A0A5K4F639_SCHMA Loading...

Conserved oligomeric Golgi complex subunit 4 C-terminal domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F639, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 150 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	48.3	Very low	67.9	Low	192 Å²	192	104.6 Å²	104.6	95%	0.946	55%	0.545	S	S	*	.				0	104.5	0	-151.3	159.9	70.7	0	0	105.1
2	N	59.3	Low	68.3	Low	106 Å²	106	98.8 Å²	98.8	57%	0.567	52%	0.523	S	S	*	.			trans	-82.7	136.5	-168.8	-138.2	3.7	0	0	0	107.7	T4 E5 D6	N2-T4 PolarHBondContact O-N 2.81Å; N2-E5 HydrophobicContact CB-CG 4.14Å; N2-E5 PolarHBondContact N-OE2 3.14Å; N2-E5 VanDerWaalsContact N-OE2 3.14Å; N2-E5 WeakPolarHBondContact O-CB 3.43Å; N2-E5 PolarHBondContact O-N 2.94Å; N2-D6 PolarHBondContact O-N 2.91Å
3	E	69.7	Low	68.8	Low	166 Å²	166	99.9 Å²	99.9	78%	0.776	53%	0.53	S	S	*	.	H	α-helix	trans	-51.7	-28.6	-179.5	-68.6	179.1	163.1	0	0	112.7	L7	E3-L7 VanDerWaalsContact O-CG 3.3Å; E3-L7 WeakPolarHBondContact O-CG 3.31Å; E3-L7 PolarHBondContact O-N 3.06Å; E3-L7 VanDerWaalsContact O-N 3.15Å
4	T	68.4	Low	69.5	Low	78 Å²	78	99.2 Å²	99.2	48%	0.479	53%	0.526	S	S	.	.	H	α-helix	trans	-65.2	-37.9	174.4	51.9	0	0	0	0	113.8	N2 D8	N2-T4 PolarHBondContact O-N 2.81Å; T4-D8 PolarHBondContact O-N 3.44Å
5	E	68.3	Low	70.5	Confident	109 Å²	109	105.2 Å²	105.2	51%	0.509	54%	0.539	S	S	.	.	H	α-helix	trans	-68.3	-41.3	178.5	-65.9	173.6	152.2	0	0	110.5	N2 D8 V9	N2-E5 HydrophobicContact CB-CG 4.14Å; N2-E5 PolarHBondContact N-OE2 3.14Å; N2-E5 VanDerWaalsContact N-OE2 3.14Å; N2-E5 WeakPolarHBondContact O-CB 3.43Å; N2-E5 PolarHBondContact O-N 2.94Å; E5-D8 PolarHBondContact O-N 2.99Å; E5-V9 VanDerWaalsContact O-CG2 3.31Å; E5-V9 WeakPolarHBondContact O-CG2 2.99Å; E5-V9 PolarHBondContact O-N 3.31Å
6	D	69.4	Low	71.7	Confident	62 Å²	62	103.2 Å²	103.2	33%	0.332	52%	0.522	S	S	.	.	H	α-helix	trans	-63.3	-43.9	177.2	-70.5	-24.2	0	0	0	110.9	N2 D8 V9 F10	N2-D6 PolarHBondContact O-N 2.91Å; D6-D8 VanDerWaalsContact C-N 3.35Å; D6-D8 PolarHBondContact O-N 3.45Å; D6-V9 PolarHBondContact O-N 3.35Å; D6-F10 HydrophobicContact CB-CE2 4.33Å; D6-F10 WeakPolarHBondContact O-CD2 3.38Å; D6-F10 PolarHBondContact O-N 3.15Å
7	L	73.6	Confident	72.9	Confident	115 Å²	115	97.2 Å²	97.2	60%	0.602	49%	0.492	S	S	*	.	H	α-helix	trans	-61.8	-40.3	176.3	-71.8	171.8	0	0	0	112.8	E3 F10 A11	E3-L7 VanDerWaalsContact O-CG 3.3Å; E3-L7 WeakPolarHBondContact O-CG 3.31Å; E3-L7 PolarHBondContact O-N 3.06Å; E3-L7 VanDerWaalsContact O-N 3.15Å; L7-F10 PolarHBondContact O-N 3.34Å; L7-A11 WeakPolarHBondContact O-CB 3.3Å; L7-A11 PolarHBondContact O-N 3.41Å
8	D	75.2	Confident	74	Confident	39 Å²	39	97.1 Å²	97.1	21%	0.209	49%	0.49	C	S	.	.	H	α-helix	trans	-64.6	-40.8	175.9	-81.8	-20.7	0	0	0	110.7	T4 E5 D6 A11 A12 S65 F67	T4-D8 PolarHBondContact O-N 3.44Å; E5-D8 PolarHBondContact O-N 2.99Å; D6-D8 VanDerWaalsContact C-N 3.35Å; D6-D8 PolarHBondContact O-N 3.45Å; D8-A11 PolarHBondContact O-N 3.38Å; D8-A12 WeakPolarHBondContact O-CB 3.44Å; D8-A12 PolarHBondContact O-N 3.1Å; D8-S65 PolarHBondContact OD1-OG 2.83Å; D8-S65 PolarHBondContact OD2-OG 2.93Å; D8-F67 HydrophobicContact CB-CB 4.28Å; D8-F67 HydrophobicContact CB-CD1 3.49Å; D8-F67 VanDerWaalsContact CB-CD1 3.49Å; D8-F67 HydrophobicContact CB-CE1 4.02Å; D8-F67 HydrophobicContact CB-CG 3.93Å; D8-F67 WeakPolarHBondContact O-CE1 3Å
9	V	73.6	Confident	75	Confident	85 Å²	85	94.8 Å²	94.8	52%	0.515	48%	0.484	S	S	.	.	H	α-helix	trans	-64.6	-41.1	174.6	174.1	0	0	0	0	112	E5 D6 A12 N13	E5-V9 VanDerWaalsContact O-CG2 3.31Å; E5-V9 WeakPolarHBondContact O-CG2 2.99Å; E5-V9 PolarHBondContact O-N 3.31Å; D6-V9 PolarHBondContact O-N 3.35Å; V9-A12 WeakPolarHBondContact O-CB 3.39Å; V9-A12 PolarHBondContact O-N 3.34Å; V9-N13 PolarHBondContact O-N 3.23Å; V9-N13 PolarHBondContact O-ND2 2.92Å; V9-N13 VanDerWaalsContact O-ND2 3.1Å
10	F	71.2	Confident	75.9	Confident	150 Å²	150	91.8 Å²	91.8	66%	0.658	47%	0.471	S	S	*	.	H	α-helix	trans	-63.9	-43.9	174.5	-75.4	-64.4	0	0	0	111.6	D6 L7 A12 N13 D14	D6-F10 HydrophobicContact CB-CE2 4.33Å; D6-F10 WeakPolarHBondContact O-CD2 3.38Å; D6-F10 PolarHBondContact O-N 3.15Å; L7-F10 PolarHBondContact O-N 3.34Å; F10-A12 VanDerWaalsContact C-N 3.28Å; F10-A12 PolarHBondContact O-N 2.91Å; F10-N13 PolarHBondContact O-N 3.35Å; F10-N13 VanDerWaalsContact O-N 3.1Å; F10-D14 PolarHBondContact O-N 3.1Å
11	A	70.4	Confident	76.9	Confident	49 Å²	49	88.7 Å²	88.7	41%	0.405	46%	0.455	S	S	.	.	H	α-helix	trans	-63	-34.6	175.9	0	0	0	0	0	112.2	L7 D8 N13 D14	L7-A11 WeakPolarHBondContact O-CB 3.3Å; L7-A11 PolarHBondContact O-N 3.41Å; D8-A11 PolarHBondContact O-N 3.38Å; A11-N13 PolarHBondContact O-N 2.88Å; A11-D14 WeakPolarHBondContact O-CB 3.46Å; A11-D14 PolarHBondContact O-N 2.98Å; A11-D14 VanDerWaalsContact O-N 3.12Å
12	A	72.3	Confident	79.1	Confident	34 Å²	34	81.7 Å²	81.7	28%	0.281	43%	0.427	S	S	.	.	H	α-helix	trans	-62.8	-25.9	174.5	0	0	0	0	0	113.5	D8 V9 F10 F67	D8-A12 WeakPolarHBondContact O-CB 3.44Å; D8-A12 PolarHBondContact O-N 3.1Å; V9-A12 WeakPolarHBondContact O-CB 3.39Å; V9-A12 PolarHBondContact O-N 3.34Å; F10-A12 VanDerWaalsContact C-N 3.28Å; F10-A12 PolarHBondContact O-N 2.91Å; A12-F67 HydrophobicContact CB-CE1 3.74Å; A12-F67 HydrophobicContact CB-CZ 3.61Å
13	N	75.3	Confident	80.8	Confident	114 Å²	114	82.5 Å²	82.5	61%	0.61	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-1.3	178.6	-70.2	-45.6	0	0	0	112.9	V9 F10 A11 R15	V9-N13 PolarHBondContact O-N 3.23Å; V9-N13 PolarHBondContact O-ND2 2.92Å; V9-N13 VanDerWaalsContact O-ND2 3.1Å; F10-N13 PolarHBondContact O-N 3.35Å; F10-N13 VanDerWaalsContact O-N 3.1Å; A11-N13 PolarHBondContact O-N 2.88Å; N13-R15 PolarHBondContact O-N 3.49Å
14	D	77.5	Confident	82	Confident	90 Å²	90	75.1 Å²	75.1	48%	0.481	39%	0.394	S	S	.	.			trans	-66.4	123.9	174	-170.8	-0.7	0	0	0	109.6	F10 A11 W16	F10-D14 PolarHBondContact O-N 3.1Å; A11-D14 WeakPolarHBondContact O-CB 3.46Å; A11-D14 PolarHBondContact O-N 2.98Å; A11-D14 VanDerWaalsContact O-N 3.12Å; D14-W16 VanDerWaalsContact C-N 3.32Å; D14-W16 PolarHBondContact OD1-N 2.81Å
15	R	84.9	Confident	83.3	Confident	189 Å²	189	76.3 Å²	76.3	71%	0.713	39%	0.394	S	S	*	.			trans	-98.8	28.9	-176.7	-63.6	-171	-177.9	-177.8	-0.4	112.7	N13 I17 E18 S19	N13-R15 PolarHBondContact O-N 3.49Å; R15-I17 PolarHBondContact O-N 3.22Å; R15-E18 VanDerWaalsContact C-OE2 3.23Å; R15-E18 WeakPolarHBondContact CA-OE2 3.42Å; R15-E18 WeakPolarHBondContact CB-OE2 3.31Å; R15-E18 PolarHBondContact O-N 2.69Å; R15-S19 WeakPolarHBondContact O-CB 3.1Å; R15-S19 PolarHBondContact O-N 3Å
16	W	89.9	Confident	84.6	Confident	73 Å²	73	76.2 Å²	76.2	28%	0.277	40%	0.397	S	S	.	.	H	α-helix	trans	-60.9	-34.1	-175.1	76.4	-93.6	0	0	0	111.3	D14 S19 C20 L55 E75	D14-W16 VanDerWaalsContact C-N 3.32Å; D14-W16 PolarHBondContact OD1-N 2.81Å; W16-S19 WeakPolarHBondContact O-CB 3.47Å; W16-S19 PolarHBondContact O-N 3.24Å; W16-C20 HydrophobicContact CE3-CB 4.41Å; W16-C20 HydrophobicContact CZ3-CB 4.49Å; W16-C20 WeakPolarHBondContact O-CB 3.45Å; W16-C20 PolarHBondContact O-N 2.74Å; W16-L55 HydrophobicContact CH2-CD2 3.63Å; W16-L55 HydrophobicContact CZ3-CD2 3.66Å; W16-E75 VanDerWaalsContact CE2-OE2 3.28Å; W16-E75 HydrophobicContact CH2-CB 4.48Å; W16-E75 HydrophobicContact CZ2-CB 3.71Å; W16-E75 HydrophobicContact CZ2-CG 4.09Å; W16-E75 WeakPolarHBondContact CZ2-OE2 3.39Å; W16-E75 PolarHBondContact NE1-OE1 3.25Å; W16-E75 PolarHBondContact NE1-OE2 3.2Å
17	I	92.1	Very high	85.8	Confident	2 Å²	2	78.1 Å²	78.1	1%	0.01	40%	0.403	C	S	.	.	H	α-helix	trans	-73.9	-41	-179.3	-164.3	68.7	0	0	0	112.1	R15 S19 C20 I21 E75 N78 L79	R15-I17 PolarHBondContact O-N 3.22Å; I17-S19 VanDerWaalsContact C-N 3.27Å; I17-S19 PolarHBondContact O-N 3.13Å; I17-C20 WeakPolarHBondContact O-CB 3.32Å; I17-C20 PolarHBondContact O-N 2.88Å; I17-I21 HydrophobicContact CG1-CD1 4.3Å; I17-I21 VanDerWaalsContact O-CG1 3.3Å; I17-I21 WeakPolarHBondContact O-CG1 3.45Å; I17-I21 PolarHBondContact O-N 3.05Å; I17-E75 HydrophobicContact CB-CB 4.18Å; I17-E75 HydrophobicContact CB-CG 4.26Å; I17-E75 HydrophobicContact CG1-CB 4.32Å; I17-E75 HydrophobicContact CG2-CB 4.32Å; I17-E75 HydrophobicContact CG2-CG 4.05Å; I17-N78 HydrophobicContact CG1-CB 4.5Å; I17-L79 HydrophobicContact CD1-CB 3.7Å; I17-L79 HydrophobicContact CD1-CD1 4.18Å; I17-L79 HydrophobicContact CD1-CD2 4.13Å; I17-L79 HydrophobicContact CD1-CG 4.19Å; I17-L79 HydrophobicContact CG1-CB 4.27Å
18	E	92.1	Very high	86.8	Confident	95 Å²	95	72.7 Å²	72.7	44%	0.444	37%	0.374	S	S	.	.	H	α-helix	trans	-62.8	-39.2	173.3	-63.2	89.3	164.3	0	0	110.8	R15 I21 A22	R15-E18 VanDerWaalsContact C-OE2 3.23Å; R15-E18 WeakPolarHBondContact CA-OE2 3.42Å; R15-E18 WeakPolarHBondContact CB-OE2 3.31Å; R15-E18 PolarHBondContact O-N 2.69Å; E18-I21 PolarHBondContact O-N 3.45Å; E18-A22 WeakPolarHBondContact O-CB 3.38Å; E18-A22 PolarHBondContact O-N 3.28Å
19	S	94	Very high	87.7	Confident	54 Å²	54	77.8 Å²	77.8	38%	0.378	39%	0.394	S	S	.	.	H	α-helix	trans	-62.7	-45.2	173.1	-177.4	0	0	0	0	111.6	R15 W16 I17 I21 A22 H23	R15-S19 WeakPolarHBondContact O-CB 3.1Å; R15-S19 PolarHBondContact O-N 3Å; W16-S19 WeakPolarHBondContact O-CB 3.47Å; W16-S19 PolarHBondContact O-N 3.24Å; I17-S19 VanDerWaalsContact C-N 3.27Å; I17-S19 PolarHBondContact O-N 3.13Å; S19-I21 VanDerWaalsContact C-N 3.32Å; S19-I21 PolarHBondContact O-N 3.2Å; S19-A22 PolarHBondContact O-N 3.08Å; S19-H23 PolarHBondContact O-N 2.99Å; S19-H23 PolarHBondContact O-ND1 3.27Å; S19-H23 PolarHBondContact OG-CE1 3.02Å; S19-H23 PolarHBondContact OG-ND1 3.3Å
20	C	93.7	Very high	88.7	Confident	33 Å²	33	77.5 Å²	77.5	22%	0.223	39%	0.394	C	S	.	.	H	α-helix	trans	-60.1	-42.9	176.7	-177.7	0	0	0	0	111.6	W16 I17 T24	W16-C20 HydrophobicContact CE3-CB 4.41Å; W16-C20 HydrophobicContact CZ3-CB 4.49Å; W16-C20 WeakPolarHBondContact O-CB 3.45Å; W16-C20 PolarHBondContact O-N 2.74Å; I17-C20 WeakPolarHBondContact O-CB 3.32Å; I17-C20 PolarHBondContact O-N 2.88Å; C20-T24 WeakPolarHBondContact O-CB 3.3Å; C20-T24 PolarHBondContact O-N 3.42Å; C20-T24 PolarHBondContact O-OG1 3.25Å
21	I	95	Very high	89.7	Confident	28 Å²	28	74 Å²	74	14%	0.144	38%	0.379	C	S	.	.	H	α-helix	trans	-61.6	-50.1	175.8	-71.2	167.7	0	0	0	110.5	I17 E18 S19 H23 T24 E25 L79 Y82	I17-I21 HydrophobicContact CG1-CD1 4.3Å; I17-I21 VanDerWaalsContact O-CG1 3.3Å; I17-I21 WeakPolarHBondContact O-CG1 3.45Å; I17-I21 PolarHBondContact O-N 3.05Å; E18-I21 PolarHBondContact O-N 3.45Å; S19-I21 VanDerWaalsContact C-N 3.32Å; S19-I21 PolarHBondContact O-N 3.2Å; I21-H23 PolarHBondContact O-N 3.35Å; I21-T24 WeakPolarHBondContact O-CB 3.48Å; I21-T24 PolarHBondContact O-N 3.03Å; I21-T24 VanDerWaalsContact O-N 3.1Å; I21-E25 PolarHBondContact O-N 2.94Å; I21-L79 HydrophobicContact CG1-CD1 4.49Å; I21-Y82 HydrophobicContact CB-CD1 4.27Å; I21-Y82 HydrophobicContact CB-CG 4.3Å; I21-Y82 HydrophobicContact CD1-CG 4.23Å; I21-Y82 HydrophobicContact CG1-CD1 3.78Å; I21-Y82 HydrophobicContact CG1-CE1 4.46Å; I21-Y82 HydrophobicContact CG1-CG 3.85Å; I21-Y82 HydrophobicContact CG2-CD1 3.96Å; I21-Y82 HydrophobicContact CG2-CD2 3.51Å; I21-Y82 HydrophobicContact CG2-CE1 4.15Å; I21-Y82 HydrophobicContact CG2-CE2 3.72Å; I21-Y82 HydrophobicContact CG2-CG 3.63Å
22	A	95.6	Very high	90.6	Very high	44 Å²	44	77.2 Å²	77.2	36%	0.364	38%	0.38	S	S	.	.	H	α-helix	trans	-60.1	-46.6	179.7	0	0	0	0	0	112.4	E18 S19 T24 E25 D26	E18-A22 WeakPolarHBondContact O-CB 3.38Å; E18-A22 PolarHBondContact O-N 3.28Å; S19-A22 PolarHBondContact O-N 3.08Å; A22-T24 VanDerWaalsContact C-N 3.26Å; A22-T24 PolarHBondContact O-N 2.82Å; A22-E25 WeakPolarHBondContact O-CB 3.46Å; A22-E25 PolarHBondContact O-N 3.08Å; A22-D26 PolarHBondContact O-N 2.78Å
23	H	95.5	Very high	91.4	Very high	123 Å²	123	80.5 Å²	80.5	57%	0.569	40%	0.402	S	S	*	.	H	α-helix	trans	-63.1	-33.7	175.7	-70	109.3	0	0	0	112.3	S19 I21 F27	S19-H23 PolarHBondContact O-N 2.99Å; S19-H23 PolarHBondContact O-ND1 3.27Å; S19-H23 PolarHBondContact OG-CE1 3.02Å; S19-H23 PolarHBondContact OG-ND1 3.3Å; I21-H23 PolarHBondContact O-N 3.35Å; H23-F27 VanDerWaalsContact O-CB 3.26Å; H23-F27 WeakPolarHBondContact O-CB 3.42Å; H23-F27 PolarHBondContact O-N 3.12Å
24	T	94.8	Very high	92.4	Very high	11 Å²	11	80.7 Å²	80.7	7%	0.067	41%	0.406	C	S	.	.	H	α-helix	trans	-67.2	-41.7	175.3	-58.3	0	0	0	0	111.4	C20 I21 A22 F27 L28 L47 I51 Y82	C20-T24 WeakPolarHBondContact O-CB 3.3Å; C20-T24 PolarHBondContact O-N 3.42Å; C20-T24 PolarHBondContact O-OG1 3.25Å; I21-T24 WeakPolarHBondContact O-CB 3.48Å; I21-T24 PolarHBondContact O-N 3.03Å; I21-T24 VanDerWaalsContact O-N 3.1Å; A22-T24 VanDerWaalsContact C-N 3.26Å; A22-T24 PolarHBondContact O-N 2.82Å; T24-F27 PolarHBondContact O-N 3.46Å; T24-L28 HydrophobicContact CG2-CD1 4.11Å; T24-L28 WeakPolarHBondContact O-CB 3.47Å; T24-L28 WeakPolarHBondContact O-CG 3.48Å; T24-L28 PolarHBondContact O-N 2.98Å; T24-L47 HydrophobicContact CG2-CD2 3.8Å; T24-I51 HydrophobicContact CG2-CD1 4.15Å; T24-Y82 HydrophobicContact CG2-CE1 3.74Å
