G4VSX4_SCHMA Loading...

Phosphatidic acid phosphatase type 2-related

AlphaFold DB , UniProt , Accession G4VSX4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 192 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	49.2	Very low	78.9	Confident	235 Å²	235	110.4 Å²	110.4	100%	1.158	56%	0.555	S	S	*	*				0	120.4	0	-83.4	175.2	177.6	0	0	107.8	T3	M1-T3 PolarHBondContact O-N 3.37Å
2	A	60.4	Low	79.7	Confident	108 Å²	108	104.3 Å²	104.3	89%	0.893	53%	0.525	S	S	*	.			trans	-65.6	108.1	171.7	0	0	0	0	0	108	S4	A2-S4 PolarHBondContact O-N 3.37Å
3	T	64.8	Low	80.6	Confident	72 Å²	72	106.2 Å²	106.2	44%	0.442	53%	0.528	S	S	.	.			trans	-61.7	135.5	170.7	48.7	0	0	0	0	107.7	M1	M1-T3 PolarHBondContact O-N 3.37Å
4	S	81.9	Confident	81.5	Confident	59 Å²	59	99.5 Å²	99.5	41%	0.413	50%	0.495	S	S	.	.			trans	-54.3	146.8	176.7	75.3	0	0	0	0	109.8	A2 W6 T7 R8	A2-S4 PolarHBondContact O-N 3.37Å; S4-W6 PolarHBondContact O-N 2.66Å; S4-W6 VanDerWaalsContact O-N 3.1Å; S4-T7 PolarHBondContact N-OG1 3.3Å; S4-T7 VanDerWaalsContact N-OG1 3.08Å; S4-T7 PolarHBondContact O-N 2.99Å; S4-T7 PolarHBondContact O-OG1 3Å; S4-T7 WeakPolarHBondContact OG-CB 3.26Å; S4-T7 VanDerWaalsContact OG-CG2 3.28Å; S4-T7 WeakPolarHBondContact OG-CG2 3.31Å; S4-T7 PolarHBondContact OG-N 3.32Å; S4-T7 PolarHBondContact OG-OG1 3.22Å; S4-R8 PolarHBondContact O-N 3.39Å
5	R	84.6	Confident	82.1	Confident	191 Å²	191	94.3 Å²	94.3	72%	0.721	47%	0.469	S	S	*	.	H	α-helix	trans	-52.7	-37.1	177.5	-174.1	174.6	178	177.7	2.1	111.6	R8 H9	R5-R8 PolarHBondContact O-N 3.25Å; R5-H9 PolarHBondContact NE-NE2 3.45Å; R5-H9 PolarHBondContact O-CD2 3.33Å; R5-H9 PolarHBondContact O-N 3.01Å; R5-H9 VanDerWaalsContact O-N 3.07Å
6	W	84.8	Confident	82.5	Confident	218 Å²	218	97.2 Å²	97.2	83%	0.826	47%	0.473	S	S	*	.	H	α-helix	trans	-62.4	-49.3	175	-74.6	109.1	0	0	0	113.4	S4 R8 H9 L10	S4-W6 PolarHBondContact O-N 2.66Å; S4-W6 VanDerWaalsContact O-N 3.1Å; W6-R8 VanDerWaalsContact C-N 3.27Å; W6-R8 PolarHBondContact O-N 3.11Å; W6-H9 PolarHBondContact O-N 2.86Å; W6-L10 WeakPolarHBondContact O-CB 3.33Å; W6-L10 PolarHBondContact O-N 3.32Å
7	T	85.6	Confident	83.1	Confident	65 Å²	65	93.5 Å²	93.5	40%	0.399	46%	0.458	S	S	.	.	H	α-helix	trans	-64.2	-33.5	179.3	50.7	0	0	0	0	111.9	S4 S11	S4-T7 PolarHBondContact N-OG1 3.3Å; S4-T7 VanDerWaalsContact N-OG1 3.08Å; S4-T7 PolarHBondContact O-N 2.99Å; S4-T7 PolarHBondContact O-OG1 3Å; S4-T7 WeakPolarHBondContact OG-CB 3.26Å; S4-T7 VanDerWaalsContact OG-CG2 3.28Å; S4-T7 WeakPolarHBondContact OG-CG2 3.31Å; S4-T7 PolarHBondContact OG-N 3.32Å; S4-T7 PolarHBondContact OG-OG1 3.22Å; T7-S11 WeakPolarHBondContact O-CB 3.14Å; T7-S11 PolarHBondContact O-N 3.25Å; T7-S11 PolarHBondContact O-OG 2.92Å
8	R	86.2	Confident	83.4	Confident	74 Å²	74	88.4 Å²	88.4	28%	0.279	43%	0.433	S	S	.	.	H	α-helix	trans	-64.8	-49	172.6	-167.4	-176.4	73.9	98.2	0.6	112	S4 R5 W6 L10 S11 L12 D107	S4-R8 PolarHBondContact O-N 3.39Å; R5-R8 PolarHBondContact O-N 3.25Å; W6-R8 VanDerWaalsContact C-N 3.27Å; W6-R8 PolarHBondContact O-N 3.11Å; R8-L10 PolarHBondContact O-N 3.35Å; R8-S11 PolarHBondContact O-N 3.41Å; R8-L12 HydrophobicContact CG-CD1 4.42Å; R8-L12 WeakPolarHBondContact O-CG 3.48Å; R8-L12 PolarHBondContact O-N 2.8Å; R8-D107 VanDerWaalsContact NH1-CG 3.28Å; R8-D107 IonicContact NH1-OD1 2.89Å; R8-D107 PolarHBondContact NH1-OD1 3.04Å; R8-D107 IonicContact NH1-OD2 3.21Å; R8-D107 PolarHBondContact NH1-OD2 3.19Å
9	H	89	Confident	83.7	Confident	80 Å²	80	85.6 Å²	85.6	37%	0.37	42%	0.419	S	S	.	.	H	α-helix	trans	-63.3	-39.8	178	-72.9	-59.4	0	0	0	112.8	R5 W6 S11 L12 F13	R5-H9 PolarHBondContact NE-NE2 3.45Å; R5-H9 PolarHBondContact O-CD2 3.33Å; R5-H9 PolarHBondContact O-N 3.01Å; R5-H9 VanDerWaalsContact O-N 3.07Å; W6-H9 PolarHBondContact O-N 2.86Å; H9-S11 VanDerWaalsContact C-N 3.34Å; H9-L12 PolarHBondContact O-N 2.89Å; H9-F13 PolarHBondContact O-N 3.49Å
10	L	91.1	Very high	84	Confident	100 Å²	100	81.7 Å²	81.7	52%	0.524	40%	0.402	S	S	.	.	H	α-helix	trans	-61.8	-43.4	174.1	178.5	61.6	0	0	0	111.4	W6 R8 F13 L14	W6-L10 WeakPolarHBondContact O-CB 3.33Å; W6-L10 PolarHBondContact O-N 3.32Å; R8-L10 PolarHBondContact O-N 3.35Å; L10-F13 WeakPolarHBondContact O-CB 3.4Å; L10-F13 PolarHBondContact O-N 3.05Å; L10-L14 HydrophobicContact CG-CD1 4.31Å; L10-L14 WeakPolarHBondContact O-CG 3.46Å; L10-L14 PolarHBondContact O-N 2.96Å
11	S	89.9	Confident	84.3	Confident	12 Å²	12	82.8 Å²	82.8	8%	0.084	41%	0.413	C	S	.	.	H	α-helix	trans	-68.6	-35.6	179.9	-54.2	0	0	0	0	112.3	T7 R8 H9 L14 E15 M164	T7-S11 WeakPolarHBondContact O-CB 3.14Å; T7-S11 PolarHBondContact O-N 3.25Å; T7-S11 PolarHBondContact O-OG 2.92Å; R8-S11 PolarHBondContact O-N 3.41Å; H9-S11 VanDerWaalsContact C-N 3.34Å; S11-L14 PolarHBondContact O-N 2.96Å; S11-E15 PolarHBondContact O-N 3.04Å; S11-M164 WeakPolarHBondContact CB-SD 3.4Å
12	L	89.2	Confident	86.4	Confident	37 Å²	37	75.5 Å²	75.5	19%	0.194	38%	0.378	C	S	.	.	H	α-helix	trans	-63.9	-41.5	170.7	-74.1	169.4	0	0	0	111.9	R8 H9 E15 W16 D107 M164	R8-L12 HydrophobicContact CG-CD1 4.42Å; R8-L12 WeakPolarHBondContact O-CG 3.48Å; R8-L12 PolarHBondContact O-N 2.8Å; H9-L12 PolarHBondContact O-N 2.89Å; L12-E15 WeakPolarHBondContact O-CB 3.38Å; L12-E15 PolarHBondContact O-N 3.29Å; L12-W16 PolarHBondContact O-N 2.97Å; L12-D107 HydrophobicContact CD2-CB 4.12Å; L12-M164 HydrophobicContact CD2-CE 3.66Å; L12-M164 HydrophobicContact CG-CE 3.99Å
13	F	91.7	Very high	88	Confident	129 Å²	129	72.9 Å²	72.9	57%	0.566	35%	0.345	S	S	*	.	H	α-helix	trans	-61.5	-44.7	173.7	173	-101.1	0	0	0	111.4	H9 L10 E15 W16 T17	H9-F13 PolarHBondContact O-N 3.49Å; L10-F13 WeakPolarHBondContact O-CB 3.4Å; L10-F13 PolarHBondContact O-N 3.05Å; F13-E15 VanDerWaalsContact C-N 3.27Å; F13-E15 PolarHBondContact O-N 3.48Å; F13-W16 WeakPolarHBondContact O-CB 3.41Å; F13-W16 PolarHBondContact O-N 2.91Å; F13-W16 VanDerWaalsContact O-N 3.1Å; F13-T17 HydrophobicContact CD1-CG2 4.24Å; F13-T17 HydrophobicContact CE1-CG2 3.79Å; F13-T17 HydrophobicContact CE2-CG2 4.43Å; F13-T17 HydrophobicContact CZ-CG2 3.9Å; F13-T17 WeakPolarHBondContact O-CG2 3.24Å; F13-T17 PolarHBondContact O-N 2.97Å; F13-T17 VanDerWaalsContact O-N 3.1Å
14	L	92.6	Very high	89.4	Confident	13 Å²	13	71.1 Å²	71.1	7%	0.068	33%	0.333	C	S	.	.	H	α-helix	trans	-61.1	-35.9	175.9	-71.7	171.4	0	0	0	112.4	L10 S11 W16 T17 G18 I156 V157	L10-L14 HydrophobicContact CG-CD1 4.31Å; L10-L14 WeakPolarHBondContact O-CG 3.46Å; L10-L14 PolarHBondContact O-N 2.96Å; S11-L14 PolarHBondContact O-N 2.96Å; L14-W16 VanDerWaalsContact C-N 3.3Å; L14-W16 PolarHBondContact O-N 2.73Å; L14-T17 PolarHBondContact O-N 3.46Å; L14-T17 VanDerWaalsContact O-N 3.16Å; L14-T17 PolarHBondContact O-OG1 3.22Å; L14-G18 PolarHBondContact O-N 2.75Å; L14-I156 HydrophobicContact CD1-CB 4.21Å; L14-I156 HydrophobicContact CD1-CD1 4.46Å; L14-I156 HydrophobicContact CD1-CG1 4.22Å; L14-I156 HydrophobicContact CD2-CD1 3.68Å; L14-I156 HydrophobicContact CD2-CG1 3.82Å; L14-V157 HydrophobicContact CB-CG2 4.49Å; L14-V157 HydrophobicContact CD2-CG2 4.24Å
15	E	90	Very high	90.1	Very high	21 Å²	21	69.7 Å²	69.7	10%	0.098	33%	0.327	C	S	.	.	H	α-helix	trans	-57.5	-41.8	173.3	-175	170.6	150.5	0	0	111.9	S11 L12 F13 H19 H123 R161 R166	S11-E15 PolarHBondContact O-N 3.04Å; L12-E15 WeakPolarHBondContact O-CB 3.38Å; L12-E15 PolarHBondContact O-N 3.29Å; F13-E15 VanDerWaalsContact C-N 3.27Å; F13-E15 PolarHBondContact O-N 3.48Å; E15-H19 PolarHBondContact O-N 3.28Å; E15-H123 PolarHBondContact O-NE2 2.87Å; E15-R161 VanDerWaalsContact CD-NH1 3.26Å; E15-R161 IonicContact OE2-CZ 3.41Å; E15-R161 IonicContact OE2-NH1 3.5Å; E15-R161 PolarHBondContact OE2-NH1 3.41Å; E15-R161 IonicContact OE2-NH2 3.76Å; E15-R166 IonicContact OE2-CZ 2.8Å; E15-R166 IonicContact OE2-NE 3.94Å; E15-R166 PolarHBondContact OE2-NE 3.25Å; E15-R166 IonicContact OE2-NH2 3.04Å; E15-R166 PolarHBondContact OE2-NH2 3.49Å
16	W	88.9	Confident	90.6	Very high	141 Å²	141	66.4 Å²	66.4	53%	0.534	32%	0.318	S	S	.	.	H	α-helix	trans	-65	-45.8	173	-80.2	90.7	0	0	0	111.7	L12 F13 L14 G18 H19 L22 L110	L12-W16 PolarHBondContact O-N 2.97Å; F13-W16 WeakPolarHBondContact O-CB 3.41Å; F13-W16 PolarHBondContact O-N 2.91Å; F13-W16 VanDerWaalsContact O-N 3.1Å; L14-W16 VanDerWaalsContact C-N 3.3Å; L14-W16 PolarHBondContact O-N 2.73Å; W16-G18 PolarHBondContact O-N 3.31Å; W16-H19 VanDerWaalsContact O-CB 3.28Å; W16-H19 WeakPolarHBondContact O-CB 3.5Å; W16-H19 PolarHBondContact O-N 3.46Å; W16-L22 HydrophobicContact CB-CD1 4.4Å; W16-L22 HydrophobicContact CE3-CD1 3.69Å; W16-L22 HydrophobicContact CE3-CD2 4.47Å; W16-L22 HydrophobicContact CE3-CG 4.35Å; W16-L22 HydrophobicContact CZ3-CD1 4.43Å; W16-L22 HydrophobicContact CZ3-CD2 4.44Å; W16-L22 WeakPolarHBondContact O-CD1 3.32Å; W16-L110 HydrophobicContact CH2-CD2 4.01Å; W16-L110 HydrophobicContact CZ2-CD2 4.47Å; W16-L110 HydrophobicContact CZ3-CD2 4.49Å
17	T	92.4	Very high	91.1	Very high	35 Å²	35	56 Å²	56	22%	0.215	28%	0.279	C	S	.	.	H	α-helix	trans	-61	-31.2	-179.4	70.3	0	0	0	0	113.3	F13 L14 W23 W153	F13-T17 HydrophobicContact CD1-CG2 4.24Å; F13-T17 HydrophobicContact CE1-CG2 3.79Å; F13-T17 HydrophobicContact CE2-CG2 4.43Å; F13-T17 HydrophobicContact CZ-CG2 3.9Å; F13-T17 WeakPolarHBondContact O-CG2 3.24Å; F13-T17 PolarHBondContact O-N 2.97Å; F13-T17 VanDerWaalsContact O-N 3.1Å; L14-T17 PolarHBondContact O-N 3.46Å; L14-T17 VanDerWaalsContact O-N 3.16Å; L14-T17 PolarHBondContact O-OG1 3.22Å; T17-W23 PolarHBondContact O-NE1 3.41Å; T17-W153 PolarHBondContact OG1-NE1 3.08Å
18	G	88.2	Confident	91.6	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.01	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92	3.9	176.7	0	0	0	0	0	114.6	L14 W16 R126	L14-G18 PolarHBondContact O-N 2.75Å; W16-G18 PolarHBondContact O-N 3.31Å; G18-R126 PolarHBondContact O-NH1 3.38Å
19	H	89.9	Confident	92.1	Very high	35 Å²	35	58.3 Å²	58.3	16%	0.162	29%	0.293	C	S	.	.			trans	-76.6	126	-173.8	-159.1	-73	0	0	0	112	E15 W16 V21 L22	E15-H19 PolarHBondContact O-N 3.28Å; W16-H19 VanDerWaalsContact O-CB 3.28Å; W16-H19 WeakPolarHBondContact O-CB 3.5Å; W16-H19 PolarHBondContact O-N 3.46Å; H19-V21 PolarHBondContact ND1-N 3.04Å; H19-V21 PolarHBondContact O-N 3.4Å; H19-L22 HydrophobicContact CB-CD1 4.4Å; H19-L22 HydrophobicContact CB-CG 4.49Å; H19-L22 PolarHBondContact O-N 2.68Å
20	G	89.2	Confident	92.4	Very high	8 Å²	8	58.2 Å²	58.2	8%	0.082	29%	0.289	C	S	.	.	H	α-helix	trans	-61.1	-39.5	-172.7	0	0	0	0	0	114.6	L22 W23 I24 R126	G20-L22 VanDerWaalsContact C-N 3.27Å; G20-L22 PolarHBondContact O-N 3.44Å; G20-W23 PolarHBondContact O-N 2.92Å; G20-W23 VanDerWaalsContact O-N 3.16Å; G20-I24 WeakPolarHBondContact O-CG1 3.39Å; G20-I24 PolarHBondContact O-N 2.84Å; G20-R126 VanDerWaalsContact CA-CZ 3.49Å; G20-R126 VanDerWaalsContact N-NH1 3.13Å
21	V	90.9	Very high	92.5	Very high	104 Å²	104	54.2 Å²	54.2	63%	0.63	27%	0.268	S	S	*	.	H	α-helix	trans	-56.8	-39.3	178.6	177.5	0	0	0	0	112.3	H19 G25	H19-V21 PolarHBondContact ND1-N 3.04Å; H19-V21 PolarHBondContact O-N 3.4Å; V21-G25 PolarHBondContact O-N 3.32Å
22	L	92.3	Very high	92.6	Very high	82 Å²	82	58.1 Å²	58.1	43%	0.429	29%	0.287	S	S	.	.	H	α-helix	trans	-66.6	-44.9	178.7	-68.3	179.3	0	0	0	111.3	W16 H19 G20 F26	W16-L22 HydrophobicContact CB-CD1 4.4Å; W16-L22 HydrophobicContact CE3-CD1 3.69Å; W16-L22 HydrophobicContact CE3-CD2 4.47Å; W16-L22 HydrophobicContact CE3-CG 4.35Å; W16-L22 HydrophobicContact CZ3-CD1 4.43Å; W16-L22 HydrophobicContact CZ3-CD2 4.44Å; W16-L22 WeakPolarHBondContact O-CD1 3.32Å; H19-L22 HydrophobicContact CB-CD1 4.4Å; H19-L22 HydrophobicContact CB-CG 4.49Å; H19-L22 PolarHBondContact O-N 2.68Å; G20-L22 VanDerWaalsContact C-N 3.27Å; G20-L22 PolarHBondContact O-N 3.44Å; L22-F26 VanDerWaalsContact O-CB 3.24Å; L22-F26 WeakPolarHBondContact O-CB 3.29Å; L22-F26 PolarHBondContact O-N 2.8Å
23	W	94.1	Very high	92.7	Very high	53 Å²	53	59.4 Å²	59.4	20%	0.201	30%	0.296	C	S	.	.	H	α-helix	trans	-65.3	-45.7	178.3	-78.1	96.9	0	0	0	112.2	T17 G20 F26 V27 L81 L130 I134 W153	T17-W23 PolarHBondContact O-NE1 3.41Å; G20-W23 PolarHBondContact O-N 2.92Å; G20-W23 VanDerWaalsContact O-N 3.16Å; W23-F26 PolarHBondContact O-N 2.97Å; W23-V27 WeakPolarHBondContact O-CB 3.25Å; W23-V27 VanDerWaalsContact O-CG2 3.26Å; W23-V27 WeakPolarHBondContact O-CG2 3.41Å; W23-V27 PolarHBondContact O-N 2.84Å; W23-L81 HydrophobicContact CB-CD1 3.85Å; W23-L81 HydrophobicContact CB-CD2 3.79Å; W23-L81 HydrophobicContact CG-CD2 4.48Å; W23-L130 HydrophobicContact CD2-CD1 3.54Å; W23-L130 HydrophobicContact CD2-CD2 4.46Å; W23-L130 VanDerWaalsContact CE2-CD1 3.45Å; W23-L130 HydrophobicContact CE3-CD1 4.02Å; W23-L130 HydrophobicContact CE3-CD2 4.17Å; W23-L130 HydrophobicContact CG-CD1 3.89Å; W23-L130 HydrophobicContact CH2-CD1 4.3Å; W23-L130 HydrophobicContact CZ2-CD1 3.86Å; W23-L130 HydrophobicContact CZ3-CD1 4.37Å; W23-L130 HydrophobicContact CZ3-CD2 4.41Å; W23-I134 HydrophobicContact CH2-CD1 4.17Å; W23-I134 HydrophobicContact CZ3-CD1 4.15Å; W23-W153 AromaticContact CZ2-CH2 3.93Å; W23-W153 HydrophobicContact CZ2-CH2 3.93Å; W23-W153 HydrophobicContact CZ2-CZ2 4.18Å
24	I	95.7	Very high	92.6	Very high	36 Å²	36	54.4 Å²	54.4	19%	0.185	28%	0.276	C	S	.	.	H	α-helix	trans	-61.3	-48	177.4	-67.9	166.3	0	0	0	110.2	G20 F26 V27 L28 L78 L81 L82	G20-I24 WeakPolarHBondContact O-CG1 3.39Å; G20-I24 PolarHBondContact O-N 2.84Å; I24-F26 PolarHBondContact O-N 3.31Å; I24-V27 PolarHBondContact O-N 3.07Å; I24-L28 HydrophobicContact CG2-CD1 3.74Å; I24-L28 HydrophobicContact CG2-CG 4.31Å; I24-L28 WeakPolarHBondContact O-CB 3.43Å; I24-L28 VanDerWaalsContact O-CG 3.25Å; I24-L28 WeakPolarHBondContact O-CG 3.21Å; I24-L28 PolarHBondContact O-N 3.49Å; I24-L78 HydrophobicContact CG2-CD1 4.24Å; I24-L81 HydrophobicContact CG1-CB 3.88Å; I24-L81 HydrophobicContact CG1-CD1 4.39Å; I24-L82 HydrophobicContact CD1-CD2 4.19Å
25	G	95.8	Very high	92.4	Very high	28 Å²	28	57.3 Å²	57.3	29%	0.289	29%	0.291	S	S	.	.	H	α-helix	trans	-60.9	-45.3	178.3	0	0	0	0	0	112.7	V21 L28 I29	V21-G25 PolarHBondContact O-N 3.32Å; G25-L28 PolarHBondContact O-N 3.34Å; G25-I29 VanDerWaalsContact O-CG1 3.32Å; G25-I29 WeakPolarHBondContact O-CG1 3.35Å; G25-I29 PolarHBondContact O-N 2.9Å
26	F	95.5	Very high	92.3	Very high	122 Å²	122	61.3 Å²	61.3	54%	0.535	31%	0.312	S	S	.	.	H	α-helix	trans	-59.2	-49.8	176.4	171.3	-104.3	0	0	0	112	L22 W23 I24 L28 I29 W30	L22-F26 VanDerWaalsContact O-CB 3.24Å; L22-F26 WeakPolarHBondContact O-CB 3.29Å; L22-F26 PolarHBondContact O-N 2.8Å; W23-F26 PolarHBondContact O-N 2.97Å; I24-F26 PolarHBondContact O-N 3.31Å; F26-L28 PolarHBondContact O-N 2.93Å; F26-I29 PolarHBondContact O-N 3.41Å; F26-W30 HydrophobicContact CE1-CE3 4.28Å; F26-W30 WeakPolarHBondContact O-CB 3.24Å; F26-W30 PolarHBondContact O-N 3.49Å
27	V	95.7	Very high	92.1	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-67.2	-36.7	-178.9	177	0	0	0	0	111.6	W23 I24 W30 L31 P74 L77 L78 L81	W23-V27 WeakPolarHBondContact O-CB 3.25Å; W23-V27 VanDerWaalsContact O-CG2 3.26Å; W23-V27 WeakPolarHBondContact O-CG2 3.41Å; W23-V27 PolarHBondContact O-N 2.84Å; I24-V27 PolarHBondContact O-N 3.07Å; V27-W30 PolarHBondContact O-N 3.43Å; V27-L31 VanDerWaalsContact O-CB 3.31Å; V27-L31 WeakPolarHBondContact O-CB 3.46Å; V27-L31 PolarHBondContact O-N 3.05Å; V27-P74 HydrophobicContact CG1-CB 4.47Å; V27-P74 VanDerWaalsContact CG1-O 3.27Å; V27-P74 WeakPolarHBondContact CG1-O 3.45Å; V27-L77 HydrophobicContact CG2-CD2 3.66Å; V27-L77 HydrophobicContact CG2-CG 4.06Å; V27-L78 HydrophobicContact CG1-CB 3.8Å; V27-L78 HydrophobicContact CG1-CD1 4.45Å; V27-L81 HydrophobicContact CB-CD1 4.46Å; V27-L81 HydrophobicContact CG2-CD1 3.91Å
