBondContact O-N 3.46Å; V58-I62 HydrophobicContact CG1-CD1 3.71Å; V58-I62 HydrophobicContact CG1-CG1 4.28Å; V58-I62 WeakPolarHBondContact O-CG1 3.13Å; V58-I62 PolarHBondContact O-N 3.46Å
59	L	86.5	Confident	83.2	Confident	100 Å²	100	77.8 Å²	77.8	52%	0.524	42%	0.418	S	S	.	.	H	α-helix	trans	-70	-37.6	-175.5	-170.8	59.6	0	0	0	112.5	L54 I62 G63	L54-L59 HydrophobicContact CD1-CB 4.37Å; L54-L59 HydrophobicContact CD1-CD2 3.63Å; L54-L59 HydrophobicContact CD1-CG 4.31Å; L54-L59 HydrophobicContact CD2-CB 4.47Å; L54-L59 HydrophobicContact CD2-CD2 3.5Å; L54-L59 VanDerWaalsContact CD2-CD2 3.5Å; L54-L59 HydrophobicContact CG-CD2 4.16Å; L59-I62 PolarHBondContact O-N 3.09Å; L59-G63 PolarHBondContact O-N 3.24Å
60	S	89.2	Confident	83.6	Confident	4 Å²	4	81.4 Å²	81.4	3%	0.028	43%	0.426	C	S	.	.	H	α-helix	trans	-64.2	-41.5	173.1	47	0	0	0	0	111.5	G56 G57 G63 S64 G98	G56-S60 VanDerWaalsContact C-OG 3.25Å; G56-S60 PolarHBondContact O-OG 3.28Å; G57-S60 PolarHBondContact O-OG 3.46Å; S60-G63 PolarHBondContact O-N 3.16Å; S60-S64 VanDerWaalsContact O-CB 3.29Å; S60-S64 WeakPolarHBondContact O-CB 3.42Å; S60-S64 PolarHBondContact O-N 3.33Å; S60-S64 PolarHBondContact O-OG 2.9Å; S60-G98 WeakPolarHBondContact OG-CA 3.37Å
61	V	89	Confident	84	Confident	87 Å²	87	77.3 Å²	77.3	53%	0.527	40%	0.401	S	S	.	.	H	α-helix	trans	-62.2	-51.6	174.1	168.6	0	0	0	0	110.9	G57 V58 G63 S64 L65	G57-V61 WeakPolarHBondContact O-CB 3.48Å; G57-V61 WeakPolarHBondContact O-CG2 3.48Å; G57-V61 PolarHBondContact O-N 3.35Å; V58-V61 PolarHBondContact O-N 3.46Å; V61-G63 VanDerWaalsContact C-N 3.32Å; V61-G63 PolarHBondContact O-N 3.47Å; V61-S64 PolarHBondContact O-N 3.43Å; V61-S64 PolarHBondContact O-OG 3.36Å; V61-L65 WeakPolarHBondContact O-CB 3.5Å; V61-L65 PolarHBondContact O-N 2.92Å
62	I	92.6	Very high	84.5	Confident	97 Å²	97	76.7 Å²	76.7	50%	0.497	40%	0.403	S	S	.	.	H	α-helix	trans	-59.2	-45.4	178	-68	171.1	0	0	0	110.7	V58 L59 L65 A66	V58-I62 HydrophobicContact CG1-CD1 3.71Å; V58-I62 HydrophobicContact CG1-CG1 4.28Å; V58-I62 WeakPolarHBondContact O-CG1 3.13Å; V58-I62 PolarHBondContact O-N 3.46Å; L59-I62 PolarHBondContact O-N 3.09Å; I62-L65 PolarHBondContact O-N 3.18Å; I62-A66 WeakPolarHBondContact O-CB 3.35Å; I62-A66 PolarHBondContact O-N 2.96Å
63	G	94	Very high	85.4	Confident	17 Å²	17	73.3 Å²	73.3	18%	0.175	40%	0.397	C	S	.	.	H	α-helix	trans	-62.5	-44.3	178.2	0	0	0	0	0	112.4	L59 S60 V61 L65 A66 M67 L94	L59-G63 PolarHBondContact O-N 3.24Å; S60-G63 PolarHBondContact O-N 3.16Å; V61-G63 VanDerWaalsContact C-N 3.32Å; V61-G63 PolarHBondContact O-N 3.47Å; G63-L65 VanDerWaalsContact C-N 3.35Å; G63-L65 PolarHBondContact O-N 2.81Å; G63-A66 PolarHBondContact O-N 3.32Å; G63-M67 WeakPolarHBondContact O-CG 3.21Å; G63-M67 PolarHBondContact O-N 3.43Å; G63-L94 VanDerWaalsContact C-CD1 3.5Å
64	S	94.3	Very high	87.2	Confident	18 Å²	18	69.2 Å²	69.2	13%	0.126	38%	0.376	C	S	.	.	H	α-helix	trans	-63.2	-41.1	176.7	69.5	0	0	0	0	111.7	S60 V61 M67 M68 F91	S60-S64 VanDerWaalsContact O-CB 3.29Å; S60-S64 WeakPolarHBondContact O-CB 3.42Å; S60-S64 PolarHBondContact O-N 3.33Å; S60-S64 PolarHBondContact O-OG 2.9Å; V61-S64 PolarHBondContact O-N 3.43Å; V61-S64 PolarHBondContact O-OG 3.36Å; S64-M67 PolarHBondContact O-N 3.02Å; S64-M68 WeakPolarHBondContact O-CG 3.23Å; S64-M68 PolarHBondContact O-N 2.95Å; S64-F91 WeakPolarHBondContact O-CD2 3.28Å
65	L	94.6	Very high	88.9	Confident	114 Å²	114	68.9 Å²	68.9	60%	0.597	38%	0.379	S	S	*	.	H	α-helix	trans	-65.4	-40.1	175.6	-174.7	64.4	0	0	0	111.7	V61 I62 G63 M67 M68 F69	V61-L65 WeakPolarHBondContact O-CB 3.5Å; V61-L65 PolarHBondContact O-N 2.92Å; I62-L65 PolarHBondContact O-N 3.18Å; G63-L65 VanDerWaalsContact C-N 3.35Å; G63-L65 PolarHBondContact O-N 2.81Å; L65-M67 VanDerWaalsContact C-N 3.34Å; L65-M67 PolarHBondContact O-N 2.82Å; L65-M68 PolarHBondContact O-N 3.15Å; L65-F69 WeakPolarHBondContact O-CB 3.19Å; L65-F69 PolarHBondContact O-N 2.86Å
66	A	96.7	Very high	90.4	Very high	50 Å²	50	63.6 Å²	63.6	41%	0.413	35%	0.354	S	S	.	.	H	α-helix	trans	-62.5	-40.5	174.6	0	0	0	0	0	111.6	I62 G63 F69 W70	I62-A66 WeakPolarHBondContact O-CB 3.35Å; I62-A66 PolarHBondContact O-N 2.96Å; G63-A66 PolarHBondContact O-N 3.32Å; A66-F69 PolarHBondContact O-N 2.86Å; A66-W70 WeakPolarHBondContact O-CB 3.44Å; A66-W70 PolarHBondContact O-N 3.17Å
67	M	97.3	Very high	92	Very high	46 Å²	46	67.8 Å²	67.8	23%	0.227	38%	0.376	C	S	.	.	H	α-helix	trans	-66	-40.7	174.4	-67.1	-64	153.5	0	0	112	G63 S64 L65 W70 L71 I87 F91 L94	G63-M67 WeakPolarHBondContact O-CG 3.21Å; G63-M67 PolarHBondContact O-N 3.43Å; S64-M67 PolarHBondContact O-N 3.02Å; L65-M67 VanDerWaalsContact C-N 3.34Å; L65-M67 PolarHBondContact O-N 2.82Å; M67-W70 HydrophobicContact CE-CE3 4.25Å; M67-W70 HydrophobicContact CE-CZ3 4.27Å; M67-W70 PolarHBondContact O-N 3.48Å; M67-W70 HydrophobicContact SD-CE3 3.89Å; M67-W70 HydrophobicContact SD-CZ3 4.32Å; M67-L71 WeakPolarHBondContact O-CB 3.36Å; M67-L71 PolarHBondContact O-N 3.29Å; M67-I87 HydrophobicContact CB-CG2 4.19Å; M67-I87 WeakPolarHBondContact O-CG2 3.22Å; M67-I87 HydrophobicContact SD-CG2 4.26Å; M67-F91 HydrophobicContact CB-CB 3.78Å; M67-L94 HydrophobicContact CE-CD1 4.45Å; M67-L94 HydrophobicContact CG-CD1 3.88Å
68	M	95.8	Very high	92.8	Very high	48 Å²	48	71.8 Å²	71.8	24%	0.236	40%	0.397	C	S	.	.	H	α-helix	trans	-61.5	-44.9	173.9	-73.6	-177.3	69.9	0	0	111.9	S64 L65 W70 L71 A72 F91 V208 L212	S64-M68 WeakPolarHBondContact O-CG 3.23Å; S64-M68 PolarHBondContact O-N 2.95Å; L65-M68 PolarHBondContact O-N 3.15Å; M68-W70 VanDerWaalsContact C-N 3.34Å; M68-W70 PolarHBondContact O-N 3.35Å; M68-L71 WeakPolarHBondContact O-CB 3.36Å; M68-L71 PolarHBondContact O-N 2.96Å; M68-A72 PolarHBondContact O-N 3.49Å; M68-F91 HydrophobicContact CG-CD2 3.58Å; M68-F91 HydrophobicContact CG-CE2 3.35Å; M68-F91 HydrophobicContact CG-CG 4.33Å; M68-F91 HydrophobicContact CG-CZ 3.92Å; M68-F91 HydrophobicContact SD-CD2 4.34Å; M68-F91 HydrophobicContact SD-CE2 3.51Å; M68-F91 VanDerWaalsContact SD-CE2 3.51Å; M68-F91 HydrophobicContact SD-CZ 3.85Å; M68-V208 HydrophobicContact CE-CG1 4.15Å; M68-L212 HydrophobicContact CE-CD1 4.06Å
69	F	96.4	Very high	93.3	Very high	128 Å²	128	75.5 Å²	75.5	56%	0.561	41%	0.408	S	S	*	.	H	α-helix	trans	-63	-42	177	-175.3	-107.5	0	0	0	111.5	L65 A66 L71 A72 M73	L65-F69 WeakPolarHBondContact O-CB 3.19Å; L65-F69 PolarHBondContact O-N 2.86Å; A66-F69 PolarHBondContact O-N 2.86Å; F69-L71 VanDerWaalsContact C-N 3.33Å; F69-L71 PolarHBondContact O-N 3.46Å; F69-A72 PolarHBondContact O-N 3.41Å; F69-M73 HydrophobicContact CD1-CE 4.16Å; F69-M73 HydrophobicContact CD1-SD 3.8Å; F69-M73 HydrophobicContact CE1-CE 3.17Å; F69-M73 HydrophobicContact CE1-CG 4.36Å; F69-M73 HydrophobicContact CE1-SD 3.33Å; F69-M73 WeakPolarHBondContact CE1-SD 3.47Å; F69-M73 HydrophobicContact CE2-CE 3.9Å; F69-M73 HydrophobicContact CZ-CE 3.03Å; F69-M73 HydrophobicContact CZ-SD 3.82Å; F69-M73 WeakPolarHBondContact O-CG 3.4Å; F69-M73 PolarHBondContact O-N 2.97Å
70	W	97.4	Very high	93.7	Very high	131 Å²	131	72.2 Å²	72.2	50%	0.496	39%	0.391	S	S	.	.	H	α-helix	trans	-63.9	-38.2	175.8	-166.5	4.9	0	0	0	112.3	A66 M67 M68 M73 T74 I87	A66-W70 WeakPolarHBondContact O-CB 3.44Å; A66-W70 PolarHBondContact O-N 3.17Å; M67-W70 HydrophobicContact CE-CE3 4.25Å; M67-W70 HydrophobicContact CE-CZ3 4.27Å; M67-W70 PolarHBondContact O-N 3.48Å; M67-W70 HydrophobicContact SD-CE3 3.89Å; M67-W70 HydrophobicContact SD-CZ3 4.32Å; M68-W70 VanDerWaalsContact C-N 3.34Å; M68-W70 PolarHBondContact O-N 3.35Å; W70-M73 PolarHBondContact O-N 3.11Å; W70-T74 PolarHBondContact O-N 2.86Å; W70-T74 PolarHBondContact O-OG1 3.03Å; W70-I87 HydrophobicContact CB-CG2 4.41Å; W70-I87 HydrophobicContact CD2-CD1 4.09Å; W70-I87 HydrophobicContact CD2-CG1 4.28Å; W70-I87 HydrophobicContact CE3-CG1 4.47Å; W70-I87 HydrophobicContact CG-CD1 3.96Å
71	L	96.8	Very high	93.8	Very high	3 Å²	3	75.6 Å²	75.6	2%	0.016	41%	0.407	C	S	.	.	H	α-helix	trans	-63.7	-45	173.9	-176	65.9	0	0	0	111.1	M67 M68 F69 M73 T74 R84 I87 V204 W205 V208	M67-L71 WeakPolarHBondContact O-CB 3.36Å; M67-L71 PolarHBondContact O-N 3.29Å; M68-L71 WeakPolarHBondContact O-CB 3.36Å; M68-L71 PolarHBondContact O-N 2.96Å; F69-L71 VanDerWaalsContact C-N 3.33Å; F69-L71 PolarHBondContact O-N 3.46Å; L71-M73 VanDerWaalsContact C-N 3.28Å; L71-M73 PolarHBondContact O-N 2.83Å; L71-T74 PolarHBondContact O-N 3.31Å; L71-T74 VanDerWaalsContact O-N 3.12Å; L71-R84 HydrophobicContact CD1-CB 3.76Å; L71-R84 HydrophobicContact CD1-CG 3.91Å; L71-R84 PolarHBondContact O-NH1 3.43Å; L71-I87 HydrophobicContact CB-CG2 3.87Å; L71-I87 HydrophobicContact CD1-CB 4.5Å; L71-V204 HydrophobicContact CD1-CG1 3.92Å; L71-V204 HydrophobicContact CD2-CG1 4.22Å; L71-W205 HydrophobicContact CD2-CE3 4.01Å; L71-W205 HydrophobicContact CD2-CZ3 4.28Å; L71-W205 HydrophobicContact CG-CE3 4.24Å; L71-W205 HydrophobicContact CG-CZ3 4.37Å; L71-V208 HydrophobicContact CD2-CG2 3.66Å
72	A	95.1	Very high	94.1	Very high	59 Å²	59	80.1 Å²	80.1	49%	0.488	42%	0.419	S	S	.	.	H	α-helix	trans	-61.9	-35.1	177.9	0	0	0	0	0	112.6	M68 F69 T74 W205	M68-A72 PolarHBondContact O-N 3.49Å; F69-A72 PolarHBondContact O-N 3.41Å; A72-T74 VanDerWaalsContact C-N 3.33Å; A72-W205 HydrophobicContact CB-CH2 4.06Å; A72-W205 HydrophobicContact CB-CZ3 3.87Å
73	M	95.9	Very high	94.3	Very high	125 Å²	125	80.6 Å²	80.6	62%	0.616	42%	0.418	S	S	*	.	H	α-helix	trans	-77.5	-14.9	176.5	-72.8	-175.9	152.2	0	0	114.3	F69 W70 L71 P75	F69-M73 HydrophobicContact CD1-CE 4.16Å; F69-M73 HydrophobicContact CD1-SD 3.8Å; F69-M73 HydrophobicContact CE1-CE 3.17Å; F69-M73 HydrophobicContact CE1-CG 4.36Å; F69-M73 HydrophobicContact CE1-SD 3.33Å; F69-M73 WeakPolarHBondContact CE1-SD 3.47Å; F69-M73 HydrophobicContact CE2-CE 3.9Å; F69-M73 HydrophobicContact CZ-CE 3.03Å; F69-M73 HydrophobicContact CZ-SD 3.82Å; F69-M73 WeakPolarHBondContact O-CG 3.4Å; F69-M73 PolarHBondContact O-N 2.97Å; W70-M73 PolarHBondContact O-N 3.11Å; L71-M73 VanDerWaalsContact C-N 3.28Å; L71-M73 PolarHBondContact O-N 2.83Å; M73-P75 WeakPolarHBondContact O-CD 3.45Å
74	T	94.8	Very high	94.5	Very high	8 Å²	8	80.1 Å²	80.1	5%	0.049	41%	0.411	C	S	.	.	S	Bend	trans	-90.6	117.2	-178.2	-60.2	0	0	0	0	109.1	W70 L71 A72 T80 K83 R84	W70-T74 PolarHBondContact O-N 2.86Å; W70-T74 PolarHBondContact O-OG1 3.03Å; L71-T74 PolarHBondContact O-N 3.31Å; L71-T74 VanDerWaalsContact O-N 3.12Å; A72-T74 VanDerWaalsContact C-N 3.33Å; T74-T80 HydrophobicContact CG2-CG2 4.24Å; T74-K83 HydrophobicContact CG2-CD 4.31Å; T74-R84 HydrophobicContact CG2-CG 3.61Å; T74-R84 PolarHBondContact O-NH1 3.24Å
75	P	92.1	Very high	94.6	Very high	79 Å²	79	82 Å²	82	51%	0.513	42%	0.419	S	S	.	.			trans	-57.7	148.5	-177.9	-25.3	34.4	0	0	0	112.9	M73 N77 T80	M73-P75 WeakPolarHBondContact O-CD 3.45Å; P75-N77 PolarHBondContact O-N 3.5Å; P75-T80 WeakPolarHBondContact O-CB 2.96Å; P75-T80 PolarHBondContact O-OG1 3.31Å
76	H	90.9	Very high	94.8	Very high	85 Å²	85	78.7 Å²	78.7	39%	0.394	41%	0.413	S	S	.	.			trans	-84.3	88.9	175	174.9	67.1	0	0	0	110.6	K201 D202	H76-K201 PolarHBondContact CE1-O 2.62Å; H76-K201 PolarHBondContact NE2-O 3.09Å; H76-D202 HydrophobicContact CB-CB 4.47Å; H76-D202 IonicContact ND1-OD1 3.63Å; H76-D202 PolarHBondContact ND1-OD1 3.41Å
77	N	90.8	Very high	94.9	Very high	88 Å²	88	76.8 Å²	76.8	47%	0.471	40%	0.395	S	S	.	.	S	Bend	trans	-135.3	158.9	177.4	-68.3	-15.3	0	0	0	110.1	P75 E79 T80 E81	P75-N77 PolarHBondContact O-N 3.5Å; N77-E79 PolarHBondContact O-N 2.9Å; N77-T80 PolarHBondContact N-OG1 3.11Å; N77-T80 PolarHBondContact O-N 3.47Å; N77-T80 VanDerWaalsContact O-N 3.13Å; N77-T80 PolarHBondContact O-OG1 3.37Å; N77-E81 PolarHBondContact O-N 2.9Å
78	P	87.8	Confident	94.9	Very high	114 Å²	114	74.8 Å²	74.8	74%	0.74	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-33.5	178.4	-26.1	35	0	0	0	114	E81	P78-E81 WeakPolarHBondContact O-CB 3.08Å
79	E	91.3	Very high	95	Very high	185 Å²	185	74.2 Å²	74.2	86%	0.864	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-33.2	179.8	-61.4	-178.1	174.3	0	0	113	N77	N77-E79 PolarHBondContact O-N 2.9Å
80	T	93.9	Very high	95.1	Very high	30 Å²	30	69.3 Å²	69.3	18%	0.184	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-8.1	-177.4	57	0	0	0	0	112.6	T74 P75 N77 K82 K83 R84	T74-T80 HydrophobicContact CG2-CG2 4.24Å; P75-T80 WeakPolarHBondContact O-CB 2.96Å; P75-T80 PolarHBondContact O-OG1 3.31Å; N77-T80 PolarHBondContact N-OG1 3.11Å; N77-T80 PolarHBondContact O-N 3.47Å; N77-T80 VanDerWaalsContact O-N 3.13Å; N77-T80 PolarHBondContact O-OG1 3.37Å; T80-K82 PolarHBondContact O-N 3.5Å; T80-K83 WeakPolarHBondContact O-CB 3.35Å; T80-K83 PolarHBondContact O-N 3.25Å; T80-K83 VanDerWaalsContact O-N 3.08Å; T80-R84 WeakPolarHBondContact O-CG 3.44Å; T80-R84 PolarHBondContact O-N 3.28Å
81	E	93	Very high	95.1	Very high	75 Å²	75	63.2 Å²	63.2	35%	0.35	35%	0.351	S	S	.	.	H	α-helix	trans	-54.1	-50.9	-174.7	-174.6	178.1	-170	0	0	112.6	N77 P78 K83 R84 L85 Y203	N77-E81 PolarHBondContact O-N 2.9Å; P78-E81 WeakPolarHBondContact O-CB 3.08Å; E81-K83 VanDerWaalsContact C-N 3.29Å; E81-K83 PolarHBondContact O-N 3.13Å; E81-R84 PolarHBondContact O-N 3.33Å; E81-R84 VanDerWaalsContact O-N 3.15Å; E81-L85 HydrophobicContact CG-CD1 4.46Å; E81-L85 WeakPolarHBondContact O-CG 3.39Å; E81-L85 PolarHBondContact O-N 3.09Å; E81-Y203 HydrophobicContact CG-CE1 4.45Å; E81-Y203 WeakPolarHBondContact OE1-CE1 3.27Å; E81-Y203 VanDerWaalsContact OE1-CZ 3.3Å; E81-Y203 PolarHBondContact OE1-OH 3.12Å
82	K	95.1	Very high	95.2	Very high	183 Å²	183	63.1 Å²	63.1	80%	0.796	35%	0.35	S	S	*	.	H	α-helix	trans	-59.9	-39.9	178.7	-66.8	-177	-177.6	177.2	0	112.3	T80 G86	T80-K82 PolarHBondContact O-N 3.5Å; K82-G86 PolarHBondContact O-N 3.26Å
83	K	96.5	Very high	95.3	Very high	107 Å²	107	63.5 Å²	63.5	47%	0.465	34%	0.341	S	S	.	.	H	α-helix	trans	-65.4	-45.7	176.5	-179.9	-176.2	176.3	-175.5	0	110.5	T74 T80 E81 L85 G86 I87	T74-K83 HydrophobicContact CG2-CD 4.31Å; T80-K83 WeakPolarHBondContact O-CB 3.35Å; T80-K83 PolarHBondContact O-N 3.25Å; T80-K83 VanDerWaalsContact O-N 3.08Å; E81-K83 VanDerWaalsContact C-N 3.29Å; E81-K83 PolarHBondContact O-N 3.13Å; K83-L85 VanDerWaalsContact C-N 3.34Å; K83-L85 PolarHBondContact O-N 3Å; K83-G86 PolarHBondContact O-N 3.1Å; K83-G86 VanDerWaalsContact O-N 3.13Å; K83-I87 HydrophobicContact CG-CD1 4.1Å; K83-I87 WeakPolarHBondContact O-CG1 3.34Å; K83-I87 PolarHBondContact O-N 3.22Å
84	R	97.6	Very high	95.3	Very high	6 Å²	6	59.6 Å²	59.6	2%	0.023	32%	0.322	C	S	.	.	H	α-helix	trans	-60.5	-41.8	177.7	-71.4	179.4	60.1	89.8	1.1	111.8	L71 T74 T80 E81 I87 L88 D202 V204	L71-R84 HydrophobicContact CD1-CB 3.76Å; L71-R84 HydrophobicContact CD1-CG 3.91Å; L71-R84 PolarHBondContact O-NH1 3.43Å; T74-R84 HydrophobicContact CG2-CG 3.61Å; T74-R84 PolarHBondContact O-NH1 3.24Å; T80-R84 WeakPolarHBondContact O-CG 3.44Å; T80-R84 PolarHBondContact O-N 3.28Å; E81-R84 PolarHBondContact O-N 3.33Å; E81-R84 VanDerWaalsContact O-N 3.15Å; R84-I87 PolarHBondContact O-N 3.02Å; R84-L88 WeakPolarHBondContact O-CB 3.48Å; R84-L88 PolarHBondContact O-N 2.96Å; R84-D202 IonicContact CZ-OD1 2.8Å; R84-D202 IonicContact CZ-OD2 3.96Å; R84-D202 IonicContact NE-OD1 3.08Å; R84-D202 IonicContact NH1-OD2 2.65Å; R84-D202 IonicContact NH2-OD1 3.81Å; R84-D202 PolarHBondContact NH2-OD1 2.92Å; R84-D202 IonicContact NH2-OD2 3.41Å; R84-D202 PolarHBondContact NH2-OD2 3.37Å; R84-V204 HydrophobicContact CB-CG1 4.21Å; R84-V204 HydrophobicContact CB-CG2 4.41Å
85	L	97.4	Very high	95.4	Very high	59 Å²	59	60 Å²	60	31%	0.309	33%	0.325	S	S	.	.	H	α-helix	trans	-63.4	-39	173.1	-71	175	0	0	0	112.5	E81 K83 L88 A89 Y203 V204	E81-L85 HydrophobicContact CG-CD1 4.46Å; E81-L85 WeakPolarHBondContact O-CG 3.39Å; E81-L85 PolarHBondContact O-N 3.09Å; K83-L85 VanDerWaalsContact C-N 3.34Å; K83-L85 PolarHBondContact O-N 3Å; L85-L88 HydrophobicContact CD2-CD2 4.37Å; L85-L88 PolarHBondContact O-N 3.01Å; L85-A89 WeakPolarHBondContact O-CB 3.24Å; L85-A89 PolarHBondContact O-N 2.94Å; L85-Y203 HydrophobicContact CD2-CE2 4.03Å; L85-V204 HydrophobicContact CD2-CG2 4Å; L85-V204 HydrophobicContact CG-CG2 4.45Å
86	G	97.9	Very high	95.5	Very high	44 Å²	44	56.2 Å²	56.2	45%	0.454	30%	0.3	S	S	.	.	H	α-helix	trans	-62.4	-43.1	173.1	0	0	0	0	0	112.8	K82 K83 A89 G90	K82-G86 PolarHBondContact O-N 3.26Å; K83-G86 PolarHBondContact O-N 3.1Å; K83-G86 VanDerWaalsContact O-N 3.13Å; G86-A89 PolarHBondContact O-N 3.47Å; G86-G90 PolarHBondContact O-N 3.03Å