25	E	94.3	Very high	93.2	Very high	103 Å²	103	79 Å²	79	48%	0.481	40%	0.397	S	S	.	.	H	α-helix	trans	-61.2	-48.7	174.4	-70.1	-174.8	164	0	0	111.7	I21 A22 F27 L28 K29 Y82	I21-E25 PolarHBondContact O-N 2.94Å; A22-E25 WeakPolarHBondContact O-CB 3.46Å; A22-E25 PolarHBondContact O-N 3.08Å; E25-F27 VanDerWaalsContact C-N 3.33Å; E25-F27 PolarHBondContact O-N 3.22Å; E25-L28 PolarHBondContact O-N 2.68Å; E25-K29 WeakPolarHBondContact O-CB 3.45Å; E25-K29 PolarHBondContact O-N 3.21Å; E25-Y82 HydrophobicContact CG-CE2 3.58Å; E25-Y82 WeakPolarHBondContact CG-OH 3.47Å; E25-Y82 PolarHBondContact N-OH 3.37Å; E25-Y82 WeakPolarHBondContact OE1-CE2 3.45Å
26	D	95.7	Very high	93.6	Very high	107 Å²	107	73.1 Å²	73.1	57%	0.572	39%	0.385	S	S	*	.	H	α-helix	trans	-62.5	-40	178.9	-78.8	-23.4	0	0	0	111.9	A22 P30	A22-D26 PolarHBondContact O-N 2.78Å; D26-P30 WeakPolarHBondContact O-CD 3.39Å
27	F	95.1	Very high	93.7	Very high	103 Å²	103	74.1 Å²	74.1	45%	0.452	40%	0.399	S	S	.	.	H	α-helix	trans	-62.9	-43	175.1	176.3	-99.4	0	0	0	112.1	H23 T24 E25 P30 F31 L47	H23-F27 VanDerWaalsContact O-CB 3.26Å; H23-F27 WeakPolarHBondContact O-CB 3.42Å; H23-F27 PolarHBondContact O-N 3.12Å; T24-F27 PolarHBondContact O-N 3.46Å; E25-F27 VanDerWaalsContact C-N 3.33Å; E25-F27 PolarHBondContact O-N 3.22Å; F27-P30 WeakPolarHBondContact O-CD 3.06Å; F27-F31 HydrophobicContact CD1-CE2 4.4Å; F27-F31 HydrophobicContact CD2-CE2 4.5Å; F27-F31 HydrophobicContact CE1-CE2 4.03Å; F27-F31 HydrophobicContact CE2-CE2 4.14Å; F27-F31 AromaticContact CZ-CE2 3.89Å; F27-F31 HydrophobicContact CZ-CE2 3.89Å; F27-F31 HydrophobicContact CZ-CZ 4.34Å; F27-F31 WeakPolarHBondContact O-CD2 3.42Å; F27-F31 WeakPolarHBondContact O-CE2 3.38Å; F27-L47 HydrophobicContact CD1-CD1 4.34Å; F27-L47 HydrophobicContact CD1-CD2 3.77Å; F27-L47 HydrophobicContact CE1-CD1 4.18Å; F27-L47 HydrophobicContact CE1-CD2 4.04Å
28	L	94.4	Very high	93.7	Very high	0 Å²	0	79.6 Å²	79.6	0%	0	43%	0.425	C	S	.	.	H	α-helix	trans	-75.7	-26.1	-177.4	-73.1	174.4	0	0	0	113.4	T24 E25 F31 R32 L43 V44 L47 I86	T24-L28 HydrophobicContact CG2-CD1 4.11Å; T24-L28 WeakPolarHBondContact O-CB 3.47Å; T24-L28 WeakPolarHBondContact O-CG 3.48Å; T24-L28 PolarHBondContact O-N 2.98Å; E25-L28 PolarHBondContact O-N 2.68Å; L28-F31 PolarHBondContact O-N 2.7Å; L28-R32 PolarHBondContact O-N 3.4Å; L28-L43 HydrophobicContact CD2-CD2 4.14Å; L28-L43 HydrophobicContact CD2-CG 4.32Å; L28-V44 HydrophobicContact CD1-CG2 4.14Å; L28-V44 HydrophobicContact CD2-CG2 4.17Å; L28-L47 HydrophobicContact CD1-CD2 4.04Å; L28-L47 HydrophobicContact CD2-CD2 3.68Å; L28-L47 HydrophobicContact CG-CD2 3.8Å; L28-I86 HydrophobicContact CD1-CD1 3.62Å
29	K	93.7	Very high	93.8	Very high	147 Å²	147	78.8 Å²	78.8	64%	0.639	42%	0.423	S	S	*	.	H	α-helix	trans	-52.2	-47.3	-172.7	-175.7	179.6	-175.9	176.4	0	114.3	E25 F31 R32	E25-K29 WeakPolarHBondContact O-CB 3.45Å; E25-K29 PolarHBondContact O-N 3.21Å; K29-F31 VanDerWaalsContact C-N 3.26Å; K29-F31 PolarHBondContact O-N 2.8Å; K29-R32 PolarHBondContact O-N 3.2Å
30	P	94.2	Very high	93.8	Very high	79 Å²	79	76.9 Å²	76.9	51%	0.513	41%	0.409	S	S	.	.	H	α-helix	trans	-65.8	-28.4	180	-19.8	33.9	0	0	0	113.2	D26 F27 S33	D26-P30 WeakPolarHBondContact O-CD 3.39Å; F27-P30 WeakPolarHBondContact O-CD 3.06Å; P30-S33 PolarHBondContact O-OG 3.22Å
31	F	93.6	Very high	93.7	Very high	76 Å²	76	76.5 Å²	76.5	33%	0.333	41%	0.405	S	S	.	.	H	α-helix	trans	-79.5	-28.6	-177.2	-59	-73.4	0	0	0	112.6	F27 L28 K29 S33 V34 L35 L43	F27-F31 HydrophobicContact CD1-CE2 4.4Å; F27-F31 HydrophobicContact CD2-CE2 4.5Å; F27-F31 HydrophobicContact CE1-CE2 4.03Å; F27-F31 HydrophobicContact CE2-CE2 4.14Å; F27-F31 AromaticContact CZ-CE2 3.89Å; F27-F31 HydrophobicContact CZ-CE2 3.89Å; F27-F31 HydrophobicContact CZ-CZ 4.34Å; F27-F31 WeakPolarHBondContact O-CD2 3.42Å; F27-F31 WeakPolarHBondContact O-CE2 3.38Å; L28-F31 PolarHBondContact O-N 2.7Å; K29-F31 VanDerWaalsContact C-N 3.26Å; K29-F31 PolarHBondContact O-N 2.8Å; F31-S33 PolarHBondContact O-N 3.28Å; F31-V34 PolarHBondContact O-N 3.09Å; F31-V34 VanDerWaalsContact O-N 3.14Å; F31-L35 HydrophobicContact CB-CD1 3.87Å; F31-L35 HydrophobicContact CB-CG 4.23Å; F31-L35 HydrophobicContact CD1-CD1 4.41Å; F31-L35 HydrophobicContact CG-CD1 4.5Å; F31-L35 WeakPolarHBondContact O-CB 3.39Å; F31-L35 WeakPolarHBondContact O-CG 3.42Å; F31-L35 PolarHBondContact O-N 3.33Å; F31-L43 HydrophobicContact CB-CD2 3.65Å; F31-L43 HydrophobicContact CD1-CD2 4.06Å; F31-L43 HydrophobicContact CD2-CD2 3.8Å; F31-L43 HydrophobicContact CE2-CD2 4.46Å; F31-L43 HydrophobicContact CG-CD2 3.56Å
32	R	89	Confident	93.6	Very high	116 Å²	116	81.8 Å²	81.8	44%	0.438	42%	0.423	S	S	.	.	H	α-helix	trans	-61.7	-26.9	-179.5	-70	-175.9	-174.3	-81.7	4.1	113.2	L28 K29	L28-R32 PolarHBondContact O-N 3.4Å; K29-R32 PolarHBondContact O-N 3.2Å
33	S	89.5	Confident	93.6	Very high	104 Å²	104	81.5 Å²	81.5	73%	0.727	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-12.4	177.8	56	0	0	0	0	114.6	P30 F31	P30-S33 PolarHBondContact O-OG 3.22Å; F31-S33 PolarHBondContact O-N 3.28Å
34	V	95.1	Very high	93.5	Very high	117 Å²	117	75.7 Å²	75.7	71%	0.709	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.1	-33.1	-171.8	-177.6	0	0	0	0	112.1	F31	F31-V34 PolarHBondContact O-N 3.09Å; F31-V34 VanDerWaalsContact O-N 3.14Å
35	L	94.6	Very high	93.6	Very high	56 Å²	56	76.4 Å²	76.4	29%	0.293	39%	0.392	S	S	.	.	S	Bend	trans	-87	147	-178.6	-60.3	-176.8	0	0	0	111.4	F31 N39 N40 L43	F31-L35 HydrophobicContact CB-CD1 3.87Å; F31-L35 HydrophobicContact CB-CG 4.23Å; F31-L35 HydrophobicContact CD1-CD1 4.41Å; F31-L35 HydrophobicContact CG-CD1 4.5Å; F31-L35 WeakPolarHBondContact O-CB 3.39Å; F31-L35 WeakPolarHBondContact O-CG 3.42Å; F31-L35 PolarHBondContact O-N 3.33Å; L35-N39 HydrophobicContact CB-CB 4.05Å; L35-N39 HydrophobicContact CD2-CB 4.32Å; L35-N40 HydrophobicContact CB-CB 4.24Å; L35-L43 HydrophobicContact CD1-CB 4.24Å; L35-L43 HydrophobicContact CD1-CD2 3.71Å
36	S	94.5	Very high	93.7	Very high	64 Å²	64	77.1 Å²	77.1	45%	0.448	40%	0.397	S	S	.	.			trans	-61.6	158.8	161.9	65.2	0	0	0	0	110.3	E38 N39 N40	S36-E38 VanDerWaalsContact C-N 3.28Å; S36-E38 PolarHBondContact O-N 3.27Å; S36-N39 PolarHBondContact O-N 3Å; S36-N39 VanDerWaalsContact O-N 3.1Å; S36-N39 WeakPolarHBondContact OG-CB 3.5Å; S36-N39 PolarHBondContact OG-N 3.01Å; S36-N39 PolarHBondContact OG-ND2 2.99Å; S36-N40 WeakPolarHBondContact O-CB 3.16Å; S36-N40 PolarHBondContact O-N 3.33Å
37	T	91	Very high	93.7	Very high	95 Å²	95	73.4 Å²	73.4	58%	0.583	38%	0.378	S	S	*	.	H	α-helix	trans	-52.6	-45.1	178.3	-49.6	0	0	0	0	112.4	N40 D41 Y88	T37-N40 PolarHBondContact O-N 2.64Å; T37-D41 WeakPolarHBondContact O-CB 3.34Å; T37-D41 PolarHBondContact O-N 2.78Å; T37-Y88 HydrophobicContact CG2-CE2 3.85Å
38	E	92.4	Very high	93.7	Very high	116 Å²	116	68.6 Å²	68.6	54%	0.542	36%	0.356	S	S	.	.	H	α-helix	trans	-63.4	-44	178.1	-178.9	114.8	-178.7	0	0	112.2	S36 N40 D41 R42	S36-E38 VanDerWaalsContact C-N 3.28Å; S36-E38 PolarHBondContact O-N 3.27Å; E38-N40 VanDerWaalsContact C-N 3.31Å; E38-N40 PolarHBondContact O-N 3.36Å; E38-D41 PolarHBondContact O-N 2.87Å; E38-R42 WeakPolarHBondContact O-CG 3.48Å; E38-R42 PolarHBondContact O-N 2.97Å; E38-R42 IonicContact OE1-CZ 3.26Å; E38-R42 IonicContact OE1-NE 3.77Å; E38-R42 IonicContact OE1-NH2 3.02Å; E38-R42 PolarHBondContact OE1-NH2 3.28Å
39	N	94.3	Very high	93.8	Very high	78 Å²	78	72.4 Å²	72.4	42%	0.417	38%	0.377	S	S	.	.	H	α-helix	trans	-68.5	-34.7	178.3	-73.5	-14.9	0	0	0	111.5	L35 S36 L43	L35-N39 HydrophobicContact CB-CB 4.05Å; L35-N39 HydrophobicContact CD2-CB 4.32Å; S36-N39 PolarHBondContact O-N 3Å; S36-N39 VanDerWaalsContact O-N 3.1Å; S36-N39 WeakPolarHBondContact OG-CB 3.5Å; S36-N39 PolarHBondContact OG-N 3.01Å; S36-N39 PolarHBondContact OG-ND2 2.99Å; N39-L43 WeakPolarHBondContact O-CB 3.32Å; N39-L43 PolarHBondContact O-N 2.94Å
40	N	92.7	Very high	93.9	Very high	15 Å²	15	69.8 Å²	69.8	8%	0.08	37%	0.367	C	S	.	.	H	α-helix	trans	-64.7	-45.6	174.4	-168.1	-94.2	0	0	0	111.2	L35 S36 T37 E38 R42 L43 V44	L35-N40 HydrophobicContact CB-CB 4.24Å; S36-N40 WeakPolarHBondContact O-CB 3.16Å; S36-N40 PolarHBondContact O-N 3.33Å; T37-N40 PolarHBondContact O-N 2.64Å; E38-N40 VanDerWaalsContact C-N 3.31Å; E38-N40 PolarHBondContact O-N 3.36Å; N40-R42 PolarHBondContact O-N 3.15Å; N40-L43 WeakPolarHBondContact O-CB 3.17Å; N40-L43 PolarHBondContact O-N 2.84Å; N40-V44 WeakPolarHBondContact O-CG2 3.43Å; N40-V44 PolarHBondContact O-N 2.87Å
41	D	91.8	Very high	94	Very high	25 Å²	25	67 Å²	67	13%	0.134	35%	0.348	C	S	.	.	H	α-helix	trans	-62.6	-43.2	177.7	-176.3	58.9	0	0	0	111.8	T37 E38 L43 V44 L45 Y88 N89	T37-D41 WeakPolarHBondContact O-CB 3.34Å; T37-D41 PolarHBondContact O-N 2.78Å; E38-D41 PolarHBondContact O-N 2.87Å; D41-L43 PolarHBondContact O-N 3.01Å; D41-V44 PolarHBondContact O-N 2.88Å; D41-L45 WeakPolarHBondContact O-CG 3.36Å; D41-L45 PolarHBondContact O-N 3.48Å; D41-Y88 HydrophobicContact CB-CD2 4.12Å; D41-Y88 PolarHBondContact OD1-N 3.48Å; D41-N89 PolarHBondContact OD1-ND2 3.2Å; D41-N89 VanDerWaalsContact OD1-ND2 3.09Å; D41-N89 PolarHBondContact OD2-ND2 3.36Å
42	R	94	Very high	94	Very high	139 Å²	139	64 Å²	64	53%	0.525	34%	0.335	S	S	.	.	H	α-helix	trans	-61	-41.8	173	-70.1	177.6	-170.7	-174.4	4.7	112.7	E38 N40 V44 L45 I46	E38-R42 WeakPolarHBondContact O-CG 3.48Å; E38-R42 PolarHBondContact O-N 2.97Å; E38-R42 IonicContact OE1-CZ 3.26Å; E38-R42 IonicContact OE1-NE 3.77Å; E38-R42 IonicContact OE1-NH2 3.02Å; E38-R42 PolarHBondContact OE1-NH2 3.28Å; N40-R42 PolarHBondContact O-N 3.15Å; R42-V44 VanDerWaalsContact C-N 3.35Å; R42-L45 PolarHBondContact O-N 3.03Å; R42-I46 WeakPolarHBondContact O-CG1 3.26Å; R42-I46 PolarHBondContact O-N 3.12Å
43	L	94.8	Very high	94.3	Very high	38 Å²	38	63.1 Å²	63.1	20%	0.199	34%	0.335	C	S	.	.	H	α-helix	trans	-60.8	-45.3	175.1	174.7	65.3	0	0	0	111	L28 F31 L35 N39 N40 D41 L45 I46 L47	L28-L43 HydrophobicContact CD2-CD2 4.14Å; L28-L43 HydrophobicContact CD2-CG 4.32Å; F31-L43 HydrophobicContact CB-CD2 3.65Å; F31-L43 HydrophobicContact CD1-CD2 4.06Å; F31-L43 HydrophobicContact CD2-CD2 3.8Å; F31-L43 HydrophobicContact CE2-CD2 4.46Å; F31-L43 HydrophobicContact CG-CD2 3.56Å; L35-L43 HydrophobicContact CD1-CB 4.24Å; L35-L43 HydrophobicContact CD1-CD2 3.71Å; N39-L43 WeakPolarHBondContact O-CB 3.32Å; N39-L43 PolarHBondContact O-N 2.94Å; N40-L43 WeakPolarHBondContact O-CB 3.17Å; N40-L43 PolarHBondContact O-N 2.84Å; D41-L43 PolarHBondContact O-N 3.01Å; L43-L45 VanDerWaalsContact C-N 3.33Å; L43-L45 PolarHBondContact O-N 3.34Å; L43-I46 PolarHBondContact O-N 3.14Å; L43-L47 WeakPolarHBondContact O-CB 3.19Å; L43-L47 PolarHBondContact O-N 3.19Å
44	V	94.9	Very high	94.6	Very high	1 Å²	1	61.8 Å²	61.8	1%	0.006	32%	0.318	C	S	.	.	H	α-helix	trans	-59.5	-43.8	177	168.2	0	0	0	0	110.7	L28 N40 D41 R42 I46 L47 I48 I86	L28-V44 HydrophobicContact CD1-CG2 4.14Å; L28-V44 HydrophobicContact CD2-CG2 4.17Å; N40-V44 WeakPolarHBondContact O-CG2 3.43Å; N40-V44 PolarHBondContact O-N 2.87Å; D41-V44 PolarHBondContact O-N 2.88Å; R42-V44 VanDerWaalsContact C-N 3.35Å; V44-I46 PolarHBondContact O-N 3.03Å; V44-L47 PolarHBondContact O-N 3.32Å; V44-I48 HydrophobicContact CG1-CD1 3.62Å; V44-I48 HydrophobicContact CG1-CG1 4.33Å; V44-I48 WeakPolarHBondContact O-CB 3.47Å; V44-I48 WeakPolarHBondContact O-CD1 3.36Å; V44-I48 WeakPolarHBondContact O-CG1 3.43Å; V44-I48 PolarHBondContact O-N 3.36Å; V44-I86 HydrophobicContact CG1-CD1 4.04Å; V44-I86 HydrophobicContact CG1-CG1 4.08Å
45	L	95.9	Very high	94.6	Very high	26 Å²	26	57.1 Å²	57.1	14%	0.136	29%	0.289	C	S	.	.	H	α-helix	trans	-62.8	-41.1	176.4	-70.5	-179.5	0	0	0	113.5	D41 R42 L43 L47 I48 N49 N89 L91 Y94	D41-L45 WeakPolarHBondContact O-CG 3.36Å; D41-L45 PolarHBondContact O-N 3.48Å; R42-L45 PolarHBondContact O-N 3.03Å; L43-L45 VanDerWaalsContact C-N 3.33Å; L43-L45 PolarHBondContact O-N 3.34Å; L45-L47 VanDerWaalsContact C-N 3.34Å; L45-I48 PolarHBondContact O-N 3.25Å; L45-N49 PolarHBondContact O-N 3.06Å; L45-N49 VanDerWaalsContact O-N 3.13Å; L45-N49 PolarHBondContact O-ND2 3.32Å; L45-N49 VanDerWaalsContact O-ND2 3.16Å; L45-N89 HydrophobicContact CD2-CB 4.02Å; L45-L91 HydrophobicContact CD2-CD2 4.03Å; L45-Y94 HydrophobicContact CD2-CE2 4.41Å
46	I	96	Very high	94.6	Very high	117 Å²	117	55.3 Å²	55.3	60%	0.6	28%	0.279	S	S	*	.	H	α-helix	trans	-62.5	-45.8	175.4	-68.6	165.4	0	0	0	109.7	R42 L43 V44 I48 N49 E50	R42-I46 WeakPolarHBondContact O-CG1 3.26Å; R42-I46 PolarHBondContact O-N 3.12Å; L43-I46 PolarHBondContact O-N 3.14Å; V44-I46 PolarHBondContact O-N 3.03Å; I46-I48 PolarHBondContact O-N 3.43Å; I46-N49 PolarHBondContact O-N 3.28Å; I46-E50 PolarHBondContact O-N 2.87Å