28	L	95.9	Very high	91.4	Very high	72 Å²	72	60.9 Å²	60.9	38%	0.377	32%	0.318	S	S	.	.	H	α-helix	trans	-62.4	-48.6	174.8	-78.1	170.9	0	0	0	112	I24 G25 F26 W30 L31 I32 L78	I24-L28 HydrophobicContact CG2-CD1 3.74Å; I24-L28 HydrophobicContact CG2-CG 4.31Å; I24-L28 WeakPolarHBondContact O-CB 3.43Å; I24-L28 VanDerWaalsContact O-CG 3.25Å; I24-L28 WeakPolarHBondContact O-CG 3.21Å; I24-L28 PolarHBondContact O-N 3.49Å; G25-L28 PolarHBondContact O-N 3.34Å; F26-L28 PolarHBondContact O-N 2.93Å; L28-W30 VanDerWaalsContact C-N 3.31Å; L28-W30 PolarHBondContact O-N 3.47Å; L28-L31 PolarHBondContact O-N 3.02Å; L28-I32 WeakPolarHBondContact O-CB 3.31Å; L28-I32 VanDerWaalsContact O-CG1 3.24Å; L28-I32 WeakPolarHBondContact O-CG1 3.02Å; L28-I32 PolarHBondContact O-N 3.4Å; L28-L78 HydrophobicContact CD2-CD1 3.94Å; L28-L78 HydrophobicContact CD2-CD2 3.6Å; L28-L78 HydrophobicContact CD2-CG 4.44Å; L28-L78 HydrophobicContact CG-CD1 3.91Å; L28-L78 HydrophobicContact CG-CD2 4.43Å
29	I	96.2	Very high	90.6	Very high	115 Å²	115	62.8 Å²	62.8	59%	0.59	33%	0.334	S	S	*	.	H	α-helix	trans	-59.6	-46.6	176.9	-67.8	166.3	0	0	0	109.7	G25 F26 L31 I32 T33	G25-I29 VanDerWaalsContact O-CG1 3.32Å; G25-I29 WeakPolarHBondContact O-CG1 3.35Å; G25-I29 PolarHBondContact O-N 2.9Å; F26-I29 PolarHBondContact O-N 3.41Å; I29-L31 PolarHBondContact O-N 3.49Å; I29-I32 PolarHBondContact O-N 2.94Å; I29-T33 WeakPolarHBondContact O-CG2 3.4Å; I29-T33 PolarHBondContact O-N 2.91Å; I29-T33 PolarHBondContact O-OG1 3.4Å
30	W	95.2	Very high	89.2	Confident	79 Å²	79	69.1 Å²	69.1	30%	0.299	36%	0.364	S	S	.	.	H	α-helix	trans	-58.7	-47.6	177.8	-177.5	21.4	0	0	0	112.1	F26 V27 L28 I32 T33 L34 P74 W138	F26-W30 HydrophobicContact CE1-CE3 4.28Å; F26-W30 WeakPolarHBondContact O-CB 3.24Å; F26-W30 PolarHBondContact O-N 3.49Å; V27-W30 PolarHBondContact O-N 3.43Å; L28-W30 VanDerWaalsContact C-N 3.31Å; L28-W30 PolarHBondContact O-N 3.47Å; W30-I32 PolarHBondContact O-N 3.23Å; W30-T33 PolarHBondContact O-N 2.92Å; W30-T33 PolarHBondContact O-OG1 2.86Å; W30-L34 HydrophobicContact CG-CD1 4.41Å; W30-L34 WeakPolarHBondContact O-CG 3.26Å; W30-L34 PolarHBondContact O-N 2.89Å; W30-P74 HydrophobicContact CD2-CB 4.16Å; W30-P74 HydrophobicContact CD2-CG 4Å; W30-P74 HydrophobicContact CE3-CB 3.89Å; W30-P74 HydrophobicContact CE3-CG 3.96Å; W30-P74 HydrophobicContact CH2-CB 4.43Å; W30-P74 HydrophobicContact CH2-CG 3.71Å; W30-P74 HydrophobicContact CZ2-CG 3.72Å; W30-P74 HydrophobicContact CZ3-CB 4.04Å; W30-P74 HydrophobicContact CZ3-CG 3.82Å; W30-W138 AromaticContact CH2-CE2 4Å; W30-W138 AromaticContact CH2-CZ2 3.73Å; W30-W138 HydrophobicContact CH2-CZ2 3.73Å; W30-W138 AromaticContact CH2-NE1 3.99Å; W30-W138 HydrophobicContact CZ3-CZ2 4.04Å
31	L	93	Very high	87.5	Confident	15 Å²	15	71.1 Å²	71.1	8%	0.079	38%	0.384	C	S	.	.	H	α-helix	trans	-62.7	-41.8	178.3	-173.5	66.5	0	0	0	111.8	V27 L28 I29 L34 L35 I71 P74 F75 L78	V27-L31 VanDerWaalsContact O-CB 3.31Å; V27-L31 WeakPolarHBondContact O-CB 3.46Å; V27-L31 PolarHBondContact O-N 3.05Å; L28-L31 PolarHBondContact O-N 3.02Å; I29-L31 PolarHBondContact O-N 3.49Å; L31-L34 PolarHBondContact O-N 3.16Å; L31-L35 HydrophobicContact CG-CD1 4.11Å; L31-L35 WeakPolarHBondContact O-CB 3.46Å; L31-L35 VanDerWaalsContact O-CG 3.25Å; L31-L35 WeakPolarHBondContact O-CG 3.27Å; L31-L35 PolarHBondContact O-N 3.28Å; L31-I71 HydrophobicContact CD1-CG2 3.95Å; L31-P74 HydrophobicContact CD1-CB 4.41Å; L31-F75 HydrophobicContact CD1-CB 4.3Å; L31-F75 HydrophobicContact CD2-CD2 4.01Å; L31-L78 HydrophobicContact CD2-CD2 4.07Å
32	I	92.4	Very high	85.7	Confident	95 Å²	95	70.8 Å²	70.8	49%	0.487	38%	0.378	S	S	.	.	H	α-helix	trans	-61.2	-45.8	176.5	-69.6	164.8	0	0	0	110.8	L28 I29 W30 L34 L35 I36	L28-I32 WeakPolarHBondContact O-CB 3.31Å; L28-I32 VanDerWaalsContact O-CG1 3.24Å; L28-I32 WeakPolarHBondContact O-CG1 3.02Å; L28-I32 PolarHBondContact O-N 3.4Å; I29-I32 PolarHBondContact O-N 2.94Å; W30-I32 PolarHBondContact O-N 3.23Å; I32-L34 VanDerWaalsContact C-N 3.35Å; I32-L34 PolarHBondContact O-N 3.23Å; I32-L35 PolarHBondContact O-N 2.89Å; I32-I36 HydrophobicContact CG2-CD1 3.78Å; I32-I36 HydrophobicContact CG2-CG1 4.43Å; I32-I36 WeakPolarHBondContact O-CG1 3.25Å; I32-I36 PolarHBondContact O-N 2.95Å
33	T	91.9	Very high	83.5	Confident	63 Å²	63	76.4 Å²	76.4	39%	0.387	39%	0.393	S	S	.	.	H	α-helix	trans	-59.9	-45.1	177.8	56	0	0	0	0	111.8	I29 W30 L35 I36 D37	I29-T33 WeakPolarHBondContact O-CG2 3.4Å; I29-T33 PolarHBondContact O-N 2.91Å; I29-T33 PolarHBondContact O-OG1 3.4Å; W30-T33 PolarHBondContact O-N 2.92Å; W30-T33 PolarHBondContact O-OG1 2.86Å; T33-L35 VanDerWaalsContact C-N 3.34Å; T33-L35 PolarHBondContact O-N 3.34Å; T33-I36 PolarHBondContact O-N 3.36Å; T33-D37 VanDerWaalsContact O-CG 3.32Å; T33-D37 PolarHBondContact O-N 3.12Å
34	L	89.6	Confident	81.2	Confident	25 Å²	25	78.8 Å²	78.8	13%	0.131	42%	0.418	C	S	.	.	H	α-helix	trans	-62.4	-40.6	176.4	-73.1	170.6	0	0	0	112.2	W30 L31 I32 D37 N38 K70 I71 P74	W30-L34 HydrophobicContact CG-CD1 4.41Å; W30-L34 WeakPolarHBondContact O-CG 3.26Å; W30-L34 PolarHBondContact O-N 2.89Å; L31-L34 PolarHBondContact O-N 3.16Å; I32-L34 VanDerWaalsContact C-N 3.35Å; I32-L34 PolarHBondContact O-N 3.23Å; L34-D37 PolarHBondContact O-N 3.34Å; L34-N38 WeakPolarHBondContact O-CB 3.26Å; L34-N38 PolarHBondContact O-N 3.45Å; L34-N38 PolarHBondContact O-ND2 3.42Å; L34-K70 WeakPolarHBondContact CD1-O 3.32Å; L34-I71 HydrophobicContact CB-CG1 4.42Å; L34-P74 HydrophobicContact CD1-CG 3.83Å
35	L	87.6	Confident	78.9	Confident	73 Å²	73	85.4 Å²	85.4	38%	0.382	44%	0.442	S	S	.	.	H	α-helix	trans	-65.8	-38.2	177.8	-72.6	170.7	0	0	0	111.9	L31 I32 T33 N38 A39 I71	L31-L35 HydrophobicContact CG-CD1 4.11Å; L31-L35 WeakPolarHBondContact O-CB 3.46Å; L31-L35 VanDerWaalsContact O-CG 3.25Å; L31-L35 WeakPolarHBondContact O-CG 3.27Å; L31-L35 PolarHBondContact O-N 3.28Å; I32-L35 PolarHBondContact O-N 2.89Å; T33-L35 VanDerWaalsContact C-N 3.34Å; T33-L35 PolarHBondContact O-N 3.34Å; L35-N38 CarbonylContact O-C 3.21Å; L35-A39 WeakPolarHBondContact O-CA 3.26Å; L35-A39 WeakPolarHBondContact O-CB 3.31Å; L35-A39 PolarHBondContact O-N 3.43Å; L35-I71 HydrophobicContact CD2-CD1 4.33Å; L35-I71 HydrophobicContact CD2-CG2 4.2Å
36	I	87.7	Confident	76.9	Confident	106 Å²	106	88.9 Å²	88.9	54%	0.544	46%	0.462	S	S	.	.	H	α-helix	trans	-65.6	-47.6	175.4	-68.1	166.9	0	0	0	110.6	I32 T33 N38 A39	I32-I36 HydrophobicContact CG2-CD1 3.78Å; I32-I36 HydrophobicContact CG2-CG1 4.43Å; I32-I36 WeakPolarHBondContact O-CG1 3.25Å; I32-I36 PolarHBondContact O-N 2.95Å; T33-I36 PolarHBondContact O-N 3.36Å; I36-N38 PolarHBondContact O-N 3.33Å; I36-A39 WeakPolarHBondContact O-CB 3.5Å; I36-A39 PolarHBondContact O-N 2.89Å
37	D	84.2	Confident	74.8	Confident	115 Å²	115	86 Å²	86	62%	0.615	46%	0.457	S	S	*	.	H	α-helix	trans	-63	-33.8	-179.3	-69.2	-18.1	0	0	0	112	T33 L34	T33-D37 VanDerWaalsContact O-CG 3.32Å; T33-D37 PolarHBondContact O-N 3.12Å; L34-D37 PolarHBondContact O-N 3.34Å
38	N	79.2	Confident	72.7	Confident	51 Å²	51	93.5 Å²	93.5	27%	0.273	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-3.8	176.1	-68.9	-91.8	0	0	0	112.8	L34 L35 I36 H40 G41 I42 I71	L34-N38 WeakPolarHBondContact O-CB 3.26Å; L34-N38 PolarHBondContact O-N 3.45Å; L34-N38 PolarHBondContact O-ND2 3.42Å; L35-N38 CarbonylContact O-C 3.21Å; I36-N38 PolarHBondContact O-N 3.33Å; N38-H40 PolarHBondContact O-N 2.97Å; N38-G41 PolarHBondContact O-N 3.48Å; N38-I42 HydrophobicContact CB-CD1 4.48Å; N38-I42 WeakPolarHBondContact O-CG1 3.41Å; N38-I42 PolarHBondContact O-N 3.02Å; N38-I42 VanDerWaalsContact O-N 3.11Å; N38-I71 HydrophobicContact CB-CD1 4.15Å
39	A	71.5	Confident	70.5	Confident	42 Å²	42	92.5 Å²	92.5	35%	0.347	50%	0.503	S	S	.	.	H	α-helix	trans	-64	-28.6	-177.6	0	0	0	0	0	112.3	L35 I36 G41 I42 R43	L35-A39 WeakPolarHBondContact O-CA 3.26Å; L35-A39 WeakPolarHBondContact O-CB 3.31Å; L35-A39 PolarHBondContact O-N 3.43Å; I36-A39 WeakPolarHBondContact O-CB 3.5Å; I36-A39 PolarHBondContact O-N 2.89Å; A39-G41 VanDerWaalsContact C-N 3.26Å; A39-G41 PolarHBondContact O-N 3.28Å; A39-I42 PolarHBondContact O-N 3.43Å; A39-R43 VanDerWaalsContact O-CB 3.31Å; A39-R43 WeakPolarHBondContact O-CB 3.42Å; A39-R43 PolarHBondContact O-N 3.45Å
40	H	59	Low	68.6	Low	168 Å²	168	91 Å²	91	78%	0.778	50%	0.5	S	S	*	.	H	α-helix	trans	-64.1	-30.3	173.5	-71.7	-70.8	0	0	0	112.9	N38	N38-H40 PolarHBondContact O-N 2.97Å
41	G	54.8	Low	66.4	Low	50 Å²	50	93.5 Å²	93.5	52%	0.515	52%	0.518	S	S	.	.	H	α-helix	trans	-79	-34.5	170.7	0	0	0	0	0	113	N38 A39	N38-G41 PolarHBondContact O-N 3.48Å; A39-G41 VanDerWaalsContact C-N 3.26Å; A39-G41 PolarHBondContact O-N 3.28Å
42	I	51.6	Low	64.4	Low	96 Å²	96	103.8 Å²	103.8	49%	0.492	56%	0.556	S	S	.	*	H	α-helix	trans	-75.5	-30.6	-179.4	-62.2	167.5	0	0	0	111.7	N38 A39 S44 Y45	N38-I42 HydrophobicContact CB-CD1 4.48Å; N38-I42 WeakPolarHBondContact O-CG1 3.41Å; N38-I42 PolarHBondContact O-N 3.02Å; N38-I42 VanDerWaalsContact O-N 3.11Å; A39-I42 PolarHBondContact O-N 3.43Å; I42-S44 PolarHBondContact O-N 2.98Å; I42-Y45 PolarHBondContact O-N 3.14Å
43	R	47.4	Very low	62.1	Low	200 Å²	200	106.1 Å²	106.1	76%	0.755	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-68.7	-14.9	179.7	-152.8	175.6	-152.7	-169.6	6.2	113.7	A39 Y45 S46	A39-R43 VanDerWaalsContact O-CB 3.31Å; A39-R43 WeakPolarHBondContact O-CB 3.42Å; A39-R43 PolarHBondContact O-N 3.45Å; R43-Y45 PolarHBondContact O-N 3.41Å; R43-S46 VanDerWaalsContact O-CB 3.26Å; R43-S46 WeakPolarHBondContact O-CB 3.31Å; R43-S46 PolarHBondContact O-N 2.93Å; R43-S46 PolarHBondContact O-OG 3.31Å
44	S	46	Very low	60	Low	104 Å²	104	111.3 Å²	111.3	73%	0.727	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-70.7	-11.9	170.6	-158.2	0	0	0	0	113	I42	I42-S44 PolarHBondContact O-N 2.98Å
45	Y	47.5	Very low	57.8	Low	174 Å²	174	121.3 Å²	121.3	68%	0.682	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-104.2	28.8	175.1	-63.8	-83.8	0	0	0	112.4	I42 R43 S47	I42-Y45 PolarHBondContact O-N 3.14Å; R43-Y45 PolarHBondContact O-N 3.41Å; Y45-S47 PolarHBondContact O-N 3.46Å
46	S	53.9	Low	55.7	Low	102 Å²	102	125.6 Å²	125.6	71%	0.713	64%	0.641	S	S	*	*			trans	-70.5	7.9	-171.5	63.8	0	0	0	0	116.6	R43	R43-S46 VanDerWaalsContact O-CB 3.26Å; R43-S46 WeakPolarHBondContact O-CB 3.31Å; R43-S46 PolarHBondContact O-N 2.93Å; R43-S46 PolarHBondContact O-OG 3.31Å
47	S	50.8	Low	54	Low	61 Å²	61	123.9 Å²	123.9	43%	0.427	64%	0.637	S	S	.	*			trans	-106.3	113.3	170.6	41.4	0	0	0	0	110	Y45 G49 T50	Y45-S47 PolarHBondContact O-N 3.46Å; S47-G49 PolarHBondContact O-N 3.47Å; S47-T50 PolarHBondContact O-N 3.34Å; S47-T50 PolarHBondContact O-OG1 3.45Å; S47-T50 PolarHBondContact OG-OG1 2.86Å
48	L	50.3	Low	52.1	Low	158 Å²	158	124.2 Å²	124.2	83%	0.827	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.3	-18.1	166.3	-76	161.7	0	0	0	112.5	I51	L48-I51 HydrophobicContact CD2-CD1 4.43Å
49	G	51.6	Low	50.6	Low	50 Å²	50	127.8 Å²	127.8	52%	0.515	67%	0.671	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.6	-14.5	173	0	0	0	0	0	116.8	S47 I51	S47-G49 PolarHBondContact O-N 3.47Å; G49-I51 VanDerWaalsContact C-N 3.28Å
50	T	55.1	Low	49.2	Very low	85 Å²	85	133.8 Å²	133.8	52%	0.521	69%	0.692	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.8	-16.7	174.2	-40	0	0	0	0	111.7	S47 W52	S47-T50 PolarHBondContact O-N 3.34Å; S47-T50 PolarHBondContact O-OG1 3.45Å; S47-T50 PolarHBondContact OG-OG1 2.86Å; T50-W52 VanDerWaalsContact C-N 3.33Å; T50-W52 PolarHBondContact O-N 2.99Å
51	I	50.2	Low	48.2	Very low	131 Å²	131	133.4 Å²	133.4	67%	0.672	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-15.1	-178.3	-64	172.9	0	0	0	112.2	L48 G49	L48-I51 HydrophobicContact CD2-CD1 4.43Å; G49-I51 VanDerWaalsContact C-N 3.28Å
52	W	49.8	Very low	47.5	Very low	231 Å²	231	138.8 Å²	138.8	88%	0.875	70%	0.702	S	S	*	*	S	Bend	trans	-122.7	-1.8	-170.7	-161.6	-103.6	0	0	0	116	T50	T50-W52 VanDerWaalsContact C-N 3.33Å; T50-W52 PolarHBondContact O-N 2.99Å
53	N	45.2	Very low	46.6	Very low	144 Å²	144	138.4 Å²	138.4	77%	0.77	71%	0.708	S	S	*	*			trans	-103.2	36.6	-170.2	-110.2	-3.5	0	0	0	115.8	R55	N53-R55 VanDerWaalsContact C-N 3.35Å; N53-R55 PolarHBondContact O-N 3.3Å
54	W	47.3	Very low	46.4	Very low	172 Å²	172	132 Å²	132	65%	0.652	69%	0.694	S	S	*	*			trans	-86.5	16.3	-174	-144.4	81.2	0	0	0	115.4	N56 P57	W54-N56 PolarHBondContact O-N 2.89Å; W54-P57 HydrophobicContact CZ3-CG 4.19Å
55	R	44.2	Very low	46.6	Very low	235 Å²	235	134.7 Å²	134.7	89%	0.887	70%	0.699	S	S	*	*			trans	-92	31.5	-170.9	-158.2	-176.6	-83.6	-147	-4.8	114.7	N53	N53-R55 VanDerWaalsContact C-N 3.35Å; N53-R55 PolarHBondContact O-N 3.3Å
56	N	43.6	Very low	47.1	Very low	162 Å²	162	132.2 Å²	132.2	87%	0.866	70%	0.701	S	S	*	*			trans	-159.1	80.2	164.3	-108.7	-15.6	0	0	0	110.9	W54	W54-N56 PolarHBondContact O-N 2.89Å
57	P	50	Low	47.7	Very low	71 Å²	71	131.1 Å²	131.1	46%	0.461	69%	0.69	S	S	.	*			trans	-91.7	107	159.9	31.7	-19	0	0	0	105.6	W54 V59	W54-P57 HydrophobicContact CZ3-CG 4.19Å; P57-V59 PolarHBondContact O-N 2.91Å
58	S	45.8	Very low	49.2	Very low	121 Å²	121	131.1 Å²	131.1	85%	0.846	69%	0.685	S	S	*	*			trans	-72.1	74.1	160.6	57.1	0	0	0	0	107.5
59	V	47.2	Very low	50.7	Low	126 Å²	126	129.3 Å²	129.3	76%	0.764	67%	0.673	S	S	*	*	S	Bend	trans	59.8	87	154.6	-171.2	0	0	0	0	115.6	P57	P57-V59 PolarHBondContact O-N 2.91Å
60	E	42.2	Very low	52.4	Low	169 Å²	169	133.2 Å²	133.2	79%	0.79	68%	0.676	S	S	*	*			trans	169.2	98.1	142.3	-98.5	172	177.9	0	0	108.8
61	Q	38.8	Very low	53.9	Low	160 Å²	160	130.2 Å²	130.2	75%	0.748	66%	0.656	S	S	*	*				97.2	103.1	91	-155.3	157.9	-0.8	0	0	111.7
62	Q	38.7	Very low	55.7	Low	162 Å²	162	125.3 Å²	125.3	76%	0.757	64%	0.635	S	S	*	*			trans	89.6	72.3	158.5	-140.4	151.1	7.3	0	0	119	S64	Q62-S64 VanDerWaalsContact C-N 3.27Å; Q62-S64 PolarHBondContact O-N 3.45Å; Q62-S64 VanDerWaalsContact O-N 3.07Å
63	S	33.2	Very low	57.7	Low	88 Å²	88	117 Å²	117	62%	0.615	61%	0.605	S	S	*	*			trans	-75	77.8	154.4	58.5	0	0	0	0	110.3
64	S	42.4	Very low	60	Low	67 Å²	67	110.1 Å²	110.1	47%	0.469	57%	0.569	S	S	.	*			trans	-96.4	126.8	154.7	52.1	0	0	0	0	107.1	Q62 V66	Q62-S64 VanDerWaalsContact C-N 3.27Å; Q62-S64 PolarHBondContact O-N 3.45Å; Q62-S64 VanDerWaalsContact O-N 3.07Å; S64-V66 PolarHBondContact O-N 3.4Å
65	I	51.5	Low	62.1	Low	160 Å²	160	107.2 Å²	107.2	82%	0.821	56%	0.56	S	S	*	*			trans	-64.4	96.1	162.6	-65.9	163.8	0	0	0	104.8	V67	I65-V67 VanDerWaalsContact C-N 3.26Å; I65-V67 HydrophobicContact CG2-CG2 3.95Å; I65-V67 PolarHBondContact O-N 2.94Å
66	V	57.1	Low	64.4	Low	121 Å²	121	96.6 Å²	96.6	73%	0.733	52%	0.522	S	S	*	.			trans	-74.2	89.7	174.3	-177.2	0	0	0	0	106.5	S64 N68	S64-V66 PolarHBondContact O-N 3.4Å; V66-N68 PolarHBondContact O-N 2.75Å
67	V	67.5	Low	66.9	Low	80 Å²	80	89.1 Å²	89.1	49%	0.485	48%	0.482	S	S	.	.			trans	-63.8	124.8	170.4	-177.3	0	0	0	0	107.2	I65 E69 I71 A72	I65-V67 VanDerWaalsContact C-N 3.26Å; I65-V67 HydrophobicContact CG2-CG2 3.95Å; I65-V67 PolarHBondContact O-N 2.94Å; V67-E69 PolarHBondContact O-N 3.28Å; V67-I71 HydrophobicContact CG1-CB 4.29Å; V67-I71 HydrophobicContact CG1-CG2 4.3Å; V67-A72 HydrophobicContact CB-CB 4.46Å; V67-A72 HydrophobicContact CG1-CB 4.01Å
