A0A087XTB4_POEFO Loading...

Hexosyltransferase

AlphaFold DB , UniProt , Accession A0A087XTB4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 537 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	38.2	Very low	49.2	Very low	240 Å²	240	158.3 Å²	158.3	100%	1.182	79%	0.787	S	S	*	*				0	120.3	0	-77.4	-178.2	167.1	0	0	108.7
2	P	41.2	Very low	50.9	Low	131 Å²	131	151.8 Å²	151.8	85%	0.851	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-82.5	133.8	-177.9	32.7	-29.2	0	0	0	110.2
3	R	41.7	Very low	52.4	Low	252 Å²	252	154.1 Å²	154.1	95%	0.951	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-85.3	123.5	173.6	-81.1	-175.7	174	179.2	-1.3	109.6
4	R	47.3	Very low	54.1	Low	241 Å²	241	156.9 Å²	156.9	91%	0.909	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-56.9	124.9	179.9	-71.4	168.6	169.4	168.8	-4.6	111.7
5	G	42.3	Very low	55.8	Low	74 Å²	74	154.3 Å²	154.3	76%	0.763	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-80.2	132.6	162.8	0	0	0	0	0	110.6
6	F	47.9	Very low	57.2	Low	175 Å²	175	151.6 Å²	151.6	77%	0.768	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-69.7	136.6	-178.6	-80.1	-96.5	0	0	0	112.1	L8	F6-L8 HydrophobicContact CD1-CD1 4.3Å; F6-L8 PolarHBondContact O-N 3.25Å
7	P	51.7	Low	58.7	Low	109 Å²	109	148.1 Å²	148.1	71%	0.708	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	18.8	-176.7	35.5	-35.5	0	0	0	114
8	L	53.5	Low	60.2	Low	123 Å²	123	142.9 Å²	142.9	64%	0.644	71%	0.706	S	S	*	*	H	α-helix	trans	-80.4	-21.6	-173.7	-94.7	115	0	0	0	114.3	F6	F6-L8 HydrophobicContact CD1-CD1 4.3Å; F6-L8 PolarHBondContact O-N 3.25Å
9	Q	57.7	Low	61.6	Low	157 Å²	157	141.2 Å²	141.2	73%	0.734	70%	0.699	S	S	*	*	H	α-helix	trans	-73.5	-27	-179.1	-111.6	178.5	-18.3	0	0	113.7	R13	Q9-R13 WeakPolarHBondContact O-CB 3.32Å; Q9-R13 PolarHBondContact O-N 3.02Å
10	G	58.2	Low	62.9	Low	37 Å²	37	140.9 Å²	140.9	38%	0.381	69%	0.693	S	S	.	*	H	α-helix	trans	-70.2	-47.9	-179.4	0	0	0	0	0	112.4	V12 R13 W14	G10-V12 PolarHBondContact O-N 3.1Å; G10-R13 PolarHBondContact O-N 3.23Å; G10-W14 PolarHBondContact O-N 3.3Å
11	R	61.8	Low	64.1	Low	202 Å²	202	138.8 Å²	138.8	76%	0.762	68%	0.684	S	S	*	*	H	α-helix	trans	-66.4	-37.8	-176.9	-75.3	-175.2	176	-179.9	-1.4	112.9	W14 L15	R11-W14 PolarHBondContact O-N 3.42Å; R11-L15 WeakPolarHBondContact O-CG 3.28Å; R11-L15 PolarHBondContact O-N 3Å
12	V	69.4	Low	66.4	Low	81 Å²	81	132.3 Å²	132.3	49%	0.491	65%	0.654	S	S	.	*	H	α-helix	trans	-68.8	-38.7	176.6	179.6	0	0	0	0	111	G10 L15 L16	G10-V12 PolarHBondContact O-N 3.1Å; V12-L15 PolarHBondContact O-N 2.98Å; V12-L16 HydrophobicContact CG1-CD1 3.97Å; V12-L16 HydrophobicContact CG1-CG 4.48Å; V12-L16 WeakPolarHBondContact O-CB 3.31Å; V12-L16 WeakPolarHBondContact O-CG 3.32Å; V12-L16 PolarHBondContact O-N 3.41Å
13	R	70.1	Confident	68.4	Low	181 Å²	181	130.7 Å²	130.7	68%	0.683	64%	0.638	S	S	*	*	H	α-helix	trans	-62.5	-42.4	172.9	-88.3	-178	165.8	-175.9	-3.7	112.5	Q9 G10 L16 L17	Q9-R13 WeakPolarHBondContact O-CB 3.32Å; Q9-R13 PolarHBondContact O-N 3.02Å; G10-R13 PolarHBondContact O-N 3.23Å; R13-L16 PolarHBondContact O-N 3.01Å; R13-L17 WeakPolarHBondContact O-CB 3.38Å; R13-L17 PolarHBondContact O-N 3.35Å
14	W	76.9	Confident	70.6	Confident	193 Å²	193	121.5 Å²	121.5	73%	0.731	61%	0.609	S	S	*	*	H	α-helix	trans	-66.8	-36.6	176.8	-79.3	110.2	0	0	0	112.8	G10 R11 A18	G10-W14 PolarHBondContact O-N 3.3Å; R11-W14 PolarHBondContact O-N 3.42Å; W14-A18 VanDerWaalsContact O-CB 3.29Å; W14-A18 WeakPolarHBondContact O-CB 3.45Å; W14-A18 PolarHBondContact O-N 3.46Å
15	L	79.4	Confident	72.4	Confident	119 Å²	119	115.6 Å²	115.6	62%	0.623	60%	0.595	S	S	*	*	H	α-helix	trans	-66.1	-43.4	173.8	-81.7	160.3	0	0	0	112	R11 V12 A18 L19	R11-L15 WeakPolarHBondContact O-CG 3.28Å; R11-L15 PolarHBondContact O-N 3Å; V12-L15 PolarHBondContact O-N 2.98Å; L15-A18 PolarHBondContact O-N 3.47Å; L15-L19 WeakPolarHBondContact O-CB 3.33Å; L15-L19 PolarHBondContact O-N 2.93Å
16	L	78.5	Confident	74.3	Confident	111 Å²	111	117.4 Å²	117.4	58%	0.581	59%	0.587	S	S	*	*	H	α-helix	trans	-66.9	-38.3	176.6	-71.4	166.9	0	0	0	112	V12 R13 L19 F20	V12-L16 HydrophobicContact CG1-CD1 3.97Å; V12-L16 HydrophobicContact CG1-CG 4.48Å; V12-L16 WeakPolarHBondContact O-CB 3.31Å; V12-L16 WeakPolarHBondContact O-CG 3.32Å; V12-L16 PolarHBondContact O-N 3.41Å; R13-L16 PolarHBondContact O-N 3.01Å; L16-L19 PolarHBondContact O-N 3Å; L16-F20 VanDerWaalsContact O-CB 3.27Å; L16-F20 WeakPolarHBondContact O-CB 3.34Å; L16-F20 PolarHBondContact O-N 3.49Å
17	L	82.4	Confident	75.8	Confident	91 Å²	91	114 Å²	114	48%	0.476	58%	0.576	S	S	.	*	H	α-helix	trans	-64.3	-42.1	173	-105.9	142	0	0	0	112	R13 F20 L21	R13-L17 WeakPolarHBondContact O-CB 3.38Å; R13-L17 PolarHBondContact O-N 3.35Å; L17-F20 PolarHBondContact O-N 2.92Å; L17-L21 WeakPolarHBondContact O-CB 3.39Å; L17-L21 WeakPolarHBondContact O-CG 3.31Å; L17-L21 PolarHBondContact O-N 3.47Å
18	A	84.6	Confident	77	Confident	56 Å²	56	114.9 Å²	114.9	46%	0.463	57%	0.569	S	S	.	*	H	α-helix	trans	-65.6	-41.2	176.6	0	0	0	0	0	111.6	W14 L15 L21 L22	W14-A18 VanDerWaalsContact O-CB 3.29Å; W14-A18 WeakPolarHBondContact O-CB 3.45Å; W14-A18 PolarHBondContact O-N 3.46Å; L15-A18 PolarHBondContact O-N 3.47Å; A18-L21 PolarHBondContact O-N 3.42Å; A18-L22 WeakPolarHBondContact O-CB 3.31Å; A18-L22 PolarHBondContact O-N 2.92Å
19	L	87.8	Confident	78.1	Confident	109 Å²	109	111.2 Å²	111.2	57%	0.571	56%	0.557	S	S	*	*	H	α-helix	trans	-67.1	-39.5	177.4	-150.9	109.9	0	0	0	111.6	L15 L16 L22 L23	L15-L19 WeakPolarHBondContact O-CB 3.33Å; L15-L19 PolarHBondContact O-N 2.93Å; L16-L19 PolarHBondContact O-N 3Å; L19-L22 PolarHBondContact O-N 2.93Å; L19-L23 HydrophobicContact CD2-CD1 4.28Å; L19-L23 WeakPolarHBondContact O-CB 3.47Å; L19-L23 PolarHBondContact O-N 3.2Å
20	F	87.3	Confident	79	Confident	136 Å²	136	110.9 Å²	110.9	60%	0.596	55%	0.55	S	S	*	.	H	α-helix	trans	-64.7	-45	174.3	-178.2	-99.2	0	0	0	111.6	L16 L17 L22 L23 V24	L16-F20 VanDerWaalsContact O-CB 3.27Å; L16-F20 WeakPolarHBondContact O-CB 3.34Å; L16-F20 PolarHBondContact O-N 3.49Å; L17-F20 PolarHBondContact O-N 2.92Å; F20-L22 VanDerWaalsContact C-N 3.32Å; F20-L22 PolarHBondContact O-N 3.2Å; F20-L23 PolarHBondContact O-N 2.87Å; F20-V24 HydrophobicContact CD1-CG2 4.16Å; F20-V24 HydrophobicContact CE1-CG2 3.8Å; F20-V24 HydrophobicContact CE2-CG2 4.41Å; F20-V24 HydrophobicContact CZ-CG2 3.94Å; F20-V24 VanDerWaalsContact O-CG2 3.3Å; F20-V24 WeakPolarHBondContact O-CG2 3.49Å; F20-V24 PolarHBondContact O-N 2.86Å
21	L	87.4	Confident	79.7	Confident	96 Å²	96	113.3 Å²	113.3	50%	0.503	55%	0.554	S	S	.	*	H	α-helix	trans	-62.4	-38.1	175.1	-85.9	158.5	0	0	0	112.3	L17 A18 V24 L25	L17-L21 WeakPolarHBondContact O-CB 3.39Å; L17-L21 WeakPolarHBondContact O-CG 3.31Å; L17-L21 PolarHBondContact O-N 3.47Å; A18-L21 PolarHBondContact O-N 3.42Å; L21-V24 PolarHBondContact O-N 3.41Å; L21-L25 WeakPolarHBondContact O-CB 3.38Å; L21-L25 WeakPolarHBondContact O-CG 3.49Å; L21-L25 PolarHBondContact O-N 2.84Å
22	L	87.5	Confident	80	Confident	104 Å²	104	109.4 Å²	109.4	55%	0.545	55%	0.547	S	S	.	.	H	α-helix	trans	-64.5	-44.2	175	-166.1	95.6	0	0	0	111.4	A18 L19 F20 L25 L26	A18-L22 WeakPolarHBondContact O-CB 3.31Å; A18-L22 PolarHBondContact O-N 2.92Å; L19-L22 PolarHBondContact O-N 2.93Å; F20-L22 VanDerWaalsContact C-N 3.32Å; F20-L22 PolarHBondContact O-N 3.2Å; L22-L25 PolarHBondContact O-N 3.19Å; L22-L26 HydrophobicContact CD2-CD1 4.29Å; L22-L26 HydrophobicContact CG-CD1 4.39Å; L22-L26 WeakPolarHBondContact O-CB 3.35Å; L22-L26 WeakPolarHBondContact O-CG 3.4Å; L22-L26 PolarHBondContact O-N 3.48Å
23	L	83.8	Confident	79.9	Confident	98 Å²	98	113.6 Å²	113.6	51%	0.513	56%	0.561	S	S	.	*	H	α-helix	trans	-62.7	-42.5	175.3	-97.1	151.6	0	0	0	111.8	L19 F20 L26 L27	L19-L23 HydrophobicContact CD2-CD1 4.28Å; L19-L23 WeakPolarHBondContact O-CB 3.47Å; L19-L23 PolarHBondContact O-N 3.2Å; F20-L23 PolarHBondContact O-N 2.87Å; L23-L26 PolarHBondContact O-N 3.41Å; L23-L27 WeakPolarHBondContact O-CB 3.31Å; L23-L27 PolarHBondContact O-N 3.47Å
24	V	87.3	Confident	79.1	Confident	58 Å²	58	108.6 Å²	108.6	35%	0.352	55%	0.553	S	S	.	*	H	α-helix	trans	-64.1	-40.7	175.5	171.3	0	0	0	0	111.1	F20 L21 L27 F28	F20-V24 HydrophobicContact CD1-CG2 4.16Å; F20-V24 HydrophobicContact CE1-CG2 3.8Å; F20-V24 HydrophobicContact CE2-CG2 4.41Å; F20-V24 HydrophobicContact CZ-CG2 3.94Å; F20-V24 VanDerWaalsContact O-CG2 3.3Å; F20-V24 WeakPolarHBondContact O-CG2 3.49Å; F20-V24 PolarHBondContact O-N 2.86Å; L21-V24 PolarHBondContact O-N 3.41Å; V24-L27 PolarHBondContact O-N 3.16Å; V24-F28 WeakPolarHBondContact O-CB 3.45Å; V24-F28 PolarHBondContact O-N 3.39Å
25	L	84.6	Confident	77.9	Confident	118 Å²	118	103.7 Å²	103.7	62%	0.618	54%	0.544	S	S	*	.	H	α-helix	trans	-65.1	-40.8	175.6	-83.6	161.3	0	0	0	112.4	L21 L22 L27 F28 A29	L21-L25 WeakPolarHBondContact O-CB 3.38Å; L21-L25 WeakPolarHBondContact O-CG 3.49Å; L21-L25 PolarHBondContact O-N 2.84Å; L22-L25 PolarHBondContact O-N 3.19Å; L25-L27 VanDerWaalsContact C-N 3.34Å; L25-F28 PolarHBondContact O-N 3.02Å; L25-A29 WeakPolarHBondContact O-CB 3.45Å; L25-A29 PolarHBondContact O-N 3.19Å
26	L	82.2	Confident	76.5	Confident	111 Å²	111	103.3 Å²	103.3	58%	0.581	55%	0.549	S	S	*	.	H	α-helix	trans	-65.4	-38.3	174.4	-75.2	166.2	0	0	0	111.6	L22 L23 A29 Y30	L22-L26 HydrophobicContact CD2-CD1 4.29Å; L22-L26 HydrophobicContact CG-CD1 4.39Å; L22-L26 WeakPolarHBondContact O-CB 3.35Å; L22-L26 WeakPolarHBondContact O-CG 3.4Å; L22-L26 PolarHBondContact O-N 3.48Å; L23-L26 PolarHBondContact O-N 3.41Å; L26-A29 PolarHBondContact O-N 2.9Å; L26-Y30 VanDerWaalsContact O-CB 3.32Å; L26-Y30 WeakPolarHBondContact O-CB 3.43Å; L26-Y30 PolarHBondContact O-N 3.36Å
27	L	79.1	Confident	74.8	Confident	105 Å²	105	103.4 Å²	103.4	55%	0.55	56%	0.557	S	S	.	*	H	α-helix	trans	-68.8	-37.7	175.6	-135.3	133.9	0	0	0	111.5	L23 V24 L25 L31	L23-L27 WeakPolarHBondContact O-CB 3.31Å; L23-L27 PolarHBondContact O-N 3.47Å; V24-L27 PolarHBondContact O-N 3.16Å; L25-L27 VanDerWaalsContact C-N 3.34Å; L27-L31 HydrophobicContact CD2-CD1 3.98Å; L27-L31 WeakPolarHBondContact O-CB 3.4Å; L27-L31 WeakPolarHBondContact O-CG 3.35Å; L27-L31 PolarHBondContact O-N 3.48Å
28	F	78.3	Confident	73	Confident	127 Å²	127	103.7 Å²	103.7	56%	0.557	57%	0.572	S	S	*	*	H	α-helix	trans	-68.3	-39.4	174	-123	-86.4	0	0	0	112.1	V24 L25 L31 L32	V24-F28 WeakPolarHBondContact O-CB 3.45Å; V24-F28 PolarHBondContact O-N 3.39Å; L25-F28 PolarHBondContact O-N 3.02Å; F28-L31 PolarHBondContact O-N 3.01Å; F28-L32 HydrophobicContact CD1-CD1 4.09Å; F28-L32 WeakPolarHBondContact O-CB 3.34Å; F28-L32 WeakPolarHBondContact O-CD1 3.42Å; F28-L32 WeakPolarHBondContact O-CG 3.44Å; F28-L32 PolarHBondContact O-N 3.49Å
29	A	76.3	Confident	71.1	Confident	46 Å²	46	109 Å²	109	38%	0.38	59%	0.593	S	S	.	*	H	α-helix	trans	-65.5	-43.2	174.7	0	0	0	0	0	111.3	L25 L26 L31 L32 E33	L25-A29 WeakPolarHBondContact O-CB 3.45Å; L25-A29 PolarHBondContact O-N 3.19Å; L26-A29 PolarHBondContact O-N 2.9Å; A29-L31 PolarHBondContact O-N 3.17Å; A29-L32 PolarHBondContact O-N 3.46Å; A29-E33 WeakPolarHBondContact O-CB 3.25Å; A29-E33 PolarHBondContact O-N 2.91Å
30	Y	75.9	Confident	68.6	Low	150 Å²	150	107.9 Å²	107.9	59%	0.588	60%	0.599	S	S	*	*	H	α-helix	trans	-61.8	-42	173.4	-177.7	-98.7	0	0	0	111.9	L26 E33 C34	L26-Y30 VanDerWaalsContact O-CB 3.32Å; L26-Y30 WeakPolarHBondContact O-CB 3.43Å; L26-Y30 PolarHBondContact O-N 3.36Å; Y30-E33 PolarHBondContact O-N 2.89Å; Y30-C34 VanDerWaalsContact O-CB 3.23Å; Y30-C34 WeakPolarHBondContact O-CB 3.39Å; Y30-C34 PolarHBondContact O-N 3.26Å
31	L	72.8	Confident	66.2	Low	88 Å²	88	106.8 Å²	106.8	46%	0.461	61%	0.608	S	S	.	*	H	α-helix	trans	-68	-35.1	174.9	-73	168.8	0	0	0	112.2	L27 F28 A29 C34 T35	L27-L31 HydrophobicContact CD2-CD1 3.98Å; L27-L31 WeakPolarHBondContact O-CB 3.4Å; L27-L31 WeakPolarHBondContact O-CG 3.35Å; L27-L31 PolarHBondContact O-N 3.48Å; F28-L31 PolarHBondContact O-N 3.01Å; A29-L31 PolarHBondContact O-N 3.17Å; L31-C34 CarbonylContact O-C 3.59Å; L31-C34 PolarHBondContact O-N 3.02Å; L31-T35 WeakPolarHBondContact O-CB 3.46Å; L31-T35 WeakPolarHBondContact O-CG2 3.49Å; L31-T35 PolarHBondContact O-N 2.95Å; L31-T35 PolarHBondContact O-OG1 2.86Å; L31-T35 VanDerWaalsContact O-OG1 3.12Å
32	L	69.1	Low	64.2	Low	119 Å²	119	111.4 Å²	111.4	62%	0.623	63%	0.627	S	S	*	*	H	α-helix	trans	-70.5	-33.6	174.4	-80.9	158.7	0	0	0	112.6	F28 A29 T35	F28-L32 HydrophobicContact CD1-CD1 4.09Å; F28-L32 WeakPolarHBondContact O-CB 3.34Å; F28-L32 WeakPolarHBondContact O-CD1 3.42Å; F28-L32 WeakPolarHBondContact O-CG 3.44Å; F28-L32 PolarHBondContact O-N 3.49Å; A29-L32 PolarHBondContact O-N 3.46Å; L32-T35 PolarHBondContact O-OG1 3.05Å
33	E	66.2	Low	61.5	Low	170 Å²	170	113 Å²	113	79%	0.794	64%	0.642	S	S	*	*	H	α-helix	trans	-77.5	-21.5	172.8	-77.1	178.9	168.2	0	0	112.6	A29 Y30	A29-E33 WeakPolarHBondContact O-CB 3.25Å; A29-E33 PolarHBondContact O-N 2.91Å; Y30-E33 PolarHBondContact O-N 2.89Å
34	C	52.7	Low	59.1	Low	75 Å²	75	116.3 Å²	116.3	51%	0.507	66%	0.659	S	S	.	*	H	α-helix	trans	-111.8	8.8	179.5	-70	0	0	0	0	115	Y30 L31 P36	Y30-C34 VanDerWaalsContact O-CB 3.23Å; Y30-C34 WeakPolarHBondContact O-CB 3.39Å; Y30-C34 PolarHBondContact O-N 3.26Å; L31-C34 CarbonylContact O-C 3.59Å; L31-C34 PolarHBondContact O-N 3.02Å; C34-P36 VanDerWaalsContact O-CD 3.27Å; C34-P36 WeakPolarHBondContact O-CD 3.29Å
35	T	52.9	Low	56.6	Low	90 Å²	90	119.9 Å²	119.9	55%	0.552	68%	0.683	S	S	*	*			trans	-79.6	115	170.3	35.7	0	0	0	0	110	L31 L32	L31-T35 WeakPolarHBondContact O-CB 3.46Å; L31-T35 WeakPolarHBondContact O-CG2 3.49Å; L31-T35 PolarHBondContact O-N 2.95Å; L31-T35 PolarHBondContact O-OG1 2.86Å; L31-T35 VanDerWaalsContact O-OG1 3.12Å; L32-T35 PolarHBondContact O-OG1 3.05Å
36	P	49.3	Very low	54.1	Low	111 Å²	111	117.4 Å²	117.4	72%	0.721	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-68.1	143.1	169.1	29.2	-31.7	0	0	0	109.1	C34 A38	C34-P36 VanDerWaalsContact O-CD 3.27Å; C34-P36 WeakPolarHBondContact O-CD 3.29Å; P36-A38 PolarHBondContact O-N 3.46Å
37	P	43	Very low	51.8	Low	114 Å²	114	118.9 Å²	118.9	74%	0.74	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-62.7	129	175.9	25	-31.1	0	0	0	109.9
38	A	45.8	Very low	49.8	Very low	97 Å²	97	120.7 Å²	120.7	80%	0.802	72%	0.715	S	S	*	*	S	Bend	trans	-71.1	131.2	166.9	0	0	0	0	0	108.6	P36	P36-A38 PolarHBondContact O-N 3.46Å
39	D	43.5	Very low	48	Very low	168 Å²	168	117.8 Å²	117.8	90%	0.898	72%	0.72	S	S	*	*			trans	75.5	75.7	-174.5	-63.9	-19.5	0	0	0	116.9
40	A	35.5	Very low	46.3	Very low	84 Å²	84	123.8 Å²	123.8	69%	0.694	74%	0.741	S	S	*	*			trans	-131.6	94.4	151.1	0	0	0	0	0	109.1	Q42	A40-Q42 PolarHBondContact O-N 2.94Å