47	L	95.6	Very high	94.6	Very high	30 Å²	30	55.4 Å²	55.4	16%	0.157	27%	0.273	C	S	.	.	H	α-helix	trans	-63	-41.6	179.4	-176.4	59.7	0	0	0	112.1	T24 F27 L28 L43 V44 L45 N49 E50 I51	T24-L47 HydrophobicContact CG2-CD2 3.8Å; F27-L47 HydrophobicContact CD1-CD1 4.34Å; F27-L47 HydrophobicContact CD1-CD2 3.77Å; F27-L47 HydrophobicContact CE1-CD1 4.18Å; F27-L47 HydrophobicContact CE1-CD2 4.04Å; L28-L47 HydrophobicContact CD1-CD2 4.04Å; L28-L47 HydrophobicContact CD2-CD2 3.68Å; L28-L47 HydrophobicContact CG-CD2 3.8Å; L43-L47 WeakPolarHBondContact O-CB 3.19Å; L43-L47 PolarHBondContact O-N 3.19Å; V44-L47 PolarHBondContact O-N 3.32Å; L45-L47 VanDerWaalsContact C-N 3.34Å; L47-N49 PolarHBondContact O-N 3.19Å; L47-E50 PolarHBondContact O-N 2.97Å; L47-I51 HydrophobicContact CD1-CD1 4.17Å; L47-I51 HydrophobicContact CD1-CG1 4.29Å; L47-I51 HydrophobicContact CG-CD1 3.88Å; L47-I51 HydrophobicContact CG-CG1 4.43Å; L47-I51 VanDerWaalsContact O-CG1 3.29Å; L47-I51 WeakPolarHBondContact O-CG1 3.43Å; L47-I51 PolarHBondContact O-N 3.1Å
48	I	95.7	Very high	94.7	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-59	-48.1	175.9	-72.2	162	0	0	0	110.9	V44 L45 I46 E50 I51 L52 L83 L91 Y94 F95	V44-I48 HydrophobicContact CG1-CD1 3.62Å; V44-I48 HydrophobicContact CG1-CG1 4.33Å; V44-I48 WeakPolarHBondContact O-CB 3.47Å; V44-I48 WeakPolarHBondContact O-CD1 3.36Å; V44-I48 WeakPolarHBondContact O-CG1 3.43Å; V44-I48 PolarHBondContact O-N 3.36Å; L45-I48 PolarHBondContact O-N 3.25Å; I46-I48 PolarHBondContact O-N 3.43Å; I48-E50 VanDerWaalsContact C-N 3.3Å; I48-E50 PolarHBondContact O-N 3.11Å; I48-I51 PolarHBondContact O-N 3.03Å; I48-L52 HydrophobicContact CG2-CD1 3.94Å; I48-L52 HydrophobicContact CG2-CG 4.44Å; I48-L52 WeakPolarHBondContact O-CB 3.49Å; I48-L52 VanDerWaalsContact O-CG 3.32Å; I48-L52 WeakPolarHBondContact O-CG 3.25Å; I48-L52 PolarHBondContact O-N 3.35Å; I48-L83 HydrophobicContact CB-CD1 4.37Å; I48-L83 HydrophobicContact CD1-CB 4.33Å; I48-L83 HydrophobicContact CG1-CB 4.23Å; I48-L83 HydrophobicContact CG1-CD1 3.82Å; I48-L83 HydrophobicContact CG1-CD2 3.87Å; I48-L83 HydrophobicContact CG1-CG 4.18Å; I48-L83 HydrophobicContact CG2-CD1 4.13Å; I48-L91 HydrophobicContact CD1-CD1 3.65Å; I48-L91 HydrophobicContact CD1-CD2 3.76Å; I48-L91 HydrophobicContact CD1-CG 4.37Å; I48-Y94 HydrophobicContact CG2-CD1 4.46Å; I48-F95 HydrophobicContact CG2-CE2 4.4Å
49	N	95.9	Very high	94.9	Very high	81 Å²	81	51 Å²	51	43%	0.433	24%	0.244	S	C	.	.	H	α-helix	trans	-58.7	-44	177.1	-81.2	-49.6	0	0	0	111.8	L45 I46 L47 L52 H53 Y94	L45-N49 PolarHBondContact O-N 3.06Å; L45-N49 VanDerWaalsContact O-N 3.13Å; L45-N49 PolarHBondContact O-ND2 3.32Å; L45-N49 VanDerWaalsContact O-ND2 3.16Å; I46-N49 PolarHBondContact O-N 3.28Å; L47-N49 PolarHBondContact O-N 3.19Å; N49-L52 PolarHBondContact O-N 3.1Å; N49-H53 VanDerWaalsContact O-CB 3.27Å; N49-H53 WeakPolarHBondContact O-CB 3.29Å; N49-H53 PolarHBondContact O-N 3.16Å; N49-Y94 VanDerWaalsContact OD1-CD1 3.26Å; N49-Y94 WeakPolarHBondContact OD1-CD1 3.32Å; N49-Y94 WeakPolarHBondContact OD1-CE1 3.41Å
50	E	96.3	Very high	94.9	Very high	92 Å²	92	51.2 Å²	51.2	43%	0.43	24%	0.243	S	C	.	.	H	α-helix	trans	-64.4	-46.7	179.3	-176.8	57.2	-154.1	0	0	111.6	I46 L47 I48 L52 H53 Q54	I46-E50 PolarHBondContact O-N 2.87Å; L47-E50 PolarHBondContact O-N 2.97Å; I48-E50 VanDerWaalsContact C-N 3.3Å; I48-E50 PolarHBondContact O-N 3.11Å; E50-L52 VanDerWaalsContact C-N 3.35Å; E50-L52 PolarHBondContact O-N 3.41Å; E50-H53 PolarHBondContact O-N 3.02Å; E50-Q54 HydrophobicContact CG-CG 4.5Å; E50-Q54 VanDerWaalsContact O-CG 3.32Å; E50-Q54 WeakPolarHBondContact O-CG 3.25Å; E50-Q54 PolarHBondContact O-N 3.17Å; E50-Q54 WeakPolarHBondContact OE1-CG 3.49Å; E50-Q54 PolarHBondContact OE1-NE2 3.3Å
51	I	95.6	Very high	95	Very high	20 Å²	20	59.3 Å²	59.3	10%	0.103	27%	0.272	C	S	.	.	H	α-helix	trans	-57.4	-49.1	176.8	-69.9	167.7	0	0	0	110.4	T24 L47 I48 H53 Q54 L55 L79 L83	T24-I51 HydrophobicContact CG2-CD1 4.15Å; L47-I51 HydrophobicContact CD1-CD1 4.17Å; L47-I51 HydrophobicContact CD1-CG1 4.29Å; L47-I51 HydrophobicContact CG-CD1 3.88Å; L47-I51 HydrophobicContact CG-CG1 4.43Å; L47-I51 VanDerWaalsContact O-CG1 3.29Å; L47-I51 WeakPolarHBondContact O-CG1 3.43Å; L47-I51 PolarHBondContact O-N 3.1Å; I48-I51 PolarHBondContact O-N 3.03Å; I51-H53 VanDerWaalsContact C-N 3.34Å; I51-H53 PolarHBondContact O-N 3.36Å; I51-Q54 PolarHBondContact O-N 3.27Å; I51-L55 HydrophobicContact CG2-CD1 3.92Å; I51-L55 HydrophobicContact CG2-CG 4.46Å; I51-L55 WeakPolarHBondContact O-CB 3.17Å; I51-L55 VanDerWaalsContact O-CG 3.28Å; I51-L55 WeakPolarHBondContact O-CG 3.39Å; I51-L55 PolarHBondContact O-N 2.83Å; I51-L79 HydrophobicContact CG2-CD2 4Å; I51-L83 HydrophobicContact CD1-CD2 4.47Å
52	L	95.5	Very high	95.1	Very high	13 Å²	13	64.4 Å²	64.4	7%	0.068	29%	0.293	C	S	.	.	H	α-helix	trans	-64.8	-38.5	-179.7	-68.6	177	0	0	0	112.2	I48 N49 E50 L55 D56 Y76 Y94 F95	I48-L52 HydrophobicContact CG2-CD1 3.94Å; I48-L52 HydrophobicContact CG2-CG 4.44Å; I48-L52 WeakPolarHBondContact O-CB 3.49Å; I48-L52 VanDerWaalsContact O-CG 3.32Å; I48-L52 WeakPolarHBondContact O-CG 3.25Å; I48-L52 PolarHBondContact O-N 3.35Å; N49-L52 PolarHBondContact O-N 3.1Å; E50-L52 VanDerWaalsContact C-N 3.35Å; E50-L52 PolarHBondContact O-N 3.41Å; L52-L55 PolarHBondContact O-N 3.47Å; L52-D56 PolarHBondContact O-N 2.77Å; L52-Y76 HydrophobicContact CD2-CE1 4.16Å; L52-Y94 WeakPolarHBondContact CD1-O 3.48Å; L52-F95 HydrophobicContact CD1-CD2 3.9Å; L52-F95 HydrophobicContact CD1-CE2 3.92Å; L52-F95 HydrophobicContact CD1-CG 4.44Å; L52-F95 HydrophobicContact CD1-CZ 4.47Å; L52-F95 HydrophobicContact CD2-CD1 4.18Å; L52-F95 HydrophobicContact CD2-CD2 4.45Å; L52-F95 HydrophobicContact CD2-CE1 3.85Å; L52-F95 HydrophobicContact CD2-CE2 4.14Å; L52-F95 HydrophobicContact CD2-CG 4.49Å; L52-F95 HydrophobicContact CD2-CZ 3.85Å; L52-F95 HydrophobicContact CG-CE2 4.44Å
53	H	95.1	Very high	95.2	Very high	97 Å²	97	60.7 Å²	60.7	45%	0.449	29%	0.288	S	S	.	.	H	α-helix	trans	-62	-49.1	175.6	178.2	67.7	0	0	0	111.5	N49 E50 I51 L55 D56 Q57	N49-H53 VanDerWaalsContact O-CB 3.27Å; N49-H53 WeakPolarHBondContact O-CB 3.29Å; N49-H53 PolarHBondContact O-N 3.16Å; E50-H53 PolarHBondContact O-N 3.02Å; I51-H53 VanDerWaalsContact C-N 3.34Å; I51-H53 PolarHBondContact O-N 3.36Å; H53-L55 VanDerWaalsContact C-N 3.33Å; H53-L55 PolarHBondContact O-N 3.2Å; H53-D56 PolarHBondContact O-N 3.27Å; H53-Q57 WeakPolarHBondContact O-CG 3.48Å; H53-Q57 PolarHBondContact O-N 3.45Å; H53-Q57 VanDerWaalsContact O-N 3.13Å
54	Q	95.4	Very high	95.2	Very high	76 Å²	76	59.8 Å²	59.8	36%	0.355	28%	0.283	S	S	.	.	H	α-helix	trans	-61.7	-42.3	178	-67.6	-61.6	-26.2	0	0	111.2	E50 I51 D56 Q57 F58	E50-Q54 HydrophobicContact CG-CG 4.5Å; E50-Q54 VanDerWaalsContact O-CG 3.32Å; E50-Q54 WeakPolarHBondContact O-CG 3.25Å; E50-Q54 PolarHBondContact O-N 3.17Å; E50-Q54 WeakPolarHBondContact OE1-CG 3.49Å; E50-Q54 PolarHBondContact OE1-NE2 3.3Å; I51-Q54 PolarHBondContact O-N 3.27Å; Q54-D56 PolarHBondContact O-N 2.9Å; Q54-Q57 WeakPolarHBondContact O-CB 3.37Å; Q54-Q57 PolarHBondContact O-N 2.92Å; Q54-F58 HydrophobicContact CB-CD2 4.31Å; Q54-F58 HydrophobicContact CB-CE2 4.06Å; Q54-F58 WeakPolarHBondContact O-CD2 3.43Å; Q54-F58 PolarHBondContact O-N 3.37Å
55	L	94.7	Very high	95.2	Very high	20 Å²	20	60.9 Å²	60.9	11%	0.105	29%	0.291	C	S	.	.	H	α-helix	trans	-61.2	-43.1	177	-72.8	173.2	0	0	0	112.7	W16 I51 L52 H53 Q57 F58 I59 Y76 L79	W16-L55 HydrophobicContact CH2-CD2 3.63Å; W16-L55 HydrophobicContact CZ3-CD2 3.66Å; I51-L55 HydrophobicContact CG2-CD1 3.92Å; I51-L55 HydrophobicContact CG2-CG 4.46Å; I51-L55 WeakPolarHBondContact O-CB 3.17Å; I51-L55 VanDerWaalsContact O-CG 3.28Å; I51-L55 WeakPolarHBondContact O-CG 3.39Å; I51-L55 PolarHBondContact O-N 2.83Å; L52-L55 PolarHBondContact O-N 3.47Å; H53-L55 VanDerWaalsContact C-N 3.33Å; H53-L55 PolarHBondContact O-N 3.2Å; L55-Q57 VanDerWaalsContact C-N 3.31Å; L55-Q57 PolarHBondContact O-N 2.97Å; L55-F58 PolarHBondContact O-N 3.49Å; L55-I59 WeakPolarHBondContact O-CB 3.41Å; L55-I59 WeakPolarHBondContact O-CD1 3.38Å; L55-I59 VanDerWaalsContact O-CG1 3.25Å; L55-I59 WeakPolarHBondContact O-CG1 3.27Å; L55-I59 PolarHBondContact O-N 3.16Å; L55-Y76 HydrophobicContact CD1-CE1 4.15Å; L55-L79 HydrophobicContact CD1-CD2 3.37Å
56	D	94.1	Very high	95.1	Very high	17 Å²	17	63.4 Å²	63.4	9%	0.091	30%	0.298	C	S	.	.	H	α-helix	trans	-58.2	-45.4	174.7	-169.7	19.2	0	0	0	110.6	L52 H53 Q54 F58 I59 Q60 R97 I101	L52-D56 PolarHBondContact O-N 2.77Å; H53-D56 PolarHBondContact O-N 3.27Å; Q54-D56 PolarHBondContact O-N 2.9Å; D56-F58 PolarHBondContact O-N 3.4Å; D56-I59 PolarHBondContact O-N 2.96Å; D56-Q60 WeakPolarHBondContact O-CG 3.44Å; D56-Q60 PolarHBondContact O-N 3.49Å; D56-Q60 VanDerWaalsContact O-N 3.16Å; D56-Q60 PolarHBondContact OD1-NE2 3.2Å; D56-Q60 VanDerWaalsContact OD1-NE2 3.13Å; D56-R97 IonicContact OD2-CZ 3.56Å; D56-R97 IonicContact OD2-NE 3.59Å; D56-R97 PolarHBondContact OD2-NE 2.73Å; D56-R97 IonicContact OD2-NH2 2.77Å; D56-R97 PolarHBondContact OD2-NH2 2.98Å; D56-I101 WeakPolarHBondContact OD1-CD1 3.3Å
57	Q	94.8	Very high	94.9	Very high	67 Å²	67	61.4 Å²	61.4	31%	0.313	29%	0.285	S	S	.	.	H	α-helix	trans	-62.1	-39.1	176.4	-65.8	-61.9	-39.4	0	0	113	H53 Q54 L55 R61	H53-Q57 WeakPolarHBondContact O-CG 3.48Å; H53-Q57 PolarHBondContact O-N 3.45Å; H53-Q57 VanDerWaalsContact O-N 3.13Å; Q54-Q57 WeakPolarHBondContact O-CB 3.37Å; Q54-Q57 PolarHBondContact O-N 2.92Å; L55-Q57 VanDerWaalsContact C-N 3.31Å; L55-Q57 PolarHBondContact O-N 2.97Å; Q57-R61 WeakPolarHBondContact O-CG 3.34Å
58	F	94.2	Very high	94.8	Very high	110 Å²	110	60.8 Å²	60.8	48%	0.482	29%	0.287	S	S	.	.	H	α-helix	trans	-69.1	-43	177.5	-75.7	-60.2	0	0	0	112	Q54 L55 D56 Q60 R61 K62	Q54-F58 HydrophobicContact CB-CD2 4.31Å; Q54-F58 HydrophobicContact CB-CE2 4.06Å; Q54-F58 WeakPolarHBondContact O-CD2 3.43Å; Q54-F58 PolarHBondContact O-N 3.37Å; L55-F58 PolarHBondContact O-N 3.49Å; D56-F58 PolarHBondContact O-N 3.4Å; F58-Q60 VanDerWaalsContact C-N 3.31Å; F58-Q60 PolarHBondContact O-N 3.37Å; F58-R61 PolarHBondContact O-N 3.19Å; F58-R61 VanDerWaalsContact O-N 3.1Å; F58-K62 WeakPolarHBondContact O-CG 3.45Å
59	I	95.2	Very high	94.8	Very high	7 Å²	7	60.8 Å²	60.8	4%	0.036	29%	0.286	C	S	.	.	H	α-helix	trans	-60.5	-42.1	-179.9	-72.9	161.3	0	0	0	111.1	L55 D56 R61 K62 F64 L72 Y76 I101 L105 L135	L55-I59 WeakPolarHBondContact O-CB 3.41Å; L55-I59 WeakPolarHBondContact O-CD1 3.38Å; L55-I59 VanDerWaalsContact O-CG1 3.25Å; L55-I59 WeakPolarHBondContact O-CG1 3.27Å; L55-I59 PolarHBondContact O-N 3.16Å; D56-I59 PolarHBondContact O-N 2.96Å; I59-R61 PolarHBondContact O-N 3.19Å; I59-K62 PolarHBondContact O-N 3.16Å; I59-F64 HydrophobicContact CG2-CE2 3.97Å; I59-F64 HydrophobicContact CG2-CZ 4.05Å; I59-L72 HydrophobicContact CD1-CD1 4.11Å; I59-L72 HydrophobicContact CD1-CD2 4.06Å; I59-L72 HydrophobicContact CG1-CD1 4.19Å; I59-L72 HydrophobicContact CG1-CD2 4.2Å; I59-Y76 HydrophobicContact CD1-CE2 3.53Å; I59-Y76 WeakPolarHBondContact CD1-OH 3.21Å; I59-I101 HydrophobicContact CG2-CG2 4.19Å; I59-L105 HydrophobicContact CG2-CD1 4.24Å; I59-L135 HydrophobicContact CG2-CD1 4.01Å
60	Q	94.7	Very high	94.7	Very high	84 Å²	84	59.9 Å²	59.9	39%	0.393	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-13.3	178.9	-70.1	-179	31.4	0	0	114.1	D56 F58 I132	D56-Q60 WeakPolarHBondContact O-CG 3.44Å; D56-Q60 PolarHBondContact O-N 3.49Å; D56-Q60 VanDerWaalsContact O-N 3.16Å; D56-Q60 PolarHBondContact OD1-NE2 3.2Å; D56-Q60 VanDerWaalsContact OD1-NE2 3.13Å; F58-Q60 VanDerWaalsContact C-N 3.31Å; F58-Q60 PolarHBondContact O-N 3.37Å; Q60-I132 HydrophobicContact CG-CD1 4.36Å
61	R	95.2	Very high	94.5	Very high	185 Å²	185	56.9 Å²	56.9	70%	0.698	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-0.1	177.4	-60	173.9	-173.1	178.9	3.4	113.3	Q57 F58 I59	Q57-R61 WeakPolarHBondContact O-CG 3.34Å; F58-R61 PolarHBondContact O-N 3.19Å; F58-R61 VanDerWaalsContact O-N 3.1Å; I59-R61 PolarHBondContact O-N 3.19Å
62	K	94.1	Very high	94.4	Very high	131 Å²	131	56.5 Å²	56.5	57%	0.57	27%	0.265	S	S	*	.			trans	-104.5	163.5	-176.7	-63.7	-71.3	-174.6	169.3	0	110.8	F58 I59 F64 L135	F58-K62 WeakPolarHBondContact O-CG 3.45Å; I59-K62 PolarHBondContact O-N 3.16Å; K62-F64 HydrophobicContact CB-CD2 4.47Å; K62-F64 HydrophobicContact CB-CE2 3.69Å; K62-F64 HydrophobicContact CB-CZ 3.74Å; K62-F64 HydrophobicContact CG-CZ 4.48Å; K62-L135 WeakPolarHBondContact O-CD2 3.47Å
63	S	95.4	Very high	94.4	Very high	61 Å²	61	58.7 Å²	58.7	43%	0.427	28%	0.275	S	S	.	.			trans	-123.9	138.8	166.8	60	0	0	0	0	109	L135 R137	S63-L135 CarbonylContact C-O 3.52Å; S63-L135 VanDerWaalsContact CA-O 3.31Å; S63-L135 WeakPolarHBondContact CA-O 3.41Å; S63-R137 PolarHBondContact O-NH2 3.34Å; S63-R137 PolarHBondContact OG-NE 3.45Å; S63-R137 PolarHBondContact OG-NH2 2.95Å; S63-R137 VanDerWaalsContact OG-NH2 3.13Å