68	N	81.7	Confident	69	Low	60 Å²	60	86.4 Å²	86.4	32%	0.321	46%	0.464	S	S	.	.			trans	-51.4	126.5	176.6	-177.1	-25.2	0	0	0	109.6	V66 K70 I71 A72	V66-N68 PolarHBondContact O-N 2.75Å; N68-K70 PolarHBondContact O-N 3.41Å; N68-K70 VanDerWaalsContact OD1-CB 3.29Å; N68-K70 WeakPolarHBondContact OD1-CB 3.5Å; N68-K70 WeakPolarHBondContact OD1-CG 3.46Å; N68-K70 PolarHBondContact OD1-N 3.29Å; N68-I71 HydrophobicContact CB-CD1 4.25Å; N68-I71 HydrophobicContact CB-CG1 4.34Å; N68-I71 WeakPolarHBondContact O-CA 3.38Å; N68-I71 WeakPolarHBondContact O-CB 3.44Å; N68-I71 PolarHBondContact O-N 3.1Å; N68-A72 PolarHBondContact O-N 2.91Å
69	E	82.5	Confident	71.4	Confident	120 Å²	120	84.1 Å²	84.1	56%	0.561	44%	0.441	S	S	*	.	H	α-helix	trans	-53.5	-30	-179.1	58.6	162.5	176.8	0	0	112.7	V67 I71 A72 K73	V67-E69 PolarHBondContact O-N 3.28Å; E69-I71 PolarHBondContact O-N 3.35Å; E69-A72 PolarHBondContact O-N 3.16Å; E69-K73 WeakPolarHBondContact O-CG 3.12Å; E69-K73 PolarHBondContact O-N 3.06Å; E69-K73 IonicContact OE2-NZ 3.68Å; E69-K73 PolarHBondContact OE2-NZ 3.1Å
70	K	85.6	Confident	73.7	Confident	132 Å²	132	78.1 Å²	78.1	57%	0.574	41%	0.405	S	S	*	.	H	α-helix	trans	-63.6	-30.5	176.5	-63.3	-177.3	180	-178.7	0	112.2	L34 N68 P74	L34-K70 WeakPolarHBondContact CD1-O 3.32Å; N68-K70 PolarHBondContact O-N 3.41Å; N68-K70 VanDerWaalsContact OD1-CB 3.29Å; N68-K70 WeakPolarHBondContact OD1-CB 3.5Å; N68-K70 WeakPolarHBondContact OD1-CG 3.46Å; N68-K70 PolarHBondContact OD1-N 3.29Å; K70-P74 WeakPolarHBondContact O-CD 3.43Å; K70-P74 VanDerWaalsContact O-CG 3.26Å; K70-P74 WeakPolarHBondContact O-CG 3.41Å
71	I	87.8	Confident	76.4	Confident	23 Å²	23	70.1 Å²	70.1	12%	0.118	37%	0.368	C	S	.	.	H	α-helix	trans	-91.9	-39.8	176.8	-60.1	174.7	0	0	0	110.2	L31 L34 L35 N38 V67 N68 E69 K73 P74 F75	L31-I71 HydrophobicContact CD1-CG2 3.95Å; L34-I71 HydrophobicContact CB-CG1 4.42Å; L35-I71 HydrophobicContact CD2-CD1 4.33Å; L35-I71 HydrophobicContact CD2-CG2 4.2Å; N38-I71 HydrophobicContact CB-CD1 4.15Å; V67-I71 HydrophobicContact CG1-CB 4.29Å; V67-I71 HydrophobicContact CG1-CG2 4.3Å; N68-I71 HydrophobicContact CB-CD1 4.25Å; N68-I71 HydrophobicContact CB-CG1 4.34Å; N68-I71 WeakPolarHBondContact O-CA 3.38Å; N68-I71 WeakPolarHBondContact O-CB 3.44Å; N68-I71 PolarHBondContact O-N 3.1Å; E69-I71 PolarHBondContact O-N 3.35Å; I71-K73 PolarHBondContact O-N 2.81Å; I71-P74 WeakPolarHBondContact O-CD 3.27Å; I71-F75 VanDerWaalsContact O-CB 3.26Å; I71-F75 WeakPolarHBondContact O-CB 3.34Å; I71-F75 PolarHBondContact O-N 3.4Å; I71-F75 VanDerWaalsContact O-N 3.12Å
72	A	88.2	Confident	79.2	Confident	27 Å²	27	66 Å²	66	22%	0.223	35%	0.351	C	S	.	.	H	α-helix	trans	-62	-43.9	-177.7	0	0	0	0	0	112.4	V67 N68 E69 F75 C76	V67-A72 HydrophobicContact CB-CB 4.46Å; V67-A72 HydrophobicContact CG1-CB 4.01Å; N68-A72 PolarHBondContact O-N 2.91Å; E69-A72 PolarHBondContact O-N 3.16Å; A72-F75 PolarHBondContact O-N 2.91Å; A72-C76 VanDerWaalsContact O-CB 3.31Å; A72-C76 WeakPolarHBondContact O-CB 3.32Å; A72-C76 PolarHBondContact O-N 2.94Å
73	K	91.7	Very high	81.9	Confident	56 Å²	56	61.3 Å²	61.3	24%	0.243	33%	0.328	C	S	.	.	H	α-helix	trans	-65.7	-49	-177.1	-61.9	173.9	-178.4	-173.2	0	113.2	E69 I71 F75 C76 L77 L137 W138	E69-K73 WeakPolarHBondContact O-CG 3.12Å; E69-K73 PolarHBondContact O-N 3.06Å; E69-K73 IonicContact OE2-NZ 3.68Å; E69-K73 PolarHBondContact OE2-NZ 3.1Å; I71-K73 PolarHBondContact O-N 2.81Å; K73-F75 VanDerWaalsContact C-N 3.32Å; K73-F75 PolarHBondContact O-N 3.35Å; K73-C76 WeakPolarHBondContact O-CB 3.49Å; K73-C76 PolarHBondContact O-N 3.05Å; K73-L77 PolarHBondContact O-N 2.84Å; K73-L137 HydrophobicContact CB-CD1 4.47Å; K73-L137 HydrophobicContact CD-CB 4.45Å; K73-L137 WeakPolarHBondContact CD-O 3.5Å; K73-L137 VanDerWaalsContact CE-O 3.31Å; K73-L137 WeakPolarHBondContact CE-O 3.45Å; K73-L137 HydrophobicContact CG-CB 4.47Å; K73-L137 PolarHBondContact NZ-O 3.19Å; K73-W138 HydrophobicContact CB-CH2 4.01Å; K73-W138 HydrophobicContact CB-CZ2 3.38Å
74	P	92.3	Very high	85	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.006	30%	0.298	C	S	.	.	H	α-helix	trans	-64.3	-34.7	174.1	-22.9	35	0	0	0	113.1	V27 W30 L31 L34 K70 I71 L77 L78 W138	V27-P74 HydrophobicContact CG1-CB 4.47Å; V27-P74 VanDerWaalsContact CG1-O 3.27Å; V27-P74 WeakPolarHBondContact CG1-O 3.45Å; W30-P74 HydrophobicContact CD2-CB 4.16Å; W30-P74 HydrophobicContact CD2-CG 4Å; W30-P74 HydrophobicContact CE3-CB 3.89Å; W30-P74 HydrophobicContact CE3-CG 3.96Å; W30-P74 HydrophobicContact CH2-CB 4.43Å; W30-P74 HydrophobicContact CH2-CG 3.71Å; W30-P74 HydrophobicContact CZ2-CG 3.72Å; W30-P74 HydrophobicContact CZ3-CB 4.04Å; W30-P74 HydrophobicContact CZ3-CG 3.82Å; L31-P74 HydrophobicContact CD1-CB 4.41Å; L34-P74 HydrophobicContact CD1-CG 3.83Å; K70-P74 WeakPolarHBondContact O-CD 3.43Å; K70-P74 VanDerWaalsContact O-CG 3.26Å; K70-P74 WeakPolarHBondContact O-CG 3.41Å; I71-P74 WeakPolarHBondContact O-CD 3.27Å; P74-L77 WeakPolarHBondContact O-CB 3.43Å; P74-L77 PolarHBondContact O-N 3.36Å; P74-L78 PolarHBondContact O-N 3.11Å; P74-W138 HydrophobicContact CG-CZ2 4.46Å
75	F	92	Very high	87.6	Confident	110 Å²	110	56.1 Å²	56.1	48%	0.482	29%	0.294	S	S	.	.	H	α-helix	trans	-63.1	-45.8	174.5	-176.8	-100	0	0	0	111.6	L31 I71 A72 K73 L77 L78 I79	L31-F75 HydrophobicContact CD1-CB 4.3Å; L31-F75 HydrophobicContact CD2-CD2 4.01Å; I71-F75 VanDerWaalsContact O-CB 3.26Å; I71-F75 WeakPolarHBondContact O-CB 3.34Å; I71-F75 PolarHBondContact O-N 3.4Å; I71-F75 VanDerWaalsContact O-N 3.12Å; A72-F75 PolarHBondContact O-N 2.91Å; K73-F75 VanDerWaalsContact C-N 3.32Å; K73-F75 PolarHBondContact O-N 3.35Å; F75-L77 VanDerWaalsContact C-N 3.32Å; F75-L77 PolarHBondContact O-N 3.49Å; F75-L78 WeakPolarHBondContact O-CB 3.48Å; F75-L78 PolarHBondContact O-N 2.91Å; F75-L78 VanDerWaalsContact O-N 3.14Å; F75-I79 HydrophobicContact CD1-CG1 4.26Å; F75-I79 HydrophobicContact CE1-CD1 4.33Å; F75-I79 HydrophobicContact CE1-CG1 3.88Å; F75-I79 HydrophobicContact CE2-CD1 4.5Å; F75-I79 HydrophobicContact CZ-CD1 4.03Å; F75-I79 HydrophobicContact CZ-CG1 4.08Å; F75-I79 WeakPolarHBondContact O-CG1 3.26Å; F75-I79 PolarHBondContact O-N 3.35Å
76	C	93	Very high	89.7	Confident	13 Å²	13	53.1 Å²	53.1	9%	0.088	28%	0.279	C	S	.	.	H	α-helix	trans	-56.6	-45.1	173.7	-179.6	0	0	0	0	111.6	A72 K73 L78 I79 A80 L137 I186	A72-C76 VanDerWaalsContact O-CB 3.31Å; A72-C76 WeakPolarHBondContact O-CB 3.32Å; A72-C76 PolarHBondContact O-N 2.94Å; K73-C76 WeakPolarHBondContact O-CB 3.49Å; K73-C76 PolarHBondContact O-N 3.05Å; C76-L78 VanDerWaalsContact C-N 3.35Å; C76-L78 PolarHBondContact O-N 3.01Å; C76-I79 PolarHBondContact O-N 3.41Å; C76-A80 WeakPolarHBondContact O-CB 3.48Å; C76-A80 PolarHBondContact O-N 3.17Å; C76-L137 HydrophobicContact CB-CD1 4.46Å; C76-I186 WeakPolarHBondContact SG-CG2 3.45Å
77	L	94.9	Very high	91.7	Very high	4 Å²	4	50.1 Å²	50.1	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-61.7	-39.2	175.5	-173	62.8	0	0	0	112.9	V27 K73 P74 F75 A80 L81 L130 L133 W138	V27-L77 HydrophobicContact CG2-CD2 3.66Å; V27-L77 HydrophobicContact CG2-CG 4.06Å; K73-L77 PolarHBondContact O-N 2.84Å; P74-L77 WeakPolarHBondContact O-CB 3.43Å; P74-L77 PolarHBondContact O-N 3.36Å; F75-L77 VanDerWaalsContact C-N 3.32Å; F75-L77 PolarHBondContact O-N 3.49Å; L77-A80 PolarHBondContact O-N 2.81Å; L77-L81 HydrophobicContact CG-CD1 4.31Å; L77-L81 WeakPolarHBondContact O-CB 3.35Å; L77-L81 VanDerWaalsContact O-CG 3.32Å; L77-L81 WeakPolarHBondContact O-CG 3.5Å; L77-L81 PolarHBondContact O-N 2.8Å; L77-L130 HydrophobicContact CD1-CD2 3.56Å; L77-L133 HydrophobicContact CD1-CD2 3.8Å; L77-L133 HydrophobicContact CD1-CG 4.45Å; L77-W138 HydrophobicContact CB-CH2 4.09Å; L77-W138 HydrophobicContact CD2-CH2 3.91Å; L77-W138 HydrophobicContact CD2-CZ3 4.32Å; L77-W138 HydrophobicContact CG-CH2 4.5Å
78	L	95.6	Very high	93	Very high	14 Å²	14	46.8 Å²	46.8	7%	0.073	24%	0.237	C	C	.	.	H	α-helix	trans	-63.8	-47.3	175.7	-179.3	62.2	0	0	0	111.4	I24 V27 L28 L31 P74 F75 C76 A80 L81 L82	I24-L78 HydrophobicContact CG2-CD1 4.24Å; V27-L78 HydrophobicContact CG1-CB 3.8Å; V27-L78 HydrophobicContact CG1-CD1 4.45Å; L28-L78 HydrophobicContact CD2-CD1 3.94Å; L28-L78 HydrophobicContact CD2-CD2 3.6Å; L28-L78 HydrophobicContact CD2-CG 4.44Å; L28-L78 HydrophobicContact CG-CD1 3.91Å; L28-L78 HydrophobicContact CG-CD2 4.43Å; L31-L78 HydrophobicContact CD2-CD2 4.07Å; P74-L78 PolarHBondContact O-N 3.11Å; F75-L78 WeakPolarHBondContact O-CB 3.48Å; F75-L78 PolarHBondContact O-N 2.91Å; F75-L78 VanDerWaalsContact O-N 3.14Å; C76-L78 VanDerWaalsContact C-N 3.35Å; C76-L78 PolarHBondContact O-N 3.01Å; L78-A80 VanDerWaalsContact C-N 3.3Å; L78-A80 PolarHBondContact O-N 3.2Å; L78-L81 PolarHBondContact O-N 2.9Å; L78-L82 HydrophobicContact CD1-CD1 4.36Å; L78-L82 HydrophobicContact CD1-CG 4.4Å; L78-L82 HydrophobicContact CG-CD1 4.19Å; L78-L82 WeakPolarHBondContact O-CG 3.19Å; L78-L82 PolarHBondContact O-N 3.02Å
79	I	94.8	Very high	93.7	Very high	73 Å²	73	44.9 Å²	44.9	37%	0.374	23%	0.232	S	C	.	.	H	α-helix	trans	-60.1	-44	177.2	-64.7	-59.2	0	0	0	110.4	F75 C76 L81 L82 F83 I186	F75-I79 HydrophobicContact CD1-CG1 4.26Å; F75-I79 HydrophobicContact CE1-CD1 4.33Å; F75-I79 HydrophobicContact CE1-CG1 3.88Å; F75-I79 HydrophobicContact CE2-CD1 4.5Å; F75-I79 HydrophobicContact CZ-CD1 4.03Å; F75-I79 HydrophobicContact CZ-CG1 4.08Å; F75-I79 WeakPolarHBondContact O-CG1 3.26Å; F75-I79 PolarHBondContact O-N 3.35Å; C76-I79 PolarHBondContact O-N 3.41Å; I79-L81 PolarHBondContact O-N 2.94Å; I79-L82 PolarHBondContact O-N 3.05Å; I79-F83 VanDerWaalsContact O-CB 3.26Å; I79-F83 WeakPolarHBondContact O-CB 3.45Å; I79-F83 PolarHBondContact O-N 3.26Å; I79-I186 HydrophobicContact CG2-CD1 4.14Å
80	A	96.8	Very high	94.4	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-59.6	-45.8	176.7	0	0	0	0	0	112.1	C76 L77 L78 L82 F83 D84 M129 L133 I186	C76-A80 WeakPolarHBondContact O-CB 3.48Å; C76-A80 PolarHBondContact O-N 3.17Å; L77-A80 PolarHBondContact O-N 2.81Å; L78-A80 VanDerWaalsContact C-N 3.3Å; L78-A80 PolarHBondContact O-N 3.2Å; A80-L82 PolarHBondContact O-N 3.26Å; A80-F83 PolarHBondContact O-N 2.98Å; A80-D84 PolarHBondContact O-N 3.06Å; A80-M129 HydrophobicContact CB-CE 4.18Å; A80-M129 HydrophobicContact CB-SD 3.65Å; A80-M129 VanDerWaalsContact O-SD 3.38Å; A80-L133 HydrophobicContact CB-CD2 3.52Å; A80-I186 HydrophobicContact CB-CD1 4.11Å; A80-I186 HydrophobicContact CB-CG1 3.88Å; A80-I186 HydrophobicContact CB-CG2 4.3Å
81	L	97.6	Very high	94.9	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-63.6	-39.8	177.9	-76.5	165.8	0	0	0	113.3	W23 I24 V27 L77 L78 I79 A85 R126 M129 L130	W23-L81 HydrophobicContact CB-CD1 3.85Å; W23-L81 HydrophobicContact CB-CD2 3.79Å; W23-L81 HydrophobicContact CG-CD2 4.48Å; I24-L81 HydrophobicContact CG1-CB 3.88Å; I24-L81 HydrophobicContact CG1-CD1 4.39Å; V27-L81 HydrophobicContact CB-CD1 4.46Å; V27-L81 HydrophobicContact CG2-CD1 3.91Å; L77-L81 HydrophobicContact CG-CD1 4.31Å; L77-L81 WeakPolarHBondContact O-CB 3.35Å; L77-L81 VanDerWaalsContact O-CG 3.32Å; L77-L81 WeakPolarHBondContact O-CG 3.5Å; L77-L81 PolarHBondContact O-N 2.8Å; L78-L81 PolarHBondContact O-N 2.9Å; I79-L81 PolarHBondContact O-N 2.94Å; L81-A85 PolarHBondContact O-N 2.99Å; L81-A85 VanDerWaalsContact O-N 3.15Å; L81-R126 HydrophobicContact CD2-CG 4.02Å; L81-M129 HydrophobicContact CD2-CE 3.94Å; L81-M129 HydrophobicContact CG-CE 4.24Å; L81-L130 HydrophobicContact CD2-CD2 4.12Å; L81-L130 HydrophobicContact CD2-CG 4.49Å
82	L	97.1	Very high	95.4	Very high	75 Å²	75	38.2 Å²	38.2	39%	0.393	21%	0.205	S	C	.	.	H	α-helix	trans	-68.5	-39.4	175.5	-67.5	174.4	0	0	0	111	I24 L78 I79 A80 A85 I86	I24-L82 HydrophobicContact CD1-CD2 4.19Å; L78-L82 HydrophobicContact CD1-CD1 4.36Å; L78-L82 HydrophobicContact CD1-CG 4.4Å; L78-L82 HydrophobicContact CG-CD1 4.19Å; L78-L82 WeakPolarHBondContact O-CG 3.19Å; L78-L82 PolarHBondContact O-N 3.02Å; I79-L82 PolarHBondContact O-N 3.05Å; A80-L82 PolarHBondContact O-N 3.26Å; L82-A85 PolarHBondContact O-N 2.77Å; L82-I86 VanDerWaalsContact O-CG1 3.28Å; L82-I86 WeakPolarHBondContact O-CG1 3.24Å; L82-I86 PolarHBondContact O-N 3.01Å
83	F	97.2	Very high	95.6	Very high	63 Å²	63	40.3 Å²	40.3	28%	0.276	22%	0.218	S	C	.	.	H	α-helix	trans	-63.4	-46.5	176.5	-171.8	-108.5	0	0	0	112	I79 A80 A85 I86 M87 E182 L185	I79-F83 VanDerWaalsContact O-CB 3.26Å; I79-F83 WeakPolarHBondContact O-CB 3.45Å; I79-F83 PolarHBondContact O-N 3.26Å; A80-F83 PolarHBondContact O-N 2.98Å; F83-A85 VanDerWaalsContact C-N 3.35Å; F83-A85 PolarHBondContact O-N 3.35Å; F83-I86 PolarHBondContact O-N 2.89Å; F83-M87 HydrophobicContact CD1-CG 4.19Å; F83-M87 HydrophobicContact CD2-CE 4.16Å; F83-M87 HydrophobicContact CD2-CG 4.44Å; F83-M87 HydrophobicContact CE1-CE 4.46Å; F83-M87 HydrophobicContact CE1-CG 3.88Å; F83-M87 HydrophobicContact CE2-CE 3.33Å; F83-M87 HydrophobicContact CE2-CG 4.16Å; F83-M87 HydrophobicContact CG-CG 4.46Å; F83-M87 HydrophobicContact CZ-CE 3.52Å; F83-M87 HydrophobicContact CZ-CG 3.87Å; F83-M87 HydrophobicContact CZ-SD 4.29Å; F83-M87 WeakPolarHBondContact O-CB 3.48Å; F83-M87 WeakPolarHBondContact O-CG 3.28Å; F83-M87 PolarHBondContact O-N 3.21Å; F83-E182 HydrophobicContact CD1-CB 4.37Å; F83-E182 HydrophobicContact CD1-CG 3.93Å; F83-E182 HydrophobicContact CE1-CG 3.91Å; F83-L185 HydrophobicContact CE1-CD1 4.28Å; F83-L185 HydrophobicContact CZ-CD1 4.44Å
84	D	98	Very high	95.9	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-54.7	-48.8	172.6	168.7	80.5	0	0	0	111.3	A80 I86 M87 V88 S125 R126 M129 E182	A80-D84 PolarHBondContact O-N 3.06Å; D84-I86 VanDerWaalsContact C-N 3.3Å; D84-I86 PolarHBondContact O-N 3.44Å; D84-M87 PolarHBondContact O-N 2.98Å; D84-V88 VanDerWaalsContact O-CB 3.29Å; D84-V88 WeakPolarHBondContact O-CB 3.15Å; D84-V88 VanDerWaalsContact O-CG2 3.25Å; D84-V88 WeakPolarHBondContact O-CG2 3.36Å; D84-V88 PolarHBondContact O-N 3.2Å; D84-S125 WeakPolarHBondContact OD1-CB 3.24Å; D84-S125 PolarHBondContact OD1-OG 3.13Å; D84-R126 PolarHBondContact OD1-N 3.02Å; D84-R126 IonicContact OD2-CZ 3.49Å; D84-R126 IonicContact OD2-NE 3.44Å; D84-R126 PolarHBondContact OD2-NE 2.98Å; D84-R126 IonicContact OD2-NH2 2.98Å; D84-R126 PolarHBondContact OD2-NH2 3.41Å; D84-M129 HydrophobicContact CB-CE 4.09Å; D84-M129 HydrophobicContact CB-SD 4.08Å; D84-E182 WeakPolarHBondContact CA-OE1 3.23Å; D84-E182 WeakPolarHBondContact CB-OE2 3.32Å
85	A	96	Very high	96	Very high	45 Å²	45	49.7 Å²	49.7	37%	0.372	26%	0.264	S	S	.	.	H	α-helix	trans	-60.2	-41	-179.7	0	0	0	0	0	112.3	L81 L82 F83 G89	L81-A85 PolarHBondContact O-N 2.99Å; L81-A85 VanDerWaalsContact O-N 3.15Å; L82-A85 PolarHBondContact O-N 2.77Å; F83-A85 VanDerWaalsContact C-N 3.35Å; F83-A85 PolarHBondContact O-N 3.35Å; A85-G89 PolarHBondContact O-N 3.09Å
86	I	96.7	Very high	96.1	Very high	98 Å²	98	49.2 Å²	49.2	50%	0.503	26%	0.263	S	S	.	.	H	α-helix	trans	-67.5	-50.7	176.9	-67.5	164.8	0	0	0	110.4	L82 F83 D84 G89 L90	L82-I86 VanDerWaalsContact O-CG1 3.28Å; L82-I86 WeakPolarHBondContact O-CG1 3.24Å; L82-I86 PolarHBondContact O-N 3.01Å; F83-I86 PolarHBondContact O-N 2.89Å; D84-I86 VanDerWaalsContact C-N 3.3Å; D84-I86 PolarHBondContact O-N 3.44Å; I86-G89 PolarHBondContact O-N 3.07Å; I86-L90 HydrophobicContact CG2-CD1 3.8Å; I86-L90 HydrophobicContact CG2-CG 4.28Å; I86-L90 WeakPolarHBondContact O-CB 3.4Å; I86-L90 VanDerWaalsContact O-CG 3.28Å; I86-L90 WeakPolarHBondContact O-CG 3.3Å; I86-L90 PolarHBondContact O-N 3.43Å