87	I	98.1	Very high	95.7	Very high	10 Å²	10	52.7 Å²	52.7	5%	0.051	29%	0.285	C	S	.	.	H	α-helix	trans	-64	-43.3	174.8	-62.6	164.8	0	0	0	110.3	M67 W70 L71 K83 R84 A89 G90 F91	M67-I87 HydrophobicContact CB-CG2 4.19Å; M67-I87 WeakPolarHBondContact O-CG2 3.22Å; M67-I87 HydrophobicContact SD-CG2 4.26Å; W70-I87 HydrophobicContact CB-CG2 4.41Å; W70-I87 HydrophobicContact CD2-CD1 4.09Å; W70-I87 HydrophobicContact CD2-CG1 4.28Å; W70-I87 HydrophobicContact CE3-CG1 4.47Å; W70-I87 HydrophobicContact CG-CD1 3.96Å; L71-I87 HydrophobicContact CB-CG2 3.87Å; L71-I87 HydrophobicContact CD1-CB 4.5Å; K83-I87 HydrophobicContact CG-CD1 4.1Å; K83-I87 WeakPolarHBondContact O-CG1 3.34Å; K83-I87 PolarHBondContact O-N 3.22Å; R84-I87 PolarHBondContact O-N 3.02Å; I87-A89 VanDerWaalsContact C-N 3.34Å; I87-A89 PolarHBondContact O-N 3.27Å; I87-G90 PolarHBondContact O-N 3.08Å; I87-F91 WeakPolarHBondContact O-CB 3.46Å; I87-F91 PolarHBondContact O-N 3.29Å
88	L	98.4	Very high	95.8	Very high	4 Å²	4	49.7 Å²	49.7	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-59.2	-43.1	175.7	176.8	66.3	0	0	0	111.7	C37 R84 L85 F91 A92 V204 C207 V208	C37-L88 VanDerWaalsContact SG-CG 3.57Å; R84-L88 WeakPolarHBondContact O-CB 3.48Å; R84-L88 PolarHBondContact O-N 2.96Å; L85-L88 HydrophobicContact CD2-CD2 4.37Å; L85-L88 PolarHBondContact O-N 3.01Å; L88-F91 HydrophobicContact CD1-CD1 4.21Å; L88-F91 WeakPolarHBondContact O-CB 3.31Å; L88-F91 PolarHBondContact O-N 2.85Å; L88-A92 WeakPolarHBondContact O-CB 3.46Å; L88-A92 PolarHBondContact O-N 3.23Å; L88-V204 HydrophobicContact CB-CG1 4.06Å; L88-V204 HydrophobicContact CD2-CG1 3.95Å; L88-V204 HydrophobicContact CG-CG1 4.45Å; L88-C207 HydrophobicContact CD2-CB 4.32Å; L88-V208 HydrophobicContact CD1-CG2 3.55Å
89	A	98.4	Very high	96.1	Very high	36 Å²	36	44.7 Å²	44.7	30%	0.298	24%	0.241	S	C	.	.	H	α-helix	trans	-64.3	-43.4	175.5	0	0	0	0	0	111.7	V40 L85 G86 I87 F91 A92 F93	V40-A89 HydrophobicContact CG1-CB 4.46Å; V40-A89 WeakPolarHBondContact CG1-O 3.26Å; L85-A89 WeakPolarHBondContact O-CB 3.24Å; L85-A89 PolarHBondContact O-N 2.94Å; G86-A89 PolarHBondContact O-N 3.47Å; I87-A89 VanDerWaalsContact C-N 3.34Å; I87-A89 PolarHBondContact O-N 3.27Å; A89-F91 VanDerWaalsContact C-N 3.35Å; A89-F91 PolarHBondContact O-N 3.04Å; A89-A92 PolarHBondContact O-N 3.32Å; A89-F93 WeakPolarHBondContact O-CB 3.33Å; A89-F93 PolarHBondContact O-N 2.87Å
90	G	97.9	Very high	96.1	Very high	24 Å²	24	35.9 Å²	35.9	25%	0.247	20%	0.2	C	C	.	.	H	α-helix	trans	-60.3	-43.4	174.3	0	0	0	0	0	112.6	G86 I87 F93 L94	G86-G90 PolarHBondContact O-N 3.03Å; I87-G90 PolarHBondContact O-N 3.08Å; G90-F93 PolarHBondContact O-N 3.4Å; G90-L94 WeakPolarHBondContact O-CB 3.47Å; G90-L94 VanDerWaalsContact O-CG 3.3Å; G90-L94 WeakPolarHBondContact O-CG 3.23Å; G90-L94 PolarHBondContact O-N 3.03Å
91	F	98.3	Very high	96	Very high	4 Å²	4	37.2 Å²	37.2	2%	0.018	21%	0.209	C	C	.	.	H	α-helix	trans	-57.6	-54	172.3	167.5	-112.4	0	0	0	111.4	S64 M67 M68 I87 L88 A89 F93 L94 T95 V208 F211 L212	S64-F91 WeakPolarHBondContact O-CD2 3.28Å; M67-F91 HydrophobicContact CB-CB 3.78Å; M68-F91 HydrophobicContact CG-CD2 3.58Å; M68-F91 HydrophobicContact CG-CE2 3.35Å; M68-F91 HydrophobicContact CG-CG 4.33Å; M68-F91 HydrophobicContact CG-CZ 3.92Å; M68-F91 HydrophobicContact SD-CD2 4.34Å; M68-F91 HydrophobicContact SD-CE2 3.51Å; M68-F91 VanDerWaalsContact SD-CE2 3.51Å; M68-F91 HydrophobicContact SD-CZ 3.85Å; I87-F91 WeakPolarHBondContact O-CB 3.46Å; I87-F91 PolarHBondContact O-N 3.29Å; L88-F91 HydrophobicContact CD1-CD1 4.21Å; L88-F91 WeakPolarHBondContact O-CB 3.31Å; L88-F91 PolarHBondContact O-N 2.85Å; A89-F91 VanDerWaalsContact C-N 3.35Å; A89-F91 PolarHBondContact O-N 3.04Å; F91-F93 VanDerWaalsContact C-N 3.31Å; F91-F93 PolarHBondContact O-N 3.41Å; F91-L94 PolarHBondContact O-N 2.95Å; F91-T95 PolarHBondContact O-N 3.33Å; F91-T95 PolarHBondContact O-OG1 3.02Å; F91-V208 HydrophobicContact CE1-CG1 3.98Å; F91-V208 HydrophobicContact CE1-CG2 4.43Å; F91-V208 HydrophobicContact CZ-CG1 4.27Å; F91-F211 HydrophobicContact CD1-CD1 4.25Å; F91-F211 HydrophobicContact CD1-CE1 4.2Å; F91-F211 AromaticContact CE1-CD1 3.45Å; F91-F211 HydrophobicContact CE1-CD1 3.45Å; F91-F211 VanDerWaalsContact CE1-CD1 3.45Å; F91-F211 AromaticContact CE1-CE1 3.64Å; F91-F211 HydrophobicContact CE1-CE1 3.64Å; F91-F211 HydrophobicContact CZ-CD1 4.08Å; F91-F211 HydrophobicContact CZ-CE1 4.13Å; F91-L212 HydrophobicContact CZ-CD2 3.81Å; F91-L212 HydrophobicContact CZ-CG 4.2Å
92	A	98.4	Very high	96	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-59.4	-41.3	-179.4	0	0	0	0	0	112.3	C37 V40 A41 L88 A89 T95 G96 F211	C37-A92 HydrophobicContact CB-CB 3.86Å; V40-A92 HydrophobicContact CB-CB 4.31Å; V40-A92 HydrophobicContact CG1-CB 4.16Å; A41-A92 WeakPolarHBondContact CA-O 3.25Å; A41-A92 WeakPolarHBondContact CB-O 3.44Å; L88-A92 WeakPolarHBondContact O-CB 3.46Å; L88-A92 PolarHBondContact O-N 3.23Å; A89-A92 PolarHBondContact O-N 3.32Å; A92-T95 PolarHBondContact O-N 3.37Å; A92-G96 PolarHBondContact O-N 3.25Å; A92-F211 HydrophobicContact CB-CE1 4.4Å; A92-F211 HydrophobicContact CB-CE2 3.99Å; A92-F211 HydrophobicContact CB-CZ 3.78Å
93	F	97.3	Very high	95.9	Very high	68 Å²	68	26.5 Å²	26.5	30%	0.298	16%	0.164	S	C	.	.	H	α-helix	trans	-61.6	-49.4	176.7	-177.7	-93.6	0	0	0	111.3	V40 G44 V47 A89 G90 F91 T95 G96 V97	V40-F93 HydrophobicContact CG1-CB 3.7Å; V40-F93 HydrophobicContact CG1-CD2 4.47Å; G44-F93 VanDerWaalsContact CA-CE2 3.41Å; V47-F93 HydrophobicContact CB-CZ 4.2Å; V47-F93 HydrophobicContact CG1-CZ 4.32Å; V47-F93 HydrophobicContact CG2-CE2 4.17Å; V47-F93 HydrophobicContact CG2-CZ 4.06Å; A89-F93 WeakPolarHBondContact O-CB 3.33Å; A89-F93 PolarHBondContact O-N 2.87Å; G90-F93 PolarHBondContact O-N 3.4Å; F91-F93 VanDerWaalsContact C-N 3.31Å; F91-F93 PolarHBondContact O-N 3.41Å; F93-T95 VanDerWaalsContact C-N 3.35Å; F93-T95 PolarHBondContact O-N 3.49Å; F93-G96 WeakPolarHBondContact O-CA 3.48Å; F93-G96 PolarHBondContact O-N 2.93Å; F93-G96 VanDerWaalsContact O-N 3.11Å; F93-V97 HydrophobicContact CD1-CG2 4.15Å; F93-V97 HydrophobicContact CE1-CG2 3.8Å; F93-V97 HydrophobicContact CZ-CG2 4.25Å; F93-V97 WeakPolarHBondContact O-CG2 3.34Å; F93-V97 PolarHBondContact O-N 3.17Å
94	L	95.9	Very high	95.7	Very high	42 Å²	42	24 Å²	24	22%	0.22	16%	0.156	C	C	.	.	H	α-helix	trans	-66	-36.5	179.5	-70.7	170.3	0	0	0	112.2	G63 M67 G90 F91 G96 V97 G98	G63-L94 VanDerWaalsContact C-CD1 3.5Å; M67-L94 HydrophobicContact CE-CD1 4.45Å; M67-L94 HydrophobicContact CG-CD1 3.88Å; G90-L94 WeakPolarHBondContact O-CB 3.47Å; G90-L94 VanDerWaalsContact O-CG 3.3Å; G90-L94 WeakPolarHBondContact O-CG 3.23Å; G90-L94 PolarHBondContact O-N 3.03Å; F91-L94 PolarHBondContact O-N 2.95Å; L94-G96 VanDerWaalsContact C-N 3.32Å; L94-V97 PolarHBondContact O-N 2.92Å; L94-G98 PolarHBondContact O-N 3.29Å
95	T	96.1	Very high	95.5	Very high	17 Å²	17	27.3 Å²	27.3	10%	0.104	17%	0.17	C	C	.	.	H	α-helix	trans	-61.9	-41.7	170.6	-58.6	0	0	0	0	111.1	F91 A92 F93 G98 L99 F211 I215	F91-T95 PolarHBondContact O-N 3.33Å; F91-T95 PolarHBondContact O-OG1 3.02Å; A92-T95 PolarHBondContact O-N 3.37Å; F93-T95 VanDerWaalsContact C-N 3.35Å; F93-T95 PolarHBondContact O-N 3.49Å; T95-G98 CarbonylContact O-C 3.56Å; T95-G98 WeakPolarHBondContact O-CA 3.41Å; T95-G98 PolarHBondContact O-N 2.89Å; T95-G98 VanDerWaalsContact O-N 3.1Å; T95-L99 PolarHBondContact O-N 3.2Å; T95-L99 VanDerWaalsContact O-N 3.13Å; T95-F211 HydrophobicContact CG2-CE1 3.74Å; T95-F211 HydrophobicContact CG2-CZ 4.02Å; T95-I215 HydrophobicContact CG2-CB 4.5Å; T95-I215 HydrophobicContact CG2-CG1 4.23Å; T95-I215 HydrophobicContact CG2-CG2 3.82Å
96	G	95.4	Very high	95.4	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-59.4	-45.9	173.6	0	0	0	0	0	113.3	A41 S45 A92 F93 L94 G98 L99	A41-G96 VanDerWaalsContact O-CA 3.26Å; A41-G96 WeakPolarHBondContact O-CA 3.46Å; S45-G96 WeakPolarHBondContact CA-O 3.31Å; S45-G96 PolarHBondContact N-O 2.98Å; S45-G96 PolarHBondContact OG-O 3.35Å; A92-G96 PolarHBondContact O-N 3.25Å; F93-G96 WeakPolarHBondContact O-CA 3.48Å; F93-G96 PolarHBondContact O-N 2.93Å; F93-G96 VanDerWaalsContact O-N 3.11Å; L94-G96 VanDerWaalsContact C-N 3.32Å; G96-G98 VanDerWaalsContact C-N 3.26Å; G96-G98 PolarHBondContact O-N 3.15Å; G96-L99 WeakPolarHBondContact O-CB 3.3Å; G96-L99 PolarHBondContact O-N 3.5Å
97	V	94.8	Very high	95.3	Very high	11 Å²	11	25.4 Å²	25.4	7%	0.067	15%	0.15	C	C	.	.	H	α-helix	trans	-60.5	-39.6	171.5	175.5	0	0	0	0	110.5	G44 H48 F93 L94 L99 G100	G44-V97 WeakPolarHBondContact O-CG2 3.38Å; H48-V97 HydrophobicContact CB-CG1 4.35Å; F93-V97 HydrophobicContact CD1-CG2 4.15Å; F93-V97 HydrophobicContact CE1-CG2 3.8Å; F93-V97 HydrophobicContact CZ-CG2 4.25Å; F93-V97 WeakPolarHBondContact O-CG2 3.34Å; F93-V97 PolarHBondContact O-N 3.17Å; L94-V97 PolarHBondContact O-N 2.92Å; V97-L99 PolarHBondContact O-N 3.44Å; V97-G100 WeakPolarHBondContact O-CA 3.12Å; V97-G100 PolarHBondContact O-N 3.18Å
98	G	93.3	Very high	95.1	Very high	24 Å²	24	30.1 Å²	30.1	25%	0.247	18%	0.179	C	C	.	.	H	α-helix	trans	-59.9	-24.4	176.6	0	0	0	0	0	115.4	G56 S60 L94 T95 G96 G100	G56-G98 WeakPolarHBondContact O-CA 3.46Å; S60-G98 WeakPolarHBondContact OG-CA 3.37Å; L94-G98 PolarHBondContact O-N 3.29Å; T95-G98 CarbonylContact O-C 3.56Å; T95-G98 WeakPolarHBondContact O-CA 3.41Å; T95-G98 PolarHBondContact O-N 2.89Å; T95-G98 VanDerWaalsContact O-N 3.1Å; G96-G98 VanDerWaalsContact C-N 3.26Å; G96-G98 PolarHBondContact O-N 3.15Å; G98-G100 PolarHBondContact O-N 3.25Å
99	L	93.6	Very high	95	Very high	9 Å²	9	30.6 Å²	30.6	5%	0.047	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-13.1	172.7	-67.3	176.1	0	0	0	112.9	T95 G96 V97 T102 L103 I215 F218 R219	T95-L99 PolarHBondContact O-N 3.2Å; T95-L99 VanDerWaalsContact O-N 3.13Å; G96-L99 WeakPolarHBondContact O-CB 3.3Å; G96-L99 PolarHBondContact O-N 3.5Å; V97-L99 PolarHBondContact O-N 3.44Å; L99-T102 WeakPolarHBondContact O-CA 3.49Å; L99-T102 WeakPolarHBondContact O-CB 3.43Å; L99-T102 PolarHBondContact O-N 3.38Å; L99-L103 HydrophobicContact CB-CD1 4.21Å; L99-L103 HydrophobicContact CB-CG 4.41Å; L99-L103 PolarHBondContact O-N 3.04Å; L99-I215 HydrophobicContact CD1-CD1 4.09Å; L99-I215 HydrophobicContact CD1-CG2 4.33Å; L99-I215 HydrophobicContact CD2-CG2 4.12Å; L99-F218 HydrophobicContact CD1-CD1 3.96Å; L99-F218 HydrophobicContact CD1-CE1 3.97Å; L99-R219 HydrophobicContact CD2-CB 4.06Å; L99-R219 HydrophobicContact CD2-CG 4.23Å
100	G	91.8	Very high	94.8	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-44	-57.7	-174.9	0	0	0	0	0	115.4	H48 V97 G98 T102 L103 D104	H48-G100 WeakPolarHBondContact CD2-CA 3.24Å; H48-G100 VanDerWaalsContact CG-CA 3.44Å; H48-G100 VanDerWaalsContact NE2-CA 3.32Å; H48-G100 WeakPolarHBondContact NE2-CA 3.31Å; V97-G100 WeakPolarHBondContact O-CA 3.12Å; V97-G100 PolarHBondContact O-N 3.18Å; G98-G100 PolarHBondContact O-N 3.25Å; G100-T102 PolarHBondContact O-N 2.85Å; G100-L103 WeakPolarHBondContact O-CA 3.17Å; G100-L103 WeakPolarHBondContact O-CB 3.41Å; G100-L103 PolarHBondContact O-N 3.37Å; G100-D104 PolarHBondContact O-N 3.28Å
101	P	90.2	Very high	94.7	Very high	58 Å²	58	33.4 Å²	33.4	38%	0.377	19%	0.191	S	C	.	.	H	α-helix	trans	-59	-32.9	179.1	-26.2	35	0	0	0	113.9	G56 F105	G56-P101 WeakPolarHBondContact O-CD 3.37Å; P101-F105 PolarHBondContact O-N 3.06Å
102	T	92.7	Very high	94.6	Very high	26 Å²	26	36.3 Å²	36.3	16%	0.16	21%	0.211	C	C	.	.	H	α-helix	trans	-71.6	-41.3	175.5	-56.3	0	0	0	0	110.5	L99 G100 F105 V106 R219 M222 I223	L99-T102 WeakPolarHBondContact O-CA 3.49Å; L99-T102 WeakPolarHBondContact O-CB 3.43Å; L99-T102 PolarHBondContact O-N 3.38Å; G100-T102 PolarHBondContact O-N 2.85Å; T102-F105 WeakPolarHBondContact O-CB 3.33Å; T102-F105 PolarHBondContact O-N 3.46Å; T102-V106 VanDerWaalsContact O-CG2 3.26Å; T102-V106 WeakPolarHBondContact O-CG2 3.33Å; T102-V106 PolarHBondContact O-N 2.8Å; T102-R219 HydrophobicContact CG2-CG 4.34Å; T102-M222 HydrophobicContact CG2-CE 4.3Å; T102-I223 HydrophobicContact CG2-CD1 4.08Å; T102-I223 HydrophobicContact CG2-CG1 3.72Å
103	L	94.3	Very high	94.6	Very high	7 Å²	7	36.8 Å²	36.8	4%	0.037	21%	0.214	C	C	.	.	H	α-helix	trans	-63.2	-45	175.9	-67.2	169.6	0	0	0	111.3	S45 L99 G100 F105 V106 I107 I114 M222	S45-L103 VanDerWaalsContact CB-CD1 3.49Å; L99-L103 HydrophobicContact CB-CD1 4.21Å; L99-L103 HydrophobicContact CB-CG 4.41Å; L99-L103 PolarHBondContact O-N 3.04Å; G100-L103 WeakPolarHBondContact O-CA 3.17Å; G100-L103 WeakPolarHBondContact O-CB 3.41Å; G100-L103 PolarHBondContact O-N 3.37Å; L103-F105 VanDerWaalsContact C-N 3.29Å; L103-F105 PolarHBondContact O-N 2.91Å; L103-V106 PolarHBondContact O-N 3.35Å; L103-V106 VanDerWaalsContact O-N 3.09Å; L103-I107 WeakPolarHBondContact O-CB 3.12Å; L103-I107 VanDerWaalsContact O-CG1 3.22Å; L103-I107 WeakPolarHBondContact O-CG1 3.43Å; L103-I107 PolarHBondContact O-N 3.42Å; L103-I114 HydrophobicContact CD2-CD1 3.84Å; L103-I114 HydrophobicContact CD2-CG1 3.97Å; L103-I114 HydrophobicContact CD2-CG2 4.07Å; L103-M222 HydrophobicContact CD2-CE 4.23Å; L103-M222 HydrophobicContact CD2-SD 3.66Å
104	D	93	Very high	94.6	Very high	56 Å²	56	35.7 Å²	35.7	30%	0.299	21%	0.21	S	C	.	.	H	α-helix	trans	-55.6	-46.9	176.2	-68	-28.8	0	0	0	110.6	H48 G100 V106 I107 T108	H48-D104 IonicContact CD2-OD2 2.9Å; H48-D104 IonicContact CE1-OD2 3.87Å; H48-D104 IonicContact NE2-OD1 2.77Å; H48-D104 IonicContact NE2-OD2 2.74Å; H48-D104 PolarHBondContact NE2-OD2 3.46Å; G100-D104 PolarHBondContact O-N 3.28Å; D104-V106 PolarHBondContact O-N 3.48Å; D104-I107 PolarHBondContact O-N 3Å; D104-T108 VanDerWaalsContact O-CG2 3.23Å; D104-T108 WeakPolarHBondContact O-CG2 3.29Å; D104-T108 PolarHBondContact O-N 2.93Å; D104-T108 VanDerWaalsContact O-N 3.15Å
105	F	92.6	Very high	94.6	Very high	74 Å²	74	39.3 Å²	39.3	33%	0.325	23%	0.228	S	C	.	.	H	α-helix	trans	-57.5	-50.8	173.9	173.1	-99.3	0	0	0	111.9	P101 T102 L103 I107 T108 V109 A226 K230	P101-F105 PolarHBondContact O-N 3.06Å; T102-F105 WeakPolarHBondContact O-CB 3.33Å; T102-F105 PolarHBondContact O-N 3.46Å; L103-F105 VanDerWaalsContact C-N 3.29Å; L103-F105 PolarHBondContact O-N 2.91Å; F105-I107 PolarHBondContact O-N 3.48Å; F105-T108 PolarHBondContact O-N 2.91Å; F105-T108 PolarHBondContact O-OG1 3.44Å; F105-V109 HydrophobicContact CE1-CG2 4.32Å; F105-V109 HydrophobicContact CZ-CG2 4.32Å; F105-V109 WeakPolarHBondContact O-CG2 3.33Å; F105-V109 PolarHBondContact O-N 2.73Å; F105-A226 HydrophobicContact CD1-CB 4.31Å; F105-A226 HydrophobicContact CE1-CB 3.77Å; F105-K230 HydrophobicContact CZ-CD 4.27Å
106	V	96	Very high	94.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.4	-40.2	-178.2	176.4	0	0	0	0	111.6	T102 L103 D104 T108 V109 N110 I113 I114 M222 A226	T102-V106 VanDerWaalsContact O-CG2 3.26Å; T102-V106 WeakPolarHBondContact O-CG2 3.33Å; T102-V106 PolarHBondContact O-N 2.8Å; L103-V106 PolarHBondContact O-N 3.35Å; L103-V106 VanDerWaalsContact O-N 3.09Å; D104-V106 PolarHBondContact O-N 3.48Å; V106-T108 VanDerWaalsContact C-N 3.28Å; V106-T108 PolarHBondContact O-N 3.47Å; V106-V109 WeakPolarHBondContact O-CB 3.26Å; V106-V109 PolarHBondContact O-N 3.44Å; V106-N110 CarbonylContact O-C 3.59Å; V106-N110 PolarHBondContact O-N 3.01Å; V106-I113 HydrophobicContact CG1-CB 3.67Å; V106-I113 HydrophobicContact CG1-CG2 3.73Å; V106-I114 HydrophobicContact CB-CG1 4.34Å; V106-I114 HydrophobicContact CG1-CD1 4.48Å; V106-I114 HydrophobicContact CG1-CG1 3.73Å; V106-M222 HydrophobicContact CG2-CB 4.17Å; V106-A226 HydrophobicContact CG2-CB 4.05Å
107	I	95	Very high	94.8	Very high	64 Å²	64	42.1 Å²	42.1	33%	0.328	25%	0.245	S	C	.	.	H	α-helix	trans	-58.9	-40.7	176.7	-70.3	165.7	0	0	0	110.5	V49 L103 D104 F105 V109 P111 I114	V49-I107 HydrophobicContact CG1-CD1 4.24Å; V49-I107 HydrophobicContact CG2-CD1 4.13Å; L103-I107 WeakPolarHBondContact O-CB 3.12Å; L103-I107 VanDerWaalsContact O-CG1 3.22Å; L103-I107 WeakPolarHBondContact O-CG1 3.43Å; L103-I107 PolarHBondContact O-N 3.42Å; D104-I107 PolarHBondContact O-N 3Å; F105-I107 PolarHBondContact O-N 3.48Å; I107-V109 PolarHBondContact O-N 3.24Å; I107-P111 HydrophobicContact CG2-CG 4.31Å; I107-P111 WeakPolarHBondContact O-CD 3.09Å; I107-I114 HydrophobicContact CD1-CD1 4.29Å; I107-I114 HydrophobicContact CG1-CD1 3.73Å
108	T	94.3	Very high	95	Very high	109 Å²	109	45.3 Å²	45.3	67%	0.669	26%	0.258	S	S	*	.	H	α-helix	trans	-66.4	-25	176.2	71.6	0	0	0	0	113.6	D104 F105 V106	D104-T108 VanDerWaalsContact O-CG2 3.23Å; D104-T108 WeakPolarHBondContact O-CG2 3.29Å; D104-T108 PolarHBondContact O-N 2.93Å; D104-T108 VanDerWaalsContact O-N 3.15Å; F105-T108 PolarHBondContact O-N 2.91Å; F105-T108 PolarHBondContact O-OG1 3.44Å; V106-T108 VanDerWaalsContact C-N 3.28Å; V106-T108 PolarHBondContact O-N 3.47Å