64	F	95.1	Very high	94.3	Very high	20 Å²	20	59.4 Å²	59.4	9%	0.088	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-115.2	135.5	-169.5	-64.6	-88.6	0	0	0	111.1	I59 K62 L72 L105 L135 R137	I59-F64 HydrophobicContact CG2-CE2 3.97Å; I59-F64 HydrophobicContact CG2-CZ 4.05Å; K62-F64 HydrophobicContact CB-CD2 4.47Å; K62-F64 HydrophobicContact CB-CE2 3.69Å; K62-F64 HydrophobicContact CB-CZ 3.74Å; K62-F64 HydrophobicContact CG-CZ 4.48Å; F64-L72 HydrophobicContact CE1-CB 4.23Å; F64-L72 HydrophobicContact CE1-CD2 3.78Å; F64-L72 HydrophobicContact CE1-CG 4.41Å; F64-L72 HydrophobicContact CZ-CD2 3.86Å; F64-L105 HydrophobicContact CD2-CD1 4.13Å; F64-L105 HydrophobicContact CD2-CD2 4.03Å; F64-L105 HydrophobicContact CE2-CD1 4.05Å; F64-L105 HydrophobicContact CG-CD1 4.49Å; F64-L105 HydrophobicContact CZ-CD1 4.34Å; F64-L135 HydrophobicContact CD2-CB 3.91Å; F64-L135 HydrophobicContact CE2-CB 4.35Å; F64-L135 HydrophobicContact CE2-CD1 4.27Å; F64-L135 PolarHBondContact N-O 3.07Å; F64-R137 PolarHBondContact O-N 3.03Å
65	S	94.4	Very high	94.3	Very high	24 Å²	24	56.4 Å²	56.4	17%	0.168	26%	0.263	C	S	.	.			trans	-77.2	168.5	153.5	61.3	0	0	0	0	109.2	D8 F67 G68 A69	D8-S65 PolarHBondContact OD1-OG 2.83Å; D8-S65 PolarHBondContact OD2-OG 2.93Å; S65-F67 PolarHBondContact O-N 3.43Å; S65-G68 PolarHBondContact O-N 3.27Å; S65-G68 PolarHBondContact OG-N 3.41Å; S65-A69 PolarHBondContact O-N 2.96Å
66	R	93.5	Very high	94.2	Very high	78 Å²	78	55.6 Å²	55.6	29%	0.294	26%	0.258	S	S	.	.	H	α-helix	trans	-55.9	-42	170.2	180	58.6	165.4	137.2	-14.9	111.4	A69 I70 N106 D108	R66-A69 PolarHBondContact O-N 3.36Å; R66-I70 HydrophobicContact CG-CD1 4.42Å; R66-I70 WeakPolarHBondContact O-CG1 3.39Å; R66-I70 PolarHBondContact O-N 2.89Å; R66-N106 VanDerWaalsContact NH1-C 3.31Å; R66-N106 VanDerWaalsContact NH1-CG 3.35Å; R66-N106 PolarHBondContact NH1-O 3.42Å; R66-N106 PolarHBondContact NH1-OD1 3.31Å; R66-N106 PolarHBondContact NH2-O 2.96Å; R66-D108 IonicContact CZ-OD1 3.41Å; R66-D108 VanDerWaalsContact CZ-OD1 3.26Å; R66-D108 IonicContact NE-OD1 2.81Å; R66-D108 PolarHBondContact NE-OD1 3.2Å; R66-D108 IonicContact NH2-OD1 3.13Å; R66-D108 PolarHBondContact NH2-OD1 2.96Å; R66-D108 IonicContact NH2-OD2 2.78Å
67	F	92.5	Very high	94.2	Very high	75 Å²	75	59.2 Å²	59.2	33%	0.329	28%	0.275	S	S	.	.	H	α-helix	trans	-64	-46.9	177	-177.3	-88.9	0	0	0	111.9	D8 A12 S65 A69 I70 Q71	D8-F67 HydrophobicContact CB-CB 4.28Å; D8-F67 HydrophobicContact CB-CD1 3.49Å; D8-F67 VanDerWaalsContact CB-CD1 3.49Å; D8-F67 HydrophobicContact CB-CE1 4.02Å; D8-F67 HydrophobicContact CB-CG 3.93Å; D8-F67 WeakPolarHBondContact O-CE1 3Å; A12-F67 HydrophobicContact CB-CE1 3.74Å; A12-F67 HydrophobicContact CB-CZ 3.61Å; S65-F67 PolarHBondContact O-N 3.43Å; F67-A69 VanDerWaalsContact C-N 3.26Å; F67-A69 PolarHBondContact O-N 3.33Å; F67-I70 WeakPolarHBondContact O-CB 3.45Å; F67-I70 PolarHBondContact O-N 2.89Å; F67-I70 VanDerWaalsContact O-N 3.08Å; F67-Q71 PolarHBondContact O-N 3.45Å
68	G	93.3	Very high	94.2	Very high	18 Å²	18	59.9 Å²	59.9	19%	0.186	28%	0.28	C	S	.	.	H	α-helix	trans	-60.1	-34.6	177.6	0	0	0	0	0	113.3	S65 Q71 L72	S65-G68 PolarHBondContact O-N 3.27Å; S65-G68 PolarHBondContact OG-N 3.41Å; G68-Q71 PolarHBondContact O-N 2.99Å; G68-L72 WeakPolarHBondContact O-CB 3.39Å; G68-L72 PolarHBondContact O-N 3.29Å
69	A	95.1	Very high	94.2	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-67.4	-38.7	173.8	0	0	0	0	0	112.8	S65 R66 F67 L72 E73 L105 N106	S65-A69 PolarHBondContact O-N 2.96Å; R66-A69 PolarHBondContact O-N 3.36Å; F67-A69 VanDerWaalsContact C-N 3.26Å; F67-A69 PolarHBondContact O-N 3.33Å; A69-L72 PolarHBondContact O-N 3.21Å; A69-E73 PolarHBondContact O-N 3.05Å; A69-E73 VanDerWaalsContact O-N 3.12Å; A69-L105 HydrophobicContact CB-CB 3.83Å; A69-L105 WeakPolarHBondContact CB-O 3.04Å; A69-N106 VanDerWaalsContact CB-OD1 3.26Å; A69-N106 WeakPolarHBondContact CB-OD1 3.47Å; A69-N106 PolarHBondContact O-ND2 3.41Å
70	I	94.1	Very high	94.2	Very high	62 Å²	62	57.3 Å²	57.3	32%	0.318	27%	0.269	S	S	.	.	H	α-helix	trans	-66	-41.4	175.1	-67.1	167.7	0	0	0	110.3	R66 F67 E73 K74 N106	R66-I70 HydrophobicContact CG-CD1 4.42Å; R66-I70 WeakPolarHBondContact O-CG1 3.39Å; R66-I70 PolarHBondContact O-N 2.89Å; F67-I70 WeakPolarHBondContact O-CB 3.45Å; F67-I70 PolarHBondContact O-N 2.89Å; F67-I70 VanDerWaalsContact O-N 3.08Å; I70-E73 PolarHBondContact O-N 2.97Å; I70-K74 WeakPolarHBondContact O-CG 3.46Å; I70-K74 PolarHBondContact O-N 3.14Å; I70-K74 VanDerWaalsContact O-N 3.15Å; I70-N106 WeakPolarHBondContact CG1-OD1 2.98Å; I70-N106 PolarHBondContact N-OD1 3.21Å; I70-N106 VanDerWaalsContact N-OD1 3.14Å
71	Q	92.9	Very high	94.2	Very high	30 Å²	30	56.3 Å²	56.3	14%	0.14	28%	0.275	C	S	.	.	H	α-helix	trans	-62.9	-45.9	177.5	-178.1	58.8	23.9	0	0	111.3	F67 G68 E73 K74 E75	F67-Q71 PolarHBondContact O-N 3.45Å; G68-Q71 PolarHBondContact O-N 2.99Å; Q71-E73 VanDerWaalsContact C-N 3.31Å; Q71-E73 PolarHBondContact O-N 3.1Å; Q71-K74 WeakPolarHBondContact O-CB 3.48Å; Q71-K74 PolarHBondContact O-N 2.76Å; Q71-K74 VanDerWaalsContact O-N 3.16Å; Q71-E75 WeakPolarHBondContact CG-OE1 3.3Å; Q71-E75 PolarHBondContact NE2-OE1 3.01Å; Q71-E75 WeakPolarHBondContact O-CG 3.36Å; Q71-E75 PolarHBondContact O-N 3.03Å
72	L	93.9	Very high	94.2	Very high	12 Å²	12	48.3 Å²	48.3	6%	0.063	25%	0.245	C	C	.	.	H	α-helix	trans	-56.4	-43.5	175.4	-178.5	70.3	0	0	0	112.2	I59 F64 G68 A69 K74 E75 Y76 L105	I59-L72 HydrophobicContact CD1-CD1 4.11Å; I59-L72 HydrophobicContact CD1-CD2 4.06Å; I59-L72 HydrophobicContact CG1-CD1 4.19Å; I59-L72 HydrophobicContact CG1-CD2 4.2Å; F64-L72 HydrophobicContact CE1-CB 4.23Å; F64-L72 HydrophobicContact CE1-CD2 3.78Å; F64-L72 HydrophobicContact CE1-CG 4.41Å; F64-L72 HydrophobicContact CZ-CD2 3.86Å; G68-L72 WeakPolarHBondContact O-CB 3.39Å; G68-L72 PolarHBondContact O-N 3.29Å; A69-L72 PolarHBondContact O-N 3.21Å; L72-K74 PolarHBondContact O-N 2.82Å; L72-E75 WeakPolarHBondContact CA-OE2 3.41Å; L72-E75 PolarHBondContact O-N 3.44Å; L72-Y76 HydrophobicContact CD1-CD2 4.1Å; L72-Y76 HydrophobicContact CD1-CE2 3.9Å; L72-Y76 HydrophobicContact CD2-CE2 4.37Å; L72-Y76 HydrophobicContact CG-CD2 3.97Å; L72-Y76 HydrophobicContact CG-CE2 4Å; L72-Y76 WeakPolarHBondContact O-CD2 3.28Å; L72-Y76 PolarHBondContact O-N 3.42Å; L72-L105 HydrophobicContact CD2-CD1 3.6Å
73	E	95.3	Very high	94.3	Very high	58 Å²	58	42.1 Å²	42.1	27%	0.271	22%	0.218	S	C	.	.	H	α-helix	trans	-62.7	-42.1	178.3	-179.5	169.4	-144	0	0	112	A69 I70 Q71 E75 Y76 H77 C102 N106	A69-E73 PolarHBondContact O-N 3.05Å; A69-E73 VanDerWaalsContact O-N 3.12Å; I70-E73 PolarHBondContact O-N 2.97Å; Q71-E73 VanDerWaalsContact C-N 3.31Å; Q71-E73 PolarHBondContact O-N 3.1Å; E73-E75 VanDerWaalsContact C-N 3.32Å; E73-E75 PolarHBondContact O-N 2.94Å; E73-Y76 PolarHBondContact O-N 3.45Å; E73-H77 PolarHBondContact O-CD2 3.44Å; E73-H77 PolarHBondContact O-N 3.32Å; E73-C102 HydrophobicContact CB-CB 4.17Å; E73-C102 HydrophobicContact CG-CB 4.28Å; E73-N106 WeakPolarHBondContact CB-ND2 3.45Å; E73-N106 PolarHBondContact OE2-ND2 3.25Å
74	K	93.6	Very high	94.3	Very high	112 Å²	112	42 Å²	42	49%	0.487	22%	0.215	S	C	.	.	H	α-helix	trans	-60.4	-42.5	174.5	-69.4	175.6	-177.5	174.2	0	111.9	I70 Q71 L72 H77 N78	I70-K74 WeakPolarHBondContact O-CG 3.46Å; I70-K74 PolarHBondContact O-N 3.14Å; I70-K74 VanDerWaalsContact O-N 3.15Å; Q71-K74 WeakPolarHBondContact O-CB 3.48Å; Q71-K74 PolarHBondContact O-N 2.76Å; Q71-K74 VanDerWaalsContact O-N 3.16Å; L72-K74 PolarHBondContact O-N 2.82Å; K74-H77 PolarHBondContact O-N 3.16Å; K74-N78 PolarHBondContact O-N 3.31Å
75	E	93.6	Very high	94.2	Very high	13 Å²	13	45.3 Å²	45.3	6%	0.061	24%	0.241	C	C	.	.	H	α-helix	trans	-64.2	-41.6	178.4	-67.5	160.6	168.1	0	0	111.4	W16 I17 Q71 L72 E73 H77 N78 L79	W16-E75 VanDerWaalsContact CE2-OE2 3.28Å; W16-E75 HydrophobicContact CH2-CB 4.48Å; W16-E75 HydrophobicContact CZ2-CB 3.71Å; W16-E75 HydrophobicContact CZ2-CG 4.09Å; W16-E75 WeakPolarHBondContact CZ2-OE2 3.39Å; W16-E75 PolarHBondContact NE1-OE1 3.25Å; W16-E75 PolarHBondContact NE1-OE2 3.2Å; I17-E75 HydrophobicContact CB-CB 4.18Å; I17-E75 HydrophobicContact CB-CG 4.26Å; I17-E75 HydrophobicContact CG1-CB 4.32Å; I17-E75 HydrophobicContact CG2-CB 4.32Å; I17-E75 HydrophobicContact CG2-CG 4.05Å; Q71-E75 WeakPolarHBondContact CG-OE1 3.3Å; Q71-E75 PolarHBondContact NE2-OE1 3.01Å; Q71-E75 WeakPolarHBondContact O-CG 3.36Å; Q71-E75 PolarHBondContact O-N 3.03Å; L72-E75 WeakPolarHBondContact CA-OE2 3.41Å; L72-E75 PolarHBondContact O-N 3.44Å; E73-E75 VanDerWaalsContact C-N 3.32Å; E73-E75 PolarHBondContact O-N 2.94Å; E75-H77 VanDerWaalsContact C-N 3.32Å; E75-H77 PolarHBondContact O-N 3.46Å; E75-N78 PolarHBondContact O-N 2.89Å; E75-L79 WeakPolarHBondContact O-CB 3.32Å; E75-L79 PolarHBondContact O-N 2.96Å
76	Y	94	Very high	94.1	Very high	3 Å²	3	45.3 Å²	45.3	1%	0.012	24%	0.238	C	C	.	.	H	α-helix	trans	-61.3	-38.9	172.1	-94	-71.6	0	0	0	112.9	L52 L55 I59 L72 E73 L79 F80 F95 S98 C102	L52-Y76 HydrophobicContact CD2-CE1 4.16Å; L55-Y76 HydrophobicContact CD1-CE1 4.15Å; I59-Y76 HydrophobicContact CD1-CE2 3.53Å; I59-Y76 WeakPolarHBondContact CD1-OH 3.21Å; L72-Y76 HydrophobicContact CD1-CD2 4.1Å; L72-Y76 HydrophobicContact CD1-CE2 3.9Å; L72-Y76 HydrophobicContact CD2-CE2 4.37Å; L72-Y76 HydrophobicContact CG-CD2 3.97Å; L72-Y76 HydrophobicContact CG-CE2 4Å; L72-Y76 WeakPolarHBondContact O-CD2 3.28Å; L72-Y76 PolarHBondContact O-N 3.42Å; E73-Y76 PolarHBondContact O-N 3.45Å; Y76-L79 PolarHBondContact O-N 3.47Å; Y76-F80 VanDerWaalsContact O-CB 3.24Å; Y76-F80 WeakPolarHBondContact O-CB 3.39Å; Y76-F80 PolarHBondContact O-N 3.03Å; Y76-F95 HydrophobicContact CD1-CD1 4.4Å; Y76-F95 HydrophobicContact CD1-CE1 4.26Å; Y76-S98 VanDerWaalsContact CE1-CB 3.43Å; Y76-C102 WeakPolarHBondContact CD2-SG 3.35Å
77	H	93.7	Very high	94.1	Very high	93 Å²	93	42.3 Å²	42.3	43%	0.431	23%	0.229	S	C	.	.	H	α-helix	trans	-65.6	-41.1	175.1	-75.5	-58.3	0	0	0	112.3	E73 K74 E75 F80 A81	E73-H77 PolarHBondContact O-CD2 3.44Å; E73-H77 PolarHBondContact O-N 3.32Å; K74-H77 PolarHBondContact O-N 3.16Å; E75-H77 VanDerWaalsContact C-N 3.32Å; E75-H77 PolarHBondContact O-N 3.46Å; H77-F80 PolarHBondContact O-N 2.95Å; H77-A81 WeakPolarHBondContact O-CB 3.24Å; H77-A81 PolarHBondContact O-N 3.31Å
78	N	93.8	Very high	94	Very high	82 Å²	82	47.3 Å²	47.3	44%	0.439	25%	0.247	S	C	.	.	H	α-helix	trans	-63	-45.4	175.2	-71.2	-10.6	0	0	0	111.3	I17 K74 E75 A81 Y82	I17-N78 HydrophobicContact CG1-CB 4.5Å; K74-N78 PolarHBondContact O-N 3.31Å; E75-N78 PolarHBondContact O-N 2.89Å; N78-A81 PolarHBondContact O-N 3.38Å; N78-Y82 PolarHBondContact O-N 3.21Å
79	L	95.3	Very high	93.8	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.8	-44.6	175.7	-175.5	56.4	0	0	0	111.9	I17 I21 I51 L55 E75 Y76 A81 Y82 L83 F95	I17-L79 HydrophobicContact CD1-CB 3.7Å; I17-L79 HydrophobicContact CD1-CD1 4.18Å; I17-L79 HydrophobicContact CD1-CD2 4.13Å; I17-L79 HydrophobicContact CD1-CG 4.19Å; I17-L79 HydrophobicContact CG1-CB 4.27Å; I21-L79 HydrophobicContact CG1-CD1 4.49Å; I51-L79 HydrophobicContact CG2-CD2 4Å; L55-L79 HydrophobicContact CD1-CD2 3.37Å; E75-L79 WeakPolarHBondContact O-CB 3.32Å; E75-L79 PolarHBondContact O-N 2.96Å; Y76-L79 PolarHBondContact O-N 3.47Å; L79-A81 VanDerWaalsContact C-N 3.34Å; L79-A81 PolarHBondContact O-N 2.95Å; L79-Y82 PolarHBondContact O-N 3.13Å; L79-L83 HydrophobicContact CD1-CD1 3.9Å; L79-L83 HydrophobicContact CD1-CD2 4.49Å; L79-L83 HydrophobicContact CD1-CG 3.92Å; L79-L83 HydrophobicContact CG-CD1 3.95Å; L79-L83 HydrophobicContact CG-CG 4.3Å; L79-L83 WeakPolarHBondContact O-CB 3.44Å; L79-L83 WeakPolarHBondContact O-CG 3.45Å; L79-L83 PolarHBondContact O-N 3.41Å; L79-F95 HydrophobicContact CG-CZ 4.36Å
80	F	95.3	Very high	93.8	Very high	62 Å²	62	54 Å²	54	27%	0.272	29%	0.286	S	S	.	.	H	α-helix	trans	-60.6	-43.8	178	-179	-111	0	0	0	111.7	Y76 H77 T84 L91 F95	Y76-F80 VanDerWaalsContact O-CB 3.24Å; Y76-F80 WeakPolarHBondContact O-CB 3.39Å; Y76-F80 PolarHBondContact O-N 3.03Å; H77-F80 PolarHBondContact O-N 2.95Å; F80-T84 VanDerWaalsContact O-CB 3.23Å; F80-T84 WeakPolarHBondContact O-CB 3.27Å; F80-T84 PolarHBondContact O-N 3.13Å; F80-T84 PolarHBondContact O-OG1 3.47Å; F80-L91 HydrophobicContact CE2-CB 3.89Å; F80-F95 HydrophobicContact CB-CD1 3.92Å; F80-F95 HydrophobicContact CB-CE1 3.58Å; F80-F95 HydrophobicContact CB-CZ 3.98Å; F80-F95 HydrophobicContact CD2-CB 4.06Å; F80-F95 AromaticContact CD2-CD1 3.65Å; F80-F95 HydrophobicContact CD2-CD1 3.65Å; F80-F95 AromaticContact CD2-CD2 3.48Å; F80-F95 HydrophobicContact CD2-CD2 3.48Å; F80-F95 VanDerWaalsContact CD2-CD2 3.48Å; F80-F95 AromaticContact CD2-CE1 3.84Å; F80-F95 HydrophobicContact CD2-CE1 3.84Å; F80-F95 AromaticContact CD2-CE2 3.68Å; F80-F95 HydrophobicContact CD2-CE2 3.68Å; F80-F95 AromaticContact CD2-CG 3.44Å; F80-F95 HydrophobicContact CD2-CG 3.44Å; F80-F95 VanDerWaalsContact CD2-CG 3.44Å; F80-F95 AromaticContact CD2-CZ 3.84Å; F80-F95 HydrophobicContact CD2-CZ 3.84Å; F80-F95 HydrophobicContact CE2-CB 4.22Å; F80-F95 AromaticContact CE2-CD2 3.91Å; F80-F95 HydrophobicContact CE2-CD2 3.91Å; F80-F95 HydrophobicContact CE2-CE2 4.4Å; F80-F95 AromaticContact CE2-CG 4Å; F80-F95 HydrophobicContact CE2-CG 4Å; F80-F95 HydrophobicContact CG-CD1 4.17Å; F80-F95 HydrophobicContact CG-CE1 4.2Å; F80-F95 HydrophobicContact CG-CG 4.37Å; F80-F95 HydrophobicContact CG-CZ 4.43Å