87	M	97.6	Very high	96.2	Very high	58 Å²	58	52.4 Å²	52.4	29%	0.286	27%	0.274	S	S	.	.	H	α-helix	trans	-63.4	-47.3	-177	-73.6	-59.8	151.7	0	0	112	F83 D84 G89 L90 I91 L178 E182	F83-M87 HydrophobicContact CD1-CG 4.19Å; F83-M87 HydrophobicContact CD2-CE 4.16Å; F83-M87 HydrophobicContact CD2-CG 4.44Å; F83-M87 HydrophobicContact CE1-CE 4.46Å; F83-M87 HydrophobicContact CE1-CG 3.88Å; F83-M87 HydrophobicContact CE2-CE 3.33Å; F83-M87 HydrophobicContact CE2-CG 4.16Å; F83-M87 HydrophobicContact CG-CG 4.46Å; F83-M87 HydrophobicContact CZ-CE 3.52Å; F83-M87 HydrophobicContact CZ-CG 3.87Å; F83-M87 HydrophobicContact CZ-SD 4.29Å; F83-M87 WeakPolarHBondContact O-CB 3.48Å; F83-M87 WeakPolarHBondContact O-CG 3.28Å; F83-M87 PolarHBondContact O-N 3.21Å; D84-M87 PolarHBondContact O-N 2.98Å; M87-G89 VanDerWaalsContact C-N 3.32Å; M87-G89 PolarHBondContact O-N 3.38Å; M87-L90 PolarHBondContact O-N 3.15Å; M87-I91 VanDerWaalsContact O-CG1 3.22Å; M87-I91 WeakPolarHBondContact O-CG1 3.3Å; M87-I91 PolarHBondContact O-N 3.34Å; M87-L178 HydrophobicContact CB-CD1 4.48Å; M87-E182 VanDerWaalsContact CB-OE1 3.32Å; M87-E182 WeakPolarHBondContact CB-OE1 3.5Å
88	V	96.8	Very high	96.1	Very high	10 Å²	10	58.5 Å²	58.5	6%	0.061	30%	0.302	C	S	.	.	H	α-helix	trans	-59.3	-44.9	174.7	172.4	0	0	0	0	110.6	D84 I91 K92 L178	D84-V88 VanDerWaalsContact O-CB 3.29Å; D84-V88 WeakPolarHBondContact O-CB 3.15Å; D84-V88 VanDerWaalsContact O-CG2 3.25Å; D84-V88 WeakPolarHBondContact O-CG2 3.36Å; D84-V88 PolarHBondContact O-N 3.2Å; V88-I91 PolarHBondContact O-N 2.86Å; V88-K92 HydrophobicContact CG1-CD 4.11Å; V88-K92 HydrophobicContact CG1-CG 4.35Å; V88-K92 VanDerWaalsContact O-CB 3.3Å; V88-K92 WeakPolarHBondContact O-CB 3.25Å; V88-K92 VanDerWaalsContact O-CG 3.31Å; V88-K92 WeakPolarHBondContact O-CG 3.29Å; V88-K92 PolarHBondContact O-N 3.21Å; V88-L178 HydrophobicContact CG2-CD2 3.87Å
89	G	95.5	Very high	96	Very high	20 Å²	20	58.8 Å²	58.8	21%	0.206	30%	0.302	C	S	.	.	H	α-helix	trans	-60.9	-45.4	178.2	0	0	0	0	0	113	A85 I86 M87 K92 S93	A85-G89 PolarHBondContact O-N 3.09Å; I86-G89 PolarHBondContact O-N 3.07Å; M87-G89 VanDerWaalsContact C-N 3.32Å; M87-G89 PolarHBondContact O-N 3.38Å; G89-K92 PolarHBondContact O-N 3.26Å; G89-S93 WeakPolarHBondContact O-CB 3.46Å; G89-S93 PolarHBondContact O-N 3.28Å
90	L	96.5	Very high	95.9	Very high	94 Å²	94	56.1 Å²	56.1	49%	0.492	29%	0.289	S	S	.	.	H	α-helix	trans	-62.8	-49.2	177.1	-71.9	174	0	0	0	111.5	I86 M87 K92 S93 I94	I86-L90 HydrophobicContact CG2-CD1 3.8Å; I86-L90 HydrophobicContact CG2-CG 4.28Å; I86-L90 WeakPolarHBondContact O-CB 3.4Å; I86-L90 VanDerWaalsContact O-CG 3.28Å; I86-L90 WeakPolarHBondContact O-CG 3.3Å; I86-L90 PolarHBondContact O-N 3.43Å; M87-L90 PolarHBondContact O-N 3.15Å; L90-K92 PolarHBondContact O-N 3.05Å; L90-S93 WeakPolarHBondContact O-CB 3.48Å; L90-S93 PolarHBondContact O-N 3.17Å; L90-S93 VanDerWaalsContact O-N 3.16Å; L90-I94 WeakPolarHBondContact O-CG1 3.31Å; L90-I94 PolarHBondContact O-N 3.32Å
91	I	97.3	Very high	95.5	Very high	39 Å²	39	66.1 Å²	66.1	20%	0.2	33%	0.333	C	S	.	.	H	α-helix	trans	-64.7	-41.6	-179.2	-60	164.5	0	0	0	110.2	M87 V88 S93 I94 F95 F119 P120 L178	M87-I91 VanDerWaalsContact O-CG1 3.22Å; M87-I91 WeakPolarHBondContact O-CG1 3.3Å; M87-I91 PolarHBondContact O-N 3.34Å; V88-I91 PolarHBondContact O-N 2.86Å; I91-S93 VanDerWaalsContact C-N 3.3Å; I91-S93 PolarHBondContact O-N 2.87Å; I91-I94 PolarHBondContact O-N 2.88Å; I91-I94 VanDerWaalsContact O-N 3.13Å; I91-F95 HydrophobicContact CG2-CD2 3.51Å; I91-F95 HydrophobicContact CG2-CE2 3.77Å; I91-F95 WeakPolarHBondContact O-CD2 3.28Å; I91-F95 PolarHBondContact O-N 2.86Å; I91-F119 HydrophobicContact CG2-CD1 3.91Å; I91-F119 HydrophobicContact CG2-CE1 3.77Å; I91-P120 HydrophobicContact CB-CG 4.27Å; I91-P120 HydrophobicContact CD1-CG 4.41Å; I91-P120 HydrophobicContact CG2-CG 4.12Å; I91-L178 HydrophobicContact CD1-CD1 4.12Å; I91-L178 HydrophobicContact CD1-CD2 3.74Å
92	K	96.8	Very high	94.7	Very high	2 Å²	2	72 Å²	72	1%	0.009	36%	0.364	C	S	.	.	H	α-helix	trans	-57.8	-42.5	173.4	-80.4	-172.3	180	-150.3	0	112.1	V88 G89 L90 I94 Q96 I114 D115 W117 F119 P120	V88-K92 HydrophobicContact CG1-CD 4.11Å; V88-K92 HydrophobicContact CG1-CG 4.35Å; V88-K92 VanDerWaalsContact O-CB 3.3Å; V88-K92 WeakPolarHBondContact O-CB 3.25Å; V88-K92 VanDerWaalsContact O-CG 3.31Å; V88-K92 WeakPolarHBondContact O-CG 3.29Å; V88-K92 PolarHBondContact O-N 3.21Å; G89-K92 PolarHBondContact O-N 3.26Å; L90-K92 PolarHBondContact O-N 3.05Å; K92-I94 VanDerWaalsContact C-N 3.29Å; K92-I94 PolarHBondContact O-N 3.12Å; K92-Q96 WeakPolarHBondContact O-CA 3.23Å; K92-Q96 PolarHBondContact O-N 3.25Å; K92-I114 WeakPolarHBondContact CD-O 3.42Å; K92-D115 IonicContact NZ-OD1 3.41Å; K92-D115 PolarHBondContact NZ-OD1 2.87Å; K92-W117 HydrophobicContact CB-CB 4.02Å; K92-W117 HydrophobicContact CD-CB 4.26Å; K92-W117 VanDerWaalsContact CE-O 3.27Å; K92-W117 WeakPolarHBondContact CE-O 3.38Å; K92-W117 HydrophobicContact CG-CB 4.11Å; K92-W117 PolarHBondContact NZ-O 3.04Å; K92-F119 WeakPolarHBondContact CA-O 3.37Å; K92-F119 VanDerWaalsContact CG-O 3.28Å; K92-F119 WeakPolarHBondContact CG-O 3.41Å; K92-P120 WeakPolarHBondContact CE-O 3.43Å
93	S	94.2	Very high	94.1	Very high	71 Å²	71	69.2 Å²	69.2	50%	0.497	35%	0.35	S	S	.	.	H	α-helix	trans	-66.6	-28.5	177.7	-171.1	0	0	0	0	113.5	G89 L90 I91 Q96	G89-S93 WeakPolarHBondContact O-CB 3.46Å; G89-S93 PolarHBondContact O-N 3.28Å; L90-S93 WeakPolarHBondContact O-CB 3.48Å; L90-S93 PolarHBondContact O-N 3.17Å; L90-S93 VanDerWaalsContact O-N 3.16Å; I91-S93 VanDerWaalsContact C-N 3.3Å; I91-S93 PolarHBondContact O-N 2.87Å; S93-Q96 WeakPolarHBondContact O-CG 3.38Å; S93-Q96 PolarHBondContact O-NE2 3.34Å
94	I	96.2	Very high	93.3	Very high	128 Å²	128	69.7 Å²	69.7	66%	0.656	36%	0.355	S	S	*	.	H	α-helix	trans	-80.8	-50.3	179	-67.9	163.7	0	0	0	111	L90 I91 K92	L90-I94 WeakPolarHBondContact O-CG1 3.31Å; L90-I94 PolarHBondContact O-N 3.32Å; I91-I94 PolarHBondContact O-N 2.88Å; I91-I94 VanDerWaalsContact O-N 3.13Å; K92-I94 VanDerWaalsContact C-N 3.29Å; K92-I94 PolarHBondContact O-N 3.12Å
95	F	95.5	Very high	92.2	Very high	126 Å²	126	74.8 Å²	74.8	55%	0.553	38%	0.382	S	S	*	.	H	α-helix	trans	-85.4	-31.5	-171.6	-77.5	-90.8	0	0	0	113.7	I91 R97 F119	I91-F95 HydrophobicContact CG2-CD2 3.51Å; I91-F95 HydrophobicContact CG2-CE2 3.77Å; I91-F95 WeakPolarHBondContact O-CD2 3.28Å; I91-F95 PolarHBondContact O-N 2.86Å; F95-R97 PolarHBondContact O-N 2.94Å; F95-F119 HydrophobicContact CB-CB 4.44Å; F95-F119 HydrophobicContact CB-CD1 3.79Å; F95-F119 HydrophobicContact CB-CG 4.48Å; F95-F119 HydrophobicContact CD1-CD1 4.03Å; F95-F119 HydrophobicContact CD1-CE1 4.09Å; F95-F119 AromaticContact CD2-CD1 3.72Å; F95-F119 HydrophobicContact CD2-CD1 3.72Å; F95-F119 AromaticContact CD2-CE1 3.72Å; F95-F119 HydrophobicContact CD2-CE1 3.72Å; F95-F119 HydrophobicContact CE1-CE1 4.17Å; F95-F119 HydrophobicContact CE2-CD1 4.29Å; F95-F119 AromaticContact CE2-CE1 3.81Å; F95-F119 HydrophobicContact CE2-CE1 3.81Å; F95-F119 AromaticContact CG-CD1 3.56Å; F95-F119 HydrophobicContact CG-CD1 3.56Å; F95-F119 AromaticContact CG-CE1 3.86Å; F95-F119 HydrophobicContact CG-CE1 3.86Å; F95-F119 HydrophobicContact CZ-CE1 4.02Å
96	Q	93.4	Very high	91.3	Very high	99 Å²	99	76.1 Å²	76.1	46%	0.463	39%	0.389	S	S	.	.			trans	45.7	42.7	176.1	-60.9	-172.9	17	0	0	113.6	K92 S93 Q98 W117	K92-Q96 WeakPolarHBondContact O-CA 3.23Å; K92-Q96 PolarHBondContact O-N 3.25Å; S93-Q96 WeakPolarHBondContact O-CG 3.38Å; S93-Q96 PolarHBondContact O-NE2 3.34Å; Q96-Q98 PolarHBondContact O-N 3.1Å; Q96-W117 VanDerWaalsContact C-CZ3 3.47Å; Q96-W117 VanDerWaalsContact CA-CD2 3.49Å; Q96-W117 VanDerWaalsContact CA-CE3 3.44Å; Q96-W117 HydrophobicContact CB-CD2 3.83Å; Q96-W117 HydrophobicContact CB-CE3 3.83Å; Q96-W117 HydrophobicContact CB-CH2 3.71Å; Q96-W117 HydrophobicContact CB-CZ2 3.74Å; Q96-W117 HydrophobicContact CB-CZ3 3.74Å; Q96-W117 HydrophobicContact CG-CD2 4.16Å; Q96-W117 HydrophobicContact CG-CH2 4.3Å; Q96-W117 HydrophobicContact CG-CZ2 3.83Å; Q96-W117 WeakPolarHBondContact O-CZ3 3.17Å
97	R	94.7	Very high	90.5	Very high	81 Å²	81	72.7 Å²	72.7	31%	0.306	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-75.5	129.6	-178.9	-170.8	-173.4	178.7	-178.1	7.5	110.3	F95 S118 F119 H168 D171	F95-R97 PolarHBondContact O-N 2.94Å; R97-S118 WeakPolarHBondContact O-CB 3.41Å; R97-S118 PolarHBondContact O-N 2.94Å; R97-F119 HydrophobicContact CB-CB 3.69Å; R97-F119 HydrophobicContact CG-CB 4.49Å; R97-H168 PolarHBondContact NE-CD2 3.23Å; R97-H168 PolarHBondContact NH2-CD2 2.95Å; R97-D171 WeakPolarHBondContact CD-OD1 3.29Å; R97-D171 IonicContact CZ-OD1 3.61Å; R97-D171 IonicContact NE-OD1 3.87Å; R97-D171 VanDerWaalsContact NH1-CG 3.34Å; R97-D171 IonicContact NH1-OD1 2.64Å; R97-D171 PolarHBondContact NH1-OD1 2.71Å; R97-D171 IonicContact NH1-OD2 3.52Å
98	Q	93.7	Very high	89.4	Confident	131 Å²	131	71.4 Å²	71.4	61%	0.612	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-62.3	144.9	173.3	-62.8	-63.3	-21.8	0	0	111.7	Q96 W117 S118 H168	Q96-Q98 PolarHBondContact O-N 3.1Å; Q98-W117 VanDerWaalsContact NE2-CZ3 3.27Å; Q98-S118 WeakPolarHBondContact O-CB 3.33Å; Q98-H168 PolarHBondContact O-NE2 3.02Å
99	R	93.4	Very high	87.9	Confident	21 Å²	21	78.8 Å²	78.8	8%	0.079	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-66.6	159.2	170.9	-68.5	-175.8	178.7	-149.4	0.1	110.2	N103 M108 D115 A116	R99-N103 HydrophobicContact CB-CB 4.42Å; R99-M108 VanDerWaalsContact CZ-SD 3.59Å; R99-M108 PolarHBondContact NH1-SD 3.48Å; R99-D115 PolarHBondContact NE-O 3.38Å; R99-D115 PolarHBondContact NH2-O 2.99Å; R99-D115 IonicContact NH2-OD1 3.69Å; R99-D115 IonicContact NH2-OD2 2.68Å; R99-D115 PolarHBondContact NH2-OD2 3.47Å; R99-A116 WeakPolarHBondContact CG-O 3.36Å; R99-A116 PolarHBondContact NE-O 3.46Å
100	P	92.9	Very high	86.3	Confident	16 Å²	16	82.9 Å²	82.9	10%	0.104	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-52.2	143.9	173.4	-25.6	32.5	0	0	0	112.7	D102 N103 H165	P100-D102 PolarHBondContact O-N 3.45Å; P100-D102 VanDerWaalsContact O-N 3.17Å; P100-N103 WeakPolarHBondContact O-CB 3.49Å; P100-N103 PolarHBondContact O-N 3.12Å; P100-H165 HydrophobicContact CB-CB 4.07Å; P100-H165 WeakPolarHBondContact CB-O 3.49Å; P100-H165 VanDerWaalsContact CD-O 3.29Å; P100-H165 WeakPolarHBondContact CD-O 3.44Å; P100-H165 VanDerWaalsContact CG-O 3.28Å; P100-H165 WeakPolarHBondContact CG-O 3.32Å
101	K	87.5	Confident	84.6	Confident	210 Å²	210	80.5 Å²	80.5	91%	0.913	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-29.2	-175.9	-66.9	-174.9	179.1	-178.1	0	114	N103	K101-N103 PolarHBondContact O-N 2.95Å
102	D	82.6	Confident	83	Confident	126 Å²	126	83.4 Å²	83.4	67%	0.674	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	12.5	-179.8	-57.3	-33.8	0	0	0	112.7	P100 N104 H165	P100-D102 PolarHBondContact O-N 3.45Å; P100-D102 VanDerWaalsContact O-N 3.17Å; D102-N104 PolarHBondContact O-N 3.15Å; D102-H165 HydrophobicContact CB-CB 4.32Å
103	N	83.1	Confident	81.5	Confident	16 Å²	16	87.9 Å²	87.9	9%	0.086	46%	0.461	C	S	.	.			trans	-63.3	127.1	173.4	178.8	57.3	0	0	0	110.2	R99 P100 K101 D105 M108 H165 R166	R99-N103 HydrophobicContact CB-CB 4.42Å; P100-N103 WeakPolarHBondContact O-CB 3.49Å; P100-N103 PolarHBondContact O-N 3.12Å; K101-N103 PolarHBondContact O-N 2.95Å; N103-D105 PolarHBondContact ND2-OD1 3.23Å; N103-D105 PolarHBondContact O-N 3Å; N103-M108 PolarHBondContact ND2-SD 2.71Å; N103-H165 WeakPolarHBondContact CB-O 3.28Å; N103-R166 WeakPolarHBondContact OD1-CD 3.18Å; N103-R166 PolarHBondContact OD1-NH1 3.4Å
104	N	80.5	Confident	79.8	Confident	72 Å²	72	89.1 Å²	89.1	39%	0.385	46%	0.46	S	S	.	.			trans	-81.5	97.7	172.5	-172.5	15	0	0	0	110.4	D102 S106 D107 R166	D102-N104 PolarHBondContact O-N 3.15Å; N104-S106 VanDerWaalsContact CG-OG 3.31Å; N104-S106 PolarHBondContact ND2-OG 3.07Å; N104-S106 PolarHBondContact O-N 3.36Å; N104-S106 PolarHBondContact OD1-N 3.13Å; N104-S106 PolarHBondContact OD1-OG 3.35Å; N104-D107 HydrophobicContact CB-CB 4.48Å; N104-D107 PolarHBondContact ND2-OD1 3Å; N104-D107 PolarHBondContact ND2-OD2 3.33Å; N104-D107 PolarHBondContact O-N 3.47Å; N104-D107 VanDerWaalsContact O-N 3.08Å; N104-R166 PolarHBondContact O-NH1 2.99Å
105	D	75.8	Confident	78.7	Confident	108 Å²	108	84.9 Å²	84.9	58%	0.578	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-60.8	-28.4	-178.8	-67.5	-23.7	0	0	0	112.7	N103 D107 M108	N103-D105 PolarHBondContact ND2-OD1 3.23Å; N103-D105 PolarHBondContact O-N 3Å; D105-D107 PolarHBondContact O-N 3.06Å; D105-D107 VanDerWaalsContact O-N 3.13Å; D105-M108 HydrophobicContact CB-CE 4.2Å; D105-M108 WeakPolarHBondContact O-CB 3.47Å; D105-M108 PolarHBondContact O-N 3.24Å; D105-M108 WeakPolarHBondContact OD1-CE 3.46Å
106	S	76.9	Confident	78	Confident	73 Å²	73	81.1 Å²	81.1	51%	0.51	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-62	-23.6	177.2	78.7	0	0	0	0	113.1	N104 M108 L109	N104-S106 VanDerWaalsContact CG-OG 3.31Å; N104-S106 PolarHBondContact ND2-OG 3.07Å; N104-S106 PolarHBondContact O-N 3.36Å; N104-S106 PolarHBondContact OD1-N 3.13Å; N104-S106 PolarHBondContact OD1-OG 3.35Å; S106-M108 VanDerWaalsContact C-N 3.29Å; S106-L109 WeakPolarHBondContact O-CG 3.34Å
107	D	78.9	Confident	78	Confident	26 Å²	26	79.3 Å²	79.3	14%	0.139	42%	0.42	C	S	.	.	G	3₁₀ helix	trans	-87.3	1.7	-179.2	-72.5	-15.7	0	0	0	111.7	R8 L12 N104 D105 M164 R166	R8-D107 VanDerWaalsContact NH1-CG 3.28Å; R8-D107 IonicContact NH1-OD1 2.89Å; R8-D107 PolarHBondContact NH1-OD1 3.04Å; R8-D107 IonicContact NH1-OD2 3.21Å; R8-D107 PolarHBondContact NH1-OD2 3.19Å; L12-D107 HydrophobicContact CD2-CB 4.12Å; N104-D107 HydrophobicContact CB-CB 4.48Å; N104-D107 PolarHBondContact ND2-OD1 3Å; N104-D107 PolarHBondContact ND2-OD2 3.33Å; N104-D107 PolarHBondContact O-N 3.47Å; N104-D107 VanDerWaalsContact O-N 3.08Å; D105-D107 PolarHBondContact O-N 3.06Å; D105-D107 VanDerWaalsContact O-N 3.13Å; D107-M164 HydrophobicContact CB-CE 4.48Å; D107-R166 PolarHBondContact O-NH2 2.89Å
108	M	76	Confident	77.9	Confident	31 Å²	31	75.5 Å²	75.5	15%	0.153	41%	0.406	C	S	.	.			trans	-99	40.3	-177.8	-61.1	-162.2	-48.5	0	0	113.3	R99 N103 D105 S106 L110 T111	R99-M108 VanDerWaalsContact CZ-SD 3.59Å; R99-M108 PolarHBondContact NH1-SD 3.48Å; N103-M108 PolarHBondContact ND2-SD 2.71Å; D105-M108 HydrophobicContact CB-CE 4.2Å; D105-M108 WeakPolarHBondContact O-CB 3.47Å; D105-M108 PolarHBondContact O-N 3.24Å; D105-M108 WeakPolarHBondContact OD1-CE 3.46Å; S106-M108 VanDerWaalsContact C-N 3.29Å; M108-L110 PolarHBondContact O-N 2.87Å; M108-T111 HydrophobicContact CB-CG2 3.69Å; M108-T111 HydrophobicContact CG-CG2 4.23Å; M108-T111 PolarHBondContact O-N 3.24Å; M108-T111 PolarHBondContact O-OG1 2.9Å; M108-T111 VanDerWaalsContact O-OG1 3.05Å; M108-T111 HydrophobicContact SD-CG2 4.32Å
109	L	63.9	Low	78.1	Confident	165 Å²	165	71 Å²	71	86%	0.864	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-14.4	-168.6	-64.1	173.6	0	0	0	115.3	S106	S106-L109 WeakPolarHBondContact O-CG 3.34Å
