A0A087XZX8_POEFO Loading...

ATPase H+ transporting V1 subunit E1a

Subunit of the V1 complex of vacuolar(H+)-ATPase (V-ATPase), a multisubunit enzyme composed of a peripheral complex (V1) that hydrolyzes ATP and a membrane integral complex (V0) that translocates protons. V-ATPase is responsible for acidifying and maintaining the pH of intracellular compartments and in some cell types, is targeted to the plasma membrane, where it is responsible for acidifying the extracellular environment.

AlphaFold DB , UniProt , Accession A0A087XZX8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 226 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	47.8	Very low	72.1	Confident	246 Å²	246	112.1 Å²	112.1	100%	1.212	61%	0.614	S	S	*	*				0	119.3	0	-84	169.3	158.9	0	0	107.1
2	A	56.2	Low	73	Confident	100 Å²	100	110.3 Å²	110.3	83%	0.826	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-64.8	134.3	171.5	0	0	0	0	0	108.2	T4	A2-T4 PolarHBondContact O-N 3.04Å
3	L	61.7	Low	74.1	Confident	117 Å²	117	113.4 Å²	113.4	61%	0.613	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-52.9	133.6	174	-79.9	138.5	0	0	0	109.5	D7 V8	L3-D7 HydrophobicContact CD2-CB 4.24Å; L3-V8 HydrophobicContact CB-CG2 4.17Å
4	T	75.5	Confident	75.1	Confident	92 Å²	92	115.3 Å²	115.3	56%	0.564	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-69.6	141.9	176	11	0	0	0	0	110.2	A2 A6 D7 V8	A2-T4 PolarHBondContact O-N 3.04Å; T4-A6 PolarHBondContact O-N 3.41Å; T4-D7 WeakPolarHBondContact O-CB 3.43Å; T4-D7 PolarHBondContact O-N 3.46Å; T4-D7 PolarHBondContact OG1-OD2 3.09Å; T4-V8 PolarHBondContact O-N 3.29Å
5	D	72.8	Confident	76	Confident	130 Å²	130	115.9 Å²	115.9	70%	0.695	61%	0.609	S	S	*	*	H	α-helix	trans	-56.5	-28.6	-173.5	-148.2	28.7	0	0	0	112.9	V8 Q9	D5-V8 PolarHBondContact O-N 2.95Å; D5-Q9 PolarHBondContact O-N 3.19Å
6	A	77.7	Confident	76.7	Confident	61 Å²	61	116.1 Å²	116.1	50%	0.504	61%	0.608	S	S	.	*	H	α-helix	trans	-67.5	-31.3	173.1	0	0	0	0	0	114.1	T4 K10	T4-A6 PolarHBondContact O-N 3.41Å; A6-K10 WeakPolarHBondContact O-CG 3.38Å; A6-K10 PolarHBondContact O-N 3.46Å; A6-K10 VanDerWaalsContact O-N 3.16Å
7	D	77.4	Confident	77.5	Confident	61 Å²	61	112.5 Å²	112.5	33%	0.326	60%	0.598	S	S	.	*	H	α-helix	trans	-79	-34.2	177.6	-60.7	-46.2	0	0	0	111.1	L3 T4 K10 Q11	L3-D7 HydrophobicContact CD2-CB 4.24Å; T4-D7 WeakPolarHBondContact O-CB 3.43Å; T4-D7 PolarHBondContact O-N 3.46Å; T4-D7 PolarHBondContact OG1-OD2 3.09Å; D7-K10 PolarHBondContact O-N 3.21Å; D7-Q11 PolarHBondContact O-N 3.05Å
8	V	79.4	Confident	78.3	Confident	53 Å²	53	112.8 Å²	112.8	32%	0.321	59%	0.594	S	S	.	*	H	α-helix	trans	-62.9	-44.8	171	-179.2	0	0	0	0	110.3	L3 T4 D5 K10 Q11 I12	L3-V8 HydrophobicContact CB-CG2 4.17Å; T4-V8 PolarHBondContact O-N 3.29Å; D5-V8 PolarHBondContact O-N 2.95Å; V8-K10 VanDerWaalsContact C-N 3.35Å; V8-K10 PolarHBondContact O-N 3.48Å; V8-Q11 PolarHBondContact O-N 3.4Å; V8-I12 HydrophobicContact CG1-CD1 4.06Å; V8-I12 WeakPolarHBondContact O-CG1 3.48Å; V8-I12 PolarHBondContact O-N 3.12Å
9	Q	79.8	Confident	79.1	Confident	116 Å²	116	112.4 Å²	112.4	54%	0.542	59%	0.591	S	S	.	*	H	α-helix	trans	-62.9	-36.8	174.6	-76.9	-171.7	-2.8	0	0	113.5	D5 I12 K13	D5-Q9 PolarHBondContact O-N 3.19Å; Q9-I12 PolarHBondContact O-N 2.87Å; Q9-K13 WeakPolarHBondContact O-CG 3.08Å; Q9-K13 PolarHBondContact O-N 3.39Å
10	K	83.6	Confident	79.8	Confident	143 Å²	143	113.2 Å²	113.2	62%	0.622	59%	0.592	S	S	*	*	H	α-helix	trans	-65.9	-41.4	174.3	-78.1	176	-178	172.8	0	111.9	A6 D7 V8 K13 H14	A6-K10 WeakPolarHBondContact O-CG 3.38Å; A6-K10 PolarHBondContact O-N 3.46Å; A6-K10 VanDerWaalsContact O-N 3.16Å; D7-K10 PolarHBondContact O-N 3.21Å; V8-K10 VanDerWaalsContact C-N 3.35Å; V8-K10 PolarHBondContact O-N 3.48Å; K10-K13 PolarHBondContact O-N 2.9Å; K10-H14 WeakPolarHBondContact O-CB 3.43Å; K10-H14 PolarHBondContact O-N 2.86Å
11	Q	81.2	Confident	80.4	Confident	114 Å²	114	113.1 Å²	113.1	53%	0.533	59%	0.588	S	S	.	*	H	α-helix	trans	-64.2	-41.5	175	-78.6	-175.1	-24.6	0	0	112.3	D7 V8 H14 M15	D7-Q11 PolarHBondContact O-N 3.05Å; V8-Q11 PolarHBondContact O-N 3.4Å; Q11-H14 PolarHBondContact O-N 2.89Å; Q11-M15 PolarHBondContact O-N 3.37Å
12	I	83.5	Confident	82.7	Confident	91 Å²	91	105 Å²	105	47%	0.467	55%	0.547	S	S	.	.	H	α-helix	trans	-61.9	-44.9	175.5	-68	168.4	0	0	0	110.7	V8 Q9 H14 M15 M16	V8-I12 HydrophobicContact CG1-CD1 4.06Å; V8-I12 WeakPolarHBondContact O-CG1 3.48Å; V8-I12 PolarHBondContact O-N 3.12Å; Q9-I12 PolarHBondContact O-N 2.87Å; I12-H14 VanDerWaalsContact C-N 3.34Å; I12-H14 PolarHBondContact O-N 2.96Å; I12-M15 PolarHBondContact O-N 3.46Å; I12-M16 HydrophobicContact CG2-CG 4.45Å; I12-M16 HydrophobicContact CG2-SD 4.14Å; I12-M16 WeakPolarHBondContact O-CG 3.22Å; I12-M16 PolarHBondContact O-N 3.04Å
13	K	87.2	Confident	84.5	Confident	150 Å²	150	102.5 Å²	102.5	65%	0.652	53%	0.527	S	S	*	.	H	α-helix	trans	-62.4	-40.2	175.9	-75.7	-178.5	179.9	-178.3	0	112.6	Q9 K10 M16 A17	Q9-K13 WeakPolarHBondContact O-CG 3.08Å; Q9-K13 PolarHBondContact O-N 3.39Å; K10-K13 PolarHBondContact O-N 2.9Å; K13-M16 PolarHBondContact O-N 3.28Å; K13-A17 WeakPolarHBondContact O-CB 3.48Å; K13-A17 PolarHBondContact O-N 2.92Å
14	H	88.3	Confident	86.1	Confident	140 Å²	140	101.2 Å²	101.2	65%	0.648	52%	0.521	S	S	*	.	H	α-helix	trans	-64.7	-41.8	175.2	-173.8	-80.4	0	0	0	111.7	K10 Q11 I12 A17 F18	K10-H14 WeakPolarHBondContact O-CB 3.43Å; K10-H14 PolarHBondContact O-N 2.86Å; Q11-H14 PolarHBondContact O-N 2.89Å; I12-H14 VanDerWaalsContact C-N 3.34Å; I12-H14 PolarHBondContact O-N 2.96Å; H14-A17 PolarHBondContact O-N 3Å; H14-F18 WeakPolarHBondContact O-CB 3.49Å; H14-F18 PolarHBondContact O-N 3.39Å
15	M	87.6	Confident	87	Confident	124 Å²	124	101.9 Å²	101.9	61%	0.611	52%	0.517	S	S	*	.	H	α-helix	trans	-63.4	-41.5	173.8	-79	-174.5	69.2	0	0	112.1	Q11 I12 F18 I19	Q11-M15 PolarHBondContact O-N 3.37Å; I12-M15 PolarHBondContact O-N 3.46Å; M15-F18 PolarHBondContact O-N 3.26Å; M15-I19 VanDerWaalsContact O-CG1 3.28Å; M15-I19 WeakPolarHBondContact O-CG1 3.46Å; M15-I19 PolarHBondContact O-N 3.21Å
16	M	86.9	Confident	88.1	Confident	120 Å²	120	102.7 Å²	102.7	59%	0.591	51%	0.511	S	S	*	.	H	α-helix	trans	-63	-44.9	176	-72.5	177.4	67.2	0	0	112	I12 K13 F18 I19 E20	I12-M16 HydrophobicContact CG2-CG 4.45Å; I12-M16 HydrophobicContact CG2-SD 4.14Å; I12-M16 WeakPolarHBondContact O-CG 3.22Å; I12-M16 PolarHBondContact O-N 3.04Å; K13-M16 PolarHBondContact O-N 3.28Å; M16-F18 VanDerWaalsContact C-N 3.31Å; M16-F18 PolarHBondContact O-N 2.81Å; M16-I19 PolarHBondContact O-N 3.17Å; M16-E20 WeakPolarHBondContact O-CB 3.39Å; M16-E20 PolarHBondContact O-N 3.24Å
17	A	90.4	Very high	88.9	Confident	54 Å²	54	103.6 Å²	103.6	45%	0.446	51%	0.51	S	S	.	.	H	α-helix	trans	-63.3	-37.4	176.9	0	0	0	0	0	112.2	K13 H14 E20 Q21	K13-A17 WeakPolarHBondContact O-CB 3.48Å; K13-A17 PolarHBondContact O-N 2.92Å; H14-A17 PolarHBondContact O-N 3Å; A17-E20 PolarHBondContact O-N 2.65Å; A17-Q21 WeakPolarHBondContact O-CB 3.4Å; A17-Q21 PolarHBondContact O-N 2.93Å
18	F	93.2	Very high	89.7	Confident	118 Å²	118	107.4 Å²	107.4	52%	0.518	53%	0.525	S	S	.	.	H	α-helix	trans	-64.1	-44.7	174.1	-179.5	-93.9	0	0	0	112	H14 M15 M16 E20 Q21 E22	H14-F18 WeakPolarHBondContact O-CB 3.49Å; H14-F18 PolarHBondContact O-N 3.39Å; M15-F18 PolarHBondContact O-N 3.26Å; M16-F18 VanDerWaalsContact C-N 3.31Å; M16-F18 PolarHBondContact O-N 2.81Å; F18-E20 VanDerWaalsContact C-N 3.31Å; F18-E20 PolarHBondContact O-N 2.84Å; F18-Q21 PolarHBondContact O-N 3.22Å; F18-E22 WeakPolarHBondContact O-CB 3.43Å; F18-E22 PolarHBondContact O-N 2.67Å
19	I	93.2	Very high	90.5	Very high	105 Å²	105	109.7 Å²	109.7	54%	0.538	53%	0.533	S	S	.	.	H	α-helix	trans	-62.3	-41.1	176.9	-68.2	165.1	0	0	0	110.8	M15 M16 A23	M15-I19 VanDerWaalsContact O-CG1 3.28Å; M15-I19 WeakPolarHBondContact O-CG1 3.46Å; M15-I19 PolarHBondContact O-N 3.21Å; M16-I19 PolarHBondContact O-N 3.17Å; I19-A23 VanDerWaalsContact O-CB 3.31Å; I19-A23 WeakPolarHBondContact O-CB 3.47Å; I19-A23 PolarHBondContact O-N 2.93Å
20	E	92.8	Very high	91.2	Very high	129 Å²	129	110 Å²	110	60%	0.603	54%	0.537	S	S	*	.	H	α-helix	trans	-67.1	-41.4	177.9	-170.4	172	-168.3	0	0	111.8	M16 A17 F18 A23 N24	M16-E20 WeakPolarHBondContact O-CB 3.39Å; M16-E20 PolarHBondContact O-N 3.24Å; A17-E20 PolarHBondContact O-N 2.65Å; F18-E20 VanDerWaalsContact C-N 3.31Å; F18-E20 PolarHBondContact O-N 2.84Å; E20-A23 PolarHBondContact O-N 2.83Å; E20-N24 WeakPolarHBondContact O-CB 3.25Å; E20-N24 VanDerWaalsContact O-CG 3.24Å; E20-N24 PolarHBondContact O-N 3.09Å; E20-N24 PolarHBondContact O-ND2 3.44Å
21	Q	93	Very high	91.8	Very high	112 Å²	112	108.3 Å²	108.3	52%	0.523	53%	0.534	S	S	.	.	H	α-helix	trans	-64.1	-46.5	174.3	-176	178	-10.5	0	0	111.7	A17 F18 A23 N24 E25	A17-Q21 WeakPolarHBondContact O-CB 3.4Å; A17-Q21 PolarHBondContact O-N 2.93Å; F18-Q21 PolarHBondContact O-N 3.22Å; Q21-A23 VanDerWaalsContact C-N 3.29Å; Q21-A23 PolarHBondContact O-N 3.39Å; Q21-N24 PolarHBondContact O-N 2.99Å; Q21-E25 HydrophobicContact CG-CG 4.43Å; Q21-E25 WeakPolarHBondContact CG-OE1 3.27Å; Q21-E25 PolarHBondContact NE2-OE1 3.28Å; Q21-E25 WeakPolarHBondContact O-CG 3.46Å; Q21-E25 PolarHBondContact O-N 3.44Å
22	E	94.6	Very high	92.5	Very high	74 Å²	74	105.2 Å²	105.2	35%	0.346	53%	0.528	S	S	.	.	H	α-helix	trans	-61.9	-39	177.9	-168.1	-172.8	164.1	0	0	111.2	F18 R26	F18-E22 WeakPolarHBondContact O-CB 3.43Å; F18-E22 PolarHBondContact O-N 2.67Å; E22-R26 WeakPolarHBondContact O-CB 3.22Å; E22-R26 WeakPolarHBondContact O-CG 3.43Å; E22-R26 PolarHBondContact O-N 3.48Å; E22-R26 IonicContact OE1-CZ 3.87Å; E22-R26 IonicContact OE1-NE 3.41Å; E22-R26 IonicContact OE1-NH2 2.8Å; E22-R26 PolarHBondContact OE1-NH2 2.94Å
23	A	95.8	Very high	93.1	Very high	49 Å²	49	106.1 Å²	106.1	41%	0.405	53%	0.529	S	S	.	.	H	α-helix	trans	-64.2	-44.3	175	0	0	0	0	0	111.9	I19 E20 Q21 R26 V27	I19-A23 VanDerWaalsContact O-CB 3.31Å; I19-A23 WeakPolarHBondContact O-CB 3.47Å; I19-A23 PolarHBondContact O-N 2.93Å; E20-A23 PolarHBondContact O-N 2.83Å; Q21-A23 VanDerWaalsContact C-N 3.29Å; Q21-A23 PolarHBondContact O-N 3.39Å; A23-R26 PolarHBondContact O-N 2.59Å; A23-V27 WeakPolarHBondContact O-CG2 3.47Å; A23-V27 PolarHBondContact O-N 2.82Å
24	N	94	Very high	93.6	Very high	90 Å²	90	100.8 Å²	100.8	48%	0.481	52%	0.516	S	S	.	.	H	α-helix	trans	-65.3	-43.6	178	-72.3	-28.9	0	0	0	111.9	E20 Q21 R26 V27 E28	E20-N24 WeakPolarHBondContact O-CB 3.25Å; E20-N24 VanDerWaalsContact O-CG 3.24Å; E20-N24 PolarHBondContact O-N 3.09Å; E20-N24 PolarHBondContact O-ND2 3.44Å; Q21-N24 PolarHBondContact O-N 2.99Å; N24-R26 VanDerWaalsContact C-N 3.32Å; N24-R26 PolarHBondContact O-N 3.41Å; N24-V27 PolarHBondContact O-N 3.31Å; N24-V27 VanDerWaalsContact O-N 3.15Å; N24-E28 PolarHBondContact O-N 3.15Å
25	E	94.6	Very high	93.9	Very high	105 Å²	105	99.1 Å²	99.1	49%	0.491	51%	0.512	S	S	.	.	H	α-helix	trans	-60.6	-40.9	175.3	-74.7	176.4	-170	0	0	111.4	Q21 E28 E29	Q21-E25 HydrophobicContact CG-CG 4.43Å; Q21-E25 WeakPolarHBondContact CG-OE1 3.27Å; Q21-E25 PolarHBondContact NE2-OE1 3.28Å; Q21-E25 WeakPolarHBondContact O-CG 3.46Å; Q21-E25 PolarHBondContact O-N 3.44Å; E25-E28 PolarHBondContact O-N 3.08Å; E25-E29 WeakPolarHBondContact O-CB 3.47Å; E25-E29 PolarHBondContact O-N 2.78Å
26	R	95.3	Very high	94.2	Very high	148 Å²	148	99.2 Å²	99.2	56%	0.558	51%	0.511	S	S	*	.	H	α-helix	trans	-65.6	-37.3	174.1	-76.3	-169.1	-169	-171.3	8.7	113.1	E22 A23 N24 E29 I30	E22-R26 WeakPolarHBondContact O-CB 3.22Å; E22-R26 WeakPolarHBondContact O-CG 3.43Å; E22-R26 PolarHBondContact O-N 3.48Å; E22-R26 IonicContact OE1-CZ 3.87Å; E22-R26 IonicContact OE1-NE 3.41Å; E22-R26 IonicContact OE1-NH2 2.8Å; E22-R26 PolarHBondContact OE1-NH2 2.94Å; A23-R26 PolarHBondContact O-N 2.59Å; N24-R26 VanDerWaalsContact C-N 3.32Å; N24-R26 PolarHBondContact O-N 3.41Å; R26-E29 PolarHBondContact O-N 3.16Å; R26-I30 VanDerWaalsContact O-CG1 3.24Å; R26-I30 WeakPolarHBondContact O-CG1 3.45Å; R26-I30 PolarHBondContact O-N 2.84Å
27	V	95.6	Very high	94.6	Very high	80 Å²	80	98.5 Å²	98.5	49%	0.485	51%	0.506	S	S	.	.	H	α-helix	trans	-64.3	-46.5	175.7	169.4	0	0	0	0	110.1	A23 N24 E29 I30 L31	A23-V27 WeakPolarHBondContact O-CG2 3.47Å; A23-V27 PolarHBondContact O-N 2.82Å; N24-V27 PolarHBondContact O-N 3.31Å; N24-V27 VanDerWaalsContact O-N 3.15Å; V27-E29 VanDerWaalsContact C-N 3.34Å; V27-E29 PolarHBondContact O-N 2.96Å; V27-I30 PolarHBondContact O-N 3.42Å; V27-L31 HydrophobicContact CG1-CD1 3.96Å; V27-L31 HydrophobicContact CG1-CG 4.44Å; V27-L31 VanDerWaalsContact O-CG 3.31Å; V27-L31 WeakPolarHBondContact O-CG 3.24Å; V27-L31 PolarHBondContact O-N 3.39Å
28	E	94.2	Very high	94.8	Very high	140 Å²	140	101.7 Å²	101.7	65%	0.654	51%	0.51	S	S	*	.	H	α-helix	trans	-61.1	-42.2	176.3	-72.5	-172.5	171.5	0	0	112	N24 E25 I30 L31 A32	N24-E28 PolarHBondContact O-N 3.15Å; E25-E28 PolarHBondContact O-N 3.08Å; E28-I30 PolarHBondContact O-N 2.87Å; E28-L31 PolarHBondContact O-N 3.06Å; E28-A32 WeakPolarHBondContact O-CB 3.33Å; E28-A32 PolarHBondContact O-N 3.01Å
29	E	95.3	Very high	95	Very high	102 Å²	102	100.8 Å²	100.8	48%	0.477	51%	0.511	S	S	.	.	H	α-helix	trans	-62.5	-42.1	176.8	-168.4	-172.7	176.5	0	0	112	E25 R26 V27 K33	E25-E29 WeakPolarHBondContact O-CB 3.47Å; E25-E29 PolarHBondContact O-N 2.78Å; R26-E29 PolarHBondContact O-N 3.16Å; V27-E29 VanDerWaalsContact C-N 3.34Å; V27-E29 PolarHBondContact O-N 2.96Å; E29-K33 HydrophobicContact CG-CD 4.33Å; E29-K33 WeakPolarHBondContact O-CB 3.49Å; E29-K33 VanDerWaalsContact O-CG 3.3Å; E29-K33 WeakPolarHBondContact O-CG 3.44Å; E29-K33 PolarHBondContact O-N 3.16Å; E29-K33 VanDerWaalsContact OE1-CE 3.24Å; E29-K33 WeakPolarHBondContact OE1-CE 3.48Å; E29-K33 IonicContact OE1-NZ 2.68Å; E29-K33 PolarHBondContact OE1-NZ 3.27Å
30	I	95.8	Very high	95.1	Very high	121 Å²	121	101.4 Å²	101.4	62%	0.621	51%	0.514	S	S	*	.	H	α-helix	trans	-65.1	-42.1	177.2	-70.8	167.2	0	0	0	110.8	R26 V27 E28 K33 G34	R26-I30 VanDerWaalsContact O-CG1 3.24Å; R26-I30 WeakPolarHBondContact O-CG1 3.45Å; R26-I30 PolarHBondContact O-N 2.84Å; V27-I30 PolarHBondContact O-N 3.42Å; E28-I30 PolarHBondContact O-N 2.87Å; I30-K33 PolarHBondContact O-N 2.9Å; I30-G34 PolarHBondContact O-N 3Å
31	L	95.3	Very high	95.2	Very high	108 Å²	108	101.3 Å²	101.3	57%	0.565	51%	0.512	S	S	*	.	H	α-helix	trans	-65.8	-46.4	178.5	-70.6	173.4	0	0	0	111.4	V27 E28 K33 G34 D35	V27-L31 HydrophobicContact CG1-CD1 3.96Å; V27-L31 HydrophobicContact CG1-CG 4.44Å; V27-L31 VanDerWaalsContact O-CG 3.31Å; V27-L31 WeakPolarHBondContact O-CG 3.24Å; V27-L31 PolarHBondContact O-N 3.39Å; E28-L31 PolarHBondContact O-N 3.06Å; L31-K33 VanDerWaalsContact C-N 3.35Å; L31-K33 PolarHBondContact O-N 3.31Å; L31-G34 WeakPolarHBondContact O-CA 3.09Å; L31-G34 PolarHBondContact O-N 3.19Å; L31-G34 VanDerWaalsContact O-N 3.1Å; L31-D35 PolarHBondContact O-N 3.32Å
32	A	95.6	Very high	95.4	Very high	50 Å²	50	101.6 Å²	101.6	41%	0.413	51%	0.511	S	S	.	.	H	α-helix	trans	-59	-45.6	176.5	0	0	0	0	0	111.5	E28 G34 D35 E36	E28-A32 WeakPolarHBondContact O-CB 3.33Å; E28-A32 PolarHBondContact O-N 3.01Å; A32-G34 VanDerWaalsContact C-N 3.32Å; A32-G34 PolarHBondContact O-N 3.49Å; A32-D35 PolarHBondContact O-N 2.91Å; A32-E36 WeakPolarHBondContact O-CG 3.33Å; A32-E36 PolarHBondContact O-N 3.15Å