109	V	95	Very high	95.2	Very high	13 Å²	13	48.6 Å²	48.6	8%	0.079	27%	0.269	C	S	.	.	H	α-helix	trans	-84.6	-63.1	178.5	-179.8	0	0	0	0	110.8	F105 V106 I107 I113 A226 D229 K230 K233	F105-V109 HydrophobicContact CE1-CG2 4.32Å; F105-V109 HydrophobicContact CZ-CG2 4.32Å; F105-V109 WeakPolarHBondContact O-CG2 3.33Å; F105-V109 PolarHBondContact O-N 2.73Å; V106-V109 WeakPolarHBondContact O-CB 3.26Å; V106-V109 PolarHBondContact O-N 3.44Å; I107-V109 PolarHBondContact O-N 3.24Å; V109-I113 HydrophobicContact CG1-CD1 4.32Å; V109-A226 HydrophobicContact CB-CB 4.43Å; V109-A226 HydrophobicContact CG1-CB 4.41Å; V109-A226 HydrophobicContact CG2-CB 4.34Å; V109-D229 HydrophobicContact CG1-CB 3.98Å; V109-D229 WeakPolarHBondContact CG1-OD2 3.45Å; V109-K230 HydrophobicContact CB-CG 4.48Å; V109-K230 HydrophobicContact CG1-CG 3.81Å; V109-K230 HydrophobicContact CG2-CD 4.02Å; V109-K230 HydrophobicContact CG2-CG 3.82Å; V109-K233 PolarHBondContact O-NZ 3.19Å
110	N	95.3	Very high	95.4	Very high	43 Å²	43	49.4 Å²	49.4	23%	0.23	28%	0.28	C	S	.	.			trans	-168.2	108.6	-177.4	-177.1	-8.6	0	0	0	108.8	V106 S112 I113	V106-N110 CarbonylContact O-C 3.59Å; V106-N110 PolarHBondContact O-N 3.01Å; N110-S112 PolarHBondContact ND2-OG 3.32Å; N110-S112 PolarHBondContact O-N 2.9Å; N110-S112 WeakPolarHBondContact OD1-CB 3.44Å; N110-S112 PolarHBondContact OD1-N 3.49Å; N110-S112 PolarHBondContact OD1-OG 2.85Å; N110-I113 HydrophobicContact CB-CD1 3.77Å; N110-I113 HydrophobicContact CB-CG1 3.99Å; N110-I113 WeakPolarHBondContact O-CB 3.5Å; N110-I113 WeakPolarHBondContact O-CG1 3.32Å; N110-I113 PolarHBondContact O-N 2.95Å
111	P	95.1	Very high	95.8	Very high	77 Å²	77	49.4 Å²	49.4	50%	0.5	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-26.6	179.7	-24.6	33.7	0	0	0	114.5	I107 I113 I114	I107-P111 HydrophobicContact CG2-CG 4.31Å; I107-P111 WeakPolarHBondContact O-CD 3.09Å; P111-I113 PolarHBondContact O-N 3.04Å; P111-I113 VanDerWaalsContact O-N 3.12Å; P111-I114 PolarHBondContact O-N 2.99Å
112	S	96.4	Very high	96.1	Very high	65 Å²	65	47.7 Å²	47.7	46%	0.455	27%	0.27	S	S	.	.	H	α-helix	trans	-64.5	-19	-179.3	79.8	0	0	0	0	112.9	N110 I114 M115 T116	N110-S112 PolarHBondContact ND2-OG 3.32Å; N110-S112 PolarHBondContact O-N 2.9Å; N110-S112 WeakPolarHBondContact OD1-CB 3.44Å; N110-S112 PolarHBondContact OD1-N 3.49Å; N110-S112 PolarHBondContact OD1-OG 2.85Å; S112-I114 VanDerWaalsContact C-N 3.28Å; S112-I114 PolarHBondContact O-N 2.94Å; S112-M115 PolarHBondContact O-N 3.47Å; S112-T116 PolarHBondContact O-N 3.26Å; S112-T116 VanDerWaalsContact O-N 3.15Å; S112-T116 PolarHBondContact O-OG1 3.32Å
113	I	97.7	Very high	96.4	Very high	9 Å²	9	50.9 Å²	50.9	5%	0.046	29%	0.289	C	S	.	.	H	α-helix	trans	-64.7	-33.1	177.9	-67.2	176.8	0	0	0	111.4	V106 V109 N110 P111 M115 T116 A117 L225 A226 D229	V106-I113 HydrophobicContact CG1-CB 3.67Å; V106-I113 HydrophobicContact CG1-CG2 3.73Å; V109-I113 HydrophobicContact CG1-CD1 4.32Å; N110-I113 HydrophobicContact CB-CD1 3.77Å; N110-I113 HydrophobicContact CB-CG1 3.99Å; N110-I113 WeakPolarHBondContact O-CB 3.5Å; N110-I113 WeakPolarHBondContact O-CG1 3.32Å; N110-I113 PolarHBondContact O-N 2.95Å; P111-I113 PolarHBondContact O-N 3.04Å; P111-I113 VanDerWaalsContact O-N 3.12Å; I113-M115 PolarHBondContact O-N 2.97Å; I113-T116 PolarHBondContact O-N 2.97Å; I113-A117 VanDerWaalsContact O-CB 3.22Å; I113-A117 WeakPolarHBondContact O-CB 3.15Å; I113-A117 PolarHBondContact O-N 2.68Å; I113-L225 HydrophobicContact CD1-CB 4.45Å; I113-L225 HydrophobicContact CG1-CB 4.46Å; I113-L225 HydrophobicContact CG2-CB 3.48Å; I113-L225 VanDerWaalsContact CG2-CB 3.48Å; I113-L225 HydrophobicContact CG2-CD1 4.14Å; I113-L225 HydrophobicContact CG2-CG 4.47Å; I113-A226 HydrophobicContact CD1-CB 4.16Å; I113-D229 HydrophobicContact CD1-CB 3.85Å
114	I	97.6	Very high	96.6	Very high	45 Å²	45	52.6 Å²	52.6	23%	0.231	30%	0.297	C	S	.	.	H	α-helix	trans	-59.7	-50.5	-179.8	-62.5	171.1	0	0	0	109.9	L103 V106 I107 P111 S112 A117 F118 F218 M222	L103-I114 HydrophobicContact CD2-CD1 3.84Å; L103-I114 HydrophobicContact CD2-CG1 3.97Å; L103-I114 HydrophobicContact CD2-CG2 4.07Å; V106-I114 HydrophobicContact CB-CG1 4.34Å; V106-I114 HydrophobicContact CG1-CD1 4.48Å; V106-I114 HydrophobicContact CG1-CG1 3.73Å; I107-I114 HydrophobicContact CD1-CD1 4.29Å; I107-I114 HydrophobicContact CG1-CD1 3.73Å; P111-I114 PolarHBondContact O-N 2.99Å; S112-I114 VanDerWaalsContact C-N 3.28Å; S112-I114 PolarHBondContact O-N 2.94Å; I114-A117 PolarHBondContact O-N 2.7Å; I114-F118 PolarHBondContact O-N 3.2Å; I114-F218 HydrophobicContact CG2-CZ 4.29Å; I114-M222 HydrophobicContact CG1-SD 4.48Å
115	M	96.9	Very high	96.8	Very high	119 Å²	119	50.4 Å²	50.4	59%	0.586	29%	0.285	S	S	*	.	H	α-helix	trans	-64.1	-44.8	179.1	-134.8	-55.1	-148.6	0	0	111	S112 I113 A117 F118 L119	S112-M115 PolarHBondContact O-N 3.47Å; I113-M115 PolarHBondContact O-N 2.97Å; M115-A117 VanDerWaalsContact C-N 3.35Å; M115-A117 PolarHBondContact O-N 3.25Å; M115-F118 PolarHBondContact O-N 2.74Å; M115-L119 HydrophobicContact CE-CD1 4.1Å; M115-L119 HydrophobicContact CE-CG 4.45Å; M115-L119 WeakPolarHBondContact O-CG 3.46Å; M115-L119 PolarHBondContact O-N 3.17Å; M115-L119 HydrophobicContact SD-CD1 3.66Å; M115-L119 HydrophobicContact SD-CD2 4.28Å; M115-L119 HydrophobicContact SD-CG 3.67Å
116	T	97.8	Very high	97.1	Very high	76 Å²	76	51.5 Å²	51.5	47%	0.466	29%	0.294	S	S	.	.	H	α-helix	trans	-60.9	-43.3	178.8	-53.2	0	0	0	0	111.8	S112 I113 G120 L225	S112-T116 PolarHBondContact O-N 3.26Å; S112-T116 VanDerWaalsContact O-N 3.15Å; S112-T116 PolarHBondContact O-OG1 3.32Å; I113-T116 PolarHBondContact O-N 2.97Å; T116-G120 PolarHBondContact O-N 3.17Å; T116-L225 HydrophobicContact CG2-CD1 4.03Å
117	A	98.1	Very high	97.1	Very high	0 Å²	0	55 Å²	55	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-66.6	-41.6	177.3	0	0	0	0	0	111.3	I113 I114 M115 G120 T121 F218 L221 M222 L225	I113-A117 VanDerWaalsContact O-CB 3.22Å; I113-A117 WeakPolarHBondContact O-CB 3.15Å; I113-A117 PolarHBondContact O-N 2.68Å; I114-A117 PolarHBondContact O-N 2.7Å; M115-A117 VanDerWaalsContact C-N 3.35Å; M115-A117 PolarHBondContact O-N 3.25Å; A117-G120 PolarHBondContact O-N 3.06Å; A117-T121 WeakPolarHBondContact O-CB 3.49Å; A117-T121 PolarHBondContact O-N 2.72Å; A117-T121 PolarHBondContact O-OG1 3.06Å; A117-F218 HydrophobicContact CB-CD2 4.08Å; A117-F218 HydrophobicContact CB-CE2 3.9Å; A117-L221 HydrophobicContact CB-CB 4.45Å; A117-L221 HydrophobicContact CB-CD2 4.5Å; A117-L221 HydrophobicContact CB-CG 4.27Å; A117-L221 WeakPolarHBondContact O-CD2 3.33Å; A117-M222 HydrophobicContact CB-CB 4.17Å; A117-M222 HydrophobicContact CB-CG 3.34Å; A117-L225 HydrophobicContact CB-CD1 4.07Å
118	F	97.9	Very high	97.3	Very high	78 Å²	78	55.4 Å²	55.4	34%	0.342	32%	0.317	S	S	.	.	H	α-helix	trans	-63	-46.5	179	-179.9	-98.4	0	0	0	111.6	I114 M115 T121 S122 F214 F218	I114-F118 PolarHBondContact O-N 3.2Å; M115-F118 PolarHBondContact O-N 2.74Å; F118-T121 PolarHBondContact O-N 3.11Å; F118-S122 WeakPolarHBondContact O-CB 3.08Å; F118-S122 PolarHBondContact O-N 3.01Å; F118-S122 PolarHBondContact O-OG 3.21Å; F118-F214 HydrophobicContact CD2-CE1 4.18Å; F118-F214 HydrophobicContact CD2-CZ 4.17Å; F118-F214 AromaticContact CE2-CE1 3.94Å; F118-F214 HydrophobicContact CE2-CE1 3.94Å; F118-F214 AromaticContact CE2-CZ 3.82Å; F118-F214 HydrophobicContact CE2-CZ 3.82Å; F118-F214 HydrophobicContact CZ-CZ 4.46Å; F118-F218 HydrophobicContact CB-CD2 4.26Å; F118-F218 HydrophobicContact CB-CE2 3.73Å; F118-F218 HydrophobicContact CB-CZ 4.44Å; F118-F218 HydrophobicContact CD2-CE2 4.44Å
119	L	98.3	Very high	97.4	Very high	92 Å²	92	50.7 Å²	50.7	48%	0.482	29%	0.288	S	S	.	.	H	α-helix	trans	-63.8	-45	175.6	-68	178.1	0	0	0	111.6	M115 T121 S122 V123	M115-L119 HydrophobicContact CE-CD1 4.1Å; M115-L119 HydrophobicContact CE-CG 4.45Å; M115-L119 WeakPolarHBondContact O-CG 3.46Å; M115-L119 PolarHBondContact O-N 3.17Å; M115-L119 HydrophobicContact SD-CD1 3.66Å; M115-L119 HydrophobicContact SD-CD2 4.28Å; M115-L119 HydrophobicContact SD-CG 3.67Å; L119-T121 PolarHBondContact O-N 3.23Å; L119-S122 WeakPolarHBondContact O-CB 3.4Å; L119-S122 PolarHBondContact O-N 3.18Å; L119-V123 WeakPolarHBondContact O-CG2 3.32Å; L119-V123 PolarHBondContact O-N 3.34Å
120	G	98.4	Very high	97.3	Very high	26 Å²	26	53.1 Å²	53.1	27%	0.268	30%	0.3	S	S	.	.	H	α-helix	trans	-59.7	-45.4	176.9	0	0	0	0	0	112.4	T116 A117 V123 I124	T116-G120 PolarHBondContact O-N 3.17Å; A117-G120 PolarHBondContact O-N 3.06Å; G120-V123 PolarHBondContact O-N 2.97Å; G120-I124 VanDerWaalsContact O-CG1 3.26Å; G120-I124 WeakPolarHBondContact O-CG1 3.43Å; G120-I124 PolarHBondContact O-N 3.49Å
121	T	98.4	Very high	97.3	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-63.4	-41.6	175	-64.4	0	0	0	0	111.8	A117 F118 L119 V123 I124 F125 F214 I217 F218	A117-T121 WeakPolarHBondContact O-CB 3.49Å; A117-T121 PolarHBondContact O-N 2.72Å; A117-T121 PolarHBondContact O-OG1 3.06Å; F118-T121 PolarHBondContact O-N 3.11Å; L119-T121 PolarHBondContact O-N 3.23Å; T121-V123 VanDerWaalsContact C-N 3.35Å; T121-V123 PolarHBondContact O-N 2.95Å; T121-I124 PolarHBondContact O-N 2.99Å; T121-F125 WeakPolarHBondContact O-CB 3.41Å; T121-F125 PolarHBondContact O-N 3.39Å; T121-F214 HydrophobicContact CG2-CD1 4.03Å; T121-F214 HydrophobicContact CG2-CD2 3.94Å; T121-F214 HydrophobicContact CG2-CE1 3.84Å; T121-F214 HydrophobicContact CG2-CE2 3.77Å; T121-F214 HydrophobicContact CG2-CG 4.08Å; T121-F214 HydrophobicContact CG2-CZ 3.7Å; T121-I217 HydrophobicContact CG2-CB 3.86Å; T121-I217 HydrophobicContact CG2-CG2 3.57Å; T121-F218 HydrophobicContact CG2-CB 4.05Å; T121-F218 VanDerWaalsContact OG1-CA 3.23Å; T121-F218 WeakPolarHBondContact OG1-CA 3.22Å; T121-F218 PolarHBondContact OG1-N 3.4Å
122	S	98.1	Very high	97.3	Very high	23 Å²	23	49.9 Å²	49.9	16%	0.161	28%	0.282	C	S	.	.	H	α-helix	trans	-60.3	-45	176.9	-59.1	0	0	0	0	111.5	F118 L119 F125 I126	F118-S122 WeakPolarHBondContact O-CB 3.08Å; F118-S122 PolarHBondContact O-N 3.01Å; F118-S122 PolarHBondContact O-OG 3.21Å; L119-S122 WeakPolarHBondContact O-CB 3.4Å; L119-S122 PolarHBondContact O-N 3.18Å; S122-F125 PolarHBondContact O-N 3.04Å; S122-I126 WeakPolarHBondContact O-CB 3.44Å; S122-I126 WeakPolarHBondContact O-CD1 3.1Å; S122-I126 WeakPolarHBondContact O-CG1 2.93Å; S122-I126 PolarHBondContact O-N 3.03Å
123	V	98.4	Very high	97.1	Very high	93 Å²	93	48 Å²	48	56%	0.564	27%	0.267	S	S	*	.	H	α-helix	trans	-62.8	-48.3	176	171.7	0	0	0	0	111.2	L119 G120 T121 F125 I126 C127	L119-V123 WeakPolarHBondContact O-CG2 3.32Å; L119-V123 PolarHBondContact O-N 3.34Å; G120-V123 PolarHBondContact O-N 2.97Å; T121-V123 VanDerWaalsContact C-N 3.35Å; T121-V123 PolarHBondContact O-N 2.95Å; V123-F125 PolarHBondContact O-N 3.2Å; V123-I126 PolarHBondContact O-N 3.25Å; V123-C127 WeakPolarHBondContact O-CB 3.25Å; V123-C127 PolarHBondContact O-N 3.32Å; V123-C127 PolarHBondContact O-SG 3.41Å
124	I	98.3	Very high	96.7	Very high	42 Å²	42	52.1 Å²	52.1	22%	0.215	28%	0.283	C	S	.	.	H	α-helix	trans	-55.2	-53.8	176.6	-72.2	167	0	0	0	109.9	G120 T121 I126 C127 F128 C182 I217 L221	G120-I124 VanDerWaalsContact O-CG1 3.26Å; G120-I124 WeakPolarHBondContact O-CG1 3.43Å; G120-I124 PolarHBondContact O-N 3.49Å; T121-I124 PolarHBondContact O-N 2.99Å; I124-I126 PolarHBondContact O-N 3.3Å; I124-C127 PolarHBondContact O-N 3.5Å; I124-F128 HydrophobicContact CG2-CD2 3.75Å; I124-F128 HydrophobicContact CG2-CE2 3.98Å; I124-F128 VanDerWaalsContact O-CD2 3.24Å; I124-F128 WeakPolarHBondContact O-CD2 3.4Å; I124-F128 PolarHBondContact O-N 3.1Å; I124-C182 WeakPolarHBondContact CG2-SG 3.27Å; I124-I217 HydrophobicContact CD1-CG2 4.43Å; I124-I217 HydrophobicContact CG2-CD1 4.35Å; I124-I217 HydrophobicContact CG2-CG2 4.29Å; I124-L221 HydrophobicContact CD1-CD2 4.35Å
125	F	98	Very high	96.4	Very high	11 Å²	11	50.8 Å²	50.8	5%	0.048	28%	0.279	C	S	.	.	H	α-helix	trans	-60.6	-48	-175.9	-168	-85.3	0	0	0	111.4	Y31 L34 T121 S122 V123 C127 F128 T129 V185 L210 D213 F214	Y31-F125 HydrophobicContact CE1-CE1 4.06Å; L34-F125 HydrophobicContact CD2-CE1 3.74Å; L34-F125 HydrophobicContact CD2-CZ 3.78Å; T121-F125 WeakPolarHBondContact O-CB 3.41Å; T121-F125 PolarHBondContact O-N 3.39Å; S122-F125 PolarHBondContact O-N 3.04Å; V123-F125 PolarHBondContact O-N 3.2Å; F125-C127 PolarHBondContact O-N 2.94Å; F125-F128 PolarHBondContact O-N 3.5Å; F125-T129 WeakPolarHBondContact CE1-OG1 3.38Å; F125-T129 WeakPolarHBondContact O-CB 3.4Å; F125-T129 PolarHBondContact O-N 2.93Å; F125-T129 PolarHBondContact O-OG1 3.36Å; F125-T129 VanDerWaalsContact O-OG1 3.11Å; F125-V185 HydrophobicContact CD2-CG1 4.02Å; F125-V185 HydrophobicContact CD2-CG2 3.66Å; F125-V185 HydrophobicContact CE2-CG1 4.06Å; F125-V185 HydrophobicContact CE2-CG2 3.81Å; F125-V185 HydrophobicContact CG-CG1 4.38Å; F125-V185 HydrophobicContact CZ-CG1 4.44Å; F125-L210 HydrophobicContact CZ-CB 4.04Å; F125-L210 HydrophobicContact CZ-CD1 4.45Å; F125-L210 HydrophobicContact CZ-CD2 4.15Å; F125-L210 HydrophobicContact CZ-CG 4.44Å; F125-D213 HydrophobicContact CE2-CB 4.28Å; F125-F214 HydrophobicContact CB-CD2 3.97Å; F125-F214 HydrophobicContact CB-CE2 4.26Å; F125-F214 HydrophobicContact CD1-CD2 4.31Å; F125-F214 HydrophobicContact CD2-CB 4.02Å; F125-F214 AromaticContact CD2-CD2 3.78Å; F125-F214 HydrophobicContact CD2-CD2 3.78Å; F125-F214 HydrophobicContact CD2-CG 4.38Å; F125-F214 HydrophobicContact CE2-CB 4Å; F125-F214 HydrophobicContact CE2-CD2 4.37Å; F125-F214 AromaticContact CG-CD2 3.76Å; F125-F214 HydrophobicContact CG-CD2 3.76Å; F125-F214 HydrophobicContact CG-CE2 4.44Å
126	I	97.3	Very high	96.1	Very high	97 Å²	97	53 Å²	53	50%	0.497	29%	0.285	S	S	.	.	H	α-helix	trans	-60.5	-46.1	177.2	-69.4	165.6	0	0	0	111.1	S122 V123 I124 T129 L130	S122-I126 WeakPolarHBondContact O-CB 3.44Å; S122-I126 WeakPolarHBondContact O-CD1 3.1Å; S122-I126 WeakPolarHBondContact O-CG1 2.93Å; S122-I126 PolarHBondContact O-N 3.03Å; V123-I126 PolarHBondContact O-N 3.25Å; I124-I126 PolarHBondContact O-N 3.3Å; I126-T129 PolarHBondContact O-N 2.88Å; I126-L130 HydrophobicContact CG2-CD1 3.77Å; I126-L130 HydrophobicContact CG2-CG 4.25Å; I126-L130 WeakPolarHBondContact O-CB 3.41Å; I126-L130 VanDerWaalsContact O-CG 3.27Å; I126-L130 WeakPolarHBondContact O-CG 3.29Å; I126-L130 PolarHBondContact O-N 3.18Å
127	C	97.7	Very high	95.4	Very high	74 Å²	74	53.2 Å²	53.2	50%	0.5	28%	0.277	S	S	.	.	H	α-helix	trans	-60.8	-47.6	179.8	-74.4	0	0	0	0	112.1	V123 I124 F125 S131	V123-C127 WeakPolarHBondContact O-CB 3.25Å; V123-C127 PolarHBondContact O-N 3.32Å; V123-C127 PolarHBondContact O-SG 3.41Å; I124-C127 PolarHBondContact O-N 3.5Å; F125-C127 PolarHBondContact O-N 2.94Å; C127-S131 WeakPolarHBondContact O-CB 3.37Å; C127-S131 PolarHBondContact O-N 2.94Å
128	F	97.5	Very high	94.9	Very high	71 Å²	71	59.8 Å²	59.8	31%	0.311	30%	0.302	S	S	.	.	H	α-helix	trans	-70.3	-40.3	179.3	-78.9	-73.6	0	0	0	112	I124 F125 L130 S131 A132 C182 V185 L186	I124-F128 HydrophobicContact CG2-CD2 3.75Å; I124-F128 HydrophobicContact CG2-CE2 3.98Å; I124-F128 VanDerWaalsContact O-CD2 3.24Å; I124-F128 WeakPolarHBondContact O-CD2 3.4Å; I124-F128 PolarHBondContact O-N 3.1Å; F125-F128 PolarHBondContact O-N 3.5Å; F128-L130 PolarHBondContact O-N 3.35Å; F128-S131 WeakPolarHBondContact O-CB 3.3Å; F128-S131 PolarHBondContact O-N 3.32Å; F128-A132 PolarHBondContact O-N 3.31Å; F128-C182 HydrophobicContact CD2-CB 3.99Å; F128-C182 HydrophobicContact CE1-CB 4.34Å; F128-C182 HydrophobicContact CE2-CB 3.6Å; F128-C182 HydrophobicContact CZ-CB 3.78Å; F128-V185 HydrophobicContact CB-CB 4.1Å; F128-V185 HydrophobicContact CB-CG1 3.76Å; F128-L186 HydrophobicContact CB-CD2 4.28Å; F128-L186 HydrophobicContact CB-CG 4.25Å; F128-L186 HydrophobicContact CD1-CD1 3.62Å; F128-L186 HydrophobicContact CD1-CD2 3.84Å; F128-L186 HydrophobicContact CD1-CG 3.54Å; F128-L186 HydrophobicContact CE1-CD1 3.94Å; F128-L186 HydrophobicContact CE1-CG 4.35Å; F128-L186 HydrophobicContact CG-CG 4.34Å; F128-L186 VanDerWaalsContact O-CD2 3.25Å; F128-L186 WeakPolarHBondContact O-CD2 3.23Å
129	T	96.5	Very high	94.6	Very high	10 Å²	10	58.1 Å²	58.1	6%	0.061	30%	0.3	C	S	.	.	H	α-helix	trans	-58.7	-47.5	172.4	-73.8	0	0	0	0	111.9	Y31 F125 I126 S131 A132 L133 T189	Y31-T129 HydrophobicContact CE1-CG2 3.87Å; Y31-T129 HydrophobicContact CE2-CG2 4.37Å; Y31-T129 WeakPolarHBondContact OH-CG2 3.48Å; F125-T129 WeakPolarHBondContact CE1-OG1 3.38Å; F125-T129 WeakPolarHBondContact O-CB 3.4Å; F125-T129 PolarHBondContact O-N 2.93Å; F125-T129 PolarHBondContact O-OG1 3.36Å; F125-T129 VanDerWaalsContact O-OG1 3.11Å; I126-T129 PolarHBondContact O-N 2.88Å; T129-S131 VanDerWaalsContact C-N 3.34Å; T129-S131 PolarHBondContact O-N 3.47Å; T129-A132 WeakPolarHBondContact O-CB 3.42Å; T129-A132 PolarHBondContact O-N 2.99Å; T129-A132 VanDerWaalsContact O-N 3.17Å; T129-L133 HydrophobicContact CG2-CD1 3.79Å; T129-L133 HydrophobicContact CG2-CG 4.35Å; T129-L133 WeakPolarHBondContact O-CG 3.34Å; T129-L133 PolarHBondContact O-N 3.23Å; T129-T189 HydrophobicContact CG2-CG2 4.37Å