110	L	62.3	Low	78.3	Confident	106 Å²	106	70.2 Å²	70.2	56%	0.555	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.4	17.6	-178	-157.7	68.2	0	0	0	113.4	W16 M108 V112	W16-L110 HydrophobicContact CH2-CD2 4.01Å; W16-L110 HydrophobicContact CZ2-CD2 4.47Å; W16-L110 HydrophobicContact CZ3-CD2 4.49Å; M108-L110 PolarHBondContact O-N 2.87Å; L110-V112 PolarHBondContact O-N 3.48Å
111	T	61	Low	78.5	Confident	43 Å²	43	69.4 Å²	69.4	26%	0.264	38%	0.377	S	S	.	.			trans	-80.7	119.7	-179.4	56.1	0	0	0	0	111.1	M108 D115	M108-T111 HydrophobicContact CB-CG2 3.69Å; M108-T111 HydrophobicContact CG-CG2 4.23Å; M108-T111 PolarHBondContact O-N 3.24Å; M108-T111 PolarHBondContact O-OG1 2.9Å; M108-T111 VanDerWaalsContact O-OG1 3.05Å; M108-T111 HydrophobicContact SD-CG2 4.32Å; T111-D115 HydrophobicContact CG2-CB 4.43Å; T111-D115 VanDerWaalsContact CG2-OD2 3.3Å; T111-D115 WeakPolarHBondContact CG2-OD2 3.46Å
112	V	64.4	Low	78.9	Confident	100 Å²	100	59.6 Å²	59.6	61%	0.606	34%	0.335	S	S	*	.			trans	-66.5	153.4	163.9	-177.4	0	0	0	0	108.6	L110 I114 D115	L110-V112 PolarHBondContact O-N 3.48Å; V112-I114 PolarHBondContact O-N 3.4Å; V112-I114 VanDerWaalsContact O-N 3.09Å; V112-D115 WeakPolarHBondContact O-CA 3.38Å; V112-D115 VanDerWaalsContact O-CB 3.31Å; V112-D115 WeakPolarHBondContact O-CB 3.42Å; V112-D115 PolarHBondContact O-N 3.33Å
113	S	63.9	Low	79.5	Confident	97 Å²	97	54 Å²	54	68%	0.678	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-51.4	-36.3	-178.7	58	0	0	0	0	114.1	D115 A116	S113-D115 PolarHBondContact O-N 2.91Å; S113-A116 WeakPolarHBondContact O-CB 3.36Å; S113-A116 PolarHBondContact O-N 2.89Å; S113-A116 VanDerWaalsContact O-N 3.07Å
114	I	59.8	Low	80.2	Confident	96 Å²	96	53.3 Å²	53.3	49%	0.492	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-62.7	-32.1	175.2	-65.9	162.7	0	0	0	111.5	K92 V112 A116	K92-I114 WeakPolarHBondContact CD-O 3.42Å; V112-I114 PolarHBondContact O-N 3.4Å; V112-I114 VanDerWaalsContact O-N 3.09Å; I114-A116 PolarHBondContact O-N 3.24Å
115	D	73.2	Confident	81.1	Confident	39 Å²	39	49.9 Å²	49.9	21%	0.209	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-73.8	-10.5	177.5	-161.5	44.2	0	0	0	112.6	K92 R99 T111 V112 S113 W117	K92-D115 IonicContact NZ-OD1 3.41Å; K92-D115 PolarHBondContact NZ-OD1 2.87Å; R99-D115 PolarHBondContact NE-O 3.38Å; R99-D115 PolarHBondContact NH2-O 2.99Å; R99-D115 IonicContact NH2-OD1 3.69Å; R99-D115 IonicContact NH2-OD2 2.68Å; R99-D115 PolarHBondContact NH2-OD2 3.47Å; T111-D115 HydrophobicContact CG2-CB 4.43Å; T111-D115 VanDerWaalsContact CG2-OD2 3.3Å; T111-D115 WeakPolarHBondContact CG2-OD2 3.46Å; V112-D115 WeakPolarHBondContact O-CA 3.38Å; V112-D115 VanDerWaalsContact O-CB 3.31Å; V112-D115 WeakPolarHBondContact O-CB 3.42Å; V112-D115 PolarHBondContact O-N 3.33Å; S113-D115 PolarHBondContact O-N 2.91Å; D115-W117 PolarHBondContact O-N 2.8Å; D115-W117 VanDerWaalsContact O-N 3.11Å
116	A	80.9	Confident	82.1	Confident	47 Å²	47	45.9 Å²	45.9	39%	0.388	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-58.3	-28.1	176.7	0	0	0	0	0	113.1	R99 S113 I114	R99-A116 WeakPolarHBondContact CG-O 3.36Å; R99-A116 PolarHBondContact NE-O 3.46Å; S113-A116 WeakPolarHBondContact O-CB 3.36Å; S113-A116 PolarHBondContact O-N 2.89Å; S113-A116 VanDerWaalsContact O-N 3.07Å; I114-A116 PolarHBondContact O-N 3.24Å
117	W	91.9	Very high	83.1	Confident	62 Å²	62	42.4 Å²	42.4	24%	0.235	24%	0.236	C	C	.	.			trans	-79.9	146.3	179.9	-55.1	117.9	0	0	0	113.4	K92 Q96 Q98 D115	K92-W117 HydrophobicContact CB-CB 4.02Å; K92-W117 HydrophobicContact CD-CB 4.26Å; K92-W117 VanDerWaalsContact CE-O 3.27Å; K92-W117 WeakPolarHBondContact CE-O 3.38Å; K92-W117 HydrophobicContact CG-CB 4.11Å; K92-W117 PolarHBondContact NZ-O 3.04Å; Q96-W117 VanDerWaalsContact C-CZ3 3.47Å; Q96-W117 VanDerWaalsContact CA-CD2 3.49Å; Q96-W117 VanDerWaalsContact CA-CE3 3.44Å; Q96-W117 HydrophobicContact CB-CD2 3.83Å; Q96-W117 HydrophobicContact CB-CE3 3.83Å; Q96-W117 HydrophobicContact CB-CH2 3.71Å; Q96-W117 HydrophobicContact CB-CZ2 3.74Å; Q96-W117 HydrophobicContact CB-CZ3 3.74Å; Q96-W117 HydrophobicContact CG-CD2 4.16Å; Q96-W117 HydrophobicContact CG-CH2 4.3Å; Q96-W117 HydrophobicContact CG-CZ2 3.83Å; Q96-W117 WeakPolarHBondContact O-CZ3 3.17Å; Q98-W117 VanDerWaalsContact NE2-CZ3 3.27Å; D115-W117 PolarHBondContact O-N 2.8Å; D115-W117 VanDerWaalsContact O-N 3.11Å
118	S	94.2	Very high	84.1	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.229	C	C	.	.			trans	-88.6	-37.2	-173.8	-161.1	0	0	0	0	114	R97 Q98 P120 H167 D171	R97-S118 WeakPolarHBondContact O-CB 3.41Å; R97-S118 PolarHBondContact O-N 2.94Å; Q98-S118 WeakPolarHBondContact O-CB 3.33Å; S118-P120 CarbonylContact O-C 3.59Å; S118-H167 PolarHBondContact O-CE1 3.39Å; S118-H167 PolarHBondContact O-ND1 2.98Å; S118-H167 PolarHBondContact OG-ND1 3.18Å; S118-D171 WeakPolarHBondContact CB-OD2 3.43Å; S118-D171 WeakPolarHBondContact O-CB 3.17Å; S118-D171 PolarHBondContact OG-OD2 2.64Å
119	F	96.7	Very high	85.1	Confident	38 Å²	38	39.7 Å²	39.7	17%	0.167	22%	0.222	C	C	.	.	S	Bend	trans	-100.6	127.8	-173.2	-175.7	-88.5	0	0	0	111.8	I91 K92 F95 R97 D171 A174	I91-F119 HydrophobicContact CG2-CD1 3.91Å; I91-F119 HydrophobicContact CG2-CE1 3.77Å; K92-F119 WeakPolarHBondContact CA-O 3.37Å; K92-F119 VanDerWaalsContact CG-O 3.28Å; K92-F119 WeakPolarHBondContact CG-O 3.41Å; F95-F119 HydrophobicContact CB-CB 4.44Å; F95-F119 HydrophobicContact CB-CD1 3.79Å; F95-F119 HydrophobicContact CB-CG 4.48Å; F95-F119 HydrophobicContact CD1-CD1 4.03Å; F95-F119 HydrophobicContact CD1-CE1 4.09Å; F95-F119 AromaticContact CD2-CD1 3.72Å; F95-F119 HydrophobicContact CD2-CD1 3.72Å; F95-F119 AromaticContact CD2-CE1 3.72Å; F95-F119 HydrophobicContact CD2-CE1 3.72Å; F95-F119 HydrophobicContact CE1-CE1 4.17Å; F95-F119 HydrophobicContact CE2-CD1 4.29Å; F95-F119 AromaticContact CE2-CE1 3.81Å; F95-F119 HydrophobicContact CE2-CE1 3.81Å; F95-F119 AromaticContact CG-CD1 3.56Å; F95-F119 HydrophobicContact CG-CD1 3.56Å; F95-F119 AromaticContact CG-CE1 3.86Å; F95-F119 HydrophobicContact CG-CE1 3.86Å; F95-F119 HydrophobicContact CZ-CE1 4.02Å; R97-F119 HydrophobicContact CB-CB 3.69Å; R97-F119 HydrophobicContact CG-CB 4.49Å; F119-D171 WeakPolarHBondContact CB-OD1 3.28Å; F119-D171 HydrophobicContact CD2-CB 4.48Å; F119-D171 VanDerWaalsContact CD2-OD1 3.27Å; F119-D171 WeakPolarHBondContact CD2-OD1 3.45Å; F119-A174 HydrophobicContact CD2-CB 4.13Å; F119-A174 HydrophobicContact CE2-CB 3.27Å; F119-A174 HydrophobicContact CZ-CB 3.57Å
120	P	97.7	Very high	86.8	Confident	3 Å²	3	31.9 Å²	31.9	2%	0.019	18%	0.181	C	C	.	.	S	Bend	cis	-83.1	172.1	-10.4	35.7	-30.5	0	0	0	110.4	I91 K92 S118 G122 A174 L178	I91-P120 HydrophobicContact CB-CG 4.27Å; I91-P120 HydrophobicContact CD1-CG 4.41Å; I91-P120 HydrophobicContact CG2-CG 4.12Å; K92-P120 WeakPolarHBondContact CE-O 3.43Å; S118-P120 CarbonylContact O-C 3.59Å; P120-G122 PolarHBondContact O-N 3Å; P120-G122 VanDerWaalsContact O-N 3.14Å; P120-A174 HydrophobicContact CB-CB 4.11Å; P120-L178 HydrophobicContact CG-CD2 4.03Å
121	S	96.9	Very high	88.5	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.158	C	C	.	.			trans	-72.7	107.9	171.5	-174.1	0	0	0	0	110.9	H123 A124 S125 H167 D171	S121-H123 VanDerWaalsContact C-N 3.3Å; S121-H123 PolarHBondContact O-N 3.47Å; S121-A124 PolarHBondContact O-N 3.27Å; S121-S125 PolarHBondContact O-N 2.66Å; S121-H167 PolarHBondContact OG-CD2 3.39Å; S121-H167 VanDerWaalsContact OG-CD2 3.23Å; S121-H167 PolarHBondContact OG-NE2 2.95Å; S121-D171 WeakPolarHBondContact CB-O 3.49Å; S121-D171 PolarHBondContact N-O 3.18Å
122	G	96	Very high	90.2	Very high	4 Å²	4	27.8 Å²	27.8	4%	0.041	16%	0.155	C	C	.	.	H	α-helix	trans	-63.6	-32.5	177.3	0	0	0	0	0	113.7	P120 R126	P120-G122 PolarHBondContact O-N 3Å; P120-G122 VanDerWaalsContact O-N 3.14Å; G122-R126 VanDerWaalsContact O-CB 3.3Å; G122-R126 WeakPolarHBondContact O-CB 3.4Å; G122-R126 PolarHBondContact O-N 3.3Å
123	H	95.6	Very high	91.7	Very high	9 Å²	9	23 Å²	23	4%	0.042	13%	0.126	C	C	.	.	H	α-helix	trans	-63.4	-45	171.7	-77.3	76.1	0	0	0	111.6	E15 S121 S127 V157 R161	E15-H123 PolarHBondContact O-NE2 2.87Å; S121-H123 VanDerWaalsContact C-N 3.3Å; S121-H123 PolarHBondContact O-N 3.47Å; H123-S127 VanDerWaalsContact O-CB 3.3Å; H123-S127 WeakPolarHBondContact O-CB 3.44Å; H123-S127 PolarHBondContact O-N 3.47Å; H123-S127 PolarHBondContact O-OG 3.5Å; H123-V157 HydrophobicContact CB-CG1 4.05Å; H123-R161 HydrophobicContact CB-CG 3.82Å
124	A	98	Very high	93.3	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-67.5	-39.1	178.7	0	0	0	0	0	112.3	S121 T128 I172	S121-A124 PolarHBondContact O-N 3.27Å; A124-T128 WeakPolarHBondContact O-CB 3.34Å; A124-T128 PolarHBondContact O-N 3.49Å; A124-T128 PolarHBondContact O-OG1 2.92Å; A124-I172 HydrophobicContact CB-CG2 4.04Å
125	S	98.3	Very high	95	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-57.8	-60.2	173	-170	0	0	0	0	111.1	D84 S121 S127 T128 M129 G175 L178 G179 E182	D84-S125 WeakPolarHBondContact OD1-CB 3.24Å; D84-S125 PolarHBondContact OD1-OG 3.13Å; S121-S125 PolarHBondContact O-N 2.66Å; S125-S127 PolarHBondContact O-N 2.84Å; S125-T128 PolarHBondContact O-N 2.96Å; S125-T128 VanDerWaalsContact O-N 3.13Å; S125-M129 PolarHBondContact O-N 3.39Å; S125-G175 WeakPolarHBondContact CA-O 3.4Å; S125-G175 PolarHBondContact N-O 3.49Å; S125-L178 WeakPolarHBondContact OG-CG 3.31Å; S125-G179 WeakPolarHBondContact O-CA 3.35Å; S125-G179 PolarHBondContact OG-N 3.08Å; S125-E182 PolarHBondContact OG-OE2 2.96Å
126	R	98	Very high	96	Very high	25 Å²	25	18.3 Å²	18.3	9%	0.094	9%	0.092	C	C	.	.	H	α-helix	trans	-60.5	-48.9	-177.3	-170.8	177.2	-52.6	103.1	20.7	113.8	G18 G20 L81 D84 G122 T128 M129 L130	G18-R126 PolarHBondContact O-NH1 3.38Å; G20-R126 VanDerWaalsContact CA-CZ 3.49Å; G20-R126 VanDerWaalsContact N-NH1 3.13Å; L81-R126 HydrophobicContact CD2-CG 4.02Å; D84-R126 PolarHBondContact OD1-N 3.02Å; D84-R126 IonicContact OD2-CZ 3.49Å; D84-R126 IonicContact OD2-NE 3.44Å; D84-R126 PolarHBondContact OD2-NE 2.98Å; D84-R126 IonicContact OD2-NH2 2.98Å; D84-R126 PolarHBondContact OD2-NH2 3.41Å; G122-R126 VanDerWaalsContact O-CB 3.3Å; G122-R126 WeakPolarHBondContact O-CB 3.4Å; G122-R126 PolarHBondContact O-N 3.3Å; R126-T128 PolarHBondContact O-N 3.01Å; R126-M129 PolarHBondContact O-N 2.89Å; R126-L130 HydrophobicContact CG-CD1 3.87Å; R126-L130 HydrophobicContact CG-CG 4.28Å; R126-L130 VanDerWaalsContact O-CB 3.32Å; R126-L130 WeakPolarHBondContact O-CB 3.39Å; R126-L130 VanDerWaalsContact O-CG 3.23Å; R126-L130 WeakPolarHBondContact O-CG 3.29Å; R126-L130 PolarHBondContact O-N 3.42Å
127	S	98.1	Very high	96.5	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-63.4	-29.6	-178.9	66.6	0	0	0	0	111.4	H123 S125 F131 N154	H123-S127 VanDerWaalsContact O-CB 3.3Å; H123-S127 WeakPolarHBondContact O-CB 3.44Å; H123-S127 PolarHBondContact O-N 3.47Å; H123-S127 PolarHBondContact O-OG 3.5Å; S125-S127 PolarHBondContact O-N 2.84Å; S127-F131 WeakPolarHBondContact O-CB 3.33Å; S127-F131 PolarHBondContact O-N 2.84Å; S127-N154 PolarHBondContact O-ND2 3.23Å; S127-N154 PolarHBondContact OG-ND2 2.72Å
128	T	98.7	Very high	96.6	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-77.6	-46.8	179.1	-55.7	0	0	0	0	110.7	A124 S125 R126 L130 F131 F132 N154 Y176	A124-T128 WeakPolarHBondContact O-CB 3.34Å; A124-T128 PolarHBondContact O-N 3.49Å; A124-T128 PolarHBondContact O-OG1 2.92Å; S125-T128 PolarHBondContact O-N 2.96Å; S125-T128 VanDerWaalsContact O-N 3.13Å; R126-T128 PolarHBondContact O-N 3.01Å; T128-L130 VanDerWaalsContact C-N 3.33Å; T128-L130 PolarHBondContact O-N 3.26Å; T128-F131 PolarHBondContact O-N 3.01Å; T128-F132 HydrophobicContact CG2-CD2 3.82Å; T128-F132 HydrophobicContact CG2-CE2 3.66Å; T128-F132 VanDerWaalsContact O-CD2 3.29Å; T128-F132 WeakPolarHBondContact O-CD2 3.04Å; T128-F132 PolarHBondContact O-N 3.02Å; T128-F132 VanDerWaalsContact O-N 3.1Å; T128-N154 WeakPolarHBondContact CA-ND2 3.2Å; T128-N154 PolarHBondContact N-ND2 3.18Å; T128-N154 PolarHBondContact OG1-ND2 3.5Å; T128-Y176 HydrophobicContact CG2-CD1 4.13Å; T128-Y176 HydrophobicContact CG2-CD2 3.81Å; T128-Y176 HydrophobicContact CG2-CE1 4.1Å; T128-Y176 HydrophobicContact CG2-CE2 3.79Å; T128-Y176 HydrophobicContact CG2-CG 3.98Å; T128-Y176 WeakPolarHBondContact CG2-O 3.3Å; T128-Y176 WeakPolarHBondContact OG1-CD2 3.34Å
129	M	98.4	Very high	96.7	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-54.9	-49.1	172.2	-177.3	-164.8	62.7	0	0	111.1	A80 L81 D84 S125 R126 F131 F132 L133 G179 E182	A80-M129 HydrophobicContact CB-CE 4.18Å; A80-M129 HydrophobicContact CB-SD 3.65Å; A80-M129 VanDerWaalsContact O-SD 3.38Å; L81-M129 HydrophobicContact CD2-CE 3.94Å; L81-M129 HydrophobicContact CG-CE 4.24Å; D84-M129 HydrophobicContact CB-CE 4.09Å; D84-M129 HydrophobicContact CB-SD 4.08Å; S125-M129 PolarHBondContact O-N 3.39Å; R126-M129 PolarHBondContact O-N 2.89Å; M129-F131 PolarHBondContact O-N 3.18Å; M129-F132 PolarHBondContact O-N 3.07Å; M129-L133 WeakPolarHBondContact O-CB 3.35Å; M129-L133 PolarHBondContact O-N 3.43Å; M129-G179 WeakPolarHBondContact CA-O 3.13Å; M129-G179 WeakPolarHBondContact CB-O 3.47Å; M129-E182 HydrophobicContact CG-CB 4.29Å; M129-E182 HydrophobicContact SD-CB 4.26Å
130	L	98	Very high	96.4	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-62.1	-42.6	178.6	-72.9	174.8	0	0	0	112.4	W23 L77 L81 R126 T128 I134 W153	W23-L130 HydrophobicContact CD2-CD1 3.54Å; W23-L130 HydrophobicContact CD2-CD2 4.46Å; W23-L130 VanDerWaalsContact CE2-CD1 3.45Å; W23-L130 HydrophobicContact CE3-CD1 4.02Å; W23-L130 HydrophobicContact CE3-CD2 4.17Å; W23-L130 HydrophobicContact CG-CD1 3.89Å; W23-L130 HydrophobicContact CH2-CD1 4.3Å; W23-L130 HydrophobicContact CZ2-CD1 3.86Å; W23-L130 HydrophobicContact CZ3-CD1 4.37Å; W23-L130 HydrophobicContact CZ3-CD2 4.41Å; L77-L130 HydrophobicContact CD1-CD2 3.56Å; L81-L130 HydrophobicContact CD2-CD2 4.12Å; L81-L130 HydrophobicContact CD2-CG 4.49Å; R126-L130 HydrophobicContact CG-CD1 3.87Å; R126-L130 HydrophobicContact CG-CG 4.28Å; R126-L130 VanDerWaalsContact O-CB 3.32Å; R126-L130 WeakPolarHBondContact O-CB 3.39Å; R126-L130 VanDerWaalsContact O-CG 3.23Å; R126-L130 WeakPolarHBondContact O-CG 3.29Å; R126-L130 PolarHBondContact O-N 3.42Å; T128-L130 VanDerWaalsContact C-N 3.33Å; T128-L130 PolarHBondContact O-N 3.26Å; L130-I134 HydrophobicContact CB-CD1 4.3Å; L130-I134 HydrophobicContact CD2-CD1 4.27Å; L130-I134 WeakPolarHBondContact O-CB 3.35Å; L130-I134 VanDerWaalsContact O-CG1 3.24Å; L130-I134 WeakPolarHBondContact O-CG1 3.48Å; L130-I134 PolarHBondContact O-N 2.86Å; L130-W153 HydrophobicContact CB-CH2 4.48Å; L130-W153 HydrophobicContact CB-CZ3 4.23Å; L130-W153 HydrophobicContact CD1-CH2 3.92Å; L130-W153 HydrophobicContact CD1-CZ3 4.48Å
131	F	98.1	Very high	96	Very high	18 Å²	18	26.8 Å²	26.8	8%	0.079	14%	0.14	C	C	.	.	H	α-helix	trans	-56.5	-53.2	176.4	161.1	-116.5	0	0	0	111.4	S127 T128 M129 S135 I147 L150 L151 N154	S127-F131 WeakPolarHBondContact O-CB 3.33Å; S127-F131 PolarHBondContact O-N 2.84Å; T128-F131 PolarHBondContact O-N 3.01Å; M129-F131 PolarHBondContact O-N 3.18Å; F131-S135 WeakPolarHBondContact O-CB 3.38Å; F131-S135 PolarHBondContact O-N 3.41Å; F131-S135 VanDerWaalsContact O-N 3.17Å; F131-S135 PolarHBondContact O-OG 3.13Å; F131-I147 HydrophobicContact CE2-CG2 3.97Å; F131-I147 HydrophobicContact CZ-CG2 4.44Å; F131-L150 HydrophobicContact CD2-CB 3.78Å; F131-L150 HydrophobicContact CE2-CB 4.46Å; F131-L151 HydrophobicContact CD1-CD1 4.47Å; F131-L151 HydrophobicContact CD2-CB 4.21Å; F131-L151 HydrophobicContact CE1-CD1 3.96Å; F131-L151 HydrophobicContact CE2-CB 3.66Å; F131-L151 HydrophobicContact CE2-CD1 4.4Å; F131-L151 HydrophobicContact CZ-CB 3.95Å; F131-L151 HydrophobicContact CZ-CD1 3.92Å; F131-L151 HydrophobicContact CZ-CG 4.39Å; F131-N154 HydrophobicContact CB-CB 4.21Å