41	S	37.9	Very low	44.7	Very low	114 Å²	114	122 Å²	122	80%	0.797	75%	0.748	S	S	*	*			trans	-54.5	122.9	159.2	36.2	0	0	0	0	109.1	T43	S41-T43 PolarHBondContact O-N 3.44Å; S41-T43 VanDerWaalsContact O-N 3.09Å
42	Q	45.4	Very low	43.5	Very low	193 Å²	193	124.4 Å²	124.4	90%	0.902	76%	0.755	S	S	*	*	S	Bend	trans	-18.2	99.9	171.1	-65.8	171.4	-12.7	0	0	115.1	A40	A40-Q42 PolarHBondContact O-N 2.94Å
43	T	30.4	Very low	42.8	Very low	138 Å²	138	124.1 Å²	124.1	85%	0.847	75%	0.754	S	S	*	*			trans	-148.9	120.8	155.5	39	0	0	0	0	109.9	S41	S41-T43 PolarHBondContact O-N 3.44Å; S41-T43 VanDerWaalsContact O-N 3.09Å
44	L	32.9	Very low	42.5	Very low	166 Å²	166	125.5 Å²	125.5	87%	0.869	75%	0.752	S	S	*	*			trans	-70	158.3	171	-90.8	123.5	0	0	0	110.8	G46	L44-G46 PolarHBondContact O-N 2.96Å
45	P	33.9	Very low	43.2	Very low	133 Å²	133	128.4 Å²	128.4	86%	0.864	76%	0.758	S	S	*	*			trans	-72	98.1	-177.5	29.7	-30.5	0	0	0	110.1
46	G	32.1	Very low	44	Very low	67 Å²	67	128.9 Å²	128.9	69%	0.691	75%	0.75	S	S	*	*			trans	-116.1	134	170.3	0	0	0	0	0	109.9	L44	L44-G46 PolarHBondContact O-N 2.96Å
47	V	34.5	Very low	45	Very low	142 Å²	142	131.1 Å²	131.1	86%	0.861	75%	0.745	S	S	*	*			trans	-31.4	140.4	168.3	175.5	0	0	0	0	113.3	G49	V47-G49 PolarHBondContact O-N 3.31Å
48	V	37.5	Very low	46.6	Very low	143 Å²	143	130.5 Å²	130.5	87%	0.867	73%	0.732	S	S	*	*	S	Bend	trans	-42.2	118.4	168.9	174.1	0	0	0	0	111.7
49	G	40.4	Very low	48.1	Very low	65 Å²	65	129.8 Å²	129.8	67%	0.67	72%	0.718	S	S	*	*	S	Bend	trans	75.6	97.1	150.4	0	0	0	0	0	118.5	V47	V47-G49 PolarHBondContact O-N 3.31Å
50	E	40.7	Very low	49.9	Very low	172 Å²	172	125.2 Å²	125.2	80%	0.804	69%	0.693	S	S	*	*				168.3	153.1	127.1	-95.3	-167.2	174.3	0	0	110.8	F52	E50-F52 PolarHBondContact O-N 2.86Å; E50-F52 VanDerWaalsContact O-N 3.08Å
51	P	42.4	Very low	51.9	Low	114 Å²	114	126.6 Å²	126.6	74%	0.74	69%	0.688	S	S	*	*			trans	-74.1	102.5	-176.3	30.3	-31	0	0	0	109.7	N53	P51-N53 PolarHBondContact O-N 2.9Å
52	F	46.3	Very low	54.2	Low	138 Å²	138	126.4 Å²	126.4	61%	0.605	68%	0.675	S	S	*	*			trans	-70.5	98.5	176	-87.2	-68.7	0	0	0	110.9	E50 Y56	E50-F52 PolarHBondContact O-N 2.86Å; E50-F52 VanDerWaalsContact O-N 3.08Å; F52-Y56 HydrophobicContact CB-CD1 4.06Å; F52-Y56 HydrophobicContact CB-CG 4.24Å; F52-Y56 AromaticContact CD1-CD1 3.7Å; F52-Y56 HydrophobicContact CD1-CD1 3.7Å; F52-Y56 AromaticContact CD1-CD2 3.37Å; F52-Y56 HydrophobicContact CD1-CD2 3.37Å; F52-Y56 HydrophobicContact CD1-CE1 4.28Å; F52-Y56 AromaticContact CD1-CE2 4Å; F52-Y56 HydrophobicContact CD1-CE2 4Å; F52-Y56 AromaticContact CD1-CG 3.19Å; F52-Y56 HydrophobicContact CD1-CG 3.19Å; F52-Y56 HydrophobicContact CE1-CD1 4.26Å; F52-Y56 AromaticContact CE1-CD2 3.21Å; F52-Y56 HydrophobicContact CE1-CD2 3.21Å; F52-Y56 AromaticContact CE1-CE2 3.55Å; F52-Y56 HydrophobicContact CE1-CE2 3.55Å; F52-Y56 AromaticContact CE1-CG 3.61Å; F52-Y56 HydrophobicContact CE1-CG 3.61Å; F52-Y56 AromaticContact CG-CD1 3.92Å; F52-Y56 HydrophobicContact CG-CD1 3.92Å; F52-Y56 HydrophobicContact CG-CD2 4.33Å; F52-Y56 HydrophobicContact CG-CE1 4.36Å; F52-Y56 AromaticContact CG-CG 3.89Å; F52-Y56 HydrophobicContact CG-CG 3.89Å; F52-Y56 HydrophobicContact CZ-CD2 4.12Å; F52-Y56 AromaticContact CZ-CE2 4Å; F52-Y56 HydrophobicContact CZ-CE2 4Å
53	N	55.9	Low	56	Low	113 Å²	113	121.6 Å²	121.6	60%	0.604	65%	0.652	S	S	*	*			trans	-58.1	156.5	173.1	-99.5	-29.7	0	0	0	111.9	P51 E55 Y56	P51-N53 PolarHBondContact O-N 2.9Å; N53-E55 PolarHBondContact O-N 3.17Å; N53-Y56 WeakPolarHBondContact O-CB 3.34Å; N53-Y56 PolarHBondContact O-N 3.33Å
54	R	58.9	Low	58.3	Low	199 Å²	199	119.4 Å²	119.4	75%	0.751	63%	0.633	S	S	*	*	H	α-helix	trans	-38.1	-30.2	167.8	175.1	176.5	157.5	-177.8	-4.1	114.6	Q58	R54-Q58 WeakPolarHBondContact O-CG 3.37Å; R54-Q58 PolarHBondContact O-N 3.38Å
55	E	67.6	Low	60.7	Low	135 Å²	135	117.5 Å²	117.5	63%	0.631	62%	0.619	S	S	*	*	H	α-helix	trans	-60.1	-40.2	173.8	-71.8	176	164.6	0	0	113	N53 Y57 Q58 T59	N53-E55 PolarHBondContact O-N 3.17Å; E55-Y57 PolarHBondContact O-N 3.19Å; E55-Q58 CarbonylContact O-C 3.45Å; E55-Q58 WeakPolarHBondContact O-CA 3.3Å; E55-Q58 WeakPolarHBondContact O-CB 3.4Å; E55-Q58 PolarHBondContact O-N 3.26Å; E55-Q58 VanDerWaalsContact O-N 3.13Å; E55-T59 PolarHBondContact O-N 3.36Å; E55-T59 PolarHBondContact O-OG1 3.3Å
56	Y	69.8	Low	63.3	Low	101 Å²	101	116.5 Å²	116.5	40%	0.396	60%	0.603	S	S	.	*	H	α-helix	trans	-66	-39.6	179.9	176.8	-105.4	0	0	0	113.5	F52 N53 Q58 T59 L60	F52-Y56 HydrophobicContact CB-CD1 4.06Å; F52-Y56 HydrophobicContact CB-CG 4.24Å; F52-Y56 AromaticContact CD1-CD1 3.7Å; F52-Y56 HydrophobicContact CD1-CD1 3.7Å; F52-Y56 AromaticContact CD1-CD2 3.37Å; F52-Y56 HydrophobicContact CD1-CD2 3.37Å; F52-Y56 HydrophobicContact CD1-CE1 4.28Å; F52-Y56 AromaticContact CD1-CE2 4Å; F52-Y56 HydrophobicContact CD1-CE2 4Å; F52-Y56 AromaticContact CD1-CG 3.19Å; F52-Y56 HydrophobicContact CD1-CG 3.19Å; F52-Y56 HydrophobicContact CE1-CD1 4.26Å; F52-Y56 AromaticContact CE1-CD2 3.21Å; F52-Y56 HydrophobicContact CE1-CD2 3.21Å; F52-Y56 AromaticContact CE1-CE2 3.55Å; F52-Y56 HydrophobicContact CE1-CE2 3.55Å; F52-Y56 AromaticContact CE1-CG 3.61Å; F52-Y56 HydrophobicContact CE1-CG 3.61Å; F52-Y56 AromaticContact CG-CD1 3.92Å; F52-Y56 HydrophobicContact CG-CD1 3.92Å; F52-Y56 HydrophobicContact CG-CD2 4.33Å; F52-Y56 HydrophobicContact CG-CE1 4.36Å; F52-Y56 AromaticContact CG-CG 3.89Å; F52-Y56 HydrophobicContact CG-CG 3.89Å; F52-Y56 HydrophobicContact CZ-CD2 4.12Å; F52-Y56 AromaticContact CZ-CE2 4Å; F52-Y56 HydrophobicContact CZ-CE2 4Å; N53-Y56 WeakPolarHBondContact O-CB 3.34Å; N53-Y56 PolarHBondContact O-N 3.33Å; Y56-Q58 VanDerWaalsContact C-N 3.3Å; Y56-T59 PolarHBondContact O-N 2.92Å; Y56-L60 HydrophobicContact CD1-CD1 3.99Å; Y56-L60 HydrophobicContact CE1-CD1 3.41Å; Y56-L60 VanDerWaalsContact CE1-CD1 3.41Å; Y56-L60 HydrophobicContact CE2-CD1 4.29Å; Y56-L60 PolarHBondContact O-N 3.39Å
57	Y	69.6	Low	65.6	Low	157 Å²	157	118.8 Å²	118.8	62%	0.616	59%	0.591	S	S	*	*	H	α-helix	trans	-66.2	-35.1	173	-72.9	-77.8	0	0	0	111.5	E55 L60 L61	E55-Y57 PolarHBondContact O-N 3.19Å; Y57-L60 PolarHBondContact O-N 2.94Å; Y57-L61 WeakPolarHBondContact O-CB 3.5Å; Y57-L61 WeakPolarHBondContact O-CG 3.41Å; Y57-L61 PolarHBondContact O-N 2.86Å
58	Q	77.4	Confident	67.8	Low	101 Å²	101	116.3 Å²	116.3	47%	0.472	57%	0.57	S	S	.	*	H	α-helix	trans	-66.6	-40.7	172.5	-72.5	178.4	-50.4	0	0	111.6	R54 E55 Y56 L60 L61 Q62	R54-Q58 WeakPolarHBondContact O-CG 3.37Å; R54-Q58 PolarHBondContact O-N 3.38Å; E55-Q58 CarbonylContact O-C 3.45Å; E55-Q58 WeakPolarHBondContact O-CA 3.3Å; E55-Q58 WeakPolarHBondContact O-CB 3.4Å; E55-Q58 PolarHBondContact O-N 3.26Å; E55-Q58 VanDerWaalsContact O-N 3.13Å; Y56-Q58 VanDerWaalsContact C-N 3.3Å; Q58-L60 PolarHBondContact O-N 2.87Å; Q58-L61 PolarHBondContact O-N 2.84Å; Q58-Q62 WeakPolarHBondContact O-CB 3.42Å; Q58-Q62 PolarHBondContact O-N 2.84Å
59	T	78.3	Confident	70.2	Confident	82 Å²	82	115 Å²	115	50%	0.503	56%	0.557	S	S	.	*	H	α-helix	trans	-63.9	-40.8	175.9	-35.5	0	0	0	0	111.7	E55 Y56 Q62 E63	E55-T59 PolarHBondContact O-N 3.36Å; E55-T59 PolarHBondContact O-OG1 3.3Å; Y56-T59 PolarHBondContact O-N 2.92Å; T59-Q62 PolarHBondContact O-N 2.96Å; T59-E63 WeakPolarHBondContact O-CB 3.23Å; T59-E63 PolarHBondContact O-N 3.36Å
60	L	79.6	Confident	72.3	Confident	72 Å²	72	115.8 Å²	115.8	38%	0.377	55%	0.552	S	S	.	*	H	α-helix	trans	-65.2	-40	176.1	-105.1	155.7	0	0	0	112.9	Y56 Y57 Q58 H64	Y56-L60 HydrophobicContact CD1-CD1 3.99Å; Y56-L60 HydrophobicContact CE1-CD1 3.41Å; Y56-L60 VanDerWaalsContact CE1-CD1 3.41Å; Y56-L60 HydrophobicContact CE2-CD1 4.29Å; Y56-L60 PolarHBondContact O-N 3.39Å; Y57-L60 PolarHBondContact O-N 2.94Å; Q58-L60 PolarHBondContact O-N 2.87Å; L60-H64 WeakPolarHBondContact O-CB 3.4Å; L60-H64 PolarHBondContact O-N 2.81Å
61	L	77.3	Confident	74.4	Confident	113 Å²	113	114.8 Å²	114.8	59%	0.592	54%	0.541	S	S	*	.	H	α-helix	trans	-64.3	-45.7	174.1	-83.5	161.9	0	0	0	111	Y57 Q58 E63 H64 E65	Y57-L61 WeakPolarHBondContact O-CB 3.5Å; Y57-L61 WeakPolarHBondContact O-CG 3.41Å; Y57-L61 PolarHBondContact O-N 2.86Å; Q58-L61 PolarHBondContact O-N 2.84Å; L61-E63 VanDerWaalsContact C-N 3.33Å; L61-E63 PolarHBondContact O-N 3.48Å; L61-H64 WeakPolarHBondContact O-CB 3.46Å; L61-H64 PolarHBondContact O-N 3.37Å; L61-H64 VanDerWaalsContact O-N 3.15Å; L61-E65 PolarHBondContact O-N 3.49Å
62	Q	86.8	Confident	76.3	Confident	111 Å²	111	112.8 Å²	112.8	52%	0.519	53%	0.526	S	S	.	.	H	α-helix	trans	-63.2	-40.3	178.1	-170.2	174.3	-15.8	0	0	111.6	Q58 T59 H64 E65 E66	Q58-Q62 WeakPolarHBondContact O-CB 3.42Å; Q58-Q62 PolarHBondContact O-N 2.84Å; T59-Q62 PolarHBondContact O-N 2.96Å; Q62-H64 VanDerWaalsContact C-N 3.3Å; Q62-H64 PolarHBondContact O-N 3.43Å; Q62-E65 PolarHBondContact O-N 2.86Å; Q62-E66 WeakPolarHBondContact O-CB 3.47Å; Q62-E66 WeakPolarHBondContact O-CG 3.44Å; Q62-E66 PolarHBondContact O-N 2.92Å
63	E	84.1	Confident	78.3	Confident	91 Å²	91	114.2 Å²	114.2	43%	0.425	53%	0.529	S	S	.	.	H	α-helix	trans	-65.4	-34.7	175.6	-157	-167.2	150.1	0	0	111.7	T59 L61 R67	T59-E63 WeakPolarHBondContact O-CB 3.23Å; T59-E63 PolarHBondContact O-N 3.36Å; L61-E63 VanDerWaalsContact C-N 3.33Å; L61-E63 PolarHBondContact O-N 3.48Å; E63-R67 WeakPolarHBondContact O-CG 3.28Å; E63-R67 PolarHBondContact O-N 3.48Å; E63-R67 IonicContact OE1-CZ 3.62Å; E63-R67 IonicContact OE1-NE 3.67Å; E63-R67 IonicContact OE1-NH2 2.74Å; E63-R67 PolarHBondContact OE1-NH2 3.27Å; E63-R67 IonicContact OE2-NH2 3.6Å
64	H	77.7	Confident	79.8	Confident	93 Å²	93	111.5 Å²	111.5	43%	0.431	52%	0.519	S	S	.	.	H	α-helix	trans	-70.2	-43.3	174.9	-153.4	148.1	0	0	0	111.4	L60 L61 Q62 E66 R67 H68	L60-H64 WeakPolarHBondContact O-CB 3.4Å; L60-H64 PolarHBondContact O-N 2.81Å; L61-H64 WeakPolarHBondContact O-CB 3.46Å; L61-H64 PolarHBondContact O-N 3.37Å; L61-H64 VanDerWaalsContact O-N 3.15Å; Q62-H64 VanDerWaalsContact C-N 3.3Å; Q62-H64 PolarHBondContact O-N 3.43Å; H64-E66 VanDerWaalsContact C-N 3.34Å; H64-E66 PolarHBondContact O-N 3.18Å; H64-R67 PolarHBondContact O-N 3.26Å; H64-H68 AromaticContact CD2-CD2 3.22Å; H64-H68 PolarHBondContact CD2-CD2 2.86Å; H64-H68 AromaticContact CD2-NE2 3.05Å; H64-H68 PolarHBondContact CD2-NE2 3.43Å; H64-H68 AromaticContact NE2-CD2 3.74Å; H64-H68 AromaticContact NE2-CE1 3.81Å; H64-H68 AromaticContact NE2-NE2 3.01Å; H64-H68 PolarHBondContact NE2-NE2 3.4Å; H64-H68 PolarHBondContact O-CD2 2.96Å; H64-H68 VanDerWaalsContact O-CD2 3.24Å; H64-H68 PolarHBondContact O-N 3.21Å
65	E	84.8	Confident	80.9	Confident	126 Å²	126	106.6 Å²	106.6	59%	0.589	51%	0.507	S	S	*	.	H	α-helix	trans	-60.2	-43.4	173.9	-76.1	-178.2	169.3	0	0	111.6	L61 Q62 R67 H68 L69	L61-E65 PolarHBondContact O-N 3.49Å; Q62-E65 PolarHBondContact O-N 2.86Å; E65-R67 PolarHBondContact O-N 3.04Å; E65-H68 PolarHBondContact O-N 3.44Å; E65-L69 WeakPolarHBondContact O-CB 3.3Å; E65-L69 VanDerWaalsContact O-CG 3.3Å; E65-L69 WeakPolarHBondContact O-CG 3.3Å; E65-L69 PolarHBondContact O-N 2.95Å
66	E	86.8	Confident	81.8	Confident	112 Å²	112	107 Å²	107	52%	0.523	51%	0.507	S	S	.	.	H	α-helix	trans	-63	-39.5	176	-77.6	-178.9	-175.6	0	0	112.2	Q62 H64 L69 S70	Q62-E66 WeakPolarHBondContact O-CB 3.47Å; Q62-E66 WeakPolarHBondContact O-CG 3.44Å; Q62-E66 PolarHBondContact O-N 2.92Å; H64-E66 VanDerWaalsContact C-N 3.34Å; H64-E66 PolarHBondContact O-N 3.18Å; E66-L69 PolarHBondContact O-N 2.81Å; E66-S70 VanDerWaalsContact O-CB 3.23Å; E66-S70 WeakPolarHBondContact O-CB 3.32Å; E66-S70 PolarHBondContact O-N 3.45Å
67	R	80.3	Confident	82.8	Confident	114 Å²	114	110.5 Å²	110.5	43%	0.43	52%	0.519	S	S	.	.	H	α-helix	trans	-64.5	-40.1	173.5	-74.3	-176	-137.5	144.3	-1.5	112.1	E63 H64 E65 S70 R71	E63-R67 WeakPolarHBondContact O-CG 3.28Å; E63-R67 PolarHBondContact O-N 3.48Å; E63-R67 IonicContact OE1-CZ 3.62Å; E63-R67 IonicContact OE1-NE 3.67Å; E63-R67 IonicContact OE1-NH2 2.74Å; E63-R67 PolarHBondContact OE1-NH2 3.27Å; E63-R67 IonicContact OE2-NH2 3.6Å; H64-R67 PolarHBondContact O-N 3.26Å; E65-R67 PolarHBondContact O-N 3.04Å; R67-S70 PolarHBondContact O-N 3.19Å; R67-R71 WeakPolarHBondContact O-CG 3.37Å; R67-R71 PolarHBondContact O-N 3.44Å
68	H	81.1	Confident	83.5	Confident	90 Å²	90	107.8 Å²	107.8	42%	0.417	51%	0.513	S	S	.	.	H	α-helix	trans	-66.7	-45.1	175.7	-79	-55.2	0	0	0	111.7	H64 E65 S70 R71 V72	H64-H68 AromaticContact CD2-CD2 3.22Å; H64-H68 PolarHBondContact CD2-CD2 2.86Å; H64-H68 AromaticContact CD2-NE2 3.05Å; H64-H68 PolarHBondContact CD2-NE2 3.43Å; H64-H68 AromaticContact NE2-CD2 3.74Å; H64-H68 AromaticContact NE2-CE1 3.81Å; H64-H68 AromaticContact NE2-NE2 3.01Å; H64-H68 PolarHBondContact NE2-NE2 3.4Å; H64-H68 PolarHBondContact O-CD2 2.96Å; H64-H68 VanDerWaalsContact O-CD2 3.24Å; H64-H68 PolarHBondContact O-N 3.21Å; E65-H68 PolarHBondContact O-N 3.44Å; H68-S70 VanDerWaalsContact C-N 3.3Å; H68-S70 PolarHBondContact O-N 2.95Å; H68-R71 PolarHBondContact O-N 3.27Å; H68-V72 WeakPolarHBondContact O-CB 3.33Å; H68-V72 VanDerWaalsContact O-CG2 3.3Å; H68-V72 WeakPolarHBondContact O-CG2 3.4Å; H68-V72 PolarHBondContact O-N 3.04Å
69	L	87.8	Confident	83.9	Confident	117 Å²	117	107.3 Å²	107.3	61%	0.613	51%	0.512	S	S	*	.	H	α-helix	trans	-61.1	-40.3	176	-72.9	171.4	0	0	0	111.6	E65 E66 V72 Y73	E65-L69 WeakPolarHBondContact O-CB 3.3Å; E65-L69 VanDerWaalsContact O-CG 3.3Å; E65-L69 WeakPolarHBondContact O-CG 3.3Å; E65-L69 PolarHBondContact O-N 2.95Å; E66-L69 PolarHBondContact O-N 2.81Å; L69-V72 PolarHBondContact O-N 2.88Å; L69-Y73 WeakPolarHBondContact O-CB 3.47Å; L69-Y73 PolarHBondContact O-N 3.31Å
70	S	85.6	Confident	84.3	Confident	80 Å²	80	106.3 Å²	106.3	56%	0.559	51%	0.512	S	S	*	.	H	α-helix	trans	-63.6	-42.7	174.6	-176.2	0	0	0	0	112	E66 R67 H68 Y73 S74	E66-S70 VanDerWaalsContact O-CB 3.23Å; E66-S70 WeakPolarHBondContact O-CB 3.32Å; E66-S70 PolarHBondContact O-N 3.45Å; R67-S70 PolarHBondContact O-N 3.19Å; H68-S70 VanDerWaalsContact C-N 3.3Å; H68-S70 PolarHBondContact O-N 2.95Å; S70-Y73 PolarHBondContact O-N 3.24Å; S70-S74 WeakPolarHBondContact O-CB 3.24Å; S70-S74 PolarHBondContact O-N 3.42Å
71	R	83.5	Confident	84.7	Confident	152 Å²	152	107.7 Å²	107.7	57%	0.574	52%	0.517	S	S	*	.	H	α-helix	trans	-63.2	-45.2	173.1	-77.2	178.2	-178.9	156.1	-1.7	112.1	R67 H68 Y73 S74 L75	R67-R71 WeakPolarHBondContact O-CG 3.37Å; R67-R71 PolarHBondContact O-N 3.44Å; H68-R71 PolarHBondContact O-N 3.27Å; R71-Y73 VanDerWaalsContact C-N 3.3Å; R71-Y73 PolarHBondContact O-N 3.49Å; R71-S74 WeakPolarHBondContact O-CB 3.48Å; R71-S74 PolarHBondContact O-N 2.74Å; R71-L75 WeakPolarHBondContact O-CB 3.41Å; R71-L75 VanDerWaalsContact O-CG 3.3Å; R71-L75 WeakPolarHBondContact O-CG 3.37Å; R71-L75 PolarHBondContact O-N 3.05Å