81	A	94.7	Very high	93.8	Very high	63 Å²	63	51.1 Å²	51.1	52%	0.521	27%	0.271	S	S	.	.	H	α-helix	trans	-61.8	-46.4	177.4	0	0	0	0	0	111.3	H77 N78 L79 S85	H77-A81 WeakPolarHBondContact O-CB 3.24Å; H77-A81 PolarHBondContact O-N 3.31Å; N78-A81 PolarHBondContact O-N 3.38Å; L79-A81 VanDerWaalsContact C-N 3.34Å; L79-A81 PolarHBondContact O-N 2.95Å; A81-S85 PolarHBondContact O-N 3.2Å; A81-S85 VanDerWaalsContact O-N 3.11Å
82	Y	95.4	Very high	93.8	Very high	17 Å²	17	58.4 Å²	58.4	7%	0.067	30%	0.297	C	S	.	.	H	α-helix	trans	-62.1	-52.7	176	168.3	-106.8	0	0	0	112.3	I21 T24 E25 N78 L79 T84 S85 I86	I21-Y82 HydrophobicContact CB-CD1 4.27Å; I21-Y82 HydrophobicContact CB-CG 4.3Å; I21-Y82 HydrophobicContact CD1-CG 4.23Å; I21-Y82 HydrophobicContact CG1-CD1 3.78Å; I21-Y82 HydrophobicContact CG1-CE1 4.46Å; I21-Y82 HydrophobicContact CG1-CG 3.85Å; I21-Y82 HydrophobicContact CG2-CD1 3.96Å; I21-Y82 HydrophobicContact CG2-CD2 3.51Å; I21-Y82 HydrophobicContact CG2-CE1 4.15Å; I21-Y82 HydrophobicContact CG2-CE2 3.72Å; I21-Y82 HydrophobicContact CG2-CG 3.63Å; T24-Y82 HydrophobicContact CG2-CE1 3.74Å; E25-Y82 HydrophobicContact CG-CE2 3.58Å; E25-Y82 WeakPolarHBondContact CG-OH 3.47Å; E25-Y82 PolarHBondContact N-OH 3.37Å; E25-Y82 WeakPolarHBondContact OE1-CE2 3.45Å; N78-Y82 PolarHBondContact O-N 3.21Å; L79-Y82 PolarHBondContact O-N 3.13Å; Y82-T84 VanDerWaalsContact C-N 3.27Å; Y82-T84 PolarHBondContact O-N 3.22Å; Y82-S85 WeakPolarHBondContact O-CA 3.49Å; Y82-S85 WeakPolarHBondContact O-CB 3.38Å; Y82-S85 PolarHBondContact O-N 3.37Å; Y82-S85 PolarHBondContact O-OG 3.26Å; Y82-I86 HydrophobicContact CE1-CD1 4.01Å; Y82-I86 HydrophobicContact CE2-CG2 3.98Å; Y82-I86 PolarHBondContact O-N 3.11Å
83	L	95.2	Very high	93.7	Very high	1 Å²	1	63.5 Å²	63.5	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-62.5	-36.1	-177.8	-69	-177.7	0	0	0	112	I48 I51 L79 S85 I86 S87 L91 F95	I48-L83 HydrophobicContact CB-CD1 4.37Å; I48-L83 HydrophobicContact CD1-CB 4.33Å; I48-L83 HydrophobicContact CG1-CB 4.23Å; I48-L83 HydrophobicContact CG1-CD1 3.82Å; I48-L83 HydrophobicContact CG1-CD2 3.87Å; I48-L83 HydrophobicContact CG1-CG 4.18Å; I48-L83 HydrophobicContact CG2-CD1 4.13Å; I51-L83 HydrophobicContact CD1-CD2 4.47Å; L79-L83 HydrophobicContact CD1-CD1 3.9Å; L79-L83 HydrophobicContact CD1-CD2 4.49Å; L79-L83 HydrophobicContact CD1-CG 3.92Å; L79-L83 HydrophobicContact CG-CD1 3.95Å; L79-L83 HydrophobicContact CG-CG 4.3Å; L79-L83 WeakPolarHBondContact O-CB 3.44Å; L79-L83 WeakPolarHBondContact O-CG 3.45Å; L79-L83 PolarHBondContact O-N 3.41Å; L83-S85 VanDerWaalsContact C-N 3.27Å; L83-S85 PolarHBondContact O-N 2.95Å; L83-I86 HydrophobicContact CD2-CD1 3.95Å; L83-I86 VanDerWaalsContact O-CG1 3.24Å; L83-I86 WeakPolarHBondContact O-CG1 3.35Å; L83-I86 PolarHBondContact O-N 3.38Å; L83-S87 PolarHBondContact O-N 3.33Å; L83-L91 VanDerWaalsContact C-CD1 3.43Å; L83-L91 HydrophobicContact CB-CD1 3.7Å; L83-L91 WeakPolarHBondContact O-CD1 3.38Å; L83-F95 HydrophobicContact CD1-CE2 4Å; L83-F95 HydrophobicContact CD1-CZ 3.7Å
84	T	94.8	Very high	93.6	Very high	59 Å²	59	64.6 Å²	64.6	36%	0.362	33%	0.327	S	S	.	.	H	α-helix	trans	-64.4	-33.1	173.3	-57.8	0	0	0	0	111.8	F80 Y82 I86	F80-T84 VanDerWaalsContact O-CB 3.23Å; F80-T84 WeakPolarHBondContact O-CB 3.27Å; F80-T84 PolarHBondContact O-N 3.13Å; F80-T84 PolarHBondContact O-OG1 3.47Å; Y82-T84 VanDerWaalsContact C-N 3.27Å; Y82-T84 PolarHBondContact O-N 3.22Å; T84-I86 VanDerWaalsContact C-N 3.25Å; T84-I86 PolarHBondContact O-N 2.85Å
85	S	94.5	Very high	93.7	Very high	90 Å²	90	59.3 Å²	59.3	63%	0.629	30%	0.304	S	S	*	.	H	α-helix	trans	-69.8	-20.7	178.8	79.7	0	0	0	0	114	A81 Y82 L83	A81-S85 PolarHBondContact O-N 3.2Å; A81-S85 VanDerWaalsContact O-N 3.11Å; Y82-S85 WeakPolarHBondContact O-CA 3.49Å; Y82-S85 WeakPolarHBondContact O-CB 3.38Å; Y82-S85 PolarHBondContact O-N 3.37Å; Y82-S85 PolarHBondContact O-OG 3.26Å; L83-S85 VanDerWaalsContact C-N 3.27Å; L83-S85 PolarHBondContact O-N 2.95Å
86	I	92.6	Very high	93.7	Very high	24 Å²	24	59.8 Å²	59.8	12%	0.123	31%	0.308	C	S	.	.	H	α-helix	trans	-108.4	-6.3	-177.2	64.2	164.8	0	0	0	114.2	L28 V44 Y82 L83 T84	L28-I86 HydrophobicContact CD1-CD1 3.62Å; V44-I86 HydrophobicContact CG1-CD1 4.04Å; V44-I86 HydrophobicContact CG1-CG1 4.08Å; Y82-I86 HydrophobicContact CE1-CD1 4.01Å; Y82-I86 HydrophobicContact CE2-CG2 3.98Å; Y82-I86 PolarHBondContact O-N 3.11Å; L83-I86 HydrophobicContact CD2-CD1 3.95Å; L83-I86 VanDerWaalsContact O-CG1 3.24Å; L83-I86 WeakPolarHBondContact O-CG1 3.35Å; L83-I86 PolarHBondContact O-N 3.38Å; T84-I86 VanDerWaalsContact C-N 3.25Å; T84-I86 PolarHBondContact O-N 2.85Å
87	S	92	Very high	93.8	Very high	15 Å²	15	62.9 Å²	62.9	11%	0.105	32%	0.32	C	S	.	.			trans	-109.9	143.7	-179.3	-172.7	0	0	0	0	111.5	L83 N89	L83-S87 PolarHBondContact O-N 3.33Å; S87-N89 VanDerWaalsContact C-N 3.33Å; S87-N89 PolarHBondContact OG-N 3.04Å
88	Y	90	Very high	93.9	Very high	180 Å²	180	58.8 Å²	58.8	71%	0.706	30%	0.302	S	S	*	.	S	Bend	trans	-83.7	-12.2	171.1	-66.9	-78.1	0	0	0	112.8	T37 D41	T37-Y88 HydrophobicContact CG2-CE2 3.85Å; D41-Y88 HydrophobicContact CB-CD2 4.12Å; D41-Y88 PolarHBondContact OD1-N 3.48Å
89	N	90.8	Very high	93.9	Very high	64 Å²	64	57.2 Å²	57.2	34%	0.342	29%	0.293	S	S	.	.	S	Bend	trans	-94.4	151.5	-176.9	-65.5	-87.9	0	0	0	111.5	D41 L45 S87 L91	D41-N89 PolarHBondContact OD1-ND2 3.2Å; D41-N89 VanDerWaalsContact OD1-ND2 3.09Å; D41-N89 PolarHBondContact OD2-ND2 3.36Å; L45-N89 HydrophobicContact CD2-CB 4.02Å; S87-N89 VanDerWaalsContact C-N 3.33Å; S87-N89 PolarHBondContact OG-N 3.04Å; N89-L91 PolarHBondContact O-N 2.84Å
90	S	93.9	Very high	93.9	Very high	93 Å²	93	57.5 Å²	57.5	65%	0.65	29%	0.294	S	S	*	.			trans	-66.4	119.7	167.1	176.4	0	0	0	0	110
91	L	94.4	Very high	94	Very high	2 Å²	2	54.6 Å²	54.6	1%	0.01	28%	0.281	C	S	.	.			trans	-91.3	4.9	-178.4	-57.6	-174	0	0	0	113.9	L45 I48 F80 L83 N89 D93 Y94 F95	L45-L91 HydrophobicContact CD2-CD2 4.03Å; I48-L91 HydrophobicContact CD1-CD1 3.65Å; I48-L91 HydrophobicContact CD1-CD2 3.76Å; I48-L91 HydrophobicContact CD1-CG 4.37Å; F80-L91 HydrophobicContact CE2-CB 3.89Å; L83-L91 VanDerWaalsContact C-CD1 3.43Å; L83-L91 HydrophobicContact CB-CD1 3.7Å; L83-L91 WeakPolarHBondContact O-CD1 3.38Å; N89-L91 PolarHBondContact O-N 2.84Å; L91-D93 VanDerWaalsContact C-N 3.32Å; L91-D93 PolarHBondContact O-N 3.16Å; L91-Y94 HydrophobicContact CD2-CD2 4.18Å; L91-Y94 HydrophobicContact CD2-CE2 4.45Å; L91-Y94 WeakPolarHBondContact O-CB 3.32Å; L91-Y94 PolarHBondContact O-N 3.08Å; L91-F95 HydrophobicContact CB-CD2 4.24Å; L91-F95 HydrophobicContact CB-CE2 4.41Å; L91-F95 HydrophobicContact CD1-CE2 4.5Å; L91-F95 PolarHBondContact O-N 3.49Å; L91-F95 VanDerWaalsContact O-N 3.16Å
92	R	92.5	Very high	94.1	Very high	183 Å²	183	51.6 Å²	51.6	69%	0.691	26%	0.256	S	S	*	.	H	α-helix	trans	-56.9	-44.6	-174.1	-176.2	-179.5	-66.6	-160.8	-0.6	112.6	F95 T96	R92-F95 PolarHBondContact O-N 2.93Å; R92-T96 PolarHBondContact O-N 3.05Å; R92-T96 VanDerWaalsContact O-N 3.09Å; R92-T96 PolarHBondContact O-OG1 2.98Å
93	D	92.7	Very high	94.1	Very high	120 Å²	120	55.7 Å²	55.7	64%	0.642	27%	0.272	S	S	*	.	H	α-helix	trans	-69.4	-37.2	-177.4	-69.9	-24.1	0	0	0	111.7	L91 F95 T96	L91-D93 VanDerWaalsContact C-N 3.32Å; L91-D93 PolarHBondContact O-N 3.16Å; D93-F95 VanDerWaalsContact C-N 3.32Å; D93-F95 PolarHBondContact O-N 3.2Å; D93-T96 WeakPolarHBondContact O-CB 3.44Å; D93-T96 PolarHBondContact O-N 2.93Å
94	Y	93.6	Very high	94.3	Very high	81 Å²	81	55.7 Å²	55.7	32%	0.318	27%	0.272	S	S	.	.	H	α-helix	trans	-59.4	-42.4	175.5	-64.5	-97.3	0	0	0	111.7	L45 I48 N49 L52 L91	L45-Y94 HydrophobicContact CD2-CE2 4.41Å; I48-Y94 HydrophobicContact CG2-CD1 4.46Å; N49-Y94 VanDerWaalsContact OD1-CD1 3.26Å; N49-Y94 WeakPolarHBondContact OD1-CD1 3.32Å; N49-Y94 WeakPolarHBondContact OD1-CE1 3.41Å; L52-Y94 WeakPolarHBondContact CD1-O 3.48Å; L91-Y94 HydrophobicContact CD2-CD2 4.18Å; L91-Y94 HydrophobicContact CD2-CE2 4.45Å; L91-Y94 WeakPolarHBondContact O-CB 3.32Å; L91-Y94 PolarHBondContact O-N 3.08Å
95	F	95	Very high	94.4	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-85.1	-10.7	-178.6	-84.6	-106.1	0	0	0	114.3	I48 L52 Y76 L79 F80 L83 L91 R92 D93 R97 S98 L99	I48-F95 HydrophobicContact CG2-CE2 4.4Å; L52-F95 HydrophobicContact CD1-CD2 3.9Å; L52-F95 HydrophobicContact CD1-CE2 3.92Å; L52-F95 HydrophobicContact CD1-CG 4.44Å; L52-F95 HydrophobicContact CD1-CZ 4.47Å; L52-F95 HydrophobicContact CD2-CD1 4.18Å; L52-F95 HydrophobicContact CD2-CD2 4.45Å; L52-F95 HydrophobicContact CD2-CE1 3.85Å; L52-F95 HydrophobicContact CD2-CE2 4.14Å; L52-F95 HydrophobicContact CD2-CG 4.49Å; L52-F95 HydrophobicContact CD2-CZ 3.85Å; L52-F95 HydrophobicContact CG-CE2 4.44Å; Y76-F95 HydrophobicContact CD1-CD1 4.4Å; Y76-F95 HydrophobicContact CD1-CE1 4.26Å; L79-F95 HydrophobicContact CG-CZ 4.36Å; F80-F95 HydrophobicContact CB-CD1 3.92Å; F80-F95 HydrophobicContact CB-CE1 3.58Å; F80-F95 HydrophobicContact CB-CZ 3.98Å; F80-F95 HydrophobicContact CD2-CB 4.06Å; F80-F95 AromaticContact CD2-CD1 3.65Å; F80-F95 HydrophobicContact CD2-CD1 3.65Å; F80-F95 AromaticContact CD2-CD2 3.48Å; F80-F95 HydrophobicContact CD2-CD2 3.48Å; F80-F95 VanDerWaalsContact CD2-CD2 3.48Å; F80-F95 AromaticContact CD2-CE1 3.84Å; F80-F95 HydrophobicContact CD2-CE1 3.84Å; F80-F95 AromaticContact CD2-CE2 3.68Å; F80-F95 HydrophobicContact CD2-CE2 3.68Å; F80-F95 AromaticContact CD2-CG 3.44Å; F80-F95 HydrophobicContact CD2-CG 3.44Å; F80-F95 VanDerWaalsContact CD2-CG 3.44Å; F80-F95 AromaticContact CD2-CZ 3.84Å; F80-F95 HydrophobicContact CD2-CZ 3.84Å; F80-F95 HydrophobicContact CE2-CB 4.22Å; F80-F95 AromaticContact CE2-CD2 3.91Å; F80-F95 HydrophobicContact CE2-CD2 3.91Å; F80-F95 HydrophobicContact CE2-CE2 4.4Å; F80-F95 AromaticContact CE2-CG 4Å; F80-F95 HydrophobicContact CE2-CG 4Å; F80-F95 HydrophobicContact CG-CD1 4.17Å; F80-F95 HydrophobicContact CG-CE1 4.2Å; F80-F95 HydrophobicContact CG-CG 4.37Å; F80-F95 HydrophobicContact CG-CZ 4.43Å; L83-F95 HydrophobicContact CD1-CE2 4Å; L83-F95 HydrophobicContact CD1-CZ 3.7Å; L91-F95 HydrophobicContact CB-CD2 4.24Å; L91-F95 HydrophobicContact CB-CE2 4.41Å; L91-F95 HydrophobicContact CD1-CE2 4.5Å; L91-F95 PolarHBondContact O-N 3.49Å; L91-F95 VanDerWaalsContact O-N 3.16Å; R92-F95 PolarHBondContact O-N 2.93Å; D93-F95 VanDerWaalsContact C-N 3.32Å; D93-F95 PolarHBondContact O-N 3.2Å; F95-R97 VanDerWaalsContact C-N 3.29Å; F95-R97 PolarHBondContact O-N 3.34Å; F95-S98 PolarHBondContact O-N 3.1Å; F95-S98 VanDerWaalsContact O-N 3.12Å; F95-L99 HydrophobicContact CB-CD1 4.31Å; F95-L99 HydrophobicContact CB-CG 4.4Å; F95-L99 WeakPolarHBondContact O-CG 3.48Å; F95-L99 PolarHBondContact O-N 3.42Å
96	T	94.2	Very high	94.5	Very high	23 Å²	23	49.5 Å²	49.5	14%	0.141	23%	0.229	C	C	.	.	H	α-helix	trans	-55.7	-44.5	-172.5	-71.1	0	0	0	0	111.9	R92 D93 Q100 R123	R92-T96 PolarHBondContact O-N 3.05Å; R92-T96 VanDerWaalsContact O-N 3.09Å; R92-T96 PolarHBondContact O-OG1 2.98Å; D93-T96 WeakPolarHBondContact O-CB 3.44Å; D93-T96 PolarHBondContact O-N 2.93Å; T96-Q100 WeakPolarHBondContact O-CG 3.26Å; T96-Q100 PolarHBondContact O-N 2.8Å; T96-Q100 VanDerWaalsContact O-N 3.08Å; T96-R123 HydrophobicContact CG2-CG 3.85Å
97	R	95	Very high	94.8	Very high	69 Å²	69	48.6 Å²	48.6	26%	0.26	23%	0.225	S	C	.	.	H	α-helix	trans	-64.9	-47.2	178.5	-173.6	-178.3	162.1	93.6	-1.1	111.8	D56 F95 L99 Q100 I101 L124 E128	D56-R97 IonicContact OD2-CZ 3.56Å; D56-R97 IonicContact OD2-NE 3.59Å; D56-R97 PolarHBondContact OD2-NE 2.73Å; D56-R97 IonicContact OD2-NH2 2.77Å; D56-R97 PolarHBondContact OD2-NH2 2.98Å; F95-R97 VanDerWaalsContact C-N 3.29Å; F95-R97 PolarHBondContact O-N 3.34Å; R97-L99 VanDerWaalsContact C-N 3.34Å; R97-L99 PolarHBondContact O-N 3.12Å; R97-Q100 WeakPolarHBondContact O-CB 3.32Å; R97-Q100 PolarHBondContact O-N 3.05Å; R97-Q100 VanDerWaalsContact O-N 3.16Å; R97-I101 HydrophobicContact CG-CD1 4.45Å; R97-I101 WeakPolarHBondContact O-CG1 3.35Å; R97-I101 PolarHBondContact O-N 2.91Å; R97-L124 HydrophobicContact CG-CD2 3.66Å; R97-E128 IonicContact CZ-OE1 3.22Å; R97-E128 IonicContact NH1-OE1 3.64Å; R97-E128 PolarHBondContact NH1-OE1 3.46Å; R97-E128 IonicContact NH1-OE2 3.83Å; R97-E128 PolarHBondContact NH1-OE2 3.34Å; R97-E128 VanDerWaalsContact NH1-OE2 3.13Å; R97-E128 IonicContact NH2-OE1 2.69Å; R97-E128 PolarHBondContact NH2-OE1 2.7Å