132	F	98	Very high	95.8	Very high	46 Å²	46	31.7 Å²	31.7	20%	0.202	18%	0.175	C	C	.	.	H	α-helix	trans	-69.2	-45.1	-178.4	-75.4	-71.4	0	0	0	112.3	T128 M129 S135 H136 Y180 Y183	T128-F132 HydrophobicContact CG2-CD2 3.82Å; T128-F132 HydrophobicContact CG2-CE2 3.66Å; T128-F132 VanDerWaalsContact O-CD2 3.29Å; T128-F132 WeakPolarHBondContact O-CD2 3.04Å; T128-F132 PolarHBondContact O-N 3.02Å; T128-F132 VanDerWaalsContact O-N 3.1Å; M129-F132 PolarHBondContact O-N 3.07Å; F132-S135 PolarHBondContact O-N 3.1Å; F132-H136 WeakPolarHBondContact O-CB 3.16Å; F132-H136 PolarHBondContact O-N 3.49Å; F132-Y180 HydrophobicContact CD1-CD2 4.41Å; F132-Y180 AromaticContact CD2-CD2 3.84Å; F132-Y180 HydrophobicContact CD2-CD2 3.84Å; F132-Y180 HydrophobicContact CE1-CD2 4.16Å; F132-Y180 HydrophobicContact CE1-CE2 4.18Å; F132-Y180 AromaticContact CE2-CD2 3.57Å; F132-Y180 HydrophobicContact CE2-CD2 3.57Å; F132-Y180 HydrophobicContact CE2-CE2 4.38Å; F132-Y180 HydrophobicContact CE2-CG 4.41Å; F132-Y180 HydrophobicContact CG-CD2 4.27Å; F132-Y180 AromaticContact CZ-CD2 3.74Å; F132-Y180 HydrophobicContact CZ-CD2 3.74Å; F132-Y180 HydrophobicContact CZ-CE2 4.12Å; F132-Y183 HydrophobicContact CB-CD1 3.56Å; F132-Y183 HydrophobicContact CB-CD2 3.57Å; F132-Y183 HydrophobicContact CB-CE1 3.9Å; F132-Y183 HydrophobicContact CB-CE2 3.9Å; F132-Y183 HydrophobicContact CB-CG 3.37Å; F132-Y183 HydrophobicContact CD1-CD1 4.46Å; F132-Y183 HydrophobicContact CD1-CE1 4.29Å; F132-Y183 HydrophobicContact CG-CD1 4Å; F132-Y183 HydrophobicContact CG-CE1 4.26Å; F132-Y183 HydrophobicContact CG-CG 4.27Å
133	L	96	Very high	95.7	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-68.8	-42.4	-175.7	-169.6	61.6	0	0	0	112.1	L77 A80 M129 H136 L137 Y183 I186 I187	L77-L133 HydrophobicContact CD1-CD2 3.8Å; L77-L133 HydrophobicContact CD1-CG 4.45Å; A80-L133 HydrophobicContact CB-CD2 3.52Å; M129-L133 WeakPolarHBondContact O-CB 3.35Å; M129-L133 PolarHBondContact O-N 3.43Å; L133-H136 PolarHBondContact O-N 3.25Å; L133-L137 HydrophobicContact CD1-CD1 3.71Å; L133-L137 HydrophobicContact CD1-CG 3.99Å; L133-L137 HydrophobicContact CG-CD1 3.8Å; L133-L137 HydrophobicContact CG-CG 4.35Å; L133-L137 WeakPolarHBondContact O-CB 3.11Å; L133-L137 WeakPolarHBondContact O-CG 3.5Å; L133-L137 PolarHBondContact O-N 2.89Å; L133-Y183 HydrophobicContact CB-CD2 4.07Å; L133-Y183 HydrophobicContact CD1-CD2 4.12Å; L133-I186 HydrophobicContact CD1-CG2 4.02Å; L133-I186 HydrophobicContact CD2-CG2 4.31Å; L133-I187 HydrophobicContact CD1-CD1 3.65Å; L133-I187 HydrophobicContact CD1-CG1 4.16Å
134	I	96.4	Very high	95.6	Very high	27 Å²	27	37.2 Å²	37.2	14%	0.138	21%	0.205	C	C	.	.	H	α-helix	trans	-66.3	-42.7	176.9	-66	171.6	0	0	0	110.4	W23 L130 H136 L137 W138 L150	W23-I134 HydrophobicContact CH2-CD1 4.17Å; W23-I134 HydrophobicContact CZ3-CD1 4.15Å; L130-I134 HydrophobicContact CB-CD1 4.3Å; L130-I134 HydrophobicContact CD2-CD1 4.27Å; L130-I134 WeakPolarHBondContact O-CB 3.35Å; L130-I134 VanDerWaalsContact O-CG1 3.24Å; L130-I134 WeakPolarHBondContact O-CG1 3.48Å; L130-I134 PolarHBondContact O-N 2.86Å; I134-H136 VanDerWaalsContact C-N 3.28Å; I134-H136 PolarHBondContact O-N 3.42Å; I134-L137 PolarHBondContact O-N 2.86Å; I134-W138 HydrophobicContact CB-CE3 4.27Å; I134-W138 HydrophobicContact CG1-CE3 4.33Å; I134-W138 HydrophobicContact CG1-CZ3 4.12Å; I134-W138 HydrophobicContact CG2-CE3 4.15Å; I134-W138 PolarHBondContact O-N 3.23Å; I134-W138 VanDerWaalsContact O-N 3.11Å; I134-L150 HydrophobicContact CB-CD1 4.13Å; I134-L150 HydrophobicContact CG2-CD1 3.71Å
135	S	96.3	Very high	95.6	Very high	19 Å²	19	44.7 Å²	44.7	13%	0.133	23%	0.233	C	C	.	.	H	α-helix	trans	-61	-38.8	177.2	-59.5	0	0	0	0	111.9	F131 F132 L139	F131-S135 WeakPolarHBondContact O-CB 3.38Å; F131-S135 PolarHBondContact O-N 3.41Å; F131-S135 VanDerWaalsContact O-N 3.17Å; F131-S135 PolarHBondContact O-OG 3.13Å; F132-S135 PolarHBondContact O-N 3.1Å; S135-L139 WeakPolarHBondContact O-CB 3.49Å; S135-L139 PolarHBondContact O-N 2.98Å
136	H	94	Very high	95.5	Very high	86 Å²	86	47.3 Å²	47.3	40%	0.398	25%	0.247	S	C	.	.	H	α-helix	trans	-72.2	-46.9	178.8	-168.5	119.5	0	0	0	112.8	F132 L133 I134 Y183 I187	F132-H136 WeakPolarHBondContact O-CB 3.16Å; F132-H136 PolarHBondContact O-N 3.49Å; L133-H136 PolarHBondContact O-N 3.25Å; I134-H136 VanDerWaalsContact C-N 3.28Å; I134-H136 PolarHBondContact O-N 3.42Å; H136-Y183 HydrophobicContact CB-CE2 3.78Å; H136-Y183 AromaticContact ND1-CE2 3.88Å; H136-Y183 AromaticContact ND1-CZ 3.8Å; H136-Y183 PolarHBondContact ND1-OH 2.9Å; H136-I187 HydrophobicContact CB-CD1 4.38Å
137	L	92.2	Very high	95.5	Very high	16 Å²	16	48 Å²	48	8%	0.084	25%	0.252	C	S	.	.	H	α-helix	trans	-81.9	-29.2	-169.5	-68	179.4	0	0	0	114.1	K73 C76 L133 I134 I187	K73-L137 HydrophobicContact CB-CD1 4.47Å; K73-L137 HydrophobicContact CD-CB 4.45Å; K73-L137 WeakPolarHBondContact CD-O 3.5Å; K73-L137 VanDerWaalsContact CE-O 3.31Å; K73-L137 WeakPolarHBondContact CE-O 3.45Å; K73-L137 HydrophobicContact CG-CB 4.47Å; K73-L137 PolarHBondContact NZ-O 3.19Å; C76-L137 HydrophobicContact CB-CD1 4.46Å; L133-L137 HydrophobicContact CD1-CD1 3.71Å; L133-L137 HydrophobicContact CD1-CG 3.99Å; L133-L137 HydrophobicContact CG-CD1 3.8Å; L133-L137 HydrophobicContact CG-CG 4.35Å; L133-L137 WeakPolarHBondContact O-CB 3.11Å; L133-L137 WeakPolarHBondContact O-CG 3.5Å; L133-L137 PolarHBondContact O-N 2.89Å; I134-L137 PolarHBondContact O-N 2.86Å; L137-I187 HydrophobicContact CD2-CD1 4.03Å; L137-I187 HydrophobicContact CG-CD1 4.48Å
138	W	94.1	Very high	95.4	Very high	85 Å²	85	52.7 Å²	52.7	32%	0.322	28%	0.276	S	S	.	.	H	α-helix	trans	-125.3	-22.5	-172.9	-68.3	-85.4	0	0	0	115.2	W30 K73 P74 L77 I134	W30-W138 AromaticContact CH2-CE2 4Å; W30-W138 AromaticContact CH2-CZ2 3.73Å; W30-W138 HydrophobicContact CH2-CZ2 3.73Å; W30-W138 AromaticContact CH2-NE1 3.99Å; W30-W138 HydrophobicContact CZ3-CZ2 4.04Å; K73-W138 HydrophobicContact CB-CH2 4.01Å; K73-W138 HydrophobicContact CB-CZ2 3.38Å; P74-W138 HydrophobicContact CG-CZ2 4.46Å; L77-W138 HydrophobicContact CB-CH2 4.09Å; L77-W138 HydrophobicContact CD2-CH2 3.91Å; L77-W138 HydrophobicContact CD2-CZ3 4.32Å; L77-W138 HydrophobicContact CG-CH2 4.5Å; I134-W138 HydrophobicContact CB-CE3 4.27Å; I134-W138 HydrophobicContact CG1-CE3 4.33Å; I134-W138 HydrophobicContact CG1-CZ3 4.12Å; I134-W138 HydrophobicContact CG2-CE3 4.15Å; I134-W138 PolarHBondContact O-N 3.23Å; I134-W138 VanDerWaalsContact O-N 3.11Å
139	L	94.7	Very high	95.4	Very high	33 Å²	33	57.3 Å²	57.3	17%	0.173	30%	0.301	C	S	.	.			trans	-100	152.6	-175.2	-53.2	-174.4	0	0	0	110.7	S135 T143 L146 I147 L150	S135-L139 WeakPolarHBondContact O-CB 3.49Å; S135-L139 PolarHBondContact O-N 2.98Å; L139-T143 WeakPolarHBondContact CB-OG1 3.27Å; L139-L146 HydrophobicContact CD1-CB 3.8Å; L139-L146 HydrophobicContact CD2-CB 4.14Å; L139-L146 HydrophobicContact CD2-CD1 3.85Å; L139-I147 HydrophobicContact CB-CD1 4.22Å; L139-I147 HydrophobicContact CB-CG1 3.93Å; L139-I147 HydrophobicContact CD1-CG1 3.6Å; L139-I147 HydrophobicContact CG-CG1 4.42Å; L139-L150 HydrophobicContact CD1-CD1 3.71Å
140	S	91.3	Very high	95.3	Very high	63 Å²	63	59 Å²	59	44%	0.441	31%	0.309	S	S	.	.			trans	-130.7	176.2	173	69.1	0	0	0	0	110	S142 T143	S140-S142 PolarHBondContact O-N 2.73Å; S140-S142 VanDerWaalsContact O-N 3.13Å; S140-S142 PolarHBondContact OG-OG 2.65Å; S140-T143 PolarHBondContact N-OG1 3.02Å; S140-T143 WeakPolarHBondContact O-CA 3.5Å; S140-T143 PolarHBondContact O-N 2.95Å; S140-T143 PolarHBondContact O-OG1 3.14Å
141	T	88.9	Confident	95.3	Very high	131 Å²	131	61.5 Å²	61.5	80%	0.804	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-56.7	-29.2	178.6	-46.4	0	0	0	0	112.8	T143 L144	T141-T143 PolarHBondContact O-N 3.5Å; T141-L144 PolarHBondContact O-N 3.35Å
142	S	92.6	Very high	95.3	Very high	104 Å²	104	66.9 Å²	66.9	73%	0.727	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-68.5	-18.5	176	65.1	0	0	0	0	113.4	S140	S140-S142 PolarHBondContact O-N 2.73Å; S140-S142 VanDerWaalsContact O-N 3.13Å; S140-S142 PolarHBondContact OG-OG 2.65Å
143	T	93.7	Very high	95.3	Very high	32 Å²	32	66.5 Å²	66.5	20%	0.196	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-106.7	30.5	178.3	52.3	0	0	0	0	112.5	L139 S140 T141 W145 L146 I147	L139-T143 WeakPolarHBondContact CB-OG1 3.27Å; S140-T143 PolarHBondContact N-OG1 3.02Å; S140-T143 WeakPolarHBondContact O-CA 3.5Å; S140-T143 PolarHBondContact O-N 2.95Å; S140-T143 PolarHBondContact O-OG1 3.14Å; T141-T143 PolarHBondContact O-N 3.5Å; T143-W145 PolarHBondContact O-N 3.3Å; T143-W145 VanDerWaalsContact O-N 3.12Å; T143-L146 HydrophobicContact CG2-CD1 4.24Å; T143-L146 WeakPolarHBondContact O-CB 3.12Å; T143-L146 PolarHBondContact O-N 3.39Å; T143-I147 PolarHBondContact O-N 3.41Å
144	L	94.8	Very high	95.4	Very high	97 Å²	97	66.5 Å²	66.5	51%	0.508	34%	0.343	S	S	.	.	H	α-helix	trans	-51.8	-37.9	-178.7	-179.4	62	0	0	0	113.1	T141 L146 I147 L148	T141-L144 PolarHBondContact O-N 3.35Å; L144-L146 VanDerWaalsContact C-N 3.29Å; L144-L146 PolarHBondContact O-N 3.22Å; L144-I147 WeakPolarHBondContact O-CB 3.33Å; L144-I147 PolarHBondContact O-N 2.73Å; L144-I147 VanDerWaalsContact O-N 3.15Å; L144-L148 HydrophobicContact CD1-CG 4.43Å; L144-L148 HydrophobicContact CG-CD1 4.28Å; L144-L148 HydrophobicContact CG-CG 4.4Å; L144-L148 WeakPolarHBondContact O-CG 3.47Å; L144-L148 PolarHBondContact O-N 3.45Å
145	W	96.7	Very high	95.5	Very high	157 Å²	157	69.4 Å²	69.4	60%	0.595	36%	0.359	S	S	*	.	H	α-helix	trans	-60.4	-36	177.7	67.6	-91.4	0	0	0	112.7	T143 L148 L149	T143-W145 PolarHBondContact O-N 3.3Å; T143-W145 VanDerWaalsContact O-N 3.12Å; W145-L148 PolarHBondContact O-N 3.03Å; W145-L149 HydrophobicContact CE3-CD1 3.59Å; W145-L149 HydrophobicContact CE3-CG 4.49Å; W145-L149 HydrophobicContact CZ3-CD1 3.63Å; W145-L149 WeakPolarHBondContact O-CG 3.45Å; W145-L149 PolarHBondContact O-N 3.47Å
146	L	97.2	Very high	95.5	Very high	55 Å²	55	70.9 Å²	70.9	29%	0.288	36%	0.364	S	S	.	.	H	α-helix	trans	-68.8	-40.1	174.7	-76.6	171	0	0	0	111.6	L139 T143 L144 L148 L149 L150	L139-L146 HydrophobicContact CD1-CB 3.8Å; L139-L146 HydrophobicContact CD2-CB 4.14Å; L139-L146 HydrophobicContact CD2-CD1 3.85Å; T143-L146 HydrophobicContact CG2-CD1 4.24Å; T143-L146 WeakPolarHBondContact O-CB 3.12Å; T143-L146 PolarHBondContact O-N 3.39Å; L144-L146 VanDerWaalsContact C-N 3.29Å; L144-L146 PolarHBondContact O-N 3.22Å; L146-L148 VanDerWaalsContact C-N 3.3Å; L146-L148 PolarHBondContact O-N 2.99Å; L146-L149 PolarHBondContact O-N 3.11Å; L146-L150 WeakPolarHBondContact O-CG 3.32Å; L146-L150 PolarHBondContact O-N 3.07Å
147	I	97.1	Very high	95.7	Very high	39 Å²	39	66.8 Å²	66.8	20%	0.2	35%	0.345	C	S	.	.	H	α-helix	trans	-60.7	-44.5	175.8	-60.6	174	0	0	0	109.7	F131 L139 T143 L144 L150 L151	F131-I147 HydrophobicContact CE2-CG2 3.97Å; F131-I147 HydrophobicContact CZ-CG2 4.44Å; L139-I147 HydrophobicContact CB-CD1 4.22Å; L139-I147 HydrophobicContact CB-CG1 3.93Å; L139-I147 HydrophobicContact CD1-CG1 3.6Å; L139-I147 HydrophobicContact CG-CG1 4.42Å; T143-I147 PolarHBondContact O-N 3.41Å; L144-I147 WeakPolarHBondContact O-CB 3.33Å; L144-I147 PolarHBondContact O-N 2.73Å; L144-I147 VanDerWaalsContact O-N 3.15Å; I147-L150 PolarHBondContact O-N 3.33Å; I147-L151 WeakPolarHBondContact O-CB 3.28Å; I147-L151 PolarHBondContact O-N 3.45Å
148	L	97.3	Very high	95.9	Very high	99 Å²	99	66.6 Å²	66.6	52%	0.518	35%	0.345	S	S	.	.	H	α-helix	trans	-65.4	-37.4	177.1	-66.5	177.2	0	0	0	112.5	L144 W145 L146 L151 F152	L144-L148 HydrophobicContact CD1-CG 4.43Å; L144-L148 HydrophobicContact CG-CD1 4.28Å; L144-L148 HydrophobicContact CG-CG 4.4Å; L144-L148 WeakPolarHBondContact O-CG 3.47Å; L144-L148 PolarHBondContact O-N 3.45Å; W145-L148 PolarHBondContact O-N 3.03Å; L146-L148 VanDerWaalsContact C-N 3.3Å; L146-L148 PolarHBondContact O-N 2.99Å; L148-L151 PolarHBondContact O-N 3.31Å; L148-F152 WeakPolarHBondContact O-CB 3.31Å; L148-F152 PolarHBondContact O-N 3.47Å
149	L	97.4	Very high	96	Very high	97 Å²	97	70 Å²	70	51%	0.508	36%	0.36	S	S	.	.	H	α-helix	trans	-65.6	-41.6	173.9	-74	177	0	0	0	112.2	W145 L146 F152 W153	W145-L149 HydrophobicContact CE3-CD1 3.59Å; W145-L149 HydrophobicContact CE3-CG 4.49Å; W145-L149 HydrophobicContact CZ3-CD1 3.63Å; W145-L149 WeakPolarHBondContact O-CG 3.45Å; W145-L149 PolarHBondContact O-N 3.47Å; L146-L149 PolarHBondContact O-N 3.11Å; L149-F152 PolarHBondContact O-N 3.39Å; L149-W153 WeakPolarHBondContact O-CB 3.34Å; L149-W153 PolarHBondContact O-N 3.48Å
150	L	97.2	Very high	96	Very high	35 Å²	35	68.5 Å²	68.5	18%	0.183	35%	0.352	C	S	.	.	H	α-helix	trans	-66.3	-40	175.8	-71.5	175.2	0	0	0	111.8	F131 I134 L139 L146 I147 W153 N154	F131-L150 HydrophobicContact CD2-CB 3.78Å; F131-L150 HydrophobicContact CE2-CB 4.46Å; I134-L150 HydrophobicContact CB-CD1 4.13Å; I134-L150 HydrophobicContact CG2-CD1 3.71Å; L139-L150 HydrophobicContact CD1-CD1 3.71Å; L146-L150 WeakPolarHBondContact O-CG 3.32Å; L146-L150 PolarHBondContact O-N 3.07Å; I147-L150 PolarHBondContact O-N 3.33Å; L150-W153 PolarHBondContact O-N 2.96Å; L150-N154 WeakPolarHBondContact O-CB 3.35Å; L150-N154 PolarHBondContact O-N 3.38Å
151	L	98	Very high	96.1	Very high	53 Å²	53	65.5 Å²	65.5	28%	0.277	33%	0.331	S	S	.	.	H	α-helix	trans	-62.1	-46.2	173.6	178	59.9	0	0	0	110.7	F131 I147 L148 W153 N154 L155	F131-L151 HydrophobicContact CD1-CD1 4.47Å; F131-L151 HydrophobicContact CD2-CB 4.21Å; F131-L151 HydrophobicContact CE1-CD1 3.96Å; F131-L151 HydrophobicContact CE2-CB 3.66Å; F131-L151 HydrophobicContact CE2-CD1 4.4Å; F131-L151 HydrophobicContact CZ-CB 3.95Å; F131-L151 HydrophobicContact CZ-CD1 3.92Å; F131-L151 HydrophobicContact CZ-CG 4.39Å; I147-L151 WeakPolarHBondContact O-CB 3.28Å; I147-L151 PolarHBondContact O-N 3.45Å; L148-L151 PolarHBondContact O-N 3.31Å; L151-W153 PolarHBondContact O-N 3.38Å; L151-N154 WeakPolarHBondContact O-CB 3.22Å; L151-N154 PolarHBondContact O-N 3.16Å; L151-L155 HydrophobicContact CD1-CD1 4.18Å; L151-L155 HydrophobicContact CD1-CG 4.2Å; L151-L155 HydrophobicContact CG-CD1 4.16Å; L151-L155 VanDerWaalsContact O-CG 3.32Å; L151-L155 WeakPolarHBondContact O-CG 3.3Å; L151-L155 PolarHBondContact O-N 2.9Å
152	F	98.1	Very high	96.4	Very high	130 Å²	130	65.1 Å²	65.1	57%	0.57	32%	0.315	S	S	*	.	H	α-helix	trans	-59.6	-47.8	176.5	-179.9	-106.8	0	0	0	111.2	L148 L149 N154 L155 I156	L148-F152 WeakPolarHBondContact O-CB 3.31Å; L148-F152 PolarHBondContact O-N 3.47Å; L149-F152 PolarHBondContact O-N 3.39Å; F152-N154 PolarHBondContact O-N 2.82Å; F152-L155 PolarHBondContact O-N 2.68Å; F152-I156 HydrophobicContact CD1-CD1 4.21Å; F152-I156 HydrophobicContact CD1-CG2 4.43Å; F152-I156 HydrophobicContact CD2-CG2 4.25Å; F152-I156 HydrophobicContact CE1-CD1 3.95Å; F152-I156 HydrophobicContact CE1-CG2 4.02Å; F152-I156 HydrophobicContact CE2-CG2 3.81Å; F152-I156 HydrophobicContact CZ-CG2 3.68Å; F152-I156 WeakPolarHBondContact O-CG1 3.35Å; F152-I156 WeakPolarHBondContact O-CG2 3.22Å; F152-I156 PolarHBondContact O-N 2.84Å