130	L	94.4	Very high	94.4	Very high	65 Å²	65	56.3 Å²	56.3	34%	0.34	29%	0.287	S	S	.	.	H	α-helix	trans	-63.4	-42.1	177.5	-72.8	174.8	0	0	0	111.3	I126 F128 A132 L133 Y134	I126-L130 HydrophobicContact CG2-CD1 3.77Å; I126-L130 HydrophobicContact CG2-CG 4.25Å; I126-L130 WeakPolarHBondContact O-CB 3.41Å; I126-L130 VanDerWaalsContact O-CG 3.27Å; I126-L130 WeakPolarHBondContact O-CG 3.29Å; I126-L130 PolarHBondContact O-N 3.18Å; F128-L130 PolarHBondContact O-N 3.35Å; L130-A132 VanDerWaalsContact C-N 3.26Å; L130-A132 PolarHBondContact O-N 2.84Å; L130-L133 HydrophobicContact CD2-CD1 4.41Å; L130-L133 PolarHBondContact O-N 2.92Å; L130-L133 VanDerWaalsContact O-N 3.15Å; L130-Y134 HydrophobicContact CB-CD2 4.38Å; L130-Y134 HydrophobicContact CB-CE2 4.3Å; L130-Y134 HydrophobicContact CD2-CE2 4.21Å; L130-Y134 WeakPolarHBondContact O-CD2 2.95Å; L130-Y134 PolarHBondContact O-N 3.37Å
131	S	94.7	Very high	94.2	Very high	51 Å²	51	57 Å²	57	36%	0.357	29%	0.285	S	S	.	.	H	α-helix	trans	-57.3	-41.4	173.9	-171.2	0	0	0	0	111.5	C127 F128 T129 A135 Y140	C127-S131 WeakPolarHBondContact O-CB 3.37Å; C127-S131 PolarHBondContact O-N 2.94Å; F128-S131 WeakPolarHBondContact O-CB 3.3Å; F128-S131 PolarHBondContact O-N 3.32Å; T129-S131 VanDerWaalsContact C-N 3.34Å; T129-S131 PolarHBondContact O-N 3.47Å; S131-A135 VanDerWaalsContact O-CB 3.28Å; S131-A135 WeakPolarHBondContact O-CB 3.01Å; S131-A135 PolarHBondContact O-N 3.06Å; S131-A135 VanDerWaalsContact O-N 3.11Å; S131-Y140 PolarHBondContact OG-OH 2.83Å; S131-Y140 VanDerWaalsContact OG-OH 3.13Å
132	A	94.3	Very high	94	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-65.9	-44.6	174	0	0	0	0	0	112.2	F128 T129 L130 Y134 A135 Y140 L186 T189 Q190	F128-A132 PolarHBondContact O-N 3.31Å; T129-A132 WeakPolarHBondContact O-CB 3.42Å; T129-A132 PolarHBondContact O-N 2.99Å; T129-A132 VanDerWaalsContact O-N 3.17Å; L130-A132 VanDerWaalsContact C-N 3.26Å; L130-A132 PolarHBondContact O-N 2.84Å; A132-Y134 VanDerWaalsContact C-N 3.3Å; A132-Y134 PolarHBondContact O-N 3.1Å; A132-A135 PolarHBondContact O-N 2.58Å; A132-Y140 HydrophobicContact CB-CD2 4.39Å; A132-L186 HydrophobicContact CB-CD2 4.15Å; A132-T189 HydrophobicContact CB-CG2 3.59Å; A132-Q190 HydrophobicContact CB-CG 4.22Å; A132-Q190 PolarHBondContact O-NE2 2.83Å
133	L	92.4	Very high	93.8	Very high	25 Å²	25	64.8 Å²	64.8	13%	0.131	32%	0.317	C	S	.	.	H	α-helix	trans	-64.8	-31.6	-179.5	-69.7	167.7	0	0	0	113.4	F16 I19 L27 T129 L130 T189 I193	F16-L133 HydrophobicContact CD1-CB 4.24Å; F16-L133 HydrophobicContact CE1-CB 3.79Å; I19-L133 HydrophobicContact CD1-CD2 4.04Å; L27-L133 HydrophobicContact CD1-CD2 3.68Å; T129-L133 HydrophobicContact CG2-CD1 3.79Å; T129-L133 HydrophobicContact CG2-CG 4.35Å; T129-L133 WeakPolarHBondContact O-CG 3.34Å; T129-L133 PolarHBondContact O-N 3.23Å; L130-L133 HydrophobicContact CD2-CD1 4.41Å; L130-L133 PolarHBondContact O-N 2.92Å; L130-L133 VanDerWaalsContact O-N 3.15Å; L133-T189 HydrophobicContact CD2-CG2 4.27Å; L133-T189 HydrophobicContact CG-CG2 4.2Å; L133-I193 HydrophobicContact CD2-CD1 3.93Å
134	Y	90.7	Very high	93.5	Very high	96 Å²	96	61 Å²	61	38%	0.376	30%	0.298	S	S	.	.	H	α-helix	trans	-86.9	-18.5	177.4	-72.7	-56.6	0	0	0	114.6	I13 F16 L130 A132	I13-Y134 WeakPolarHBondContact CG2-OH 3.5Å; I13-Y134 WeakPolarHBondContact O-CE1 3.45Å; I13-Y134 VanDerWaalsContact O-CZ 3.24Å; I13-Y134 PolarHBondContact O-OH 3.49Å; F16-Y134 HydrophobicContact CD1-CE1 4.21Å; F16-Y134 HydrophobicContact CE1-CD1 4.2Å; F16-Y134 AromaticContact CE1-CE1 3.64Å; F16-Y134 HydrophobicContact CE1-CE1 3.64Å; F16-Y134 AromaticContact CE1-CZ 3.85Å; F16-Y134 HydrophobicContact CZ-CE1 4.34Å; L130-Y134 HydrophobicContact CB-CD2 4.38Å; L130-Y134 HydrophobicContact CB-CE2 4.3Å; L130-Y134 HydrophobicContact CD2-CE2 4.21Å; L130-Y134 WeakPolarHBondContact O-CD2 2.95Å; L130-Y134 PolarHBondContact O-N 3.37Å; A132-Y134 VanDerWaalsContact C-N 3.3Å; A132-Y134 PolarHBondContact O-N 3.1Å
135	A	90.8	Very high	93.4	Very high	18 Å²	18	61.5 Å²	61.5	15%	0.149	31%	0.313	C	S	.	.	S	Bend	trans	-71.7	153.2	-178.9	0	0	0	0	0	111.6	S131 A132 R137 S139 Y140	S131-A135 VanDerWaalsContact O-CB 3.28Å; S131-A135 WeakPolarHBondContact O-CB 3.01Å; S131-A135 PolarHBondContact O-N 3.06Å; S131-A135 VanDerWaalsContact O-N 3.11Å; A132-A135 PolarHBondContact O-N 2.58Å; A135-R137 PolarHBondContact O-N 3.09Å; A135-S139 WeakPolarHBondContact CB-OG 3.38Å; A135-Y140 HydrophobicContact CB-CD2 3.94Å; A135-Y140 HydrophobicContact CB-CE2 3.32Å
136	K	89.1	Confident	93.4	Very high	164 Å²	164	65.5 Å²	65.5	71%	0.713	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-55.5	132.8	174.4	-175.5	178.8	-179.8	-179.1	0	109.3	R138 S139	K136-R138 PolarHBondContact O-N 3.48Å; K136-S139 WeakPolarHBondContact O-CB 3.27Å; K136-S139 PolarHBondContact O-N 3.33Å; K136-S139 PolarHBondContact O-OG 3.14Å
137	R	84.8	Confident	93.3	Very high	81 Å²	81	61.6 Å²	61.6	31%	0.306	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.3	133.3	179.3	-166.9	-177.5	162.7	172.6	-6.3	111.8	A135 S139 E194 E197	A135-R137 PolarHBondContact O-N 3.09Å; R137-S139 VanDerWaalsContact C-N 3.25Å; R137-S139 PolarHBondContact O-N 2.95Å; R137-E194 IonicContact CZ-OE1 3.69Å; R137-E194 IonicContact CZ-OE2 3.81Å; R137-E194 IonicContact NE-OE2 3.89Å; R137-E194 PolarHBondContact NE-OE2 3.43Å; R137-E194 VanDerWaalsContact NH2-CD 3.28Å; R137-E194 IonicContact NH2-OE1 3.36Å; R137-E194 PolarHBondContact NH2-OE1 3.25Å; R137-E194 IonicContact NH2-OE2 3.24Å; R137-E194 PolarHBondContact NH2-OE2 2.8Å; R137-E194 VanDerWaalsContact NH2-OE2 3.08Å; R137-E197 VanDerWaalsContact CZ-CB 3.45Å; R137-E197 IonicContact NH1-OE2 3.76Å; R137-E197 PolarHBondContact NH1-OE2 2.82Å
138	R	87.9	Confident	93.3	Very high	139 Å²	139	63.3 Å²	63.3	53%	0.525	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.6	1	-176.8	-50.1	-173.7	179	173	-4.6	116.1	K136 Y140 L141 E194	K136-R138 PolarHBondContact O-N 3.48Å; R138-Y140 PolarHBondContact O-N 3.38Å; R138-L141 HydrophobicContact CB-CD1 3.93Å; R138-L141 HydrophobicContact CB-CG 4.39Å; R138-L141 HydrophobicContact CG-CD1 3.86Å; R138-L141 PolarHBondContact O-N 3.01Å; R138-L141 VanDerWaalsContact O-N 3.16Å; R138-E194 VanDerWaalsContact CG-OE2 3.27Å; R138-E194 WeakPolarHBondContact CG-OE2 3.36Å; R138-E194 IonicContact CZ-OE1 2.67Å; R138-E194 VanDerWaalsContact CZ-OE1 3.28Å; R138-E194 IonicContact CZ-OE2 3.8Å; R138-E194 IonicContact NE-OE1 3.46Å; R138-E194 PolarHBondContact NE-OE1 3.31Å; R138-E194 VanDerWaalsContact NE-OE1 3.13Å; R138-E194 IonicContact NE-OE2 3.28Å; R138-E194 PolarHBondContact NE-OE2 3.45Å; R138-E194 IonicContact NH2-OE1 3.13Å; R138-E194 PolarHBondContact NH2-OE1 3.02Å; R138-E194 IonicContact NH2-OE2 2.87Å
139	S	90.6	Very high	93.3	Very high	43 Å²	43	63.2 Å²	63.2	30%	0.301	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-25.1	-175.6	67.3	0	0	0	0	114.1	A135 K136 R137 F142	A135-S139 WeakPolarHBondContact CB-OG 3.38Å; K136-S139 WeakPolarHBondContact O-CB 3.27Å; K136-S139 PolarHBondContact O-N 3.33Å; K136-S139 PolarHBondContact O-OG 3.14Å; R137-S139 VanDerWaalsContact C-N 3.25Å; R137-S139 PolarHBondContact O-N 2.95Å; S139-F142 WeakPolarHBondContact O-CD1 3.47Å; S139-F142 WeakPolarHBondContact O-CE1 3.34Å
140	Y	94.1	Very high	93.3	Very high	54 Å²	54	63.4 Å²	63.4	21%	0.212	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-7.1	177.1	-63.9	-62.5	0	0	0	113.5	S131 A132 A135 R138 F142 L143 L186 Q190	S131-Y140 PolarHBondContact OG-OH 2.83Å; S131-Y140 VanDerWaalsContact OG-OH 3.13Å; A132-Y140 HydrophobicContact CB-CD2 4.39Å; A135-Y140 HydrophobicContact CB-CD2 3.94Å; A135-Y140 HydrophobicContact CB-CE2 3.32Å; R138-Y140 PolarHBondContact O-N 3.38Å; Y140-F142 PolarHBondContact O-N 3.31Å; Y140-L143 HydrophobicContact CD1-CD1 3.68Å; Y140-L143 HydrophobicContact CG-CD1 4.36Å; Y140-L143 VanDerWaalsContact O-CB 3.25Å; Y140-L143 WeakPolarHBondContact O-CB 3.19Å; Y140-L143 PolarHBondContact O-N 2.95Å; Y140-L186 HydrophobicContact CD1-CB 4.4Å; Y140-L186 HydrophobicContact CD1-CD1 4.31Å; Y140-L186 HydrophobicContact CD2-CB 4.29Å; Y140-L186 HydrophobicContact CD2-CD2 4.13Å; Y140-L186 HydrophobicContact CE1-CD1 4.11Å; Y140-L186 HydrophobicContact CE1-CD2 4.35Å; Y140-L186 HydrophobicContact CE2-CD2 3.77Å; Y140-L186 HydrophobicContact CG-CB 4.12Å; Y140-Q190 HydrophobicContact CD2-CG 3.83Å; Y140-Q190 HydrophobicContact CG-CG 4.41Å
141	L	94	Very high	93.4	Very high	40 Å²	40	63.9 Å²	63.9	21%	0.209	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-23.7	-179.5	-64.1	-177.5	0	0	0	112.9	R138 L143 G144 F187 Q190 L191 E194	R138-L141 HydrophobicContact CB-CD1 3.93Å; R138-L141 HydrophobicContact CB-CG 4.39Å; R138-L141 HydrophobicContact CG-CD1 3.86Å; R138-L141 PolarHBondContact O-N 3.01Å; R138-L141 VanDerWaalsContact O-N 3.16Å; L141-L143 PolarHBondContact O-N 2.66Å; L141-G144 PolarHBondContact O-N 3.12Å; L141-F187 HydrophobicContact CD2-CD2 4.22Å; L141-F187 HydrophobicContact CD2-CE2 4Å; L141-F187 WeakPolarHBondContact O-CE2 3.22Å; L141-Q190 HydrophobicContact CD2-CB 4.05Å; L141-Q190 HydrophobicContact CG-CB 4.41Å; L141-L191 HydrophobicContact CD2-CB 3.9Å; L141-L191 HydrophobicContact CD2-CD1 4.13Å; L141-E194 HydrophobicContact CD1-CB 4.03Å; L141-E194 HydrophobicContact CD1-CG 3.96Å
142	F	94.1	Very high	93.5	Very high	150 Å²	150	64.3 Å²	64.3	66%	0.658	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-24.6	173.3	83.3	-95.9	0	0	0	112.5	S139 Y140 G144	S139-F142 WeakPolarHBondContact O-CD1 3.47Å; S139-F142 WeakPolarHBondContact O-CE1 3.34Å; Y140-F142 PolarHBondContact O-N 3.31Å; F142-G144 PolarHBondContact O-N 3.08Å
143	L	93.4	Very high	93.6	Very high	36 Å²	36	69.1 Å²	69.1	19%	0.188	36%	0.363	C	S	.	.	H	α-helix	trans	-68	-17.1	179.5	-68.7	167.7	0	0	0	112.4	Y140 L141 G145 T146 L147	Y140-L143 HydrophobicContact CD1-CD1 3.68Å; Y140-L143 HydrophobicContact CG-CD1 4.36Å; Y140-L143 VanDerWaalsContact O-CB 3.25Å; Y140-L143 WeakPolarHBondContact O-CB 3.19Å; Y140-L143 PolarHBondContact O-N 2.95Å; L141-L143 PolarHBondContact O-N 2.66Å; L143-G145 VanDerWaalsContact C-N 3.28Å; L143-G145 PolarHBondContact O-N 2.94Å; L143-T146 PolarHBondContact O-N 3.47Å; L143-L147 HydrophobicContact CB-CD1 3.79Å; L143-L147 HydrophobicContact CB-CG 4.09Å; L143-L147 WeakPolarHBondContact O-CB 3.43Å; L143-L147 WeakPolarHBondContact O-CG 3.32Å; L143-L147 PolarHBondContact O-N 3.47Å
144	G	93.7	Very high	93.8	Very high	15 Å²	15	68.3 Å²	68.3	16%	0.155	36%	0.358	C	S	.	.	H	α-helix	trans	-52.4	-44.3	-175	0	0	0	0	0	113.3	L141 F142 M148	L141-G144 PolarHBondContact O-N 3.12Å; F142-G144 PolarHBondContact O-N 3.08Å; G144-M148 VanDerWaalsContact O-CB 3.22Å; G144-M148 WeakPolarHBondContact O-CB 3.47Å; G144-M148 PolarHBondContact O-N 3.34Å
145	G	96	Very high	94	Very high	51 Å²	51	70 Å²	70	53%	0.526	37%	0.368	S	S	.	.	H	α-helix	trans	-65	-43.5	177.7	0	0	0	0	0	113.2	L143 S149	L143-G145 VanDerWaalsContact C-N 3.28Å; L143-G145 PolarHBondContact O-N 2.94Å; G145-S149 WeakPolarHBondContact O-CB 3.12Å; G145-S149 PolarHBondContact O-N 3.36Å; G145-S149 VanDerWaalsContact O-N 3.09Å; G145-S149 PolarHBondContact O-OG 2.91Å
146	T	96.6	Very high	94.2	Very high	96 Å²	96	73.8 Å²	73.8	59%	0.589	39%	0.385	S	S	*	.	H	α-helix	trans	-67.1	-45.1	178.5	-54.2	0	0	0	0	111.8	L143 S149 G150	L143-T146 PolarHBondContact O-N 3.47Å; T146-S149 PolarHBondContact O-N 3.33Å; T146-G150 PolarHBondContact O-N 3.3Å
147	L	97	Very high	94.5	Very high	15 Å²	15	67.2 Å²	67.2	8%	0.079	36%	0.357	C	S	.	.	H	α-helix	trans	-66.8	-43.4	-179.6	-66.2	171.9	0	0	0	111.7	L143 S149 G150 L151 G183 F184 F187	L143-L147 HydrophobicContact CB-CD1 3.79Å; L143-L147 HydrophobicContact CB-CG 4.09Å; L143-L147 WeakPolarHBondContact O-CB 3.43Å; L143-L147 WeakPolarHBondContact O-CG 3.32Å; L143-L147 PolarHBondContact O-N 3.47Å; L147-S149 VanDerWaalsContact C-N 3.3Å; L147-S149 PolarHBondContact O-N 2.89Å; L147-G150 PolarHBondContact O-N 2.9Å; L147-L151 PolarHBondContact O-N 2.98Å; L147-G183 VanDerWaalsContact CD1-C 3.49Å; L147-G183 WeakPolarHBondContact CD1-O 3.47Å; L147-F184 HydrophobicContact CB-CD1 4.28Å; L147-F184 HydrophobicContact CB-CD2 4.39Å; L147-F184 HydrophobicContact CB-CE1 3.8Å; L147-F184 HydrophobicContact CB-CE2 3.94Å; L147-F184 HydrophobicContact CB-CZ 3.62Å; L147-F184 HydrophobicContact CD1-CD1 4.22Å; L147-F184 HydrophobicContact CD1-CE1 4.49Å; L147-F184 HydrophobicContact CD1-CG 4.41Å; L147-F187 HydrophobicContact CD1-CB 3.59Å; L147-F187 HydrophobicContact CD1-CG 4.13Å
148	M	97	Very high	94.8	Very high	109 Å²	109	66.1 Å²	66.1	54%	0.537	36%	0.362	S	S	.	.	H	α-helix	trans	-63.5	-37.3	176.2	-171.3	60.3	74.7	0	0	112	G144 L151 S152	G144-M148 VanDerWaalsContact O-CB 3.22Å; G144-M148 WeakPolarHBondContact O-CB 3.47Å; G144-M148 PolarHBondContact O-N 3.34Å; M148-L151 PolarHBondContact O-N 2.87Å; M148-L151 HydrophobicContact SD-CD2 4.32Å; M148-S152 WeakPolarHBondContact O-CB 3.21Å; M148-S152 PolarHBondContact O-N 3.2Å; M148-S152 PolarHBondContact O-OG 3.18Å
149	S	97.6	Very high	95.1	Very high	70 Å²	70	62.9 Å²	62.9	49%	0.49	36%	0.355	S	S	.	.	H	α-helix	trans	-65.2	-43.7	173.3	-61.2	0	0	0	0	111.3	G145 T146 L147 L151 S152 I153	G145-S149 WeakPolarHBondContact O-CB 3.12Å; G145-S149 PolarHBondContact O-N 3.36Å; G145-S149 VanDerWaalsContact O-N 3.09Å; G145-S149 PolarHBondContact O-OG 2.91Å; T146-S149 PolarHBondContact O-N 3.33Å; L147-S149 VanDerWaalsContact C-N 3.3Å; L147-S149 PolarHBondContact O-N 2.89Å; S149-L151 PolarHBondContact O-N 3.11Å; S149-S152 WeakPolarHBondContact O-CB 3.47Å; S149-S152 PolarHBondContact O-N 3.44Å; S149-I153 WeakPolarHBondContact O-CG1 3.42Å; S149-I153 PolarHBondContact O-N 2.9Å
150	G	96.8	Very high	95.2	Very high	14 Å²	14	65.6 Å²	65.6	14%	0.144	36%	0.364	C	S	.	.	H	α-helix	trans	-59.2	-43.5	173.4	0	0	0	0	0	112.8	T146 L147 S152 I153 L154	T146-G150 PolarHBondContact O-N 3.3Å; L147-G150 PolarHBondContact O-N 2.9Å; G150-S152 VanDerWaalsContact C-N 3.33Å; G150-S152 PolarHBondContact O-N 3.17Å; G150-I153 PolarHBondContact O-N 3.14Å; G150-L154 VanDerWaalsContact O-CG 3.29Å; G150-L154 WeakPolarHBondContact O-CG 3.43Å; G150-L154 PolarHBondContact O-N 3.47Å
151	L	95.9	Very high	95.1	Very high	74 Å²	74	64.7 Å²	64.7	39%	0.387	36%	0.363	S	S	.	.	H	α-helix	trans	-62.4	-40.8	176	-171.7	63.8	0	0	0	111.8	L147 M148 S149 L154 F155 F184	L147-L151 PolarHBondContact O-N 2.98Å; M148-L151 PolarHBondContact O-N 2.87Å; M148-L151 HydrophobicContact SD-CD2 4.32Å; S149-L151 PolarHBondContact O-N 3.11Å; L151-L154 PolarHBondContact O-N 2.91Å; L151-F155 WeakPolarHBondContact O-CB 3.33Å; L151-F155 PolarHBondContact O-N 3.48Å; L151-F184 HydrophobicContact CB-CE2 4.16Å; L151-F184 HydrophobicContact CB-CZ 4.27Å; L151-F184 HydrophobicContact CD2-CE2 4.34Å; L151-F184 HydrophobicContact CD2-CZ 4.19Å
152	S	96.5	Very high	95	Very high	60 Å²	60	68.8 Å²	68.8	42%	0.42	38%	0.383	S	S	.	.	H	α-helix	trans	-64.7	-41.5	176.8	-61.5	0	0	0	0	112	M148 S149 G150 F155 L156	M148-S152 WeakPolarHBondContact O-CB 3.21Å; M148-S152 PolarHBondContact O-N 3.2Å; M148-S152 PolarHBondContact O-OG 3.18Å; S149-S152 WeakPolarHBondContact O-CB 3.47Å; S149-S152 PolarHBondContact O-N 3.44Å; G150-S152 VanDerWaalsContact C-N 3.33Å; G150-S152 PolarHBondContact O-N 3.17Å; S152-F155 WeakPolarHBondContact O-CB 3.44Å; S152-F155 PolarHBondContact O-N 3.23Å; S152-L156 WeakPolarHBondContact O-CG 3.23Å; S152-L156 PolarHBondContact O-N 2.86Å
153	I	96.4	Very high	95	Very high	102 Å²	102	69.9 Å²	69.9	52%	0.523	39%	0.388	S	S	.	.	H	α-helix	trans	-62.4	-44.5	173.2	-68.4	166.3	0	0	0	110.6	S149 G150 F155 L156 M157	S149-I153 WeakPolarHBondContact O-CG1 3.42Å; S149-I153 PolarHBondContact O-N 2.9Å; G150-I153 PolarHBondContact O-N 3.14Å; I153-F155 VanDerWaalsContact C-N 3.28Å; I153-F155 PolarHBondContact O-N 3.37Å; I153-L156 PolarHBondContact O-N 3.34Å; I153-M157 VanDerWaalsContact O-CB 3.27Å; I153-M157 WeakPolarHBondContact O-CB 3.41Å; I153-M157 PolarHBondContact O-N 2.67Å
154	L	96.1	Very high	94.9	Very high	7 Å²	7	75.1 Å²	75.1	4%	0.037	41%	0.41	C	S	.	.	H	α-helix	trans	-62.4	-37.3	177.5	-72.4	165.9	0	0	0	112.2	G150 L151 M157 S158 H173 L176 G177 V180	G150-L154 VanDerWaalsContact O-CG 3.29Å; G150-L154 WeakPolarHBondContact O-CG 3.43Å; G150-L154 PolarHBondContact O-N 3.47Å; L151-L154 PolarHBondContact O-N 2.91Å; L154-M157 PolarHBondContact O-N 3.1Å; L154-S158 PolarHBondContact O-N 2.84Å; L154-H173 PolarHBondContact O-CE1 3.42Å; L154-H173 VanDerWaalsContact O-CE1 3.3Å; L154-H173 PolarHBondContact O-ND1 3.16Å; L154-L176 HydrophobicContact CD2-CB 4.16Å; L154-L176 HydrophobicContact CD2-CD2 4.05Å; L154-L176 HydrophobicContact CD2-CG 4.04Å; L154-G177 VanDerWaalsContact CD1-CA 3.48Å; L154-V180 HydrophobicContact CD1-CB 4.01Å; L154-V180 HydrophobicContact CD1-CG1 4.21Å; L154-V180 HydrophobicContact CD1-CG2 3.99Å