98	S	95.4	Very high	95	Very high	7 Å²	7	52.6 Å²	52.6	5%	0.049	25%	0.245	C	C	.	.	H	α-helix	trans	-61.9	-39.4	179.1	-56.9	0	0	0	0	112.8	Y76 F95 Q100 I101 C102	Y76-S98 VanDerWaalsContact CE1-CB 3.43Å; F95-S98 PolarHBondContact O-N 3.1Å; F95-S98 VanDerWaalsContact O-N 3.12Å; S98-Q100 VanDerWaalsContact C-N 3.34Å; S98-I101 WeakPolarHBondContact O-CB 3.29Å; S98-I101 PolarHBondContact O-N 2.96Å; S98-C102 PolarHBondContact O-N 2.91Å; S98-C102 PolarHBondContact O-SG 3.38Å
99	L	94.4	Very high	95.3	Very high	49 Å²	49	52.1 Å²	52.1	26%	0.257	24%	0.242	S	C	.	.	H	α-helix	trans	-68.2	-33.3	175.8	-66.8	176.3	0	0	0	112.2	F95 R97 C102 R103	F95-L99 HydrophobicContact CB-CD1 4.31Å; F95-L99 HydrophobicContact CB-CG 4.4Å; F95-L99 WeakPolarHBondContact O-CG 3.48Å; F95-L99 PolarHBondContact O-N 3.42Å; R97-L99 VanDerWaalsContact C-N 3.34Å; R97-L99 PolarHBondContact O-N 3.12Å; L99-C102 PolarHBondContact O-N 3.22Å; L99-R103 WeakPolarHBondContact O-CB 3.32Å; L99-R103 PolarHBondContact O-N 3.46Å
100	Q	96	Very high	95.6	Very high	5 Å²	5	49.1 Å²	49.1	2%	0.023	23%	0.226	C	C	.	.	H	α-helix	trans	-66.3	-39.7	171.6	-73.1	170.7	11.3	0	0	111.7	T96 R97 S98 R103 L104 S121 W122 L124	T96-Q100 WeakPolarHBondContact O-CG 3.26Å; T96-Q100 PolarHBondContact O-N 2.8Å; T96-Q100 VanDerWaalsContact O-N 3.08Å; R97-Q100 WeakPolarHBondContact O-CB 3.32Å; R97-Q100 PolarHBondContact O-N 3.05Å; R97-Q100 VanDerWaalsContact O-N 3.16Å; S98-Q100 VanDerWaalsContact C-N 3.34Å; Q100-R103 PolarHBondContact O-N 3.25Å; Q100-L104 WeakPolarHBondContact O-CG 3.48Å; Q100-L104 PolarHBondContact O-N 3.42Å; Q100-S121 PolarHBondContact NE2-O 3.24Å; Q100-W122 HydrophobicContact CB-CZ3 4.41Å; Q100-W122 HydrophobicContact CG-CE3 4.25Å; Q100-W122 HydrophobicContact CG-CZ3 4.17Å; Q100-L124 HydrophobicContact CB-CD1 3.84Å; Q100-L124 HydrophobicContact CB-CG 4.28Å
101	I	96.9	Very high	95.7	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-60.5	-49.4	173.7	-67.1	170	0	0	0	110.5	D56 I59 R97 S98 R103 L104 L105 L124 I132	D56-I101 WeakPolarHBondContact OD1-CD1 3.3Å; I59-I101 HydrophobicContact CG2-CG2 4.19Å; R97-I101 HydrophobicContact CG-CD1 4.45Å; R97-I101 WeakPolarHBondContact O-CG1 3.35Å; R97-I101 PolarHBondContact O-N 2.91Å; S98-I101 WeakPolarHBondContact O-CB 3.29Å; S98-I101 PolarHBondContact O-N 2.96Å; I101-R103 VanDerWaalsContact C-N 3.3Å; I101-R103 PolarHBondContact O-N 2.89Å; I101-L104 PolarHBondContact O-N 3.46Å; I101-L105 HydrophobicContact CG2-CD1 4.02Å; I101-L105 HydrophobicContact CG2-CG 4.49Å; I101-L105 WeakPolarHBondContact O-CG 3.24Å; I101-L105 PolarHBondContact O-N 2.98Å; I101-L124 HydrophobicContact CG1-CD1 4.17Å; I101-L124 HydrophobicContact CG1-CD2 4.22Å; I101-I132 HydrophobicContact CD1-CD1 4.43Å; I101-I132 HydrophobicContact CG1-CD1 4.29Å; I101-I132 HydrophobicContact CG1-CG1 4.26Å; I101-I132 HydrophobicContact CG2-CD1 3.99Å; I101-I132 HydrophobicContact CG2-CG1 4.41Å; I101-I132 HydrophobicContact CG2-CG2 4.01Å
102	C	97	Very high	95.8	Very high	0 Å²	0	53 Å²	53	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-56.6	-45.8	176.4	-65.8	0	0	0	0	111.3	E73 Y76 S98 L99 L104 L105 N106	E73-C102 HydrophobicContact CB-CB 4.17Å; E73-C102 HydrophobicContact CG-CB 4.28Å; Y76-C102 WeakPolarHBondContact CD2-SG 3.35Å; S98-C102 PolarHBondContact O-N 2.91Å; S98-C102 PolarHBondContact O-SG 3.38Å; L99-C102 PolarHBondContact O-N 3.22Å; C102-L104 PolarHBondContact O-N 2.88Å; C102-L105 CarbonylContact O-C 3.57Å; C102-L105 PolarHBondContact O-N 3.38Å; C102-N106 WeakPolarHBondContact O-CB 3.23Å; C102-N106 PolarHBondContact O-N 2.91Å; C102-N106 PolarHBondContact O-ND2 2.68Å
103	R	96.2	Very high	96	Very high	104 Å²	104	44.2 Å²	44.2	39%	0.392	20%	0.201	S	C	.	.	H	α-helix	trans	-60	-43.1	178.3	-172.7	172.3	-65	149.8	3.4	112.8	L99 Q100 I101 N106 L107 Y116	L99-R103 WeakPolarHBondContact O-CB 3.32Å; L99-R103 PolarHBondContact O-N 3.46Å; Q100-R103 PolarHBondContact O-N 3.25Å; I101-R103 VanDerWaalsContact C-N 3.3Å; I101-R103 PolarHBondContact O-N 2.89Å; R103-N106 CarbonylContact O-C 3.48Å; R103-N106 PolarHBondContact O-N 3.4Å; R103-L107 PolarHBondContact O-N 2.78Å; R103-Y116 HydrophobicContact CG-CE2 4.26Å
104	L	97.6	Very high	96.1	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-62.8	-43.9	175.3	-73	176.6	0	0	0	111.9	Q100 I101 C102 N106 L107 V113 W122 L124 V129 I132 L133	Q100-L104 WeakPolarHBondContact O-CG 3.48Å; Q100-L104 PolarHBondContact O-N 3.42Å; I101-L104 PolarHBondContact O-N 3.46Å; C102-L104 PolarHBondContact O-N 2.88Å; L104-N106 PolarHBondContact O-N 3.46Å; L104-L107 HydrophobicContact CD2-CD1 4.17Å; L104-L107 WeakPolarHBondContact O-CG 3.48Å; L104-L107 PolarHBondContact O-N 3.13Å; L104-V113 HydrophobicContact CD2-CB 4.35Å; L104-V113 HydrophobicContact CD2-CG2 3.61Å; L104-W122 HydrophobicContact CD1-CH2 4.22Å; L104-W122 HydrophobicContact CD1-CZ2 4.28Å; L104-W122 HydrophobicContact CD2-CH2 3.85Å; L104-W122 HydrophobicContact CD2-CZ2 4.35Å; L104-W122 HydrophobicContact CG-CH2 4.04Å; L104-L124 HydrophobicContact CD1-CD1 3.46Å; L104-L124 VanDerWaalsContact CD1-CD1 3.46Å; L104-L124 HydrophobicContact CG-CD1 4.49Å; L104-V129 HydrophobicContact CD1-CB 4.39Å; L104-V129 HydrophobicContact CD1-CG1 4.24Å; L104-V129 HydrophobicContact CD1-CG2 4.08Å; L104-V129 HydrophobicContact CD2-CG1 4.23Å; L104-I132 HydrophobicContact CB-CG2 3.8Å; L104-I132 HydrophobicContact CD1-CB 4.21Å; L104-I132 HydrophobicContact CD1-CG2 4.04Å; L104-L133 HydrophobicContact CB-CD2 4.34Å; L104-L133 HydrophobicContact CD2-CD2 4.34Å
105	L	97.8	Very high	96.1	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-66.5	-22.9	176.3	-67.4	174.4	0	0	0	112.1	I59 F64 A69 L72 I101 C102 I132 L135 R136	I59-L105 HydrophobicContact CG2-CD1 4.24Å; F64-L105 HydrophobicContact CD2-CD1 4.13Å; F64-L105 HydrophobicContact CD2-CD2 4.03Å; F64-L105 HydrophobicContact CE2-CD1 4.05Å; F64-L105 HydrophobicContact CG-CD1 4.49Å; F64-L105 HydrophobicContact CZ-CD1 4.34Å; A69-L105 HydrophobicContact CB-CB 3.83Å; A69-L105 WeakPolarHBondContact CB-O 3.04Å; L72-L105 HydrophobicContact CD2-CD1 3.6Å; I101-L105 HydrophobicContact CG2-CD1 4.02Å; I101-L105 HydrophobicContact CG2-CG 4.49Å; I101-L105 WeakPolarHBondContact O-CG 3.24Å; I101-L105 PolarHBondContact O-N 2.98Å; C102-L105 CarbonylContact O-C 3.57Å; C102-L105 PolarHBondContact O-N 3.38Å; L105-I132 HydrophobicContact CD2-CG2 3.92Å; L105-I132 WeakPolarHBondContact CD2-O 3.27Å; L105-I132 HydrophobicContact CG-CG2 3.9Å; L105-L135 HydrophobicContact CD2-CB 3.99Å; L105-L135 HydrophobicContact CD2-CD1 4.4Å; L105-R136 HydrophobicContact CD2-CG 4.2Å; L105-R136 WeakPolarHBondContact O-CD 3.45Å; L105-R136 PolarHBondContact O-NH1 3.49Å
106	N	97.5	Very high	95.9	Very high	18 Å²	18	51.3 Å²	51.3	10%	0.096	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	13.8	179.4	-80.5	-46.6	0	0	0	114.7	R66 A69 I70 E73 C102 R103 L104	R66-N106 VanDerWaalsContact NH1-C 3.31Å; R66-N106 VanDerWaalsContact NH1-CG 3.35Å; R66-N106 PolarHBondContact NH1-O 3.42Å; R66-N106 PolarHBondContact NH1-OD1 3.31Å; R66-N106 PolarHBondContact NH2-O 2.96Å; A69-N106 VanDerWaalsContact CB-OD1 3.26Å; A69-N106 WeakPolarHBondContact CB-OD1 3.47Å; A69-N106 PolarHBondContact O-ND2 3.41Å; I70-N106 WeakPolarHBondContact CG1-OD1 2.98Å; I70-N106 PolarHBondContact N-OD1 3.21Å; I70-N106 VanDerWaalsContact N-OD1 3.14Å; E73-N106 WeakPolarHBondContact CB-ND2 3.45Å; E73-N106 PolarHBondContact OE2-ND2 3.25Å; C102-N106 WeakPolarHBondContact O-CB 3.23Å; C102-N106 PolarHBondContact O-N 2.91Å; C102-N106 PolarHBondContact O-ND2 2.68Å; R103-N106 CarbonylContact O-C 3.48Å; R103-N106 PolarHBondContact O-N 3.4Å; L104-N106 PolarHBondContact O-N 3.46Å
107	L	97.7	Very high	95.7	Very high	5 Å²	5	52 Å²	52	3%	0.026	22%	0.223	C	C	.	.			trans	-68.6	147.3	168.8	-60.4	-178.9	0	0	0	110.7	R103 L104 E112 V113 Y116 L133 R136 F139	R103-L107 PolarHBondContact O-N 2.78Å; L104-L107 HydrophobicContact CD2-CD1 4.17Å; L104-L107 WeakPolarHBondContact O-CG 3.48Å; L104-L107 PolarHBondContact O-N 3.13Å; L107-E112 HydrophobicContact CB-CB 4.48Å; L107-E112 HydrophobicContact CD1-CB 4.25Å; L107-E112 HydrophobicContact CD2-CB 3.89Å; L107-E112 HydrophobicContact CG-CB 4.42Å; L107-V113 HydrophobicContact CD1-CB 4.06Å; L107-Y116 HydrophobicContact CD2-CD2 4.43Å; L107-Y116 HydrophobicContact CD2-CE2 3.74Å; L107-L133 HydrophobicContact CD1-CD2 4.07Å; L107-R136 PolarHBondContact O-NH1 3.27Å; L107-F139 HydrophobicContact CB-CZ 4.14Å; L107-F139 WeakPolarHBondContact O-CZ 3.48Å
108	D	96.8	Very high	95.1	Very high	99 Å²	99	55.5 Å²	55.5	53%	0.529	25%	0.247	S	C	.	.	S	Bend	trans	-84.2	-29.8	170.9	-68	-37.4	0	0	0	110.6	R66 E112	R66-D108 IonicContact CZ-OD1 3.41Å; R66-D108 VanDerWaalsContact CZ-OD1 3.26Å; R66-D108 IonicContact NE-OD1 2.81Å; R66-D108 PolarHBondContact NE-OD1 3.2Å; R66-D108 IonicContact NH2-OD1 3.13Å; R66-D108 PolarHBondContact NH2-OD1 2.96Å; R66-D108 IonicContact NH2-OD2 2.78Å; D108-E112 PolarHBondContact N-OE2 2.74Å
109	R	96.7	Very high	94.7	Very high	170 Å²	170	57.7 Å²	57.7	64%	0.642	26%	0.263	S	S	*	.	S	Bend	trans	-136.8	146.8	175.3	-58.1	179.1	-178.9	177.1	1.1	112	E111 E112	R109-E111 PolarHBondContact O-N 2.73Å; R109-E112 HydrophobicContact CB-CG 4.1Å; R109-E112 PolarHBondContact N-OE2 3.3Å; R109-E112 WeakPolarHBondContact O-CB 3.49Å; R109-E112 WeakPolarHBondContact O-CG 3.5Å; R109-E112 PolarHBondContact O-N 2.62Å; R109-E112 VanDerWaalsContact O-N 3.11Å
110	V	97.2	Very high	94.4	Very high	2 Å²	2	61.5 Å²	61.5	1%	0.012	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-53.8	-38.4	179.4	175.4	0	0	0	0	112.4	E112 V113 L133 F139 E143 I144 L147	V110-E112 VanDerWaalsContact C-N 3.27Å; V110-E112 PolarHBondContact O-N 2.94Å; V110-V113 WeakPolarHBondContact O-CG1 3.36Å; V110-V113 PolarHBondContact O-N 2.93Å; V110-L133 HydrophobicContact CG1-CD1 4.34Å; V110-F139 HydrophobicContact CG2-CB 3.74Å; V110-F139 HydrophobicContact CG2-CD1 3.88Å; V110-F139 HydrophobicContact CG2-CD2 3.62Å; V110-F139 HydrophobicContact CG2-CE1 4.33Å; V110-F139 HydrophobicContact CG2-CE2 4.12Å; V110-F139 HydrophobicContact CG2-CG 3.48Å; V110-F139 VanDerWaalsContact CG2-CG 3.48Å; V110-F139 HydrophobicContact CG2-CZ 4.44Å; V110-E143 HydrophobicContact CB-CB 4.27Å; V110-E143 HydrophobicContact CG1-CB 4.27Å; V110-E143 HydrophobicContact CG2-CB 4.21Å; V110-I144 HydrophobicContact CG1-CG1 4.04Å; V110-I144 HydrophobicContact CG2-CG1 4.12Å; V110-L147 HydrophobicContact CG1-CD1 3.6Å; V110-L147 HydrophobicContact CG1-CD2 3.98Å; V110-L147 HydrophobicContact CG1-CG 3.79Å
111	E	96.2	Very high	94.1	Very high	127 Å²	127	63.8 Å²	63.8	59%	0.593	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-66.3	-23.9	-177.1	-63.6	162.8	178.2	0	0	113.8	R109 V113 H114	R109-E111 PolarHBondContact O-N 2.73Å; E111-V113 PolarHBondContact O-N 3.4Å; E111-H114 WeakPolarHBondContact O-CB 3.21Å; E111-H114 PolarHBondContact O-CD2 3.22Å; E111-H114 VanDerWaalsContact O-CD2 3.3Å; E111-H114 PolarHBondContact O-N 3.11Å; E111-H114 VanDerWaalsContact O-N 3.1Å
112	E	96.3	Very high	93.9	Very high	48 Å²	48	65.5 Å²	65.5	22%	0.224	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-64.3	-15.6	-178.5	-61.7	178.6	157.2	0	0	112.4	L107 D108 R109 V110 H114 Y115	L107-E112 HydrophobicContact CB-CB 4.48Å; L107-E112 HydrophobicContact CD1-CB 4.25Å; L107-E112 HydrophobicContact CD2-CB 3.89Å; L107-E112 HydrophobicContact CG-CB 4.42Å; D108-E112 PolarHBondContact N-OE2 2.74Å; R109-E112 HydrophobicContact CB-CG 4.1Å; R109-E112 PolarHBondContact N-OE2 3.3Å; R109-E112 WeakPolarHBondContact O-CB 3.49Å; R109-E112 WeakPolarHBondContact O-CG 3.5Å; R109-E112 PolarHBondContact O-N 2.62Å; R109-E112 VanDerWaalsContact O-N 3.11Å; V110-E112 VanDerWaalsContact C-N 3.27Å; V110-E112 PolarHBondContact O-N 2.94Å; E112-H114 PolarHBondContact O-N 2.78Å; E112-H114 VanDerWaalsContact O-N 3.14Å; E112-Y115 HydrophobicContact CB-CD2 3.86Å; E112-Y115 HydrophobicContact CB-CE2 3.91Å; E112-Y115 HydrophobicContact CG-CD2 4.36Å; E112-Y115 HydrophobicContact CG-CE2 3.91Å; E112-Y115 WeakPolarHBondContact O-CB 3.45Å; E112-Y115 WeakPolarHBondContact O-CD2 3.41Å; E112-Y115 PolarHBondContact O-N 3.43Å