72	V	84.1	Confident	85	Confident	71 Å²	71	107.3 Å²	107.3	43%	0.43	52%	0.515	S	S	.	.	H	α-helix	trans	-60.2	-42.4	176.5	169.2	0	0	0	0	110.6	H68 L69 L75 K76	H68-V72 WeakPolarHBondContact O-CB 3.33Å; H68-V72 VanDerWaalsContact O-CG2 3.3Å; H68-V72 WeakPolarHBondContact O-CG2 3.4Å; H68-V72 PolarHBondContact O-N 3.04Å; L69-V72 PolarHBondContact O-N 2.88Å; V72-L75 PolarHBondContact O-N 2.86Å; V72-K76 HydrophobicContact CG1-CD 4.31Å; V72-K76 WeakPolarHBondContact O-CB 3.45Å; V72-K76 WeakPolarHBondContact O-CG 3.45Å; V72-K76 PolarHBondContact O-N 3.38Å
73	Y	87.3	Confident	84.9	Confident	168 Å²	168	109 Å²	109	66%	0.659	52%	0.52	S	S	*	.	H	α-helix	trans	-66.6	-42.7	177.1	-170.3	-95.3	0	0	0	112.1	L69 S70 R71 K76 R77	L69-Y73 WeakPolarHBondContact O-CB 3.47Å; L69-Y73 PolarHBondContact O-N 3.31Å; S70-Y73 PolarHBondContact O-N 3.24Å; R71-Y73 VanDerWaalsContact C-N 3.3Å; R71-Y73 PolarHBondContact O-N 3.49Å; Y73-K76 PolarHBondContact O-N 2.87Å; Y73-R77 WeakPolarHBondContact O-CB 3.39Å; Y73-R77 PolarHBondContact O-N 3.38Å
74	S	87.9	Confident	85	Confident	57 Å²	57	110.3 Å²	110.3	40%	0.399	53%	0.526	S	S	.	.	H	α-helix	trans	-59.8	-47	174.6	-175.1	0	0	0	0	111.7	S70 R71 R77 Q78	S70-S74 WeakPolarHBondContact O-CB 3.24Å; S70-S74 PolarHBondContact O-N 3.42Å; R71-S74 WeakPolarHBondContact O-CB 3.48Å; R71-S74 PolarHBondContact O-N 2.74Å; S74-R77 WeakPolarHBondContact O-CB 3.21Å; S74-R77 PolarHBondContact O-N 3.16Å; S74-Q78 WeakPolarHBondContact O-CG 3.5Å; S74-Q78 PolarHBondContact O-N 3.02Å
75	L	82	Confident	85.3	Confident	96 Å²	96	110.6 Å²	110.6	50%	0.503	53%	0.528	S	S	.	.	H	α-helix	trans	-64.5	-43.2	177.1	-72.5	168.8	0	0	0	111.6	R71 V72 R77 Q78 I79	R71-L75 WeakPolarHBondContact O-CB 3.41Å; R71-L75 VanDerWaalsContact O-CG 3.3Å; R71-L75 WeakPolarHBondContact O-CG 3.37Å; R71-L75 PolarHBondContact O-N 3.05Å; V72-L75 PolarHBondContact O-N 2.86Å; L75-R77 VanDerWaalsContact C-N 3.25Å; L75-R77 PolarHBondContact O-N 3.07Å; L75-Q78 PolarHBondContact O-N 3.26Å; L75-I79 VanDerWaalsContact O-CG1 3.29Å; L75-I79 WeakPolarHBondContact O-CG1 3.35Å; L75-I79 PolarHBondContact O-N 3.04Å
76	K	87	Confident	85.2	Confident	144 Å²	144	110.6 Å²	110.6	63%	0.626	53%	0.531	S	S	*	.	H	α-helix	trans	-58.1	-39.7	173.4	-80.8	-176.8	177.6	-176.7	0	111.8	V72 Y73 A80	V72-K76 HydrophobicContact CG1-CD 4.31Å; V72-K76 WeakPolarHBondContact O-CB 3.45Å; V72-K76 WeakPolarHBondContact O-CG 3.45Å; V72-K76 PolarHBondContact O-N 3.38Å; Y73-K76 PolarHBondContact O-N 2.87Å; K76-A80 WeakPolarHBondContact O-CB 3.23Å; K76-A80 PolarHBondContact O-N 3.13Å
77	R	88.9	Confident	85	Confident	173 Å²	173	110.2 Å²	110.2	65%	0.653	53%	0.53	S	S	*	.	H	α-helix	trans	-67.2	-42.7	176.1	-171.9	178.3	176.7	179.1	-0.2	111.7	Y73 S74 L75 A80 Q81	Y73-R77 WeakPolarHBondContact O-CB 3.39Å; Y73-R77 PolarHBondContact O-N 3.38Å; S74-R77 WeakPolarHBondContact O-CB 3.21Å; S74-R77 PolarHBondContact O-N 3.16Å; L75-R77 VanDerWaalsContact C-N 3.25Å; L75-R77 PolarHBondContact O-N 3.07Å; R77-A80 PolarHBondContact O-N 3.27Å; R77-Q81 WeakPolarHBondContact O-CB 3.24Å; R77-Q81 PolarHBondContact O-N 3.46Å
78	Q	85.4	Confident	85	Confident	101 Å²	101	109.1 Å²	109.1	47%	0.472	53%	0.529	S	S	.	.	H	α-helix	trans	-62.5	-42.6	175.3	-73.5	177.7	-5	0	0	111.8	S74 L75 Q81 L82	S74-Q78 WeakPolarHBondContact O-CG 3.5Å; S74-Q78 PolarHBondContact O-N 3.02Å; L75-Q78 PolarHBondContact O-N 3.26Å; Q78-Q81 PolarHBondContact O-N 3.02Å; Q78-L82 WeakPolarHBondContact O-CB 3.26Å; Q78-L82 WeakPolarHBondContact O-CG 3.2Å; Q78-L82 PolarHBondContact O-N 2.8Å
79	I	85.8	Confident	84.6	Confident	91 Å²	91	111.3 Å²	111.3	47%	0.467	54%	0.541	S	S	.	.	H	α-helix	trans	-62.5	-43.7	175.2	-67.9	168.1	0	0	0	110.8	L75 Q81 L82 K83	L75-I79 VanDerWaalsContact O-CG1 3.29Å; L75-I79 WeakPolarHBondContact O-CG1 3.35Å; L75-I79 PolarHBondContact O-N 3.04Å; I79-Q81 VanDerWaalsContact C-N 3.31Å; I79-Q81 PolarHBondContact O-N 2.74Å; I79-L82 PolarHBondContact O-N 2.83Å; I79-K83 HydrophobicContact CG2-CD 4.28Å; I79-K83 WeakPolarHBondContact O-CB 3.28Å; I79-K83 VanDerWaalsContact O-CG 3.31Å; I79-K83 WeakPolarHBondContact O-CG 3.28Å; I79-K83 PolarHBondContact O-N 3.07Å
80	A	87.3	Confident	84.1	Confident	60 Å²	60	108.1 Å²	108.1	50%	0.496	53%	0.529	S	S	.	.	H	α-helix	trans	-62.3	-40.3	176.5	0	0	0	0	0	111.8	K76 R77 K83 Q84	K76-A80 WeakPolarHBondContact O-CB 3.23Å; K76-A80 PolarHBondContact O-N 3.13Å; R77-A80 PolarHBondContact O-N 3.27Å; A80-K83 PolarHBondContact O-N 2.72Å; A80-Q84 PolarHBondContact O-N 3.4Å
81	Q	86.9	Confident	83.7	Confident	102 Å²	102	107.7 Å²	107.7	48%	0.477	52%	0.52	S	S	.	.	H	α-helix	trans	-68.6	-44.1	179.4	-164	170.9	-9	0	0	111.8	R77 Q78 I79 K83 Q84 E85	R77-Q81 WeakPolarHBondContact O-CB 3.24Å; R77-Q81 PolarHBondContact O-N 3.46Å; Q78-Q81 PolarHBondContact O-N 3.02Å; I79-Q81 VanDerWaalsContact C-N 3.31Å; I79-Q81 PolarHBondContact O-N 2.74Å; Q81-K83 VanDerWaalsContact C-N 3.34Å; Q81-K83 PolarHBondContact O-N 3.41Å; Q81-Q84 WeakPolarHBondContact O-CB 3.33Å; Q81-Q84 PolarHBondContact O-N 3.37Å; Q81-E85 PolarHBondContact O-N 3.3Å
82	L	84.3	Confident	83.3	Confident	105 Å²	105	106.8 Å²	106.8	55%	0.55	52%	0.521	S	S	.	.	H	α-helix	trans	-62.8	-39.6	174.1	-78.4	164.6	0	0	0	112.1	Q78 I79 Q84 E85 L86	Q78-L82 WeakPolarHBondContact O-CB 3.26Å; Q78-L82 WeakPolarHBondContact O-CG 3.2Å; Q78-L82 PolarHBondContact O-N 2.8Å; I79-L82 PolarHBondContact O-N 2.83Å; L82-Q84 VanDerWaalsContact C-N 3.31Å; L82-Q84 PolarHBondContact O-N 2.85Å; L82-E85 PolarHBondContact O-N 3.03Å; L82-L86 WeakPolarHBondContact O-CB 3.32Å; L82-L86 PolarHBondContact O-N 3.42Å
83	K	84.9	Confident	82.6	Confident	145 Å²	145	109 Å²	109	63%	0.63	53%	0.529	S	S	*	.	H	α-helix	trans	-61.9	-39.9	173.6	-78.6	-177.7	176.7	-171.7	0	111.8	I79 A80 Q81 Q87	I79-K83 HydrophobicContact CG2-CD 4.28Å; I79-K83 WeakPolarHBondContact O-CB 3.28Å; I79-K83 VanDerWaalsContact O-CG 3.31Å; I79-K83 WeakPolarHBondContact O-CG 3.28Å; I79-K83 PolarHBondContact O-N 3.07Å; A80-K83 PolarHBondContact O-N 2.72Å; Q81-K83 VanDerWaalsContact C-N 3.34Å; Q81-K83 PolarHBondContact O-N 3.41Å; K83-Q87 WeakPolarHBondContact O-CB 3.49Å; K83-Q87 PolarHBondContact O-N 3.37Å
84	Q	86.1	Confident	81.9	Confident	119 Å²	119	106.5 Å²	106.5	56%	0.556	52%	0.522	S	S	*	.	H	α-helix	trans	-67.8	-42.8	176.1	-173	-178.9	-18.4	0	0	111.7	A80 Q81 L82 L86 Q87 E88	A80-Q84 PolarHBondContact O-N 3.4Å; Q81-Q84 WeakPolarHBondContact O-CB 3.33Å; Q81-Q84 PolarHBondContact O-N 3.37Å; L82-Q84 VanDerWaalsContact C-N 3.31Å; L82-Q84 PolarHBondContact O-N 2.85Å; Q84-L86 VanDerWaalsContact C-N 3.34Å; Q84-L86 PolarHBondContact O-N 2.87Å; Q84-Q87 WeakPolarHBondContact O-CB 3.47Å; Q84-Q87 PolarHBondContact O-N 3.46Å; Q84-E88 PolarHBondContact NE2-OE1 3.05Å; Q84-E88 PolarHBondContact O-N 2.92Å
85	E	84.1	Confident	81	Confident	100 Å²	100	107.4 Å²	107.4	47%	0.467	53%	0.525	S	S	.	.	H	α-helix	trans	-63.4	-39.2	176.1	-74.9	178.5	-172.8	0	0	112.2	Q81 L82 Q87 E88 M89	Q81-E85 PolarHBondContact O-N 3.3Å; L82-E85 PolarHBondContact O-N 3.03Å; E85-Q87 VanDerWaalsContact C-N 3.34Å; E85-E88 PolarHBondContact O-N 3.01Å; E85-M89 WeakPolarHBondContact O-CB 3.4Å; E85-M89 VanDerWaalsContact O-CG 3.31Å; E85-M89 WeakPolarHBondContact O-CG 3.49Å; E85-M89 PolarHBondContact O-N 3.22Å
86	L	81.6	Confident	80.1	Confident	126 Å²	126	109.5 Å²	109.5	66%	0.66	53%	0.534	S	S	*	.	H	α-helix	trans	-60.5	-43.4	171.8	-103.4	151.1	0	0	0	111.7	L82 Q84 S90	L82-L86 WeakPolarHBondContact O-CB 3.32Å; L82-L86 PolarHBondContact O-N 3.42Å; Q84-L86 VanDerWaalsContact C-N 3.34Å; Q84-L86 PolarHBondContact O-N 2.87Å; L86-S90 VanDerWaalsContact O-CB 3.31Å; L86-S90 WeakPolarHBondContact O-CB 3.47Å; L86-S90 PolarHBondContact O-N 3.15Å
87	Q	82.7	Confident	78.6	Confident	104 Å²	104	107.4 Å²	107.4	49%	0.486	53%	0.526	S	S	.	.	H	α-helix	trans	-65.9	-44.9	177.2	-169.5	64.2	34	0	0	111.4	K83 Q84 E85 M89 S90 D91	K83-Q87 WeakPolarHBondContact O-CB 3.49Å; K83-Q87 PolarHBondContact O-N 3.37Å; Q84-Q87 WeakPolarHBondContact O-CB 3.47Å; Q84-Q87 PolarHBondContact O-N 3.46Å; E85-Q87 VanDerWaalsContact C-N 3.34Å; Q87-M89 PolarHBondContact O-N 3.46Å; Q87-S90 WeakPolarHBondContact O-CB 3.48Å; Q87-S90 PolarHBondContact O-N 2.91Å; Q87-D91 PolarHBondContact NE2-OD1 2.94Å; Q87-D91 VanDerWaalsContact O-CG 3.29Å; Q87-D91 PolarHBondContact O-N 3.35Å
88	E	80.1	Confident	77.1	Confident	90 Å²	90	107 Å²	107	42%	0.421	53%	0.532	S	S	.	.	H	α-helix	trans	-65.4	-37	177.7	-77.4	-177.4	-165.5	0	0	112.7	Q84 E85 K92	Q84-E88 PolarHBondContact NE2-OE1 3.05Å; Q84-E88 PolarHBondContact O-N 2.92Å; E85-E88 PolarHBondContact O-N 3.01Å; E88-K92 WeakPolarHBondContact O-CB 3.23Å; E88-K92 VanDerWaalsContact O-CG 3.28Å; E88-K92 WeakPolarHBondContact O-CG 3.29Å; E88-K92 PolarHBondContact O-N 3.29Å
89	M	74.4	Confident	75.7	Confident	136 Å²	136	110.9 Å²	110.9	67%	0.67	55%	0.547	S	S	*	.	H	α-helix	trans	-65.7	-41.8	172.4	-79.2	-110.4	-73	0	0	111.4	E85 Q87 K92 L93	E85-M89 WeakPolarHBondContact O-CB 3.4Å; E85-M89 VanDerWaalsContact O-CG 3.31Å; E85-M89 WeakPolarHBondContact O-CG 3.49Å; E85-M89 PolarHBondContact O-N 3.22Å; Q87-M89 PolarHBondContact O-N 3.46Å; M89-K92 PolarHBondContact O-N 2.83Å; M89-L93 WeakPolarHBondContact O-CB 3.41Å; M89-L93 PolarHBondContact O-N 2.79Å
90	S	77.3	Confident	73.9	Confident	50 Å²	50	115.2 Å²	115.2	35%	0.35	56%	0.562	S	S	.	*	H	α-helix	trans	-61.5	-45.4	175.3	-173.7	0	0	0	0	111.8	L86 Q87 L93 K94	L86-S90 VanDerWaalsContact O-CB 3.31Å; L86-S90 WeakPolarHBondContact O-CB 3.47Å; L86-S90 PolarHBondContact O-N 3.15Å; Q87-S90 WeakPolarHBondContact O-CB 3.48Å; Q87-S90 PolarHBondContact O-N 2.91Å; S90-L93 WeakPolarHBondContact O-CB 3.5Å; S90-L93 PolarHBondContact O-N 3.13Å; S90-K94 PolarHBondContact O-N 3.18Å
91	D	75.8	Confident	71.7	Confident	72 Å²	72	121.1 Å²	121.1	39%	0.385	58%	0.58	S	S	.	*	H	α-helix	trans	-68.8	-37.8	178.5	-67	-24.1	0	0	0	111.7	Q87 L93 K94 V95	Q87-D91 PolarHBondContact NE2-OD1 2.94Å; Q87-D91 VanDerWaalsContact O-CG 3.29Å; Q87-D91 PolarHBondContact O-N 3.35Å; D91-L93 VanDerWaalsContact C-N 3.31Å; D91-L93 PolarHBondContact O-N 3.02Å; D91-K94 PolarHBondContact O-N 3.49Å; D91-V95 WeakPolarHBondContact O-CG2 3.41Å; D91-V95 PolarHBondContact O-N 3.47Å
92	K	76.1	Confident	69.7	Low	133 Å²	133	121.8 Å²	121.8	58%	0.578	59%	0.593	S	S	*	*	H	α-helix	trans	-61.8	-38.9	170.7	-80.4	173.8	-175.9	166.4	0	111.9	E88 M89 V95 M96	E88-K92 WeakPolarHBondContact O-CB 3.23Å; E88-K92 VanDerWaalsContact O-CG 3.28Å; E88-K92 WeakPolarHBondContact O-CG 3.29Å; E88-K92 PolarHBondContact O-N 3.29Å; M89-K92 PolarHBondContact O-N 2.83Å; K92-V95 PolarHBondContact O-N 2.81Å; K92-M96 VanDerWaalsContact O-CG 3.32Å; K92-M96 WeakPolarHBondContact O-CG 3.45Å; K92-M96 PolarHBondContact O-N 3.32Å
93	L	68.7	Low	68.1	Low	117 Å²	117	123.1 Å²	123.1	61%	0.613	61%	0.608	S	S	*	*	H	α-helix	trans	-63.9	-45.3	177.2	-141	87.5	0	0	0	110.8	M89 S90 D91 V95 M96 Q97	M89-L93 WeakPolarHBondContact O-CB 3.41Å; M89-L93 PolarHBondContact O-N 2.79Å; S90-L93 WeakPolarHBondContact O-CB 3.5Å; S90-L93 PolarHBondContact O-N 3.13Å; D91-L93 VanDerWaalsContact C-N 3.31Å; D91-L93 PolarHBondContact O-N 3.02Å; L93-V95 PolarHBondContact O-N 2.71Å; L93-M96 PolarHBondContact O-N 3.31Å; L93-Q97 PolarHBondContact O-N 2.95Å
94	K	72.9	Confident	66.2	Low	115 Å²	115	119.6 Å²	119.6	50%	0.5	61%	0.613	S	S	.	*	H	α-helix	trans	-60	-44.9	176	-73.8	179.4	179.7	177.9	0	112.4	S90 D91 M96 Q97 E98	S90-K94 PolarHBondContact O-N 3.18Å; D91-K94 PolarHBondContact O-N 3.49Å; K94-M96 VanDerWaalsContact C-N 3.31Å; K94-M96 PolarHBondContact O-N 2.81Å; K94-Q97 VanDerWaalsContact O-CB 3.31Å; K94-Q97 WeakPolarHBondContact O-CB 3.32Å; K94-Q97 PolarHBondContact O-N 3.19Å; K94-Q97 VanDerWaalsContact O-N 3.1Å; K94-E98 PolarHBondContact O-N 2.82Å
95	V	69.3	Low	63.7	Low	77 Å²	77	120.8 Å²	120.8	47%	0.467	63%	0.628	S	S	.	*	H	α-helix	trans	-66.8	-31.9	177.9	173.1	0	0	0	0	112.2	D91 K92 L93 Q97 K99	D91-V95 WeakPolarHBondContact O-CG2 3.41Å; D91-V95 PolarHBondContact O-N 3.47Å; K92-V95 PolarHBondContact O-N 2.81Å; L93-V95 PolarHBondContact O-N 2.71Å; V95-Q97 VanDerWaalsContact C-N 3.33Å; V95-K99 PolarHBondContact O-N 2.88Å
96	M	62.2	Low	61.8	Low	140 Å²	140	125.6 Å²	125.6	69%	0.69	65%	0.65	S	S	*	*	H	α-helix	trans	-72.1	-28.5	172.7	-73.7	-177	70.6	0	0	112.6	K92 L93 K94	K92-M96 VanDerWaalsContact O-CG 3.32Å; K92-M96 WeakPolarHBondContact O-CG 3.45Å; K92-M96 PolarHBondContact O-N 3.32Å; L93-M96 PolarHBondContact O-N 3.31Å; K94-M96 VanDerWaalsContact C-N 3.31Å; K94-M96 PolarHBondContact O-N 2.81Å
97	Q	56.1	Low	59.8	Low	100 Å²	100	122.6 Å²	122.6	47%	0.467	65%	0.65	S	S	.	*	H	α-helix	trans	-73.4	-43	176	-128.4	168.2	-4.8	0	0	111.8	L93 K94 V95 K99 K100 N111	L93-Q97 PolarHBondContact O-N 2.95Å; K94-Q97 VanDerWaalsContact O-CB 3.31Å; K94-Q97 WeakPolarHBondContact O-CB 3.32Å; K94-Q97 PolarHBondContact O-N 3.19Å; K94-Q97 VanDerWaalsContact O-N 3.1Å; V95-Q97 VanDerWaalsContact C-N 3.33Å; Q97-K99 PolarHBondContact O-N 2.84Å; Q97-K100 PolarHBondContact O-N 2.71Å; Q97-N111 PolarHBondContact NE2-ND2 2.96Å
98	E	57.2	Low	58.1	Low	163 Å²	163	126.6 Å²	126.6	76%	0.762	67%	0.674	S	S	*	*	H	α-helix	trans	-67.3	-22.4	177.3	-71.7	179.8	171.3	0	0	113.4	K94 K100	K94-E98 PolarHBondContact O-N 2.82Å; E98-K100 VanDerWaalsContact C-N 3.33Å
99	K	55.2	Low	56.2	Low	183 Å²	183	125.6 Å²	125.6	80%	0.796	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	0.1	176.9	-92	-179.1	175.6	175.6	0	114.7	V95 Q97	V95-K99 PolarHBondContact O-N 2.88Å; Q97-K99 PolarHBondContact O-N 2.84Å
100	K	48.7	Very low	54.7	Low	182 Å²	182	128.2 Å²	128.2	79%	0.791	70%	0.699	S	S	*	*			trans	-120.8	62.1	-174.3	-123.2	-173.5	-174.8	-176.2	0	112.2	Q97 E98	Q97-K100 PolarHBondContact O-N 2.71Å; E98-K100 VanDerWaalsContact C-N 3.33Å
101	E	41.9	Very low	53.2	Low	185 Å²	185	131.6 Å²	131.6	86%	0.864	71%	0.712	S	S	*	*			trans	-116.7	117.4	157.2	-77.3	-163.4	155	0	0	110.7
102	P	44.7	Very low	51.8	Low	116 Å²	116	135.2 Å²	135.2	75%	0.753	73%	0.727	S	S	*	*				-130.7	166.5	124	32.7	-18.7	0	0	0	111.8
103	P	50.7	Low	50.8	Low	132 Å²	132	135.7 Å²	135.7	86%	0.857	73%	0.731	S	S	*	*			trans	-85.4	137.8	-158	32.4	-32.2	0	0	0	113
104	G	43.9	Very low	50.2	Low	72 Å²	72	135.7 Å²	135.7	74%	0.742	74%	0.738	S	S	*	*			trans	98.2	99.2	157.4	0	0	0	0	0	114.9
105	V	34.5	Very low	49.6	Very low	144 Å²	144	132.3 Å²	132.3	87%	0.873	74%	0.737	S	S	*	*				-164.3	119.9	122.4	167.9	0	0	0	0	106.4
106	Q	44.8	Very low	50	Low	200 Å²	200	132.2 Å²	132.2	94%	0.935	73%	0.734	S	S	*	*			trans	-65.4	126.3	166.9	-75.7	169.9	-23.1	0	0	109.1
107	G	39.7	Very low	50.9	Low	64 Å²	64	129.9 Å²	129.9	66%	0.66	72%	0.723	S	S	*	*			trans	161.9	93.1	169.6	0	0	0	0	0	114.6
108	L	45	Very low	52.1	Low	187 Å²	187	129.7 Å²	129.7	98%	0.979	73%	0.725	S	S	*	*			trans	49.4	103.5	151.1	-72.5	129.9	0	0	0	118.3