155	F	95.6	Very high	94.7	Very high	132 Å²	132	77.3 Å²	77.3	58%	0.579	43%	0.432	S	S	*	.	H	α-helix	trans	-64.1	-50.4	174.4	176.8	-103.1	0	0	0	111.5	L151 S152 I153 M157 S158 L159	L151-F155 WeakPolarHBondContact O-CB 3.33Å; L151-F155 PolarHBondContact O-N 3.48Å; S152-F155 WeakPolarHBondContact O-CB 3.44Å; S152-F155 PolarHBondContact O-N 3.23Å; I153-F155 VanDerWaalsContact C-N 3.28Å; I153-F155 PolarHBondContact O-N 3.37Å; F155-M157 VanDerWaalsContact C-N 3.29Å; F155-M157 PolarHBondContact O-N 3.13Å; F155-S158 WeakPolarHBondContact O-CB 3.39Å; F155-S158 PolarHBondContact O-N 3.23Å; F155-S158 VanDerWaalsContact O-N 3.1Å; F155-L159 HydrophobicContact CD1-CD1 4.18Å; F155-L159 HydrophobicContact CE1-CD1 3.57Å; F155-L159 HydrophobicContact CE1-CG 4.29Å; F155-L159 HydrophobicContact CZ-CD1 3.88Å; F155-L159 HydrophobicContact CZ-CD2 4.48Å; F155-L159 HydrophobicContact CZ-CG 4.27Å; F155-L159 PolarHBondContact O-N 2.66Å
156	L	95.4	Very high	94.5	Very high	98 Å²	98	76.9 Å²	76.9	51%	0.513	42%	0.421	S	S	.	.	H	α-helix	trans	-58.8	-42.1	175.2	-70.7	174.7	0	0	0	111.8	S152 I153 S158 L159 M160	S152-L156 WeakPolarHBondContact O-CG 3.23Å; S152-L156 PolarHBondContact O-N 2.86Å; I153-L156 PolarHBondContact O-N 3.34Å; L156-S158 VanDerWaalsContact C-N 3.3Å; L156-S158 PolarHBondContact O-N 3Å; L156-L159 WeakPolarHBondContact O-CB 3.42Å; L156-L159 PolarHBondContact O-N 3.47Å; L156-L159 VanDerWaalsContact O-N 3.17Å; L156-M160 WeakPolarHBondContact O-CG 3.34Å; L156-M160 PolarHBondContact O-N 2.95Å
157	M	94.4	Very high	94.2	Very high	26 Å²	26	77.7 Å²	77.7	13%	0.128	42%	0.42	C	S	.	.	H	α-helix	trans	-62.2	-38.2	176.5	-168.2	-178.6	-165.4	0	0	111.9	I153 L154 F155 M160 N161 L169 V172 H173	I153-M157 VanDerWaalsContact O-CB 3.27Å; I153-M157 WeakPolarHBondContact O-CB 3.41Å; I153-M157 PolarHBondContact O-N 2.67Å; L154-M157 PolarHBondContact O-N 3.1Å; F155-M157 VanDerWaalsContact C-N 3.29Å; F155-M157 PolarHBondContact O-N 3.13Å; M157-M160 PolarHBondContact O-N 3.28Å; M157-N161 VanDerWaalsContact O-CB 3.3Å; M157-N161 WeakPolarHBondContact O-CB 3.37Å; M157-N161 PolarHBondContact O-N 3.22Å; M157-L169 HydrophobicContact CE-CB 3.88Å; M157-L169 HydrophobicContact CE-CD2 3.57Å; M157-L169 HydrophobicContact CE-CG 4.33Å; M157-L169 WeakPolarHBondContact CE-O 3.33Å; M157-V172 HydrophobicContact CE-CB 3.84Å; M157-V172 HydrophobicContact CE-CG1 3.75Å; M157-V172 HydrophobicContact SD-CG1 4.47Å; M157-H173 HydrophobicContact CE-CB 4.41Å; M157-H173 HydrophobicContact SD-CB 3.8Å
158	S	92.4	Very high	93.9	Very high	57 Å²	57	83.9 Å²	83.9	40%	0.399	45%	0.45	S	S	.	.	H	α-helix	trans	-63.7	-42.8	173.9	-170.9	0	0	0	0	111.4	L154 F155 L156 N161 I162	L154-S158 PolarHBondContact O-N 2.84Å; F155-S158 WeakPolarHBondContact O-CB 3.39Å; F155-S158 PolarHBondContact O-N 3.23Å; F155-S158 VanDerWaalsContact O-N 3.1Å; L156-S158 VanDerWaalsContact C-N 3.3Å; L156-S158 PolarHBondContact O-N 3Å; S158-N161 PolarHBondContact O-N 2.97Å; S158-I162 WeakPolarHBondContact O-CG1 3.21Å; S158-I162 PolarHBondContact O-N 3.38Å
159	L	93.1	Very high	93.7	Very high	72 Å²	72	81.2 Å²	81.2	38%	0.377	44%	0.438	S	S	.	.	H	α-helix	trans	-63.5	-47.1	176.1	-68.9	177.8	0	0	0	111.6	F155 L156 N161 I162 F163	F155-L159 HydrophobicContact CD1-CD1 4.18Å; F155-L159 HydrophobicContact CE1-CD1 3.57Å; F155-L159 HydrophobicContact CE1-CG 4.29Å; F155-L159 HydrophobicContact CZ-CD1 3.88Å; F155-L159 HydrophobicContact CZ-CD2 4.48Å; F155-L159 HydrophobicContact CZ-CG 4.27Å; F155-L159 PolarHBondContact O-N 2.66Å; L156-L159 WeakPolarHBondContact O-CB 3.42Å; L156-L159 PolarHBondContact O-N 3.47Å; L156-L159 VanDerWaalsContact O-N 3.17Å; L159-N161 VanDerWaalsContact C-N 3.3Å; L159-N161 PolarHBondContact O-N 3.05Å; L159-I162 WeakPolarHBondContact O-CB 3.47Å; L159-I162 PolarHBondContact O-N 3.22Å; L159-F163 VanDerWaalsContact O-CD2 3.23Å; L159-F163 WeakPolarHBondContact O-CD2 3.42Å
160	M	92.6	Very high	93.6	Very high	100 Å²	100	81.2 Å²	81.2	49%	0.493	43%	0.429	S	S	.	.	H	α-helix	trans	-58.4	-44	176.2	-70.6	178.6	70.7	0	0	111.3	L156 M157 I162 F163 F164	L156-M160 WeakPolarHBondContact O-CG 3.34Å; L156-M160 PolarHBondContact O-N 2.95Å; M157-M160 PolarHBondContact O-N 3.28Å; M160-I162 PolarHBondContact O-N 3.28Å; M160-F163 PolarHBondContact O-N 2.87Å; M160-F164 HydrophobicContact CB-CD2 4.23Å; M160-F164 HydrophobicContact CB-CE2 4.39Å; M160-F164 HydrophobicContact CE-CE2 4.07Å; M160-F164 WeakPolarHBondContact O-CD2 3.48Å; M160-F164 PolarHBondContact O-N 3.38Å; M160-F164 VanDerWaalsContact O-N 3.1Å
161	N	92.7	Very high	93.4	Very high	35 Å²	35	83.8 Å²	83.8	19%	0.187	44%	0.436	C	S	.	.	H	α-helix	trans	-65.8	-20.7	-176.8	-163	53.7	0	0	0	113.6	M157 S158 L159 F163 G165 S166	M157-N161 VanDerWaalsContact O-CB 3.3Å; M157-N161 WeakPolarHBondContact O-CB 3.37Å; M157-N161 PolarHBondContact O-N 3.22Å; S158-N161 PolarHBondContact O-N 2.97Å; L159-N161 VanDerWaalsContact C-N 3.3Å; L159-N161 PolarHBondContact O-N 3.05Å; N161-F163 VanDerWaalsContact C-N 3.31Å; N161-G165 WeakPolarHBondContact O-CA 3.48Å; N161-G165 PolarHBondContact O-N 2.89Å; N161-S166 PolarHBondContact OD1-N 3.33Å; N161-S166 PolarHBondContact OD1-O 3.05Å; N161-S166 VanDerWaalsContact OD1-O 3.08Å
162	I	92.1	Very high	93.4	Very high	126 Å²	126	83.5 Å²	83.5	65%	0.646	44%	0.437	S	S	*	.	H	α-helix	trans	-64.5	-37.3	171.5	-66.3	166.6	0	0	0	110.9	S158 L159 M160	S158-I162 WeakPolarHBondContact O-CG1 3.21Å; S158-I162 PolarHBondContact O-N 3.38Å; L159-I162 WeakPolarHBondContact O-CB 3.47Å; L159-I162 PolarHBondContact O-N 3.22Å; M160-I162 PolarHBondContact O-N 3.28Å
163	F	93	Very high	93.3	Very high	173 Å²	173	82.1 Å²	82.1	76%	0.759	42%	0.424	S	S	*	.	H	α-helix	trans	-82.5	-39.1	179.6	-61.1	-79.4	0	0	0	112.9	L159 M160 N161	L159-F163 VanDerWaalsContact O-CD2 3.23Å; L159-F163 WeakPolarHBondContact O-CD2 3.42Å; M160-F163 PolarHBondContact O-N 2.87Å; N161-F163 VanDerWaalsContact C-N 3.31Å
164	F	91.5	Very high	93.3	Very high	145 Å²	145	78 Å²	78	64%	0.636	40%	0.403	S	S	*	.	H	α-helix	trans	-90.8	-27.4	-174.9	-66.7	-74.6	0	0	0	114.5	M160 S166	M160-F164 HydrophobicContact CB-CD2 4.23Å; M160-F164 HydrophobicContact CB-CE2 4.39Å; M160-F164 HydrophobicContact CE-CE2 4.07Å; M160-F164 WeakPolarHBondContact O-CD2 3.48Å; M160-F164 PolarHBondContact O-N 3.38Å; M160-F164 VanDerWaalsContact O-N 3.1Å; F164-S166 PolarHBondContact O-N 3.23Å
165	G	89.3	Confident	93.4	Very high	61 Å²	61	83 Å²	83	63%	0.629	42%	0.422	S	S	*	.			trans	60.4	27.7	-178.5	0	0	0	0	0	114.9	N161 M167	N161-G165 WeakPolarHBondContact O-CA 3.48Å; N161-G165 PolarHBondContact O-N 2.89Å; G165-M167 PolarHBondContact O-N 3.01Å
166	S	93	Very high	93.5	Very high	42 Å²	42	79.9 Å²	79.9	29%	0.294	41%	0.411	S	S	.	.			trans	-79.6	121.6	-172.5	175.2	0	0	0	0	112.6	N161 F164 M168 L169 F170	N161-S166 PolarHBondContact OD1-N 3.33Å; N161-S166 PolarHBondContact OD1-O 3.05Å; N161-S166 VanDerWaalsContact OD1-O 3.08Å; F164-S166 PolarHBondContact O-N 3.23Å; S166-M168 PolarHBondContact O-N 3.31Å; S166-M168 PolarHBondContact OG-N 2.99Å; S166-L169 PolarHBondContact O-N 3.36Å; S166-L169 PolarHBondContact OG-N 3.43Å; S166-F170 PolarHBondContact O-N 3.39Å
167	M	89.6	Confident	93.6	Very high	114 Å²	114	75.2 Å²	75.2	56%	0.562	39%	0.387	S	S	*	.	H	α-helix	trans	-63	-31.8	175.7	-166.9	176.4	-144.5	0	0	112.5	G165 F170 K171	G165-M167 PolarHBondContact O-N 3.01Å; M167-F170 PolarHBondContact O-N 2.81Å; M167-K171 WeakPolarHBondContact O-CG 3.13Å; M167-K171 PolarHBondContact O-N 3.14Å
168	M	91.8	Very high	93.8	Very high	144 Å²	144	75.2 Å²	75.2	71%	0.709	39%	0.387	S	S	*	.	H	α-helix	trans	-68.5	-46	177.1	-171.7	-171.7	-166.5	0	0	111.1	S166 F170 K171 V172	S166-M168 PolarHBondContact O-N 3.31Å; S166-M168 PolarHBondContact OG-N 2.99Å; M168-F170 VanDerWaalsContact C-N 3.27Å; M168-F170 PolarHBondContact O-N 3.2Å; M168-K171 PolarHBondContact O-N 3.25Å; M168-V172 WeakPolarHBondContact O-CG2 3.4Å; M168-V172 PolarHBondContact O-N 3.39Å
169	L	93	Very high	94	Very high	54 Å²	54	78.1 Å²	78.1	28%	0.283	40%	0.397	S	S	.	.	H	α-helix	trans	-60	-41.8	175.5	-69.3	-179.1	0	0	0	110.7	M157 S166 V172 H173	M157-L169 HydrophobicContact CE-CB 3.88Å; M157-L169 HydrophobicContact CE-CD2 3.57Å; M157-L169 HydrophobicContact CE-CG 4.33Å; M157-L169 WeakPolarHBondContact CE-O 3.33Å; S166-L169 PolarHBondContact O-N 3.36Å; S166-L169 PolarHBondContact OG-N 3.43Å; L169-V172 PolarHBondContact O-N 3.21Å; L169-H173 VanDerWaalsContact O-CB 3.31Å; L169-H173 WeakPolarHBondContact O-CB 3.41Å; L169-H173 PolarHBondContact O-N 2.77Å
170	F	93.6	Very high	94.3	Very high	70 Å²	70	75.1 Å²	75.1	31%	0.307	38%	0.382	S	S	.	.	H	α-helix	trans	-60.4	-46.5	175	-176.9	-102.7	0	0	0	112.7	S166 M167 M168 V172 H173 M174 I223 M227	S166-F170 PolarHBondContact O-N 3.39Å; M167-F170 PolarHBondContact O-N 2.81Å; M168-F170 VanDerWaalsContact C-N 3.27Å; M168-F170 PolarHBondContact O-N 3.2Å; F170-V172 PolarHBondContact O-N 3.18Å; F170-H173 PolarHBondContact O-N 2.83Å; F170-M174 HydrophobicContact CD2-CE 3.98Å; F170-M174 HydrophobicContact CE1-CE 4.42Å; F170-M174 HydrophobicContact CE1-CG 4.19Å; F170-M174 HydrophobicContact CE2-CE 3.31Å; F170-M174 HydrophobicContact CZ-CE 3.57Å; F170-M174 HydrophobicContact CZ-CG 4.22Å; F170-M174 HydrophobicContact CZ-SD 4.49Å; F170-M174 WeakPolarHBondContact O-CG 3.33Å; F170-M174 PolarHBondContact O-N 3.18Å; F170-I223 HydrophobicContact CE1-CG2 3.89Å; F170-I223 HydrophobicContact CZ-CG2 3.84Å; F170-M227 HydrophobicContact CD1-CE 3.62Å; F170-M227 HydrophobicContact CD1-SD 3.96Å; F170-M227 HydrophobicContact CE1-CE 3.8Å; F170-M227 HydrophobicContact CE1-SD 3.51Å; F170-M227 VanDerWaalsContact CE1-SD 3.51Å
171	K	93.8	Very high	94.5	Very high	67 Å²	67	71 Å²	71	29%	0.291	36%	0.362	S	S	.	.	H	α-helix	trans	-56.8	-50.7	175.6	-80.6	-177.6	177.4	-167.6	0	111.2	M167 M168 H173 M174 Y175 M227 D231	M167-K171 WeakPolarHBondContact O-CG 3.13Å; M167-K171 PolarHBondContact O-N 3.14Å; M168-K171 PolarHBondContact O-N 3.25Å; K171-H173 PolarHBondContact O-N 2.96Å; K171-M174 PolarHBondContact O-N 2.96Å; K171-M174 VanDerWaalsContact O-N 3.15Å; K171-Y175 WeakPolarHBondContact O-CD2 3.11Å; K171-Y175 PolarHBondContact O-N 3.27Å; K171-Y175 VanDerWaalsContact O-N 3.15Å; K171-M227 HydrophobicContact CB-CE 4.38Å; K171-M227 HydrophobicContact CD-CE 4.18Å; K171-M227 HydrophobicContact CG-CE 3.27Å; K171-D231 IonicContact NZ-OD2 2.92Å; K171-D231 PolarHBondContact NZ-OD2 2.66Å
172	V	95.1	Very high	94.8	Very high	68 Å²	68	70 Å²	70	41%	0.412	36%	0.357	S	S	.	.	H	α-helix	trans	-61.5	-43.9	179.5	170.7	0	0	0	0	111.1	M157 M168 L169 F170 M174 Y175 L176	M157-V172 HydrophobicContact CE-CB 3.84Å; M157-V172 HydrophobicContact CE-CG1 3.75Å; M157-V172 HydrophobicContact SD-CG1 4.47Å; M168-V172 WeakPolarHBondContact O-CG2 3.4Å; M168-V172 PolarHBondContact O-N 3.39Å; L169-V172 PolarHBondContact O-N 3.21Å; F170-V172 PolarHBondContact O-N 3.18Å; V172-M174 PolarHBondContact O-N 2.85Å; V172-Y175 PolarHBondContact O-N 2.89Å; V172-L176 VanDerWaalsContact O-CB 3.24Å; V172-L176 WeakPolarHBondContact O-CB 3.44Å; V172-L176 PolarHBondContact O-N 3.47Å
173	H	95.8	Very high	95	Very high	32 Å²	32	64.6 Å²	64.6	15%	0.148	33%	0.333	C	S	.	.	H	α-helix	trans	-58.1	-35.9	175.9	177.9	92.7	0	0	0	112.6	L154 M157 L169 F170 K171 G177 K220	L154-H173 PolarHBondContact O-CE1 3.42Å; L154-H173 VanDerWaalsContact O-CE1 3.3Å; L154-H173 PolarHBondContact O-ND1 3.16Å; M157-H173 HydrophobicContact CE-CB 4.41Å; M157-H173 HydrophobicContact SD-CB 3.8Å; L169-H173 VanDerWaalsContact O-CB 3.31Å; L169-H173 WeakPolarHBondContact O-CB 3.41Å; L169-H173 PolarHBondContact O-N 2.77Å; F170-H173 PolarHBondContact O-N 2.83Å; K171-H173 PolarHBondContact O-N 2.96Å; H173-G177 WeakPolarHBondContact O-CA 3.44Å; H173-G177 PolarHBondContact O-N 3.41Å; H173-K220 PolarHBondContact CD2-NZ 2.93Å; H173-K220 PolarHBondContact NE2-NZ 3.26Å; H173-K220 PolarHBondContact O-NZ 3.19Å
174	M	96.4	Very high	95.3	Very high	15 Å²	15	57.1 Å²	57.1	7%	0.074	30%	0.3	C	S	.	.	H	α-helix	trans	-69.4	-51.3	177.6	-69.5	-56.3	145.5	0	0	112	F170 K171 V172 L178 K220 I223 I224	F170-M174 HydrophobicContact CD2-CE 3.98Å; F170-M174 HydrophobicContact CE1-CE 4.42Å; F170-M174 HydrophobicContact CE1-CG 4.19Å; F170-M174 HydrophobicContact CE2-CE 3.31Å; F170-M174 HydrophobicContact CZ-CE 3.57Å; F170-M174 HydrophobicContact CZ-CG 4.22Å; F170-M174 HydrophobicContact CZ-SD 4.49Å; F170-M174 WeakPolarHBondContact O-CG 3.33Å; F170-M174 PolarHBondContact O-N 3.18Å; K171-M174 PolarHBondContact O-N 2.96Å; K171-M174 VanDerWaalsContact O-N 3.15Å; V172-M174 PolarHBondContact O-N 2.85Å; M174-L178 WeakPolarHBondContact O-CB 3.42Å; M174-L178 PolarHBondContact O-N 3.4Å; M174-K220 HydrophobicContact SD-CG 4.06Å; M174-I223 HydrophobicContact CE-CD1 4.34Å; M174-I223 HydrophobicContact CG-CG2 4Å; M174-I223 HydrophobicContact SD-CB 4.39Å; M174-I223 HydrophobicContact SD-CD1 4.19Å; M174-I223 HydrophobicContact SD-CG2 4.07Å; M174-I224 HydrophobicContact CB-CD1 4.17Å; M174-I224 HydrophobicContact CB-CG1 3.8Å
175	Y	97.3	Very high	95.6	Very high	113 Å²	113	50.2 Å²	50.2	44%	0.443	27%	0.269	S	S	.	.	H	α-helix	trans	-68.2	-46.6	-179.6	-76.1	-77.2	0	0	0	112.9	K171 V172 G177 L178 L179 I224 N228	K171-Y175 WeakPolarHBondContact O-CD2 3.11Å; K171-Y175 PolarHBondContact O-N 3.27Å; K171-Y175 VanDerWaalsContact O-N 3.15Å; V172-Y175 PolarHBondContact O-N 2.89Å; Y175-G177 VanDerWaalsContact C-N 3.33Å; Y175-G177 PolarHBondContact O-N 3.37Å; Y175-L178 WeakPolarHBondContact O-CB 3.43Å; Y175-L178 PolarHBondContact O-N 3.31Å; Y175-L179 PolarHBondContact O-N 3.38Å; Y175-L179 VanDerWaalsContact O-N 3.1Å; Y175-I224 HydrophobicContact CD1-CD1 4.09Å; Y175-I224 HydrophobicContact CE1-CD1 4.25Å; Y175-I224 HydrophobicContact CE1-CG1 4.47Å; Y175-I224 HydrophobicContact CE1-CG2 3.73Å; Y175-I224 HydrophobicContact CE2-CG2 4.43Å; Y175-I224 HydrophobicContact CG-CD1 4.4Å; Y175-I224 WeakPolarHBondContact OH-CG2 3.43Å; Y175-N228 PolarHBondContact OH-ND2 3.36Å; Y175-N228 VanDerWaalsContact OH-ND2 3.1Å; Y175-N228 PolarHBondContact OH-OD1 3.22Å
176	L	97.5	Very high	96	Very high	66 Å²	66	48 Å²	48	35%	0.346	24%	0.243	S	C	.	.	H	α-helix	trans	-63.6	-42.4	177.9	-180	60.9	0	0	0	110.8	L154 V172 L178 L179 V180	L154-L176 HydrophobicContact CD2-CB 4.16Å; L154-L176 HydrophobicContact CD2-CD2 4.05Å; L154-L176 HydrophobicContact CD2-CG 4.04Å; V172-L176 VanDerWaalsContact O-CB 3.24Å; V172-L176 WeakPolarHBondContact O-CB 3.44Å; V172-L176 PolarHBondContact O-N 3.47Å; L176-L178 VanDerWaalsContact C-N 3.31Å; L176-L178 PolarHBondContact O-N 3.17Å; L176-L179 PolarHBondContact O-N 3.26Å; L176-V180 HydrophobicContact CD1-CG2 4.42Å; L176-V180 WeakPolarHBondContact O-CG2 3.28Å; L176-V180 PolarHBondContact O-N 3.2Å
177	G	97.6	Very high	96.2	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-65.4	-33.5	176.6	0	0	0	0	0	113.5	L154 H173 Y175 M181	L154-G177 VanDerWaalsContact CD1-CA 3.48Å; H173-G177 WeakPolarHBondContact O-CA 3.44Å; H173-G177 PolarHBondContact O-N 3.41Å; Y175-G177 VanDerWaalsContact C-N 3.33Å; Y175-G177 PolarHBondContact O-N 3.37Å; G177-M181 VanDerWaalsContact O-CG 3.3Å; G177-M181 WeakPolarHBondContact O-CG 3.4Å; G177-M181 PolarHBondContact O-N 3.02Å
178	L	98.1	Very high	96.6	Very high	26 Å²	26	43.2 Å²	43.2	14%	0.136	22%	0.215	C	C	.	.	H	α-helix	trans	-63.6	-46.5	173.8	177.3	63.8	0	0	0	110.4	M174 Y175 L176 M181 C182 I217 K220 L221 I224	M174-L178 WeakPolarHBondContact O-CB 3.42Å; M174-L178 PolarHBondContact O-N 3.4Å; Y175-L178 WeakPolarHBondContact O-CB 3.43Å; Y175-L178 PolarHBondContact O-N 3.31Å; L176-L178 VanDerWaalsContact C-N 3.31Å; L176-L178 PolarHBondContact O-N 3.17Å; L178-M181 PolarHBondContact O-N 3.39Å; L178-C182 PolarHBondContact O-N 3.05Å; L178-C182 PolarHBondContact O-SG 3.2Å; L178-I217 HydrophobicContact CD1-CB 4.33Å; L178-I217 HydrophobicContact CD1-CG1 4.49Å; L178-I217 HydrophobicContact CD1-CG2 3.66Å; L178-K220 HydrophobicContact CB-CB 4.43Å; L178-K220 HydrophobicContact CB-CD 4.43Å; L178-L221 HydrophobicContact CD2-CD1 4.4Å; L178-I224 HydrophobicContact CB-CD1 4.28Å; L178-I224 HydrophobicContact CD2-CD1 3.82Å
179	L	97.9	Very high	96.9	Very high	117 Å²	117	36.3 Å²	36.3	61%	0.613	18%	0.181	S	C	*	.	H	α-helix	trans	-59.5	-48.4	177.2	-173.4	164.1	0	0	0	111.5	Y175 L176 M181 C182 G183	Y175-L179 PolarHBondContact O-N 3.38Å; Y175-L179 VanDerWaalsContact O-N 3.1Å; L176-L179 PolarHBondContact O-N 3.26Å; L179-M181 VanDerWaalsContact C-N 3.3Å; L179-M181 PolarHBondContact O-N 3.24Å; L179-C182 WeakPolarHBondContact O-CB 3.27Å; L179-C182 PolarHBondContact O-N 2.77Å; L179-G183 PolarHBondContact O-N 2.98Å; L179-G183 VanDerWaalsContact O-N 3.12Å