33	K	96.3	Very high	95.5	Very high	110 Å²	110	99.7 Å²	99.7	48%	0.478	51%	0.511	S	S	.	.	H	α-helix	trans	-62.7	-38.4	174.2	-74.8	177.2	-176.1	170.2	0	112.5	E29 I30 L31 E36 E37	E29-K33 HydrophobicContact CG-CD 4.33Å; E29-K33 WeakPolarHBondContact O-CB 3.49Å; E29-K33 VanDerWaalsContact O-CG 3.3Å; E29-K33 WeakPolarHBondContact O-CG 3.44Å; E29-K33 PolarHBondContact O-N 3.16Å; E29-K33 VanDerWaalsContact OE1-CE 3.24Å; E29-K33 WeakPolarHBondContact OE1-CE 3.48Å; E29-K33 IonicContact OE1-NZ 2.68Å; E29-K33 PolarHBondContact OE1-NZ 3.27Å; I30-K33 PolarHBondContact O-N 2.9Å; L31-K33 VanDerWaalsContact C-N 3.35Å; L31-K33 PolarHBondContact O-N 3.31Å; K33-E36 PolarHBondContact O-N 3.45Å; K33-E37 WeakPolarHBondContact O-CB 3.32Å; K33-E37 WeakPolarHBondContact O-CG 3.35Å; K33-E37 PolarHBondContact O-N 3.22Å
34	G	96.7	Very high	95.5	Very high	38 Å²	38	106.6 Å²	106.6	39%	0.392	53%	0.527	S	S	.	.	H	α-helix	trans	-60	-45.5	176	0	0	0	0	0	112.4	I30 L31 A32 E37 F38	I30-G34 PolarHBondContact O-N 3Å; L31-G34 WeakPolarHBondContact O-CA 3.09Å; L31-G34 PolarHBondContact O-N 3.19Å; L31-G34 VanDerWaalsContact O-N 3.1Å; A32-G34 VanDerWaalsContact C-N 3.32Å; A32-G34 PolarHBondContact O-N 3.49Å; G34-E37 PolarHBondContact O-N 2.92Å; G34-F38 WeakPolarHBondContact O-CB 3.44Å; G34-F38 PolarHBondContact O-N 3.4Å
35	D	94.6	Very high	95.6	Very high	105 Å²	105	107.3 Å²	107.3	56%	0.561	53%	0.53	S	S	*	.	H	α-helix	trans	-68.9	-40.6	178.6	-77.7	-20	0	0	0	112.4	L31 A32 F38 N39	L31-D35 PolarHBondContact O-N 3.32Å; A32-D35 PolarHBondContact O-N 2.91Å; D35-F38 PolarHBondContact O-N 3.49Å; D35-N39 WeakPolarHBondContact O-CB 3.45Å; D35-N39 PolarHBondContact O-N 3.02Å; D35-N39 PolarHBondContact O-ND2 3.33Å
36	E	94.8	Very high	95.7	Very high	126 Å²	126	105.3 Å²	105.3	59%	0.589	53%	0.525	S	S	*	.	H	α-helix	trans	-60.4	-49.7	173.5	-74.6	-178.3	179.5	0	0	111.3	A32 K33 F38 N39 I40	A32-E36 WeakPolarHBondContact O-CG 3.33Å; A32-E36 PolarHBondContact O-N 3.15Å; K33-E36 PolarHBondContact O-N 3.45Å; E36-F38 VanDerWaalsContact C-N 3.34Å; E36-F38 PolarHBondContact O-N 3.05Å; E36-N39 PolarHBondContact O-N 2.85Å; E36-I40 VanDerWaalsContact O-CG1 3.25Å; E36-I40 WeakPolarHBondContact O-CG1 3.44Å; E36-I40 PolarHBondContact O-N 3.18Å
37	E	95.3	Very high	95.7	Very high	105 Å²	105	103.4 Å²	103.4	49%	0.491	52%	0.522	S	S	.	.	H	α-helix	trans	-62.1	-40.6	177.6	-81.2	-159.5	-168.3	0	0	112.5	K33 G34 I40 K41	K33-E37 WeakPolarHBondContact O-CB 3.32Å; K33-E37 WeakPolarHBondContact O-CG 3.35Å; K33-E37 PolarHBondContact O-N 3.22Å; G34-E37 PolarHBondContact O-N 2.92Å; E37-I40 PolarHBondContact O-N 3.46Å; E37-K41 WeakPolarHBondContact O-CB 3.42Å; E37-K41 WeakPolarHBondContact O-CG 3.18Å; E37-K41 PolarHBondContact O-N 3.41Å; E37-K41 IonicContact OE2-NZ 2.76Å; E37-K41 PolarHBondContact OE2-NZ 2.92Å
38	F	95.8	Very high	95.7	Very high	120 Å²	120	102.6 Å²	102.6	53%	0.526	52%	0.518	S	S	.	.	H	α-helix	trans	-59.8	-48.6	176.8	172.2	-99.8	0	0	0	110.9	G34 D35 E36 I40 K41 K42	G34-F38 WeakPolarHBondContact O-CB 3.44Å; G34-F38 PolarHBondContact O-N 3.4Å; D35-F38 PolarHBondContact O-N 3.49Å; E36-F38 VanDerWaalsContact C-N 3.34Å; E36-F38 PolarHBondContact O-N 3.05Å; F38-I40 PolarHBondContact O-N 3.25Å; F38-K41 PolarHBondContact O-N 3.06Å; F38-K42 HydrophobicContact CE1-CD 4Å; F38-K42 HydrophobicContact CZ-CD 4.06Å; F38-K42 WeakPolarHBondContact O-CB 3.34Å; F38-K42 PolarHBondContact O-N 3.25Å
39	N	95.6	Very high	95.8	Very high	100 Å²	100	100.4 Å²	100.4	54%	0.535	51%	0.508	S	S	.	.	H	α-helix	trans	-63.9	-41.1	179.8	-75.3	-41.2	0	0	0	111.9	D35 E36 G43	D35-N39 WeakPolarHBondContact O-CB 3.45Å; D35-N39 PolarHBondContact O-N 3.02Å; D35-N39 PolarHBondContact O-ND2 3.33Å; E36-N39 PolarHBondContact O-N 2.85Å; N39-G43 PolarHBondContact O-N 2.91Å
40	I	95.6	Very high	95.9	Very high	117 Å²	117	102.6 Å²	102.6	60%	0.6	51%	0.511	S	S	*	.	H	α-helix	trans	-63.6	-48.5	176	-67.9	165.8	0	0	0	110.9	E36 E37 F38 G43 R44	E36-I40 VanDerWaalsContact O-CG1 3.25Å; E36-I40 WeakPolarHBondContact O-CG1 3.44Å; E36-I40 PolarHBondContact O-N 3.18Å; E37-I40 PolarHBondContact O-N 3.46Å; F38-I40 PolarHBondContact O-N 3.25Å; I40-G43 PolarHBondContact O-N 3.45Å; I40-R44 WeakPolarHBondContact O-CB 3.23Å; I40-R44 PolarHBondContact O-N 3Å
41	K	95.3	Very high	95.9	Very high	128 Å²	128	100.5 Å²	100.5	56%	0.557	50%	0.504	S	S	*	.	H	α-helix	trans	-64.8	-44.6	-179.2	-74.9	172.8	-173.7	156.4	0	111.4	E37 F38 R44 L45	E37-K41 WeakPolarHBondContact O-CB 3.42Å; E37-K41 WeakPolarHBondContact O-CG 3.18Å; E37-K41 PolarHBondContact O-N 3.41Å; E37-K41 IonicContact OE2-NZ 2.76Å; E37-K41 PolarHBondContact OE2-NZ 2.92Å; F38-K41 PolarHBondContact O-N 3.06Å; K41-R44 PolarHBondContact O-N 3.42Å; K41-L45 WeakPolarHBondContact O-CB 3.46Å; K41-L45 PolarHBondContact O-N 2.98Å
42	K	97.2	Very high	96	Very high	117 Å²	117	101.3 Å²	101.3	51%	0.509	50%	0.503	S	S	.	.	H	α-helix	trans	-59.9	-47.9	174.7	-179.5	-177.6	174.5	-176.2	0	111	F38 R44 L45 V46	F38-K42 HydrophobicContact CE1-CD 4Å; F38-K42 HydrophobicContact CZ-CD 4.06Å; F38-K42 WeakPolarHBondContact O-CB 3.34Å; F38-K42 PolarHBondContact O-N 3.25Å; K42-R44 PolarHBondContact O-N 3.44Å; K42-L45 PolarHBondContact O-N 2.77Å; K42-V46 VanDerWaalsContact O-CG2 3.32Å; K42-V46 WeakPolarHBondContact O-CG2 3.39Å; K42-V46 PolarHBondContact O-N 3.14Å
43	G	95.9	Very high	96.1	Very high	34 Å²	34	103.4 Å²	103.4	35%	0.351	51%	0.506	S	S	.	.	H	α-helix	trans	-57.4	-49.4	176.6	0	0	0	0	0	111.8	N39 I40 L45 V46 Q47	N39-G43 PolarHBondContact O-N 2.91Å; I40-G43 PolarHBondContact O-N 3.45Å; G43-L45 PolarHBondContact O-N 3.47Å; G43-V46 PolarHBondContact O-N 3.08Å; G43-Q47 VanDerWaalsContact O-CG 3.29Å; G43-Q47 WeakPolarHBondContact O-CG 3.23Å; G43-Q47 PolarHBondContact O-N 3.34Å
44	R	96.2	Very high	96.1	Very high	194 Å²	194	104.5 Å²	104.5	73%	0.732	52%	0.515	S	S	*	.	H	α-helix	trans	-60	-43.4	178	-172.4	176.7	-178.8	177.7	1.2	112.4	I40 K41 K42 T48	I40-R44 WeakPolarHBondContact O-CB 3.23Å; I40-R44 PolarHBondContact O-N 3Å; K41-R44 PolarHBondContact O-N 3.42Å; K42-R44 PolarHBondContact O-N 3.44Å; R44-T48 WeakPolarHBondContact O-CB 3.29Å; R44-T48 PolarHBondContact O-N 3.18Å; R44-T48 PolarHBondContact O-OG1 3.06Å
45	L	96.2	Very high	96.1	Very high	106 Å²	106	106.3 Å²	106.3	56%	0.555	52%	0.516	S	S	*	.	H	α-helix	trans	-63.8	-48.7	178.5	-172.6	66.7	0	0	0	110.9	K41 K42 G43 Q47 T48 H49	K41-L45 WeakPolarHBondContact O-CB 3.46Å; K41-L45 PolarHBondContact O-N 2.98Å; K42-L45 PolarHBondContact O-N 2.77Å; G43-L45 PolarHBondContact O-N 3.47Å; L45-Q47 PolarHBondContact O-N 2.86Å; L45-T48 PolarHBondContact O-N 3.49Å; L45-H49 PolarHBondContact O-CD2 3.07Å; L45-H49 VanDerWaalsContact O-CD2 3.27Å; L45-H49 PolarHBondContact O-N 2.79Å
46	V	97.2	Very high	96.2	Very high	62 Å²	62	107.3 Å²	107.3	38%	0.376	51%	0.512	S	S	.	.	H	α-helix	trans	-60.7	-45.3	178.8	171.5	0	0	0	0	111.1	K42 G43 H49 R50	K42-V46 VanDerWaalsContact O-CG2 3.32Å; K42-V46 WeakPolarHBondContact O-CG2 3.39Å; K42-V46 PolarHBondContact O-N 3.14Å; G43-V46 PolarHBondContact O-N 3.08Å; V46-H49 PolarHBondContact O-N 3.41Å; V46-R50 HydrophobicContact CG1-CG 4.28Å; V46-R50 WeakPolarHBondContact O-CB 3.49Å; V46-R50 VanDerWaalsContact O-CG 3.28Å; V46-R50 WeakPolarHBondContact O-CG 3.47Å; V46-R50 PolarHBondContact O-N 3.37Å
47	Q	95.4	Very high	96.4	Very high	108 Å²	108	108.3 Å²	108.3	51%	0.505	51%	0.512	S	S	.	.	H	α-helix	trans	-64.6	-42.8	178.6	-67.1	-59.8	-12.8	0	0	111.9	G43 L45 H49 R50 V51	G43-Q47 VanDerWaalsContact O-CG 3.29Å; G43-Q47 WeakPolarHBondContact O-CG 3.23Å; G43-Q47 PolarHBondContact O-N 3.34Å; L45-Q47 PolarHBondContact O-N 2.86Å; Q47-H49 VanDerWaalsContact C-N 3.33Å; Q47-H49 PolarHBondContact O-N 3.29Å; Q47-R50 PolarHBondContact O-N 3.36Å; Q47-V51 WeakPolarHBondContact O-CG2 3.37Å; Q47-V51 PolarHBondContact O-N 2.99Å
48	T	96.5	Very high	96.4	Very high	64 Å²	64	107.7 Å²	107.7	39%	0.393	51%	0.509	S	S	.	.	H	α-helix	trans	-59.9	-44.1	177.6	-57.2	0	0	0	0	111.5	R44 L45 K52	R44-T48 WeakPolarHBondContact O-CB 3.29Å; R44-T48 PolarHBondContact O-N 3.18Å; R44-T48 PolarHBondContact O-OG1 3.06Å; L45-T48 PolarHBondContact O-N 3.49Å; T48-K52 WeakPolarHBondContact O-CG 3.43Å; T48-K52 PolarHBondContact O-N 3.05Å
49	H	95.8	Very high	96.5	Very high	94 Å²	94	108.8 Å²	108.8	44%	0.435	51%	0.513	S	S	.	.	H	α-helix	trans	-72.7	-34.5	177.6	-79.6	-78.9	0	0	0	112.8	L45 V46 Q47 K52 I53	L45-H49 PolarHBondContact O-CD2 3.07Å; L45-H49 VanDerWaalsContact O-CD2 3.27Å; L45-H49 PolarHBondContact O-N 2.79Å; V46-H49 PolarHBondContact O-N 3.41Å; Q47-H49 VanDerWaalsContact C-N 3.33Å; Q47-H49 PolarHBondContact O-N 3.29Å; H49-K52 PolarHBondContact O-N 2.81Å; H49-I53 VanDerWaalsContact O-CG1 3.3Å; H49-I53 WeakPolarHBondContact O-CG1 3.45Å; H49-I53 PolarHBondContact O-N 2.87Å
50	R	96.5	Very high	96.6	Very high	148 Å²	148	108 Å²	108	56%	0.558	51%	0.505	S	S	*	.	H	α-helix	trans	-59.1	-47.7	173.8	-82.6	179.1	168.4	-159.5	-3.8	111.8	V46 Q47 K52 I53 M54	V46-R50 HydrophobicContact CG1-CG 4.28Å; V46-R50 WeakPolarHBondContact O-CB 3.49Å; V46-R50 VanDerWaalsContact O-CG 3.28Å; V46-R50 WeakPolarHBondContact O-CG 3.47Å; V46-R50 PolarHBondContact O-N 3.37Å; Q47-R50 PolarHBondContact O-N 3.36Å; R50-K52 VanDerWaalsContact C-N 3.34Å; R50-K52 PolarHBondContact O-N 3.34Å; R50-I53 PolarHBondContact O-N 3.32Å; R50-I53 VanDerWaalsContact O-N 3.16Å; R50-M54 WeakPolarHBondContact O-CG 3.49Å; R50-M54 PolarHBondContact O-N 3.29Å
51	V	97.1	Very high	96.6	Very high	77 Å²	77	109 Å²	109	47%	0.467	51%	0.507	S	S	.	.	H	α-helix	trans	-59.6	-45.8	177.1	174.7	0	0	0	0	110.8	Q47 I53 M54 D55	Q47-V51 WeakPolarHBondContact O-CG2 3.37Å; Q47-V51 PolarHBondContact O-N 2.99Å; V51-I53 VanDerWaalsContact C-N 3.29Å; V51-I53 PolarHBondContact O-N 3.47Å; V51-M54 PolarHBondContact O-N 3.05Å; V51-M54 VanDerWaalsContact O-N 3.13Å; V51-D55 PolarHBondContact O-N 3.14Å
52	K	96.9	Very high	96.7	Very high	124 Å²	124	108.1 Å²	108.1	54%	0.539	50%	0.504	S	S	.	.	H	α-helix	trans	-58.2	-39.7	176	-71.4	177	179.3	179.9	0	113	T48 H49 R50 Y56	T48-K52 WeakPolarHBondContact O-CG 3.43Å; T48-K52 PolarHBondContact O-N 3.05Å; H49-K52 PolarHBondContact O-N 2.81Å; R50-K52 VanDerWaalsContact C-N 3.34Å; R50-K52 PolarHBondContact O-N 3.34Å; K52-Y56 WeakPolarHBondContact O-CB 3.41Å; K52-Y56 PolarHBondContact O-N 3.34Å; K52-Y56 VanDerWaalsContact O-N 3.14Å
53	I	97.2	Very high	96.7	Very high	95 Å²	95	108.1 Å²	108.1	49%	0.487	51%	0.505	S	S	.	.	H	α-helix	trans	-67.9	-44	177.2	-69.7	168.3	0	0	0	110.2	H49 R50 V51 Y56 Y57	H49-I53 VanDerWaalsContact O-CG1 3.3Å; H49-I53 WeakPolarHBondContact O-CG1 3.45Å; H49-I53 PolarHBondContact O-N 2.87Å; R50-I53 PolarHBondContact O-N 3.32Å; R50-I53 VanDerWaalsContact O-N 3.16Å; V51-I53 VanDerWaalsContact C-N 3.29Å; V51-I53 PolarHBondContact O-N 3.47Å; I53-Y56 PolarHBondContact O-N 3.07Å; I53-Y57 HydrophobicContact CG2-CD2 3.64Å; I53-Y57 HydrophobicContact CG2-CE2 3.65Å; I53-Y57 VanDerWaalsContact O-CD2 3.26Å; I53-Y57 WeakPolarHBondContact O-CD2 3.29Å; I53-Y57 PolarHBondContact O-N 3.19Å
54	M	96.5	Very high	96.8	Very high	133 Å²	133	111.1 Å²	111.1	66%	0.655	51%	0.512	S	S	*	.	H	α-helix	trans	-59.3	-49.4	176.5	-71.2	178	66.2	0	0	111.4	R50 V51 Y56 Y57 E58	R50-M54 WeakPolarHBondContact O-CG 3.49Å; R50-M54 PolarHBondContact O-N 3.29Å; V51-M54 PolarHBondContact O-N 3.05Å; V51-M54 VanDerWaalsContact O-N 3.13Å; M54-Y56 VanDerWaalsContact C-N 3.26Å; M54-Y56 PolarHBondContact O-N 2.69Å; M54-Y57 PolarHBondContact O-N 3.35Å; M54-Y57 VanDerWaalsContact O-N 3.16Å; M54-E58 WeakPolarHBondContact O-CB 3.39Å; M54-E58 PolarHBondContact O-N 3.43Å
55	D	96.8	Very high	96.8	Very high	76 Å²	76	106.6 Å²	106.6	41%	0.406	50%	0.499	S	S	.	.	H	α-helix	trans	-59.3	-37.8	178.4	-67.6	-12	0	0	0	112.2	V51 K59	V51-D55 PolarHBondContact O-N 3.14Å; D55-K59 VanDerWaalsContact O-CG 3.32Å; D55-K59 WeakPolarHBondContact O-CG 3.44Å; D55-K59 PolarHBondContact O-N 3.4Å; D55-K59 VanDerWaalsContact O-N 3.1Å
56	Y	97.3	Very high	96.9	Very high	126 Å²	126	107.5 Å²	107.5	49%	0.494	50%	0.501	S	S	.	.	H	α-helix	trans	-65.9	-45.4	177.2	177.2	-98.5	0	0	0	111.9	K52 I53 M54 K59 K60	K52-Y56 WeakPolarHBondContact O-CB 3.41Å; K52-Y56 PolarHBondContact O-N 3.34Å; K52-Y56 VanDerWaalsContact O-N 3.14Å; I53-Y56 PolarHBondContact O-N 3.07Å; M54-Y56 VanDerWaalsContact C-N 3.26Å; M54-Y56 PolarHBondContact O-N 2.69Å; Y56-K59 PolarHBondContact O-N 3.15Å; Y56-K60 HydrophobicContact CD1-CD 4.32Å; Y56-K60 HydrophobicContact CE1-CD 3.66Å; Y56-K60 HydrophobicContact CE1-CG 4.41Å; Y56-K60 PolarHBondContact O-N 3.38Å; Y56-K60 VanDerWaalsContact O-N 3.08Å; Y56-K60 WeakPolarHBondContact OH-CE 3.47Å; Y56-K60 PolarHBondContact OH-NZ 2.94Å
57	Y	97.4	Very high	96.8	Very high	147 Å²	147	110.1 Å²	110.1	58%	0.576	51%	0.509	S	S	*	.	H	α-helix	trans	-69.5	-37.9	177.9	-82	-69.5	0	0	0	112.2	I53 M54 K59 K60 E61	I53-Y57 HydrophobicContact CG2-CD2 3.64Å; I53-Y57 HydrophobicContact CG2-CE2 3.65Å; I53-Y57 VanDerWaalsContact O-CD2 3.26Å; I53-Y57 WeakPolarHBondContact O-CD2 3.29Å; I53-Y57 PolarHBondContact O-N 3.19Å; M54-Y57 PolarHBondContact O-N 3.35Å; M54-Y57 VanDerWaalsContact O-N 3.16Å; Y57-K59 VanDerWaalsContact C-N 3.33Å; Y57-K59 PolarHBondContact O-N 3.07Å; Y57-K60 PolarHBondContact O-N 3.44Å; Y57-E61 WeakPolarHBondContact O-CB 3.5Å; Y57-E61 PolarHBondContact O-N 3.23Å
58	E	96.9	Very high	97	Very high	92 Å²	92	111.5 Å²	111.5	43%	0.43	51%	0.513	S	S	.	.	H	α-helix	trans	-61.2	-42.9	175.7	-169.3	-171.5	168.5	0	0	111.2	M54 E61 K62	M54-E58 WeakPolarHBondContact O-CB 3.39Å; M54-E58 PolarHBondContact O-N 3.43Å; E58-E61 PolarHBondContact O-N 3.22Å; E58-K62 HydrophobicContact CG-CD 4.48Å; E58-K62 WeakPolarHBondContact O-CG 3.18Å; E58-K62 PolarHBondContact O-N 3.08Å; E58-K62 VanDerWaalsContact OE1-CE 3.24Å; E58-K62 WeakPolarHBondContact OE1-CE 3.48Å; E58-K62 IonicContact OE1-NZ 3.17Å; E58-K62 PolarHBondContact OE1-NZ 3.48Å
59	K	97.1	Very high	97	Very high	142 Å²	142	114.5 Å²	114.5	62%	0.617	52%	0.52	S	S	*	.	H	α-helix	trans	-62.5	-44.5	174.4	-74.9	173.5	-176.4	175.1	0	111.9	D55 Y56 Y57 K62 Q63	D55-K59 VanDerWaalsContact O-CG 3.32Å; D55-K59 WeakPolarHBondContact O-CG 3.44Å; D55-K59 PolarHBondContact O-N 3.4Å; D55-K59 VanDerWaalsContact O-N 3.1Å; Y56-K59 PolarHBondContact O-N 3.15Å; Y57-K59 VanDerWaalsContact C-N 3.33Å; Y57-K59 PolarHBondContact O-N 3.07Å; K59-K62 PolarHBondContact O-N 3.47Å; K59-Q63 WeakPolarHBondContact O-CB 3.45Å; K59-Q63 WeakPolarHBondContact O-CG 3.35Å; K59-Q63 PolarHBondContact O-N 3.31Å
60	K	97.7	Very high	97.1	Very high	85 Å²	85	114.1 Å²	114.1	37%	0.37	52%	0.521	S	S	.	.	H	α-helix	trans	-61.9	-43	176.5	-86.3	-169.3	165.7	179.8	0	112.1	Y56 Y57 Q63 I64	Y56-K60 HydrophobicContact CD1-CD 4.32Å; Y56-K60 HydrophobicContact CE1-CD 3.66Å; Y56-K60 HydrophobicContact CE1-CG 4.41Å; Y56-K60 PolarHBondContact O-N 3.38Å; Y56-K60 VanDerWaalsContact O-N 3.08Å; Y56-K60 WeakPolarHBondContact OH-CE 3.47Å; Y56-K60 PolarHBondContact OH-NZ 2.94Å; Y57-K60 PolarHBondContact O-N 3.44Å; K60-Q63 PolarHBondContact O-N 2.94Å; K60-I64 VanDerWaalsContact O-CG1 3.29Å; K60-I64 WeakPolarHBondContact O-CG1 3.48Å; K60-I64 PolarHBondContact O-N 3.32Å
61	E	96.7	Very high	97.1	Very high	138 Å²	138	112.6 Å²	112.6	65%	0.645	52%	0.52	S	S	*	.	H	α-helix	trans	-62.5	-48.5	179	-173	173.2	-169.7	0	0	110.9	Y57 E58 Q63 I64 E65	Y57-E61 WeakPolarHBondContact O-CB 3.5Å; Y57-E61 PolarHBondContact O-N 3.23Å; E58-E61 PolarHBondContact O-N 3.22Å; E61-Q63 VanDerWaalsContact C-N 3.33Å; E61-Q63 PolarHBondContact O-N 3.15Å; E61-I64 PolarHBondContact O-N 2.77Å; E61-E65 PolarHBondContact O-N 3.31Å