153	W	97.9	Very high	96.4	Very high	38 Å²	38	61.2 Å²	61.2	14%	0.144	29%	0.289	C	S	.	.	H	α-helix	trans	-56.5	-45.8	174.8	170.5	71	0	0	0	112.4	T17 W23 L130 L149 L150 L151 L155 I156 V157	T17-W153 PolarHBondContact OG1-NE1 3.08Å; W23-W153 AromaticContact CZ2-CH2 3.93Å; W23-W153 HydrophobicContact CZ2-CH2 3.93Å; W23-W153 HydrophobicContact CZ2-CZ2 4.18Å; L130-W153 HydrophobicContact CB-CH2 4.48Å; L130-W153 HydrophobicContact CB-CZ3 4.23Å; L130-W153 HydrophobicContact CD1-CH2 3.92Å; L130-W153 HydrophobicContact CD1-CZ3 4.48Å; L149-W153 WeakPolarHBondContact O-CB 3.34Å; L149-W153 PolarHBondContact O-N 3.48Å; L150-W153 PolarHBondContact O-N 2.96Å; L151-W153 PolarHBondContact O-N 3.38Å; W153-L155 PolarHBondContact O-N 3.31Å; W153-I156 WeakPolarHBondContact O-CG1 3.44Å; W153-I156 PolarHBondContact O-N 2.88Å; W153-V157 HydrophobicContact CD2-CG2 4.47Å; W153-V157 HydrophobicContact CZ2-CG2 4.29Å; W153-V157 VanDerWaalsContact O-CG2 3.31Å; W153-V157 WeakPolarHBondContact O-CG2 3.33Å; W153-V157 PolarHBondContact O-N 3.48Å
154	N	98	Very high	96.2	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-56.2	-50.9	175.4	170.1	-89.9	0	0	0	111.8	S127 T128 F131 L150 L151 F152 I156 V157 C158	S127-N154 PolarHBondContact O-ND2 3.23Å; S127-N154 PolarHBondContact OG-ND2 2.72Å; T128-N154 WeakPolarHBondContact CA-ND2 3.2Å; T128-N154 PolarHBondContact N-ND2 3.18Å; T128-N154 PolarHBondContact OG1-ND2 3.5Å; F131-N154 HydrophobicContact CB-CB 4.21Å; L150-N154 WeakPolarHBondContact O-CB 3.35Å; L150-N154 PolarHBondContact O-N 3.38Å; L151-N154 WeakPolarHBondContact O-CB 3.22Å; L151-N154 PolarHBondContact O-N 3.16Å; F152-N154 PolarHBondContact O-N 2.82Å; N154-I156 PolarHBondContact O-N 3.45Å; N154-V157 PolarHBondContact O-N 2.93Å; N154-C158 PolarHBondContact O-N 3.42Å; N154-C158 PolarHBondContact O-SG 2.98Å; N154-C158 VanDerWaalsContact O-SG 3.39Å
155	L	97.9	Very high	96.1	Very high	89 Å²	89	59.6 Å²	59.6	47%	0.466	28%	0.277	S	S	.	.	H	α-helix	trans	-65.5	-40.5	-176.5	-67.3	175.3	0	0	0	112.2	L151 F152 W153 C158 Y159	L151-L155 HydrophobicContact CD1-CD1 4.18Å; L151-L155 HydrophobicContact CD1-CG 4.2Å; L151-L155 HydrophobicContact CG-CD1 4.16Å; L151-L155 VanDerWaalsContact O-CG 3.32Å; L151-L155 WeakPolarHBondContact O-CG 3.3Å; L151-L155 PolarHBondContact O-N 2.9Å; F152-L155 PolarHBondContact O-N 2.68Å; W153-L155 PolarHBondContact O-N 3.31Å; L155-C158 PolarHBondContact O-N 3.04Å; L155-Y159 WeakPolarHBondContact O-CB 3.28Å; L155-Y159 PolarHBondContact O-N 2.87Å
156	I	97.1	Very high	95.8	Very high	49 Å²	49	52.2 Å²	52.2	25%	0.251	25%	0.249	S	C	.	.	H	α-helix	trans	-69.6	-34	177	65.4	-179	0	0	0	112	L14 F152 W153 N154 Y159 S160	L14-I156 HydrophobicContact CD1-CB 4.21Å; L14-I156 HydrophobicContact CD1-CD1 4.46Å; L14-I156 HydrophobicContact CD1-CG1 4.22Å; L14-I156 HydrophobicContact CD2-CD1 3.68Å; L14-I156 HydrophobicContact CD2-CG1 3.82Å; F152-I156 HydrophobicContact CD1-CD1 4.21Å; F152-I156 HydrophobicContact CD1-CG2 4.43Å; F152-I156 HydrophobicContact CD2-CG2 4.25Å; F152-I156 HydrophobicContact CE1-CD1 3.95Å; F152-I156 HydrophobicContact CE1-CG2 4.02Å; F152-I156 HydrophobicContact CE2-CG2 3.81Å; F152-I156 HydrophobicContact CZ-CG2 3.68Å; F152-I156 WeakPolarHBondContact O-CG1 3.35Å; F152-I156 WeakPolarHBondContact O-CG2 3.22Å; F152-I156 PolarHBondContact O-N 2.84Å; W153-I156 WeakPolarHBondContact O-CG1 3.44Å; W153-I156 PolarHBondContact O-N 2.88Å; N154-I156 PolarHBondContact O-N 3.45Å; I156-Y159 PolarHBondContact O-N 3.04Å; I156-S160 WeakPolarHBondContact O-CB 3.39Å; I156-S160 PolarHBondContact O-N 2.97Å
157	V	96.9	Very high	95.7	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.8	-49.7	172	167.9	0	0	0	0	109.9	L14 H123 W153 N154 Y159 S160 R161	L14-V157 HydrophobicContact CB-CG2 4.49Å; L14-V157 HydrophobicContact CD2-CG2 4.24Å; H123-V157 HydrophobicContact CB-CG1 4.05Å; W153-V157 HydrophobicContact CD2-CG2 4.47Å; W153-V157 HydrophobicContact CZ2-CG2 4.29Å; W153-V157 VanDerWaalsContact O-CG2 3.31Å; W153-V157 WeakPolarHBondContact O-CG2 3.33Å; W153-V157 PolarHBondContact O-N 3.48Å; N154-V157 PolarHBondContact O-N 2.93Å; V157-Y159 PolarHBondContact O-N 2.86Å; V157-S160 WeakPolarHBondContact O-CB 3.29Å; V157-S160 PolarHBondContact O-N 3.24Å; V157-S160 PolarHBondContact O-OG 3.44Å; V157-R161 WeakPolarHBondContact O-CG 3.45Å; V157-R161 PolarHBondContact O-N 3.33Å
158	C	97.1	Very high	95.7	Very high	12 Å²	12	50.7 Å²	50.7	8%	0.081	24%	0.239	C	C	.	.	H	α-helix	trans	-57.1	-47.7	175.9	-72.1	0	0	0	0	111.9	N154 L155 S160 R161 Y162 I172	N154-C158 PolarHBondContact O-N 3.42Å; N154-C158 PolarHBondContact O-SG 2.98Å; N154-C158 VanDerWaalsContact O-SG 3.39Å; L155-C158 PolarHBondContact O-N 3.04Å; C158-S160 VanDerWaalsContact C-N 3.33Å; C158-S160 PolarHBondContact O-N 3.44Å; C158-R161 WeakPolarHBondContact O-CB 3.36Å; C158-R161 PolarHBondContact O-N 3.46Å; C158-Y162 PolarHBondContact O-N 3.11Å; C158-I172 HydrophobicContact CB-CG2 3.87Å
159	Y	95.9	Very high	95.7	Very high	158 Å²	158	52 Å²	52	62%	0.62	24%	0.241	S	C	*	.	H	α-helix	trans	-61.4	-40.1	177.3	179.5	-101.6	0	0	0	112.2	L155 I156 V157 R161 Y162 A163	L155-Y159 WeakPolarHBondContact O-CB 3.28Å; L155-Y159 PolarHBondContact O-N 2.87Å; I156-Y159 PolarHBondContact O-N 3.04Å; V157-Y159 PolarHBondContact O-N 2.86Å; Y159-R161 VanDerWaalsContact C-N 3.25Å; Y159-R161 PolarHBondContact O-N 3.08Å; Y159-Y162 WeakPolarHBondContact O-CB 3.46Å; Y159-Y162 PolarHBondContact O-N 3.03Å; Y159-Y162 VanDerWaalsContact O-N 3.11Å; Y159-A163 HydrophobicContact CD1-CB 4.33Å; Y159-A163 HydrophobicContact CE1-CB 3.94Å; Y159-A163 WeakPolarHBondContact O-CB 3.47Å; Y159-A163 PolarHBondContact O-N 3.45Å
160	S	94.7	Very high	95.7	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.007	24%	0.24	C	C	.	.	H	α-helix	trans	-59.3	-37.2	178.2	78.6	0	0	0	0	112.2	I156 V157 C158 Y162 A163 M164	I156-S160 WeakPolarHBondContact O-CB 3.39Å; I156-S160 PolarHBondContact O-N 2.97Å; V157-S160 WeakPolarHBondContact O-CB 3.29Å; V157-S160 PolarHBondContact O-N 3.24Å; V157-S160 PolarHBondContact O-OG 3.44Å; C158-S160 VanDerWaalsContact C-N 3.33Å; C158-S160 PolarHBondContact O-N 3.44Å; S160-Y162 VanDerWaalsContact C-N 3.33Å; S160-Y162 PolarHBondContact O-N 2.96Å; S160-A163 PolarHBondContact O-N 3.3Å; S160-M164 VanDerWaalsContact O-CB 3.29Å; S160-M164 WeakPolarHBondContact O-CB 3.49Å; S160-M164 WeakPolarHBondContact O-CG 3.46Å; S160-M164 PolarHBondContact O-N 3.28Å
161	R	94.7	Very high	95.7	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-65.1	-37.6	177.4	-62.2	-37.1	-66.7	168.6	-9.1	112.2	E15 H123 V157 C158 Y159 R166 H167 I172	E15-R161 VanDerWaalsContact CD-NH1 3.26Å; E15-R161 IonicContact OE2-CZ 3.41Å; E15-R161 IonicContact OE2-NH1 3.5Å; E15-R161 PolarHBondContact OE2-NH1 3.41Å; E15-R161 IonicContact OE2-NH2 3.76Å; H123-R161 HydrophobicContact CB-CG 3.82Å; V157-R161 WeakPolarHBondContact O-CG 3.45Å; V157-R161 PolarHBondContact O-N 3.33Å; C158-R161 WeakPolarHBondContact O-CB 3.36Å; C158-R161 PolarHBondContact O-N 3.46Å; Y159-R161 VanDerWaalsContact C-N 3.25Å; Y159-R161 PolarHBondContact O-N 3.08Å; R161-R166 VanDerWaalsContact CZ-CB 3.48Å; R161-R166 VanDerWaalsContact CZ-CG 3.42Å; R161-R166 VanDerWaalsContact NH2-CG 3.31Å; R161-R166 WeakPolarHBondContact O-CB 3.46Å; R161-R166 PolarHBondContact O-N 2.86Å; R161-H167 HydrophobicContact CB-CB 4.38Å; R161-H167 PolarHBondContact NE-CD2 2.86Å; R161-H167 PolarHBondContact O-N 3.19Å; R161-I172 HydrophobicContact CB-CD1 4.09Å; R161-I172 HydrophobicContact CB-CG1 4.31Å
162	Y	94.5	Very high	95.7	Very high	123 Å²	123	48.3 Å²	48.3	48%	0.482	22%	0.221	S	C	.	.	H	α-helix	trans	-71.1	-51.2	174.7	-177.1	-108.7	0	0	0	111.3	C158 Y159 S160 M164 H165 F169 I172	C158-Y162 PolarHBondContact O-N 3.11Å; Y159-Y162 WeakPolarHBondContact O-CB 3.46Å; Y159-Y162 PolarHBondContact O-N 3.03Å; Y159-Y162 VanDerWaalsContact O-N 3.11Å; S160-Y162 VanDerWaalsContact C-N 3.33Å; S160-Y162 PolarHBondContact O-N 2.96Å; Y162-M164 VanDerWaalsContact C-N 3.29Å; Y162-M164 PolarHBondContact O-N 2.84Å; Y162-H165 WeakPolarHBondContact O-CA 3.36Å; Y162-H165 PolarHBondContact O-N 3.48Å; Y162-F169 HydrophobicContact CD2-CB 4.3Å; Y162-F169 HydrophobicContact CE2-CB 4.11Å; Y162-I172 HydrophobicContact CD2-CD1 4.43Å; Y162-I172 HydrophobicContact CG-CD1 4.45Å
163	A	92.4	Very high	95.7	Very high	22 Å²	22	45.7 Å²	45.7	18%	0.182	21%	0.213	C	C	.	.	H	α-helix	trans	-64	-31	-175.6	0	0	0	0	0	113.4	Y159 S160 H165	Y159-A163 HydrophobicContact CD1-CB 4.33Å; Y159-A163 HydrophobicContact CE1-CB 3.94Å; Y159-A163 WeakPolarHBondContact O-CB 3.47Å; Y159-A163 PolarHBondContact O-N 3.45Å; S160-A163 PolarHBondContact O-N 3.3Å; A163-H165 VanDerWaalsContact C-N 3.29Å
164	M	90.1	Very high	95.8	Very high	20 Å²	20	45 Å²	45	10%	0.099	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	3.3	173.4	-71.8	-173.3	75	0	0	113.7	S11 L12 D107 S160 Y162 R166	S11-M164 WeakPolarHBondContact CB-SD 3.4Å; L12-M164 HydrophobicContact CD2-CE 3.66Å; L12-M164 HydrophobicContact CG-CE 3.99Å; D107-M164 HydrophobicContact CB-CE 4.48Å; S160-M164 VanDerWaalsContact O-CB 3.29Å; S160-M164 WeakPolarHBondContact O-CB 3.49Å; S160-M164 WeakPolarHBondContact O-CG 3.46Å; S160-M164 PolarHBondContact O-N 3.28Å; Y162-M164 VanDerWaalsContact C-N 3.29Å; Y162-M164 PolarHBondContact O-N 2.84Å; M164-R166 HydrophobicContact CB-CG 3.57Å; M164-R166 PolarHBondContact O-N 3.43Å
165	H	91.7	Very high	95.8	Very high	75 Å²	75	45 Å²	45	35%	0.347	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	32.1	-175.9	-55.1	93.2	0	0	0	113.1	P100 D102 N103 Y162 A163	P100-H165 HydrophobicContact CB-CB 4.07Å; P100-H165 WeakPolarHBondContact CB-O 3.49Å; P100-H165 VanDerWaalsContact CD-O 3.29Å; P100-H165 WeakPolarHBondContact CD-O 3.44Å; P100-H165 VanDerWaalsContact CG-O 3.28Å; P100-H165 WeakPolarHBondContact CG-O 3.32Å; D102-H165 HydrophobicContact CB-CB 4.32Å; N103-H165 WeakPolarHBondContact CB-O 3.28Å; Y162-H165 WeakPolarHBondContact O-CA 3.36Å; Y162-H165 PolarHBondContact O-N 3.48Å; A163-H165 VanDerWaalsContact C-N 3.29Å
166	R	90.8	Very high	95.8	Very high	1 Å²	1	44.4 Å²	44.4	0%	0.004	21%	0.207	C	C	.	.	S	Bend	trans	-79.3	-30	178.5	-58.9	-62.1	-146	-165.6	2.8	111.9	E15 N103 N104 D107 R161 M164	E15-R166 IonicContact OE2-CZ 2.8Å; E15-R166 IonicContact OE2-NE 3.94Å; E15-R166 PolarHBondContact OE2-NE 3.25Å; E15-R166 IonicContact OE2-NH2 3.04Å; E15-R166 PolarHBondContact OE2-NH2 3.49Å; N103-R166 WeakPolarHBondContact OD1-CD 3.18Å; N103-R166 PolarHBondContact OD1-NH1 3.4Å; N104-R166 PolarHBondContact O-NH1 2.99Å; D107-R166 PolarHBondContact O-NH2 2.89Å; R161-R166 VanDerWaalsContact CZ-CB 3.48Å; R161-R166 VanDerWaalsContact CZ-CG 3.42Å; R161-R166 VanDerWaalsContact NH2-CG 3.31Å; R161-R166 WeakPolarHBondContact O-CB 3.46Å; R161-R166 PolarHBondContact O-N 2.86Å; M164-R166 HydrophobicContact CB-CG 3.57Å; M164-R166 PolarHBondContact O-N 3.43Å
167	H	95.2	Very high	95.9	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.009	22%	0.218	C	C	.	.	S	Bend	trans	-142.8	144.8	-175.2	-71	-74.1	0	0	0	109.6	S118 S121 R161 D171 I172	S118-H167 PolarHBondContact O-CE1 3.39Å; S118-H167 PolarHBondContact O-ND1 2.98Å; S118-H167 PolarHBondContact OG-ND1 3.18Å; S121-H167 PolarHBondContact OG-CD2 3.39Å; S121-H167 VanDerWaalsContact OG-CD2 3.23Å; S121-H167 PolarHBondContact OG-NE2 2.95Å; R161-H167 HydrophobicContact CB-CB 4.38Å; R161-H167 PolarHBondContact NE-CD2 2.86Å; R161-H167 PolarHBondContact O-N 3.19Å; H167-D171 HydrophobicContact CB-CB 4Å; H167-I172 HydrophobicContact CB-CD1 4.31Å; H167-I172 HydrophobicContact CB-CG1 3.94Å
168	H	96.5	Very high	96	Very high	60 Å²	60	46.9 Å²	46.9	28%	0.278	22%	0.224	S	C	.	.			trans	-70.6	156.8	166.3	-61.2	-81.5	0	0	0	109.9	R97 Q98 I170 D171 I172	R97-H168 PolarHBondContact NE-CD2 3.23Å; R97-H168 PolarHBondContact NH2-CD2 2.95Å; Q98-H168 PolarHBondContact O-NE2 3.02Å; H168-I170 VanDerWaalsContact C-N 3.26Å; H168-I170 HydrophobicContact CB-CG2 4.43Å; H168-I170 PolarHBondContact O-N 3.33Å; H168-D171 WeakPolarHBondContact CB-OD2 3.4Å; H168-D171 IonicContact CD2-OD2 3.76Å; H168-D171 PolarHBondContact CD2-OD2 2.62Å; H168-D171 IonicContact CG-OD2 2.72Å; H168-D171 PolarHBondContact N-OD2 2.92Å; H168-D171 VanDerWaalsContact O-CB 3.32Å; H168-D171 WeakPolarHBondContact O-CB 3.2Å; H168-D171 PolarHBondContact O-N 3.38Å; H168-I172 PolarHBondContact O-N 3.39Å
169	F	97.2	Very high	96.1	Very high	127 Å²	127	46.3 Å²	46.3	56%	0.557	22%	0.22	S	C	*	.	H	α-helix	trans	-53.2	-42.5	179.7	-178.9	-112.3	0	0	0	113.1	Y162 D171 I172 L173	Y162-F169 HydrophobicContact CD2-CB 4.3Å; Y162-F169 HydrophobicContact CE2-CB 4.11Å; F169-D171 VanDerWaalsContact C-N 3.3Å; F169-D171 PolarHBondContact O-N 3.36Å; F169-I172 WeakPolarHBondContact O-CB 3.45Å; F169-I172 PolarHBondContact O-N 3.49Å; F169-I172 VanDerWaalsContact O-N 3.16Å; F169-L173 HydrophobicContact CD1-CD1 3.97Å; F169-L173 HydrophobicContact CD1-CG 4.38Å; F169-L173 HydrophobicContact CE1-CD1 3.47Å; F169-L173 VanDerWaalsContact CE1-CD1 3.47Å; F169-L173 HydrophobicContact CE1-CD2 4.43Å; F169-L173 HydrophobicContact CE1-CG 3.99Å; F169-L173 HydrophobicContact CE2-CD2 4.49Å; F169-L173 HydrophobicContact CE2-CG 4.5Å; F169-L173 HydrophobicContact CZ-CD1 3.93Å; F169-L173 HydrophobicContact CZ-CD2 4.04Å; F169-L173 HydrophobicContact CZ-CG 4.04Å; F169-L173 PolarHBondContact O-N 3.23Å
170	I	97.8	Very high	96.2	Very high	93 Å²	93	44 Å²	44	48%	0.477	21%	0.211	S	C	.	.	H	α-helix	trans	-67.8	-26.5	177.8	-165.5	65.2	0	0	0	113.3	H168 I172 L173 A174	H168-I170 VanDerWaalsContact C-N 3.26Å; H168-I170 HydrophobicContact CB-CG2 4.43Å; H168-I170 PolarHBondContact O-N 3.33Å; I170-I172 VanDerWaalsContact C-N 3.3Å; I170-L173 HydrophobicContact CD1-CB 4.43Å; I170-L173 HydrophobicContact CD1-CD1 4.18Å; I170-L173 PolarHBondContact O-N 2.94Å; I170-A174 VanDerWaalsContact O-CB 3.31Å; I170-A174 WeakPolarHBondContact O-CB 3.44Å; I170-A174 PolarHBondContact O-N 3.3Å
171	D	97.9	Very high	96.4	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-68.7	-34.9	174.2	-55.4	-31.4	0	0	0	110.6	R97 S118 F119 S121 H167 H168 F169 G175	R97-D171 WeakPolarHBondContact CD-OD1 3.29Å; R97-D171 IonicContact CZ-OD1 3.61Å; R97-D171 IonicContact NE-OD1 3.87Å; R97-D171 VanDerWaalsContact NH1-CG 3.34Å; R97-D171 IonicContact NH1-OD1 2.64Å; R97-D171 PolarHBondContact NH1-OD1 2.71Å; R97-D171 IonicContact NH1-OD2 3.52Å; S118-D171 WeakPolarHBondContact CB-OD2 3.43Å; S118-D171 WeakPolarHBondContact O-CB 3.17Å; S118-D171 PolarHBondContact OG-OD2 2.64Å; F119-D171 WeakPolarHBondContact CB-OD1 3.28Å; F119-D171 HydrophobicContact CD2-CB 4.48Å; F119-D171 VanDerWaalsContact CD2-OD1 3.27Å; F119-D171 WeakPolarHBondContact CD2-OD1 3.45Å; S121-D171 WeakPolarHBondContact CB-O 3.49Å; S121-D171 PolarHBondContact N-O 3.18Å; H167-D171 HydrophobicContact CB-CB 4Å; H168-D171 WeakPolarHBondContact CB-OD2 3.4Å; H168-D171 IonicContact CD2-OD2 3.76Å; H168-D171 PolarHBondContact CD2-OD2 2.62Å; H168-D171 IonicContact CG-OD2 2.72Å; H168-D171 PolarHBondContact N-OD2 2.92Å; H168-D171 VanDerWaalsContact O-CB 3.32Å; H168-D171 WeakPolarHBondContact O-CB 3.2Å; H168-D171 PolarHBondContact O-N 3.38Å; F169-D171 VanDerWaalsContact C-N 3.3Å; F169-D171 PolarHBondContact O-N 3.36Å; D171-G175 PolarHBondContact O-N 3.48Å