180	V	98.2	Very high	97.1	Very high	9 Å²	9	33.9 Å²	33.9	6%	0.055	17%	0.168	C	C	.	.	H	α-helix	trans	-58.8	-42.9	178.3	169.3	0	0	0	0	110.7	L154 L176 G183 F184	L154-V180 HydrophobicContact CD1-CB 4.01Å; L154-V180 HydrophobicContact CD1-CG1 4.21Å; L154-V180 HydrophobicContact CD1-CG2 3.99Å; L176-V180 HydrophobicContact CD1-CG2 4.42Å; L176-V180 WeakPolarHBondContact O-CG2 3.28Å; L176-V180 PolarHBondContact O-N 3.2Å; V180-G183 WeakPolarHBondContact O-CA 3.44Å; V180-G183 PolarHBondContact O-N 2.9Å; V180-G183 VanDerWaalsContact O-N 3.09Å; V180-F184 HydrophobicContact CG1-CD2 3.78Å; V180-F184 HydrophobicContact CG1-CE2 3.53Å; V180-F184 WeakPolarHBondContact O-CD2 3.45Å; V180-F184 PolarHBondContact O-N 2.96Å
181	M	97.8	Very high	97.3	Very high	14 Å²	14	32.7 Å²	32.7	7%	0.069	17%	0.165	C	C	.	.	H	α-helix	trans	-68.2	-35.2	178.1	-66.3	-34.1	-53.6	0	0	114	G177 L178 L179 G183 F184 V185 D213 T216 I217	G177-M181 VanDerWaalsContact O-CG 3.3Å; G177-M181 WeakPolarHBondContact O-CG 3.4Å; G177-M181 PolarHBondContact O-N 3.02Å; L178-M181 PolarHBondContact O-N 3.39Å; L179-M181 VanDerWaalsContact C-N 3.3Å; L179-M181 PolarHBondContact O-N 3.24Å; M181-G183 PolarHBondContact O-N 2.97Å; M181-F184 HydrophobicContact CE-CB 3.64Å; M181-F184 HydrophobicContact CE-CD2 3.56Å; M181-F184 HydrophobicContact CE-CE2 4.5Å; M181-F184 HydrophobicContact CE-CG 3.87Å; M181-F184 PolarHBondContact O-N 2.96Å; M181-F184 VanDerWaalsContact O-N 3.11Å; M181-F184 HydrophobicContact SD-CD2 3.82Å; M181-F184 HydrophobicContact SD-CE2 4.43Å; M181-V185 PolarHBondContact O-N 2.88Å; M181-D213 WeakPolarHBondContact CE-OD1 3.33Å; M181-T216 HydrophobicContact CG-CG2 3.46Å; M181-T216 VanDerWaalsContact CG-CG2 3.46Å; M181-T216 HydrophobicContact SD-CG2 4Å; M181-I217 HydrophobicContact CB-CD1 4.19Å; M181-I217 HydrophobicContact CB-CG1 3.53Å; M181-I217 HydrophobicContact CG-CG1 4.48Å
182	C	97.8	Very high	97.5	Very high	14 Å²	14	29.6 Å²	29.6	10%	0.095	15%	0.151	C	C	.	.	H	α-helix	trans	-58.8	-36.4	170.3	-65.5	0	0	0	0	111.6	I124 F128 L178 L179 V185	I124-C182 WeakPolarHBondContact CG2-SG 3.27Å; F128-C182 HydrophobicContact CD2-CB 3.99Å; F128-C182 HydrophobicContact CE1-CB 4.34Å; F128-C182 HydrophobicContact CE2-CB 3.6Å; F128-C182 HydrophobicContact CZ-CB 3.78Å; L178-C182 PolarHBondContact O-N 3.05Å; L178-C182 PolarHBondContact O-SG 3.2Å; L179-C182 WeakPolarHBondContact O-CB 3.27Å; L179-C182 PolarHBondContact O-N 2.77Å; C182-V185 PolarHBondContact O-N 3.09Å
183	G	97.8	Very high	97.5	Very high	12 Å²	12	26.5 Å²	26.5	12%	0.124	13%	0.132	C	C	.	.	H	α-helix	trans	-66.6	-39.1	172.7	0	0	0	0	0	113.3	L147 L179 V180 M181 V185 L186 F187	L147-G183 VanDerWaalsContact CD1-C 3.49Å; L147-G183 WeakPolarHBondContact CD1-O 3.47Å; L179-G183 PolarHBondContact O-N 2.98Å; L179-G183 VanDerWaalsContact O-N 3.12Å; V180-G183 WeakPolarHBondContact O-CA 3.44Å; V180-G183 PolarHBondContact O-N 2.9Å; V180-G183 VanDerWaalsContact O-N 3.09Å; M181-G183 PolarHBondContact O-N 2.97Å; G183-V185 VanDerWaalsContact C-N 3.35Å; G183-V185 PolarHBondContact O-N 2.98Å; G183-L186 WeakPolarHBondContact O-CB 3.44Å; G183-L186 PolarHBondContact O-N 3.32Å; G183-F187 PolarHBondContact O-N 3.3Å
184	F	98.3	Very high	97.6	Very high	16 Å²	16	25.6 Å²	25.6	7%	0.07	13%	0.128	C	C	.	.	H	α-helix	trans	-62.6	-38.7	174.4	-82.9	-68.6	0	0	0	112.4	L147 L151 V180 M181 L186 F187 D188 D213	L147-F184 HydrophobicContact CB-CD1 4.28Å; L147-F184 HydrophobicContact CB-CD2 4.39Å; L147-F184 HydrophobicContact CB-CE1 3.8Å; L147-F184 HydrophobicContact CB-CE2 3.94Å; L147-F184 HydrophobicContact CB-CZ 3.62Å; L147-F184 HydrophobicContact CD1-CD1 4.22Å; L147-F184 HydrophobicContact CD1-CE1 4.49Å; L147-F184 HydrophobicContact CD1-CG 4.41Å; L151-F184 HydrophobicContact CB-CE2 4.16Å; L151-F184 HydrophobicContact CB-CZ 4.27Å; L151-F184 HydrophobicContact CD2-CE2 4.34Å; L151-F184 HydrophobicContact CD2-CZ 4.19Å; V180-F184 HydrophobicContact CG1-CD2 3.78Å; V180-F184 HydrophobicContact CG1-CE2 3.53Å; V180-F184 WeakPolarHBondContact O-CD2 3.45Å; V180-F184 PolarHBondContact O-N 2.96Å; M181-F184 HydrophobicContact CE-CB 3.64Å; M181-F184 HydrophobicContact CE-CD2 3.56Å; M181-F184 HydrophobicContact CE-CE2 4.5Å; M181-F184 HydrophobicContact CE-CG 3.87Å; M181-F184 PolarHBondContact O-N 2.96Å; M181-F184 VanDerWaalsContact O-N 3.11Å; M181-F184 HydrophobicContact SD-CD2 3.82Å; M181-F184 HydrophobicContact SD-CE2 4.43Å; F184-L186 PolarHBondContact O-N 3.48Å; F184-F187 HydrophobicContact CD1-CD1 4.24Å; F184-F187 CarbonylContact O-C 3.34Å; F184-F187 PolarHBondContact O-N 2.87Å; F184-D188 WeakPolarHBondContact O-CB 3.47Å; F184-D188 PolarHBondContact O-N 3.24Å; F184-D213 VanDerWaalsContact C-OD2 3.23Å; F184-D213 WeakPolarHBondContact CB-OD1 3.34Å
185	V	98.4	Very high	97.6	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-56.4	-40.3	174.8	177.2	0	0	0	0	111.8	F125 F128 M181 C182 G183 T189 D213 I217	F125-V185 HydrophobicContact CD2-CG1 4.02Å; F125-V185 HydrophobicContact CD2-CG2 3.66Å; F125-V185 HydrophobicContact CE2-CG1 4.06Å; F125-V185 HydrophobicContact CE2-CG2 3.81Å; F125-V185 HydrophobicContact CG-CG1 4.38Å; F125-V185 HydrophobicContact CZ-CG1 4.44Å; F128-V185 HydrophobicContact CB-CB 4.1Å; F128-V185 HydrophobicContact CB-CG1 3.76Å; M181-V185 PolarHBondContact O-N 2.88Å; C182-V185 PolarHBondContact O-N 3.09Å; G183-V185 VanDerWaalsContact C-N 3.35Å; G183-V185 PolarHBondContact O-N 2.98Å; V185-T189 VanDerWaalsContact O-CB 3.22Å; V185-T189 WeakPolarHBondContact O-CB 3.47Å; V185-T189 PolarHBondContact O-N 3.22Å; V185-T189 VanDerWaalsContact O-N 3.17Å; V185-T189 PolarHBondContact O-OG1 3.38Å; V185-D213 WeakPolarHBondContact CA-OD2 3.46Å; V185-D213 HydrophobicContact CG2-CB 3.99Å; V185-D213 PolarHBondContact N-OD2 3.32Å; V185-I217 HydrophobicContact CG2-CD1 3.58Å
186	L	97.6	Very high	97.5	Very high	16 Å²	16	22.3 Å²	22.3	8%	0.084	12%	0.117	C	C	.	.	H	α-helix	trans	-64.8	-49.1	174.6	-70.8	167.8	0	0	0	112	F128 A132 Y140 G183 F184 Q190	F128-L186 HydrophobicContact CB-CD2 4.28Å; F128-L186 HydrophobicContact CB-CG 4.25Å; F128-L186 HydrophobicContact CD1-CD1 3.62Å; F128-L186 HydrophobicContact CD1-CD2 3.84Å; F128-L186 HydrophobicContact CD1-CG 3.54Å; F128-L186 HydrophobicContact CE1-CD1 3.94Å; F128-L186 HydrophobicContact CE1-CG 4.35Å; F128-L186 HydrophobicContact CG-CG 4.34Å; F128-L186 VanDerWaalsContact O-CD2 3.25Å; F128-L186 WeakPolarHBondContact O-CD2 3.23Å; A132-L186 HydrophobicContact CB-CD2 4.15Å; Y140-L186 HydrophobicContact CD1-CB 4.4Å; Y140-L186 HydrophobicContact CD1-CD1 4.31Å; Y140-L186 HydrophobicContact CD2-CB 4.29Å; Y140-L186 HydrophobicContact CD2-CD2 4.13Å; Y140-L186 HydrophobicContact CE1-CD1 4.11Å; Y140-L186 HydrophobicContact CE1-CD2 4.35Å; Y140-L186 HydrophobicContact CE2-CD2 3.77Å; Y140-L186 HydrophobicContact CG-CB 4.12Å; G183-L186 WeakPolarHBondContact O-CB 3.44Å; G183-L186 PolarHBondContact O-N 3.32Å; F184-L186 PolarHBondContact O-N 3.48Å; L186-Q190 PolarHBondContact O-N 2.89Å; L186-Q190 VanDerWaalsContact O-N 3.17Å
187	F	97.9	Very high	97.4	Very high	33 Å²	33	21.7 Å²	21.7	15%	0.145	11%	0.112	C	C	.	.	H	α-helix	trans	-65.2	-50.5	-175.9	173.7	-97.1	0	0	0	111.4	L141 L147 G183 F184 Q190 L191	L141-F187 HydrophobicContact CD2-CD2 4.22Å; L141-F187 HydrophobicContact CD2-CE2 4Å; L141-F187 WeakPolarHBondContact O-CE2 3.22Å; L147-F187 HydrophobicContact CD1-CB 3.59Å; L147-F187 HydrophobicContact CD1-CG 4.13Å; G183-F187 PolarHBondContact O-N 3.3Å; F184-F187 HydrophobicContact CD1-CD1 4.24Å; F184-F187 CarbonylContact O-C 3.34Å; F184-F187 PolarHBondContact O-N 2.87Å; F187-Q190 CarbonylContact O-C 3.44Å; F187-Q190 PolarHBondContact O-N 3.21Å; F187-L191 HydrophobicContact CE1-CD2 3.86Å; F187-L191 HydrophobicContact CZ-CD2 4.2Å; F187-L191 WeakPolarHBondContact O-CB 3.35Å; F187-L191 PolarHBondContact O-N 2.82Å
188	D	98	Very high	97.3	Very high	21 Å²	21	26.8 Å²	26.8	11%	0.112	14%	0.139	C	C	.	.	H	α-helix	trans	-67.7	-39.9	-177.7	-75.4	-12.1	0	0	0	111.4	F184 Q190 L191 I192 L210	F184-D188 WeakPolarHBondContact O-CB 3.47Å; F184-D188 PolarHBondContact O-N 3.24Å; D188-Q190 VanDerWaalsContact C-N 3.32Å; D188-Q190 PolarHBondContact O-N 3.01Å; D188-L191 PolarHBondContact O-N 3.5Å; D188-I192 WeakPolarHBondContact O-CB 3.49Å; D188-I192 WeakPolarHBondContact O-CD1 3.49Å; D188-I192 WeakPolarHBondContact O-CG1 3.37Å; D188-I192 PolarHBondContact O-N 3.45Å; D188-L210 HydrophobicContact CB-CD2 4.05Å
189	T	97.5	Very high	97.1	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-58.8	-45.2	172.6	-58.4	0	0	0	0	111	Y31 T129 A132 L133 V185 I193	Y31-T189 WeakPolarHBondContact OH-CG2 3.43Å; T129-T189 HydrophobicContact CG2-CG2 4.37Å; A132-T189 HydrophobicContact CB-CG2 3.59Å; L133-T189 HydrophobicContact CD2-CG2 4.27Å; L133-T189 HydrophobicContact CG-CG2 4.2Å; V185-T189 VanDerWaalsContact O-CB 3.22Å; V185-T189 WeakPolarHBondContact O-CB 3.47Å; V185-T189 PolarHBondContact O-N 3.22Å; V185-T189 VanDerWaalsContact O-N 3.17Å; V185-T189 PolarHBondContact O-OG1 3.38Å; T189-I193 HydrophobicContact CG2-CD1 4.36Å; T189-I193 WeakPolarHBondContact O-CD1 3.46Å; T189-I193 VanDerWaalsContact O-CG1 3.28Å; T189-I193 WeakPolarHBondContact O-CG1 3.48Å; T189-I193 PolarHBondContact O-N 3.05Å
190	Q	96.7	Very high	97	Very high	3 Å²	3	25.8 Å²	25.8	1%	0.014	15%	0.148	C	C	.	.	H	α-helix	trans	-68.2	-34.9	175.8	-84	-73.6	-48	0	0	113.2	A132 Y140 L141 L186 F187 D188 I193 E194	A132-Q190 HydrophobicContact CB-CG 4.22Å; A132-Q190 PolarHBondContact O-NE2 2.83Å; Y140-Q190 HydrophobicContact CD2-CG 3.83Å; Y140-Q190 HydrophobicContact CG-CG 4.41Å; L141-Q190 HydrophobicContact CD2-CB 4.05Å; L141-Q190 HydrophobicContact CG-CB 4.41Å; L186-Q190 PolarHBondContact O-N 2.89Å; L186-Q190 VanDerWaalsContact O-N 3.17Å; F187-Q190 CarbonylContact O-C 3.44Å; F187-Q190 PolarHBondContact O-N 3.21Å; D188-Q190 VanDerWaalsContact C-N 3.32Å; D188-Q190 PolarHBondContact O-N 3.01Å; Q190-I193 PolarHBondContact O-N 3.29Å; Q190-E194 WeakPolarHBondContact O-CB 3.47Å; Q190-E194 PolarHBondContact O-N 3.03Å
191	L	97.4	Very high	96.8	Very high	44 Å²	44	28 Å²	28	23%	0.23	16%	0.157	C	C	.	.	H	α-helix	trans	-67.9	-41.2	178.5	-176.5	63.4	0	0	0	111	L141 F187 D188 E194 K195	L141-L191 HydrophobicContact CD2-CB 3.9Å; L141-L191 HydrophobicContact CD2-CD1 4.13Å; F187-L191 HydrophobicContact CE1-CD2 3.86Å; F187-L191 HydrophobicContact CZ-CD2 4.2Å; F187-L191 WeakPolarHBondContact O-CB 3.35Å; F187-L191 PolarHBondContact O-N 2.82Å; D188-L191 PolarHBondContact O-N 3.5Å; L191-E194 PolarHBondContact O-N 3.02Å; L191-K195 HydrophobicContact CD1-CG 4.42Å; L191-K195 HydrophobicContact CG-CD 4.27Å; L191-K195 HydrophobicContact CG-CG 4.45Å; L191-K195 WeakPolarHBondContact O-CB 3.36Å; L191-K195 WeakPolarHBondContact O-CG 3.45Å; L191-K195 PolarHBondContact O-N 3.19Å
192	I	97.8	Very high	96.8	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.01	16%	0.158	C	C	.	.	H	α-helix	trans	-61.5	-44.8	174.9	-69.9	165.6	0	0	0	110.5	L27 V30 D188 E194 A196 H206 L210	L27-I192 HydrophobicContact CD2-CG2 3.73Å; V30-I192 HydrophobicContact CG2-CG2 4.4Å; D188-I192 WeakPolarHBondContact O-CB 3.49Å; D188-I192 WeakPolarHBondContact O-CD1 3.49Å; D188-I192 WeakPolarHBondContact O-CG1 3.37Å; D188-I192 PolarHBondContact O-N 3.45Å; I192-E194 VanDerWaalsContact C-N 3.34Å; I192-E194 PolarHBondContact O-N 3.42Å; I192-A196 WeakPolarHBondContact O-CB 3.3Å; I192-A196 PolarHBondContact O-N 3.21Å; I192-H206 HydrophobicContact CD1-CB 3.9Å; I192-H206 HydrophobicContact CG1-CB 3.77Å; I192-H206 HydrophobicContact CG2-CB 4.03Å; I192-L210 HydrophobicContact CD1-CD1 3.77Å; I192-L210 HydrophobicContact CD1-CD2 3.92Å; I192-L210 HydrophobicContact CD1-CG 3.56Å
193	I	96.5	Very high	96.8	Very high	3 Å²	3	28.7 Å²	28.7	2%	0.015	16%	0.158	C	C	.	.	H	α-helix	trans	-58.2	-49.7	174.6	-67	162.7	0	0	0	109.8	I19 T23 L27 L133 T189 Q190 A196 E197	I19-I193 HydrophobicContact CD1-CD1 3.98Å; I19-I193 HydrophobicContact CD1-CG1 4.43Å; I19-I193 HydrophobicContact CG1-CG2 4.45Å; T23-I193 HydrophobicContact CG2-CG2 4.27Å; L27-I193 HydrophobicContact CD1-CG1 4.04Å; L27-I193 HydrophobicContact CD2-CG1 4.27Å; L133-I193 HydrophobicContact CD2-CD1 3.93Å; T189-I193 HydrophobicContact CG2-CD1 4.36Å; T189-I193 WeakPolarHBondContact O-CD1 3.46Å; T189-I193 VanDerWaalsContact O-CG1 3.28Å; T189-I193 WeakPolarHBondContact O-CG1 3.48Å; T189-I193 PolarHBondContact O-N 3.05Å; Q190-I193 PolarHBondContact O-N 3.29Å; I193-A196 PolarHBondContact O-N 2.91Å; I193-E197 HydrophobicContact CG2-CG 4.32Å; I193-E197 WeakPolarHBondContact O-CB 3.45Å; I193-E197 WeakPolarHBondContact O-CG 3.28Å; I193-E197 PolarHBondContact O-N 3.21Å
194	E	96.3	Very high	96.8	Very high	13 Å²	13	28.2 Å²	28.2	6%	0.061	15%	0.152	C	C	.	.	H	α-helix	trans	-63.8	-44.2	-177.5	-174.5	56.8	-141	0	0	112.7	R137 R138 L141 Q190 L191 I192 E197 N198	R137-E194 IonicContact CZ-OE1 3.69Å; R137-E194 IonicContact CZ-OE2 3.81Å; R137-E194 IonicContact NE-OE2 3.89Å; R137-E194 PolarHBondContact NE-OE2 3.43Å; R137-E194 VanDerWaalsContact NH2-CD 3.28Å; R137-E194 IonicContact NH2-OE1 3.36Å; R137-E194 PolarHBondContact NH2-OE1 3.25Å; R137-E194 IonicContact NH2-OE2 3.24Å; R137-E194 PolarHBondContact NH2-OE2 2.8Å; R137-E194 VanDerWaalsContact NH2-OE2 3.08Å; R138-E194 VanDerWaalsContact CG-OE2 3.27Å; R138-E194 WeakPolarHBondContact CG-OE2 3.36Å; R138-E194 IonicContact CZ-OE1 2.67Å; R138-E194 VanDerWaalsContact CZ-OE1 3.28Å; R138-E194 IonicContact CZ-OE2 3.8Å; R138-E194 IonicContact NE-OE1 3.46Å; R138-E194 PolarHBondContact NE-OE1 3.31Å; R138-E194 VanDerWaalsContact NE-OE1 3.13Å; R138-E194 IonicContact NE-OE2 3.28Å; R138-E194 PolarHBondContact NE-OE2 3.45Å; R138-E194 IonicContact NH2-OE1 3.13Å; R138-E194 PolarHBondContact NH2-OE1 3.02Å; R138-E194 IonicContact NH2-OE2 2.87Å; L141-E194 HydrophobicContact CD1-CB 4.03Å; L141-E194 HydrophobicContact CD1-CG 3.96Å; Q190-E194 WeakPolarHBondContact O-CB 3.47Å; Q190-E194 PolarHBondContact O-N 3.03Å; L191-E194 PolarHBondContact O-N 3.02Å; I192-E194 VanDerWaalsContact C-N 3.34Å; I192-E194 PolarHBondContact O-N 3.42Å; E194-E197 PolarHBondContact O-N 2.8Å; E194-N198 VanDerWaalsContact O-CG 3.25Å; E194-N198 PolarHBondContact O-N 3.03Å; E194-N198 VanDerWaalsContact O-N 3.08Å; E194-N198 PolarHBondContact O-ND2 3.36Å; E194-N198 PolarHBondContact OE1-ND2 2.91Å
195	K	96.6	Very high	96.8	Very high	58 Å²	58	31 Å²	31	25%	0.252	16%	0.162	S	C	.	.	H	α-helix	trans	-60.1	-48.1	174.9	-77.9	-178.9	178.2	-178.8	0	111.5	L191 E197 N198 G199 D200 H206	L191-K195 HydrophobicContact CD1-CG 4.42Å; L191-K195 HydrophobicContact CG-CD 4.27Å; L191-K195 HydrophobicContact CG-CG 4.45Å; L191-K195 WeakPolarHBondContact O-CB 3.36Å; L191-K195 WeakPolarHBondContact O-CG 3.45Å; L191-K195 PolarHBondContact O-N 3.19Å; K195-E197 VanDerWaalsContact C-N 3.33Å; K195-E197 PolarHBondContact O-N 3.18Å; K195-N198 CarbonylContact O-C 3.58Å; K195-N198 WeakPolarHBondContact O-CA 3.4Å; K195-N198 PolarHBondContact O-N 2.91Å; K195-G199 PolarHBondContact O-N 2.93Å; K195-D200 CarbonylContact C-O 3.58Å; K195-D200 HydrophobicContact CB-CB 4.04Å; K195-D200 PolarHBondContact O-N 3.31Å; K195-H206 WeakPolarHBondContact CD-NE2 3.22Å
196	A	96.5	Very high	96.8	Very high	2 Å²	2	31 Å²	31	2%	0.017	16%	0.163	C	C	.	.	H	α-helix	trans	-64	-36.2	179.4	0	0	0	0	0	113	T23 H26 I192 I193 N198 G199 D200 K201	T23-A196 HydrophobicContact CG2-CB 3.8Å; H26-A196 HydrophobicContact CB-CB 4.41Å; I192-A196 WeakPolarHBondContact O-CB 3.3Å; I192-A196 PolarHBondContact O-N 3.21Å; I193-A196 PolarHBondContact O-N 2.91Å; A196-N198 VanDerWaalsContact C-N 3.29Å; A196-G199 PolarHBondContact O-N 3.4Å; A196-D200 VanDerWaalsContact CA-O 3.22Å; A196-D200 WeakPolarHBondContact CA-O 3.42Å; A196-D200 PolarHBondContact N-O 3.33Å; A196-K201 HydrophobicContact CB-CD 4.17Å; A196-K201 WeakPolarHBondContact O-CE 3.49Å; A196-K201 PolarHBondContact O-NZ 2.68Å
197	E	94.8	Very high	96.8	Very high	52 Å²	52	30.2 Å²	30.2	24%	0.243	16%	0.159	C	C	.	.	H	α-helix	trans	-68.7	-29	173.4	-71.4	-72.3	141.1	0	0	112.4	S20 T23 R137 I193 E194 K195 G199	S20-E197 WeakPolarHBondContact CB-OE1 3.47Å; S20-E197 PolarHBondContact N-OE1 2.95Å; S20-E197 PolarHBondContact OG-OE1 2.8Å; T23-E197 WeakPolarHBondContact CB-OE1 3.38Å; T23-E197 HydrophobicContact CG2-CG 4.42Å; T23-E197 PolarHBondContact OG1-OE1 3.27Å; R137-E197 VanDerWaalsContact CZ-CB 3.45Å; R137-E197 IonicContact NH1-OE2 3.76Å; R137-E197 PolarHBondContact NH1-OE2 2.82Å; I193-E197 HydrophobicContact CG2-CG 4.32Å; I193-E197 WeakPolarHBondContact O-CB 3.45Å; I193-E197 WeakPolarHBondContact O-CG 3.28Å; I193-E197 PolarHBondContact O-N 3.21Å; E194-E197 PolarHBondContact O-N 2.8Å; K195-E197 VanDerWaalsContact C-N 3.33Å; K195-E197 PolarHBondContact O-N 3.18Å; E197-G199 VanDerWaalsContact C-N 3.29Å
198	N	95.4	Very high	96.8	Very high	108 Å²	108	28.7 Å²	28.7	58%	0.578	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.4	8.3	176.1	-63.9	-32.5	0	0	0	113.4	E194 K195 A196	E194-N198 VanDerWaalsContact O-CG 3.25Å; E194-N198 PolarHBondContact O-N 3.03Å; E194-N198 VanDerWaalsContact O-N 3.08Å; E194-N198 PolarHBondContact O-ND2 3.36Å; E194-N198 PolarHBondContact OE1-ND2 2.91Å; K195-N198 CarbonylContact O-C 3.58Å; K195-N198 WeakPolarHBondContact O-CA 3.4Å; K195-N198 PolarHBondContact O-N 2.91Å; A196-N198 VanDerWaalsContact C-N 3.29Å