62	K	97.1	Very high	97.1	Very high	109 Å²	109	114.2 Å²	114.2	47%	0.474	52%	0.524	S	S	.	.	H	α-helix	trans	-58.4	-42.5	175.2	-72.8	177	-175.5	170.7	0	112.3	E58 K59 E65 Q66	E58-K62 HydrophobicContact CG-CD 4.48Å; E58-K62 WeakPolarHBondContact O-CG 3.18Å; E58-K62 PolarHBondContact O-N 3.08Å; E58-K62 VanDerWaalsContact OE1-CE 3.24Å; E58-K62 WeakPolarHBondContact OE1-CE 3.48Å; E58-K62 IonicContact OE1-NZ 3.17Å; E58-K62 PolarHBondContact OE1-NZ 3.48Å; K59-K62 PolarHBondContact O-N 3.47Å; K62-E65 PolarHBondContact O-N 3.23Å; K62-Q66 WeakPolarHBondContact O-CB 3.33Å; K62-Q66 VanDerWaalsContact O-CG 3.31Å; K62-Q66 WeakPolarHBondContact O-CG 3.37Å; K62-Q66 PolarHBondContact O-N 2.86Å
63	Q	96.8	Very high	97.1	Very high	117 Å²	117	112 Å²	112	55%	0.547	52%	0.524	S	S	.	.	H	α-helix	trans	-62.7	-44.4	176.1	-76.9	178.1	-4.4	0	0	112.2	K59 K60 E61 E65 Q66 H67	K59-Q63 WeakPolarHBondContact O-CB 3.45Å; K59-Q63 WeakPolarHBondContact O-CG 3.35Å; K59-Q63 PolarHBondContact O-N 3.31Å; K60-Q63 PolarHBondContact O-N 2.94Å; E61-Q63 VanDerWaalsContact C-N 3.33Å; E61-Q63 PolarHBondContact O-N 3.15Å; Q63-E65 VanDerWaalsContact C-N 3.35Å; Q63-Q66 PolarHBondContact O-N 2.95Å; Q63-H67 WeakPolarHBondContact O-CB 3.31Å; Q63-H67 PolarHBondContact O-CD2 3.42Å; Q63-H67 PolarHBondContact O-N 3.43Å
64	I	97.6	Very high	97.2	Very high	97 Å²	97	113.3 Å²	113.3	50%	0.497	53%	0.528	S	S	.	.	H	α-helix	trans	-63.9	-42.9	177.9	-70.5	167.4	0	0	0	110.4	K60 E61 H67 K68	K60-I64 VanDerWaalsContact O-CG1 3.29Å; K60-I64 WeakPolarHBondContact O-CG1 3.48Å; K60-I64 PolarHBondContact O-N 3.32Å; E61-I64 PolarHBondContact O-N 2.77Å; I64-H67 PolarHBondContact O-N 2.81Å; I64-K68 HydrophobicContact CG2-CD 4.18Å; I64-K68 HydrophobicContact CG2-CG 4.43Å; I64-K68 WeakPolarHBondContact O-CB 3.32Å; I64-K68 WeakPolarHBondContact O-CG 3.47Å; I64-K68 PolarHBondContact O-N 3.03Å
65	E	96.9	Very high	97.2	Very high	98 Å²	98	112.4 Å²	112.4	46%	0.458	53%	0.525	S	S	.	.	H	α-helix	trans	-62.4	-44.4	178.2	-161.9	-162.7	155.8	0	0	111.5	E61 K62 Q63 K68 K69	E61-E65 PolarHBondContact O-N 3.31Å; K62-E65 PolarHBondContact O-N 3.23Å; Q63-E65 VanDerWaalsContact C-N 3.35Å; E65-K68 PolarHBondContact O-N 3.43Å; E65-K69 WeakPolarHBondContact O-CG 3.15Å; E65-K69 PolarHBondContact O-N 3.09Å; E65-K69 WeakPolarHBondContact OE1-CE 3.5Å; E65-K69 IonicContact OE1-NZ 3.73Å; E65-K69 PolarHBondContact OE1-NZ 3.19Å
66	Q	97.1	Very high	97.2	Very high	126 Å²	126	115.4 Å²	115.4	59%	0.589	54%	0.535	S	S	*	.	H	α-helix	trans	-60.8	-47	174.1	-73.8	178.9	-4.3	0	0	111.6	K62 Q63 K68 K69 I70	K62-Q66 WeakPolarHBondContact O-CB 3.33Å; K62-Q66 VanDerWaalsContact O-CG 3.31Å; K62-Q66 WeakPolarHBondContact O-CG 3.37Å; K62-Q66 PolarHBondContact O-N 2.86Å; Q63-Q66 PolarHBondContact O-N 2.95Å; Q66-K68 VanDerWaalsContact C-N 3.34Å; Q66-K68 PolarHBondContact O-N 3.32Å; Q66-K69 WeakPolarHBondContact O-CB 3.41Å; Q66-K69 PolarHBondContact O-N 3.07Å; Q66-K69 VanDerWaalsContact O-N 3.16Å; Q66-I70 WeakPolarHBondContact O-CG1 3.29Å; Q66-I70 PolarHBondContact O-N 3.2Å
67	H	96.5	Very high	97.2	Very high	116 Å²	116	113.5 Å²	113.5	54%	0.537	53%	0.533	S	S	.	.	H	α-helix	trans	-60	-42.1	176.8	-94.8	-70.4	0	0	0	112.4	Q63 I64 K69 I70 Q71	Q63-H67 WeakPolarHBondContact O-CB 3.31Å; Q63-H67 PolarHBondContact O-CD2 3.42Å; Q63-H67 PolarHBondContact O-N 3.43Å; I64-H67 PolarHBondContact O-N 2.81Å; H67-K69 VanDerWaalsContact C-N 3.34Å; H67-K69 PolarHBondContact O-N 2.89Å; H67-I70 PolarHBondContact O-N 3.44Å; H67-Q71 WeakPolarHBondContact O-CB 3.43Å; H67-Q71 WeakPolarHBondContact O-CG 3.41Å; H67-Q71 PolarHBondContact O-N 3.08Å
68	K	97.8	Very high	97.2	Very high	138 Å²	138	111.8 Å²	111.8	60%	0.6	53%	0.53	S	S	*	.	H	α-helix	trans	-60.1	-43.5	174.6	-76.5	177.5	178.6	179.6	0	111.6	I64 E65 Q66 Q71 M72	I64-K68 HydrophobicContact CG2-CD 4.18Å; I64-K68 HydrophobicContact CG2-CG 4.43Å; I64-K68 WeakPolarHBondContact O-CB 3.32Å; I64-K68 WeakPolarHBondContact O-CG 3.47Å; I64-K68 PolarHBondContact O-N 3.03Å; E65-K68 PolarHBondContact O-N 3.43Å; Q66-K68 VanDerWaalsContact C-N 3.34Å; Q66-K68 PolarHBondContact O-N 3.32Å; K68-Q71 PolarHBondContact O-N 3.36Å; K68-M72 VanDerWaalsContact O-CB 3.3Å; K68-M72 WeakPolarHBondContact O-CB 3.48Å; K68-M72 PolarHBondContact O-N 3.04Å
69	K	97.4	Very high	97.3	Very high	126 Å²	126	109.8 Å²	109.8	55%	0.548	53%	0.529	S	S	.	.	H	α-helix	trans	-62.4	-43.3	176.4	-73.2	175	-175	168.4	0	111.8	E65 Q66 H67 S73	E65-K69 WeakPolarHBondContact O-CG 3.15Å; E65-K69 PolarHBondContact O-N 3.09Å; E65-K69 WeakPolarHBondContact OE1-CE 3.5Å; E65-K69 IonicContact OE1-NZ 3.73Å; E65-K69 PolarHBondContact OE1-NZ 3.19Å; Q66-K69 WeakPolarHBondContact O-CB 3.41Å; Q66-K69 PolarHBondContact O-N 3.07Å; Q66-K69 VanDerWaalsContact O-N 3.16Å; H67-K69 VanDerWaalsContact C-N 3.34Å; H67-K69 PolarHBondContact O-N 2.89Å; K69-S73 WeakPolarHBondContact O-CB 3.49Å; K69-S73 PolarHBondContact O-N 3.19Å
70	I	97.3	Very high	97.3	Very high	86 Å²	86	111.1 Å²	111.1	44%	0.441	53%	0.531	S	S	.	.	H	α-helix	trans	-62.7	-50.1	177	-67.4	166	0	0	0	110.5	Q66 H67 M72 S73 Q74	Q66-I70 WeakPolarHBondContact O-CG1 3.29Å; Q66-I70 PolarHBondContact O-N 3.2Å; H67-I70 PolarHBondContact O-N 3.44Å; I70-M72 PolarHBondContact O-N 3.28Å; I70-S73 WeakPolarHBondContact O-CB 3.45Å; I70-S73 PolarHBondContact O-N 3.44Å; I70-Q74 HydrophobicContact CG2-CG 4.35Å; I70-Q74 WeakPolarHBondContact O-CG 3.45Å; I70-Q74 PolarHBondContact O-N 2.94Å
71	Q	97.4	Very high	97.2	Very high	117 Å²	117	110.9 Å²	110.9	55%	0.547	53%	0.533	S	S	.	.	H	α-helix	trans	-60.2	-45.1	179.6	-74.4	176.6	-3.9	0	0	111.8	H67 K68 S73 Q74 L75	H67-Q71 WeakPolarHBondContact O-CB 3.43Å; H67-Q71 WeakPolarHBondContact O-CG 3.41Å; H67-Q71 PolarHBondContact O-N 3.08Å; K68-Q71 PolarHBondContact O-N 3.36Å; Q71-S73 VanDerWaalsContact C-N 3.32Å; Q71-S73 PolarHBondContact O-N 3.47Å; Q71-Q74 PolarHBondContact O-N 3.43Å; Q71-L75 WeakPolarHBondContact O-CB 3.41Å; Q71-L75 PolarHBondContact O-N 3.28Å
72	M	97.3	Very high	97.3	Very high	110 Å²	110	110.7 Å²	110.7	54%	0.542	53%	0.53	S	S	.	.	H	α-helix	trans	-60.8	-42.4	176.2	-177.6	63.9	84.4	0	0	111.4	K68 I70 L75 K76	K68-M72 VanDerWaalsContact O-CB 3.3Å; K68-M72 WeakPolarHBondContact O-CB 3.48Å; K68-M72 PolarHBondContact O-N 3.04Å; I70-M72 PolarHBondContact O-N 3.28Å; M72-L75 PolarHBondContact O-N 2.9Å; M72-K76 HydrophobicContact CG-CD 4.49Å; M72-K76 WeakPolarHBondContact O-CG 3.43Å; M72-K76 PolarHBondContact O-N 2.76Å
73	S	97.3	Very high	97.2	Very high	78 Å²	78	110 Å²	110	55%	0.545	53%	0.534	S	S	.	.	H	α-helix	trans	-63.2	-45.6	176.1	-174.7	0	0	0	0	112.1	K69 I70 Q71 L75 K76 N77	K69-S73 WeakPolarHBondContact O-CB 3.49Å; K69-S73 PolarHBondContact O-N 3.19Å; I70-S73 WeakPolarHBondContact O-CB 3.45Å; I70-S73 PolarHBondContact O-N 3.44Å; Q71-S73 VanDerWaalsContact C-N 3.32Å; Q71-S73 PolarHBondContact O-N 3.47Å; S73-L75 VanDerWaalsContact C-N 3.35Å; S73-L75 PolarHBondContact O-N 3.32Å; S73-K76 PolarHBondContact O-N 2.96Å; S73-N77 WeakPolarHBondContact O-CB 3.38Å; S73-N77 PolarHBondContact O-N 3.49Å
74	Q	97.8	Very high	97.1	Very high	123 Å²	123	108.4 Å²	108.4	58%	0.575	53%	0.529	S	S	*	.	H	α-helix	trans	-59.6	-44.8	176.5	-74.9	176.3	-18.5	0	0	111.6	I70 Q71 N77 Q78	I70-Q74 HydrophobicContact CG2-CG 4.35Å; I70-Q74 WeakPolarHBondContact O-CG 3.45Å; I70-Q74 PolarHBondContact O-N 2.94Å; Q71-Q74 PolarHBondContact O-N 3.43Å; Q74-N77 PolarHBondContact O-N 3.02Å; Q74-Q78 WeakPolarHBondContact O-CB 3.28Å; Q74-Q78 PolarHBondContact O-N 3.48Å
75	L	96.9	Very high	97.1	Very high	113 Å²	113	110.8 Å²	110.8	59%	0.592	54%	0.536	S	S	*	.	H	α-helix	trans	-66.4	-41.5	-179.5	-164.8	142.9	0	0	0	111.6	Q71 M72 S73 Q78 A79	Q71-L75 WeakPolarHBondContact O-CB 3.41Å; Q71-L75 PolarHBondContact O-N 3.28Å; M72-L75 PolarHBondContact O-N 2.9Å; S73-L75 VanDerWaalsContact C-N 3.35Å; S73-L75 PolarHBondContact O-N 3.32Å; L75-Q78 PolarHBondContact O-N 2.97Å; L75-A79 WeakPolarHBondContact O-CB 3.43Å; L75-A79 PolarHBondContact O-N 3.17Å
76	K	97.4	Very high	97	Very high	139 Å²	139	108.1 Å²	108.1	60%	0.604	53%	0.531	S	S	*	.	H	α-helix	trans	-60.7	-45.1	172.2	-75	179.4	-180	-175.3	0	111.9	M72 S73 A79 R80	M72-K76 HydrophobicContact CG-CD 4.49Å; M72-K76 WeakPolarHBondContact O-CG 3.43Å; M72-K76 PolarHBondContact O-N 2.76Å; S73-K76 PolarHBondContact O-N 2.96Å; K76-A79 PolarHBondContact O-N 3.16Å; K76-R80 PolarHBondContact O-N 3.34Å
77	N	97.1	Very high	96.7	Very high	86 Å²	86	103.7 Å²	103.7	46%	0.46	51%	0.514	S	S	.	.	H	α-helix	trans	-64.3	-42.2	177.8	-173.4	44.9	0	0	0	111.7	S73 Q74 A79 R80 L81	S73-N77 WeakPolarHBondContact O-CB 3.38Å; S73-N77 PolarHBondContact O-N 3.49Å; Q74-N77 PolarHBondContact O-N 3.02Å; N77-A79 VanDerWaalsContact C-N 3.35Å; N77-A79 PolarHBondContact O-N 2.96Å; N77-R80 PolarHBondContact O-N 3.27Å; N77-L81 WeakPolarHBondContact O-CG 3.34Å; N77-L81 PolarHBondContact O-N 3.03Å
78	Q	97.7	Very high	96.5	Very high	112 Å²	112	102.4 Å²	102.4	52%	0.523	52%	0.517	S	S	.	.	H	α-helix	trans	-61.6	-43.6	176.5	-169	-174.6	22.2	0	0	111.4	Q74 L75 L81 K82	Q74-Q78 WeakPolarHBondContact O-CB 3.28Å; Q74-Q78 PolarHBondContact O-N 3.48Å; L75-Q78 PolarHBondContact O-N 2.97Å; Q78-L81 PolarHBondContact O-N 2.87Å; Q78-K82 WeakPolarHBondContact O-CG 3.48Å; Q78-K82 PolarHBondContact O-N 3.39Å
79	A	97.6	Very high	96.4	Very high	49 Å²	49	99.6 Å²	99.6	41%	0.405	51%	0.511	S	S	.	.	H	α-helix	trans	-60.9	-45.8	174.9	0	0	0	0	0	111.5	L75 K76 N77 L81 K82 V83	L75-A79 WeakPolarHBondContact O-CB 3.43Å; L75-A79 PolarHBondContact O-N 3.17Å; K76-A79 PolarHBondContact O-N 3.16Å; N77-A79 VanDerWaalsContact C-N 3.35Å; N77-A79 PolarHBondContact O-N 2.96Å; A79-L81 PolarHBondContact O-N 2.68Å; A79-K82 WeakPolarHBondContact O-CB 3.38Å; A79-K82 PolarHBondContact O-N 3.03Å; A79-V83 PolarHBondContact O-N 2.88Å; A79-V83 VanDerWaalsContact O-N 3.13Å
80	R	97.4	Very high	96.2	Very high	171 Å²	171	101 Å²	101	65%	0.645	51%	0.514	S	S	*	.	H	α-helix	trans	-58.5	-46.5	175.5	178.6	179.9	166.6	173.7	-4	112.1	K76 N77 K82 V83 L84	K76-R80 PolarHBondContact O-N 3.34Å; N77-R80 PolarHBondContact O-N 3.27Å; R80-K82 VanDerWaalsContact C-N 3.32Å; R80-K82 PolarHBondContact O-N 3.32Å; R80-V83 PolarHBondContact O-N 3.26Å; R80-L84 HydrophobicContact CG-CD1 4.19Å; R80-L84 WeakPolarHBondContact O-CG 3.48Å; R80-L84 PolarHBondContact O-N 3.5Å
81	L	96.8	Very high	96	Very high	79 Å²	79	97.8 Å²	97.8	41%	0.414	50%	0.498	S	S	.	.	H	α-helix	trans	-64.5	-35.7	178.4	-72	175.1	0	0	0	112.2	N77 Q78 A79 L84 K85	N77-L81 WeakPolarHBondContact O-CG 3.34Å; N77-L81 PolarHBondContact O-N 3.03Å; Q78-L81 PolarHBondContact O-N 2.87Å; A79-L81 PolarHBondContact O-N 2.68Å; L81-L84 PolarHBondContact O-N 3.47Å; L81-K85 WeakPolarHBondContact O-CB 3.48Å; L81-K85 VanDerWaalsContact O-CG 3.26Å; L81-K85 WeakPolarHBondContact O-CG 3.4Å; L81-K85 PolarHBondContact O-N 2.84Å
82	K	97.6	Very high	95.7	Very high	134 Å²	134	96.4 Å²	96.4	58%	0.583	49%	0.492	S	S	*	.	H	α-helix	trans	-61	-45.3	174.3	-76.2	176.3	178.8	-177.4	0	111.4	Q78 A79 R80 K85 A86	Q78-K82 WeakPolarHBondContact O-CG 3.48Å; Q78-K82 PolarHBondContact O-N 3.39Å; A79-K82 WeakPolarHBondContact O-CB 3.38Å; A79-K82 PolarHBondContact O-N 3.03Å; R80-K82 VanDerWaalsContact C-N 3.32Å; R80-K82 PolarHBondContact O-N 3.32Å; K82-K85 PolarHBondContact O-N 3.48Å; K82-A86 WeakPolarHBondContact O-CB 3.13Å; K82-A86 PolarHBondContact O-N 3.27Å
83	V	96.1	Very high	95.6	Very high	94 Å²	94	95.1 Å²	95.1	57%	0.57	49%	0.487	S	S	*	.	H	α-helix	trans	-62.7	-48	176.9	176.6	0	0	0	0	110.8	A79 R80 K85 A86 S87	A79-V83 PolarHBondContact O-N 2.88Å; A79-V83 VanDerWaalsContact O-N 3.13Å; R80-V83 PolarHBondContact O-N 3.26Å; V83-K85 VanDerWaalsContact C-N 3.33Å; V83-K85 PolarHBondContact O-N 2.86Å; V83-A86 PolarHBondContact O-N 2.88Å; V83-S87 PolarHBondContact O-N 2.97Å; V83-S87 PolarHBondContact O-OG 3.38Å
84	L	94.9	Very high	95.4	Very high	85 Å²	85	94.4 Å²	94.4	45%	0.445	48%	0.477	S	S	.	.	H	α-helix	trans	-59.7	-43	178.6	-70.4	172.7	0	0	0	112.3	R80 L81 S87 C88	R80-L84 HydrophobicContact CG-CD1 4.19Å; R80-L84 WeakPolarHBondContact O-CG 3.48Å; R80-L84 PolarHBondContact O-N 3.5Å; L81-L84 PolarHBondContact O-N 3.47Å; L84-S87 PolarHBondContact O-N 3.47Å; L84-C88 PolarHBondContact O-N 2.76Å; L84-C88 PolarHBondContact O-SG 3.24Å; L84-C88 VanDerWaalsContact O-SG 3.35Å
85	K	96.1	Very high	95.1	Very high	146 Å²	146	89.6 Å²	89.6	64%	0.635	46%	0.455	S	S	*	.	H	α-helix	trans	-61.3	-45.5	175.5	-75.9	178.1	179.5	-170.1	0	111.7	L81 K82 V83 S87 C88 V89	L81-K85 WeakPolarHBondContact O-CB 3.48Å; L81-K85 VanDerWaalsContact O-CG 3.26Å; L81-K85 WeakPolarHBondContact O-CG 3.4Å; L81-K85 PolarHBondContact O-N 2.84Å; K82-K85 PolarHBondContact O-N 3.48Å; V83-K85 VanDerWaalsContact C-N 3.33Å; V83-K85 PolarHBondContact O-N 2.86Å; K85-S87 VanDerWaalsContact C-N 3.35Å; K85-S87 PolarHBondContact O-N 3Å; K85-C88 PolarHBondContact O-N 3.34Å; K85-V89 WeakPolarHBondContact O-CG2 3.5Å; K85-V89 PolarHBondContact O-N 3.46Å
86	A	95.2	Very high	94.9	Very high	43 Å²	43	87 Å²	87	36%	0.355	44%	0.442	S	S	.	.	H	α-helix	trans	-60.5	-45	177	0	0	0	0	0	111.4	K82 V83 C88 V89 Y90	K82-A86 WeakPolarHBondContact O-CB 3.13Å; K82-A86 PolarHBondContact O-N 3.27Å; V83-A86 PolarHBondContact O-N 2.88Å; A86-C88 VanDerWaalsContact C-N 3.33Å; A86-C88 PolarHBondContact O-N 3.31Å; A86-V89 PolarHBondContact O-N 3.49Å; A86-V89 VanDerWaalsContact O-N 3.17Å; A86-Y90 HydrophobicContact CB-CE2 4.44Å; A86-Y90 WeakPolarHBondContact O-CD2 3.44Å; A86-Y90 PolarHBondContact O-N 3.44Å
87	S	91.5	Very high	94.7	Very high	33 Å²	33	84.8 Å²	84.8	23%	0.231	43%	0.434	C	S	.	.	H	α-helix	trans	-58.8	-41.9	175.1	-62.7	0	0	0	0	112.7	V83 L84 K85 Y90 V91	V83-S87 PolarHBondContact O-N 2.97Å; V83-S87 PolarHBondContact O-OG 3.38Å; L84-S87 PolarHBondContact O-N 3.47Å; K85-S87 VanDerWaalsContact C-N 3.35Å; K85-S87 PolarHBondContact O-N 3Å; S87-Y90 PolarHBondContact O-N 3.17Å; S87-V91 WeakPolarHBondContact O-CG2 3.37Å; S87-V91 PolarHBondContact O-N 3.4Å
88	C	91.8	Very high	94.4	Very high	88 Å²	88	81.9 Å²	81.9	60%	0.595	42%	0.422	S	S	*	.	H	α-helix	trans	-63.4	-41	175.1	-70	0	0	0	0	112.4	L84 K85 A86 V91 Q92	L84-C88 PolarHBondContact O-N 2.76Å; L84-C88 PolarHBondContact O-SG 3.24Å; L84-C88 VanDerWaalsContact O-SG 3.35Å; K85-C88 PolarHBondContact O-N 3.34Å; A86-C88 VanDerWaalsContact C-N 3.33Å; A86-C88 PolarHBondContact O-N 3.31Å; C88-V91 PolarHBondContact O-N 3.35Å; C88-Q92 WeakPolarHBondContact O-CB 3.06Å; C88-Q92 PolarHBondContact O-N 3.19Å
89	V	95.4	Very high	94.1	Very high	79 Å²	79	80.1 Å²	80.1	48%	0.479	41%	0.41	S	S	.	.	H	α-helix	trans	-61.4	-45.9	177	171.4	0	0	0	0	110.6	K85 A86 V91 Q92 D93	K85-V89 WeakPolarHBondContact O-CG2 3.5Å; K85-V89 PolarHBondContact O-N 3.46Å; A86-V89 PolarHBondContact O-N 3.49Å; A86-V89 VanDerWaalsContact O-N 3.17Å; V89-V91 VanDerWaalsContact C-N 3.33Å; V89-V91 PolarHBondContact O-N 3.35Å; V89-Q92 WeakPolarHBondContact O-CB 3.29Å; V89-Q92 PolarHBondContact O-N 3.02Å; V89-Q92 VanDerWaalsContact O-N 3.09Å; V89-D93 VanDerWaalsContact O-CG 3.27Å; V89-D93 PolarHBondContact O-N 3.35Å
90	Y	93.3	Very high	93.7	Very high	156 Å²	156	84.2 Å²	84.2	61%	0.612	42%	0.421	S	S	*	.	H	α-helix	trans	-60.1	-40.6	177.5	-73.9	-62.3	0	0	0	113.4	A86 S87 D93 L94	A86-Y90 HydrophobicContact CB-CE2 4.44Å; A86-Y90 WeakPolarHBondContact O-CD2 3.44Å; A86-Y90 PolarHBondContact O-N 3.44Å; S87-Y90 PolarHBondContact O-N 3.17Å; Y90-D93 PolarHBondContact O-N 3.25Å; Y90-L94 PolarHBondContact O-N 2.83Å
91	V	92.9	Very high	93.4	Very high	18 Å²	18	83.7 Å²	83.7	11%	0.109	42%	0.419	C	S	.	.	H	α-helix	trans	-65.4	-42.3	175.2	173	0	0	0	0	110.5	S87 C88 V89 D93 L94 L95 M208 L215 F216	S87-V91 WeakPolarHBondContact O-CG2 3.37Å; S87-V91 PolarHBondContact O-N 3.4Å; C88-V91 PolarHBondContact O-N 3.35Å; V89-V91 VanDerWaalsContact C-N 3.33Å; V89-V91 PolarHBondContact O-N 3.35Å; V91-D93 VanDerWaalsContact C-N 3.33Å; V91-D93 PolarHBondContact O-N 2.98Å; V91-L94 PolarHBondContact O-N 3.39Å; V91-L95 HydrophobicContact CG1-CD1 4.32Å; V91-L95 WeakPolarHBondContact O-CG 3.38Å; V91-L95 PolarHBondContact O-N 3.16Å; V91-M208 HydrophobicContact CG1-CE 3.83Å; V91-M208 HydrophobicContact CG1-SD 3.99Å; V91-L215 HydrophobicContact CG2-CD1 4.22Å; V91-F216 HydrophobicContact CG2-CE2 4.08Å; V91-F216 HydrophobicContact CG2-CZ 4.47Å