113	V	96.1	Very high	93.7	Very high	0 Å²	0	73 Å²	73	0%	0	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-54.6	-30.5	171.9	70.9	0	0	0	0	112.7	L104 L107 V110 E111 Y115 Y116 W117 V129 L147 L149	L104-V113 HydrophobicContact CD2-CB 4.35Å; L104-V113 HydrophobicContact CD2-CG2 3.61Å; L107-V113 HydrophobicContact CD1-CB 4.06Å; V110-V113 WeakPolarHBondContact O-CG1 3.36Å; V110-V113 PolarHBondContact O-N 2.93Å; E111-V113 PolarHBondContact O-N 3.4Å; V113-Y115 PolarHBondContact O-N 2.71Å; V113-Y116 PolarHBondContact O-N 3.09Å; V113-W117 PolarHBondContact O-N 3.4Å; V113-W117 VanDerWaalsContact O-N 3.1Å; V113-V129 HydrophobicContact CG2-CG1 3.71Å; V113-L147 HydrophobicContact CG1-CD1 3.94Å; V113-L147 HydrophobicContact CG1-CD2 3.63Å; V113-L147 HydrophobicContact CG1-CG 4.42Å; V113-L149 HydrophobicContact CG1-CD2 4.16Å
114	H	94.9	Very high	93.7	Very high	87 Å²	87	68.4 Å²	68.4	40%	0.403	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-63.3	-23.3	179.2	-74.4	-62.7	0	0	0	113.3	E111 E112 Y116	E111-H114 WeakPolarHBondContact O-CB 3.21Å; E111-H114 PolarHBondContact O-CD2 3.22Å; E111-H114 VanDerWaalsContact O-CD2 3.3Å; E111-H114 PolarHBondContact O-N 3.11Å; E111-H114 VanDerWaalsContact O-N 3.1Å; E112-H114 PolarHBondContact O-N 2.78Å; E112-H114 VanDerWaalsContact O-N 3.14Å; H114-Y116 PolarHBondContact O-N 3.3Å
115	Y	92.8	Very high	93.6	Very high	185 Å²	185	72 Å²	72	73%	0.725	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-67.6	-20.8	174.6	-57.3	-46.7	0	0	0	113	E112 V113	E112-Y115 HydrophobicContact CB-CD2 3.86Å; E112-Y115 HydrophobicContact CB-CE2 3.91Å; E112-Y115 HydrophobicContact CG-CD2 4.36Å; E112-Y115 HydrophobicContact CG-CE2 3.91Å; E112-Y115 WeakPolarHBondContact O-CB 3.45Å; E112-Y115 WeakPolarHBondContact O-CD2 3.41Å; E112-Y115 PolarHBondContact O-N 3.43Å; V113-Y115 PolarHBondContact O-N 2.71Å
116	Y	91.7	Very high	93.4	Very high	77 Å²	77	73.3 Å²	73.3	30%	0.302	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	-24.8	-174.3	-51.4	-72.4	0	0	0	114.2	R103 L107 V113 H114 N118 S119 W122	R103-Y116 HydrophobicContact CG-CE2 4.26Å; L107-Y116 HydrophobicContact CD2-CD2 4.43Å; L107-Y116 HydrophobicContact CD2-CE2 3.74Å; V113-Y116 PolarHBondContact O-N 3.09Å; H114-Y116 PolarHBondContact O-N 3.3Å; Y116-N118 PolarHBondContact O-N 3.16Å; Y116-S119 VanDerWaalsContact O-CB 3.27Å; Y116-S119 WeakPolarHBondContact O-CB 3.23Å; Y116-S119 PolarHBondContact O-N 2.92Å; Y116-W122 VanDerWaalsContact CB-CZ3 3.46Å; Y116-W122 HydrophobicContact CG-CZ3 4.41Å
117	W	89.1	Confident	93.3	Very high	37 Å²	37	79 Å²	79	14%	0.14	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-35.4	-170.9	-174.4	-112.1	0	0	0	114.2	V113 W122 A126 V129 L149 Q150	V113-W117 PolarHBondContact O-N 3.4Å; V113-W117 VanDerWaalsContact O-N 3.1Å; W117-W122 AromaticContact CE3-CE2 3.97Å; W117-W122 HydrophobicContact CE3-CZ2 4.3Å; W117-W122 AromaticContact CE3-NE1 3.54Å; W117-W122 AromaticContact CZ3-NE1 3.33Å; W117-W122 VanDerWaalsContact CZ3-NE1 3.33Å; W117-A126 VanDerWaalsContact CH2-CA 3.48Å; W117-A126 HydrophobicContact CH2-CB 3.66Å; W117-A126 HydrophobicContact CZ2-CB 4.02Å; W117-V129 HydrophobicContact CE3-CG2 4.22Å; W117-V129 HydrophobicContact CZ3-CB 4.46Å; W117-V129 HydrophobicContact CZ3-CG2 3.64Å; W117-L149 HydrophobicContact CB-CD2 4.45Å; W117-L149 HydrophobicContact CD2-CB 4.19Å; W117-L149 HydrophobicContact CD2-CD2 3.73Å; W117-L149 HydrophobicContact CD2-CG 4.4Å; W117-L149 HydrophobicContact CE3-CB 4.48Å; W117-L149 HydrophobicContact CE3-CD1 4.33Å; W117-L149 HydrophobicContact CE3-CD2 4.03Å; W117-L149 HydrophobicContact CE3-CG 4.5Å; W117-L149 HydrophobicContact CG-CD2 3.9Å; W117-L149 HydrophobicContact CH2-CB 4.11Å; W117-L149 HydrophobicContact CZ2-CB 3.71Å; W117-L149 HydrophobicContact CZ3-CB 4.45Å; W117-L149 HydrophobicContact CZ3-CD1 4.29Å; W117-Q150 PolarHBondContact NE1-O 3.07Å
118	N	82.4	Confident	93.3	Very high	144 Å²	144	81.1 Å²	81.1	77%	0.77	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	16.5	-178.2	-64.4	-35.9	0	0	0	114.1	Y116	Y116-N118 PolarHBondContact O-N 3.16Å
119	S	88.5	Confident	93.3	Very high	53 Å²	53	76.4 Å²	76.4	37%	0.371	37%	0.371	S	S	.	.			trans	-71.7	135.9	175.6	-176.8	0	0	0	0	110.9	Y116 S121 W122	Y116-S119 VanDerWaalsContact O-CB 3.27Å; Y116-S119 WeakPolarHBondContact O-CB 3.23Å; Y116-S119 PolarHBondContact O-N 2.92Å; S119-S121 PolarHBondContact O-N 3.38Å; S119-S121 PolarHBondContact OG-N 2.99Å; S119-S121 PolarHBondContact OG-OG 3.45Å; S119-W122 VanDerWaalsContact O-CB 3.23Å; S119-W122 WeakPolarHBondContact O-CB 3.33Å; S119-W122 PolarHBondContact O-N 3.02Å
120	S	87.6	Confident	93.3	Very high	128 Å²	128	71.6 Å²	71.6	90%	0.895	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-20.3	173.5	56.4	0	0	0	0	113.8
121	S	88.8	Confident	93.3	Very high	54 Å²	54	73.5 Å²	73.5	38%	0.378	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-4.6	178.2	67.4	0	0	0	0	113.8	Q100 S119 R123	Q100-S121 PolarHBondContact NE2-O 3.24Å; S119-S121 PolarHBondContact O-N 3.38Å; S119-S121 PolarHBondContact OG-N 2.99Å; S119-S121 PolarHBondContact OG-OG 3.45Å; S121-R123 WeakPolarHBondContact O-CG 3.38Å
122	W	92.9	Very high	93.3	Very high	37 Å²	37	67.6 Å²	67.6	14%	0.14	34%	0.339	C	S	.	.			trans	-66.6	131.6	-173.5	-164.1	-99.9	0	0	0	112.3	Q100 L104 Y116 W117 S119 L124 V129	Q100-W122 HydrophobicContact CB-CZ3 4.41Å; Q100-W122 HydrophobicContact CG-CE3 4.25Å; Q100-W122 HydrophobicContact CG-CZ3 4.17Å; L104-W122 HydrophobicContact CD1-CH2 4.22Å; L104-W122 HydrophobicContact CD1-CZ2 4.28Å; L104-W122 HydrophobicContact CD2-CH2 3.85Å; L104-W122 HydrophobicContact CD2-CZ2 4.35Å; L104-W122 HydrophobicContact CG-CH2 4.04Å; Y116-W122 VanDerWaalsContact CB-CZ3 3.46Å; Y116-W122 HydrophobicContact CG-CZ3 4.41Å; W117-W122 AromaticContact CE3-CE2 3.97Å; W117-W122 HydrophobicContact CE3-CZ2 4.3Å; W117-W122 AromaticContact CE3-NE1 3.54Å; W117-W122 AromaticContact CZ3-NE1 3.33Å; W117-W122 VanDerWaalsContact CZ3-NE1 3.33Å; S119-W122 VanDerWaalsContact O-CB 3.23Å; S119-W122 WeakPolarHBondContact O-CB 3.33Å; S119-W122 PolarHBondContact O-N 3.02Å; W122-L124 HydrophobicContact CH2-CD1 4.45Å; W122-L124 HydrophobicContact CZ2-CB 4.1Å; W122-L124 HydrophobicContact CZ2-CD1 4.09Å; W122-L124 HydrophobicContact CZ2-CG 4.49Å; W122-L124 PolarHBondContact NE1-O 3.44Å; W122-V129 HydrophobicContact CZ2-CG2 3.6Å
123	R	94	Very high	93.4	Very high	158 Å²	158	65.3 Å²	65.3	60%	0.596	33%	0.328	S	S	*	.			trans	-123	-2	-174	-57.6	-56.4	-174.3	167.8	3.1	114.1	T96 S121	T96-R123 HydrophobicContact CG2-CG 3.85Å; S121-R123 WeakPolarHBondContact O-CG 3.38Å
124	L	94.9	Very high	93.5	Very high	6 Å²	6	68.8 Å²	68.8	3%	0.031	35%	0.353	C	S	.	.			trans	-99.7	133.2	-177.6	-58.8	175.8	0	0	0	110.9	R97 Q100 I101 L104 W122 E128 V129	R97-L124 HydrophobicContact CG-CD2 3.66Å; Q100-L124 HydrophobicContact CB-CD1 3.84Å; Q100-L124 HydrophobicContact CB-CG 4.28Å; I101-L124 HydrophobicContact CG1-CD1 4.17Å; I101-L124 HydrophobicContact CG1-CD2 4.22Å; L104-L124 HydrophobicContact CD1-CD1 3.46Å; L104-L124 VanDerWaalsContact CD1-CD1 3.46Å; L104-L124 HydrophobicContact CG-CD1 4.49Å; W122-L124 HydrophobicContact CH2-CD1 4.45Å; W122-L124 HydrophobicContact CZ2-CB 4.1Å; W122-L124 HydrophobicContact CZ2-CD1 4.09Å; W122-L124 HydrophobicContact CZ2-CG 4.49Å; W122-L124 PolarHBondContact NE1-O 3.44Å; L124-E128 HydrophobicContact CB-CB 4.4Å; L124-V129 HydrophobicContact CB-CG2 3.9Å
125	T	94.9	Very high	93.6	Very high	77 Å²	77	65.6 Å²	65.6	47%	0.472	34%	0.338	S	S	.	.			trans	-70	161.2	171.5	65.2	0	0	0	0	111.4	H127 E128 V129	T125-H127 PolarHBondContact O-N 3.27Å; T125-E128 WeakPolarHBondContact CG2-OE2 3.17Å; T125-E128 PolarHBondContact N-OE2 2.77Å; T125-E128 PolarHBondContact O-N 3.41Å; T125-E128 VanDerWaalsContact O-N 3.11Å; T125-E128 VanDerWaalsContact OG1-CD 3.3Å; T125-E128 WeakPolarHBondContact OG1-CG 3.17Å; T125-E128 PolarHBondContact OG1-N 2.99Å; T125-E128 PolarHBondContact OG1-OE2 3.48Å; T125-V129 WeakPolarHBondContact O-CG2 3.42Å; T125-V129 PolarHBondContact O-N 2.87Å
126	A	95.3	Very high	93.9	Very high	28 Å²	28	57 Å²	57	23%	0.231	31%	0.305	C	S	.	.	H	α-helix	trans	-61.1	-31.4	178.9	0	0	0	0	0	112.1	W117 R130 L149	W117-A126 VanDerWaalsContact CH2-CA 3.48Å; W117-A126 HydrophobicContact CH2-CB 3.66Å; W117-A126 HydrophobicContact CZ2-CB 4.02Å; A126-R130 WeakPolarHBondContact O-CG 3.47Å; A126-R130 PolarHBondContact O-N 3.25Å; A126-L149 HydrophobicContact CB-CB 3.85Å
127	H	95.5	Very high	94.1	Very high	136 Å²	136	61.5 Å²	61.5	63%	0.63	32%	0.321	S	S	*	.	H	α-helix	trans	-66.3	-50	174.3	178.7	66.3	0	0	0	111.1	T125 V129 R130 S131	T125-H127 PolarHBondContact O-N 3.27Å; H127-V129 VanDerWaalsContact C-N 3.31Å; H127-V129 PolarHBondContact O-N 3.47Å; H127-R130 PolarHBondContact O-N 3.49Å; H127-S131 PolarHBondContact O-N 3.31Å; H127-S131 PolarHBondContact O-OG 3.36Å
128	E	95.9	Very high	94.4	Very high	50 Å²	50	64.3 Å²	64.3	23%	0.234	34%	0.339	C	S	.	.	H	α-helix	trans	-60	-42	178.5	-70.5	166.3	140	0	0	111.7	R97 L124 T125 R130 S131 I132	R97-E128 IonicContact CZ-OE1 3.22Å; R97-E128 IonicContact NH1-OE1 3.64Å; R97-E128 PolarHBondContact NH1-OE1 3.46Å; R97-E128 IonicContact NH1-OE2 3.83Å; R97-E128 PolarHBondContact NH1-OE2 3.34Å; R97-E128 VanDerWaalsContact NH1-OE2 3.13Å; R97-E128 IonicContact NH2-OE1 2.69Å; R97-E128 PolarHBondContact NH2-OE1 2.7Å; L124-E128 HydrophobicContact CB-CB 4.4Å; T125-E128 WeakPolarHBondContact CG2-OE2 3.17Å; T125-E128 PolarHBondContact N-OE2 2.77Å; T125-E128 PolarHBondContact O-N 3.41Å; T125-E128 VanDerWaalsContact O-N 3.11Å; T125-E128 VanDerWaalsContact OG1-CD 3.3Å; T125-E128 WeakPolarHBondContact OG1-CG 3.17Å; T125-E128 PolarHBondContact OG1-N 2.99Å; T125-E128 PolarHBondContact OG1-OE2 3.48Å; E128-R130 VanDerWaalsContact C-N 3.34Å; E128-R130 PolarHBondContact O-N 3.05Å; E128-S131 PolarHBondContact O-N 3.42Å; E128-I132 VanDerWaalsContact O-CG1 3.3Å; E128-I132 WeakPolarHBondContact O-CG1 3.36Å; E128-I132 PolarHBondContact O-N 3.29Å
129	V	96.9	Very high	95.1	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-56.8	-48.5	176.2	172.8	0	0	0	0	111.7	L104 V113 W117 W122 L124 T125 H127 S131 I132 L133 L149	L104-V129 HydrophobicContact CD1-CB 4.39Å; L104-V129 HydrophobicContact CD1-CG1 4.24Å; L104-V129 HydrophobicContact CD1-CG2 4.08Å; L104-V129 HydrophobicContact CD2-CG1 4.23Å; V113-V129 HydrophobicContact CG2-CG1 3.71Å; W117-V129 HydrophobicContact CE3-CG2 4.22Å; W117-V129 HydrophobicContact CZ3-CB 4.46Å; W117-V129 HydrophobicContact CZ3-CG2 3.64Å; W122-V129 HydrophobicContact CZ2-CG2 3.6Å; L124-V129 HydrophobicContact CB-CG2 3.9Å; T125-V129 WeakPolarHBondContact O-CG2 3.42Å; T125-V129 PolarHBondContact O-N 2.87Å; H127-V129 VanDerWaalsContact C-N 3.31Å; H127-V129 PolarHBondContact O-N 3.47Å; V129-S131 VanDerWaalsContact C-N 3.34Å; V129-S131 PolarHBondContact O-N 3.13Å; V129-I132 PolarHBondContact O-N 3.22Å; V129-L133 HydrophobicContact CG1-CD1 3.75Å; V129-L133 HydrophobicContact CG1-CG 4.34Å; V129-L133 WeakPolarHBondContact O-CB 3.44Å; V129-L133 VanDerWaalsContact O-CG 3.25Å; V129-L133 WeakPolarHBondContact O-CG 3.26Å; V129-L133 PolarHBondContact O-N 3.32Å; V129-L149 HydrophobicContact CB-CD1 3.91Å; V129-L149 HydrophobicContact CG1-CD1 3.53Å
130	R	97	Very high	95.5	Very high	69 Å²	69	57.9 Å²	57.9	26%	0.26	31%	0.305	S	S	.	.	H	α-helix	trans	-64.1	-40.7	178.8	-67.2	175.8	-158.5	-91.3	4.8	111.6	A126 H127 E128 S134 I144 R145 L147	A126-R130 WeakPolarHBondContact O-CG 3.47Å; A126-R130 PolarHBondContact O-N 3.25Å; H127-R130 PolarHBondContact O-N 3.49Å; E128-R130 VanDerWaalsContact C-N 3.34Å; E128-R130 PolarHBondContact O-N 3.05Å; R130-S134 WeakPolarHBondContact O-CB 3.44Å; R130-S134 PolarHBondContact O-N 3.27Å; R130-I144 HydrophobicContact CB-CG2 3.85Å; R130-I144 HydrophobicContact CG-CG2 3.97Å; R130-I144 PolarHBondContact NH1-O 3.49Å; R130-R145 PolarHBondContact NH1-O 2.98Å; R130-L147 VanDerWaalsContact CZ-O 3.3Å; R130-L147 PolarHBondContact NH1-O 3.34Å; R130-L147 PolarHBondContact NH2-O 3.1Å
131	S	96.9	Very high	95.9	Very high	42 Å²	42	55.9 Å²	55.9	29%	0.294	29%	0.288	S	S	.	.	H	α-helix	trans	-61.9	-46	176.7	-63.2	0	0	0	0	111.5	H127 E128 V129 S134	H127-S131 PolarHBondContact O-N 3.31Å; H127-S131 PolarHBondContact O-OG 3.36Å; E128-S131 PolarHBondContact O-N 3.42Å; V129-S131 VanDerWaalsContact C-N 3.34Å; V129-S131 PolarHBondContact O-N 3.13Å; S131-S134 PolarHBondContact O-N 3.06Å; S131-S134 PolarHBondContact O-OG 3.27Å