109	G	41.7	Very low	53.4	Low	69 Å²	69	128.5 Å²	128.5	71%	0.711	72%	0.719	S	S	*	*			trans	167.4	61.9	163.4	0	0	0	0	0	111.7	N111	G109-N111 PolarHBondContact O-N 2.78Å
110	E	43.2	Very low	54.8	Low	192 Å²	192	124.6 Å²	124.6	90%	0.897	70%	0.702	S	S	*	*			trans	-64.9	127.3	166.4	-78.9	179.8	155.3	0	0	108.8	Q112	E110-Q112 PolarHBondContact O-N 2.87Å; E110-Q112 VanDerWaalsContact O-N 3.16Å
111	N	46	Very low	56.4	Low	120 Å²	120	116.4 Å²	116.4	64%	0.642	67%	0.668	S	S	*	*			trans	-67.3	106.4	174.3	-60.9	-71.4	0	0	0	107.9	Q97 G109 E113	Q97-N111 PolarHBondContact NE2-ND2 2.96Å; G109-N111 PolarHBondContact O-N 2.78Å; N111-E113 PolarHBondContact O-N 3.47Å
112	Q	44.9	Very low	58.5	Low	148 Å²	148	111.8 Å²	111.8	69%	0.692	65%	0.646	S	S	*	*			trans	-68.1	122	171.3	-77.2	174.7	-25	0	0	109	E110 D116	E110-Q112 PolarHBondContact O-N 2.87Å; E110-Q112 VanDerWaalsContact O-N 3.16Å; Q112-D116 HydrophobicContact CB-CB 4.29Å; Q112-D116 HydrophobicContact CG-CB 4.49Å
113	E	54.7	Low	60.3	Low	143 Å²	143	108.1 Å²	108.1	67%	0.668	62%	0.623	S	S	*	*			trans	-68.5	155.9	171.6	-72.2	-154.7	157.8	0	0	110	N111 G115 D116	N111-E113 PolarHBondContact O-N 3.47Å; E113-G115 PolarHBondContact O-N 2.81Å; E113-D116 PolarHBondContact N-OD2 3.15Å; E113-D116 WeakPolarHBondContact O-CB 3.36Å; E113-D116 PolarHBondContact O-N 2.91Å
114	P	55.9	Low	61.7	Low	117 Å²	117	102.6 Å²	102.6	76%	0.76	59%	0.585	S	S	*	*	H	α-helix	trans	-55.5	-25.9	178.9	-24.8	33.1	0	0	0	114.6	L118	P114-L118 PolarHBondContact O-N 3.43Å
115	G	62	Low	63.5	Low	45 Å²	45	99.9 Å²	99.9	46%	0.464	55%	0.554	S	S	.	*	H	α-helix	trans	-67.4	-40.2	173.7	0	0	0	0	0	112.9	E113 L117 L118 E119	E113-G115 PolarHBondContact O-N 2.81Å; G115-L117 VanDerWaalsContact C-N 3.28Å; G115-L117 PolarHBondContact O-N 3.23Å; G115-L118 PolarHBondContact O-N 2.71Å; G115-E119 WeakPolarHBondContact O-CB 3.5Å; G115-E119 PolarHBondContact O-N 2.7Å
116	D	77.5	Confident	65.7	Low	75 Å²	75	98.9 Å²	98.9	40%	0.401	54%	0.544	S	S	.	.	H	α-helix	trans	-64.5	-35.5	-179.5	-59.1	-25	0	0	0	111.4	Q112 E113 F120	Q112-D116 HydrophobicContact CB-CB 4.29Å; Q112-D116 HydrophobicContact CG-CB 4.49Å; E113-D116 PolarHBondContact N-OD2 3.15Å; E113-D116 WeakPolarHBondContact O-CB 3.36Å; E113-D116 PolarHBondContact O-N 2.91Å; D116-F120 VanDerWaalsContact O-CB 3.25Å; D116-F120 WeakPolarHBondContact O-CB 3.46Å; D116-F120 PolarHBondContact O-N 2.76Å
117	L	81.4	Confident	67.1	Low	91 Å²	91	95.3 Å²	95.3	48%	0.476	53%	0.525	S	S	.	.	H	α-helix	trans	-69.4	-47.4	176.9	-178.2	62.2	0	0	0	111.2	G115 E119 F120 L121	G115-L117 VanDerWaalsContact C-N 3.28Å; G115-L117 PolarHBondContact O-N 3.23Å; L117-E119 VanDerWaalsContact C-N 3.31Å; L117-E119 PolarHBondContact O-N 3.09Å; L117-F120 WeakPolarHBondContact O-CB 3.35Å; L117-F120 PolarHBondContact O-N 3.32Å; L117-L121 HydrophobicContact CD1-CG 4.44Å; L117-L121 HydrophobicContact CG-CD1 4.42Å; L117-L121 VanDerWaalsContact O-CG 3.28Å; L117-L121 WeakPolarHBondContact O-CG 3.22Å; L117-L121 PolarHBondContact O-N 3.33Å
118	L	81.2	Confident	68.8	Low	95 Å²	95	92.6 Å²	92.6	50%	0.497	50%	0.496	S	S	.	.	H	α-helix	trans	-61.9	-42.5	178.9	-165.1	87.4	0	0	0	111.1	P114 G115 F120 L121 H122	P114-L118 PolarHBondContact O-N 3.43Å; G115-L118 PolarHBondContact O-N 2.71Å; L118-F120 VanDerWaalsContact C-N 3.35Å; L118-L121 PolarHBondContact O-N 3.17Å; L118-H122 PolarHBondContact O-N 3.4Å
119	E	84.2	Confident	70.3	Confident	139 Å²	139	85 Å²	85	65%	0.65	46%	0.456	S	S	*	.	H	α-helix	trans	-62.8	-41.3	175.1	-171.4	175	178.3	0	0	111.6	G115 L117 L121 H122 S123	G115-E119 WeakPolarHBondContact O-CB 3.5Å; G115-E119 PolarHBondContact O-N 2.7Å; L117-E119 VanDerWaalsContact C-N 3.31Å; L117-E119 PolarHBondContact O-N 3.09Å; E119-L121 PolarHBondContact O-N 2.98Å; E119-H122 PolarHBondContact O-N 3.07Å; E119-S123 WeakPolarHBondContact O-CB 3.26Å; E119-S123 PolarHBondContact O-N 2.93Å
120	F	83.6	Confident	72	Confident	100 Å²	100	82.2 Å²	82.2	44%	0.439	43%	0.425	S	S	.	.	H	α-helix	trans	-60.3	-44	173.3	173.3	-96.8	0	0	0	112.3	D116 L117 L118 S123 Q124	D116-F120 VanDerWaalsContact O-CB 3.25Å; D116-F120 WeakPolarHBondContact O-CB 3.46Å; D116-F120 PolarHBondContact O-N 2.76Å; L117-F120 WeakPolarHBondContact O-CB 3.35Å; L117-F120 PolarHBondContact O-N 3.32Å; L118-F120 VanDerWaalsContact C-N 3.35Å; F120-S123 WeakPolarHBondContact O-CB 3.28Å; F120-S123 PolarHBondContact O-N 3.04Å; F120-Q124 HydrophobicContact CD1-CG 4.49Å; F120-Q124 HydrophobicContact CE1-CG 4.01Å; F120-Q124 VanDerWaalsContact CE2-NE2 3.35Å; F120-Q124 HydrophobicContact CZ-CG 4.07Å; F120-Q124 WeakPolarHBondContact O-CG 3.17Å; F120-Q124 PolarHBondContact O-N 2.67Å
121	L	83.7	Confident	73.4	Confident	11 Å²	11	77.5 Å²	77.5	6%	0.058	41%	0.406	C	S	.	.	H	α-helix	trans	-65.6	-43.7	179.1	-62.5	176.3	0	0	0	111.5	L117 L118 E119 S123 Q124 I125 P248 P251 M253	L117-L121 HydrophobicContact CD1-CG 4.44Å; L117-L121 HydrophobicContact CG-CD1 4.42Å; L117-L121 VanDerWaalsContact O-CG 3.28Å; L117-L121 WeakPolarHBondContact O-CG 3.22Å; L117-L121 PolarHBondContact O-N 3.33Å; L118-L121 PolarHBondContact O-N 3.17Å; E119-L121 PolarHBondContact O-N 2.98Å; L121-S123 VanDerWaalsContact C-N 3.32Å; L121-S123 PolarHBondContact O-N 2.87Å; L121-Q124 WeakPolarHBondContact O-CB 3.37Å; L121-Q124 PolarHBondContact O-N 3.23Å; L121-Q124 VanDerWaalsContact O-N 3.13Å; L121-I125 PolarHBondContact O-N 2.92Å; L121-P248 HydrophobicContact CB-CG 4.3Å; L121-P248 HydrophobicContact CD2-CB 3.69Å; L121-P248 HydrophobicContact CD2-CG 3.57Å; L121-P248 HydrophobicContact CG-CG 4.31Å; L121-P251 HydrophobicContact CD1-CG 4.49Å; L121-M253 HydrophobicContact CB-CE 4.48Å; L121-M253 HydrophobicContact CB-SD 3.74Å; L121-M253 HydrophobicContact CD1-SD 4.32Å
122	H	84.1	Confident	74.9	Confident	88 Å²	88	75 Å²	75	41%	0.407	40%	0.402	S	S	.	.	H	α-helix	trans	-60.4	-41.1	172	-71.5	161.8	0	0	0	111.8	L118 E119 Q124 I125 D126 M253	L118-H122 PolarHBondContact O-N 3.4Å; E119-H122 PolarHBondContact O-N 3.07Å; H122-Q124 PolarHBondContact O-N 3.35Å; H122-I125 WeakPolarHBondContact O-CB 3.39Å; H122-I125 PolarHBondContact O-N 2.92Å; H122-D126 PolarHBondContact O-N 3.12Å; H122-M253 WeakPolarHBondContact CD2-CE 3.49Å; H122-M253 WeakPolarHBondContact NE2-CE 3.35Å
123	S	82.5	Confident	76.6	Confident	39 Å²	39	68.7 Å²	68.7	27%	0.273	38%	0.377	S	S	.	.	H	α-helix	trans	-60.7	-31.7	174.8	-174.9	0	0	0	0	113	E119 F120 L121 K127	E119-S123 WeakPolarHBondContact O-CB 3.26Å; E119-S123 PolarHBondContact O-N 2.93Å; F120-S123 WeakPolarHBondContact O-CB 3.28Å; F120-S123 PolarHBondContact O-N 3.04Å; L121-S123 VanDerWaalsContact C-N 3.32Å; L121-S123 PolarHBondContact O-N 2.87Å; S123-K127 WeakPolarHBondContact O-CB 3.36Å; S123-K127 WeakPolarHBondContact O-CD 3.3Å; S123-K127 VanDerWaalsContact O-CG 3.24Å; S123-K127 WeakPolarHBondContact O-CG 3.49Å; S123-K127 PolarHBondContact O-N 3.11Å; S123-K127 VanDerWaalsContact O-N 3.16Å; S123-K127 WeakPolarHBondContact OG-CE 3.43Å; S123-K127 PolarHBondContact OG-NZ 3.31Å
124	Q	81.1	Confident	78	Confident	15 Å²	15	63.9 Å²	63.9	7%	0.07	36%	0.362	C	S	.	.	H	α-helix	trans	-67.9	-38.8	173.3	-63.3	-49.5	-61.2	0	0	112.1	F120 L121 H122 K127 A128 F246	F120-Q124 HydrophobicContact CD1-CG 4.49Å; F120-Q124 HydrophobicContact CE1-CG 4.01Å; F120-Q124 VanDerWaalsContact CE2-NE2 3.35Å; F120-Q124 HydrophobicContact CZ-CG 4.07Å; F120-Q124 WeakPolarHBondContact O-CG 3.17Å; F120-Q124 PolarHBondContact O-N 2.67Å; L121-Q124 WeakPolarHBondContact O-CB 3.37Å; L121-Q124 PolarHBondContact O-N 3.23Å; L121-Q124 VanDerWaalsContact O-N 3.13Å; H122-Q124 PolarHBondContact O-N 3.35Å; Q124-K127 PolarHBondContact O-N 3.48Å; Q124-A128 WeakPolarHBondContact O-CB 3.45Å; Q124-A128 PolarHBondContact O-N 3.47Å; Q124-F246 HydrophobicContact CB-CE1 4.06Å
125	I	82.6	Confident	79.8	Confident	16 Å²	16	66.2 Å²	66.2	8%	0.082	36%	0.355	C	S	.	.	H	α-helix	trans	-62.4	-45.6	176.1	-63.6	170.3	0	0	0	110	L121 H122 K127 A128 F246 M253 V255	L121-I125 PolarHBondContact O-N 2.92Å; H122-I125 WeakPolarHBondContact O-CB 3.39Å; H122-I125 PolarHBondContact O-N 2.92Å; I125-K127 PolarHBondContact O-N 3.13Å; I125-A128 PolarHBondContact O-N 2.93Å; I125-F246 HydrophobicContact CB-CD1 4.43Å; I125-F246 HydrophobicContact CD1-CB 4.46Å; I125-F246 HydrophobicContact CD1-CD1 4.35Å; I125-F246 HydrophobicContact CG1-CB 4.03Å; I125-F246 HydrophobicContact CG1-CD1 3.4Å; I125-F246 HydrophobicContact CG1-CE1 4.1Å; I125-F246 HydrophobicContact CG1-CG 3.93Å; I125-M253 HydrophobicContact CD1-CB 4.01Å; I125-M253 HydrophobicContact CD1-CE 4.23Å; I125-M253 HydrophobicContact CD1-SD 3.85Å; I125-V255 HydrophobicContact CG2-CG2 4.15Å
126	D	79.1	Confident	81.2	Confident	123 Å²	123	65.3 Å²	65.3	66%	0.658	34%	0.339	S	S	*	.	H	α-helix	trans	-63.9	-30.4	179.4	-68.8	-25.3	0	0	0	112.9	H122	H122-D126 PolarHBondContact O-N 3.12Å
127	K	75.4	Confident	81.9	Confident	125 Å²	125	66.4 Å²	66.4	54%	0.543	35%	0.351	S	S	.	.	H	α-helix	trans	-84.5	-21.4	177.1	-71.8	171.2	-172.8	168	0	113.5	S123 Q124 I125 K224	S123-K127 WeakPolarHBondContact O-CB 3.36Å; S123-K127 WeakPolarHBondContact O-CD 3.3Å; S123-K127 VanDerWaalsContact O-CG 3.24Å; S123-K127 WeakPolarHBondContact O-CG 3.49Å; S123-K127 PolarHBondContact O-N 3.11Å; S123-K127 VanDerWaalsContact O-N 3.16Å; S123-K127 WeakPolarHBondContact OG-CE 3.43Å; S123-K127 PolarHBondContact OG-NZ 3.31Å; Q124-K127 PolarHBondContact O-N 3.48Å; I125-K127 PolarHBondContact O-N 3.13Å; K127-K224 HydrophobicContact CB-CD 4.42Å; K127-K224 WeakPolarHBondContact O-CE 3.33Å; K127-K224 PolarHBondContact O-NZ 2.73Å
128	A	75.6	Confident	82.4	Confident	7 Å²	7	63.6 Å²	63.6	6%	0.058	34%	0.339	C	S	.	.	S	Bend	trans	-74.6	152.6	177	0	0	0	0	0	109.9	Q124 I125 V130 K224 F246	Q124-A128 WeakPolarHBondContact O-CB 3.45Å; Q124-A128 PolarHBondContact O-N 3.47Å; I125-A128 PolarHBondContact O-N 2.93Å; A128-V130 HydrophobicContact CB-CG2 3.57Å; A128-V130 PolarHBondContact O-N 3.06Å; A128-K224 HydrophobicContact CB-CD 4.02Å; A128-F246 HydrophobicContact CB-CD2 4.32Å; A128-F246 HydrophobicContact CB-CE2 3.6Å; A128-F246 HydrophobicContact CB-CZ 3.86Å
129	E	76.6	Confident	82.9	Confident	26 Å²	26	60.1 Å²	60.1	12%	0.121	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	55	179.4	-59.9	174.6	173.1	0	0	111.4	A132 A134 R219	E129-A132 WeakPolarHBondContact CA-O 3.48Å; E129-A134 HydrophobicContact CG-CB 3.98Å; E129-A134 WeakPolarHBondContact OE1-CB 3.48Å; E129-R219 IonicContact OE2-CZ 3.7Å; E129-R219 IonicContact OE2-NH1 3.37Å; E129-R219 PolarHBondContact OE2-NH1 2.98Å; E129-R219 IonicContact OE2-NH2 2.86Å; E129-R219 PolarHBondContact OE2-NH2 2.95Å
130	V	75.6	Confident	83.2	Confident	11 Å²	11	63.1 Å²	63.1	7%	0.067	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-47.5	-173.5	179.1	0	0	0	0	109.8	A128 L227 F246 V255	A128-V130 HydrophobicContact CB-CG2 3.57Å; A128-V130 PolarHBondContact O-N 3.06Å; V130-L227 HydrophobicContact CG1-CD1 4.36Å; V130-L227 HydrophobicContact CG2-CD1 4.05Å; V130-L227 HydrophobicContact CG2-CD2 4.25Å; V130-F246 HydrophobicContact CG2-CD2 4.26Å; V130-V255 HydrophobicContact CG1-CB 4.16Å; V130-V255 HydrophobicContact CG1-CG1 3.2Å; V130-V255 HydrophobicContact CG1-CG2 4.05Å
131	N	73.9	Confident	83.6	Confident	94 Å²	94	60.4 Å²	60.4	50%	0.503	32%	0.323	S	S	.	.	S	Bend	trans	-100.8	-27.8	-176.1	-69.6	-36.8	0	0	0	113.4
132	A	78.1	Confident	84	Confident	67 Å²	67	60.6 Å²	60.6	55%	0.554	32%	0.324	S	S	*	.	S	Bend	trans	-140.4	149.1	-179.3	0	0	0	0	0	111.1	E129	E129-A132 WeakPolarHBondContact CA-O 3.48Å
133	G	79.6	Confident	84.4	Confident	16 Å²	16	59.5 Å²	59.5	17%	0.165	32%	0.323	C	S	.	.			trans	-75.5	148.6	175.5	0	0	0	0	0	111.6	E465	G133-E465 PolarHBondContact N-O 2.95Å
134	A	85.3	Confident	85	Confident	42 Å²	42	59.6 Å²	59.6	35%	0.347	32%	0.323	S	S	.	.			trans	-93.3	147.7	169	0	0	0	0	0	110.7	E129 L136	E129-A134 HydrophobicContact CG-CB 3.98Å; E129-A134 WeakPolarHBondContact OE1-CB 3.48Å; A134-L136 HydrophobicContact CB-CD2 4.48Å; A134-L136 PolarHBondContact O-N 3.17Å
135	R	92.3	Very high	85.7	Confident	166 Å²	166	59 Å²	59	63%	0.626	32%	0.32	S	S	*	.			trans	-78.4	115.7	171.1	-62.9	-175.1	-171.3	178.6	2.9	109.3	L462 E465	R135-L462 CarbonylContact C-O 3.53Å; R135-L462 WeakPolarHBondContact CA-O 3.24Å; R135-E465 IonicContact CZ-OE1 3.85Å; R135-E465 IonicContact NH2-OE1 3.01Å; R135-E465 PolarHBondContact NH2-OE1 3.36Å
136	L	92.9	Very high	86.2	Confident	25 Å²	25	59.4 Å²	59.4	13%	0.131	32%	0.322	C	S	.	.			trans	-105.8	140.4	-176.9	-62	173.7	0	0	0	111.1	A134 S138 A141 L142 L462	A134-L136 HydrophobicContact CB-CD2 4.48Å; A134-L136 PolarHBondContact O-N 3.17Å; L136-S138 PolarHBondContact O-N 2.96Å; L136-A141 HydrophobicContact CB-CB 4.35Å; L136-A141 HydrophobicContact CD2-CB 4.24Å; L136-L142 HydrophobicContact CD1-CB 3.85Å; L136-L142 HydrophobicContact CD1-CD1 3.49Å; L136-L142 VanDerWaalsContact CD1-CD1 3.49Å; L136-L142 HydrophobicContact CD1-CG 4.29Å; L136-L462 HydrophobicContact CB-CB 4.25Å; L136-L462 HydrophobicContact CB-CD2 4.31Å; L136-L462 HydrophobicContact CD1-CD2 3.87Å; L136-L462 PolarHBondContact N-O 2.91Å
137	P	92	Very high	87	Confident	98 Å²	98	54.1 Å²	54.1	64%	0.636	29%	0.294	S	S	*	.	S	Bend	trans	-70.5	-32.2	-175.5	26.9	-34.8	0	0	0	113.1	A141	P137-A141 HydrophobicContact CG-CB 3.94Å
138	S	92	Very high	87.9	Confident	32 Å²	32	48.4 Å²	48.4	22%	0.224	27%	0.269	C	S	.	.	S	Bend	trans	-159.7	166.4	-177.2	64	0	0	0	0	111.2	L136 Y140 A141	L136-S138 PolarHBondContact O-N 2.96Å; S138-Y140 PolarHBondContact O-N 3.49Å; S138-Y140 VanDerWaalsContact O-N 3.14Å; S138-A141 WeakPolarHBondContact O-CB 3.45Å; S138-A141 PolarHBondContact O-N 2.87Å
139	E	91.1	Very high	88.8	Confident	23 Å²	23	49.8 Å²	49.8	11%	0.107	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-51.5	-31.6	173.3	62.7	-82.9	-162.7	0	0	114.2	A141 L142 F427 Y458 R459 L462	E139-A141 PolarHBondContact O-N 2.92Å; E139-L142 PolarHBondContact O-N 3.08Å; E139-F427 HydrophobicContact CB-CZ 3.96Å; E139-F427 HydrophobicContact CG-CZ 4.33Å; E139-Y458 HydrophobicContact CB-CD1 3.92Å; E139-Y458 HydrophobicContact CB-CE1 3.58Å; E139-R459 IonicContact OE1-CZ 3.29Å; E139-R459 IonicContact OE1-NE 2.81Å; E139-R459 IonicContact OE1-NH2 3.51Å; E139-R459 PolarHBondContact OE1-NH2 3.33Å; E139-R459 IonicContact OE2-CZ 3.83Å; E139-R459 IonicContact OE2-NE 2.81Å; E139-R459 PolarHBondContact OE2-NE 3.18Å; E139-R459 IonicContact OE2-NH2 3.85Å; E139-R459 PolarHBondContact OE2-NH2 2.87Å; E139-L462 HydrophobicContact CB-CD1 4.28Å
140	Y	90.5	Very high	89.3	Confident	201 Å²	201	53 Å²	53	79%	0.788	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-73.5	-12.9	179.5	-54	-67.4	0	0	0	114.3	S138	S138-Y140 PolarHBondContact O-N 3.49Å; S138-Y140 VanDerWaalsContact O-N 3.14Å