199	G	94.4	Very high	96.8	Very high	56 Å²	56	29.2 Å²	29.2	58%	0.577	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	97.5	-4.1	173.9	0	0	0	0	0	115.8	K195 A196 E197 K201	K195-G199 PolarHBondContact O-N 2.93Å; A196-G199 PolarHBondContact O-N 3.4Å; E197-G199 VanDerWaalsContact C-N 3.29Å; G199-K201 PolarHBondContact O-N 3.47Å
200	D	95.7	Very high	96.8	Very high	66 Å²	66	29.2 Å²	29.2	35%	0.353	16%	0.155	S	C	.	.			trans	-79.8	100.6	173.8	178.6	2.7	0	0	0	110.4	K195 A196 D202 H206	K195-D200 CarbonylContact C-O 3.58Å; K195-D200 HydrophobicContact CB-CB 4.04Å; K195-D200 PolarHBondContact O-N 3.31Å; A196-D200 VanDerWaalsContact CA-O 3.22Å; A196-D200 WeakPolarHBondContact CA-O 3.42Å; A196-D200 PolarHBondContact N-O 3.33Å; D200-D202 PolarHBondContact OD1-N 2.93Å; D200-H206 IonicContact OD2-NE2 3.91Å
201	K	95	Very high	96.9	Very high	55 Å²	55	29.1 Å²	29.1	24%	0.239	15%	0.154	C	C	.	.			trans	-105.2	25.5	-175.5	-60	-60.5	-167.9	-178.3	0	113.4	S22 T23 H26 H76 A196 G199 Y203	S22-K201 VanDerWaalsContact OG-CE 3.28Å; S22-K201 WeakPolarHBondContact OG-CE 3.44Å; S22-K201 PolarHBondContact OG-NZ 2.89Å; T23-K201 PolarHBondContact OG1-NZ 2.8Å; H26-K201 HydrophobicContact CB-CD 4.26Å; H26-K201 PolarHBondContact CE1-O 3.1Å; H76-K201 PolarHBondContact CE1-O 2.62Å; H76-K201 PolarHBondContact NE2-O 3.09Å; A196-K201 HydrophobicContact CB-CD 4.17Å; A196-K201 WeakPolarHBondContact O-CE 3.49Å; A196-K201 PolarHBondContact O-NZ 2.68Å; G199-K201 PolarHBondContact O-N 3.47Å; K201-Y203 VanDerWaalsContact C-N 3.29Å; K201-Y203 PolarHBondContact O-N 3.41Å
202	D	96.6	Very high	96.9	Very high	19 Å²	19	29.9 Å²	29.9	10%	0.102	16%	0.158	C	C	.	.			trans	-76.1	76.2	176.3	-166.2	-6.8	0	0	0	112.7	H76 R84 D200 V204 W205 H206	H76-D202 HydrophobicContact CB-CB 4.47Å; H76-D202 IonicContact ND1-OD1 3.63Å; H76-D202 PolarHBondContact ND1-OD1 3.41Å; R84-D202 IonicContact CZ-OD1 2.8Å; R84-D202 IonicContact CZ-OD2 3.96Å; R84-D202 IonicContact NE-OD1 3.08Å; R84-D202 IonicContact NH1-OD2 2.65Å; R84-D202 IonicContact NH2-OD1 3.81Å; R84-D202 PolarHBondContact NH2-OD1 2.92Å; R84-D202 IonicContact NH2-OD2 3.41Å; R84-D202 PolarHBondContact NH2-OD2 3.37Å; D200-D202 PolarHBondContact OD1-N 2.93Å; D202-V204 PolarHBondContact O-N 3.22Å; D202-V204 PolarHBondContact OD1-N 3.24Å; D202-W205 HydrophobicContact CB-CB 4.23Å; D202-W205 PolarHBondContact O-N 3.4Å; D202-W205 PolarHBondContact OD1-N 3.44Å; D202-H206 PolarHBondContact O-N 3.08Å
203	Y	97.5	Very high	97	Very high	24 Å²	24	30 Å²	30	9%	0.094	16%	0.159	C	C	.	.	H	α-helix	trans	-65	-23.8	-176.3	76.8	-92.9	0	0	0	112.6	H26 N29 S33 E81 L85 K201 C207	H26-Y203 VanDerWaalsContact CE1-CA 3.41Å; H26-Y203 WeakPolarHBondContact CE1-CA 3.44Å; H26-Y203 VanDerWaalsContact CE1-CB 3.49Å; H26-Y203 WeakPolarHBondContact CE1-CB 3.22Å; H26-Y203 PolarHBondContact CE1-N 2.74Å; H26-Y203 VanDerWaalsContact CE1-N 3.31Å; N29-Y203 HydrophobicContact CB-CD1 4.25Å; N29-Y203 HydrophobicContact CB-CD2 3.77Å; N29-Y203 HydrophobicContact CB-CE2 4.24Å; N29-Y203 HydrophobicContact CB-CG 3.77Å; S33-Y203 WeakPolarHBondContact OG-CE2 3.44Å; E81-Y203 HydrophobicContact CG-CE1 4.45Å; E81-Y203 WeakPolarHBondContact OE1-CE1 3.27Å; E81-Y203 VanDerWaalsContact OE1-CZ 3.3Å; E81-Y203 PolarHBondContact OE1-OH 3.12Å; L85-Y203 HydrophobicContact CD2-CE2 4.03Å; K201-Y203 VanDerWaalsContact C-N 3.29Å; K201-Y203 PolarHBondContact O-N 3.41Å; Y203-C207 VanDerWaalsContact O-CB 3.22Å; Y203-C207 WeakPolarHBondContact O-CB 3.41Å; Y203-C207 PolarHBondContact O-N 3.49Å
204	V	97.9	Very high	97.1	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.006	16%	0.161	C	C	.	.	H	α-helix	trans	-69.6	-45.2	177.1	-176.5	0	0	0	0	109.7	L71 R84 L85 L88 D202 C207 V208	L71-V204 HydrophobicContact CD1-CG1 3.92Å; L71-V204 HydrophobicContact CD2-CG1 4.22Å; R84-V204 HydrophobicContact CB-CG1 4.21Å; R84-V204 HydrophobicContact CB-CG2 4.41Å; L85-V204 HydrophobicContact CD2-CG2 4Å; L85-V204 HydrophobicContact CG-CG2 4.45Å; L88-V204 HydrophobicContact CB-CG1 4.06Å; L88-V204 HydrophobicContact CD2-CG1 3.95Å; L88-V204 HydrophobicContact CG-CG1 4.45Å; D202-V204 PolarHBondContact O-N 3.22Å; D202-V204 PolarHBondContact OD1-N 3.24Å; V204-C207 WeakPolarHBondContact O-CB 3.32Å; V204-C207 PolarHBondContact O-N 2.92Å; V204-V208 PolarHBondContact O-N 3.01Å
205	W	97.8	Very high	97.1	Very high	74 Å²	74	30.6 Å²	30.6	28%	0.28	16%	0.162	S	C	.	.	H	α-helix	trans	-67.6	-44.3	176.1	-168.1	-85.7	0	0	0	111.7	L71 A72 D202 C207 V208 D209	L71-W205 HydrophobicContact CD2-CE3 4.01Å; L71-W205 HydrophobicContact CD2-CZ3 4.28Å; L71-W205 HydrophobicContact CG-CE3 4.24Å; L71-W205 HydrophobicContact CG-CZ3 4.37Å; A72-W205 HydrophobicContact CB-CH2 4.06Å; A72-W205 HydrophobicContact CB-CZ3 3.87Å; D202-W205 HydrophobicContact CB-CB 4.23Å; D202-W205 PolarHBondContact O-N 3.4Å; D202-W205 PolarHBondContact OD1-N 3.44Å; W205-C207 PolarHBondContact O-N 2.77Å; W205-V208 WeakPolarHBondContact O-CA 3.38Å; W205-V208 WeakPolarHBondContact O-CB 3.39Å; W205-V208 PolarHBondContact O-N 3.08Å; W205-D209 PolarHBondContact O-N 3.25Å
206	H	98.3	Very high	97.2	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-60	-30.5	175	-66.5	168.5	0	0	0	112.6	H26 V30 I192 K195 D200 D202 L210	H26-H206 AromaticContact CE1-ND1 3.57Å; H26-H206 AromaticContact NE2-CE1 4Å; H26-H206 AromaticContact NE2-CG 3.94Å; H26-H206 AromaticContact NE2-ND1 3.03Å; H26-H206 PolarHBondContact NE2-ND1 3Å; V30-H206 HydrophobicContact CG1-CB 4.35Å; V30-H206 HydrophobicContact CG2-CB 3.78Å; I192-H206 HydrophobicContact CD1-CB 3.9Å; I192-H206 HydrophobicContact CG1-CB 3.77Å; I192-H206 HydrophobicContact CG2-CB 4.03Å; K195-H206 WeakPolarHBondContact CD-NE2 3.22Å; D200-H206 IonicContact OD2-NE2 3.91Å; D202-H206 PolarHBondContact O-N 3.08Å; H206-L210 PolarHBondContact O-N 3.13Å
207	C	98.4	Very high	97.3	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-68.1	-36.3	171.3	178.6	0	0	0	0	112.5	V30 S33 L34 L88 Y203 V204 W205 F211	V30-C207 HydrophobicContact CG1-CB 4.4Å; S33-C207 VanDerWaalsContact C-SG 3.52Å; S33-C207 VanDerWaalsContact CB-SG 3.6Å; L34-C207 VanDerWaalsContact CA-SG 3.55Å; L34-C207 PolarHBondContact N-SG 2.83Å; L88-C207 HydrophobicContact CD2-CB 4.32Å; Y203-C207 VanDerWaalsContact O-CB 3.22Å; Y203-C207 WeakPolarHBondContact O-CB 3.41Å; Y203-C207 PolarHBondContact O-N 3.49Å; V204-C207 WeakPolarHBondContact O-CB 3.32Å; V204-C207 PolarHBondContact O-N 2.92Å; W205-C207 PolarHBondContact O-N 2.77Å; C207-F211 WeakPolarHBondContact O-CB 3.47Å; C207-F211 PolarHBondContact O-N 3.13Å
208	V	98.3	Very high	97.5	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.006	15%	0.149	C	C	.	.	H	α-helix	trans	-62	-45.8	176.7	173.1	0	0	0	0	110.7	M68 L71 L88 F91 V204 W205 F211 L212	M68-V208 HydrophobicContact CE-CG1 4.15Å; L71-V208 HydrophobicContact CD2-CG2 3.66Å; L88-V208 HydrophobicContact CD1-CG2 3.55Å; F91-V208 HydrophobicContact CE1-CG1 3.98Å; F91-V208 HydrophobicContact CE1-CG2 4.43Å; F91-V208 HydrophobicContact CZ-CG1 4.27Å; V204-V208 PolarHBondContact O-N 3.01Å; W205-V208 WeakPolarHBondContact O-CA 3.38Å; W205-V208 WeakPolarHBondContact O-CB 3.39Å; W205-V208 PolarHBondContact O-N 3.08Å; V208-F211 PolarHBondContact O-N 3.02Å; V208-L212 HydrophobicContact CG1-CD1 4.02Å; V208-L212 HydrophobicContact CG1-CG 4.41Å; V208-L212 WeakPolarHBondContact O-CG 3.29Å; V208-L212 PolarHBondContact O-N 3.46Å
209	D	97.5	Very high	97.6	Very high	32 Å²	32	27.3 Å²	27.3	17%	0.171	14%	0.141	C	C	.	.	H	α-helix	trans	-55.3	-55.7	179	-61.9	-28.7	0	0	0	110.3	W205 F211 L212 D213	W205-D209 PolarHBondContact O-N 3.25Å; D209-F211 VanDerWaalsContact C-N 3.33Å; D209-F211 PolarHBondContact O-N 3.35Å; D209-L212 PolarHBondContact O-N 2.87Å; D209-D213 PolarHBondContact O-N 2.67Å; D209-D213 VanDerWaalsContact O-N 3.14Å
210	L	98.5	Very high	97.7	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-64.7	-32.5	178.5	-68.9	-171.8	0	0	0	114.1	V30 Y31 L34 F125 D188 I192 H206 F214	V30-L210 HydrophobicContact CG1-CD1 3.7Å; Y31-L210 HydrophobicContact CD1-CD1 4.32Å; Y31-L210 HydrophobicContact CE1-CD1 3.63Å; L34-L210 HydrophobicContact CD1-CB 4.42Å; L34-L210 HydrophobicContact CD2-CB 4.21Å; F125-L210 HydrophobicContact CZ-CB 4.04Å; F125-L210 HydrophobicContact CZ-CD1 4.45Å; F125-L210 HydrophobicContact CZ-CD2 4.15Å; F125-L210 HydrophobicContact CZ-CG 4.44Å; D188-L210 HydrophobicContact CB-CD2 4.05Å; I192-L210 HydrophobicContact CD1-CD1 3.77Å; I192-L210 HydrophobicContact CD1-CD2 3.92Å; I192-L210 HydrophobicContact CD1-CG 3.56Å; H206-L210 PolarHBondContact O-N 3.13Å; L210-F214 PolarHBondContact O-N 2.57Å
211	F	98.6	Very high	97.9	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-66.4	-43	176.5	174.5	-97	0	0	0	111.5	L34 C37 M38 A41 F91 A92 T95 C207 V208 D209 F214 I215	L34-F211 VanDerWaalsContact CD1-CA 3.49Å; L34-F211 HydrophobicContact CD1-CB 3.75Å; L34-F211 HydrophobicContact CD1-CD2 4.26Å; C37-F211 HydrophobicContact CB-CD2 3.44Å; C37-F211 VanDerWaalsContact CB-CD2 3.44Å; C37-F211 HydrophobicContact CB-CE2 3.65Å; C37-F211 HydrophobicContact CB-CG 4.34Å; M38-F211 HydrophobicContact CE-CD2 3.11Å; M38-F211 HydrophobicContact CE-CE2 3.32Å; M38-F211 HydrophobicContact CE-CG 4.24Å; A41-F211 HydrophobicContact CB-CE2 4.01Å; A41-F211 HydrophobicContact CB-CZ 4.01Å; F91-F211 HydrophobicContact CD1-CD1 4.25Å; F91-F211 HydrophobicContact CD1-CE1 4.2Å; F91-F211 AromaticContact CE1-CD1 3.45Å; F91-F211 HydrophobicContact CE1-CD1 3.45Å; F91-F211 VanDerWaalsContact CE1-CD1 3.45Å; F91-F211 AromaticContact CE1-CE1 3.64Å; F91-F211 HydrophobicContact CE1-CE1 3.64Å; F91-F211 HydrophobicContact CZ-CD1 4.08Å; F91-F211 HydrophobicContact CZ-CE1 4.13Å; A92-F211 HydrophobicContact CB-CE1 4.4Å; A92-F211 HydrophobicContact CB-CE2 3.99Å; A92-F211 HydrophobicContact CB-CZ 3.78Å; T95-F211 HydrophobicContact CG2-CE1 3.74Å; T95-F211 HydrophobicContact CG2-CZ 4.02Å; C207-F211 WeakPolarHBondContact O-CB 3.47Å; C207-F211 PolarHBondContact O-N 3.13Å; V208-F211 PolarHBondContact O-N 3.02Å; D209-F211 VanDerWaalsContact C-N 3.33Å; D209-F211 PolarHBondContact O-N 3.35Å; F211-F214 PolarHBondContact O-N 2.9Å; F211-I215 HydrophobicContact CD1-CG1 4.26Å; F211-I215 HydrophobicContact CD2-CG1 4.26Å; F211-I215 HydrophobicContact CE1-CG1 3.89Å; F211-I215 HydrophobicContact CE2-CD1 4.11Å; F211-I215 HydrophobicContact CE2-CG1 3.84Å; F211-I215 HydrophobicContact CG-CG1 4.44Å; F211-I215 HydrophobicContact CZ-CD1 4.04Å; F211-I215 HydrophobicContact CZ-CG1 3.64Å; F211-I215 WeakPolarHBondContact O-CB 3.34Å; F211-I215 WeakPolarHBondContact O-CG1 3.18Å; F211-I215 PolarHBondContact O-N 3.36Å
212	L	97.8	Very high	98	Very high	60 Å²	60	20.5 Å²	20.5	31%	0.314	9%	0.093	S	C	.	.	H	α-helix	trans	-64.7	-40.4	177.1	-74.9	174.7	0	0	0	111.9	M68 F91 V208 D209 T216	M68-L212 HydrophobicContact CE-CD1 4.06Å; F91-L212 HydrophobicContact CZ-CD2 3.81Å; F91-L212 HydrophobicContact CZ-CG 4.2Å; V208-L212 HydrophobicContact CG1-CD1 4.02Å; V208-L212 HydrophobicContact CG1-CG 4.41Å; V208-L212 WeakPolarHBondContact O-CG 3.29Å; V208-L212 PolarHBondContact O-N 3.46Å; D209-L212 PolarHBondContact O-N 2.87Å; L212-T216 VanDerWaalsContact O-CB 3.27Å; L212-T216 WeakPolarHBondContact O-CB 3.2Å; L212-T216 PolarHBondContact O-N 3.29Å; L212-T216 PolarHBondContact O-OG1 3.49Å
213	D	98.3	Very high	98	Very high	6 Å²	6	20.6 Å²	20.6	3%	0.032	9%	0.093	C	C	.	.	H	α-helix	trans	-56.8	-54.1	171.8	-86.2	-4.5	0	0	0	111.4	F125 M181 F184 V185 D209 I215 T216 I217	F125-D213 HydrophobicContact CE2-CB 4.28Å; M181-D213 WeakPolarHBondContact CE-OD1 3.33Å; F184-D213 VanDerWaalsContact C-OD2 3.23Å; F184-D213 WeakPolarHBondContact CB-OD1 3.34Å; V185-D213 WeakPolarHBondContact CA-OD2 3.46Å; V185-D213 HydrophobicContact CG2-CB 3.99Å; V185-D213 PolarHBondContact N-OD2 3.32Å; D209-D213 PolarHBondContact O-N 2.67Å; D209-D213 VanDerWaalsContact O-N 3.14Å; D213-I215 PolarHBondContact O-N 2.85Å; D213-T216 PolarHBondContact O-N 2.91Å; D213-I217 WeakPolarHBondContact O-CG1 3.22Å; D213-I217 PolarHBondContact O-N 2.94Å
214	F	98.6	Very high	98	Very high	12 Å²	12	19.7 Å²	19.7	5%	0.053	9%	0.09	C	C	.	.	H	α-helix	trans	-58.7	-51.6	-178.9	-172.4	-76.6	0	0	0	111.6	M38 F118 T121 F125 L210 F211 T216 I217 F218	M38-F214 HydrophobicContact CE-CB 4.39Å; M38-F214 HydrophobicContact CE-CD1 3.91Å; M38-F214 HydrophobicContact CE-CG 4.21Å; M38-F214 HydrophobicContact SD-CD1 3.29Å; M38-F214 WeakPolarHBondContact SD-CD1 3.32Å; M38-F214 HydrophobicContact SD-CD2 4.37Å; M38-F214 HydrophobicContact SD-CE1 3.33Å; M38-F214 WeakPolarHBondContact SD-CE1 3.49Å; M38-F214 HydrophobicContact SD-CE2 4.38Å; M38-F214 HydrophobicContact SD-CG 3.87Å; M38-F214 HydrophobicContact SD-CZ 3.9Å; F118-F214 HydrophobicContact CD2-CE1 4.18Å; F118-F214 HydrophobicContact CD2-CZ 4.17Å; F118-F214 AromaticContact CE2-CE1 3.94Å; F118-F214 HydrophobicContact CE2-CE1 3.94Å; F118-F214 AromaticContact CE2-CZ 3.82Å; F118-F214 HydrophobicContact CE2-CZ 3.82Å; F118-F214 HydrophobicContact CZ-CZ 4.46Å; T121-F214 HydrophobicContact CG2-CD1 4.03Å; T121-F214 HydrophobicContact CG2-CD2 3.94Å; T121-F214 HydrophobicContact CG2-CE1 3.84Å; T121-F214 HydrophobicContact CG2-CE2 3.77Å; T121-F214 HydrophobicContact CG2-CG 4.08Å; T121-F214 HydrophobicContact CG2-CZ 3.7Å; F125-F214 HydrophobicContact CB-CD2 3.97Å; F125-F214 HydrophobicContact CB-CE2 4.26Å; F125-F214 HydrophobicContact CD1-CD2 4.31Å; F125-F214 HydrophobicContact CD2-CB 4.02Å; F125-F214 AromaticContact CD2-CD2 3.78Å; F125-F214 HydrophobicContact CD2-CD2 3.78Å; F125-F214 HydrophobicContact CD2-CG 4.38Å; F125-F214 HydrophobicContact CE2-CB 4Å; F125-F214 HydrophobicContact CE2-CD2 4.37Å; F125-F214 AromaticContact CG-CD2 3.76Å; F125-F214 HydrophobicContact CG-CD2 3.76Å; F125-F214 HydrophobicContact CG-CE2 4.44Å; L210-F214 PolarHBondContact O-N 2.57Å; F211-F214 PolarHBondContact O-N 2.9Å; F214-T216 PolarHBondContact O-N 3.15Å; F214-I217 PolarHBondContact O-N 2.9Å; F214-F218 HydrophobicContact CD1-CB 4.45Å; F214-F218 HydrophobicContact CE1-CB 4.33Å; F214-F218 WeakPolarHBondContact O-CB 3.22Å; F214-F218 PolarHBondContact O-N 3.3Å
215	I	97.9	Very high	98	Very high	15 Å²	15	22 Å²	22	8%	0.077	10%	0.102	C	C	.	.	H	α-helix	trans	-61.9	-35.9	-178.7	-69.8	-67.1	0	0	0	111.1	M38 A41 T95 L99 F211 D213 F218 R219	M38-I215 HydrophobicContact CE-CD1 4.42Å; A41-I215 HydrophobicContact CB-CD1 4.44Å; T95-I215 HydrophobicContact CG2-CB 4.5Å; T95-I215 HydrophobicContact CG2-CG1 4.23Å; T95-I215 HydrophobicContact CG2-CG2 3.82Å; L99-I215 HydrophobicContact CD1-CD1 4.09Å; L99-I215 HydrophobicContact CD1-CG2 4.33Å; L99-I215 HydrophobicContact CD2-CG2 4.12Å; F211-I215 HydrophobicContact CD1-CG1 4.26Å; F211-I215 HydrophobicContact CD2-CG1 4.26Å; F211-I215 HydrophobicContact CE1-CG1 3.89Å; F211-I215 HydrophobicContact CE2-CD1 4.11Å; F211-I215 HydrophobicContact CE2-CG1 3.84Å; F211-I215 HydrophobicContact CG-CG1 4.44Å; F211-I215 HydrophobicContact CZ-CD1 4.04Å; F211-I215 HydrophobicContact CZ-CG1 3.64Å; F211-I215 WeakPolarHBondContact O-CB 3.34Å; F211-I215 WeakPolarHBondContact O-CG1 3.18Å; F211-I215 PolarHBondContact O-N 3.36Å; D213-I215 PolarHBondContact O-N 2.85Å; I215-F218 PolarHBondContact O-N 3.24Å; I215-R219 VanDerWaalsContact O-CB 3.32Å; I215-R219 WeakPolarHBondContact O-CB 3.41Å; I215-R219 PolarHBondContact O-N 2.65Å
216	T	97.5	Very high	98	Very high	27 Å²	27	18.5 Å²	18.5	17%	0.166	9%	0.089	C	C	.	.	H	α-helix	trans	-69.7	-43.5	178.5	-57.7	0	0	0	0	111.6	M181 L212 D213 F214 K220	M181-T216 HydrophobicContact CG-CG2 3.46Å; M181-T216 VanDerWaalsContact CG-CG2 3.46Å; M181-T216 HydrophobicContact SD-CG2 4Å; L212-T216 VanDerWaalsContact O-CB 3.27Å; L212-T216 WeakPolarHBondContact O-CB 3.2Å; L212-T216 PolarHBondContact O-N 3.29Å; L212-T216 PolarHBondContact O-OG1 3.49Å; D213-T216 PolarHBondContact O-N 2.91Å; F214-T216 PolarHBondContact O-N 3.15Å; T216-K220 HydrophobicContact CG2-CD 4.39Å; T216-K220 WeakPolarHBondContact O-CB 3.32Å; T216-K220 WeakPolarHBondContact O-CG 3.2Å; T216-K220 PolarHBondContact O-N 3.2Å