92	Q	92.7	Very high	93	Very high	88 Å²	88	81.8 Å²	81.8	41%	0.411	41%	0.409	S	S	.	.	H	α-helix	trans	-62.8	-41.9	177.9	-173.4	61.3	50.2	0	0	111.6	C88 V89 L94 L95 N96	C88-Q92 WeakPolarHBondContact O-CB 3.06Å; C88-Q92 PolarHBondContact O-N 3.19Å; V89-Q92 WeakPolarHBondContact O-CB 3.29Å; V89-Q92 PolarHBondContact O-N 3.02Å; V89-Q92 VanDerWaalsContact O-N 3.09Å; Q92-L94 VanDerWaalsContact C-N 3.35Å; Q92-L95 PolarHBondContact O-N 3.09Å; Q92-N96 PolarHBondContact NE2-OD1 2.76Å; Q92-N96 WeakPolarHBondContact O-CB 3.47Å; Q92-N96 PolarHBondContact O-N 2.99Å; Q92-N96 PolarHBondContact O-ND2 3.49Å; Q92-N96 PolarHBondContact O-OD1 2.95Å
93	D	94.5	Very high	92.5	Very high	83 Å²	83	76.9 Å²	76.9	44%	0.444	39%	0.394	S	S	.	.	H	α-helix	trans	-63.7	-41.2	177.3	-68	-20.3	0	0	0	111.2	V89 Y90 V91 L95 N96 E97	V89-D93 VanDerWaalsContact O-CG 3.27Å; V89-D93 PolarHBondContact O-N 3.35Å; Y90-D93 PolarHBondContact O-N 3.25Å; V91-D93 VanDerWaalsContact C-N 3.33Å; V91-D93 PolarHBondContact O-N 2.98Å; D93-L95 PolarHBondContact O-N 2.95Å; D93-N96 PolarHBondContact O-N 2.82Å; D93-E97 PolarHBondContact O-N 3.31Å
94	L	93.5	Very high	92.1	Very high	64 Å²	64	76.4 Å²	76.4	34%	0.335	39%	0.388	S	S	.	.	H	α-helix	trans	-60.7	-45.2	173.3	-177.7	156.5	0	0	0	111.8	Y90 V91 Q92 N96 E97 A98 L215	Y90-L94 PolarHBondContact O-N 2.83Å; V91-L94 PolarHBondContact O-N 3.39Å; Q92-L94 VanDerWaalsContact C-N 3.35Å; L94-N96 VanDerWaalsContact C-N 3.32Å; L94-N96 PolarHBondContact O-N 2.91Å; L94-E97 PolarHBondContact O-N 2.98Å; L94-A98 WeakPolarHBondContact O-CB 3.45Å; L94-A98 PolarHBondContact O-N 3.02Å; L94-L215 HydrophobicContact CD1-CD1 4.03Å; L94-L215 HydrophobicContact CD1-CD2 4.09Å
95	L	91.7	Very high	91.6	Very high	21 Å²	21	75.9 Å²	75.9	11%	0.11	38%	0.384	C	S	.	.	H	α-helix	trans	-65.5	-37.2	177.3	-68.4	178.2	0	0	0	111.7	V91 Q92 D93 A98 R99 A204	V91-L95 HydrophobicContact CG1-CD1 4.32Å; V91-L95 WeakPolarHBondContact O-CG 3.38Å; V91-L95 PolarHBondContact O-N 3.16Å; Q92-L95 PolarHBondContact O-N 3.09Å; D93-L95 PolarHBondContact O-N 2.95Å; L95-A98 PolarHBondContact O-N 3.35Å; L95-R99 WeakPolarHBondContact O-CG 3.26Å; L95-R99 PolarHBondContact O-N 3.28Å; L95-A204 HydrophobicContact CD1-CB 4.2Å; L95-A204 HydrophobicContact CD2-CB 3.57Å
96	N	92.1	Very high	90.8	Very high	58 Å²	58	70.3 Å²	70.3	31%	0.31	37%	0.366	S	S	.	.	H	α-helix	trans	-64.7	-41.3	174.6	-68	-20.2	0	0	0	111.4	Q92 D93 L94 R99 Q100	Q92-N96 PolarHBondContact NE2-OD1 2.76Å; Q92-N96 WeakPolarHBondContact O-CB 3.47Å; Q92-N96 PolarHBondContact O-N 2.99Å; Q92-N96 PolarHBondContact O-ND2 3.49Å; Q92-N96 PolarHBondContact O-OD1 2.95Å; D93-N96 PolarHBondContact O-N 2.82Å; L94-N96 VanDerWaalsContact C-N 3.32Å; L94-N96 PolarHBondContact O-N 2.91Å; N96-R99 WeakPolarHBondContact O-CB 3.21Å; N96-R99 PolarHBondContact O-N 3.13Å; N96-Q100 WeakPolarHBondContact O-CG 3.49Å; N96-Q100 PolarHBondContact O-N 3.23Å
97	E	92.8	Very high	90.3	Very high	93 Å²	93	75.5 Å²	75.5	44%	0.435	38%	0.38	S	S	.	.	H	α-helix	trans	-64.9	-40.5	174.1	-166.7	-175	163.1	0	0	111.3	D93 L94 R99 Q100 R101	D93-E97 PolarHBondContact O-N 3.31Å; L94-E97 PolarHBondContact O-N 2.98Å; E97-R99 VanDerWaalsContact C-N 3.32Å; E97-R99 PolarHBondContact O-N 3.18Å; E97-Q100 PolarHBondContact O-N 3.43Å; E97-R101 WeakPolarHBondContact O-CG 3.38Å; E97-R101 PolarHBondContact O-N 2.91Å; E97-R101 IonicContact OE1-CZ 3.56Å; E97-R101 IonicContact OE1-NE 2.62Å; E97-R101 PolarHBondContact OE1-NE 3.38Å; E97-R101 IonicContact OE1-NH2 3.61Å; E97-R101 PolarHBondContact OE1-NH2 3.44Å
98	A	91.9	Very high	90.2	Very high	26 Å²	26	76.6 Å²	76.6	22%	0.215	38%	0.383	C	S	.	.	H	α-helix	trans	-61	-40.4	173.6	0	0	0	0	0	111.9	L94 L95 R101 I102 L200	L94-A98 WeakPolarHBondContact O-CB 3.45Å; L94-A98 PolarHBondContact O-N 3.02Å; L95-A98 PolarHBondContact O-N 3.35Å; A98-R101 PolarHBondContact O-N 3.44Å; A98-I102 VanDerWaalsContact O-CG1 3.28Å; A98-I102 WeakPolarHBondContact O-CG1 3.38Å; A98-I102 PolarHBondContact O-N 2.87Å; A98-L200 HydrophobicContact CB-CD1 4.21Å; A98-L200 HydrophobicContact CB-CD2 4.27Å
99	R	90.3	Very high	89.9	Confident	75 Å²	75	76.1 Å²	76.1	28%	0.283	38%	0.38	S	S	.	.	H	α-helix	trans	-59.4	-46.1	172.6	-72.6	178.4	-175.3	-173.6	-2.4	111.5	L95 N96 E97 R101 I102 A103 L200 D201	L95-R99 WeakPolarHBondContact O-CG 3.26Å; L95-R99 PolarHBondContact O-N 3.28Å; N96-R99 WeakPolarHBondContact O-CB 3.21Å; N96-R99 PolarHBondContact O-N 3.13Å; E97-R99 VanDerWaalsContact C-N 3.32Å; E97-R99 PolarHBondContact O-N 3.18Å; R99-R101 PolarHBondContact O-N 3.41Å; R99-I102 PolarHBondContact O-N 3.45Å; R99-A103 PolarHBondContact O-N 2.85Å; R99-L200 HydrophobicContact CB-CD2 4.28Å; R99-L200 HydrophobicContact CG-CD2 3.28Å; R99-D201 IonicContact CZ-OD1 3.28Å; R99-D201 IonicContact NE-OD1 3.38Å; R99-D201 IonicContact NH2-OD1 2.69Å; R99-D201 PolarHBondContact NH2-OD1 3.22Å; R99-D201 IonicContact NH2-OD2 2.67Å; R99-D201 PolarHBondContact NH2-OD2 2.95Å
100	Q	90.1	Very high	89.5	Confident	135 Å²	135	78.2 Å²	78.2	63%	0.631	39%	0.388	S	S	*	.	H	α-helix	trans	-61.3	-44	177.6	-70.6	177.4	-2.2	0	0	112	N96 E97 I102 A103 D104	N96-Q100 WeakPolarHBondContact O-CG 3.49Å; N96-Q100 PolarHBondContact O-N 3.23Å; E97-Q100 PolarHBondContact O-N 3.43Å; Q100-I102 VanDerWaalsContact C-N 3.3Å; Q100-I102 PolarHBondContact O-N 2.93Å; Q100-A103 WeakPolarHBondContact O-CB 3.13Å; Q100-A103 PolarHBondContact O-N 3.42Å; Q100-A103 VanDerWaalsContact O-N 3.15Å; Q100-D104 PolarHBondContact O-N 2.89Å; Q100-D104 VanDerWaalsContact O-N 3.14Å
101	R	90.3	Very high	89.3	Confident	159 Å²	159	79 Å²	79	60%	0.6	39%	0.39	S	S	*	.	H	α-helix	trans	-64	-34.6	176.3	-68.6	-179.6	-171.6	-170.6	3.8	112.6	E97 A98 R99 D104	E97-R101 WeakPolarHBondContact O-CG 3.38Å; E97-R101 PolarHBondContact O-N 2.91Å; E97-R101 IonicContact OE1-CZ 3.56Å; E97-R101 IonicContact OE1-NE 2.62Å; E97-R101 PolarHBondContact OE1-NE 3.38Å; E97-R101 IonicContact OE1-NH2 3.61Å; E97-R101 PolarHBondContact OE1-NH2 3.44Å; A98-R101 PolarHBondContact O-N 3.44Å; R99-R101 PolarHBondContact O-N 3.41Å; R101-D104 WeakPolarHBondContact O-CB 3.38Å; R101-D104 PolarHBondContact O-N 2.92Å
102	I	88.1	Confident	89.2	Confident	40 Å²	40	78.2 Å²	78.2	21%	0.205	39%	0.385	C	S	.	.	H	α-helix	trans	-69.4	-36.8	174.7	-71.8	168.6	0	0	0	110.8	A98 R99 Q100 D104 I105 L196 L200	A98-I102 VanDerWaalsContact O-CG1 3.28Å; A98-I102 WeakPolarHBondContact O-CG1 3.38Å; A98-I102 PolarHBondContact O-N 2.87Å; R99-I102 PolarHBondContact O-N 3.45Å; Q100-I102 VanDerWaalsContact C-N 3.3Å; Q100-I102 PolarHBondContact O-N 2.93Å; I102-D104 PolarHBondContact O-N 2.94Å; I102-I105 WeakPolarHBondContact O-CB 3.46Å; I102-I105 PolarHBondContact O-N 3.44Å; I102-I105 VanDerWaalsContact O-N 3.07Å; I102-L196 HydrophobicContact CG2-CB 3.76Å; I102-L196 HydrophobicContact CG2-CD1 3.71Å; I102-L196 HydrophobicContact CG2-CG 4.21Å; I102-L200 HydrophobicContact CD1-CB 4.16Å; I102-L200 HydrophobicContact CD1-CD1 3.89Å; I102-L200 HydrophobicContact CD1-CD2 4.08Å; I102-L200 HydrophobicContact CD1-CG 4.26Å
103	A	86.9	Confident	89	Confident	31 Å²	31	75.4 Å²	75.4	26%	0.256	38%	0.377	S	S	.	.	H	α-helix	trans	-62.2	-31.1	173.6	0	0	0	0	0	112.3	R99 Q100 I105 A106 C178	R99-A103 PolarHBondContact O-N 2.85Å; Q100-A103 WeakPolarHBondContact O-CB 3.13Å; Q100-A103 PolarHBondContact O-N 3.42Å; Q100-A103 VanDerWaalsContact O-N 3.15Å; A103-I105 VanDerWaalsContact C-N 3.28Å; A103-I105 PolarHBondContact O-N 3.28Å; A103-A106 WeakPolarHBondContact O-CB 3.35Å; A103-A106 PolarHBondContact O-N 2.98Å; A103-C178 HydrophobicContact CB-CB 4.21Å
104	D	87.8	Confident	88.8	Confident	84 Å²	84	79 Å²	79	45%	0.449	39%	0.388	S	S	.	.	H	α-helix	trans	-66.3	-29.2	173.8	-69.1	-33.1	0	0	0	112.9	Q100 R101 I102 A106 K107	Q100-D104 PolarHBondContact O-N 2.89Å; Q100-D104 VanDerWaalsContact O-N 3.14Å; R101-D104 WeakPolarHBondContact O-CB 3.38Å; R101-D104 PolarHBondContact O-N 2.92Å; I102-D104 PolarHBondContact O-N 2.94Å; D104-A106 VanDerWaalsContact C-N 3.29Å; D104-A106 PolarHBondContact O-N 3.36Å; D104-K107 WeakPolarHBondContact O-CB 3.49Å; D104-K107 PolarHBondContact O-N 3.45Å; D104-K107 VanDerWaalsContact O-N 3.16Å; D104-K107 WeakPolarHBondContact OD1-CE 3.36Å; D104-K107 IonicContact OD1-NZ 2.9Å; D104-K107 PolarHBondContact OD1-NZ 2.95Å
105	I	84.3	Confident	88.8	Confident	73 Å²	73	79.1 Å²	79.1	37%	0.374	39%	0.389	S	S	.	.	H	α-helix	trans	-66.2	-35.5	174.8	-58.5	172.9	0	0	0	110.5	I102 A103 K107 D108	I102-I105 WeakPolarHBondContact O-CB 3.46Å; I102-I105 PolarHBondContact O-N 3.44Å; I102-I105 VanDerWaalsContact O-N 3.07Å; A103-I105 VanDerWaalsContact C-N 3.28Å; A103-I105 PolarHBondContact O-N 3.28Å; I105-K107 PolarHBondContact O-N 2.91Å; I105-D108 PolarHBondContact O-N 3.25Å; I105-D108 VanDerWaalsContact O-N 3.15Å
106	A	79.8	Confident	88.7	Confident	29 Å²	29	78.1 Å²	78.1	24%	0.24	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-15.7	176.6	0	0	0	0	0	113	A103 D104 Y112 C178	A103-A106 WeakPolarHBondContact O-CB 3.35Å; A103-A106 PolarHBondContact O-N 2.98Å; D104-A106 VanDerWaalsContact C-N 3.29Å; D104-A106 PolarHBondContact O-N 3.36Å; A106-Y112 HydrophobicContact CB-CD2 4.24Å; A106-Y112 HydrophobicContact CB-CE2 4.29Å; A106-C178 WeakPolarHBondContact CB-O 3.28Å
107	K	84.3	Confident	88.7	Confident	153 Å²	153	77.6 Å²	77.6	67%	0.665	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-21.5	174.3	-60.6	175	-178.6	162.5	0	113.2	D104 I105 P109	D104-K107 WeakPolarHBondContact O-CB 3.49Å; D104-K107 PolarHBondContact O-N 3.45Å; D104-K107 VanDerWaalsContact O-N 3.16Å; D104-K107 WeakPolarHBondContact OD1-CE 3.36Å; D104-K107 IonicContact OD1-NZ 2.9Å; D104-K107 PolarHBondContact OD1-NZ 2.95Å; I105-K107 PolarHBondContact O-N 2.91Å; K107-P109 WeakPolarHBondContact O-CD 3.27Å
108	D	89	Confident	88.7	Confident	55 Å²	55	75.1 Å²	75.1	29%	0.294	38%	0.379	S	S	.	.			trans	-93.3	103.9	176.9	-177	-15.5	0	0	0	109.6	I105 D110 R111 Y112	I105-D108 PolarHBondContact O-N 3.25Å; I105-D108 VanDerWaalsContact O-N 3.15Å; D108-D110 VanDerWaalsContact C-N 3.32Å; D108-D110 PolarHBondContact O-N 3.37Å; D108-D110 PolarHBondContact OD1-N 2.83Å; D108-R111 HydrophobicContact CB-CB 4.24Å; D108-R111 PolarHBondContact O-N 3.46Å; D108-R111 WeakPolarHBondContact OD2-CD 3.49Å; D108-R111 WeakPolarHBondContact OD2-CG 3.34Å; D108-R111 IonicContact OD2-NE 2.7Å; D108-R111 PolarHBondContact OD2-NE 3.45Å; D108-Y112 VanDerWaalsContact O-CB 3.23Å; D108-Y112 WeakPolarHBondContact O-CB 3.36Å; D108-Y112 PolarHBondContact O-N 3.37Å
109	P	85.3	Confident	88.7	Confident	79 Å²	79	74.2 Å²	74.2	51%	0.513	37%	0.37	S	S	.	.	H	α-helix	trans	-64.9	-33	-171.1	24.8	-32.7	0	0	0	112.9	K107 A113	K107-P109 WeakPolarHBondContact O-CD 3.27Å; P109-A113 WeakPolarHBondContact O-CB 3.32Å; P109-A113 PolarHBondContact O-N 3.01Å
110	D	88.1	Confident	88.8	Confident	123 Å²	123	70.6 Å²	70.6	66%	0.658	36%	0.357	S	S	*	.	H	α-helix	trans	-73.1	-40.9	-177.9	-72.9	-31.4	0	0	0	111.7	D108 K114	D108-D110 VanDerWaalsContact C-N 3.32Å; D108-D110 PolarHBondContact O-N 3.37Å; D108-D110 PolarHBondContact OD1-N 2.83Å; D110-K114 PolarHBondContact O-N 2.87Å
111	R	89.1	Confident	88.9	Confident	173 Å²	173	65.7 Å²	65.7	65%	0.653	34%	0.335	S	S	*	.	H	α-helix	trans	-70.4	-42.4	175.3	-71.1	-176.3	-176.6	-179.5	-0.6	111.2	D108 K114 L115	D108-R111 HydrophobicContact CB-CB 4.24Å; D108-R111 PolarHBondContact O-N 3.46Å; D108-R111 WeakPolarHBondContact OD2-CD 3.49Å; D108-R111 WeakPolarHBondContact OD2-CG 3.34Å; D108-R111 IonicContact OD2-NE 2.7Å; D108-R111 PolarHBondContact OD2-NE 3.45Å; R111-K114 PolarHBondContact O-N 2.99Å; R111-L115 PolarHBondContact O-N 3.29Å; R111-L115 VanDerWaalsContact O-N 3.08Å
112	Y	90	Very high	89.1	Confident	1 Å²	1	62 Å²	62	0%	0.004	32%	0.324	C	S	.	.	H	α-helix	trans	-67.4	-39.4	-179.3	-173.8	-124.3	0	0	0	112.3	A106 D108 K114 L115 L116 D140 M143 G179 G180 L196	A106-Y112 HydrophobicContact CB-CD2 4.24Å; A106-Y112 HydrophobicContact CB-CE2 4.29Å; D108-Y112 VanDerWaalsContact O-CB 3.23Å; D108-Y112 WeakPolarHBondContact O-CB 3.36Å; D108-Y112 PolarHBondContact O-N 3.37Å; Y112-K114 PolarHBondContact O-N 2.9Å; Y112-L115 WeakPolarHBondContact O-CB 3.37Å; Y112-L115 PolarHBondContact O-N 3.36Å; Y112-L116 HydrophobicContact CD1-CD1 3.82Å; Y112-L116 HydrophobicContact CD1-CG 4.35Å; Y112-L116 HydrophobicContact CD2-CG 4.33Å; Y112-L116 HydrophobicContact CE1-CD1 3.45Å; Y112-L116 VanDerWaalsContact CE1-CD1 3.45Å; Y112-L116 HydrophobicContact CE1-CD2 4.49Å; Y112-L116 HydrophobicContact CE1-CG 4.03Å; Y112-L116 HydrophobicContact CE2-CD1 4.32Å; Y112-L116 HydrophobicContact CE2-CD2 4.13Å; Y112-L116 HydrophobicContact CE2-CG 3.97Å; Y112-L116 HydrophobicContact CG-CD1 4.42Å; Y112-L116 HydrophobicContact CG-CG 4.5Å; Y112-L116 WeakPolarHBondContact O-CB 3.47Å; Y112-L116 WeakPolarHBondContact O-CG 3.44Å; Y112-L116 PolarHBondContact O-N 3.44Å; Y112-D140 PolarHBondContact OH-OD2 2.89Å; Y112-M143 HydrophobicContact CD1-CE 3.8Å; Y112-M143 HydrophobicContact CD1-SD 4.02Å; Y112-M143 HydrophobicContact CE1-CE 3.86Å; Y112-G179 VanDerWaalsContact OH-CA 3.23Å; Y112-G179 WeakPolarHBondContact OH-CA 3.36Å; Y112-G180 PolarHBondContact OH-N 2.96Å; Y112-L196 HydrophobicContact CE2-CD1 4.23Å
113	A	89.4	Confident	89.2	Confident	29 Å²	29	60.1 Å²	60.1	24%	0.24	31%	0.314	C	S	.	.	H	α-helix	trans	-59.8	-46.3	175.5	0	0	0	0	0	112.3	P109 L115 L116 E117	P109-A113 WeakPolarHBondContact O-CB 3.32Å; P109-A113 PolarHBondContact O-N 3.01Å; A113-L115 VanDerWaalsContact C-N 3.31Å; A113-L115 PolarHBondContact O-N 2.56Å; A113-L116 PolarHBondContact O-N 2.92Å; A113-E117 WeakPolarHBondContact O-CG 3.46Å; A113-E117 PolarHBondContact O-N 3.45Å
114	K	90.9	Very high	89.4	Confident	158 Å²	158	58.7 Å²	58.7	69%	0.687	30%	0.302	S	S	*	.	H	α-helix	trans	-62.3	-38.2	175.3	-71.4	177.9	-177.4	175.5	0	112.4	D110 R111 Y112 G118	D110-K114 PolarHBondContact O-N 2.87Å; R111-K114 PolarHBondContact O-N 2.99Å; Y112-K114 PolarHBondContact O-N 2.9Å; K114-G118 PolarHBondContact O-N 3.47Å
115	L	92	Very high	89.5	Confident	67 Å²	67	58.4 Å²	58.4	35%	0.351	30%	0.296	S	S	.	.	H	α-helix	trans	-65.8	-46.7	176.9	-175.9	64.9	0	0	0	111.1	R111 Y112 A113 E117 G118 L119 L196	R111-L115 PolarHBondContact O-N 3.29Å; R111-L115 VanDerWaalsContact O-N 3.08Å; Y112-L115 WeakPolarHBondContact O-CB 3.37Å; Y112-L115 PolarHBondContact O-N 3.36Å; A113-L115 VanDerWaalsContact C-N 3.31Å; A113-L115 PolarHBondContact O-N 2.56Å; L115-E117 VanDerWaalsContact C-N 3.31Å; L115-E117 PolarHBondContact O-N 2.85Å; L115-G118 PolarHBondContact O-N 2.88Å; L115-G118 VanDerWaalsContact O-N 3.15Å; L115-L119 HydrophobicContact CG-CD1 4.06Å; L115-L119 HydrophobicContact CG-CG 4.39Å; L115-L119 VanDerWaalsContact O-CG 3.31Å; L115-L119 WeakPolarHBondContact O-CG 3.39Å; L115-L119 PolarHBondContact O-N 3.28Å; L115-L196 HydrophobicContact CD2-CD2 3.71Å