141	A	91.5	Very high	89.9	Confident	43 Å²	43	55.5 Å²	55.5	36%	0.355	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-90.4	-17.7	177.9	0	0	0	0	0	112.3	L136 P137 S138 E139 V143	L136-A141 HydrophobicContact CB-CB 4.35Å; L136-A141 HydrophobicContact CD2-CB 4.24Å; P137-A141 HydrophobicContact CG-CB 3.94Å; S138-A141 WeakPolarHBondContact O-CB 3.45Å; S138-A141 PolarHBondContact O-N 2.87Å; E139-A141 PolarHBondContact O-N 2.92Å; A141-V143 PolarHBondContact O-N 2.95Å
142	L	92.3	Very high	90.7	Very high	15 Å²	15	53.9 Å²	53.9	8%	0.079	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-73.7	126.6	176.1	-174.7	77.9	0	0	0	109.1	L136 E139 P144 Y458 L462 V468 R470	L136-L142 HydrophobicContact CD1-CB 3.85Å; L136-L142 HydrophobicContact CD1-CD1 3.49Å; L136-L142 VanDerWaalsContact CD1-CD1 3.49Å; L136-L142 HydrophobicContact CD1-CG 4.29Å; E139-L142 PolarHBondContact O-N 3.08Å; L142-P144 WeakPolarHBondContact O-CD 3.4Å; L142-Y458 WeakPolarHBondContact CD2-OH 3.44Å; L142-L462 HydrophobicContact CB-CD2 4.19Å; L142-L462 HydrophobicContact CD1-CD2 4.28Å; L142-L462 HydrophobicContact CD2-CD2 4.49Å; L142-V468 HydrophobicContact CD1-CB 4.47Å; L142-V468 HydrophobicContact CD2-CG1 3.98Å; L142-R470 HydrophobicContact CD2-CB 3.81Å
143	V	92.4	Very high	91.4	Very high	66 Å²	66	50.8 Å²	50.8	40%	0.4	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-83.5	117.9	163.2	-175	0	0	0	0	107.3	A141 R219	A141-V143 PolarHBondContact O-N 2.95Å; V143-R219 HydrophobicContact CB-CG 4.19Å; V143-R219 HydrophobicContact CG1-CG 3.62Å; V143-R219 WeakPolarHBondContact O-CD 3.38Å; V143-R219 PolarHBondContact O-NH1 3.24Å; V143-R219 VanDerWaalsContact O-NH1 3.16Å
144	P	94.3	Very high	92	Very high	41 Å²	41	50.6 Å²	50.6	27%	0.266	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-75.2	158.2	177	31.2	-33.9	0	0	0	111	L142 L156 R470	L142-P144 WeakPolarHBondContact O-CD 3.4Å; P144-L156 HydrophobicContact CB-CD1 3.66Å; P144-L156 HydrophobicContact CG-CD1 3.65Å; P144-R470 HydrophobicContact CB-CB 4.42Å; P144-R470 HydrophobicContact CB-CG 4.25Å
145	F	95.7	Very high	92.1	Very high	3 Å²	3	49.2 Å²	49.2	1%	0.013	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-79.8	145.4	167.6	-72.2	-100.1	0	0	0	110	L217 Y218 R219 L227 E229 I469 R470 S471 P472	F145-L217 HydrophobicContact CB-CB 4.15Å; F145-L217 HydrophobicContact CB-CD1 4.34Å; F145-L217 HydrophobicContact CD1-CB 3.73Å; F145-L217 HydrophobicContact CG-CB 4.22Å; F145-L217 HydrophobicContact CG-CD1 4.42Å; F145-Y218 CarbonylContact C-O 3.59Å; F145-Y218 WeakPolarHBondContact CA-O 3.41Å; F145-R219 HydrophobicContact CD1-CB 3.61Å; F145-R219 HydrophobicContact CD2-CB 4.4Å; F145-R219 HydrophobicContact CE1-CB 3.79Å; F145-R219 HydrophobicContact CG-CB 3.94Å; F145-R219 HydrophobicContact CZ-CB 4.26Å; F145-L227 HydrophobicContact CE1-CD2 4.01Å; F145-L227 HydrophobicContact CE1-CG 4.27Å; F145-L227 HydrophobicContact CZ-CD2 3.86Å; F145-E229 HydrophobicContact CE1-CG 4.38Å; F145-I469 HydrophobicContact CD2-CG2 4.35Å; F145-I469 HydrophobicContact CE2-CD1 3.79Å; F145-I469 HydrophobicContact CZ-CD1 4.15Å; F145-R470 PolarHBondContact N-O 2.86Å; F145-S471 VanDerWaalsContact O-CA 3.3Å; F145-S471 WeakPolarHBondContact O-CA 3.28Å; F145-S471 WeakPolarHBondContact O-CB 3.34Å; F145-P472 WeakPolarHBondContact O-CD 3.47Å
146	E	94.3	Very high	91.8	Very high	24 Å²	24	42.1 Å²	42.1	11%	0.112	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	151.7	161.7	-54.6	-65.5	-152	0	0	108.9	Q155 L156 L217 Y218	E146-Q155 HydrophobicContact CB-CG 4.45Å; E146-Q155 HydrophobicContact CG-CG 4.24Å; E146-Q155 WeakPolarHBondContact OE2-CA 3.11Å; E146-L156 PolarHBondContact OE1-N 2.83Å; E146-L156 VanDerWaalsContact OE1-N 3.12Å; E146-L156 PolarHBondContact OE2-N 3.18Å; E146-L217 CarbonylContact O-C 3.32Å; E146-L217 VanDerWaalsContact O-CA 3.32Å; E146-L217 WeakPolarHBondContact O-CA 3.47Å; E146-Y218 HydrophobicContact CB-CD1 4.25Å; E146-Y218 HydrophobicContact CB-CE1 3.61Å; E146-Y218 HydrophobicContact CB-CE2 4.2Å; E146-Y218 HydrophobicContact CG-CE2 4.41Å; E146-Y218 PolarHBondContact N-O 3.43Å; E146-Y218 PolarHBondContact O-N 3.25Å
147	S	95.6	Very high	91.2	Very high	12 Å²	12	48.4 Å²	48.4	8%	0.084	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	150.8	179.4	65.8	0	0	0	0	111.6	Y154 G216 L217 P472	S147-Y154 PolarHBondContact N-O 2.87Å; S147-Y154 PolarHBondContact O-N 2.91Å; S147-G216 CarbonylContact C-O 3.55Å; S147-G216 WeakPolarHBondContact CA-O 3.44Å; S147-L217 VanDerWaalsContact CB-CD2 3.46Å; S147-P472 VanDerWaalsContact CB-O 3.28Å; S147-P472 WeakPolarHBondContact CB-O 3.37Å; S147-P472 PolarHBondContact OG-O 3.45Å
148	F	95.1	Very high	90.1	Very high	5 Å²	5	46.2 Å²	46.2	2%	0.022	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	157.4	179.1	70.6	-77.9	0	0	0	112.6	K152 V153 L177 V181 F213 G216 Y218 L230	F148-K152 CarbonylContact C-O 3.54Å; F148-K152 WeakPolarHBondContact CA-O 3.13Å; F148-K152 WeakPolarHBondContact CB-O 3.45Å; F148-V153 HydrophobicContact CB-CB 4.36Å; F148-V153 HydrophobicContact CB-CG1 4.27Å; F148-V153 HydrophobicContact CB-CG2 4.08Å; F148-L177 HydrophobicContact CB-CD1 4.35Å; F148-L177 HydrophobicContact CD1-CD2 4.21Å; F148-L177 HydrophobicContact CD2-CB 4.4Å; F148-L177 HydrophobicContact CD2-CD1 4.03Å; F148-L177 HydrophobicContact CD2-CD2 4.34Å; F148-L177 HydrophobicContact CD2-CG 4.49Å; F148-L177 HydrophobicContact CE1-CD2 3.95Å; F148-L177 HydrophobicContact CE2-CB 4.11Å; F148-L177 HydrophobicContact CE2-CD1 4.47Å; F148-L177 HydrophobicContact CE2-CD2 4.08Å; F148-L177 HydrophobicContact CE2-CG 4.44Å; F148-L177 HydrophobicContact CG-CD1 4.12Å; F148-L177 HydrophobicContact CG-CD2 4.38Å; F148-L177 HydrophobicContact CZ-CD2 3.87Å; F148-V181 HydrophobicContact CE2-CG2 4.13Å; F148-F213 HydrophobicContact CD2-CE1 4.08Å; F148-F213 AromaticContact CD2-CZ 3.99Å; F148-F213 HydrophobicContact CD2-CZ 3.99Å; F148-F213 AromaticContact CE2-CE1 3.91Å; F148-F213 HydrophobicContact CE2-CE1 3.91Å; F148-F213 AromaticContact CE2-CZ 3.55Å; F148-F213 HydrophobicContact CE2-CZ 3.55Å; F148-F213 HydrophobicContact CZ-CZ 4.06Å; F148-G216 VanDerWaalsContact CD1-C 3.48Å; F148-G216 WeakPolarHBondContact CD1-O 3.4Å; F148-G216 VanDerWaalsContact CE1-C 3.44Å; F148-G216 PolarHBondContact N-O 2.79Å; F148-G216 PolarHBondContact O-N 3.25Å; F148-Y218 AromaticContact CD1-CD1 3.53Å; F148-Y218 HydrophobicContact CD1-CD1 3.53Å; F148-Y218 AromaticContact CD1-CE1 3.9Å; F148-Y218 HydrophobicContact CD1-CE1 3.9Å; F148-Y218 AromaticContact CE1-CD1 3.71Å; F148-Y218 HydrophobicContact CE1-CD1 3.71Å; F148-Y218 HydrophobicContact CE1-CE1 4.46Å; F148-L230 HydrophobicContact CE1-CD2 4.2Å; F148-L230 HydrophobicContact CE2-CD2 4.37Å; F148-L230 HydrophobicContact CZ-CD2 3.53Å
149	T	93.4	Very high	88.8	Confident	36 Å²	36	47.6 Å²	47.6	22%	0.221	27%	0.268	C	S	.	.			trans	-120.3	-179	167.6	68.9	0	0	0	0	108.4	S151 K152	T149-S151 PolarHBondContact O-N 2.75Å; T149-S151 PolarHBondContact OG1-N 2.86Å; T149-S151 PolarHBondContact OG1-OG 2.96Å; T149-K152 PolarHBondContact N-O 2.94Å; T149-K152 PolarHBondContact OG1-N 2.84Å
150	S	88	Confident	87.3	Confident	94 Å²	94	55 Å²	55	66%	0.657	31%	0.307	S	S	*	.	S	Bend	trans	-55.9	-19.9	175.2	57.6	0	0	0	0	114.4
151	S	87.4	Confident	86	Confident	62 Å²	62	48.6 Å²	48.6	43%	0.434	29%	0.29	S	S	.	.	S	Bend	trans	-122.5	-16.9	-172.3	61.6	0	0	0	0	115.2	T149 P168	T149-S151 PolarHBondContact O-N 2.75Å; T149-S151 PolarHBondContact OG1-N 2.86Å; T149-S151 PolarHBondContact OG1-OG 2.96Å; S151-P168 VanDerWaalsContact O-CD 3.3Å; S151-P168 WeakPolarHBondContact O-CD 3.11Å
152	K	90.9	Very high	85	Confident	61 Å²	61	54.9 Å²	54.9	27%	0.265	30%	0.304	S	S	.	.			trans	-141.8	146.2	-168.9	-66.9	175.5	175.3	-155.9	0	111.1	F148 T149 Y154 E165	F148-K152 CarbonylContact C-O 3.54Å; F148-K152 WeakPolarHBondContact CA-O 3.13Å; F148-K152 WeakPolarHBondContact CB-O 3.45Å; T149-K152 PolarHBondContact N-O 2.94Å; T149-K152 PolarHBondContact OG1-N 2.84Å; K152-Y154 HydrophobicContact CB-CE1 4.42Å; K152-Y154 HydrophobicContact CB-CE2 4.18Å; K152-Y154 HydrophobicContact CD-CE1 4.36Å; K152-Y154 VanDerWaalsContact CD-OH 3.25Å; K152-Y154 WeakPolarHBondContact CD-OH 3.36Å; K152-E165 HydrophobicContact CB-CG 4.3Å; K152-E165 VanDerWaalsContact CD-CD 3.41Å; K152-E165 HydrophobicContact CD-CG 3.99Å; K152-E165 WeakPolarHBondContact CD-OE1 3.46Å; K152-E165 VanDerWaalsContact CE-CD 3.45Å; K152-E165 WeakPolarHBondContact CE-OE1 3.38Å; K152-E165 HydrophobicContact CG-CG 4.16Å; K152-E165 IonicContact NZ-OE1 3.81Å; K152-E165 PolarHBondContact NZ-OE1 2.67Å; K152-E165 IonicContact NZ-OE2 2.87Å; K152-E165 PolarHBondContact NZ-OE2 3.25Å
153	V	91.9	Very high	84.6	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.012	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	130.9	170.5	-169.8	0	0	0	0	107.6	F148 Q155 E166 P168 L177 Y218	F148-V153 HydrophobicContact CB-CB 4.36Å; F148-V153 HydrophobicContact CB-CG1 4.27Å; F148-V153 HydrophobicContact CB-CG2 4.08Å; V153-Q155 HydrophobicContact CG1-CG 3.87Å; V153-Q155 VanDerWaalsContact CG1-NE2 3.33Å; V153-E166 PolarHBondContact N-O 3.13Å; V153-E166 PolarHBondContact O-N 2.85Å; V153-P168 HydrophobicContact CG2-CB 4.12Å; V153-L177 HydrophobicContact CG2-CD1 3.66Å; V153-Y218 HydrophobicContact CG1-CE1 4.18Å; V153-Y218 WeakPolarHBondContact CG1-OH 3.35Å
154	Y	92.9	Very high	84.2	Confident	12 Å²	12	54.9 Å²	54.9	5%	0.047	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	122.9	176.9	-52	-76.3	0	0	0	108.1	S147 K152 E165 H415 W422 S474	S147-Y154 PolarHBondContact N-O 2.87Å; S147-Y154 PolarHBondContact O-N 2.91Å; K152-Y154 HydrophobicContact CB-CE1 4.42Å; K152-Y154 HydrophobicContact CB-CE2 4.18Å; K152-Y154 HydrophobicContact CD-CE1 4.36Å; K152-Y154 VanDerWaalsContact CD-OH 3.25Å; K152-Y154 WeakPolarHBondContact CD-OH 3.36Å; Y154-E165 HydrophobicContact CD1-CB 4.02Å; Y154-E165 HydrophobicContact CD1-CG 4.1Å; Y154-E165 HydrophobicContact CE1-CB 3.98Å; Y154-E165 HydrophobicContact CE1-CG 3.69Å; Y154-H415 AromaticContact CE1-ND1 3.81Å; Y154-W422 HydrophobicContact CD1-CH2 4.45Å; Y154-W422 AromaticContact CD1-CZ2 3.72Å; Y154-W422 HydrophobicContact CD1-CZ2 3.72Å; Y154-W422 HydrophobicContact CG-CZ2 4.04Å; Y154-S474 VanDerWaalsContact CE2-CB 3.47Å; Y154-S474 WeakPolarHBondContact OH-CB 3.32Å
155	Q	87.3	Confident	83.8	Confident	12 Å²	12	55.2 Å²	55.2	6%	0.056	30%	0.297	C	S	.	.			trans	-127.2	137.8	-170.9	-69.3	162.7	50.1	0	0	112	E146 V153 M158 R173 W422	E146-Q155 HydrophobicContact CB-CG 4.45Å; E146-Q155 HydrophobicContact CG-CG 4.24Å; E146-Q155 WeakPolarHBondContact OE2-CA 3.11Å; V153-Q155 HydrophobicContact CG1-CG 3.87Å; V153-Q155 VanDerWaalsContact CG1-NE2 3.33Å; Q155-M158 WeakPolarHBondContact O-CG 3.38Å; Q155-R173 VanDerWaalsContact OE1-CZ 3.31Å; Q155-R173 VanDerWaalsContact OE1-NH2 3.09Å; Q155-W422 VanDerWaalsContact O-CD1 3.24Å
156	L	86.8	Confident	83.2	Confident	18 Å²	18	57.1 Å²	57.1	9%	0.094	31%	0.306	C	S	.	.	S	Bend	trans	-77	-45.1	171.3	-59.8	-178.7	0	0	0	110.7	P144 E146 M158 V389 W422 D424 P472	P144-L156 HydrophobicContact CB-CD1 3.66Å; P144-L156 HydrophobicContact CG-CD1 3.65Å; E146-L156 PolarHBondContact OE1-N 2.83Å; E146-L156 VanDerWaalsContact OE1-N 3.12Å; E146-L156 PolarHBondContact OE2-N 3.18Å; L156-M158 PolarHBondContact O-N 3.27Å; L156-M158 VanDerWaalsContact O-N 3.09Å; L156-V389 HydrophobicContact CD1-CG2 4.19Å; L156-V389 HydrophobicContact CD2-CB 4.1Å; L156-V389 HydrophobicContact CD2-CG1 3.68Å; L156-V389 HydrophobicContact CD2-CG2 4.24Å; L156-W422 HydrophobicContact CD2-CB 3.75Å; L156-W422 HydrophobicContact CD2-CG 4.13Å; L156-D424 HydrophobicContact CD1-CB 4.48Å; L156-D424 HydrophobicContact CD2-CB 4.22Å; L156-P472 HydrophobicContact CD2-CB 4.38Å; L156-P472 HydrophobicContact CD2-CG 3.63Å; L156-P472 HydrophobicContact CG-CG 3.77Å
157	E	79.9	Confident	82.5	Confident	156 Å²	156	63.1 Å²	63.1	73%	0.729	33%	0.332	S	S	*	.	S	Bend	trans	-84.6	81.2	174.8	-70.7	-167.6	176.3	0	0	110.9	G159	E157-G159 PolarHBondContact O-N 2.59Å
158	M	68.8	Low	81.2	Confident	52 Å²	52	63.9 Å²	63.9	26%	0.256	34%	0.336	S	S	.	.			trans	-70	15	-174.8	-56.8	178.7	-80	0	0	115.5	Q155 L156 T161 R162 P164	Q155-M158 WeakPolarHBondContact O-CG 3.38Å; L156-M158 PolarHBondContact O-N 3.27Å; L156-M158 VanDerWaalsContact O-N 3.09Å; M158-T161 PolarHBondContact O-OG1 3.03Å; M158-R162 WeakPolarHBondContact O-CA 3.31Å; M158-R162 PolarHBondContact O-N 3.39Å; M158-P164 VanDerWaalsContact SD-CA 3.57Å; M158-P164 HydrophobicContact SD-CB 4.05Å; M158-P164 HydrophobicContact SD-CG 3.78Å
159	G	64.7	Low	79.4	Confident	61 Å²	61	69.5 Å²	69.5	63%	0.629	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.3	-143.3	176.9	0	0	0	0	0	115	E157	E157-G159 PolarHBondContact O-N 2.59Å
160	L	59.1	Low	78.1	Confident	179 Å²	179	76.5 Å²	76.5	94%	0.937	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-22.2	177.9	-67.1	174	0	0	0	113.4
161	T	63.1	Low	77.1	Confident	67 Å²	67	79 Å²	79	41%	0.411	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-28.6	-177.2	44.3	0	0	0	0	111.8	M158 H163 E166	M158-T161 PolarHBondContact O-OG1 3.03Å; T161-H163 PolarHBondContact O-CD2 3.15Å; T161-H163 VanDerWaalsContact O-CD2 3.29Å; T161-H163 PolarHBondContact O-N 3.19Å; T161-E166 WeakPolarHBondContact CB-OE1 3.32Å; T161-E166 PolarHBondContact OG1-OE1 3.44Å
162	R	71.2	Confident	76.4	Confident	175 Å²	175	81.3 Å²	81.3	66%	0.66	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	31.6	179.1	-57.5	-173.8	-179.6	-172.6	0.1	112.8	M158	M158-R162 WeakPolarHBondContact O-CA 3.31Å; M158-R162 PolarHBondContact O-N 3.39Å
163	H	83.3	Confident	75.7	Confident	78 Å²	78	81.5 Å²	81.5	36%	0.361	40%	0.399	S	S	.	.			trans	-97.3	120.5	177.9	-75.7	-61.5	0	0	0	109.3	T161 E165 E166	T161-H163 PolarHBondContact O-CD2 3.15Å; T161-H163 VanDerWaalsContact O-CD2 3.29Å; T161-H163 PolarHBondContact O-N 3.19Å; H163-E165 PolarHBondContact O-N 2.59Å; H163-E166 HydrophobicContact CB-CG 4.04Å
164	P	83.8	Confident	75.2	Confident	2 Å²	2	87.3 Å²	87.3	1%	0.013	42%	0.421	C	S	.	.	S	Bend	trans	-65.4	-29.5	180	-21.5	31.8	0	0	0	113.6	M158 F391 W422	M158-P164 VanDerWaalsContact SD-CA 3.57Å; M158-P164 HydrophobicContact SD-CB 4.05Å; M158-P164 HydrophobicContact SD-CG 3.78Å; P164-F391 HydrophobicContact CB-CD2 4.37Å; P164-F391 HydrophobicContact CB-CE2 3.55Å; P164-F391 HydrophobicContact CB-CZ 4.37Å; P164-F391 HydrophobicContact CG-CE2 3.77Å; P164-F391 HydrophobicContact CG-CZ 4.22Å; P164-W422 PolarHBondContact O-NE1 2.85Å