172	I	98.1	Very high	96.5	Very high	14 Å²	14	47.9 Å²	47.9	7%	0.072	23%	0.231	C	C	.	.	H	α-helix	trans	-71.1	-44.5	176.7	-62.5	165.7	0	0	0	110	A124 C158 R161 Y162 H167 H168 F169 I170 A174 G175 Y176	A124-I172 HydrophobicContact CB-CG2 4.04Å; C158-I172 HydrophobicContact CB-CG2 3.87Å; R161-I172 HydrophobicContact CB-CD1 4.09Å; R161-I172 HydrophobicContact CB-CG1 4.31Å; Y162-I172 HydrophobicContact CD2-CD1 4.43Å; Y162-I172 HydrophobicContact CG-CD1 4.45Å; H167-I172 HydrophobicContact CB-CD1 4.31Å; H167-I172 HydrophobicContact CB-CG1 3.94Å; H168-I172 PolarHBondContact O-N 3.39Å; F169-I172 WeakPolarHBondContact O-CB 3.45Å; F169-I172 PolarHBondContact O-N 3.49Å; F169-I172 VanDerWaalsContact O-N 3.16Å; I170-I172 VanDerWaalsContact C-N 3.3Å; I172-A174 VanDerWaalsContact C-N 3.34Å; I172-A174 PolarHBondContact O-N 2.89Å; I172-G175 PolarHBondContact O-N 2.9Å; I172-Y176 WeakPolarHBondContact O-CB 3.49Å; I172-Y176 PolarHBondContact O-N 3.14Å
173	L	98.4	Very high	96.7	Very high	75 Å²	75	43.8 Å²	43.8	39%	0.393	22%	0.215	S	C	.	.	H	α-helix	trans	-61.9	-40.7	174.8	-69.3	-177.3	0	0	0	112.7	F169 I170 Y176 T177	F169-L173 HydrophobicContact CD1-CD1 3.97Å; F169-L173 HydrophobicContact CD1-CG 4.38Å; F169-L173 HydrophobicContact CE1-CD1 3.47Å; F169-L173 VanDerWaalsContact CE1-CD1 3.47Å; F169-L173 HydrophobicContact CE1-CD2 4.43Å; F169-L173 HydrophobicContact CE1-CG 3.99Å; F169-L173 HydrophobicContact CE2-CD2 4.49Å; F169-L173 HydrophobicContact CE2-CG 4.5Å; F169-L173 HydrophobicContact CZ-CD1 3.93Å; F169-L173 HydrophobicContact CZ-CD2 4.04Å; F169-L173 HydrophobicContact CZ-CG 4.04Å; F169-L173 PolarHBondContact O-N 3.23Å; I170-L173 HydrophobicContact CD1-CB 4.43Å; I170-L173 HydrophobicContact CD1-CD1 4.18Å; I170-L173 PolarHBondContact O-N 2.94Å; L173-Y176 PolarHBondContact O-N 2.88Å; L173-T177 WeakPolarHBondContact O-CB 3.37Å; L173-T177 PolarHBondContact O-N 2.96Å; L173-T177 PolarHBondContact O-OG1 3.48Å
174	A	98.4	Very high	96.8	Very high	23 Å²	23	49 Å²	49	19%	0.19	23%	0.23	C	C	.	.	H	α-helix	trans	-66.3	-42.6	175.5	0	0	0	0	0	111.6	F119 P120 I170 I172 T177 L178	F119-A174 HydrophobicContact CD2-CB 4.13Å; F119-A174 HydrophobicContact CE2-CB 3.27Å; F119-A174 HydrophobicContact CZ-CB 3.57Å; P120-A174 HydrophobicContact CB-CB 4.11Å; I170-A174 VanDerWaalsContact O-CB 3.31Å; I170-A174 WeakPolarHBondContact O-CB 3.44Å; I170-A174 PolarHBondContact O-N 3.3Å; I172-A174 VanDerWaalsContact C-N 3.34Å; I172-A174 PolarHBondContact O-N 2.89Å; A174-T177 PolarHBondContact O-N 3.4Å; A174-L178 WeakPolarHBondContact O-CB 3.39Å; A174-L178 PolarHBondContact O-N 2.82Å
175	G	98.5	Very high	97.1	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-59.5	-50.1	172.9	0	0	0	0	0	111.7	S125 D171 I172 T177 L178 G179	S125-G175 WeakPolarHBondContact CA-O 3.4Å; S125-G175 PolarHBondContact N-O 3.49Å; D171-G175 PolarHBondContact O-N 3.48Å; I172-G175 PolarHBondContact O-N 2.9Å; G175-T177 VanDerWaalsContact C-N 3.32Å; G175-T177 PolarHBondContact O-N 3.12Å; G175-L178 WeakPolarHBondContact O-CB 3.49Å; G175-L178 PolarHBondContact O-N 3.04Å; G175-L178 VanDerWaalsContact O-N 3.14Å; G175-G179 PolarHBondContact O-N 3.04Å
176	Y	98.4	Very high	97.2	Very high	77 Å²	77	48.3 Å²	48.3	30%	0.302	23%	0.228	S	C	.	.	H	α-helix	trans	-55.9	-46.2	177.3	-169.6	-80.9	0	0	0	112.1	T128 I172 L173 G179 Y180	T128-Y176 HydrophobicContact CG2-CD1 4.13Å; T128-Y176 HydrophobicContact CG2-CD2 3.81Å; T128-Y176 HydrophobicContact CG2-CE1 4.1Å; T128-Y176 HydrophobicContact CG2-CE2 3.79Å; T128-Y176 HydrophobicContact CG2-CG 3.98Å; T128-Y176 WeakPolarHBondContact CG2-O 3.3Å; T128-Y176 WeakPolarHBondContact OG1-CD2 3.34Å; I172-Y176 WeakPolarHBondContact O-CB 3.49Å; I172-Y176 PolarHBondContact O-N 3.14Å; L173-Y176 PolarHBondContact O-N 2.88Å; Y176-G179 PolarHBondContact O-N 3.36Å; Y176-Y180 PolarHBondContact O-N 3.34Å; Y176-Y180 VanDerWaalsContact O-N 3.12Å
177	T	98.6	Very high	97.2	Very high	77 Å²	77	48.7 Å²	48.7	47%	0.472	23%	0.23	S	C	.	.	H	α-helix	trans	-61.5	-45.6	176.2	-55.4	0	0	0	0	111.8	L173 A174 G175 Y180 I181	L173-T177 WeakPolarHBondContact O-CB 3.37Å; L173-T177 PolarHBondContact O-N 2.96Å; L173-T177 PolarHBondContact O-OG1 3.48Å; A174-T177 PolarHBondContact O-N 3.4Å; G175-T177 VanDerWaalsContact C-N 3.32Å; G175-T177 PolarHBondContact O-N 3.12Å; T177-Y180 PolarHBondContact O-N 3.28Å; T177-I181 HydrophobicContact CG2-CD1 3.93Å; T177-I181 WeakPolarHBondContact O-CG1 3.42Å; T177-I181 PolarHBondContact O-N 2.79Å
178	L	98.6	Very high	96.9	Very high	25 Å²	25	52.2 Å²	52.2	13%	0.131	25%	0.247	C	C	.	.	H	α-helix	trans	-59.3	-50.5	177.8	177.9	62.5	0	0	0	111.2	M87 V88 I91 P120 S125 A174 G175 Y180 I181 E182	M87-L178 HydrophobicContact CB-CD1 4.48Å; V88-L178 HydrophobicContact CG2-CD2 3.87Å; I91-L178 HydrophobicContact CD1-CD1 4.12Å; I91-L178 HydrophobicContact CD1-CD2 3.74Å; P120-L178 HydrophobicContact CG-CD2 4.03Å; S125-L178 WeakPolarHBondContact OG-CG 3.31Å; A174-L178 WeakPolarHBondContact O-CB 3.39Å; A174-L178 PolarHBondContact O-N 2.82Å; G175-L178 WeakPolarHBondContact O-CB 3.49Å; G175-L178 PolarHBondContact O-N 3.04Å; G175-L178 VanDerWaalsContact O-N 3.14Å; L178-Y180 VanDerWaalsContact C-N 3.28Å; L178-Y180 PolarHBondContact O-N 2.54Å; L178-I181 WeakPolarHBondContact O-CB 3.43Å; L178-I181 PolarHBondContact O-N 3.02Å; L178-E182 HydrophobicContact CD1-CG 4.14Å; L178-E182 HydrophobicContact CG-CG 4.31Å; L178-E182 WeakPolarHBondContact CG-OE1 3.44Å; L178-E182 WeakPolarHBondContact O-CG 3.34Å; L178-E182 PolarHBondContact O-N 3.49Å
179	G	98.5	Very high	96.2	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.1	-34.5	-179.9	0	0	0	0	0	113.6	S125 M129 G175 Y176 Y183	S125-G179 WeakPolarHBondContact O-CA 3.35Å; S125-G179 PolarHBondContact OG-N 3.08Å; M129-G179 WeakPolarHBondContact CA-O 3.13Å; M129-G179 WeakPolarHBondContact CB-O 3.47Å; G175-G179 PolarHBondContact O-N 3.04Å; Y176-G179 PolarHBondContact O-N 3.36Å; G179-Y183 WeakPolarHBondContact O-CB 2.97Å; G179-Y183 PolarHBondContact O-N 2.97Å
180	Y	98.5	Very high	95.1	Very high	109 Å²	109	53 Å²	53	43%	0.427	26%	0.258	S	S	.	.	H	α-helix	trans	-67.5	-42.6	172.3	178.6	-104.1	0	0	0	112.4	F132 Y176 T177 L178 Y183 W184	F132-Y180 HydrophobicContact CD1-CD2 4.41Å; F132-Y180 AromaticContact CD2-CD2 3.84Å; F132-Y180 HydrophobicContact CD2-CD2 3.84Å; F132-Y180 HydrophobicContact CE1-CD2 4.16Å; F132-Y180 HydrophobicContact CE1-CE2 4.18Å; F132-Y180 AromaticContact CE2-CD2 3.57Å; F132-Y180 HydrophobicContact CE2-CD2 3.57Å; F132-Y180 HydrophobicContact CE2-CE2 4.38Å; F132-Y180 HydrophobicContact CE2-CG 4.41Å; F132-Y180 HydrophobicContact CG-CD2 4.27Å; F132-Y180 AromaticContact CZ-CD2 3.74Å; F132-Y180 HydrophobicContact CZ-CD2 3.74Å; F132-Y180 HydrophobicContact CZ-CE2 4.12Å; Y176-Y180 PolarHBondContact O-N 3.34Å; Y176-Y180 VanDerWaalsContact O-N 3.12Å; T177-Y180 PolarHBondContact O-N 3.28Å; L178-Y180 VanDerWaalsContact C-N 3.28Å; L178-Y180 PolarHBondContact O-N 2.54Å; Y180-Y183 HydrophobicContact CD2-CD1 4.17Å; Y180-Y183 HydrophobicContact CE2-CD1 4.26Å; Y180-Y183 HydrophobicContact CE2-CE1 4.33Å; Y180-Y183 PolarHBondContact O-N 3.43Å; Y180-W184 WeakPolarHBondContact O-CB 3.45Å; Y180-W184 PolarHBondContact O-N 3.06Å
181	I	98.4	Very high	93.6	Very high	82 Å²	82	53.6 Å²	53.6	42%	0.421	26%	0.263	S	S	.	.	H	α-helix	trans	-62.7	-44.2	175.9	-69	167.5	0	0	0	110.6	T177 L178 W184 L185	T177-I181 HydrophobicContact CG2-CD1 3.93Å; T177-I181 WeakPolarHBondContact O-CG1 3.42Å; T177-I181 PolarHBondContact O-N 2.79Å; L178-I181 WeakPolarHBondContact O-CB 3.43Å; L178-I181 PolarHBondContact O-N 3.02Å; I181-W184 PolarHBondContact O-N 3.17Å; I181-L185 HydrophobicContact CG2-CD1 3.94Å; I181-L185 HydrophobicContact CG2-CG 4.31Å; I181-L185 WeakPolarHBondContact O-CG 3.38Å; I181-L185 PolarHBondContact O-N 3.2Å
182	E	98	Very high	91.4	Very high	1 Å²	1	64.3 Å²	64.3	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-61	-47.9	177.7	-70.8	173.6	166.4	0	0	111.4	F83 D84 M87 S125 M129 L178 W184 L185 I186	F83-E182 HydrophobicContact CD1-CB 4.37Å; F83-E182 HydrophobicContact CD1-CG 3.93Å; F83-E182 HydrophobicContact CE1-CG 3.91Å; D84-E182 WeakPolarHBondContact CA-OE1 3.23Å; D84-E182 WeakPolarHBondContact CB-OE2 3.32Å; M87-E182 VanDerWaalsContact CB-OE1 3.32Å; M87-E182 WeakPolarHBondContact CB-OE1 3.5Å; S125-E182 PolarHBondContact OG-OE2 2.96Å; M129-E182 HydrophobicContact CG-CB 4.29Å; M129-E182 HydrophobicContact SD-CB 4.26Å; L178-E182 HydrophobicContact CD1-CG 4.14Å; L178-E182 HydrophobicContact CG-CG 4.31Å; L178-E182 WeakPolarHBondContact CG-OE1 3.44Å; L178-E182 WeakPolarHBondContact O-CG 3.34Å; L178-E182 PolarHBondContact O-N 3.49Å; E182-W184 VanDerWaalsContact C-N 3.32Å; E182-W184 PolarHBondContact O-N 2.92Å; E182-L185 PolarHBondContact O-N 3.29Å; E182-I186 WeakPolarHBondContact O-CB 3.31Å; E182-I186 VanDerWaalsContact O-CG1 3.23Å; E182-I186 WeakPolarHBondContact O-CG1 3.43Å; E182-I186 PolarHBondContact O-N 3.48Å
183	Y	97.6	Very high	91.1	Very high	36 Å²	36	66.8 Å²	66.8	14%	0.141	32%	0.321	C	S	.	.	H	α-helix	trans	-52.9	-50.1	171.9	152.6	-104.4	0	0	0	111.6	F132 L133 H136 G179 Y180 L185 I186 I187	F132-Y183 HydrophobicContact CB-CD1 3.56Å; F132-Y183 HydrophobicContact CB-CD2 3.57Å; F132-Y183 HydrophobicContact CB-CE1 3.9Å; F132-Y183 HydrophobicContact CB-CE2 3.9Å; F132-Y183 HydrophobicContact CB-CG 3.37Å; F132-Y183 HydrophobicContact CD1-CD1 4.46Å; F132-Y183 HydrophobicContact CD1-CE1 4.29Å; F132-Y183 HydrophobicContact CG-CD1 4Å; F132-Y183 HydrophobicContact CG-CE1 4.26Å; F132-Y183 HydrophobicContact CG-CG 4.27Å; L133-Y183 HydrophobicContact CB-CD2 4.07Å; L133-Y183 HydrophobicContact CD1-CD2 4.12Å; H136-Y183 HydrophobicContact CB-CE2 3.78Å; H136-Y183 AromaticContact ND1-CE2 3.88Å; H136-Y183 AromaticContact ND1-CZ 3.8Å; H136-Y183 PolarHBondContact ND1-OH 2.9Å; G179-Y183 WeakPolarHBondContact O-CB 2.97Å; G179-Y183 PolarHBondContact O-N 2.97Å; Y180-Y183 HydrophobicContact CD2-CD1 4.17Å; Y180-Y183 HydrophobicContact CE2-CD1 4.26Å; Y180-Y183 HydrophobicContact CE2-CE1 4.33Å; Y180-Y183 PolarHBondContact O-N 3.43Å; Y183-L185 PolarHBondContact O-N 2.96Å; Y183-I186 PolarHBondContact O-N 3.13Å; Y183-I187 HydrophobicContact CD2-CG1 3.85Å; Y183-I187 HydrophobicContact CE2-CD1 4.22Å; Y183-I187 HydrophobicContact CE2-CG1 3.44Å; Y183-I187 VanDerWaalsContact CE2-CG1 3.44Å; Y183-I187 WeakPolarHBondContact O-CG1 3.32Å; Y183-I187 PolarHBondContact O-N 3.49Å
184	W	96.2	Very high	90.7	Very high	132 Å²	132	66.4 Å²	66.4	50%	0.5	32%	0.317	S	S	.	.	H	α-helix	trans	-61.9	-44.9	-178	-177.9	86.7	0	0	0	111.4	Y180 I181 E182 I186 I187 Q188	Y180-W184 WeakPolarHBondContact O-CB 3.45Å; Y180-W184 PolarHBondContact O-N 3.06Å; I181-W184 PolarHBondContact O-N 3.17Å; E182-W184 VanDerWaalsContact C-N 3.32Å; E182-W184 PolarHBondContact O-N 2.92Å; W184-I186 PolarHBondContact O-N 2.93Å; W184-I187 PolarHBondContact O-N 3.04Å; W184-Q188 HydrophobicContact CD2-CG 4.01Å; W184-Q188 HydrophobicContact CE3-CG 4.25Å; W184-Q188 HydrophobicContact CH2-CG 4.12Å; W184-Q188 HydrophobicContact CZ2-CG 3.87Å; W184-Q188 HydrophobicContact CZ3-CG 4.31Å; W184-Q188 WeakPolarHBondContact O-CG 3.46Å; W184-Q188 PolarHBondContact O-N 3.38Å; W184-Q188 VanDerWaalsContact O-N 3.08Å
185	L	95.9	Very high	90.3	Very high	67 Å²	67	68.8 Å²	68.8	35%	0.351	32%	0.324	S	S	.	.	H	α-helix	trans	-60.8	-44.1	177	-73.4	172.3	0	0	0	112.2	F83 I181 E182 Y183 Q188 L189	F83-L185 HydrophobicContact CE1-CD1 4.28Å; F83-L185 HydrophobicContact CZ-CD1 4.44Å; I181-L185 HydrophobicContact CG2-CD1 3.94Å; I181-L185 HydrophobicContact CG2-CG 4.31Å; I181-L185 WeakPolarHBondContact O-CG 3.38Å; I181-L185 PolarHBondContact O-N 3.2Å; E182-L185 PolarHBondContact O-N 3.29Å; Y183-L185 PolarHBondContact O-N 2.96Å; L185-Q188 PolarHBondContact O-N 2.84Å; L185-L189 WeakPolarHBondContact O-CG 3.27Å; L185-L189 PolarHBondContact O-N 3.12Å
186	I	93.1	Very high	89.8	Confident	13 Å²	13	72.8 Å²	72.8	7%	0.067	34%	0.343	C	S	.	.	H	α-helix	trans	-63.9	-43.8	-179.4	-69.7	-69.3	0	0	0	111.4	C76 I79 A80 L133 E182 Y183 W184 L189 N190	C76-I186 WeakPolarHBondContact SG-CG2 3.45Å; I79-I186 HydrophobicContact CG2-CD1 4.14Å; A80-I186 HydrophobicContact CB-CD1 4.11Å; A80-I186 HydrophobicContact CB-CG1 3.88Å; A80-I186 HydrophobicContact CB-CG2 4.3Å; L133-I186 HydrophobicContact CD1-CG2 4.02Å; L133-I186 HydrophobicContact CD2-CG2 4.31Å; E182-I186 WeakPolarHBondContact O-CB 3.31Å; E182-I186 VanDerWaalsContact O-CG1 3.23Å; E182-I186 WeakPolarHBondContact O-CG1 3.43Å; E182-I186 PolarHBondContact O-N 3.48Å; Y183-I186 PolarHBondContact O-N 3.13Å; W184-I186 PolarHBondContact O-N 2.93Å; I186-L189 PolarHBondContact O-N 3.41Å; I186-N190 PolarHBondContact O-N 3.23Å; I186-N190 VanDerWaalsContact O-N 3.12Å
187	I	91	Very high	89.3	Confident	9 Å²	9	72.6 Å²	72.6	5%	0.046	35%	0.346	C	S	.	.	H	α-helix	trans	-64.9	-41.9	177	-67.5	-57.8	0	0	0	111.6	L133 H136 L137 Y183 W184 L189 N190 D191	L133-I187 HydrophobicContact CD1-CD1 3.65Å; L133-I187 HydrophobicContact CD1-CG1 4.16Å; H136-I187 HydrophobicContact CB-CD1 4.38Å; L137-I187 HydrophobicContact CD2-CD1 4.03Å; L137-I187 HydrophobicContact CG-CD1 4.48Å; Y183-I187 HydrophobicContact CD2-CG1 3.85Å; Y183-I187 HydrophobicContact CE2-CD1 4.22Å; Y183-I187 HydrophobicContact CE2-CG1 3.44Å; Y183-I187 VanDerWaalsContact CE2-CG1 3.44Å; Y183-I187 WeakPolarHBondContact O-CG1 3.32Å; Y183-I187 PolarHBondContact O-N 3.49Å; W184-I187 PolarHBondContact O-N 3.04Å; I187-L189 PolarHBondContact O-N 3.16Å; I187-N190 PolarHBondContact O-N 2.81Å; I187-D191 WeakPolarHBondContact CG2-OD2 3.41Å; I187-D191 PolarHBondContact O-N 3.45Å
188	Q	88.7	Confident	88.6	Confident	77 Å²	77	72.3 Å²	72.3	36%	0.36	34%	0.337	S	S	.	.	H	α-helix	trans	-63.5	-24.6	177.6	-68	-64.2	-18.5	0	0	113.8	W184 L185 K192	W184-Q188 HydrophobicContact CD2-CG 4.01Å; W184-Q188 HydrophobicContact CE3-CG 4.25Å; W184-Q188 HydrophobicContact CH2-CG 4.12Å; W184-Q188 HydrophobicContact CZ2-CG 3.87Å; W184-Q188 HydrophobicContact CZ3-CG 4.31Å; W184-Q188 WeakPolarHBondContact O-CG 3.46Å; W184-Q188 PolarHBondContact O-N 3.38Å; W184-Q188 VanDerWaalsContact O-N 3.08Å; L185-Q188 PolarHBondContact O-N 2.84Å; Q188-K192 WeakPolarHBondContact O-CG 3.38Å
189	L	82.8	Confident	87.9	Confident	129 Å²	129	75.6 Å²	75.6	68%	0.675	35%	0.352	S	S	*	.	H	α-helix	trans	-82.8	-26.3	172.7	-68.6	172.9	0	0	0	112.5	L185 I186 I187	L185-L189 WeakPolarHBondContact O-CG 3.27Å; L185-L189 PolarHBondContact O-N 3.12Å; I186-L189 PolarHBondContact O-N 3.41Å; I187-L189 PolarHBondContact O-N 3.16Å
190	N	74	Confident	87.1	Confident	74 Å²	74	81.5 Å²	81.5	40%	0.396	38%	0.379	S	S	.	.	H	α-helix	trans	-82	-28.9	179.5	-177.9	84.2	0	0	0	113.1	I186 I187 K192	I186-N190 PolarHBondContact O-N 3.23Å; I186-N190 VanDerWaalsContact O-N 3.12Å; I187-N190 PolarHBondContact O-N 2.81Å; N190-K192 VanDerWaalsContact C-N 3.28Å; N190-K192 PolarHBondContact O-N 2.64Å
191	D	66.7	Low	86.2	Confident	106 Å²	106	79.2 Å²	79.2	57%	0.567	38%	0.375	S	S	*	.			trans	-83.3	-0.2	-178.1	-68.3	-11.4	0	0	0	113.8	I187	I187-D191 WeakPolarHBondContact CG2-OD2 3.41Å; I187-D191 PolarHBondContact O-N 3.45Å
192	K	51.6	Low	85	Confident	224 Å²	224	78.9 Å²	78.9	97%	0.974	37%	0.371	S	S	*	.			trans	-107.4	0	178.8	-66	-176.1	-176.6	-178.5	0	111.8	Q188 N190	Q188-K192 WeakPolarHBondContact O-CG 3.38Å; N190-K192 VanDerWaalsContact C-N 3.28Å; N190-K192 PolarHBondContact O-N 2.64Å

Retrieved 192 of 192 residues in 41.7 ms (Link to these results)

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