116	L	90.8	Very high	89.9	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-59.7	-39.9	177	-78.1	177.2	0	0	0	112.3	Y112 A113 G118 L119 V120 M143 V144 V181	Y112-L116 HydrophobicContact CD1-CD1 3.82Å; Y112-L116 HydrophobicContact CD1-CG 4.35Å; Y112-L116 HydrophobicContact CD2-CG 4.33Å; Y112-L116 HydrophobicContact CE1-CD1 3.45Å; Y112-L116 VanDerWaalsContact CE1-CD1 3.45Å; Y112-L116 HydrophobicContact CE1-CD2 4.49Å; Y112-L116 HydrophobicContact CE1-CG 4.03Å; Y112-L116 HydrophobicContact CE2-CD1 4.32Å; Y112-L116 HydrophobicContact CE2-CD2 4.13Å; Y112-L116 HydrophobicContact CE2-CG 3.97Å; Y112-L116 HydrophobicContact CG-CD1 4.42Å; Y112-L116 HydrophobicContact CG-CG 4.5Å; Y112-L116 WeakPolarHBondContact O-CB 3.47Å; Y112-L116 WeakPolarHBondContact O-CG 3.44Å; Y112-L116 PolarHBondContact O-N 3.44Å; A113-L116 PolarHBondContact O-N 2.92Å; L116-G118 VanDerWaalsContact C-N 3.34Å; L116-G118 PolarHBondContact O-N 3.3Å; L116-L119 HydrophobicContact CD2-CD1 4.46Å; L116-L119 PolarHBondContact O-N 3.43Å; L116-V120 WeakPolarHBondContact O-CB 3.06Å; L116-V120 VanDerWaalsContact O-CG2 3.29Å; L116-V120 WeakPolarHBondContact O-CG2 3.35Å; L116-V120 PolarHBondContact O-N 3.03Å; L116-M143 HydrophobicContact CD1-CB 4Å; L116-V144 HydrophobicContact CD1-CG2 4.18Å; L116-V144 HydrophobicContact CD2-CG2 4.45Å; L116-V181 HydrophobicContact CD2-CG1 4.17Å
117	E	92.1	Very high	90.3	Very high	47 Å²	47	60.4 Å²	60.4	22%	0.22	30%	0.299	C	S	.	.	H	α-helix	trans	-54.6	-49.8	172.9	-75.2	173.5	-168.3	0	0	111.2	A113 L115 L121 A147 K150 N151	A113-E117 WeakPolarHBondContact O-CG 3.46Å; A113-E117 PolarHBondContact O-N 3.45Å; L115-E117 VanDerWaalsContact C-N 3.31Å; L115-E117 PolarHBondContact O-N 2.85Å; E117-L121 WeakPolarHBondContact O-CB 3.44Å; E117-L121 PolarHBondContact O-N 3.17Å; E117-L121 VanDerWaalsContact O-N 3.14Å; E117-A147 HydrophobicContact CB-CB 4.48Å; E117-A147 HydrophobicContact CG-CB 3.73Å; E117-K150 VanDerWaalsContact OE1-CD 3.25Å; E117-K150 WeakPolarHBondContact OE1-CD 3.3Å; E117-K150 WeakPolarHBondContact OE1-CE 3.01Å; E117-K150 IonicContact OE1-NZ 3.55Å; E117-K150 PolarHBondContact OE1-NZ 3Å; E117-N151 PolarHBondContact O-ND2 3.32Å
118	G	92.7	Very high	90.5	Very high	41 Å²	41	58.3 Å²	58.3	42%	0.423	30%	0.295	S	S	.	.	H	α-helix	trans	-64.2	-40.9	176.5	0	0	0	0	0	113.7	K114 L115 L116 L121 Q122	K114-G118 PolarHBondContact O-N 3.47Å; L115-G118 PolarHBondContact O-N 2.88Å; L115-G118 VanDerWaalsContact O-N 3.15Å; L116-G118 VanDerWaalsContact C-N 3.34Å; L116-G118 PolarHBondContact O-N 3.3Å; G118-L121 PolarHBondContact O-N 2.93Å; G118-Q122 WeakPolarHBondContact O-CB 3.46Å; G118-Q122 PolarHBondContact O-N 2.96Å
119	L	92.6	Very high	90.4	Very high	6 Å²	6	58.9 Å²	58.9	3%	0.031	30%	0.295	C	S	.	.	H	α-helix	trans	-65.9	-41.5	-178.6	-69	174.7	0	0	0	112.4	L115 L116 G123 V181 N194 L196	L115-L119 HydrophobicContact CG-CD1 4.06Å; L115-L119 HydrophobicContact CG-CG 4.39Å; L115-L119 VanDerWaalsContact O-CG 3.31Å; L115-L119 WeakPolarHBondContact O-CG 3.39Å; L115-L119 PolarHBondContact O-N 3.28Å; L116-L119 HydrophobicContact CD2-CD1 4.46Å; L116-L119 PolarHBondContact O-N 3.43Å; L119-G123 PolarHBondContact O-N 2.88Å; L119-G123 VanDerWaalsContact O-N 3.08Å; L119-V181 HydrophobicContact CB-CG2 4.27Å; L119-N194 WeakPolarHBondContact CA-ND2 3.37Å; L119-N194 WeakPolarHBondContact CD2-ND2 3.44Å; L119-N194 PolarHBondContact O-ND2 3.37Å; L119-L196 HydrophobicContact CD1-CD2 4.03Å
120	V	92.2	Very high	90.5	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-65.5	-46.3	176.6	169.6	0	0	0	0	110.3	L116 Q122 G123 F124 I134 V148 N151 V181	L116-V120 WeakPolarHBondContact O-CB 3.06Å; L116-V120 VanDerWaalsContact O-CG2 3.29Å; L116-V120 WeakPolarHBondContact O-CG2 3.35Å; L116-V120 PolarHBondContact O-N 3.03Å; V120-Q122 PolarHBondContact O-N 3.43Å; V120-G123 PolarHBondContact O-N 3.25Å; V120-F124 HydrophobicContact CG1-CD2 4.19Å; V120-F124 HydrophobicContact CG1-CE1 4Å; V120-F124 HydrophobicContact CG1-CE2 3.46Å; V120-F124 VanDerWaalsContact CG1-CE2 3.46Å; V120-F124 HydrophobicContact CG1-CZ 3.33Å; V120-F124 WeakPolarHBondContact O-CG 3.4Å; V120-F124 PolarHBondContact O-N 2.86Å; V120-I134 HydrophobicContact CG1-CD1 4.13Å; V120-V148 HydrophobicContact CG1-CG2 4.13Å; V120-N151 HydrophobicContact CG1-CB 4.49Å; V120-V181 HydrophobicContact CG2-CG1 4.06Å; V120-V181 HydrophobicContact CG2-CG2 3.93Å
121	L	92	Very high	90.6	Very high	32 Å²	32	58.6 Å²	58.6	17%	0.168	29%	0.288	C	S	.	.	H	α-helix	trans	-62.1	-43.9	179.5	-173.3	63.2	0	0	0	112.1	E117 G118 G123 F124 Y125 N151 V154	E117-L121 WeakPolarHBondContact O-CB 3.44Å; E117-L121 PolarHBondContact O-N 3.17Å; E117-L121 VanDerWaalsContact O-N 3.14Å; G118-L121 PolarHBondContact O-N 2.93Å; L121-G123 VanDerWaalsContact C-N 3.3Å; L121-G123 PolarHBondContact O-N 3.32Å; L121-F124 PolarHBondContact O-N 3.36Å; L121-Y125 HydrophobicContact CD1-CE1 4.34Å; L121-Y125 HydrophobicContact CD1-CE2 3.86Å; L121-Y125 HydrophobicContact CD2-CE2 3.91Å; L121-Y125 HydrophobicContact CG-CD2 4.11Å; L121-Y125 HydrophobicContact CG-CE2 3.54Å; L121-Y125 PolarHBondContact O-N 2.87Å; L121-N151 HydrophobicContact CD1-CB 4.27Å; L121-V154 HydrophobicContact CD1-CB 4.47Å; L121-V154 HydrophobicContact CD1-CG1 4.22Å; L121-V154 HydrophobicContact CD2-CG1 4.07Å
122	Q	93	Very high	90.8	Very high	81 Å²	81	50.5 Å²	50.5	38%	0.379	26%	0.258	S	S	.	.	H	α-helix	trans	-60.2	-41.4	175.2	-174	-177.1	5.9	0	0	111.6	G118 V120 F124 Y125 Q126 N194	G118-Q122 WeakPolarHBondContact O-CB 3.46Å; G118-Q122 PolarHBondContact O-N 2.96Å; V120-Q122 PolarHBondContact O-N 3.43Å; Q122-F124 VanDerWaalsContact C-N 3.31Å; Q122-F124 PolarHBondContact O-N 3.41Å; Q122-Y125 PolarHBondContact O-N 3Å; Q122-Q126 WeakPolarHBondContact O-CB 3.28Å; Q122-Q126 PolarHBondContact O-N 3.41Å; Q122-N194 PolarHBondContact OE1-ND2 3.02Å
123	G	91.8	Very high	90.9	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-60	-40.4	175.9	0	0	0	0	0	112.5	L119 V120 L121 Q126 L127	L119-G123 PolarHBondContact O-N 2.88Å; L119-G123 VanDerWaalsContact O-N 3.08Å; V120-G123 PolarHBondContact O-N 3.25Å; L121-G123 VanDerWaalsContact C-N 3.3Å; L121-G123 PolarHBondContact O-N 3.32Å; G123-Q126 PolarHBondContact O-N 3.16Å; G123-L127 WeakPolarHBondContact O-CB 3.45Å; G123-L127 PolarHBondContact O-N 3.04Å; G123-L127 VanDerWaalsContact O-N 3.07Å
124	F	89.9	Confident	91	Very high	1 Å²	1	50.5 Å²	50.5	0%	0.004	26%	0.256	C	S	.	.	H	α-helix	trans	-65.5	-44.3	176.1	-61.4	-22.9	0	0	0	112.6	V120 L121 Q122 Q126 L127 L128 V132 I134 V148 N151 Y155 I163 V165 V183	V120-F124 HydrophobicContact CG1-CD2 4.19Å; V120-F124 HydrophobicContact CG1-CE1 4Å; V120-F124 HydrophobicContact CG1-CE2 3.46Å; V120-F124 VanDerWaalsContact CG1-CE2 3.46Å; V120-F124 HydrophobicContact CG1-CZ 3.33Å; V120-F124 WeakPolarHBondContact O-CG 3.4Å; V120-F124 PolarHBondContact O-N 2.86Å; L121-F124 PolarHBondContact O-N 3.36Å; Q122-F124 VanDerWaalsContact C-N 3.31Å; Q122-F124 PolarHBondContact O-N 3.41Å; F124-Q126 PolarHBondContact O-N 3.43Å; F124-L127 PolarHBondContact O-N 3.1Å; F124-L128 PolarHBondContact O-N 3.2Å; F124-V132 HydrophobicContact CD1-CG1 4.32Å; F124-V132 HydrophobicContact CE1-CG1 4.1Å; F124-I134 HydrophobicContact CE1-CD1 3.86Å; F124-I134 HydrophobicContact CE1-CG1 4.4Å; F124-I134 HydrophobicContact CZ-CD1 3.88Å; F124-V148 HydrophobicContact CZ-CG2 4.49Å; F124-N151 HydrophobicContact CD2-CB 4.42Å; F124-N151 HydrophobicContact CE2-CB 4.05Å; F124-Y155 HydrophobicContact CB-CD2 3.64Å; F124-Y155 HydrophobicContact CB-CE2 3.74Å; F124-Y155 HydrophobicContact CB-CG 4.45Å; F124-I163 HydrophobicContact CB-CD1 4.13Å; F124-I163 HydrophobicContact CD1-CD1 3.82Å; F124-I163 HydrophobicContact CD2-CD1 4.22Å; F124-I163 HydrophobicContact CE1-CD1 4.25Å; F124-I163 HydrophobicContact CG-CD1 3.82Å; F124-V165 HydrophobicContact CE1-CG1 4.35Å; F124-V165 HydrophobicContact CE1-CG2 4.01Å; F124-V165 HydrophobicContact CE2-CG2 4.22Å; F124-V165 HydrophobicContact CZ-CB 4.48Å; F124-V165 HydrophobicContact CZ-CG1 4.06Å; F124-V165 HydrophobicContact CZ-CG2 3.58Å; F124-V183 HydrophobicContact CD1-CG1 4.45Å
125	Y	90.9	Very high	91.1	Very high	79 Å²	79	46.2 Å²	46.2	31%	0.31	24%	0.235	S	C	.	.	H	α-helix	trans	-66.1	-25.4	177.1	-67.7	-35.9	0	0	0	113.8	L121 Q122 L128 Y155 T158 V159	L121-Y125 HydrophobicContact CD1-CE1 4.34Å; L121-Y125 HydrophobicContact CD1-CE2 3.86Å; L121-Y125 HydrophobicContact CD2-CE2 3.91Å; L121-Y125 HydrophobicContact CG-CD2 4.11Å; L121-Y125 HydrophobicContact CG-CE2 3.54Å; L121-Y125 PolarHBondContact O-N 2.87Å; Q122-Y125 PolarHBondContact O-N 3Å; Y125-L128 WeakPolarHBondContact O-CD2 3.32Å; Y125-L128 VanDerWaalsContact O-CG 3.29Å; Y125-L128 WeakPolarHBondContact O-CG 3.25Å; Y125-Y155 AromaticContact CD1-CD2 3.69Å; Y125-Y155 HydrophobicContact CD1-CD2 3.69Å; Y125-Y155 AromaticContact CD1-CE2 3.73Å; Y125-Y155 HydrophobicContact CD1-CE2 3.73Å; Y125-Y155 AromaticContact CE1-CD2 3.58Å; Y125-Y155 HydrophobicContact CE1-CD2 3.58Å; Y125-Y155 HydrophobicContact CE1-CE2 4.05Å; Y125-T158 HydrophobicContact CE1-CG2 4.25Å; Y125-T158 WeakPolarHBondContact OH-CB 3.45Å; Y125-T158 PolarHBondContact OH-OG1 3.08Å; Y125-V159 HydrophobicContact CD1-CG2 3.91Å; Y125-V159 HydrophobicContact CE1-CG2 3.73Å
126	Q	91.6	Very high	91.1	Very high	125 Å²	125	43 Å²	43	58%	0.584	22%	0.218	S	C	*	.	H	α-helix	trans	-83.6	-32.5	177.5	-166.5	167.9	6.5	0	0	112.6	Q122 G123 F124 V192	Q122-Q126 WeakPolarHBondContact O-CB 3.28Å; Q122-Q126 PolarHBondContact O-N 3.41Å; G123-Q126 PolarHBondContact O-N 3.16Å; F124-Q126 PolarHBondContact O-N 3.43Å; Q126-V192 HydrophobicContact CB-CG1 4.42Å; Q126-V192 HydrophobicContact CB-CG2 4.32Å; Q126-V192 HydrophobicContact CG-CG1 4.46Å; Q126-V192 HydrophobicContact CG-CG2 4.17Å; Q126-V192 VanDerWaalsContact OE1-CG1 3.31Å
127	L	88.8	Confident	91.2	Very high	18 Å²	18	45.6 Å²	45.6	9%	0.094	23%	0.228	C	C	.	.	H	α-helix	trans	-85	-38.4	-177.7	-157.6	97	0	0	0	112.7	G123 F124 E129 V132 V183 N185 I190 V192	G123-L127 WeakPolarHBondContact O-CB 3.45Å; G123-L127 PolarHBondContact O-N 3.04Å; G123-L127 VanDerWaalsContact O-N 3.07Å; F124-L127 PolarHBondContact O-N 3.1Å; L127-E129 VanDerWaalsContact C-N 3.26Å; L127-E129 HydrophobicContact CD2-CB 3.77Å; L127-E129 HydrophobicContact CD2-CG 3.93Å; L127-E129 HydrophobicContact CG-CB 4.35Å; L127-E129 HydrophobicContact CG-CG 4.07Å; L127-E129 WeakPolarHBondContact O-CG 3.44Å; L127-E129 PolarHBondContact O-N 2.94Å; L127-V132 HydrophobicContact CD2-CB 4.4Å; L127-V132 HydrophobicContact CD2-CG1 4.1Å; L127-V132 HydrophobicContact CD2-CG2 3.6Å; L127-V183 HydrophobicContact CD2-CG1 4.39Å; L127-N185 HydrophobicContact CD2-CB 4.14Å; L127-I190 HydrophobicContact CD1-CB 4.36Å; L127-I190 HydrophobicContact CD1-CG2 3.79Å; L127-V192 HydrophobicContact CB-CG2 4.5Å; L127-V192 HydrophobicContact CD1-CG2 3.82Å
128	L	88.5	Confident	91	Very high	110 Å²	110	50.2 Å²	50.2	58%	0.576	25%	0.25	S	C	*	.			trans	49.5	37.6	179.4	-60.9	176.2	0	0	0	115.3	F124 Y125 Y155 V159	F124-L128 PolarHBondContact O-N 3.2Å; Y125-L128 WeakPolarHBondContact O-CD2 3.32Å; Y125-L128 VanDerWaalsContact O-CG 3.29Å; Y125-L128 WeakPolarHBondContact O-CG 3.25Å; L128-Y155 HydrophobicContact CD2-CE2 4.4Å; L128-V159 HydrophobicContact CD2-CG1 4.32Å
129	E	87.1	Confident	90.7	Very high	66 Å²	66	54.6 Å²	54.6	31%	0.308	26%	0.259	S	S	.	.			trans	-109.4	150.7	180	-70.9	-96.1	-161.6	0	0	111.6	L127 K131 V132 N185	L127-E129 VanDerWaalsContact C-N 3.26Å; L127-E129 HydrophobicContact CD2-CB 3.77Å; L127-E129 HydrophobicContact CD2-CG 3.93Å; L127-E129 HydrophobicContact CG-CB 4.35Å; L127-E129 HydrophobicContact CG-CG 4.07Å; L127-E129 WeakPolarHBondContact O-CG 3.44Å; L127-E129 PolarHBondContact O-N 2.94Å; E129-K131 PolarHBondContact O-N 3.18Å; E129-V132 HydrophobicContact CB-CG2 4.36Å; E129-N185 HydrophobicContact CG-CB 4.31Å
130	P	87.3	Confident	90.6	Very high	80 Å²	80	55 Å²	55	52%	0.519	26%	0.261	S	S	.	.	S	Bend	trans	-74.1	-24.6	-178.5	29.3	-35.1	0	0	0	113.4	I163 T164	P130-I163 WeakPolarHBondContact O-CA 3.3Å; P130-T164 PolarHBondContact O-N 3.5Å
131	K	90.2	Very high	90.4	Very high	116 Å²	116	56.4 Å²	56.4	50%	0.504	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	121.9	-179.6	-72.8	-175.9	-179.3	-179.2	0	109.8	E129 T164 N186	E129-K131 PolarHBondContact O-N 3.18Å; K131-T164 WeakPolarHBondContact CA-O 3.43Å; K131-N186 HydrophobicContact CB-CB 3.91Å; K131-N186 PolarHBondContact O-N 2.92Å
132	V	92.3	Very high	90.3	Very high	3 Å²	3	61.3 Å²	61.3	2%	0.018	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	138.1	-171.1	-179.2	0	0	0	0	110.2	F124 L127 E129 I163 T164 V165 R166 V183 Y184	F124-V132 HydrophobicContact CD1-CG1 4.32Å; F124-V132 HydrophobicContact CE1-CG1 4.1Å; L127-V132 HydrophobicContact CD2-CB 4.4Å; L127-V132 HydrophobicContact CD2-CG1 4.1Å; L127-V132 HydrophobicContact CD2-CG2 3.6Å; E129-V132 HydrophobicContact CB-CG2 4.36Å; V132-I163 HydrophobicContact CB-CD1 4.44Å; V132-I163 HydrophobicContact CG2-CD1 3.8Å; V132-I163 HydrophobicContact CG2-CG1 4.06Å; V132-T164 PolarHBondContact N-O 2.91Å; V132-V165 WeakPolarHBondContact O-CA 3.37Å; V132-R166 PolarHBondContact O-N 3.3Å; V132-V183 HydrophobicContact CG1-CG1 3.12Å; V132-Y184 WeakPolarHBondContact CA-O 3.43Å
133	T	92.6	Very high	90.1	Very high	31 Å²	31	60.1 Å²	60.1	19%	0.19	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	127.8	174.6	-54.7	0	0	0	0	109.7	R166 D168 Y184	T133-R166 CarbonylContact C-O 3.49Å; T133-R166 VanDerWaalsContact CA-O 3.22Å; T133-R166 WeakPolarHBondContact CA-O 3.19Å; T133-D168 HydrophobicContact CG2-CB 3.89Å; T133-Y184 PolarHBondContact N-O 3.1Å; T133-Y184 PolarHBondContact O-N 2.88Å
134	I	92.5	Very high	90.1	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	132.9	178.9	-58.9	177.6	0	0	0	109.6	V120 F124 V144 V148 V165 R166 D168 V181 E182 V183	V120-I134 HydrophobicContact CG1-CD1 4.13Å; F124-I134 HydrophobicContact CE1-CD1 3.86Å; F124-I134 HydrophobicContact CE1-CG1 4.4Å; F124-I134 HydrophobicContact CZ-CD1 3.88Å; I134-V144 HydrophobicContact CG2-CG1 4.08Å; I134-V148 HydrophobicContact CD1-CG2 3.52Å; I134-V165 HydrophobicContact CD1-CG1 3.52Å; I134-V165 HydrophobicContact CG1-CG1 3.92Å; I134-R166 PolarHBondContact N-O 2.99Å; I134-D168 PolarHBondContact O-N 3.37Å; I134-V181 HydrophobicContact CG2-CB 4.05Å; I134-V181 HydrophobicContact CG2-CG1 4.1Å; I134-E182 WeakPolarHBondContact CA-O 3.2Å; I134-V183 HydrophobicContact CG1-CG2 4.44Å
135	R	92.8	Very high	90.2	Very high	67 Å²	67	64 Å²	64	25%	0.253	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	131.7	166.5	-63.6	-171	177.2	157.8	-6.9	109.5	D168 H171 L173 E182 Y184	R135-D168 HydrophobicContact CG-CB 3.86Å; R135-D168 IonicContact CZ-OD2 3.39Å; R135-D168 IonicContact NE-OD2 2.68Å; R135-D168 PolarHBondContact NE-OD2 3.47Å; R135-D168 IonicContact NH2-OD2 2.63Å; R135-D168 PolarHBondContact NH2-OD2 3.42Å; R135-H171 WeakPolarHBondContact CD-O 3.43Å; R135-L173 HydrophobicContact CB-CD2 4.32Å; R135-L173 HydrophobicContact CB-CG 4.43Å; R135-E182 HydrophobicContact CB-CB 4.36Å; R135-E182 PolarHBondContact N-O 2.99Å; R135-E182 PolarHBondContact O-N 3.34Å; R135-Y184 HydrophobicContact CB-CE2 4.11Å; R135-Y184 VanDerWaalsContact CD-CE2 3.49Å; R135-Y184 HydrophobicContact CG-CD2 3.99Å; R135-Y184 HydrophobicContact CG-CE2 3.75Å; R135-Y184 PolarHBondContact NH1-OH 3.43Å
136	C	92.3	Very high	90.1	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	31%	0.314	C	S	.	.			trans	-137.4	175.2	178.4	58.7	0	0	0	0	109.6	V144 F172 L173 V181	C136-V144 HydrophobicContact CB-CG2 3.9Å; C136-F172 WeakPolarHBondContact O-CA 3.32Å; C136-F172 WeakPolarHBondContact O-CD1 3.24Å; C136-L173 PolarHBondContact O-N 2.88Å; C136-V181 HydrophobicContact CB-CG1 4.32Å