165	E	87	Confident	74.8	Confident	49 Å²	49	89.8 Å²	89.8	23%	0.229	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	127.7	173.9	176.2	-171.4	125.8	0	0	108.3	K152 Y154 H163 H415	K152-E165 HydrophobicContact CB-CG 4.3Å; K152-E165 VanDerWaalsContact CD-CD 3.41Å; K152-E165 HydrophobicContact CD-CG 3.99Å; K152-E165 WeakPolarHBondContact CD-OE1 3.46Å; K152-E165 VanDerWaalsContact CE-CD 3.45Å; K152-E165 WeakPolarHBondContact CE-OE1 3.38Å; K152-E165 HydrophobicContact CG-CG 4.16Å; K152-E165 IonicContact NZ-OE1 3.81Å; K152-E165 PolarHBondContact NZ-OE1 2.67Å; K152-E165 IonicContact NZ-OE2 2.87Å; K152-E165 PolarHBondContact NZ-OE2 3.25Å; Y154-E165 HydrophobicContact CD1-CB 4.02Å; Y154-E165 HydrophobicContact CD1-CG 4.1Å; Y154-E165 HydrophobicContact CE1-CB 3.98Å; Y154-E165 HydrophobicContact CE1-CG 3.69Å; H163-E165 PolarHBondContact O-N 2.59Å; E165-H415 HydrophobicContact CB-CB 3.64Å; E165-H415 IonicContact OE2-CG 3.07Å; E165-H415 IonicContact OE2-ND1 2.77Å; E165-H415 PolarHBondContact OE2-ND1 3.43Å
166	E	82.8	Confident	74.9	Confident	42 Å²	42	92.1 Å²	92.1	20%	0.196	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	138	172.8	-63.6	-167.2	153	0	0	109.8	V153 T161 H163	V153-E166 PolarHBondContact N-O 3.13Å; V153-E166 PolarHBondContact O-N 2.85Å; T161-E166 WeakPolarHBondContact CB-OE1 3.32Å; T161-E166 PolarHBondContact OG1-OE1 3.44Å; H163-E166 HydrophobicContact CB-CG 4.04Å
167	K	80.5	Confident	75.2	Confident	151 Å²	151	91.8 Å²	91.8	66%	0.657	44%	0.444	S	S	*	.			trans	-66.4	144.2	155.8	-68.8	-176.8	-179.8	-175.6	0	106.7	V169	K167-V169 HydrophobicContact CB-CG2 3.71Å; K167-V169 WeakPolarHBondContact O-CG2 3.44Å; K167-V169 PolarHBondContact O-N 2.92Å
168	P	66.3	Low	75.8	Confident	27 Å²	27	87.3 Å²	87.3	18%	0.175	43%	0.427	C	S	.	.			trans	-69.3	73.9	170.8	29.4	-33.2	0	0	0	109.1	S151 V153 R174	S151-P168 VanDerWaalsContact O-CD 3.3Å; S151-P168 WeakPolarHBondContact O-CD 3.11Å; V153-P168 HydrophobicContact CG2-CB 4.12Å; P168-R174 HydrophobicContact CB-CB 3.89Å; P168-R174 HydrophobicContact CB-CG 3.86Å; P168-R174 HydrophobicContact CG-CG 3.99Å; P168-R174 WeakPolarHBondContact O-CB 3.28Å; P168-R174 WeakPolarHBondContact O-CD 3.46Å
169	V	58.6	Low	77	Confident	123 Å²	123	88.5 Å²	88.5	75%	0.745	43%	0.432	S	S	*	.			trans	-81.4	-32.9	-176.1	179.6	0	0	0	0	110.2	K167 K171	K167-V169 HydrophobicContact CB-CG2 3.71Å; K167-V169 WeakPolarHBondContact O-CG2 3.44Å; K167-V169 PolarHBondContact O-N 2.92Å; V169-K171 PolarHBondContact O-N 2.89Å
170	R	65.3	Low	78.5	Confident	183 Å²	183	85.6 Å²	85.6	69%	0.691	40%	0.402	S	S	*	.	S	Bend	trans	-70.2	120.8	172.9	-65.5	-167.9	177.3	-175.9	1.7	108.8	D172 R173 R174	R170-D172 VanDerWaalsContact C-N 3.33Å; R170-D172 WeakPolarHBondContact CB-OD1 3.3Å; R170-D172 PolarHBondContact O-N 2.9Å; R170-R173 PolarHBondContact O-N 3.45Å; R170-R174 WeakPolarHBondContact O-CB 3.22Å; R170-R174 PolarHBondContact O-N 3.25Å
171	K	68.3	Low	80.2	Confident	147 Å²	147	77.7 Å²	77.7	64%	0.639	36%	0.361	S	S	*	.	H	α-helix	trans	-59.5	-43.1	-172.2	-177	179.3	176.4	-170.7	0	111.9	V169 R174 D175	V169-K171 PolarHBondContact O-N 2.89Å; K171-R174 PolarHBondContact O-N 3.09Å; K171-D175 WeakPolarHBondContact CE-OD2 3.44Å; K171-D175 VanDerWaalsContact CG-OD2 3.28Å; K171-D175 WeakPolarHBondContact CG-OD2 3.39Å; K171-D175 VanDerWaalsContact O-CB 3.28Å; K171-D175 WeakPolarHBondContact O-CB 3.42Å; K171-D175 PolarHBondContact O-N 3.12Å
172	D	71.5	Confident	81.8	Confident	111 Å²	111	79.6 Å²	79.6	59%	0.594	37%	0.365	S	S	*	.	H	α-helix	trans	-56.5	-53.5	177.8	57.1	-20.6	0	0	0	112.9	R170 R174 D175 E176	R170-D172 VanDerWaalsContact C-N 3.33Å; R170-D172 WeakPolarHBondContact CB-OD1 3.3Å; R170-D172 PolarHBondContact O-N 2.9Å; D172-R174 VanDerWaalsContact C-N 3.34Å; D172-R174 PolarHBondContact O-N 2.81Å; D172-D175 PolarHBondContact O-N 3.49Å; D172-E176 PolarHBondContact O-N 3.38Å
173	R	76.8	Confident	83	Confident	65 Å²	65	72.6 Å²	72.6	25%	0.245	34%	0.344	C	S	.	.	H	α-helix	trans	-68.3	-34.9	-179.8	-165.2	-180	-166	162.1	5.9	112.3	Q155 R170 L177 Y218	Q155-R173 VanDerWaalsContact OE1-CZ 3.31Å; Q155-R173 VanDerWaalsContact OE1-NH2 3.09Å; R170-R173 PolarHBondContact O-N 3.45Å; R173-L177 WeakPolarHBondContact O-CG 3.42Å; R173-L177 PolarHBondContact O-N 3.14Å; R173-L177 VanDerWaalsContact O-N 3.17Å; R173-Y218 VanDerWaalsContact CZ-OH 3.28Å; R173-Y218 PolarHBondContact NE-OH 3.22Å; R173-Y218 PolarHBondContact NH2-OH 2.66Å
174	R	81	Confident	83.6	Confident	124 Å²	124	68.9 Å²	68.9	47%	0.468	33%	0.327	S	S	.	.	H	α-helix	trans	-63.9	-48.8	175.3	-165.5	-170.1	93.9	-153.1	5.3	110.8	P168 R170 K171 D172 E176 L177 V178	P168-R174 HydrophobicContact CB-CB 3.89Å; P168-R174 HydrophobicContact CB-CG 3.86Å; P168-R174 HydrophobicContact CG-CG 3.99Å; P168-R174 WeakPolarHBondContact O-CB 3.28Å; P168-R174 WeakPolarHBondContact O-CD 3.46Å; R170-R174 WeakPolarHBondContact O-CB 3.22Å; R170-R174 PolarHBondContact O-N 3.25Å; K171-R174 PolarHBondContact O-N 3.09Å; D172-R174 VanDerWaalsContact C-N 3.34Å; D172-R174 PolarHBondContact O-N 2.81Å; R174-E176 VanDerWaalsContact C-N 3.27Å; R174-E176 PolarHBondContact O-N 3.37Å; R174-L177 PolarHBondContact O-N 3.44Å; R174-V178 HydrophobicContact CG-CG2 4.41Å; R174-V178 WeakPolarHBondContact O-CB 3.35Å; R174-V178 VanDerWaalsContact O-CG2 3.24Å; R174-V178 WeakPolarHBondContact O-CG2 3.43Å; R174-V178 PolarHBondContact O-N 2.84Å
175	D	85.6	Confident	84.1	Confident	64 Å²	64	69.4 Å²	69.4	34%	0.342	33%	0.33	S	S	.	.	H	α-helix	trans	-64	-36.9	-177.4	-65.7	-10.4	0	0	0	110	K171 D172 E179	K171-D175 WeakPolarHBondContact CE-OD2 3.44Å; K171-D175 VanDerWaalsContact CG-OD2 3.28Å; K171-D175 WeakPolarHBondContact CG-OD2 3.39Å; K171-D175 VanDerWaalsContact O-CB 3.28Å; K171-D175 WeakPolarHBondContact O-CB 3.42Å; K171-D175 PolarHBondContact O-N 3.12Å; D172-D175 PolarHBondContact O-N 3.49Å; D175-E179 WeakPolarHBondContact O-CB 3.35Å; D175-E179 PolarHBondContact O-N 2.79Å
176	E	88.9	Confident	84.4	Confident	61 Å²	61	72 Å²	72	29%	0.285	35%	0.346	S	S	.	.	H	α-helix	trans	-62.5	-48.2	173.7	175.4	173.3	-154.7	0	0	113.4	D172 R174 V178 E179 A180 Y228	D172-E176 PolarHBondContact O-N 3.38Å; R174-E176 VanDerWaalsContact C-N 3.27Å; R174-E176 PolarHBondContact O-N 3.37Å; E176-V178 VanDerWaalsContact C-N 3.34Å; E176-E179 PolarHBondContact O-N 3.32Å; E176-A180 PolarHBondContact O-N 2.78Å; E176-A180 VanDerWaalsContact O-N 3.09Å; E176-Y228 VanDerWaalsContact CG-OH 3.22Å; E176-Y228 WeakPolarHBondContact CG-OH 3.47Å; E176-Y228 PolarHBondContact OE1-OH 3Å
177	L	92.5	Very high	84.9	Confident	11 Å²	11	71.4 Å²	71.4	6%	0.058	34%	0.343	C	S	.	.	H	α-helix	trans	-67.9	-36.1	179.8	-65.4	178.7	0	0	0	111.9	F148 V153 R173 R174 A180 V181 Y218 Y228	F148-L177 HydrophobicContact CB-CD1 4.35Å; F148-L177 HydrophobicContact CD1-CD2 4.21Å; F148-L177 HydrophobicContact CD2-CB 4.4Å; F148-L177 HydrophobicContact CD2-CD1 4.03Å; F148-L177 HydrophobicContact CD2-CD2 4.34Å; F148-L177 HydrophobicContact CD2-CG 4.49Å; F148-L177 HydrophobicContact CE1-CD2 3.95Å; F148-L177 HydrophobicContact CE2-CB 4.11Å; F148-L177 HydrophobicContact CE2-CD1 4.47Å; F148-L177 HydrophobicContact CE2-CD2 4.08Å; F148-L177 HydrophobicContact CE2-CG 4.44Å; F148-L177 HydrophobicContact CG-CD1 4.12Å; F148-L177 HydrophobicContact CG-CD2 4.38Å; F148-L177 HydrophobicContact CZ-CD2 3.87Å; V153-L177 HydrophobicContact CG2-CD1 3.66Å; R173-L177 WeakPolarHBondContact O-CG 3.42Å; R173-L177 PolarHBondContact O-N 3.14Å; R173-L177 VanDerWaalsContact O-N 3.17Å; R174-L177 PolarHBondContact O-N 3.44Å; L177-A180 PolarHBondContact O-N 3.01Å; L177-V181 WeakPolarHBondContact O-CG2 3.45Å; L177-V181 PolarHBondContact O-N 3.33Å; L177-V181 VanDerWaalsContact O-N 3.11Å; L177-Y218 HydrophobicContact CD2-CD1 4.01Å; L177-Y218 HydrophobicContact CD2-CE1 4.11Å; L177-Y218 HydrophobicContact CD2-CG 4.4Å; L177-Y228 HydrophobicContact CD2-CE1 4Å
178	V	92.7	Very high	85.4	Confident	62 Å²	62	64.8 Å²	64.8	38%	0.376	32%	0.315	S	S	.	.	H	α-helix	trans	-65	-46.1	175	170.2	0	0	0	0	110.4	R174 E176 A180 V181 E182	R174-V178 HydrophobicContact CG-CG2 4.41Å; R174-V178 WeakPolarHBondContact O-CB 3.35Å; R174-V178 VanDerWaalsContact O-CG2 3.24Å; R174-V178 WeakPolarHBondContact O-CG2 3.43Å; R174-V178 PolarHBondContact O-N 2.84Å; E176-V178 VanDerWaalsContact C-N 3.34Å; V178-A180 VanDerWaalsContact C-N 3.27Å; V178-A180 PolarHBondContact O-N 3.09Å; V178-V181 PolarHBondContact O-N 3.16Å; V178-V181 VanDerWaalsContact O-N 3.12Å; V178-E182 HydrophobicContact CG1-CG 4.2Å; V178-E182 WeakPolarHBondContact O-CG 2.93Å; V178-E182 PolarHBondContact O-N 3.03Å
179	E	93.7	Very high	86.6	Confident	77 Å²	77	65.9 Å²	65.9	36%	0.36	32%	0.32	S	S	.	.	H	α-helix	trans	-56.4	-42	176	-174.4	-170.6	175.2	0	0	111.5	D175 E176 A183 R247 I252	D175-E179 WeakPolarHBondContact O-CB 3.35Å; D175-E179 PolarHBondContact O-N 2.79Å; E176-E179 PolarHBondContact O-N 3.32Å; E179-A183 VanDerWaalsContact O-CB 3.28Å; E179-A183 WeakPolarHBondContact O-CB 3.44Å; E179-A183 PolarHBondContact O-N 2.84Å; E179-R247 IonicContact OE1-CZ 3.79Å; E179-R247 IonicContact OE1-NH1 3.88Å; E179-R247 IonicContact OE1-NH2 3.07Å; E179-R247 PolarHBondContact OE1-NH2 2.81Å; E179-R247 IonicContact OE2-CZ 3.24Å; E179-R247 VanDerWaalsContact OE2-CZ 3.24Å; E179-R247 IonicContact OE2-NH1 2.72Å; E179-R247 PolarHBondContact OE2-NH1 3.41Å; E179-R247 IonicContact OE2-NH2 2.85Å; E179-R247 PolarHBondContact OE2-NH2 2.89Å; E179-I252 HydrophobicContact CB-CD1 4.49Å; E179-I252 HydrophobicContact CG-CD1 3.9Å
180	A	95.9	Very high	88	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-65	-40.7	177.2	0	0	0	0	0	112.6	E176 L177 V178 A184 Y228 L230 L245 I252	E176-A180 PolarHBondContact O-N 2.78Å; E176-A180 VanDerWaalsContact O-N 3.09Å; L177-A180 PolarHBondContact O-N 3.01Å; V178-A180 VanDerWaalsContact C-N 3.27Å; V178-A180 PolarHBondContact O-N 3.09Å; A180-A184 WeakPolarHBondContact O-CB 3.48Å; A180-A184 PolarHBondContact O-N 2.9Å; A180-Y228 HydrophobicContact CB-CD1 3.97Å; A180-Y228 HydrophobicContact CB-CD2 4.47Å; A180-Y228 HydrophobicContact CB-CE1 4.07Å; A180-Y228 HydrophobicContact CB-CG 4.19Å; A180-L230 HydrophobicContact CB-CD1 4.45Å; A180-L230 WeakPolarHBondContact O-CD1 3.19Å; A180-L245 VanDerWaalsContact O-CD1 3.26Å; A180-L245 WeakPolarHBondContact O-CD1 2.92Å; A180-I252 HydrophobicContact CB-CD1 4.34Å
181	V	96.3	Very high	88.8	Confident	12 Å²	12	59 Å²	59	7%	0.073	30%	0.295	C	S	.	.	H	α-helix	trans	-68.2	-44	177	173.5	0	0	0	0	111.1	F148 L177 V178 A184 L185 F213 L230 F232	F148-V181 HydrophobicContact CE2-CG2 4.13Å; L177-V181 WeakPolarHBondContact O-CG2 3.45Å; L177-V181 PolarHBondContact O-N 3.33Å; L177-V181 VanDerWaalsContact O-N 3.11Å; V178-V181 PolarHBondContact O-N 3.16Å; V178-V181 VanDerWaalsContact O-N 3.12Å; V181-A184 PolarHBondContact O-N 3.07Å; V181-L185 HydrophobicContact CG1-CD1 4.22Å; V181-L185 WeakPolarHBondContact O-CG 3.32Å; V181-L185 PolarHBondContact O-N 3.12Å; V181-F213 HydrophobicContact CG1-CB 4.49Å; V181-F213 HydrophobicContact CG1-CG 4.34Å; V181-F213 HydrophobicContact CG2-CD1 4.29Å; V181-F213 HydrophobicContact CG2-CD2 4.37Å; V181-F213 HydrophobicContact CG2-CE1 4.07Å; V181-F213 HydrophobicContact CG2-CE2 4.16Å; V181-F213 HydrophobicContact CG2-CG 4.44Å; V181-F213 HydrophobicContact CG2-CZ 4Å; V181-L230 HydrophobicContact CG2-CD2 4.48Å; V181-F232 HydrophobicContact CG1-CE1 4.22Å; V181-F232 HydrophobicContact CG1-CZ 4.27Å
182	E	95.7	Very high	89.2	Confident	108 Å²	108	56.4 Å²	56.4	51%	0.505	29%	0.288	S	S	.	.	H	α-helix	trans	-60.1	-47	176.2	-72.7	177.3	170.5	0	0	111.1	V178 A184 L185 D186	V178-E182 HydrophobicContact CG1-CG 4.2Å; V178-E182 WeakPolarHBondContact O-CG 2.93Å; V178-E182 PolarHBondContact O-N 3.03Å; E182-A184 VanDerWaalsContact C-N 3.3Å; E182-A184 PolarHBondContact O-N 2.87Å; E182-L185 PolarHBondContact O-N 3.29Å; E182-L185 VanDerWaalsContact O-N 3.17Å; E182-D186 PolarHBondContact O-N 2.81Å
183	A	95.8	Very high	88.8	Confident	27 Å²	27	60.7 Å²	60.7	22%	0.223	31%	0.305	C	S	.	.	H	α-helix	trans	-59.4	-40.2	176	0	0	0	0	0	112.3	E179 D186 I187 L245	E179-A183 VanDerWaalsContact O-CB 3.28Å; E179-A183 WeakPolarHBondContact O-CB 3.44Å; E179-A183 PolarHBondContact O-N 2.84Å; A183-D186 PolarHBondContact O-N 2.97Å; A183-I187 WeakPolarHBondContact O-CD1 3.15Å; A183-I187 VanDerWaalsContact O-CG1 3.3Å; A183-I187 WeakPolarHBondContact O-CG1 3.17Å; A183-I187 PolarHBondContact O-N 2.84Å; A183-I187 VanDerWaalsContact O-N 3.13Å; A183-L245 HydrophobicContact CB-CD1 4.1Å
184	A	96.2	Very high	88.2	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-67.8	-39.3	176.1	0	0	0	0	0	112.9	A180 V181 E182 D186 I187 I188 L230 F232 V243 L245	A180-A184 WeakPolarHBondContact O-CB 3.48Å; A180-A184 PolarHBondContact O-N 2.9Å; V181-A184 PolarHBondContact O-N 3.07Å; E182-A184 VanDerWaalsContact C-N 3.3Å; E182-A184 PolarHBondContact O-N 2.87Å; A184-D186 VanDerWaalsContact C-N 3.33Å; A184-I187 PolarHBondContact O-N 2.85Å; A184-I188 VanDerWaalsContact O-CG1 3.28Å; A184-I188 WeakPolarHBondContact O-CG1 3.28Å; A184-I188 PolarHBondContact O-N 3.19Å; A184-L230 HydrophobicContact CB-CB 4.46Å; A184-L230 HydrophobicContact CB-CD1 3.52Å; A184-F232 HydrophobicContact CB-CE2 3.8Å; A184-F232 HydrophobicContact CB-CZ 3.82Å; A184-V243 HydrophobicContact CB-CB 4.03Å; A184-V243 HydrophobicContact CB-CG1 3.97Å; A184-V243 HydrophobicContact CB-CG2 4.27Å; A184-L245 HydrophobicContact CB-CD1 4.18Å
185	L	95.1	Very high	87.2	Confident	14 Å²	14	61.7 Å²	61.7	7%	0.073	32%	0.318	C	S	.	.	H	α-helix	trans	-63.5	-40.6	175.1	-74.5	173.7	0	0	0	111.7	V181 E182 I187 I188 N189 D210 F232	V181-L185 HydrophobicContact CG1-CD1 4.22Å; V181-L185 WeakPolarHBondContact O-CG 3.32Å; V181-L185 PolarHBondContact O-N 3.12Å; E182-L185 PolarHBondContact O-N 3.29Å; E182-L185 VanDerWaalsContact O-N 3.17Å; L185-I187 VanDerWaalsContact C-N 3.33Å; L185-I187 PolarHBondContact O-N 2.91Å; L185-I188 PolarHBondContact O-N 2.87Å; L185-N189 VanDerWaalsContact O-CB 3.28Å; L185-N189 WeakPolarHBondContact O-CB 3.3Å; L185-N189 PolarHBondContact O-N 3.37Å; L185-N189 PolarHBondContact O-ND2 3.26Å; L185-D210 VanDerWaalsContact CD1-OD1 3.22Å; L185-D210 WeakPolarHBondContact CD1-OD1 3.31Å; L185-F232 HydrophobicContact CD2-CD1 3.86Å; L185-F232 HydrophobicContact CD2-CE1 3.48Å; L185-F232 VanDerWaalsContact CD2-CE1 3.48Å; L185-F232 HydrophobicContact CD2-CZ 4.22Å; L185-F232 HydrophobicContact CG-CE1 3.81Å; L185-F232 HydrophobicContact CG-CZ 4.23Å
186	D	93.8	Very high	85.8	Confident	104 Å²	104	61.7 Å²	61.7	56%	0.556	33%	0.333	S	S	*	.	H	α-helix	trans	-60.5	-43.4	175.1	-78.7	-14.9	0	0	0	111.3	E182 A183 A184 N190	E182-D186 PolarHBondContact O-N 2.81Å; A183-D186 PolarHBondContact O-N 2.97Å; A184-D186 VanDerWaalsContact C-N 3.33Å; D186-N190 WeakPolarHBondContact O-CB 3.33Å; D186-N190 PolarHBondContact O-N 2.91Å; D186-N190 PolarHBondContact O-ND2 2.9Å