217	I	98.6	Very high	97.9	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-60.1	-48.1	173.2	-65.6	171.5	0	0	0	109.7	T121 I124 L178 M181 V185 D213 F214 R219 K220 L221	T121-I217 HydrophobicContact CG2-CB 3.86Å; T121-I217 HydrophobicContact CG2-CG2 3.57Å; I124-I217 HydrophobicContact CD1-CG2 4.43Å; I124-I217 HydrophobicContact CG2-CD1 4.35Å; I124-I217 HydrophobicContact CG2-CG2 4.29Å; L178-I217 HydrophobicContact CD1-CB 4.33Å; L178-I217 HydrophobicContact CD1-CG1 4.49Å; L178-I217 HydrophobicContact CD1-CG2 3.66Å; M181-I217 HydrophobicContact CB-CD1 4.19Å; M181-I217 HydrophobicContact CB-CG1 3.53Å; M181-I217 HydrophobicContact CG-CG1 4.48Å; V185-I217 HydrophobicContact CG2-CD1 3.58Å; D213-I217 WeakPolarHBondContact O-CG1 3.22Å; D213-I217 PolarHBondContact O-N 2.94Å; F214-I217 PolarHBondContact O-N 2.9Å; I217-R219 PolarHBondContact O-N 3.41Å; I217-K220 PolarHBondContact O-N 2.8Å; I217-L221 VanDerWaalsContact O-CB 3.31Å; I217-L221 WeakPolarHBondContact O-CB 3.47Å; I217-L221 PolarHBondContact O-N 3.49Å
218	F	98.5	Very high	97.7	Very high	16 Å²	16	21.7 Å²	21.7	7%	0.07	11%	0.106	C	C	.	.	H	α-helix	trans	-57.3	-51.4	179.2	176.9	-124.9	0	0	0	112.3	L99 I114 A117 F118 T121 F214 I215 K220 L221 M222	L99-F218 HydrophobicContact CD1-CD1 3.96Å; L99-F218 HydrophobicContact CD1-CE1 3.97Å; I114-F218 HydrophobicContact CG2-CZ 4.29Å; A117-F218 HydrophobicContact CB-CD2 4.08Å; A117-F218 HydrophobicContact CB-CE2 3.9Å; F118-F218 HydrophobicContact CB-CD2 4.26Å; F118-F218 HydrophobicContact CB-CE2 3.73Å; F118-F218 HydrophobicContact CB-CZ 4.44Å; F118-F218 HydrophobicContact CD2-CE2 4.44Å; T121-F218 HydrophobicContact CG2-CB 4.05Å; T121-F218 VanDerWaalsContact OG1-CA 3.23Å; T121-F218 WeakPolarHBondContact OG1-CA 3.22Å; T121-F218 PolarHBondContact OG1-N 3.4Å; F214-F218 HydrophobicContact CD1-CB 4.45Å; F214-F218 HydrophobicContact CE1-CB 4.33Å; F214-F218 WeakPolarHBondContact O-CB 3.22Å; F214-F218 PolarHBondContact O-N 3.3Å; I215-F218 PolarHBondContact O-N 3.24Å; F218-K220 PolarHBondContact O-N 3.47Å; F218-L221 PolarHBondContact O-N 2.86Å; F218-M222 HydrophobicContact CD1-CE 3.55Å; F218-M222 HydrophobicContact CD1-SD 4.38Å; F218-M222 HydrophobicContact CD2-CE 4.34Å; F218-M222 HydrophobicContact CD2-CG 4.09Å; F218-M222 HydrophobicContact CD2-SD 4.39Å; F218-M222 HydrophobicContact CE1-CE 3.26Å; F218-M222 HydrophobicContact CE1-SD 3.68Å; F218-M222 HydrophobicContact CE2-CE 4.09Å; F218-M222 HydrophobicContact CE2-CG 3.7Å; F218-M222 HydrophobicContact CE2-SD 3.67Å; F218-M222 HydrophobicContact CG-CE 4.09Å; F218-M222 HydrophobicContact CZ-CE 3.57Å; F218-M222 HydrophobicContact CZ-CG 3.98Å; F218-M222 HydrophobicContact CZ-SD 3.28Å; F218-M222 WeakPolarHBondContact CZ-SD 3.17Å; F218-M222 WeakPolarHBondContact O-CB 3.16Å; F218-M222 WeakPolarHBondContact O-CG 3.35Å; F218-M222 PolarHBondContact O-N 3.44Å
219	R	97.6	Very high	97.5	Very high	109 Å²	109	23.4 Å²	23.4	41%	0.411	12%	0.115	S	C	.	.	H	α-helix	trans	-58.3	-46.9	177.6	-177.3	178.7	61.9	169.5	-3.4	111.8	L99 T102 I215 I217 I223	L99-R219 HydrophobicContact CD2-CB 4.06Å; L99-R219 HydrophobicContact CD2-CG 4.23Å; T102-R219 HydrophobicContact CG2-CG 4.34Å; I215-R219 VanDerWaalsContact O-CB 3.32Å; I215-R219 WeakPolarHBondContact O-CB 3.41Å; I215-R219 PolarHBondContact O-N 2.65Å; I217-R219 PolarHBondContact O-N 3.41Å; R219-I223 HydrophobicContact CG-CD1 4.03Å; R219-I223 VanDerWaalsContact O-CG1 3.31Å; R219-I223 WeakPolarHBondContact O-CG1 3.13Å; R219-I223 PolarHBondContact O-N 3.41Å; R219-I223 VanDerWaalsContact O-N 3.11Å
220	K	97.8	Very high	97.3	Very high	11 Å²	11	25.8 Å²	25.8	5%	0.048	12%	0.123	C	C	.	.	H	α-helix	trans	-64.9	-44	179.9	-74.7	-175.2	175.2	-74.7	0	111.5	H173 M174 L178 T216 I217 F218 I223 I224	H173-K220 PolarHBondContact CD2-NZ 2.93Å; H173-K220 PolarHBondContact NE2-NZ 3.26Å; H173-K220 PolarHBondContact O-NZ 3.19Å; M174-K220 HydrophobicContact SD-CG 4.06Å; L178-K220 HydrophobicContact CB-CB 4.43Å; L178-K220 HydrophobicContact CB-CD 4.43Å; T216-K220 HydrophobicContact CG2-CD 4.39Å; T216-K220 WeakPolarHBondContact O-CB 3.32Å; T216-K220 WeakPolarHBondContact O-CG 3.2Å; T216-K220 PolarHBondContact O-N 3.2Å; I217-K220 PolarHBondContact O-N 2.8Å; F218-K220 PolarHBondContact O-N 3.47Å; K220-I223 PolarHBondContact O-N 3.29Å; K220-I224 WeakPolarHBondContact O-CB 3.48Å; K220-I224 WeakPolarHBondContact O-CD1 3.21Å; K220-I224 VanDerWaalsContact O-CG1 3.23Å; K220-I224 WeakPolarHBondContact O-CG1 3.35Å; K220-I224 PolarHBondContact O-N 3.49Å
221	L	98.3	Very high	96.9	Very high	23 Å²	23	27.6 Å²	27.6	12%	0.12	13%	0.133	C	C	.	.	H	α-helix	trans	-65.1	-41.5	179.4	-170.8	59.7	0	0	0	111.9	A117 I124 L178 I217 F218 I223 I224 L225	A117-L221 HydrophobicContact CB-CB 4.45Å; A117-L221 HydrophobicContact CB-CD2 4.5Å; A117-L221 HydrophobicContact CB-CG 4.27Å; A117-L221 WeakPolarHBondContact O-CD2 3.33Å; I124-L221 HydrophobicContact CD1-CD2 4.35Å; L178-L221 HydrophobicContact CD2-CD1 4.4Å; I217-L221 VanDerWaalsContact O-CB 3.31Å; I217-L221 WeakPolarHBondContact O-CB 3.47Å; I217-L221 PolarHBondContact O-N 3.49Å; F218-L221 PolarHBondContact O-N 2.86Å; L221-I223 PolarHBondContact O-N 2.87Å; L221-I224 PolarHBondContact O-N 3.34Å; L221-L225 HydrophobicContact CD1-CD1 4.41Å; L221-L225 HydrophobicContact CD1-CG 4.33Å; L221-L225 HydrophobicContact CG-CD1 4.13Å; L221-L225 HydrophobicContact CG-CG 4.47Å; L221-L225 WeakPolarHBondContact O-CB 3.42Å; L221-L225 VanDerWaalsContact O-CG 3.29Å; L221-L225 WeakPolarHBondContact O-CG 3.48Å; L221-L225 PolarHBondContact O-N 2.89Å
222	M	97.8	Very high	96.5	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-55.7	-49.4	172.2	-81.5	-165.6	-65.9	0	0	112.1	T102 L103 V106 I114 A117 F218 L225 A226	T102-M222 HydrophobicContact CG2-CE 4.3Å; L103-M222 HydrophobicContact CD2-CE 4.23Å; L103-M222 HydrophobicContact CD2-SD 3.66Å; V106-M222 HydrophobicContact CG2-CB 4.17Å; I114-M222 HydrophobicContact CG1-SD 4.48Å; A117-M222 HydrophobicContact CB-CB 4.17Å; A117-M222 HydrophobicContact CB-CG 3.34Å; F218-M222 HydrophobicContact CD1-CE 3.55Å; F218-M222 HydrophobicContact CD1-SD 4.38Å; F218-M222 HydrophobicContact CD2-CE 4.34Å; F218-M222 HydrophobicContact CD2-CG 4.09Å; F218-M222 HydrophobicContact CD2-SD 4.39Å; F218-M222 HydrophobicContact CE1-CE 3.26Å; F218-M222 HydrophobicContact CE1-SD 3.68Å; F218-M222 HydrophobicContact CE2-CE 4.09Å; F218-M222 HydrophobicContact CE2-CG 3.7Å; F218-M222 HydrophobicContact CE2-SD 3.67Å; F218-M222 HydrophobicContact CG-CE 4.09Å; F218-M222 HydrophobicContact CZ-CE 3.57Å; F218-M222 HydrophobicContact CZ-CG 3.98Å; F218-M222 HydrophobicContact CZ-SD 3.28Å; F218-M222 WeakPolarHBondContact CZ-SD 3.17Å; F218-M222 WeakPolarHBondContact O-CB 3.16Å; F218-M222 WeakPolarHBondContact O-CG 3.35Å; F218-M222 PolarHBondContact O-N 3.44Å; M222-L225 PolarHBondContact O-N 3.34Å; M222-A226 VanDerWaalsContact O-CB 3.32Å; M222-A226 WeakPolarHBondContact O-CB 3.42Å; M222-A226 PolarHBondContact O-N 3.21Å
223	I	97.4	Very high	96.1	Very high	20 Å²	20	35.7 Å²	35.7	10%	0.103	17%	0.166	C	C	.	.	H	α-helix	trans	-63.5	-46.4	-179.6	-68.7	168.3	0	0	0	110.5	T102 F170 M174 R219 K220 L221 L225 A226 M227	T102-I223 HydrophobicContact CG2-CD1 4.08Å; T102-I223 HydrophobicContact CG2-CG1 3.72Å; F170-I223 HydrophobicContact CE1-CG2 3.89Å; F170-I223 HydrophobicContact CZ-CG2 3.84Å; M174-I223 HydrophobicContact CE-CD1 4.34Å; M174-I223 HydrophobicContact CG-CG2 4Å; M174-I223 HydrophobicContact SD-CB 4.39Å; M174-I223 HydrophobicContact SD-CD1 4.19Å; M174-I223 HydrophobicContact SD-CG2 4.07Å; R219-I223 HydrophobicContact CG-CD1 4.03Å; R219-I223 VanDerWaalsContact O-CG1 3.31Å; R219-I223 WeakPolarHBondContact O-CG1 3.13Å; R219-I223 PolarHBondContact O-N 3.41Å; R219-I223 VanDerWaalsContact O-N 3.11Å; K220-I223 PolarHBondContact O-N 3.29Å; L221-I223 PolarHBondContact O-N 2.87Å; I223-L225 PolarHBondContact O-N 3.18Å; I223-A226 PolarHBondContact O-N 2.95Å; I223-M227 HydrophobicContact CG2-CG 4.26Å; I223-M227 HydrophobicContact CG2-SD 3.62Å; I223-M227 WeakPolarHBondContact O-CB 3.16Å; I223-M227 WeakPolarHBondContact O-CG 3.35Å; I223-M227 PolarHBondContact O-N 2.94Å
224	I	97.9	Very high	95.6	Very high	6 Å²	6	41.6 Å²	41.6	3%	0.031	19%	0.191	C	C	.	.	H	α-helix	trans	-57.9	-50.4	178.7	-72.5	164.4	0	0	0	110.9	M174 Y175 L178 K220 L221 A226 M227 N228	M174-I224 HydrophobicContact CB-CD1 4.17Å; M174-I224 HydrophobicContact CB-CG1 3.8Å; Y175-I224 HydrophobicContact CD1-CD1 4.09Å; Y175-I224 HydrophobicContact CE1-CD1 4.25Å; Y175-I224 HydrophobicContact CE1-CG1 4.47Å; Y175-I224 HydrophobicContact CE1-CG2 3.73Å; Y175-I224 HydrophobicContact CE2-CG2 4.43Å; Y175-I224 HydrophobicContact CG-CD1 4.4Å; Y175-I224 WeakPolarHBondContact OH-CG2 3.43Å; L178-I224 HydrophobicContact CB-CD1 4.28Å; L178-I224 HydrophobicContact CD2-CD1 3.82Å; K220-I224 WeakPolarHBondContact O-CB 3.48Å; K220-I224 WeakPolarHBondContact O-CD1 3.21Å; K220-I224 VanDerWaalsContact O-CG1 3.23Å; K220-I224 WeakPolarHBondContact O-CG1 3.35Å; K220-I224 PolarHBondContact O-N 3.49Å; L221-I224 PolarHBondContact O-N 3.34Å; I224-A226 VanDerWaalsContact C-N 3.33Å; I224-A226 PolarHBondContact O-N 3.27Å; I224-M227 PolarHBondContact O-N 2.86Å; I224-N228 WeakPolarHBondContact O-CB 3.37Å; I224-N228 PolarHBondContact O-N 3.04Å; I224-N228 PolarHBondContact O-ND2 3.34Å
225	L	97.8	Very high	94.9	Very high	50 Å²	50	48.8 Å²	48.8	26%	0.262	23%	0.225	S	C	.	.	H	α-helix	trans	-62.7	-41.4	-180	-71.1	175.4	0	0	0	111.4	I113 T116 A117 L221 M222 I223 N228 D229	I113-L225 HydrophobicContact CD1-CB 4.45Å; I113-L225 HydrophobicContact CG1-CB 4.46Å; I113-L225 HydrophobicContact CG2-CB 3.48Å; I113-L225 VanDerWaalsContact CG2-CB 3.48Å; I113-L225 HydrophobicContact CG2-CD1 4.14Å; I113-L225 HydrophobicContact CG2-CG 4.47Å; T116-L225 HydrophobicContact CG2-CD1 4.03Å; A117-L225 HydrophobicContact CB-CD1 4.07Å; L221-L225 HydrophobicContact CD1-CD1 4.41Å; L221-L225 HydrophobicContact CD1-CG 4.33Å; L221-L225 HydrophobicContact CG-CD1 4.13Å; L221-L225 HydrophobicContact CG-CG 4.47Å; L221-L225 WeakPolarHBondContact O-CB 3.42Å; L221-L225 VanDerWaalsContact O-CG 3.29Å; L221-L225 WeakPolarHBondContact O-CG 3.48Å; L221-L225 PolarHBondContact O-N 2.89Å; M222-L225 PolarHBondContact O-N 3.34Å; I223-L225 PolarHBondContact O-N 3.18Å; L225-N228 PolarHBondContact O-N 2.85Å; L225-D229 WeakPolarHBondContact O-CB 3.48Å; L225-D229 PolarHBondContact O-N 3.13Å
226	A	97.3	Very high	94	Very high	0 Å²	0	57 Å²	57	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-65.9	-39.5	177.6	0	0	0	0	0	112.7	F105 V106 V109 I113 M222 I223 I224 D229 K230	F105-A226 HydrophobicContact CD1-CB 4.31Å; F105-A226 HydrophobicContact CE1-CB 3.77Å; V106-A226 HydrophobicContact CG2-CB 4.05Å; V109-A226 HydrophobicContact CB-CB 4.43Å; V109-A226 HydrophobicContact CG1-CB 4.41Å; V109-A226 HydrophobicContact CG2-CB 4.34Å; I113-A226 HydrophobicContact CD1-CB 4.16Å; M222-A226 VanDerWaalsContact O-CB 3.32Å; M222-A226 WeakPolarHBondContact O-CB 3.42Å; M222-A226 PolarHBondContact O-N 3.21Å; I223-A226 PolarHBondContact O-N 2.95Å; I224-A226 VanDerWaalsContact C-N 3.33Å; I224-A226 PolarHBondContact O-N 3.27Å; A226-D229 PolarHBondContact O-N 3.08Å; A226-K230 WeakPolarHBondContact O-CG 3.39Å; A226-K230 PolarHBondContact O-N 2.59Å
227	M	95.1	Very high	92.4	Very high	15 Å²	15	67.1 Å²	67.1	7%	0.074	30%	0.302	C	S	.	.	H	α-helix	trans	-63.8	-45.7	174.5	-68.9	168.7	76.1	0	0	111.6	F170 K171 I223 I224 D229 K230 D231	F170-M227 HydrophobicContact CD1-CE 3.62Å; F170-M227 HydrophobicContact CD1-SD 3.96Å; F170-M227 HydrophobicContact CE1-CE 3.8Å; F170-M227 HydrophobicContact CE1-SD 3.51Å; F170-M227 VanDerWaalsContact CE1-SD 3.51Å; K171-M227 HydrophobicContact CB-CE 4.38Å; K171-M227 HydrophobicContact CD-CE 4.18Å; K171-M227 HydrophobicContact CG-CE 3.27Å; I223-M227 HydrophobicContact CG2-CG 4.26Å; I223-M227 HydrophobicContact CG2-SD 3.62Å; I223-M227 WeakPolarHBondContact O-CB 3.16Å; I223-M227 WeakPolarHBondContact O-CG 3.35Å; I223-M227 PolarHBondContact O-N 2.94Å; I224-M227 PolarHBondContact O-N 2.86Å; M227-D229 VanDerWaalsContact C-N 3.33Å; M227-D229 PolarHBondContact O-N 2.95Å; M227-K230 PolarHBondContact O-N 3.25Å; M227-D231 PolarHBondContact O-N 2.87Å
228	N	94.8	Very high	92.1	Very high	53 Å²	53	70.5 Å²	70.5	28%	0.283	32%	0.317	S	S	.	.	H	α-helix	trans	-65	-36.7	179.7	-67.9	-12.4	0	0	0	111.8	Y175 I224 L225 K232	Y175-N228 PolarHBondContact OH-ND2 3.36Å; Y175-N228 VanDerWaalsContact OH-ND2 3.1Å; Y175-N228 PolarHBondContact OH-OD1 3.22Å; I224-N228 WeakPolarHBondContact O-CB 3.37Å; I224-N228 PolarHBondContact O-N 3.04Å; I224-N228 PolarHBondContact O-ND2 3.34Å; L225-N228 PolarHBondContact O-N 2.85Å; N228-K232 WeakPolarHBondContact O-CG 3.41Å; N228-K232 PolarHBondContact O-N 3.05Å; N228-K232 VanDerWaalsContact O-N 3.11Å
229	D	95	Very high	91.8	Very high	36 Å²	36	73.3 Å²	73.3	19%	0.193	33%	0.33	C	S	.	.	H	α-helix	trans	-67.6	-41.5	175	-169.3	85.7	0	0	0	112	V109 I113 L225 A226 M227 D231 K232 K233	V109-D229 HydrophobicContact CG1-CB 3.98Å; V109-D229 WeakPolarHBondContact CG1-OD2 3.45Å; I113-D229 HydrophobicContact CD1-CB 3.85Å; L225-D229 WeakPolarHBondContact O-CB 3.48Å; L225-D229 PolarHBondContact O-N 3.13Å; A226-D229 PolarHBondContact O-N 3.08Å; M227-D229 VanDerWaalsContact C-N 3.33Å; M227-D229 PolarHBondContact O-N 2.95Å; D229-D231 PolarHBondContact O-N 3.19Å; D229-K232 PolarHBondContact O-N 3.12Å; D229-K233 WeakPolarHBondContact O-CG 3.32Å; D229-K233 PolarHBondContact O-N 3.19Å; D229-K233 VanDerWaalsContact O-N 3.09Å; D229-K233 VanDerWaalsContact OD2-CE 3.26Å; D229-K233 WeakPolarHBondContact OD2-CE 3.4Å; D229-K233 IonicContact OD2-NZ 2.72Å; D229-K233 PolarHBondContact OD2-NZ 3Å
230	K	92.7	Very high	91.5	Very high	82 Å²	82	71.3 Å²	71.3	36%	0.357	33%	0.325	S	S	.	.	H	α-helix	trans	-59.8	-44.5	173.4	-79.8	-165.2	179.7	-168.1	0	112.2	F105 V109 A226 M227 K233 K234	F105-K230 HydrophobicContact CZ-CD 4.27Å; V109-K230 HydrophobicContact CB-CG 4.48Å; V109-K230 HydrophobicContact CG1-CG 3.81Å; V109-K230 HydrophobicContact CG2-CD 4.02Å; V109-K230 HydrophobicContact CG2-CG 3.82Å; A226-K230 WeakPolarHBondContact O-CG 3.39Å; A226-K230 PolarHBondContact O-N 2.59Å; M227-K230 PolarHBondContact O-N 3.25Å; K230-K233 PolarHBondContact O-N 3.38Å; K230-K234 WeakPolarHBondContact O-CG 3.45Å; K230-K234 PolarHBondContact O-N 3.25Å
231	D	90.4	Very high	91.1	Very high	38 Å²	38	74.9 Å²	74.9	20%	0.203	34%	0.342	C	S	.	.	H	α-helix	trans	-66	-44.2	-178.7	-72.5	-12.6	0	0	0	110.8	K171 M227 D229 K233 K234 E235	K171-D231 IonicContact NZ-OD2 2.92Å; K171-D231 PolarHBondContact NZ-OD2 2.66Å; M227-D231 PolarHBondContact O-N 2.87Å; D229-D231 PolarHBondContact O-N 3.19Å; D231-K233 VanDerWaalsContact C-N 3.29Å; D231-K233 PolarHBondContact O-N 3.41Å; D231-K234 WeakPolarHBondContact O-CB 3.46Å; D231-K234 PolarHBondContact O-N 2.82Å; D231-E235 PolarHBondContact O-N 3.45Å; D231-E235 VanDerWaalsContact O-N 3.15Å
232	K	90.6	Very high	90.6	Very high	131 Å²	131	78.1 Å²	78.1	57%	0.57	36%	0.355	S	S	*	.	H	α-helix	trans	-58.7	-36.1	173.9	-74.5	176.6	-179.5	-177.8	0	113.8	N228 D229 K234 K236	N228-K232 WeakPolarHBondContact O-CG 3.41Å; N228-K232 PolarHBondContact O-N 3.05Å; N228-K232 VanDerWaalsContact O-N 3.11Å; D229-K232 PolarHBondContact O-N 3.12Å; K232-K234 VanDerWaalsContact C-N 3.32Å; K232-K236 WeakPolarHBondContact O-CG 3.33Å
233	K	88.8	Confident	90.2	Very high	99 Å²	99	83.3 Å²	83.3	43%	0.43	38%	0.379	S	S	.	.	H	α-helix	trans	-71.2	-26.4	177.1	-79.5	171.6	173.1	155.9	0	112.8	V109 D229 K230 D231	V109-K233 PolarHBondContact O-NZ 3.19Å; D229-K233 WeakPolarHBondContact O-CG 3.32Å; D229-K233 PolarHBondContact O-N 3.19Å; D229-K233 VanDerWaalsContact O-N 3.09Å; D229-K233 VanDerWaalsContact OD2-CE 3.26Å; D229-K233 WeakPolarHBondContact OD2-CE 3.4Å; D229-K233 IonicContact OD2-NZ 2.72Å; D229-K233 PolarHBondContact OD2-NZ 3Å; K230-K233 PolarHBondContact O-N 3.38Å; D231-K233 VanDerWaalsContact C-N 3.29Å; D231-K233 PolarHBondContact O-N 3.41Å
234	K	87.1	Confident	89.7	Confident	131 Å²	131	87.9 Å²	87.9	57%	0.57	40%	0.399	S	S	*	.	H	α-helix	trans	-76.4	-40.6	175.3	-70.4	174.6	179.8	176.9	0	111.9	K230 D231 K232 K236 K237	K230-K234 WeakPolarHBondContact O-CG 3.45Å; K230-K234 PolarHBondContact O-N 3.25Å; D231-K234 WeakPolarHBondContact O-CB 3.46Å; D231-K234 PolarHBondContact O-N 2.82Å; K232-K234 VanDerWaalsContact C-N 3.32Å; K234-K236 PolarHBondContact O-N 2.88Å; K234-K237 PolarHBondContact O-N 3.19Å
235	E	85.3	Confident	89	Confident	162 Å²	162	94.2 Å²	94.2	76%	0.757	43%	0.427	S	S	*	.	H	α-helix	trans	-65.3	-21.8	178.9	-68.3	174.6	170.2	0	0	113.6	D231	D231-E235 PolarHBondContact O-N 3.45Å; D231-E235 VanDerWaalsContact O-N 3.15Å
236	K	79.1	Confident	88.3	Confident	188 Å²	188	97.8 Å²	97.8	82%	0.817	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-5.4	177.9	-69	-179	179.1	-172.4	0	114.2	K232 K234	K232-K236 WeakPolarHBondContact O-CG 3.33Å; K234-K236 PolarHBondContact O-N 2.88Å
237	K	63.4	Low	87.5	Confident	239 Å²	239	106.7 Å²	106.7	100%	1.039	48%	0.481	S	S	*	.			trans	-103.9	0	177.6	-76.7	-172.9	175.5	-169.4	0	109.8	K234	K234-K237 PolarHBondContact O-N 3.19Å

Retrieved 237 of 237 residues in 78.1 ms (Link to these results)

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