137	R	91.3	Very high	90.1	Very high	55 Å²	55	56.6 Å²	56.6	21%	0.208	29%	0.286	C	S	.	.			trans	-72.8	147.2	171.3	-170.7	177.9	175.1	175.5	-1.8	109.4	Q139 D140 S175 I177	R137-Q139 PolarHBondContact O-N 3.48Å; R137-Q139 VanDerWaalsContact O-N 3.09Å; R137-D140 PolarHBondContact O-N 2.99Å; R137-S175 PolarHBondContact NH1-O 2.96Å; R137-S175 PolarHBondContact NH2-O 3.42Å; R137-I177 PolarHBondContact NH1-O 3.37Å
138	Q	88.4	Confident	90.2	Very high	144 Å²	144	56 Å²	56	67%	0.673	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-56.8	-29.3	-178.3	-166.4	175.7	13.9	0	0	113.8	D140 V141 F172	Q138-D140 VanDerWaalsContact C-N 3.33Å; Q138-V141 WeakPolarHBondContact O-CG2 3.29Å; Q138-F172 HydrophobicContact CB-CD1 4.21Å; Q138-F172 HydrophobicContact CB-CG 4.25Å; Q138-F172 HydrophobicContact CG-CZ 4.45Å
139	Q	87.3	Confident	90.3	Very high	133 Å²	133	55.8 Å²	55.8	62%	0.621	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-75.6	-21.4	178.8	-63.9	173.5	-10.4	0	0	113.3	R137	R137-Q139 PolarHBondContact O-N 3.48Å; R137-Q139 VanDerWaalsContact O-N 3.09Å
140	D	89.3	Confident	90.4	Very high	13 Å²	13	58.3 Å²	58.3	7%	0.07	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-101	0.3	-171.1	-63.2	-19.8	0	0	0	112.6	Y112 R137 Q138 D142 M143 V144	Y112-D140 PolarHBondContact OH-OD2 2.89Å; R137-D140 PolarHBondContact O-N 2.99Å; Q138-D140 VanDerWaalsContact C-N 3.33Å; D140-D142 VanDerWaalsContact C-N 3.33Å; D140-D142 PolarHBondContact O-N 3.3Å; D140-M143 HydrophobicContact CB-CE 4.4Å; D140-M143 PolarHBondContact O-N 3.49Å; D140-M143 WeakPolarHBondContact OD1-CE 3.46Å; D140-V144 HydrophobicContact CB-CG2 4.26Å; D140-V144 WeakPolarHBondContact O-CB 3.37Å; D140-V144 VanDerWaalsContact O-CG2 3.27Å; D140-V144 WeakPolarHBondContact O-CG2 3.48Å; D140-V144 PolarHBondContact O-N 2.85Å
141	V	89.3	Confident	90.5	Very high	30 Å²	30	54.9 Å²	54.9	18%	0.182	27%	0.27	C	S	.	.	H	α-helix	trans	-56.4	-45.6	-172.3	176.5	0	0	0	0	111.8	Q138 V144 Q145 F172	Q138-V141 WeakPolarHBondContact O-CG2 3.29Å; V141-V144 PolarHBondContact O-N 3.4Å; V141-Q145 WeakPolarHBondContact O-CB 3.36Å; V141-Q145 PolarHBondContact O-N 2.98Å; V141-F172 HydrophobicContact CG2-CD1 4.34Å; V141-F172 HydrophobicContact CG2-CE1 3.67Å
142	D	89.7	Confident	90.4	Very high	136 Å²	136	51.6 Å²	51.6	73%	0.727	26%	0.259	S	S	*	.	H	α-helix	trans	-66.5	-42	-178.6	-64	-31.4	0	0	0	111.8	D140 Q145 A146	D140-D142 VanDerWaalsContact C-N 3.33Å; D140-D142 PolarHBondContact O-N 3.3Å; D142-Q145 PolarHBondContact O-N 3.03Å; D142-A146 PolarHBondContact O-N 3.43Å
143	M	89.3	Confident	90.1	Very high	56 Å²	56	54.6 Å²	54.6	28%	0.276	28%	0.284	S	S	.	.	H	α-helix	trans	-66.9	-40.9	177.3	-68.6	-173.3	-77.9	0	0	111.5	Y112 L116 D140 A146 A147	Y112-M143 HydrophobicContact CD1-CE 3.8Å; Y112-M143 HydrophobicContact CD1-SD 4.02Å; Y112-M143 HydrophobicContact CE1-CE 3.86Å; L116-M143 HydrophobicContact CD1-CB 4Å; D140-M143 HydrophobicContact CB-CE 4.4Å; D140-M143 PolarHBondContact O-N 3.49Å; D140-M143 WeakPolarHBondContact OD1-CE 3.46Å; M143-A146 PolarHBondContact O-N 3.39Å; M143-A147 WeakPolarHBondContact O-CB 3.34Å; M143-A147 PolarHBondContact O-N 3.1Å
144	V	91.1	Very high	89.9	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-66.9	-40.5	176.7	173	0	0	0	0	110.5	L116 I134 C136 D140 V141 A146 A147 V148 I167 V181	L116-V144 HydrophobicContact CD1-CG2 4.18Å; L116-V144 HydrophobicContact CD2-CG2 4.45Å; I134-V144 HydrophobicContact CG2-CG1 4.08Å; C136-V144 HydrophobicContact CB-CG2 3.9Å; D140-V144 HydrophobicContact CB-CG2 4.26Å; D140-V144 WeakPolarHBondContact O-CB 3.37Å; D140-V144 VanDerWaalsContact O-CG2 3.27Å; D140-V144 WeakPolarHBondContact O-CG2 3.48Å; D140-V144 PolarHBondContact O-N 2.85Å; V141-V144 PolarHBondContact O-N 3.4Å; V144-A146 VanDerWaalsContact C-N 3.34Å; V144-A146 PolarHBondContact O-N 2.68Å; V144-A147 PolarHBondContact O-N 3.23Å; V144-V148 HydrophobicContact CG1-CG2 4.25Å; V144-V148 WeakPolarHBondContact O-CB 3.47Å; V144-V148 VanDerWaalsContact O-CG2 3.22Å; V144-V148 WeakPolarHBondContact O-CG2 3.5Å; V144-V148 PolarHBondContact O-N 2.81Å; V144-I167 HydrophobicContact CG1-CD1 4.12Å; V144-V181 HydrophobicContact CG1-CG1 4.32Å; V144-V181 HydrophobicContact CG2-CG1 3.87Å
145	Q	91	Very high	89.7	Confident	82 Å²	82	56.1 Å²	56.1	38%	0.383	29%	0.293	S	S	.	.	H	α-helix	trans	-62.4	-41.5	175.9	-172.6	62.1	65.3	0	0	111.9	V141 D142 V148 N149 I167	V141-Q145 WeakPolarHBondContact O-CB 3.36Å; V141-Q145 PolarHBondContact O-N 2.98Å; D142-Q145 PolarHBondContact O-N 3.03Å; Q145-V148 PolarHBondContact O-N 3.16Å; Q145-N149 PolarHBondContact NE2-OD1 3.28Å; Q145-N149 PolarHBondContact O-N 2.98Å; Q145-N149 VanDerWaalsContact O-N 3.12Å; Q145-N149 PolarHBondContact O-ND2 2.97Å; Q145-N149 PolarHBondContact O-OD1 3.44Å; Q145-I167 HydrophobicContact CB-CD1 3.9Å; Q145-I167 HydrophobicContact CG-CD1 4.46Å
146	A	90.7	Very high	89.4	Confident	48 Å²	48	58.3 Å²	58.3	40%	0.397	30%	0.304	S	S	.	.	H	α-helix	trans	-63.1	-43.3	173.6	0	0	0	0	0	112	D142 M143 V144 N149 K150	D142-A146 PolarHBondContact O-N 3.43Å; M143-A146 PolarHBondContact O-N 3.39Å; V144-A146 VanDerWaalsContact C-N 3.34Å; V144-A146 PolarHBondContact O-N 2.68Å; A146-N149 PolarHBondContact O-N 3.29Å; A146-K150 PolarHBondContact O-N 3.14Å
147	A	91.6	Very high	89.3	Confident	1 Å²	1	66 Å²	66	1%	0.008	34%	0.34	C	S	.	.	H	α-helix	trans	-63.6	-41.6	177.2	0	0	0	0	0	112.4	E117 M143 V144 K150 N151	E117-A147 HydrophobicContact CB-CB 4.48Å; E117-A147 HydrophobicContact CG-CB 3.73Å; M143-A147 WeakPolarHBondContact O-CB 3.34Å; M143-A147 PolarHBondContact O-N 3.1Å; V144-A147 PolarHBondContact O-N 3.23Å; A147-K150 PolarHBondContact O-N 2.85Å; A147-N151 WeakPolarHBondContact O-CB 3.43Å; A147-N151 VanDerWaalsContact O-CG 3.29Å; A147-N151 PolarHBondContact O-N 2.88Å; A147-N151 PolarHBondContact O-ND2 3.13Å; A147-N151 VanDerWaalsContact O-ND2 3.09Å
148	V	91	Very high	89	Confident	4 Å²	4	67.4 Å²	67.4	2%	0.024	36%	0.355	C	S	.	.	H	α-helix	trans	-60.2	-47.7	176	168.5	0	0	0	0	110.7	V120 F124 I134 V144 Q145 K150 N151 V152 V165	V120-V148 HydrophobicContact CG1-CG2 4.13Å; F124-V148 HydrophobicContact CZ-CG2 4.49Å; I134-V148 HydrophobicContact CD1-CG2 3.52Å; V144-V148 HydrophobicContact CG1-CG2 4.25Å; V144-V148 WeakPolarHBondContact O-CB 3.47Å; V144-V148 VanDerWaalsContact O-CG2 3.22Å; V144-V148 WeakPolarHBondContact O-CG2 3.5Å; V144-V148 PolarHBondContact O-N 2.81Å; Q145-V148 PolarHBondContact O-N 3.16Å; V148-K150 VanDerWaalsContact C-N 3.28Å; V148-K150 PolarHBondContact O-N 3.27Å; V148-N151 PolarHBondContact O-N 3.01Å; V148-N151 VanDerWaalsContact O-N 3.15Å; V148-V152 HydrophobicContact CG1-CG2 4.1Å; V148-V152 VanDerWaalsContact O-CG2 3.24Å; V148-V152 WeakPolarHBondContact O-CG2 3.31Å; V148-V152 PolarHBondContact O-N 3.16Å; V148-V165 HydrophobicContact CG1-CB 3.71Å; V148-V165 HydrophobicContact CG1-CG1 3.65Å; V148-V165 HydrophobicContact CG1-CG2 4.1Å; V148-V165 HydrophobicContact CG2-CG1 4.02Å
149	N	89.3	Confident	88.9	Confident	106 Å²	106	62.7 Å²	62.7	57%	0.567	34%	0.336	S	S	*	.	H	α-helix	trans	-59.2	-39	-178	-69.3	-15.6	0	0	0	112.4	Q145 A146	Q145-N149 PolarHBondContact NE2-OD1 3.28Å; Q145-N149 PolarHBondContact O-N 2.98Å; Q145-N149 VanDerWaalsContact O-N 3.12Å; Q145-N149 PolarHBondContact O-ND2 2.97Å; Q145-N149 PolarHBondContact O-OD1 3.44Å; A146-N149 PolarHBondContact O-N 3.29Å
150	K	89.4	Confident	88.7	Confident	119 Å²	119	65.2 Å²	65.2	52%	0.517	35%	0.345	S	S	.	.	H	α-helix	trans	-70.3	-45.2	175.3	-67.8	177.9	-176.1	176.4	0	111.9	E117 A146 A147 V148 V152 A153	E117-K150 VanDerWaalsContact OE1-CD 3.25Å; E117-K150 WeakPolarHBondContact OE1-CD 3.3Å; E117-K150 WeakPolarHBondContact OE1-CE 3.01Å; E117-K150 IonicContact OE1-NZ 3.55Å; E117-K150 PolarHBondContact OE1-NZ 3Å; A146-K150 PolarHBondContact O-N 3.14Å; A147-K150 PolarHBondContact O-N 2.85Å; V148-K150 VanDerWaalsContact C-N 3.28Å; V148-K150 PolarHBondContact O-N 3.27Å; K150-V152 PolarHBondContact O-N 3.45Å; K150-A153 PolarHBondContact O-N 3.31Å
151	N	89.7	Confident	88.3	Confident	9 Å²	9	67.5 Å²	67.5	5%	0.048	36%	0.362	C	S	.	.	H	α-helix	trans	-72	-25.6	-174.2	-75.8	-34.7	0	0	0	114.1	E117 V120 L121 F124 A147 V148 A153 V154 Y155	E117-N151 PolarHBondContact O-ND2 3.32Å; V120-N151 HydrophobicContact CG1-CB 4.49Å; L121-N151 HydrophobicContact CD1-CB 4.27Å; F124-N151 HydrophobicContact CD2-CB 4.42Å; F124-N151 HydrophobicContact CE2-CB 4.05Å; A147-N151 WeakPolarHBondContact O-CB 3.43Å; A147-N151 VanDerWaalsContact O-CG 3.29Å; A147-N151 PolarHBondContact O-N 2.88Å; A147-N151 PolarHBondContact O-ND2 3.13Å; A147-N151 VanDerWaalsContact O-ND2 3.09Å; V148-N151 PolarHBondContact O-N 3.01Å; V148-N151 VanDerWaalsContact O-N 3.15Å; N151-A153 VanDerWaalsContact C-N 3.3Å; N151-A153 PolarHBondContact O-N 3.29Å; N151-V154 PolarHBondContact O-N 3.4Å; N151-Y155 VanDerWaalsContact O-CB 3.29Å; N151-Y155 WeakPolarHBondContact O-CB 3.33Å; N151-Y155 PolarHBondContact O-N 2.86Å
152	V	87.3	Confident	87.9	Confident	47 Å²	47	71.4 Å²	71.4	29%	0.285	38%	0.382	S	S	.	.	H	α-helix	trans	-60.5	-40.3	176.2	168.5	0	0	0	0	111.3	V148 K150 K156 I163 V165	V148-V152 HydrophobicContact CG1-CG2 4.1Å; V148-V152 VanDerWaalsContact O-CG2 3.24Å; V148-V152 WeakPolarHBondContact O-CG2 3.31Å; V148-V152 PolarHBondContact O-N 3.16Å; K150-V152 PolarHBondContact O-N 3.45Å; V152-K156 WeakPolarHBondContact O-CB 3.5Å; V152-K156 PolarHBondContact O-N 3.39Å; V152-K156 VanDerWaalsContact O-N 3.08Å; V152-I163 HydrophobicContact CG1-CG2 4.29Å; V152-I163 HydrophobicContact CG2-CG2 4.14Å; V152-V165 HydrophobicContact CG2-CG2 4.15Å
153	A	87.3	Confident	87.7	Confident	65 Å²	65	65.6 Å²	65.6	54%	0.537	35%	0.351	S	S	.	.	H	α-helix	trans	-65.6	-47.8	177.2	0	0	0	0	0	111.5	K150 N151 Y155 K156 E157	K150-A153 PolarHBondContact O-N 3.31Å; N151-A153 VanDerWaalsContact C-N 3.3Å; N151-A153 PolarHBondContact O-N 3.29Å; A153-Y155 PolarHBondContact O-N 3.38Å; A153-K156 PolarHBondContact O-N 2.89Å; A153-E157 PolarHBondContact O-N 2.63Å
154	V	88.4	Confident	87.6	Confident	59 Å²	59	67.3 Å²	67.3	36%	0.358	36%	0.364	S	S	.	.	H	α-helix	trans	-62.5	-43.5	179.7	179.7	0	0	0	0	111.7	L121 N151 E157 T158	L121-V154 HydrophobicContact CD1-CB 4.47Å; L121-V154 HydrophobicContact CD1-CG1 4.22Å; L121-V154 HydrophobicContact CD2-CG1 4.07Å; N151-V154 PolarHBondContact O-N 3.4Å; V154-E157 PolarHBondContact O-N 3.49Å; V154-T158 WeakPolarHBondContact O-CB 3.48Å; V154-T158 PolarHBondContact O-N 2.94Å; V154-T158 VanDerWaalsContact O-N 3.08Å; V154-T158 PolarHBondContact O-OG1 3.32Å
155	Y	87.7	Confident	87.5	Confident	5 Å²	5	68.9 Å²	68.9	2%	0.02	37%	0.374	C	S	.	.	H	α-helix	trans	-64.4	-42.1	177.7	-176.3	-92.1	0	0	0	111.7	F124 Y125 L128 N151 A153 E157 T158 V159 I163	F124-Y155 HydrophobicContact CB-CD2 3.64Å; F124-Y155 HydrophobicContact CB-CE2 3.74Å; F124-Y155 HydrophobicContact CB-CG 4.45Å; Y125-Y155 AromaticContact CD1-CD2 3.69Å; Y125-Y155 HydrophobicContact CD1-CD2 3.69Å; Y125-Y155 AromaticContact CD1-CE2 3.73Å; Y125-Y155 HydrophobicContact CD1-CE2 3.73Å; Y125-Y155 AromaticContact CE1-CD2 3.58Å; Y125-Y155 HydrophobicContact CE1-CD2 3.58Å; Y125-Y155 HydrophobicContact CE1-CE2 4.05Å; L128-Y155 HydrophobicContact CD2-CE2 4.4Å; N151-Y155 VanDerWaalsContact O-CB 3.29Å; N151-Y155 WeakPolarHBondContact O-CB 3.33Å; N151-Y155 PolarHBondContact O-N 2.86Å; A153-Y155 PolarHBondContact O-N 3.38Å; Y155-E157 VanDerWaalsContact C-N 3.34Å; Y155-E157 PolarHBondContact O-N 2.93Å; Y155-T158 PolarHBondContact O-N 2.91Å; Y155-V159 HydrophobicContact CD1-CB 4.47Å; Y155-V159 HydrophobicContact CD2-CG2 3.96Å; Y155-V159 HydrophobicContact CE1-CB 4.08Å; Y155-V159 HydrophobicContact CE1-CG1 4.3Å; Y155-V159 HydrophobicContact CE1-CG2 4.34Å; Y155-V159 HydrophobicContact CE2-CB 4.27Å; Y155-V159 HydrophobicContact CE2-CG2 3.64Å; Y155-V159 HydrophobicContact CG-CG2 4.44Å; Y155-V159 WeakPolarHBondContact O-CB 3.23Å; Y155-V159 PolarHBondContact O-N 2.71Å; Y155-I163 HydrophobicContact CD1-CB 3.91Å; Y155-I163 HydrophobicContact CD1-CD1 4.3Å; Y155-I163 HydrophobicContact CD1-CG2 3.77Å; Y155-I163 HydrophobicContact CE1-CB 3.95Å; Y155-I163 HydrophobicContact CE1-CD1 4.12Å; Y155-I163 HydrophobicContact CE1-CG2 4.33Å; Y155-I163 HydrophobicContact CG-CG2 4.41Å
156	K	87.4	Confident	87.5	Confident	113 Å²	113	72.8 Å²	72.8	49%	0.491	39%	0.385	S	S	.	.	H	α-helix	trans	-64	-38.9	178.2	-175.9	174.6	178.2	170.2	0	112.1	V152 A153 K160 N162	V152-K156 WeakPolarHBondContact O-CB 3.5Å; V152-K156 PolarHBondContact O-N 3.39Å; V152-K156 VanDerWaalsContact O-N 3.08Å; A153-K156 PolarHBondContact O-N 2.89Å; K156-K160 WeakPolarHBondContact O-CA 3.47Å; K156-K160 PolarHBondContact O-N 3.33Å; K156-N162 WeakPolarHBondContact CD-OD1 3.26Å; K156-N162 WeakPolarHBondContact CE-OD1 3.37Å; K156-N162 PolarHBondContact NZ-OD1 3.42Å
157	E	88.2	Confident	87.4	Confident	161 Å²	161	71.2 Å²	71.2	75%	0.752	37%	0.37	S	S	*	.	H	α-helix	trans	-65.7	-42.9	176.1	-172.8	173.5	-173.2	0	0	111.8	A153 V154 Y155	A153-E157 PolarHBondContact O-N 2.63Å; V154-E157 PolarHBondContact O-N 3.49Å; Y155-E157 VanDerWaalsContact C-N 3.34Å; Y155-E157 PolarHBondContact O-N 2.93Å
158	T	86.8	Confident	87.2	Confident	85 Å²	85	71.9 Å²	71.9	52%	0.521	37%	0.373	S	S	.	.	H	α-helix	trans	-79.1	-47.6	-173.1	-48.3	0	0	0	0	112.7	Y125 V154 Y155	Y125-T158 HydrophobicContact CE1-CG2 4.25Å; Y125-T158 WeakPolarHBondContact OH-CB 3.45Å; Y125-T158 PolarHBondContact OH-OG1 3.08Å; V154-T158 WeakPolarHBondContact O-CB 3.48Å; V154-T158 PolarHBondContact O-N 2.94Å; V154-T158 VanDerWaalsContact O-N 3.08Å; V154-T158 PolarHBondContact O-OG1 3.32Å; Y155-T158 PolarHBondContact O-N 2.91Å
159	V	84.8	Confident	86.9	Confident	45 Å²	45	78.5 Å²	78.5	27%	0.273	40%	0.404	S	S	.	.	H	α-helix	trans	-96	-8.1	-173.6	-173.3	0	0	0	0	112	Y125 L128 Y155 S161	Y125-V159 HydrophobicContact CD1-CG2 3.91Å; Y125-V159 HydrophobicContact CE1-CG2 3.73Å; L128-V159 HydrophobicContact CD2-CG1 4.32Å; Y155-V159 HydrophobicContact CD1-CB 4.47Å; Y155-V159 HydrophobicContact CD2-CG2 3.96Å; Y155-V159 HydrophobicContact CE1-CB 4.08Å; Y155-V159 HydrophobicContact CE1-CG1 4.3Å; Y155-V159 HydrophobicContact CE1-CG2 4.34Å; Y155-V159 HydrophobicContact CE2-CB 4.27Å; Y155-V159 HydrophobicContact CE2-CG2 3.64Å; Y155-V159 HydrophobicContact CG-CG2 4.44Å; Y155-V159 WeakPolarHBondContact O-CB 3.23Å; Y155-V159 PolarHBondContact O-N 2.71Å; V159-S161 PolarHBondContact O-N 2.96Å; V159-S161 PolarHBondContact O-OG 2.7Å
160	K	83.9	Confident	86.6	Confident	185 Å²	185	79.5 Å²	79.5	80%	0.804	41%	0.409	S	S	*	.			trans	54.2	24	-177.8	-57.6	-177.9	-179.8	178.9	0	113.8	K156	K156-K160 WeakPolarHBondContact O-CA 3.47Å; K156-K160 PolarHBondContact O-N 3.33Å
161	S	80.9	Confident	86.5	Confident	61 Å²	61	79.1 Å²	79.1	43%	0.427	41%	0.409	S	S	.	.	S	Bend	trans	-124.4	142.2	-178	-65.4	0	0	0	0	110	V159	V159-S161 PolarHBondContact O-N 2.96Å; V159-S161 PolarHBondContact O-OG 2.7Å
162	N	81.7	Confident	86.5	Confident	113 Å²	113	82.1 Å²	82.1	60%	0.604	42%	0.422	S	S	*	.			trans	-80.3	134.2	176.3	-69.3	-39.3	0	0	0	109.9	K156	K156-N162 WeakPolarHBondContact CD-OD1 3.26Å; K156-N162 WeakPolarHBondContact CE-OD1 3.37Å; K156-N162 PolarHBondContact NZ-OD1 3.42Å