187	I	92.8	Very high	84	Confident	29 Å²	29	63.1 Å²	63.1	15%	0.149	35%	0.345	C	S	.	.	H	α-helix	trans	-65.4	-43.9	176.7	-69	160.2	0	0	0	111.7	A183 A184 L185 N189 N190 V243 L245 K254	A183-I187 WeakPolarHBondContact O-CD1 3.15Å; A183-I187 VanDerWaalsContact O-CG1 3.3Å; A183-I187 WeakPolarHBondContact O-CG1 3.17Å; A183-I187 PolarHBondContact O-N 2.84Å; A183-I187 VanDerWaalsContact O-N 3.13Å; A184-I187 PolarHBondContact O-N 2.85Å; L185-I187 VanDerWaalsContact C-N 3.33Å; L185-I187 PolarHBondContact O-N 2.91Å; I187-N189 VanDerWaalsContact C-N 3.35Å; I187-N190 CarbonylContact O-C 3.58Å; I187-N190 VanDerWaalsContact O-C 3.32Å; I187-V243 HydrophobicContact CD1-CG1 4.29Å; I187-L245 HydrophobicContact CD1-CD2 3.49Å; I187-L245 VanDerWaalsContact CD1-CD2 3.49Å; I187-K254 HydrophobicContact CD1-CB 3.82Å; I187-K254 HydrophobicContact CD1-CD 4.14Å; I187-K254 HydrophobicContact CD1-CG 4Å; I187-K254 HydrophobicContact CG1-CD 4.22Å; I187-K254 HydrophobicContact CG2-CD 3.82Å; I187-K254 HydrophobicContact CG2-CG 4.43Å
188	I	91.3	Very high	81.9	Confident	11 Å²	11	70.1 Å²	70.1	6%	0.056	38%	0.378	C	S	.	.	H	α-helix	trans	-67.5	-38.2	-179	-68.2	164	0	0	0	111.2	A184 L185 Y208 F232 R241 V243	A184-I188 VanDerWaalsContact O-CG1 3.28Å; A184-I188 WeakPolarHBondContact O-CG1 3.28Å; A184-I188 PolarHBondContact O-N 3.19Å; L185-I188 PolarHBondContact O-N 2.87Å; I188-Y208 HydrophobicContact CG2-CD1 4.44Å; I188-Y208 HydrophobicContact CG2-CD2 3.34Å; I188-Y208 HydrophobicContact CG2-CE2 3.85Å; I188-Y208 HydrophobicContact CG2-CG 3.69Å; I188-F232 HydrophobicContact CD1-CB 4.36Å; I188-F232 HydrophobicContact CD1-CD1 4.48Å; I188-F232 HydrophobicContact CD1-CD2 3.33Å; I188-F232 HydrophobicContact CD1-CE2 3.62Å; I188-F232 HydrophobicContact CD1-CG 3.82Å; I188-F232 HydrophobicContact CD1-CZ 4.31Å; I188-R241 HydrophobicContact CD1-CB 3.95Å; I188-R241 HydrophobicContact CG1-CB 4.31Å; I188-R241 HydrophobicContact CG2-CB 4.49Å; I188-R241 HydrophobicContact CG2-CG 4.19Å; I188-V243 HydrophobicContact CD1-CG2 3.62Å; I188-V243 HydrophobicContact CG1-CG2 3.5Å; I188-V243 VanDerWaalsContact CG1-CG2 3.5Å
189	N	91.3	Very high	79.6	Confident	51 Å²	51	76.4 Å²	76.4	27%	0.273	40%	0.403	S	S	.	.	H	α-helix	trans	-82.3	-19.5	-177.9	-71.4	-41.4	0	0	0	113.2	L185 I187 P191 T207 Y208	L185-N189 VanDerWaalsContact O-CB 3.28Å; L185-N189 WeakPolarHBondContact O-CB 3.3Å; L185-N189 PolarHBondContact O-N 3.37Å; L185-N189 PolarHBondContact O-ND2 3.26Å; I187-N189 VanDerWaalsContact C-N 3.35Å; N189-P191 VanDerWaalsContact C-CD 3.49Å; N189-T207 WeakPolarHBondContact OD1-CA 3.25Å; N189-Y208 PolarHBondContact ND2-O 3.23Å; N189-Y208 PolarHBondContact OD1-N 2.72Å
190	N	88.6	Confident	77.1	Confident	110 Å²	110	80.1 Å²	80.1	59%	0.588	43%	0.425	S	S	*	.	S	Bend	trans	-127.6	68.3	176.3	-51.9	-79.7	0	0	0	110	D186 I187	D186-N190 WeakPolarHBondContact O-CB 3.33Å; D186-N190 PolarHBondContact O-N 2.91Å; D186-N190 PolarHBondContact O-ND2 2.9Å; I187-N190 CarbonylContact O-C 3.58Å; I187-N190 VanDerWaalsContact O-C 3.32Å
191	P	81.1	Confident	74.4	Confident	52 Å²	52	84.2 Å²	84.2	34%	0.338	45%	0.451	S	S	.	.			trans	-67.5	142.8	-178.4	28.3	-34.3	0	0	0	111.5	N189 D195 V197	N189-P191 VanDerWaalsContact C-CD 3.49Å; P191-D195 WeakPolarHBondContact CA-OD2 3.27Å; P191-D195 HydrophobicContact CB-CB 4.16Å; P191-V197 HydrophobicContact CB-CG2 4.06Å; P191-V197 HydrophobicContact CG-CG2 4.11Å
192	D	76.3	Confident	71.7	Confident	91 Å²	91	89.9 Å²	89.9	49%	0.487	49%	0.487	S	S	.	.			trans	-82.3	163.8	174.3	-59.1	-51.5	0	0	0	110.6	E194 D195 K254	D192-E194 PolarHBondContact O-N 2.89Å; D192-E194 VanDerWaalsContact O-N 3.15Å; D192-D195 PolarHBondContact N-OD2 2.86Å; D192-D195 WeakPolarHBondContact O-CB 3.35Å; D192-D195 PolarHBondContact O-N 2.8Å; D192-K254 IonicContact OD2-NZ 2.76Å; D192-K254 PolarHBondContact OD2-NZ 2.83Å
193	E	63.9	Low	69.3	Low	202 Å²	202	89.3 Å²	89.3	94%	0.944	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-57.1	-29.3	176.7	-67.4	-179.6	-178.2	0	0	112.7	D195	E193-D195 VanDerWaalsContact C-N 3.31Å; E193-D195 PolarHBondContact O-N 3.16Å
194	E	63.2	Low	66.9	Low	187 Å²	187	95.7 Å²	95.7	87%	0.874	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-75.8	-11.6	178.4	-66.7	-175.2	171.4	0	0	114.3	D192 G196	D192-E194 PolarHBondContact O-N 2.89Å; D192-E194 VanDerWaalsContact O-N 3.15Å; E194-G196 PolarHBondContact O-N 3.01Å; E194-G196 VanDerWaalsContact O-N 3.15Å
195	D	61.6	Low	65.1	Low	23 Å²	23	106.9 Å²	106.9	12%	0.123	56%	0.559	C	S	.	*	G	3₁₀ helix	trans	-79.3	9.6	-177.3	-68.3	-31.8	0	0	0	113.9	P191 D192 E193 K254	P191-D195 WeakPolarHBondContact CA-OD2 3.27Å; P191-D195 HydrophobicContact CB-CB 4.16Å; D192-D195 PolarHBondContact N-OD2 2.86Å; D192-D195 WeakPolarHBondContact O-CB 3.35Å; D192-D195 PolarHBondContact O-N 2.8Å; E193-D195 VanDerWaalsContact C-N 3.31Å; E193-D195 PolarHBondContact O-N 3.16Å; D195-K254 WeakPolarHBondContact OD1-CE 3.33Å; D195-K254 IonicContact OD1-NZ 2.71Å; D195-K254 PolarHBondContact OD1-NZ 3.12Å; D195-K254 IonicContact OD2-NZ 2.7Å; D195-K254 PolarHBondContact OD2-NZ 3.19Å
196	G	54.4	Low	63.8	Low	63 Å²	63	111.3 Å²	111.3	65%	0.649	58%	0.579	S	S	*	*			trans	69	36.1	172.2	0	0	0	0	0	114	E194 E198	E194-G196 PolarHBondContact O-N 3.01Å; E194-G196 VanDerWaalsContact O-N 3.15Å; G196-E198 PolarHBondContact O-N 2.84Å; G196-E198 VanDerWaalsContact O-N 3.16Å
197	V	52.9	Low	63.4	Low	91 Å²	91	110.7 Å²	110.7	55%	0.552	58%	0.579	S	S	*	*			trans	-71.5	107.6	172.6	-172.2	0	0	0	0	108.2	P191 E199	P191-V197 HydrophobicContact CB-CG2 4.06Å; P191-V197 HydrophobicContact CG-CG2 4.11Å; V197-E199 PolarHBondContact O-N 2.84Å; V197-E199 VanDerWaalsContact O-N 3.13Å
198	E	47.2	Very low	63.4	Low	158 Å²	158	111 Å²	111	74%	0.738	58%	0.578	S	S	*	*			trans	-56.9	116.8	168.2	-69.9	-173.8	167.6	0	0	108.8	G196 D200	G196-E198 PolarHBondContact O-N 2.84Å; G196-E198 VanDerWaalsContact O-N 3.16Å; E198-D200 PolarHBondContact O-N 3.33Å
199	E	45.5	Very low	63.5	Low	195 Å²	195	113.3 Å²	113.3	91%	0.911	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	-8.1	-174.7	-70.7	-169.2	142	0	0	114.2	V197	V197-E199 PolarHBondContact O-N 2.84Å; V197-E199 VanDerWaalsContact O-N 3.13Å
200	D	40.1	Very low	63.5	Low	154 Å²	154	115.5 Å²	115.5	82%	0.824	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.1	8.2	-162.7	-89.3	-26.5	0	0	0	116.7	E198	E198-D200 PolarHBondContact O-N 3.33Å
201	V	38.8	Very low	63.7	Low	87 Å²	87	115 Å²	115	53%	0.527	61%	0.61	S	S	.	*			trans	-110.3	122.1	173.4	-166.4	0	0	0	0	109.9	V203	V201-V203 HydrophobicContact CB-CG2 3.81Å; V201-V203 HydrophobicContact CG1-CG2 3.45Å; V201-V203 VanDerWaalsContact CG1-CG2 3.45Å; V201-V203 PolarHBondContact O-N 3.49Å
202	P	39.8	Very low	64.4	Low	130 Å²	130	114.3 Å²	114.3	84%	0.844	60%	0.603	S	S	*	*			trans	-73.4	64.3	172.9	32	-32.9	0	0	0	109.1	Q204	P202-Q204 PolarHBondContact O-N 3.39Å
203	V	45.3	Very low	65.2	Low	97 Å²	97	110.7 Å²	110.7	59%	0.588	58%	0.582	S	S	*	*			trans	-77.4	105.3	170.2	-170.6	0	0	0	0	105.2	V201 R205	V201-V203 HydrophobicContact CB-CG2 3.81Å; V201-V203 HydrophobicContact CG1-CG2 3.45Å; V201-V203 VanDerWaalsContact CG1-CG2 3.45Å; V201-V203 PolarHBondContact O-N 3.49Å; V203-R205 PolarHBondContact O-N 2.99Å
204	Q	46	Very low	66.7	Low	161 Å²	161	104.5 Å²	104.5	75%	0.752	55%	0.554	S	S	*	*			trans	-29.1	101.3	157.2	-140.2	165.4	13	0	0	108.5	P202 Q206	P202-Q204 PolarHBondContact O-N 3.39Å; Q204-Q206 VanDerWaalsContact C-N 3.33Å; Q204-Q206 WeakPolarHBondContact O-CA 3.21Å; Q204-Q206 VanDerWaalsContact O-CB 3.22Å; Q204-Q206 WeakPolarHBondContact O-CB 3.38Å; Q204-Q206 WeakPolarHBondContact O-CG 3.31Å; Q204-Q206 PolarHBondContact O-N 3.02Å
205	R	57.6	Low	68.2	Low	235 Å²	235	97.2 Å²	97.2	89%	0.887	52%	0.52	S	S	*	.			trans	-55.1	101	-174.9	-85.5	-178.1	179.6	159	-1.3	107.8	V203 T207	V203-R205 PolarHBondContact O-N 2.99Å; R205-T207 PolarHBondContact O-N 3.44Å
206	Q	68.7	Low	69.9	Low	106 Å²	106	96.1 Å²	96.1	50%	0.495	51%	0.514	S	S	.	.			trans	-95.5	92.6	-159.7	-118.3	-163.8	46.9	0	0	106.2	Q204 Y208 K234	Q204-Q206 VanDerWaalsContact C-N 3.33Å; Q204-Q206 WeakPolarHBondContact O-CA 3.21Å; Q204-Q206 VanDerWaalsContact O-CB 3.22Å; Q204-Q206 WeakPolarHBondContact O-CB 3.38Å; Q204-Q206 WeakPolarHBondContact O-CG 3.31Å; Q204-Q206 PolarHBondContact O-N 3.02Å; Q206-Y208 VanDerWaalsContact O-CD2 3.3Å; Q206-Y208 WeakPolarHBondContact O-CD2 3.4Å; Q206-Y208 WeakPolarHBondContact O-CE2 3.41Å; Q206-Y208 PolarHBondContact O-N 3.11Å; Q206-K234 PolarHBondContact O-NZ 2.77Å
207	T	86.2	Confident	71.9	Confident	91 Å²	91	93.2 Å²	93.2	56%	0.558	48%	0.484	S	S	*	.			trans	-50.7	134.5	-175.2	-46.8	0	0	0	0	112.3	N189 R205 K234	N189-T207 WeakPolarHBondContact OD1-CA 3.25Å; R205-T207 PolarHBondContact O-N 3.44Å; T207-K234 PolarHBondContact O-NZ 2.83Å; T207-K234 VanDerWaalsContact O-NZ 3.13Å
208	Y	91.6	Very high	73.9	Confident	35 Å²	35	89.6 Å²	89.6	14%	0.137	46%	0.461	C	S	.	.			trans	-95.6	149.6	170.6	-74.7	-101.7	0	0	0	109.9	I188 N189 Q206 H212 F232 K234 R241	I188-Y208 HydrophobicContact CG2-CD1 4.44Å; I188-Y208 HydrophobicContact CG2-CD2 3.34Å; I188-Y208 HydrophobicContact CG2-CE2 3.85Å; I188-Y208 HydrophobicContact CG2-CG 3.69Å; N189-Y208 PolarHBondContact ND2-O 3.23Å; N189-Y208 PolarHBondContact OD1-N 2.72Å; Q206-Y208 VanDerWaalsContact O-CD2 3.3Å; Q206-Y208 WeakPolarHBondContact O-CD2 3.4Å; Q206-Y208 WeakPolarHBondContact O-CE2 3.41Å; Q206-Y208 PolarHBondContact O-N 3.11Å; Y208-H212 HydrophobicContact CD1-CB 3.9Å; Y208-F232 HydrophobicContact CD1-CB 3.85Å; Y208-F232 HydrophobicContact CE1-CB 4.06Å; Y208-K234 HydrophobicContact CE1-CG 4.07Å; Y208-R241 HydrophobicContact CE1-CB 4.43Å; Y208-R241 HydrophobicContact CE1-CG 3.94Å; Y208-R241 HydrophobicContact CE2-CG 3.98Å; Y208-R241 VanDerWaalsContact CZ-CG 3.5Å; Y208-R241 WeakPolarHBondContact OH-CG 3.41Å
209	T	93.8	Very high	76.1	Confident	60 Å²	60	82.3 Å²	82.3	37%	0.368	43%	0.426	S	S	.	.			trans	-143.8	169.3	-174.6	52.6	0	0	0	0	108	S211 H212	T209-S211 PolarHBondContact O-N 3.13Å; T209-S211 VanDerWaalsContact O-N 3.09Å; T209-S211 PolarHBondContact OG1-OG 2.73Å; T209-H212 PolarHBondContact N-ND1 2.89Å; T209-H212 VanDerWaalsContact N-ND1 3.12Å; T209-H212 WeakPolarHBondContact O-CB 3.16Å; T209-H212 PolarHBondContact O-N 2.99Å; T209-H212 PolarHBondContact OG1-CE1 2.81Å; T209-H212 VanDerWaalsContact OG1-CE1 3.25Å; T209-H212 PolarHBondContact OG1-ND1 3.09Å
210	D	92	Very high	78.3	Confident	97 Å²	97	76.4 Å²	76.4	52%	0.519	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-55.7	-30	-179.9	-59.3	-58.5	0	0	0	113.9	L185 H212 F213	L185-D210 VanDerWaalsContact CD1-OD1 3.22Å; L185-D210 WeakPolarHBondContact CD1-OD1 3.31Å; D210-H212 PolarHBondContact O-N 3.18Å; D210-F213 VanDerWaalsContact O-CB 3.31Å; D210-F213 WeakPolarHBondContact O-CB 3.49Å; D210-F213 PolarHBondContact O-N 3.27Å; D210-F213 VanDerWaalsContact O-N 3.11Å
211	S	92.5	Very high	80.5	Confident	100 Å²	100	69.9 Å²	69.9	70%	0.699	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-64.1	-21.2	176.3	57.5	0	0	0	0	113.7	T209	T209-S211 PolarHBondContact O-N 3.13Å; T209-S211 VanDerWaalsContact O-N 3.09Å; T209-S211 PolarHBondContact OG1-OG 2.73Å
212	H	94.2	Very high	82.8	Confident	38 Å²	38	76.3 Å²	76.3	18%	0.176	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-88.7	-6.8	177.9	-59.4	116.6	0	0	0	112.5	Y208 T209 D210 M214 F232 A233	Y208-H212 HydrophobicContact CD1-CB 3.9Å; T209-H212 PolarHBondContact N-ND1 2.89Å; T209-H212 VanDerWaalsContact N-ND1 3.12Å; T209-H212 WeakPolarHBondContact O-CB 3.16Å; T209-H212 PolarHBondContact O-N 2.99Å; T209-H212 PolarHBondContact OG1-CE1 2.81Å; T209-H212 VanDerWaalsContact OG1-CE1 3.25Å; T209-H212 PolarHBondContact OG1-ND1 3.09Å; D210-H212 PolarHBondContact O-N 3.18Å; H212-M214 PolarHBondContact O-N 2.77Å; H212-F232 CarbonylContact O-C 3.56Å; H212-F232 WeakPolarHBondContact O-CA 3.13Å; H212-F232 WeakPolarHBondContact O-CB 3.37Å; H212-A233 WeakPolarHBondContact CA-O 3.5Å; H212-A233 WeakPolarHBondContact CB-O 3.37Å; H212-A233 PolarHBondContact O-N 3.44Å
213	F	94.9	Very high	85	Confident	15 Å²	15	75.4 Å²	75.4	7%	0.066	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	122.1	175.1	178.1	-120.4	0	0	0	110.1	F148 V181 D210 E215 L230 F232	F148-F213 HydrophobicContact CD2-CE1 4.08Å; F148-F213 AromaticContact CD2-CZ 3.99Å; F148-F213 HydrophobicContact CD2-CZ 3.99Å; F148-F213 AromaticContact CE2-CE1 3.91Å; F148-F213 HydrophobicContact CE2-CE1 3.91Å; F148-F213 AromaticContact CE2-CZ 3.55Å; F148-F213 HydrophobicContact CE2-CZ 3.55Å; F148-F213 HydrophobicContact CZ-CZ 4.06Å; V181-F213 HydrophobicContact CG1-CB 4.49Å; V181-F213 HydrophobicContact CG1-CG 4.34Å; V181-F213 HydrophobicContact CG2-CD1 4.29Å; V181-F213 HydrophobicContact CG2-CD2 4.37Å; V181-F213 HydrophobicContact CG2-CE1 4.07Å; V181-F213 HydrophobicContact CG2-CE2 4.16Å; V181-F213 HydrophobicContact CG2-CG 4.44Å; V181-F213 HydrophobicContact CG2-CZ 4Å; D210-F213 VanDerWaalsContact O-CB 3.31Å; D210-F213 WeakPolarHBondContact O-CB 3.49Å; D210-F213 PolarHBondContact O-N 3.27Å; D210-F213 VanDerWaalsContact O-N 3.11Å; F213-E215 VanDerWaalsContact CE2-C 3.47Å; F213-E215 VanDerWaalsContact CE2-O 3.25Å; F213-E215 WeakPolarHBondContact CE2-O 3.45Å; F213-L230 HydrophobicContact CE2-CB 4.4Å; F213-L230 HydrophobicContact CE2-CD2 3.88Å; F213-L230 HydrophobicContact CZ-CD2 4.22Å; F213-F232 HydrophobicContact CB-CD1 3.89Å; F213-F232 HydrophobicContact CB-CE1 3.72Å; F213-F232 HydrophobicContact CD2-CD1 4.23Å; F213-F232 AromaticContact CD2-CE1 3.82Å; F213-F232 HydrophobicContact CD2-CE1 3.82Å; F213-F232 HydrophobicContact CD2-CE2 4.37Å; F213-F232 AromaticContact CD2-CZ 3.9Å; F213-F232 HydrophobicContact CD2-CZ 3.9Å; F213-F232 HydrophobicContact CG-CE1 4.19Å
214	M	93.9	Very high	87	Confident	71 Å²	71	72.4 Å²	72.4	35%	0.35	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	-58.6	-179.3	-67.6	-178.1	-63	0	0	112.1	H212 F231 A233 F240	H212-M214 PolarHBondContact O-N 2.77Å; M214-F231 HydrophobicContact CE-CB 4.32Å; M214-F231 PolarHBondContact N-O 3.04Å; M214-A233 HydrophobicContact CE-CB 3.37Å; M214-A233 HydrophobicContact SD-CB 3.56Å; M214-A233 VanDerWaalsContact SD-CB 3.56Å; M214-F240 HydrophobicContact CE-CD1 3.16Å; M214-F240 HydrophobicContact CE-CE1 3.22Å; M214-F240 HydrophobicContact CE-CG 4.39Å; M214-F240 HydrophobicContact CE-CZ 4.49Å; M214-F240 HydrophobicContact SD-CD1 4.32Å; M214-F240 HydrophobicContact SD-CE1 3.8Å
215	E	95.1	Very high	89.2	Confident	34 Å²	34	64.9 Å²	64.9	16%	0.159	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	144.7	-175.3	69.1	-179.8	174.7	0	0	111.1	F213 F231 T374 L377 H378	F213-E215 VanDerWaalsContact CE2-C 3.47Å; F213-E215 VanDerWaalsContact CE2-O 3.25Å; F213-E215 WeakPolarHBondContact CE2-O 3.45Å; E215-F231 HydrophobicContact CG-CB 3.99Å; E215-F231 HydrophobicContact CG-CD2 3.95Å; E215-F231 HydrophobicContact CG-CG 4.28Å; E215-F231 PolarHBondContact O-N 3.28Å; E215-T374 PolarHBondContact OE2-OG1 2.96Å; E215-L377 WeakPolarHBondContact OE1-CD1 3.37Å; E215-H378 IonicContact OE1-CD2 3.92Å; E215-H378 IonicContact OE1-NE2 2.84Å