132	I	97.7	Very high	96.3	Very high	4 Å²	4	59.2 Å²	59.2	2%	0.021	30%	0.301	C	S	.	.	H	α-helix	trans	-65.8	-45.1	177.9	-65.4	-55.7	0	0	0	111.7	Q60 I101 L104 L105 E128 V129 S134 L135	Q60-I132 HydrophobicContact CG-CD1 4.36Å; I101-I132 HydrophobicContact CD1-CD1 4.43Å; I101-I132 HydrophobicContact CG1-CD1 4.29Å; I101-I132 HydrophobicContact CG1-CG1 4.26Å; I101-I132 HydrophobicContact CG2-CD1 3.99Å; I101-I132 HydrophobicContact CG2-CG1 4.41Å; I101-I132 HydrophobicContact CG2-CG2 4.01Å; L104-I132 HydrophobicContact CB-CG2 3.8Å; L104-I132 HydrophobicContact CD1-CB 4.21Å; L104-I132 HydrophobicContact CD1-CG2 4.04Å; L105-I132 HydrophobicContact CD2-CG2 3.92Å; L105-I132 WeakPolarHBondContact CD2-O 3.27Å; L105-I132 HydrophobicContact CG-CG2 3.9Å; E128-I132 VanDerWaalsContact O-CG1 3.3Å; E128-I132 WeakPolarHBondContact O-CG1 3.36Å; E128-I132 PolarHBondContact O-N 3.29Å; V129-I132 PolarHBondContact O-N 3.22Å; I132-S134 PolarHBondContact O-N 3.26Å; I132-L135 HydrophobicContact CD1-CD1 3.92Å; I132-L135 VanDerWaalsContact O-CB 3.29Å; I132-L135 WeakPolarHBondContact O-CB 3.48Å; I132-L135 WeakPolarHBondContact O-CG 3.46Å; I132-L135 PolarHBondContact O-N 3.41Å
133	L	98	Very high	96.5	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-60.7	-32.7	176.4	-69.8	170.8	0	0	0	111.8	L104 L107 V110 V129 L135 R136 F139 I144 L147	L104-L133 HydrophobicContact CB-CD2 4.34Å; L104-L133 HydrophobicContact CD2-CD2 4.34Å; L107-L133 HydrophobicContact CD1-CD2 4.07Å; V110-L133 HydrophobicContact CG1-CD1 4.34Å; V129-L133 HydrophobicContact CG1-CD1 3.75Å; V129-L133 HydrophobicContact CG1-CG 4.34Å; V129-L133 WeakPolarHBondContact O-CB 3.44Å; V129-L133 VanDerWaalsContact O-CG 3.25Å; V129-L133 WeakPolarHBondContact O-CG 3.26Å; V129-L133 PolarHBondContact O-N 3.32Å; L133-L135 PolarHBondContact O-N 3.2Å; L133-R136 PolarHBondContact O-N 2.93Å; L133-F139 HydrophobicContact CB-CD2 4.39Å; L133-F139 HydrophobicContact CD2-CD2 4.09Å; L133-F139 HydrophobicContact CD2-CE2 3.74Å; L133-I144 HydrophobicContact CB-CD1 4.06Å; L133-I144 HydrophobicContact CB-CG1 4.17Å; L133-I144 HydrophobicContact CB-CG2 4.35Å; L133-L147 HydrophobicContact CD1-CD1 3.59Å
134	S	97.8	Very high	96.7	Very high	73 Å²	73	54.5 Å²	54.5	51%	0.51	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-11.5	177.1	78.4	0	0	0	0	114.3	R130 S131 I132 R136	R130-S134 WeakPolarHBondContact O-CB 3.44Å; R130-S134 PolarHBondContact O-N 3.27Å; S131-S134 PolarHBondContact O-N 3.06Å; S131-S134 PolarHBondContact O-OG 3.27Å; I132-S134 PolarHBondContact O-N 3.26Å; S134-R136 VanDerWaalsContact C-N 3.29Å
135	L	98	Very high	96.7	Very high	19 Å²	19	63 Å²	63	10%	0.099	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-18.3	174.5	-50.6	176.5	0	0	0	111.9	I59 K62 S63 F64 L105 I132 L133	I59-L135 HydrophobicContact CG2-CD1 4.01Å; K62-L135 WeakPolarHBondContact O-CD2 3.47Å; S63-L135 CarbonylContact C-O 3.52Å; S63-L135 VanDerWaalsContact CA-O 3.31Å; S63-L135 WeakPolarHBondContact CA-O 3.41Å; F64-L135 HydrophobicContact CD2-CB 3.91Å; F64-L135 HydrophobicContact CE2-CB 4.35Å; F64-L135 HydrophobicContact CE2-CD1 4.27Å; F64-L135 PolarHBondContact N-O 3.07Å; L105-L135 HydrophobicContact CD2-CB 3.99Å; L105-L135 HydrophobicContact CD2-CD1 4.4Å; I132-L135 HydrophobicContact CD1-CD1 3.92Å; I132-L135 VanDerWaalsContact O-CB 3.29Å; I132-L135 WeakPolarHBondContact O-CB 3.48Å; I132-L135 WeakPolarHBondContact O-CG 3.46Å; I132-L135 PolarHBondContact O-N 3.41Å; L133-L135 PolarHBondContact O-N 3.2Å
136	R	97.5	Very high	96.7	Very high	6 Å²	6	63.3 Å²	63.3	2%	0.023	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-79	119.2	174.6	-81.4	-73.2	-64.1	-78.7	-6	110.2	L105 L107 L133 S134 D138 F139	L105-R136 HydrophobicContact CD2-CG 4.2Å; L105-R136 WeakPolarHBondContact O-CD 3.45Å; L105-R136 PolarHBondContact O-NH1 3.49Å; L107-R136 PolarHBondContact O-NH1 3.27Å; L133-R136 PolarHBondContact O-N 2.93Å; S134-R136 VanDerWaalsContact C-N 3.29Å; R136-D138 IonicContact CZ-OD1 2.74Å; R136-D138 IonicContact CZ-OD2 3.15Å; R136-D138 IonicContact NE-OD1 3.91Å; R136-D138 PolarHBondContact NE-OD1 2.91Å; R136-D138 IonicContact NE-OD2 2.68Å; R136-D138 IonicContact NH2-OD1 3.4Å; R136-D138 PolarHBondContact NH2-OD1 3.16Å; R136-D138 IonicContact NH2-OD2 3.46Å; R136-D138 PolarHBondContact NH2-OD2 3.19Å; R136-D138 PolarHBondContact O-N 3.22Å; R136-F139 HydrophobicContact CB-CB 4.13Å; R136-F139 HydrophobicContact CB-CD1 4.33Å; R136-F139 HydrophobicContact CB-CD2 3.53Å; R136-F139 HydrophobicContact CB-CE2 4Å; R136-F139 HydrophobicContact CB-CG 3.73Å; R136-F139 HydrophobicContact CG-CD2 4Å; R136-F139 HydrophobicContact CG-CE2 3.95Å; R136-F139 HydrophobicContact CG-CZ 4.45Å; R136-F139 PolarHBondContact O-N 3.2Å
137	R	95.5	Very high	96.7	Very high	171 Å²	171	62.4 Å²	62.4	65%	0.645	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-26.3	-174.1	-63.2	-179.3	-168.3	154.7	10.3	113.4	S63 F64	S63-R137 PolarHBondContact O-NH2 3.34Å; S63-R137 PolarHBondContact OG-NE 3.45Å; S63-R137 PolarHBondContact OG-NH2 2.95Å; S63-R137 VanDerWaalsContact OG-NH2 3.13Å; F64-R137 PolarHBondContact O-N 3.03Å
138	D	95.8	Very high	96.6	Very high	96 Å²	96	64.2 Å²	64.2	51%	0.513	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-6.2	-176.3	58.4	-50.4	0	0	0	113.8	R136	R136-D138 IonicContact CZ-OD1 2.74Å; R136-D138 IonicContact CZ-OD2 3.15Å; R136-D138 IonicContact NE-OD1 3.91Å; R136-D138 PolarHBondContact NE-OD1 2.91Å; R136-D138 IonicContact NE-OD2 2.68Å; R136-D138 IonicContact NH2-OD1 3.4Å; R136-D138 PolarHBondContact NH2-OD1 3.16Å; R136-D138 IonicContact NH2-OD2 3.46Å; R136-D138 PolarHBondContact NH2-OD2 3.19Å; R136-D138 PolarHBondContact O-N 3.22Å
139	F	97.7	Very high	96.3	Very high	17 Å²	17	62.2 Å²	62.2	8%	0.075	31%	0.313	C	S	.	.	S	Bend	trans	-86.6	125.5	176.6	-72.6	-6	0	0	0	111.5	L107 V110 L133 R136 V141 I144	L107-F139 HydrophobicContact CB-CZ 4.14Å; L107-F139 WeakPolarHBondContact O-CZ 3.48Å; V110-F139 HydrophobicContact CG2-CB 3.74Å; V110-F139 HydrophobicContact CG2-CD1 3.88Å; V110-F139 HydrophobicContact CG2-CD2 3.62Å; V110-F139 HydrophobicContact CG2-CE1 4.33Å; V110-F139 HydrophobicContact CG2-CE2 4.12Å; V110-F139 HydrophobicContact CG2-CG 3.48Å; V110-F139 VanDerWaalsContact CG2-CG 3.48Å; V110-F139 HydrophobicContact CG2-CZ 4.44Å; L133-F139 HydrophobicContact CB-CD2 4.39Å; L133-F139 HydrophobicContact CD2-CD2 4.09Å; L133-F139 HydrophobicContact CD2-CE2 3.74Å; R136-F139 HydrophobicContact CB-CB 4.13Å; R136-F139 HydrophobicContact CB-CD1 4.33Å; R136-F139 HydrophobicContact CB-CD2 3.53Å; R136-F139 HydrophobicContact CB-CE2 4Å; R136-F139 HydrophobicContact CB-CG 3.73Å; R136-F139 HydrophobicContact CG-CD2 4Å; R136-F139 HydrophobicContact CG-CE2 3.95Å; R136-F139 HydrophobicContact CG-CZ 4.45Å; R136-F139 PolarHBondContact O-N 3.2Å; F139-V141 PolarHBondContact O-N 3.23Å; F139-I144 HydrophobicContact CB-CD1 4.07Å; F139-I144 HydrophobicContact CB-CG1 4.5Å
140	A	96.9	Very high	95.4	Very high	44 Å²	44	73.3 Å²	73.3	36%	0.364	37%	0.365	S	S	.	.			trans	-73	130.3	-178.6	0	0	0	0	0	110.9	N142 E143 I144	A140-N142 PolarHBondContact O-N 2.92Å; A140-N142 VanDerWaalsContact O-N 3.08Å; A140-E143 HydrophobicContact CB-CB 4.42Å; A140-E143 HydrophobicContact CB-CG 3.97Å; A140-E143 WeakPolarHBondContact O-CB 3.44Å; A140-E143 PolarHBondContact O-N 3.38Å; A140-I144 PolarHBondContact O-N 2.69Å
141	V	96.2	Very high	95.3	Very high	86 Å²	86	73.6 Å²	73.6	52%	0.521	37%	0.37	S	S	.	.	H	α-helix	trans	-54.3	-34.7	179.2	178.1	0	0	0	0	112.2	F139 R145	F139-V141 PolarHBondContact O-N 3.23Å; V141-R145 HydrophobicContact CG1-CG 4.47Å; V141-R145 WeakPolarHBondContact O-CB 3.47Å; V141-R145 VanDerWaalsContact O-CG 3.3Å; V141-R145 WeakPolarHBondContact O-CG 3.43Å; V141-R145 PolarHBondContact O-N 3.09Å
142	N	96.6	Very high	95.3	Very high	124 Å²	124	75.2 Å²	75.2	66%	0.663	37%	0.374	S	S	*	.	H	α-helix	trans	-68.1	-39	178.6	-70	-20.6	0	0	0	112.6	A140 R145 S146	A140-N142 PolarHBondContact O-N 2.92Å; A140-N142 VanDerWaalsContact O-N 3.08Å; N142-R145 PolarHBondContact O-N 2.84Å; N142-S146 WeakPolarHBondContact O-CB 3.37Å; N142-S146 PolarHBondContact O-N 3.44Å; N142-S146 PolarHBondContact O-OG 3Å
143	E	97.2	Very high	95.1	Very high	89 Å²	89	79.2 Å²	79.2	42%	0.416	39%	0.394	S	S	.	.	H	α-helix	trans	-63.3	-46.9	176.1	-66.2	174.4	168.4	0	0	109.9	V110 A140 R145 S146 L147	V110-E143 HydrophobicContact CB-CB 4.27Å; V110-E143 HydrophobicContact CG1-CB 4.27Å; V110-E143 HydrophobicContact CG2-CB 4.21Å; A140-E143 HydrophobicContact CB-CB 4.42Å; A140-E143 HydrophobicContact CB-CG 3.97Å; A140-E143 WeakPolarHBondContact O-CB 3.44Å; A140-E143 PolarHBondContact O-N 3.38Å; E143-R145 VanDerWaalsContact C-N 3.3Å; E143-R145 PolarHBondContact O-N 3.14Å; E143-S146 WeakPolarHBondContact CA-OG 3.35Å; E143-S146 PolarHBondContact O-N 2.94Å; E143-S146 VanDerWaalsContact O-N 3.09Å; E143-S146 PolarHBondContact O-OG 3.26Å; E143-L147 PolarHBondContact O-N 3.22Å
144	I	97.6	Very high	94.9	Very high	8 Å²	8	83.8 Å²	83.8	4%	0.041	42%	0.417	C	S	.	.	H	α-helix	trans	-60.3	-40.7	177.5	-58.7	170.2	0	0	0	111.2	V110 R130 L133 F139 A140 L147	V110-I144 HydrophobicContact CG1-CG1 4.04Å; V110-I144 HydrophobicContact CG2-CG1 4.12Å; R130-I144 HydrophobicContact CB-CG2 3.85Å; R130-I144 HydrophobicContact CG-CG2 3.97Å; R130-I144 PolarHBondContact NH1-O 3.49Å; L133-I144 HydrophobicContact CB-CD1 4.06Å; L133-I144 HydrophobicContact CB-CG1 4.17Å; L133-I144 HydrophobicContact CB-CG2 4.35Å; F139-I144 HydrophobicContact CB-CD1 4.07Å; F139-I144 HydrophobicContact CB-CG1 4.5Å; A140-I144 PolarHBondContact O-N 2.69Å; I144-L147 WeakPolarHBondContact O-CB 3.45Å; I144-L147 PolarHBondContact O-N 3.48Å
145	R	95.5	Very high	94.8	Very high	183 Å²	183	84.5 Å²	84.5	69%	0.691	41%	0.411	S	S	*	.	H	α-helix	trans	-67.3	-35.9	176.5	-75.5	176.3	-179.5	179.5	1.3	112.4	R130 V141 N142 E143 L147	R130-R145 PolarHBondContact NH1-O 2.98Å; V141-R145 HydrophobicContact CG1-CG 4.47Å; V141-R145 WeakPolarHBondContact O-CB 3.47Å; V141-R145 VanDerWaalsContact O-CG 3.3Å; V141-R145 WeakPolarHBondContact O-CG 3.43Å; V141-R145 PolarHBondContact O-N 3.09Å; N142-R145 PolarHBondContact O-N 2.84Å; E143-R145 VanDerWaalsContact C-N 3.3Å; E143-R145 PolarHBondContact O-N 3.14Å; R145-L147 VanDerWaalsContact C-N 3.26Å; R145-L147 PolarHBondContact O-N 3.32Å
146	S	95.4	Very high	94.6	Very high	84 Å²	84	88.9 Å²	88.9	59%	0.587	43%	0.432	S	S	*	.	H	α-helix	trans	-72.3	-14.3	179.9	67.9	0	0	0	0	114.8	N142 E143 K148	N142-S146 WeakPolarHBondContact O-CB 3.37Å; N142-S146 PolarHBondContact O-N 3.44Å; N142-S146 PolarHBondContact O-OG 3Å; E143-S146 WeakPolarHBondContact CA-OG 3.35Å; E143-S146 PolarHBondContact O-N 2.94Å; E143-S146 VanDerWaalsContact O-N 3.09Å; E143-S146 PolarHBondContact O-OG 3.26Å; S146-K148 PolarHBondContact O-N 2.77Å
147	L	95.6	Very high	94.3	Very high	9 Å²	9	94.8 Å²	94.8	5%	0.047	46%	0.461	C	S	.	.			trans	-56.2	130.6	176.8	-73	174.3	0	0	0	111.6	V110 V113 R130 L133 E143 I144 R145 L149	V110-L147 HydrophobicContact CG1-CD1 3.6Å; V110-L147 HydrophobicContact CG1-CD2 3.98Å; V110-L147 HydrophobicContact CG1-CG 3.79Å; V113-L147 HydrophobicContact CG1-CD1 3.94Å; V113-L147 HydrophobicContact CG1-CD2 3.63Å; V113-L147 HydrophobicContact CG1-CG 4.42Å; R130-L147 VanDerWaalsContact CZ-O 3.3Å; R130-L147 PolarHBondContact NH1-O 3.34Å; R130-L147 PolarHBondContact NH2-O 3.1Å; L133-L147 HydrophobicContact CD1-CD1 3.59Å; E143-L147 PolarHBondContact O-N 3.22Å; I144-L147 WeakPolarHBondContact O-CB 3.45Å; I144-L147 PolarHBondContact O-N 3.48Å; R145-L147 VanDerWaalsContact C-N 3.26Å; R145-L147 PolarHBondContact O-N 3.32Å; L147-L149 HydrophobicContact CB-CD1 4.46Å; L147-L149 HydrophobicContact CB-CG 4.11Å; L147-L149 HydrophobicContact CD1-CD1 4.35Å; L147-L149 PolarHBondContact O-N 3.35Å
148	K	92.8	Very high	94.3	Very high	174 Å²	174	88.9 Å²	88.9	76%	0.757	45%	0.447	S	S	*	.			trans	-98.2	80.4	175.3	-67.5	-178.6	179.4	178.1	0	109.9	S146	S146-K148 PolarHBondContact O-N 2.77Å
149	L	89.5	Confident	94.1	Very high	9 Å²	9	88.3 Å²	88.3	5%	0.047	44%	0.441	C	S	.	.			trans	-101.2	92.6	176	-54.4	179.1	0	0	0	108	V113 W117 A126 V129 L147	V113-L149 HydrophobicContact CG1-CD2 4.16Å; W117-L149 HydrophobicContact CB-CD2 4.45Å; W117-L149 HydrophobicContact CD2-CB 4.19Å; W117-L149 HydrophobicContact CD2-CD2 3.73Å; W117-L149 HydrophobicContact CD2-CG 4.4Å; W117-L149 HydrophobicContact CE3-CB 4.48Å; W117-L149 HydrophobicContact CE3-CD1 4.33Å; W117-L149 HydrophobicContact CE3-CD2 4.03Å; W117-L149 HydrophobicContact CE3-CG 4.5Å; W117-L149 HydrophobicContact CG-CD2 3.9Å; W117-L149 HydrophobicContact CH2-CB 4.11Å; W117-L149 HydrophobicContact CZ2-CB 3.71Å; W117-L149 HydrophobicContact CZ3-CB 4.45Å; W117-L149 HydrophobicContact CZ3-CD1 4.29Å; A126-L149 HydrophobicContact CB-CB 3.85Å; V129-L149 HydrophobicContact CB-CD1 3.91Å; V129-L149 HydrophobicContact CG1-CD1 3.53Å; L147-L149 HydrophobicContact CB-CD1 4.46Å; L147-L149 HydrophobicContact CB-CG 4.11Å; L147-L149 HydrophobicContact CD1-CD1 4.35Å; L147-L149 PolarHBondContact O-N 3.35Å
150	Q	78.5	Confident	93.8	Very high	233 Å²	233	94.8 Å²	94.8	100%	1.089	48%	0.475	S	S	*	.			trans	-119.5	0	175.8	-69.5	-175.5	-40.6	0	0	109.5	W117	W117-Q150 PolarHBondContact NE1-O 3.07Å

Retrieved 150 of 150 residues in 33.4 ms (Link to these results)

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