163	I	85.5	Confident	86.6	Confident	14 Å²	14	80.5 Å²	80.5	7%	0.072	41%	0.412	C	S	.	.			trans	-116.1	130.1	176	-166	168.9	0	0	0	109.6	F124 P130 V132 V152 Y155 V165	F124-I163 HydrophobicContact CB-CD1 4.13Å; F124-I163 HydrophobicContact CD1-CD1 3.82Å; F124-I163 HydrophobicContact CD2-CD1 4.22Å; F124-I163 HydrophobicContact CE1-CD1 4.25Å; F124-I163 HydrophobicContact CG-CD1 3.82Å; P130-I163 WeakPolarHBondContact O-CA 3.3Å; V132-I163 HydrophobicContact CB-CD1 4.44Å; V132-I163 HydrophobicContact CG2-CD1 3.8Å; V132-I163 HydrophobicContact CG2-CG1 4.06Å; V152-I163 HydrophobicContact CG1-CG2 4.29Å; V152-I163 HydrophobicContact CG2-CG2 4.14Å; Y155-I163 HydrophobicContact CD1-CB 3.91Å; Y155-I163 HydrophobicContact CD1-CD1 4.3Å; Y155-I163 HydrophobicContact CD1-CG2 3.77Å; Y155-I163 HydrophobicContact CE1-CB 3.95Å; Y155-I163 HydrophobicContact CE1-CD1 4.12Å; Y155-I163 HydrophobicContact CE1-CG2 4.33Å; Y155-I163 HydrophobicContact CG-CG2 4.41Å; I163-V165 HydrophobicContact CD1-CG2 4.25Å; I163-V165 HydrophobicContact CG1-CG2 4Å; I163-V165 HydrophobicContact CG2-CG2 4.25Å
164	T	86.7	Confident	86.6	Confident	92 Å²	92	81.3 Å²	81.3	56%	0.564	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.7	112.8	171.3	-51.1	0	0	0	0	108	P130 K131 V132	P130-T164 PolarHBondContact O-N 3.5Å; K131-T164 WeakPolarHBondContact CA-O 3.43Å; V132-T164 PolarHBondContact N-O 2.91Å
165	V	89.1	Confident	86.4	Confident	32 Å²	32	82.8 Å²	82.8	19%	0.194	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	127.3	-177.6	-174.2	0	0	0	0	109.2	F124 V132 I134 V148 V152 I163	F124-V165 HydrophobicContact CE1-CG1 4.35Å; F124-V165 HydrophobicContact CE1-CG2 4.01Å; F124-V165 HydrophobicContact CE2-CG2 4.22Å; F124-V165 HydrophobicContact CZ-CB 4.48Å; F124-V165 HydrophobicContact CZ-CG1 4.06Å; F124-V165 HydrophobicContact CZ-CG2 3.58Å; V132-V165 WeakPolarHBondContact O-CA 3.37Å; I134-V165 HydrophobicContact CD1-CG1 3.52Å; I134-V165 HydrophobicContact CG1-CG1 3.92Å; V148-V165 HydrophobicContact CG1-CB 3.71Å; V148-V165 HydrophobicContact CG1-CG1 3.65Å; V148-V165 HydrophobicContact CG1-CG2 4.1Å; V148-V165 HydrophobicContact CG2-CG1 4.02Å; V152-V165 HydrophobicContact CG2-CG2 4.15Å; I163-V165 HydrophobicContact CD1-CG2 4.25Å; I163-V165 HydrophobicContact CG1-CG2 4Å; I163-V165 HydrophobicContact CG2-CG2 4.25Å
166	R	89.5	Confident	86.2	Confident	164 Å²	164	89.5 Å²	89.5	62%	0.619	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.4	135	171.8	-178	178.3	174.1	-177.5	-3.7	109	V132 T133 I134	V132-R166 PolarHBondContact O-N 3.3Å; T133-R166 CarbonylContact C-O 3.49Å; T133-R166 VanDerWaalsContact CA-O 3.22Å; T133-R166 WeakPolarHBondContact CA-O 3.19Å; I134-R166 PolarHBondContact N-O 2.99Å
167	I	89	Confident	86.1	Confident	15 Å²	15	85.1 Å²	85.1	8%	0.077	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	129.7	168.9	-55.7	-175.9	0	0	0	108	V144 Q145 Q169	V144-I167 HydrophobicContact CG1-CD1 4.12Å; Q145-I167 HydrophobicContact CB-CD1 3.9Å; Q145-I167 HydrophobicContact CG-CD1 4.46Å; I167-Q169 PolarHBondContact O-N 3.42Å
168	D	88.7	Confident	85.8	Confident	15 Å²	15	78.6 Å²	78.6	8%	0.08	41%	0.414	C	S	.	.			trans	-72.2	120.3	174.3	-162.2	-21.3	0	0	0	108.7	T133 I134 R135 D170 H171	T133-D168 HydrophobicContact CG2-CB 3.89Å; I134-D168 PolarHBondContact O-N 3.37Å; R135-D168 HydrophobicContact CG-CB 3.86Å; R135-D168 IonicContact CZ-OD2 3.39Å; R135-D168 IonicContact NE-OD2 2.68Å; R135-D168 PolarHBondContact NE-OD2 3.47Å; R135-D168 IonicContact NH2-OD2 2.63Å; R135-D168 PolarHBondContact NH2-OD2 3.42Å; D168-D170 PolarHBondContact OD1-N 3.36Å; D168-H171 PolarHBondContact OD1-N 2.87Å; D168-H171 IonicContact OD1-ND1 3.73Å; D168-H171 IonicContact OD2-CG 3.98Å; D168-H171 IonicContact OD2-ND1 3.69Å
169	Q	84.3	Confident	85.9	Confident	144 Å²	144	74.6 Å²	74.6	67%	0.673	39%	0.39	S	S	*	.	S	Bend	trans	-101.6	-8	176.9	-65.9	-175.8	2.2	0	0	112.1	I167 F172	I167-Q169 PolarHBondContact O-N 3.42Å; Q169-F172 HydrophobicContact CB-CZ 4.48Å; Q169-F172 WeakPolarHBondContact O-CE2 3.37Å; Q169-F172 WeakPolarHBondContact O-CZ 3.45Å
170	D	83.5	Confident	86.1	Confident	126 Å²	126	72.5 Å²	72.5	67%	0.674	38%	0.377	S	S	*	.	S	Bend	trans	-96	-32.1	-177.7	-58.1	-45.8	0	0	0	110.7	D168	D168-D170 PolarHBondContact OD1-N 3.36Å
171	H	86.5	Confident	86.6	Confident	111 Å²	111	63.7 Å²	63.7	51%	0.514	34%	0.339	S	S	.	.	S	Bend	trans	-125.1	99.9	-179.4	-55.6	84.3	0	0	0	112.1	R135 D168	R135-H171 WeakPolarHBondContact CD-O 3.43Å; D168-H171 PolarHBondContact OD1-N 2.87Å; D168-H171 IonicContact OD1-ND1 3.73Å; D168-H171 IonicContact OD2-CG 3.98Å; D168-H171 IonicContact OD2-ND1 3.69Å
172	F	89.6	Confident	87.2	Confident	73 Å²	73	62.3 Å²	62.3	32%	0.32	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-89.5	158.4	173.4	-63.1	-77	0	0	0	112.3	C136 Q138 V141 Q169	C136-F172 WeakPolarHBondContact O-CA 3.32Å; C136-F172 WeakPolarHBondContact O-CD1 3.24Å; Q138-F172 HydrophobicContact CB-CD1 4.21Å; Q138-F172 HydrophobicContact CB-CG 4.25Å; Q138-F172 HydrophobicContact CG-CZ 4.45Å; V141-F172 HydrophobicContact CG2-CD1 4.34Å; V141-F172 HydrophobicContact CG2-CE1 3.67Å; Q169-F172 HydrophobicContact CB-CZ 4.48Å; Q169-F172 WeakPolarHBondContact O-CE2 3.37Å; Q169-F172 WeakPolarHBondContact O-CZ 3.45Å
173	L	88.8	Confident	87.7	Confident	13 Å²	13	56.9 Å²	56.9	7%	0.068	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-66.7	148.5	168.2	-65	179.6	0	0	0	110.7	R135 C136 I177 E182 T195	R135-L173 HydrophobicContact CB-CD2 4.32Å; R135-L173 HydrophobicContact CB-CG 4.43Å; C136-L173 PolarHBondContact O-N 2.88Å; L173-I177 HydrophobicContact CB-CD1 4.33Å; L173-E182 HydrophobicContact CD1-CG 4.33Å; L173-E182 HydrophobicContact CD2-CB 4.32Å; L173-E182 VanDerWaalsContact CD2-CD 3.42Å; L173-E182 HydrophobicContact CD2-CG 3.74Å; L173-E182 WeakPolarHBondContact CD2-OE2 3.35Å; L173-T195 HydrophobicContact CD1-CG2 4.06Å
174	P	88.7	Confident	88.1	Confident	82 Å²	82	57.5 Å²	57.5	53%	0.532	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-51.9	143.2	174.1	-24.2	31.1	0	0	0	112.2	D176 I177	P174-D176 PolarHBondContact O-N 3.02Å; P174-I177 HydrophobicContact CB-CD1 4.49Å; P174-I177 HydrophobicContact CB-CG1 4.34Å; P174-I177 HydrophobicContact CG-CD1 4.23Å; P174-I177 PolarHBondContact O-N 2.88Å
175	S	82.9	Confident	88.4	Confident	90 Å²	90	53.6 Å²	53.6	63%	0.629	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-15.2	179	56.5	0	0	0	0	114.2	R137 I177	R137-S175 PolarHBondContact NH1-O 2.96Å; R137-S175 PolarHBondContact NH2-O 3.42Å; S175-I177 VanDerWaalsContact C-N 3.26Å
176	D	83.9	Confident	88.3	Confident	145 Å²	145	56.6 Å²	56.6	78%	0.775	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-20.2	178.1	-161.7	29.6	0	0	0	112.1	P174 C178	P174-D176 PolarHBondContact O-N 3.02Å; D176-C178 PolarHBondContact O-N 2.97Å
177	I	84.6	Confident	88.2	Confident	22 Å²	22	54.3 Å²	54.3	11%	0.113	29%	0.289	C	S	.	.	S	Bend	trans	-71.5	133.6	-178.7	-61.5	-177.5	0	0	0	110.2	R137 L173 P174 S175 G179 T195 E197	R137-I177 PolarHBondContact NH1-O 3.37Å; L173-I177 HydrophobicContact CB-CD1 4.33Å; P174-I177 HydrophobicContact CB-CD1 4.49Å; P174-I177 HydrophobicContact CB-CG1 4.34Å; P174-I177 HydrophobicContact CG-CD1 4.23Å; P174-I177 PolarHBondContact O-N 2.88Å; S175-I177 VanDerWaalsContact C-N 3.26Å; I177-G179 PolarHBondContact O-N 3.46Å; I177-T195 HydrophobicContact CG2-CG2 4.43Å; I177-E197 WeakPolarHBondContact CA-OE1 3.32Å
178	C	83.5	Confident	88	Confident	23 Å²	23	55.9 Å²	55.9	16%	0.155	31%	0.309	C	S	.	.			trans	-61.2	-30.4	-179.1	-60.6	0	0	0	0	113.1	A103 A106 D176 E197	A103-C178 HydrophobicContact CB-CB 4.21Å; A106-C178 WeakPolarHBondContact CB-O 3.28Å; D176-C178 PolarHBondContact O-N 2.97Å; C178-E197 PolarHBondContact N-OE1 3.31Å; C178-E197 PolarHBondContact SG-OE1 3.29Å
179	G	87.9	Confident	88	Confident	2 Å²	2	63.8 Å²	63.8	2%	0.021	34%	0.343	C	S	.	.	S	Bend	trans	154.9	-172.9	175.3	0	0	0	0	0	114.1	Y112 I177 L196	Y112-G179 VanDerWaalsContact OH-CA 3.23Å; Y112-G179 WeakPolarHBondContact OH-CA 3.36Å; I177-G179 PolarHBondContact O-N 3.46Å; G179-L196 PolarHBondContact O-N 3.33Å
180	G	89.9	Confident	88.4	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.01	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	98	-166.8	179.5	0	0	0	0	0	113.8	Y112	Y112-G180 PolarHBondContact OH-N 2.96Å
181	V	92.5	Very high	88.9	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	145.2	-169.3	-66	0	0	0	0	111.9	L116 L119 V120 I134 C136 V144 V183 N194	L116-V181 HydrophobicContact CD2-CG1 4.17Å; L119-V181 HydrophobicContact CB-CG2 4.27Å; V120-V181 HydrophobicContact CG2-CG1 4.06Å; V120-V181 HydrophobicContact CG2-CG2 3.93Å; I134-V181 HydrophobicContact CG2-CB 4.05Å; I134-V181 HydrophobicContact CG2-CG1 4.1Å; C136-V181 HydrophobicContact CB-CG1 4.32Å; V144-V181 HydrophobicContact CG1-CG1 4.32Å; V144-V181 HydrophobicContact CG2-CG1 3.87Å; V181-V183 HydrophobicContact CG2-CG2 4.42Å; V181-N194 CarbonylContact O-C 3.23Å; V181-N194 VanDerWaalsContact O-C 3.23Å; V181-N194 WeakPolarHBondContact O-CA 3.41Å; V181-N194 PolarHBondContact O-N 3.44Å
182	E	93.9	Very high	89.2	Confident	31 Å²	31	57 Å²	57	15%	0.145	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	132.1	165.5	-66.5	-172.8	161	0	0	109.5	I134 R135 L173 Y184 V192 T195	I134-E182 WeakPolarHBondContact CA-O 3.2Å; R135-E182 HydrophobicContact CB-CB 4.36Å; R135-E182 PolarHBondContact N-O 2.99Å; R135-E182 PolarHBondContact O-N 3.34Å; L173-E182 HydrophobicContact CD1-CG 4.33Å; L173-E182 HydrophobicContact CD2-CB 4.32Å; L173-E182 VanDerWaalsContact CD2-CD 3.42Å; L173-E182 HydrophobicContact CD2-CG 3.74Å; L173-E182 WeakPolarHBondContact CD2-OE2 3.35Å; E182-Y184 HydrophobicContact CB-CD2 4.38Å; E182-Y184 HydrophobicContact CB-CE2 3.62Å; E182-Y184 WeakPolarHBondContact OE2-CE2 3.32Å; E182-Y184 PolarHBondContact OE2-OH 3.47Å; E182-V192 WeakPolarHBondContact CA-O 3.38Å; E182-T195 HydrophobicContact CG-CG2 3.98Å
183	V	93.3	Very high	89.4	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	123.2	-175.1	-174.7	0	0	0	0	109	F124 L127 V132 I134 V181 K191 V192	F124-V183 HydrophobicContact CD1-CG1 4.45Å; L127-V183 HydrophobicContact CD2-CG1 4.39Å; V132-V183 HydrophobicContact CG1-CG1 3.12Å; I134-V183 HydrophobicContact CG1-CG2 4.44Å; V181-V183 HydrophobicContact CG2-CG2 4.42Å; V183-K191 CarbonylContact O-C 3.55Å; V183-K191 WeakPolarHBondContact O-CA 3.33Å; V183-V192 HydrophobicContact CB-CB 4.38Å; V183-V192 PolarHBondContact N-O 3.2Å; V183-V192 PolarHBondContact O-N 2.95Å
184	Y	93.3	Very high	89.6	Confident	27 Å²	27	55.2 Å²	55.2	11%	0.106	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	146.8	-177.3	-67.8	-97.4	0	0	0	110.8	V132 T133 R135 E182 I190 K191	V132-Y184 WeakPolarHBondContact CA-O 3.43Å; T133-Y184 PolarHBondContact N-O 3.1Å; T133-Y184 PolarHBondContact O-N 2.88Å; R135-Y184 HydrophobicContact CB-CE2 4.11Å; R135-Y184 VanDerWaalsContact CD-CE2 3.49Å; R135-Y184 HydrophobicContact CG-CD2 3.99Å; R135-Y184 HydrophobicContact CG-CE2 3.75Å; R135-Y184 PolarHBondContact NH1-OH 3.43Å; E182-Y184 HydrophobicContact CB-CD2 4.38Å; E182-Y184 HydrophobicContact CB-CE2 3.62Å; E182-Y184 WeakPolarHBondContact OE2-CE2 3.32Å; E182-Y184 PolarHBondContact OE2-OH 3.47Å; Y184-I190 WeakPolarHBondContact CA-O 3.29Å; Y184-K191 HydrophobicContact CD1-CB 3.78Å; Y184-K191 HydrophobicContact CE1-CB 3.61Å; Y184-K191 HydrophobicContact CE1-CD 4.23Å; Y184-K191 HydrophobicContact CG-CB 4.49Å
185	N	92.2	Very high	89.9	Confident	10 Å²	10	51.5 Å²	51.5	5%	0.053	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	167.1	167.2	76.7	-11.3	0	0	0	111.8	L127 E129 N187 G188 K189 I190	L127-N185 HydrophobicContact CD2-CB 4.14Å; E129-N185 HydrophobicContact CG-CB 4.31Å; N185-N187 PolarHBondContact O-N 2.98Å; N185-N187 PolarHBondContact OD1-N 3.15Å; N185-G188 PolarHBondContact O-N 3.42Å; N185-G188 WeakPolarHBondContact OD1-CA 3.35Å; N185-G188 PolarHBondContact OD1-N 2.94Å; N185-K189 PolarHBondContact OD1-N 3.47Å; N185-I190 HydrophobicContact CB-CB 4.25Å; N185-I190 PolarHBondContact N-O 2.87Å; N185-I190 PolarHBondContact OD1-N 3.5Å
186	N	88.9	Confident	90.2	Very high	95 Å²	95	47.9 Å²	47.9	51%	0.508	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-29.4	179.5	-175.3	76.4	0	0	0	114.1	K131	K131-N186 HydrophobicContact CB-CB 3.91Å; K131-N186 PolarHBondContact O-N 2.92Å
187	N	85.9	Confident	90.5	Very high	115 Å²	115	43.2 Å²	43.2	62%	0.615	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-0.3	-176.7	-59.9	-7.1	0	0	0	112.9	N185 K189	N185-N187 PolarHBondContact O-N 2.98Å; N185-N187 PolarHBondContact OD1-N 3.15Å; N187-K189 HydrophobicContact CB-CG 4.37Å; N187-K189 PolarHBondContact O-N 3.4Å; N187-K189 VanDerWaalsContact O-N 3.16Å
188	G	84.8	Confident	90.9	Very high	48 Å²	48	44.3 Å²	44.3	50%	0.495	24%	0.238	S	C	.	.	S	Bend	trans	65.3	9.1	-176.2	0	0	0	0	0	115.8	N185	N185-G188 PolarHBondContact O-N 3.42Å; N185-G188 WeakPolarHBondContact OD1-CA 3.35Å; N185-G188 PolarHBondContact OD1-N 2.94Å
189	K	89.4	Confident	91.3	Very high	182 Å²	182	47.5 Å²	47.5	79%	0.791	25%	0.246	S	C	*	.			trans	-85	-37.8	-176.2	-69.3	-172.2	178.4	-177.1	0	113.3	N185 N187	N185-K189 PolarHBondContact OD1-N 3.47Å; N187-K189 HydrophobicContact CB-CG 4.37Å; N187-K189 PolarHBondContact O-N 3.4Å; N187-K189 VanDerWaalsContact O-N 3.16Å
190	I	92.7	Very high	91.5	Very high	87 Å²	87	48.7 Å²	48.7	45%	0.446	25%	0.252	S	S	.	.			trans	-104.7	125.6	-179.6	-56.5	173.9	0	0	0	107	L127 Y184 N185	L127-I190 HydrophobicContact CD1-CB 4.36Å; L127-I190 HydrophobicContact CD1-CG2 3.79Å; Y184-I190 WeakPolarHBondContact CA-O 3.29Å; N185-I190 HydrophobicContact CB-CB 4.25Å; N185-I190 PolarHBondContact N-O 2.87Å; N185-I190 PolarHBondContact OD1-N 3.5Å
191	K	92.8	Very high	91.6	Very high	137 Å²	137	51.4 Å²	51.4	60%	0.596	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.5	136.1	176.4	73	177.5	-173.7	171.2	0	110.4	V183 Y184	V183-K191 CarbonylContact O-C 3.55Å; V183-K191 WeakPolarHBondContact O-CA 3.33Å; Y184-K191 HydrophobicContact CD1-CB 3.78Å; Y184-K191 HydrophobicContact CE1-CB 3.61Å; Y184-K191 HydrophobicContact CE1-CD 4.23Å; Y184-K191 HydrophobicContact CG-CB 4.49Å
192	V	94.1	Very high	91.6	Very high	14 Å²	14	56 Å²	56	9%	0.085	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	107.9	169.5	177.6	0	0	0	0	106.8	Q126 L127 E182 V183 N194	Q126-V192 HydrophobicContact CB-CG1 4.42Å; Q126-V192 HydrophobicContact CB-CG2 4.32Å; Q126-V192 HydrophobicContact CG-CG1 4.46Å; Q126-V192 HydrophobicContact CG-CG2 4.17Å; Q126-V192 VanDerWaalsContact OE1-CG1 3.31Å; L127-V192 HydrophobicContact CB-CG2 4.5Å; L127-V192 HydrophobicContact CD1-CG2 3.82Å; E182-V192 WeakPolarHBondContact CA-O 3.38Å; V183-V192 HydrophobicContact CB-CB 4.38Å; V183-V192 PolarHBondContact N-O 3.2Å; V183-V192 PolarHBondContact O-N 2.95Å; V192-N194 PolarHBondContact O-N 2.98Å
193	S	93.6	Very high	91.6	Very high	44 Å²	44	57.5 Å²	57.5	31%	0.308	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	107.8	174.6	-175.4	0	0	0	0	109.2	S198	S193-S198 PolarHBondContact OG-OG 3.44Å
194	N	93.8	Very high	91.5	Very high	5 Å²	5	57.9 Å²	57.9	3%	0.027	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	39.6	175.8	-149.6	13.9	0	0	0	110.5	L119 Q122 V181 V192 R199	L119-N194 WeakPolarHBondContact CA-ND2 3.37Å; L119-N194 WeakPolarHBondContact CD2-ND2 3.44Å; L119-N194 PolarHBondContact O-ND2 3.37Å; Q122-N194 PolarHBondContact OE1-ND2 3.02Å; V181-N194 CarbonylContact O-C 3.23Å; V181-N194 VanDerWaalsContact O-C 3.23Å; V181-N194 WeakPolarHBondContact O-CA 3.41Å; V181-N194 PolarHBondContact O-N 3.44Å; V192-N194 PolarHBondContact O-N 2.98Å; N194-R199 WeakPolarHBondContact OD1-CD 3.49Å; N194-R199 PolarHBondContact OD1-NH1 3Å
195	T	93.1	Very high	91.5	Very high	4 Å²	4	63.3 Å²	63.3	3%	0.025	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	153.7	170.8	66	0	0	0	0	110.7	L173 I177 E182 E197 S198 R199	L173-T195 HydrophobicContact CD1-CG2 4.06Å; I177-T195 HydrophobicContact CG2-CG2 4.43Å; E182-T195 HydrophobicContact CG-CG2 3.98Å; T195-E197 PolarHBondContact O-N 3.17Å; T195-S198 PolarHBondContact O-N 2.95Å; T195-S198 WeakPolarHBondContact OG1-CB 3.31Å; T195-S198 PolarHBondContact OG1-N 3.43Å; T195-S198 PolarHBondContact OG1-OG 3.26Å; T195-R199 WeakPolarHBondContact O-CG 3.41Å; T195-R199 PolarHBondContact O-N 3.47Å; T195-R199 VanDerWaalsContact O-N 3.09Å
196	L	90.9	Very high	91.6	Very high	14 Å²	14	69.4 Å²	69.4	7%	0.073	36%	0.359	C	S	.	.	H	α-helix	trans	-60.8	-36.3	-178.7	-63.7	178.1	0	0	0	112.3	I102 Y112 L115 L119 G179 R199 L200	I102-L196 HydrophobicContact CG2-CB 3.76Å; I102-L196 HydrophobicContact CG2-CD1 3.71Å; I102-L196 HydrophobicContact CG2-CG 4.21Å; Y112-L196 HydrophobicContact CE2-CD1 4.23Å; L115-L196 HydrophobicContact CD2-CD2 3.71Å; L119-L196 HydrophobicContact CD1-CD2 4.03Å; G179-L196 PolarHBondContact O-N 3.33Å; L196-R199 PolarHBondContact O-N 2.92Å; L196-L200 WeakPolarHBondContact O-CB 3.25Å; L196-L200 PolarHBondContact O-N 2.62Å
197	E	90	Very high	91.8	Very high	46 Å²	46	68.7 Å²	68.7	22%	0.215	35%	0.354	C	S	.	.	H	α-helix	trans	-65.5	-47.4	174.9	-75.4	159.8	-153.1	0	0	112.4	I177 C178 T195 R199 L200 D201	I177-E197 WeakPolarHBondContact CA-OE1 3.32Å; C178-E197 PolarHBondContact N-OE1 3.31Å; C178-E197 PolarHBondContact SG-OE1 3.29Å; T195-E197 PolarHBondContact O-N 3.17Å; E197-R199 PolarHBondContact O-N 3.43Å; E197-L200 PolarHBondContact O-N 2.87Å; E197-L200 VanDerWaalsContact O-N 3.16Å; E197-D201 PolarHBondContact O-N 3.34Å
198	S	92.3	Very high	92	Very high	45 Å²	45	66.4 Å²	66.4	32%	0.315	34%	0.34	S	S	.	.	H	α-helix	trans	-59.7	-38.3	178.9	-58.7	0	0	0	0	111.3	S193 T195 L202	S193-S198 PolarHBondContact OG-OG 3.44Å; T195-S198 PolarHBondContact O-N 2.95Å; T195-S198 WeakPolarHBondContact OG1-CB 3.31Å; T195-S198 PolarHBondContact OG1-N 3.43Å; T195-S198 PolarHBondContact OG1-OG 3.26Å; S198-L202 WeakPolarHBondContact O-CB 3.49Å; S198-L202 PolarHBondContact O-N 3.45Å
199	R	92.1	Very high	92.4	Very high	91 Å²	91	68.2 Å²	68.2	34%	0.343	34%	0.343	S	S	.	.	H	α-helix	trans	-68.8	-44.6	176.5	-68.2	-171.4	72.2	84.8	-0.2	112.3	N194 T195 L196 E197 D201 L202 V203	N194-R199 WeakPolarHBondContact OD1-CD 3.49Å; N194-R199 PolarHBondContact OD1-NH1 3Å; T195-R199 WeakPolarHBondContact O-CG 3.41Å; T195-R199 PolarHBondContact O-N 3.47Å; T195-R199 VanDerWaalsContact O-N 3.09Å; L196-R199 PolarHBondContact O-N 2.92Å; E197-R199 PolarHBondContact O-N 3.43Å; R199-D201 VanDerWaalsContact C-N 3.3Å; R199-D201 PolarHBondContact O-N 2.91Å; R199-L202 PolarHBondContact O-N 2.94Å; R199-V203 WeakPolarHBondContact O-CG2 3.41Å; R199-V203 PolarHBondContact O-N 3.39Å
200	L	91.6	Very high	92.6	Very high	26 Å²	26	64.8 Å²	64.8	14%	0.136	33%	0.33	C	S	.	.	H	α-helix	trans	-59.5	-45.8	176.5	178.6	67.7	0	0	0	110.4	A98 R99 I102 L196 E197 L202 V203 A204	A98-L200 HydrophobicContact CB-CD1 4.21Å; A98-L200 HydrophobicContact CB-CD2 4.27Å; R99-L200 HydrophobicContact CB-CD2 4.28Å; R99-L200 HydrophobicContact CG-CD2 3.28Å; I102-L200 HydrophobicContact CD1-CB 4.16Å; I102-L200 HydrophobicContact CD1-CD1 3.89Å; I102-L200 HydrophobicContact CD1-CD2 4.08Å; I102-L200 HydrophobicContact CD1-CG 4.26Å; L196-L200 WeakPolarHBondContact O-CB 3.25Å; L196-L200 PolarHBondContact O-N 2.62Å; E197-L200 PolarHBondContact O-N 2.87Å; E197-L200 VanDerWaalsContact O-N 3.16Å; L200-L202 VanDerWaalsContact C-N 3.34Å; L200-L202 PolarHBondContact O-N 2.87Å; L200-V203 PolarHBondContact O-N 2.8Å; L200-A204 WeakPolarHBondContact O-CB 3.38Å; L200-A204 PolarHBondContact O-N 3.49Å
201	D	91.9	Very high	92.5	Very high	58 Å²	58	62.2 Å²	62.2	31%	0.31	32%	0.317	S	S	.	.	H	α-helix	trans	-64.3	-40.1	-179.7	-71.3	-10.8	0	0	0	111.5	R99 E197 R199 Q205	R99-D201 IonicContact CZ-OD1 3.28Å; R99-D201 IonicContact NE-OD1 3.38Å; R99-D201 IonicContact NH2-OD1 2.69Å; R99-D201 PolarHBondContact NH2-OD1 3.22Å; R99-D201 IonicContact NH2-OD2 2.67Å; R99-D201 PolarHBondContact NH2-OD2 2.95Å; E197-D201 PolarHBondContact O-N 3.34Å; R199-D201 VanDerWaalsContact C-N 3.3Å; R199-D201 PolarHBondContact O-N 2.91Å; D201-Q205 WeakPolarHBondContact O-CB 3.44Å; D201-Q205 VanDerWaalsContact O-CG 3.29Å; D201-Q205 WeakPolarHBondContact O-CG 3.33Å; D201-Q205 PolarHBondContact O-N 3.02Å
202	L	93.2	Very high	92.5	Very high	96 Å²	96	62.6 Å²	62.6	50%	0.503	31%	0.314	S	S	.	.	H	α-helix	trans	-62.3	-47.8	175.4	-176.7	68.9	0	0	0	111.9	S198 R199 L200 Q205 Q206	S198-L202 WeakPolarHBondContact O-CB 3.49Å; S198-L202 PolarHBondContact O-N 3.45Å; R199-L202 PolarHBondContact O-N 2.94Å; L200-L202 VanDerWaalsContact C-N 3.34Å; L200-L202 PolarHBondContact O-N 2.87Å; L202-Q205 PolarHBondContact O-N 2.95Å; L202-Q206 WeakPolarHBondContact O-CG 3.24Å; L202-Q206 PolarHBondContact O-N 3Å
203	V	93	Very high	92.4	Very high	63 Å²	63	66 Å²	66	38%	0.382	33%	0.329	S	S	.	.	H	α-helix	trans	-67.6	-42.3	179.1	173.4	0	0	0	0	110.5	R199 L200 Q205 Q206 M207	R199-V203 WeakPolarHBondContact O-CG2 3.41Å; R199-V203 PolarHBondContact O-N 3.39Å; L200-V203 PolarHBondContact O-N 2.8Å; V203-Q205 VanDerWaalsContact C-N 3.32Å; V203-Q205 PolarHBondContact O-N 3.46Å; V203-Q206 PolarHBondContact O-N 3.29Å; V203-Q206 VanDerWaalsContact O-N 3.16Å; V203-M207 HydrophobicContact CG1-CG 3.98Å; V203-M207 HydrophobicContact CG1-SD 3.6Å; V203-M207 VanDerWaalsContact CG1-SD 3.6Å; V203-M207 WeakPolarHBondContact O-CB 3.31Å; V203-M207 WeakPolarHBondContact O-CG 3.3Å; V203-M207 PolarHBondContact O-N 2.95Å
204	A	92.5	Very high	92.4	Very high	8 Å²	8	69.7 Å²	69.7	7%	0.066	35%	0.35	C	S	.	.	H	α-helix	trans	-56.3	-47.6	176.8	0	0	0	0	0	110.6	L95 L200 Q206 M207 M208	L95-A204 HydrophobicContact CD1-CB 4.2Å; L95-A204 HydrophobicContact CD2-CB 3.57Å; L200-A204 WeakPolarHBondContact O-CB 3.38Å; L200-A204 PolarHBondContact O-N 3.49Å; A204-Q206 VanDerWaalsContact C-N 3.33Å; A204-Q206 PolarHBondContact O-N 3.38Å; A204-M207 CarbonylContact O-C 3.31Å; A204-M207 PolarHBondContact O-N 3.4Å; A204-M208 WeakPolarHBondContact O-CA 3.43Å; A204-M208 WeakPolarHBondContact O-CG 3.24Å; A204-M208 PolarHBondContact O-N 2.98Å
205	Q	92.3	Very high	92.3	Very high	142 Å²	142	73.4 Å²	73.4	66%	0.664	37%	0.37	S	S	*	.	H	α-helix	trans	-59.2	-41.3	177.4	-75.9	178.7	6.8	0	0	113	D201 L202 V203	D201-Q205 WeakPolarHBondContact O-CB 3.44Å; D201-Q205 VanDerWaalsContact O-CG 3.29Å; D201-Q205 WeakPolarHBondContact O-CG 3.33Å; D201-Q205 PolarHBondContact O-N 3.02Å; L202-Q205 PolarHBondContact O-N 2.95Å; V203-Q205 VanDerWaalsContact C-N 3.32Å; V203-Q205 PolarHBondContact O-N 3.46Å
206	Q	93.7	Very high	92.2	Very high	138 Å²	138	78 Å²	78	65%	0.645	39%	0.39	S	S	*	.	H	α-helix	trans	-71.4	-40.1	178.9	-68.9	177.6	-1.1	0	0	112.1	L202 V203 A204 P209	L202-Q206 WeakPolarHBondContact O-CG 3.24Å; L202-Q206 PolarHBondContact O-N 3Å; V203-Q206 PolarHBondContact O-N 3.29Å; V203-Q206 VanDerWaalsContact O-N 3.16Å; A204-Q206 VanDerWaalsContact C-N 3.33Å; A204-Q206 PolarHBondContact O-N 3.38Å; Q206-P209 WeakPolarHBondContact O-CD 3.36Å
207	M	93.9	Very high	92.3	Very high	79 Å²	79	79.2 Å²	79.2	39%	0.389	41%	0.405	S	S	.	.	H	α-helix	trans	-86.8	-3	-178.4	-62.9	-167.7	76.8	0	0	113.5	V203 A204 P209 E210 I211	V203-M207 HydrophobicContact CG1-CG 3.98Å; V203-M207 HydrophobicContact CG1-SD 3.6Å; V203-M207 VanDerWaalsContact CG1-SD 3.6Å; V203-M207 WeakPolarHBondContact O-CB 3.31Å; V203-M207 WeakPolarHBondContact O-CG 3.3Å; V203-M207 PolarHBondContact O-N 2.95Å; A204-M207 CarbonylContact O-C 3.31Å; A204-M207 PolarHBondContact O-N 3.4Å; M207-P209 VanDerWaalsContact C-N 3.29Å; M207-P209 VanDerWaalsContact O-N 3.17Å; M207-E210 WeakPolarHBondContact CE-OE2 3.49Å; M207-E210 WeakPolarHBondContact O-CB 3.44Å; M207-E210 PolarHBondContact O-N 3.36Å; M207-I211 HydrophobicContact CB-CD1 4.15Å; M207-I211 HydrophobicContact CB-CG1 4.36Å; M207-I211 WeakPolarHBondContact O-CG1 3.49Å; M207-I211 PolarHBondContact O-N 2.86Å
208	M	91.3	Very high	92.5	Very high	68 Å²	68	80.7 Å²	80.7	34%	0.335	42%	0.421	S	S	.	.	H	α-helix	trans	-48.5	-42.2	179.1	-88.3	-45.3	-61.8	0	0	114.1	V91 A204 I211 R212	V91-M208 HydrophobicContact CG1-CE 3.83Å; V91-M208 HydrophobicContact CG1-SD 3.99Å; A204-M208 WeakPolarHBondContact O-CA 3.43Å; A204-M208 WeakPolarHBondContact O-CG 3.24Å; A204-M208 PolarHBondContact O-N 2.98Å; M208-I211 HydrophobicContact SD-CD1 4.45Å; M208-R212 WeakPolarHBondContact O-CB 3.43Å; M208-R212 PolarHBondContact O-N 2.95Å
209	P	92.4	Very high	92.5	Very high	85 Å²	85	82.1 Å²	82.1	55%	0.552	43%	0.425	S	S	*	.	H	α-helix	trans	-60.6	-44.1	176.2	-23.8	35.7	0	0	0	112.8	Q206 M207 R212 E213	Q206-P209 WeakPolarHBondContact O-CD 3.36Å; M207-P209 VanDerWaalsContact C-N 3.29Å; M207-P209 VanDerWaalsContact O-N 3.17Å; P209-R212 PolarHBondContact O-N 2.86Å; P209-E213 WeakPolarHBondContact O-CB 3.43Å; P209-E213 PolarHBondContact O-N 3.43Å
210	E	92.9	Very high	92.5	Very high	111 Å²	111	83.4 Å²	83.4	52%	0.519	45%	0.445	S	S	.	.	H	α-helix	trans	-69.7	-42	179.6	-62.4	176.1	-166.9	0	0	111.4	M207 R212 E213 T214	M207-E210 WeakPolarHBondContact CE-OE2 3.49Å; M207-E210 WeakPolarHBondContact O-CB 3.44Å; M207-E210 PolarHBondContact O-N 3.36Å; E210-R212 VanDerWaalsContact C-N 3.31Å; E210-R212 PolarHBondContact O-N 3.16Å; E210-E213 PolarHBondContact O-N 3.45Å; E210-T214 WeakPolarHBondContact O-CB 3.34Å; E210-T214 PolarHBondContact O-N 2.87Å; E210-T214 PolarHBondContact O-OG1 3.31Å
211	I	92	Very high	92.7	Very high	32 Å²	32	88.7 Å²	88.7	16%	0.164	47%	0.473	C	S	.	.	H	α-helix	trans	-58.6	-46	174.3	-66.5	168.1	0	0	0	109.7	M207 M208 T214 L215	M207-I211 HydrophobicContact CB-CD1 4.15Å; M207-I211 HydrophobicContact CB-CG1 4.36Å; M207-I211 WeakPolarHBondContact O-CG1 3.49Å; M207-I211 PolarHBondContact O-N 2.86Å; M208-I211 HydrophobicContact SD-CD1 4.45Å; I211-T214 PolarHBondContact O-N 3.26Å; I211-L215 HydrophobicContact CG2-CD1 3.66Å; I211-L215 HydrophobicContact CG2-CG 4.29Å; I211-L215 WeakPolarHBondContact O-CB 3.28Å; I211-L215 VanDerWaalsContact O-CG 3.27Å; I211-L215 WeakPolarHBondContact O-CG 3.43Å; I211-L215 PolarHBondContact O-N 3.04Å
212	R	91.9	Very high	92.6	Very high	145 Å²	145	92.8 Å²	92.8	55%	0.547	48%	0.484	S	S	.	.	H	α-helix	trans	-61.2	-47.1	177.7	176.3	-178	173.2	-105.1	-5.9	111.6	M208 P209 E210 T214 F216	M208-R212 WeakPolarHBondContact O-CB 3.43Å; M208-R212 PolarHBondContact O-N 2.95Å; P209-R212 PolarHBondContact O-N 2.86Å; E210-R212 VanDerWaalsContact C-N 3.31Å; E210-R212 PolarHBondContact O-N 3.16Å; R212-T214 VanDerWaalsContact C-N 3.34Å; R212-F216 HydrophobicContact CG-CD2 4.17Å; R212-F216 WeakPolarHBondContact O-CB 3.45Å; R212-F216 PolarHBondContact O-N 3.06Å
213	E	92.6	Very high	92.4	Very high	86 Å²	86	98.5 Å²	98.5	40%	0.402	50%	0.499	S	S	.	.	H	α-helix	trans	-63.9	-40.2	-179.8	179.3	160.2	-161.9	0	0	112	P209 E210 G217 S218	P209-E213 WeakPolarHBondContact O-CB 3.43Å; P209-E213 PolarHBondContact O-N 3.43Å; E210-E213 PolarHBondContact O-N 3.45Å; E213-G217 CarbonylContact O-C 3.56Å; E213-G217 VanDerWaalsContact O-C 3.31Å; E213-G217 WeakPolarHBondContact O-CA 3.45Å; E213-G217 PolarHBondContact O-N 3.49Å; E213-S218 WeakPolarHBondContact CG-OG 3.38Å; E213-S218 VanDerWaalsContact OE1-CB 3.25Å; E213-S218 WeakPolarHBondContact OE1-CB 3.48Å; E213-S218 PolarHBondContact OE1-OG 3.26Å
214	T	92.3	Very high	92.3	Very high	122 Å²	122	102.3 Å²	102.3	75%	0.748	51%	0.511	S	S	*	.	H	α-helix	trans	-69.4	-41.7	179	-53	0	0	0	0	112.2	E210 I211 R212	E210-T214 WeakPolarHBondContact O-CB 3.34Å; E210-T214 PolarHBondContact O-N 2.87Å; E210-T214 PolarHBondContact O-OG1 3.31Å; I211-T214 PolarHBondContact O-N 3.26Å; R212-T214 VanDerWaalsContact C-N 3.34Å
215	L	91.7	Very high	92	Very high	82 Å²	82	108.5 Å²	108.5	43%	0.429	54%	0.542	S	S	.	.	H	α-helix	trans	-79.2	-40.1	-177.6	-68.9	176.2	0	0	0	113.4	V91 L94 I211	V91-L215 HydrophobicContact CG2-CD1 4.22Å; L94-L215 HydrophobicContact CD1-CD1 4.03Å; L94-L215 HydrophobicContact CD1-CD2 4.09Å; I211-L215 HydrophobicContact CG2-CD1 3.66Å; I211-L215 HydrophobicContact CG2-CG 4.29Å; I211-L215 WeakPolarHBondContact O-CB 3.28Å; I211-L215 VanDerWaalsContact O-CG 3.27Å; I211-L215 WeakPolarHBondContact O-CG 3.43Å; I211-L215 PolarHBondContact O-N 3.04Å
216	F	92.1	Very high	91.4	Very high	101 Å²	101	111.3 Å²	111.3	44%	0.443	56%	0.562	S	S	.	*	H	α-helix	trans	-116.1	-0.1	-169.4	-55	-65.7	0	0	0	113.7	V91 R212	V91-F216 HydrophobicContact CG2-CE2 4.08Å; V91-F216 HydrophobicContact CG2-CZ 4.47Å; R212-F216 HydrophobicContact CG-CD2 4.17Å; R212-F216 WeakPolarHBondContact O-CB 3.45Å; R212-F216 PolarHBondContact O-N 3.06Å
217	G	93.2	Very high	91.3	Very high	39 Å²	39	110 Å²	110	40%	0.402	56%	0.558	S	S	.	*			trans	85.8	159.3	-178.4	0	0	0	0	0	113.9	E213	E213-G217 CarbonylContact O-C 3.56Å; E213-G217 VanDerWaalsContact O-C 3.31Å; E213-G217 WeakPolarHBondContact O-CA 3.45Å; E213-G217 PolarHBondContact O-N 3.49Å
218	S	92.6	Very high	91.1	Very high	77 Å²	77	111.6 Å²	111.6	54%	0.538	57%	0.566	S	S	.	*			trans	-65.9	149.8	175.1	-47.3	0	0	0	0	111.4	E213 P220	E213-S218 WeakPolarHBondContact CG-OG 3.38Å; E213-S218 VanDerWaalsContact OE1-CB 3.25Å; E213-S218 WeakPolarHBondContact OE1-CB 3.48Å; E213-S218 PolarHBondContact OE1-OG 3.26Å; S218-P220 VanDerWaalsContact O-CD 3.28Å; S218-P220 WeakPolarHBondContact O-CD 3.39Å
219	N	92.7	Very high	91.1	Very high	76 Å²	76	114 Å²	114	41%	0.406	58%	0.579	S	S	.	*			trans	-74.7	115.2	175.1	-178.8	-0.4	0	0	0	110.1	N221 R222	N219-N221 PolarHBondContact O-N 2.97Å; N219-N221 VanDerWaalsContact O-N 3.1Å; N219-N221 WeakPolarHBondContact OD1-CB 3.35Å; N219-N221 PolarHBondContact OD1-N 3.3Å; N219-R222 HydrophobicContact CB-CB 4.13Å; N219-R222 PolarHBondContact O-N 2.82Å
220	P	93.5	Very high	91	Very high	118 Å²	118	115.7 Å²	115.7	77%	0.766	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	-19.3	-178.5	27.3	-36	0	0	0	113.3	S218	S218-P220 VanDerWaalsContact O-CD 3.28Å; S218-P220 WeakPolarHBondContact O-CD 3.39Å
221	N	94.2	Very high	90.9	Very high	136 Å²	136	116 Å²	116	73%	0.727	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-9.7	178.5	-63	-36.6	0	0	0	113.3	N219 R223	N219-N221 PolarHBondContact O-N 2.97Å; N219-N221 VanDerWaalsContact O-N 3.1Å; N219-N221 WeakPolarHBondContact OD1-CB 3.35Å; N219-N221 PolarHBondContact OD1-N 3.3Å; N221-R223 PolarHBondContact O-N 2.65Å
222	R	91.6	Very high	90.9	Very high	144 Å²	144	121.6 Å²	121.6	54%	0.543	61%	0.613	S	S	.	*			trans	-82.3	112.3	177	-173	-179.6	-173.5	-172.1	1.5	108.8	N219 F224	N219-R222 HydrophobicContact CB-CB 4.13Å; N219-R222 PolarHBondContact O-N 2.82Å; R222-F224 WeakPolarHBondContact CG-O 3.42Å; R222-F224 PolarHBondContact NE-O 3.39Å
223	R	88.1	Confident	90.8	Very high	216 Å²	216	119.9 Å²	119.9	82%	0.815	62%	0.618	S	S	*	*			trans	-99.3	-20.8	-178.6	-64.8	-174.8	-179.5	-173.4	-0.4	114.3	N221	N221-R223 PolarHBondContact O-N 2.65Å
224	F	91.4	Very high	90.6	Very high	143 Å²	143	122.5 Å²	122.5	63%	0.627	63%	0.634	S	S	*	*			trans	-131.4	143.7	-168.3	-62.2	-66.1	0	0	0	109.5	R222 D226	R222-F224 WeakPolarHBondContact CG-O 3.42Å; R222-F224 PolarHBondContact NE-O 3.39Å; F224-D226 WeakPolarHBondContact CA-OD1 3.45Å; F224-D226 VanDerWaalsContact CB-OD1 3.23Å; F224-D226 WeakPolarHBondContact CB-OD1 3.45Å
225	L	86.1	Confident	90.5	Very high	138 Å²	138	122.6 Å²	122.6	72%	0.723	63%	0.625	S	S	*	*			trans	-117.5	-2.9	-179.4	-63.4	-178.1	0	0	0	112.6
226	D	78.9	Confident	90.4	Very high	201 Å²	201	126.3 Å²	126.3	100%	1.075	64%	0.642	S	S	*	*			trans	-66.7	0	176	26.2	-50	0	0	0	113.5	F224	F224-D226 WeakPolarHBondContact CA-OD1 3.45Å; F224-D226 VanDerWaalsContact CB-OD1 3.23Å; F224-D226 WeakPolarHBondContact CB-OD1 3.45Å

Retrieved 226 of 226 residues in 145.6 ms (Link to these results)

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