216	G	96.8	Very high	90.9	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	140.5	169.4	0	0	0	0	0	110.3	S147 F148 E229	S147-G216 CarbonylContact C-O 3.55Å; S147-G216 WeakPolarHBondContact CA-O 3.44Å; F148-G216 VanDerWaalsContact CD1-C 3.48Å; F148-G216 WeakPolarHBondContact CD1-O 3.4Å; F148-G216 VanDerWaalsContact CE1-C 3.44Å; F148-G216 PolarHBondContact N-O 2.79Å; F148-G216 PolarHBondContact O-N 3.25Å; G216-E229 CarbonylContact C-O 3.58Å; G216-E229 VanDerWaalsContact CA-O 3.31Å; G216-E229 WeakPolarHBondContact CA-O 3.48Å
217	L	96.9	Very high	92.1	Very high	3 Å²	3	49.3 Å²	49.3	2%	0.016	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	143.4	164.5	-57.8	-170.1	0	0	0	109	F145 E146 S147 Y228 E229 H378 I469	F145-L217 HydrophobicContact CB-CB 4.15Å; F145-L217 HydrophobicContact CB-CD1 4.34Å; F145-L217 HydrophobicContact CD1-CB 3.73Å; F145-L217 HydrophobicContact CG-CB 4.22Å; F145-L217 HydrophobicContact CG-CD1 4.42Å; E146-L217 CarbonylContact O-C 3.32Å; E146-L217 VanDerWaalsContact O-CA 3.32Å; E146-L217 WeakPolarHBondContact O-CA 3.47Å; S147-L217 VanDerWaalsContact CB-CD2 3.46Å; L217-Y228 CarbonylContact O-C 3.57Å; L217-Y228 WeakPolarHBondContact O-CA 3.36Å; L217-E229 HydrophobicContact CB-CB 4.33Å; L217-E229 PolarHBondContact N-O 2.65Å; L217-E229 PolarHBondContact O-N 3.15Å; L217-H378 WeakPolarHBondContact CD1-CE1 3.3Å; L217-I469 HydrophobicContact CD1-CG2 3.78Å
218	Y	95.1	Very high	92.6	Very high	15 Å²	15	45 Å²	45	6%	0.059	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	153.4	168.3	70.8	-77.2	0	0	0	112.3	F145 E146 F148 V153 R173 L177 T226 L227 Y228	F145-Y218 CarbonylContact C-O 3.59Å; F145-Y218 WeakPolarHBondContact CA-O 3.41Å; E146-Y218 HydrophobicContact CB-CD1 4.25Å; E146-Y218 HydrophobicContact CB-CE1 3.61Å; E146-Y218 HydrophobicContact CB-CE2 4.2Å; E146-Y218 HydrophobicContact CG-CE2 4.41Å; E146-Y218 PolarHBondContact N-O 3.43Å; E146-Y218 PolarHBondContact O-N 3.25Å; F148-Y218 AromaticContact CD1-CD1 3.53Å; F148-Y218 HydrophobicContact CD1-CD1 3.53Å; F148-Y218 AromaticContact CD1-CE1 3.9Å; F148-Y218 HydrophobicContact CD1-CE1 3.9Å; F148-Y218 AromaticContact CE1-CD1 3.71Å; F148-Y218 HydrophobicContact CE1-CD1 3.71Å; F148-Y218 HydrophobicContact CE1-CE1 4.46Å; V153-Y218 HydrophobicContact CG1-CE1 4.18Å; V153-Y218 WeakPolarHBondContact CG1-OH 3.35Å; R173-Y218 VanDerWaalsContact CZ-OH 3.28Å; R173-Y218 PolarHBondContact NE-OH 3.22Å; R173-Y218 PolarHBondContact NH2-OH 2.66Å; L177-Y218 HydrophobicContact CD2-CD1 4.01Å; L177-Y218 HydrophobicContact CD2-CE1 4.11Å; L177-Y218 HydrophobicContact CD2-CG 4.4Å; Y218-T226 HydrophobicContact CD2-CG2 4.19Å; Y218-L227 CarbonylContact C-O 3.57Å; Y218-L227 WeakPolarHBondContact CA-O 3.33Å; Y218-L227 WeakPolarHBondContact CB-O 3.22Å; Y218-Y228 VanDerWaalsContact CB-CD1 3.5Å; Y218-Y228 HydrophobicContact CG-CD1 4.44Å; Y218-Y228 HydrophobicContact CG-CE1 4.16Å
219	R	93.3	Very high	92.9	Very high	5 Å²	5	43.6 Å²	43.6	2%	0.019	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	131.2	178.9	-178.7	178	75.2	171.9	7	110	E129 V143 F145 E221 T226 L227	E129-R219 IonicContact OE2-CZ 3.7Å; E129-R219 IonicContact OE2-NH1 3.37Å; E129-R219 PolarHBondContact OE2-NH1 2.98Å; E129-R219 IonicContact OE2-NH2 2.86Å; E129-R219 PolarHBondContact OE2-NH2 2.95Å; V143-R219 HydrophobicContact CB-CG 4.19Å; V143-R219 HydrophobicContact CG1-CG 3.62Å; V143-R219 WeakPolarHBondContact O-CD 3.38Å; V143-R219 PolarHBondContact O-NH1 3.24Å; V143-R219 VanDerWaalsContact O-NH1 3.16Å; F145-R219 HydrophobicContact CD1-CB 3.61Å; F145-R219 HydrophobicContact CD2-CB 4.4Å; F145-R219 HydrophobicContact CE1-CB 3.79Å; F145-R219 HydrophobicContact CG-CB 3.94Å; F145-R219 HydrophobicContact CZ-CB 4.26Å; R219-E221 IonicContact CZ-OE1 3.34Å; R219-E221 IonicContact NE-OE1 3.56Å; R219-E221 IonicContact NH2-OE1 3.18Å; R219-E221 PolarHBondContact NH2-OE1 2.88Å; R219-T226 CarbonylContact O-C 3.53Å; R219-T226 VanDerWaalsContact O-CA 3.32Å; R219-T226 WeakPolarHBondContact O-CA 3.42Å; R219-L227 PolarHBondContact N-O 3.19Å; R219-L227 PolarHBondContact O-N 3.1Å
220	T	91.2	Very high	93.1	Very high	70 Å²	70	40.8 Å²	40.8	43%	0.429	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	114.1	177.2	-53.3	0	0	0	0	110.8	G225 T226	T220-G225 CarbonylContact C-O 3.58Å; T220-G225 WeakPolarHBondContact CA-O 3.39Å; T220-T226 WeakPolarHBondContact CG2-OG1 3.47Å; T220-T226 WeakPolarHBondContact OG1-CG2 2.92Å; T220-T226 PolarHBondContact OG1-OG1 2.77Å
221	E	88	Confident	93.3	Very high	17 Å²	17	36.2 Å²	36.2	8%	0.079	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	118.9	167.3	-69.1	-180	-129	0	0	108.3	R219 D223 K224 G225	R219-E221 IonicContact CZ-OE1 3.34Å; R219-E221 IonicContact NE-OE1 3.56Å; R219-E221 IonicContact NH2-OE1 3.18Å; R219-E221 PolarHBondContact NH2-OE1 2.88Å; E221-D223 PolarHBondContact O-N 3.12Å; E221-K224 HydrophobicContact CB-CB 4.15Å; E221-K224 HydrophobicContact CB-CD 4.48Å; E221-K224 HydrophobicContact CB-CG 4.39Å; E221-K224 PolarHBondContact O-N 3.05Å; E221-K224 VanDerWaalsContact OE2-CD 3.29Å; E221-K224 WeakPolarHBondContact OE2-CD 3.29Å; E221-K224 VanDerWaalsContact OE2-CE 3.23Å; E221-K224 WeakPolarHBondContact OE2-CE 3.46Å; E221-K224 IonicContact OE2-NZ 2.71Å; E221-K224 PolarHBondContact OE2-NZ 3.02Å; E221-G225 PolarHBondContact N-O 2.87Å; E221-G225 PolarHBondContact O-N 2.88Å
222	R	87	Confident	93.4	Very high	222 Å²	222	31.4 Å²	31.4	84%	0.838	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-22.1	-167	-67.2	-176.7	-179.6	178.7	2	114.5	F249	R222-F249 WeakPolarHBondContact O-CZ 3.27Å
223	D	85.1	Confident	93.3	Very high	112 Å²	112	30 Å²	30	60%	0.599	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.2	-5.7	-177.1	62.2	-37.3	0	0	0	113.7	E221	E221-D223 PolarHBondContact O-N 3.12Å
224	K	87.5	Confident	92.9	Very high	34 Å²	34	31.1 Å²	31.1	15%	0.148	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.4	-44.3	-174.8	-52.5	-178.4	-162.7	160.6	0	113.7	K127 A128 E221 F246	K127-K224 HydrophobicContact CB-CD 4.42Å; K127-K224 WeakPolarHBondContact O-CE 3.33Å; K127-K224 PolarHBondContact O-NZ 2.73Å; A128-K224 HydrophobicContact CB-CD 4.02Å; E221-K224 HydrophobicContact CB-CB 4.15Å; E221-K224 HydrophobicContact CB-CD 4.48Å; E221-K224 HydrophobicContact CB-CG 4.39Å; E221-K224 PolarHBondContact O-N 3.05Å; E221-K224 VanDerWaalsContact OE2-CD 3.29Å; E221-K224 WeakPolarHBondContact OE2-CD 3.29Å; E221-K224 VanDerWaalsContact OE2-CE 3.23Å; E221-K224 WeakPolarHBondContact OE2-CE 3.46Å; E221-K224 IonicContact OE2-NZ 2.71Å; E221-K224 PolarHBondContact OE2-NZ 3.02Å; K224-F246 HydrophobicContact CB-CZ 4.02Å; K224-F246 WeakPolarHBondContact O-CZ 3.48Å
225	G	91.1	Very high	92.1	Very high	3 Å²	3	36.7 Å²	36.7	3%	0.031	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	137.2	-165.6	-174	0	0	0	0	0	114	T220 E221 R247	T220-G225 CarbonylContact C-O 3.58Å; T220-G225 WeakPolarHBondContact CA-O 3.39Å; E221-G225 PolarHBondContact N-O 2.87Å; E221-G225 PolarHBondContact O-N 2.88Å; G225-R247 CarbonylContact C-O 3.47Å; G225-R247 WeakPolarHBondContact CA-O 3.34Å
226	T	93.9	Very high	90.8	Very high	10 Å²	10	43.4 Å²	43.4	6%	0.061	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	123.3	-177	-53.2	0	0	0	0	111.3	Y218 R219 T220 Y228 R247	Y218-T226 HydrophobicContact CD2-CG2 4.19Å; R219-T226 CarbonylContact O-C 3.53Å; R219-T226 VanDerWaalsContact O-CA 3.32Å; R219-T226 WeakPolarHBondContact O-CA 3.42Å; T220-T226 WeakPolarHBondContact CG2-OG1 3.47Å; T220-T226 WeakPolarHBondContact OG1-CG2 2.92Å; T220-T226 PolarHBondContact OG1-OG1 2.77Å; T226-Y228 HydrophobicContact CG2-CD2 4.16Å; T226-Y228 HydrophobicContact CG2-CE1 3.97Å; T226-Y228 HydrophobicContact CG2-CE2 3.49Å; T226-Y228 VanDerWaalsContact CG2-CE2 3.49Å; T226-Y228 WeakPolarHBondContact CG2-OH 3.42Å; T226-R247 PolarHBondContact N-O 2.89Å; T226-R247 PolarHBondContact O-N 3.49Å
227	L	94.9	Very high	89.7	Confident	4 Å²	4	45.3 Å²	45.3	2%	0.021	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	137.4	169.1	175.1	60.4	0	0	0	109.6	V130 F145 Y218 R219 L245 F246	V130-L227 HydrophobicContact CG1-CD1 4.36Å; V130-L227 HydrophobicContact CG2-CD1 4.05Å; V130-L227 HydrophobicContact CG2-CD2 4.25Å; F145-L227 HydrophobicContact CE1-CD2 4.01Å; F145-L227 HydrophobicContact CE1-CG 4.27Å; F145-L227 HydrophobicContact CZ-CD2 3.86Å; Y218-L227 CarbonylContact C-O 3.57Å; Y218-L227 WeakPolarHBondContact CA-O 3.33Å; Y218-L227 WeakPolarHBondContact CB-O 3.22Å; R219-L227 PolarHBondContact N-O 3.19Å; R219-L227 PolarHBondContact O-N 3.1Å; L227-L245 WeakPolarHBondContact CD1-O 3.36Å; L227-F246 HydrophobicContact CB-CD2 4.17Å
228	Y	96.7	Very high	89.1	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	131.9	173.9	-61.7	-87.4	0	0	0	109.9	E176 L177 A180 L217 Y218 T226 S244 L245 R247	E176-Y228 VanDerWaalsContact CG-OH 3.22Å; E176-Y228 WeakPolarHBondContact CG-OH 3.47Å; E176-Y228 PolarHBondContact OE1-OH 3Å; L177-Y228 HydrophobicContact CD2-CE1 4Å; A180-Y228 HydrophobicContact CB-CD1 3.97Å; A180-Y228 HydrophobicContact CB-CD2 4.47Å; A180-Y228 HydrophobicContact CB-CE1 4.07Å; A180-Y228 HydrophobicContact CB-CG 4.19Å; L217-Y228 CarbonylContact O-C 3.57Å; L217-Y228 WeakPolarHBondContact O-CA 3.36Å; Y218-Y228 VanDerWaalsContact CB-CD1 3.5Å; Y218-Y228 HydrophobicContact CG-CD1 4.44Å; Y218-Y228 HydrophobicContact CG-CE1 4.16Å; T226-Y228 HydrophobicContact CG2-CD2 4.16Å; T226-Y228 HydrophobicContact CG2-CE1 3.97Å; T226-Y228 HydrophobicContact CG2-CE2 3.49Å; T226-Y228 VanDerWaalsContact CG2-CE2 3.49Å; T226-Y228 WeakPolarHBondContact CG2-OH 3.42Å; Y228-S244 CarbonylContact O-C 3.58Å; Y228-S244 VanDerWaalsContact O-CA 3.31Å; Y228-S244 WeakPolarHBondContact O-CA 3.35Å; Y228-L245 HydrophobicContact CD2-CB 4.46Å; Y228-L245 PolarHBondContact N-O 3.39Å; Y228-L245 PolarHBondContact O-N 3.37Å; Y228-R247 HydrophobicContact CE2-CB 3.95Å
229	E	96.9	Very high	88.8	Confident	6 Å²	6	48.2 Å²	48.2	3%	0.028	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	112.6	170.4	-61	-84.4	119.5	0	0	107.4	F145 G216 L217 F231 H242 S244 K384	F145-E229 HydrophobicContact CE1-CG 4.38Å; G216-E229 CarbonylContact C-O 3.58Å; G216-E229 VanDerWaalsContact CA-O 3.31Å; G216-E229 WeakPolarHBondContact CA-O 3.48Å; L217-E229 HydrophobicContact CB-CB 4.33Å; L217-E229 PolarHBondContact N-O 2.65Å; L217-E229 PolarHBondContact O-N 3.15Å; E229-F231 HydrophobicContact CB-CE2 4.05Å; E229-H242 IonicContact OE1-NE2 3.03Å; E229-H242 IonicContact OE2-CE1 3.33Å; E229-H242 PolarHBondContact OE2-CE1 2.76Å; E229-H242 IonicContact OE2-NE2 3.8Å; E229-H242 PolarHBondContact OE2-NE2 2.87Å; E229-S244 VanDerWaalsContact OE1-CB 3.32Å; E229-S244 WeakPolarHBondContact OE1-CB 3.25Å; E229-S244 PolarHBondContact OE1-OG 3.15Å; E229-K384 IonicContact OE2-NZ 2.79Å; E229-K384 PolarHBondContact OE2-NZ 2.97Å
230	L	97.7	Very high	88.8	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	130.5	-169.9	-57.7	168.8	0	0	0	110.2	F148 A180 V181 A184 F213 F232 H242 V243 L245	F148-L230 HydrophobicContact CE1-CD2 4.2Å; F148-L230 HydrophobicContact CE2-CD2 4.37Å; F148-L230 HydrophobicContact CZ-CD2 3.53Å; A180-L230 HydrophobicContact CB-CD1 4.45Å; A180-L230 WeakPolarHBondContact O-CD1 3.19Å; V181-L230 HydrophobicContact CG2-CD2 4.48Å; A184-L230 HydrophobicContact CB-CB 4.46Å; A184-L230 HydrophobicContact CB-CD1 3.52Å; F213-L230 HydrophobicContact CE2-CB 4.4Å; F213-L230 HydrophobicContact CE2-CD2 3.88Å; F213-L230 HydrophobicContact CZ-CD2 4.22Å; L230-F232 HydrophobicContact CB-CE2 3.82Å; L230-F232 HydrophobicContact CB-CZ 4.46Å; L230-H242 WeakPolarHBondContact O-CA 3.28Å; L230-V243 PolarHBondContact N-O 2.81Å; L230-V243 PolarHBondContact O-N 3.27Å; L230-L245 HydrophobicContact CD1-CD1 3.79Å; L230-L245 HydrophobicContact CD1-CG 4.35Å
231	F	96.5	Very high	89	Confident	1 Å²	1	46.6 Å²	46.6	0%	0.004	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	130.8	-177.2	-62.2	-92.1	0	0	0	111.6	M214 E215 E229 R241 H242 L377 H378	M214-F231 HydrophobicContact CE-CB 4.32Å; M214-F231 PolarHBondContact N-O 3.04Å; E215-F231 HydrophobicContact CG-CB 3.99Å; E215-F231 HydrophobicContact CG-CD2 3.95Å; E215-F231 HydrophobicContact CG-CG 4.28Å; E215-F231 PolarHBondContact O-N 3.28Å; E229-F231 HydrophobicContact CB-CE2 4.05Å; F231-R241 WeakPolarHBondContact CA-O 3.46Å; F231-H242 HydrophobicContact CD1-CB 3.92Å; F231-H242 AromaticContact CD1-CD2 3.9Å; F231-H242 HydrophobicContact CE1-CB 3.71Å; F231-H242 AromaticContact CE1-CD2 3.33Å; F231-H242 WeakPolarHBondContact CE1-CD2 3.39Å; F231-H242 AromaticContact CE1-CG 3.51Å; F231-H242 AromaticContact CE2-CD2 3.79Å; F231-H242 AromaticContact CZ-CD2 3.28Å; F231-H242 WeakPolarHBondContact CZ-CD2 3Å; F231-H242 AromaticContact CZ-CG 3.87Å; F231-H242 AromaticContact CZ-NE2 3.6Å; F231-L377 HydrophobicContact CB-CD1 4.37Å; F231-L377 HydrophobicContact CD1-CB 4.14Å; F231-L377 HydrophobicContact CD1-CD1 3.8Å; F231-L377 HydrophobicContact CD1-CD2 3.88Å; F231-L377 HydrophobicContact CD1-CG 4.14Å; F231-L377 HydrophobicContact CE1-CB 3.77Å; F231-L377 HydrophobicContact CE1-CD1 4.3Å; F231-L377 HydrophobicContact CE1-CD2 3.98Å; F231-L377 HydrophobicContact CE1-CG 4.22Å; F231-L377 HydrophobicContact CG-CD1 4.1Å; F231-L377 HydrophobicContact CZ-CB 4.18Å; F231-H378 AromaticContact CE2-CE1 3.27Å; F231-H378 WeakPolarHBondContact CE2-CE1 3.43Å; F231-H378 AromaticContact CE2-NE2 3.63Å; F231-H378 AromaticContact CZ-CE1 3.67Å
232	F	95.3	Very high	89.3	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	139.9	178.5	-56.2	-103.1	0	0	0	109.6	V181 A184 L185 I188 Y208 H212 F213 L230 F240 R241	V181-F232 HydrophobicContact CG1-CE1 4.22Å; V181-F232 HydrophobicContact CG1-CZ 4.27Å; A184-F232 HydrophobicContact CB-CE2 3.8Å; A184-F232 HydrophobicContact CB-CZ 3.82Å; L185-F232 HydrophobicContact CD2-CD1 3.86Å; L185-F232 HydrophobicContact CD2-CE1 3.48Å; L185-F232 VanDerWaalsContact CD2-CE1 3.48Å; L185-F232 HydrophobicContact CD2-CZ 4.22Å; L185-F232 HydrophobicContact CG-CE1 3.81Å; L185-F232 HydrophobicContact CG-CZ 4.23Å; I188-F232 HydrophobicContact CD1-CB 4.36Å; I188-F232 HydrophobicContact CD1-CD1 4.48Å; I188-F232 HydrophobicContact CD1-CD2 3.33Å; I188-F232 HydrophobicContact CD1-CE2 3.62Å; I188-F232 HydrophobicContact CD1-CG 3.82Å; I188-F232 HydrophobicContact CD1-CZ 4.31Å; Y208-F232 HydrophobicContact CD1-CB 3.85Å; Y208-F232 HydrophobicContact CE1-CB 4.06Å; H212-F232 CarbonylContact O-C 3.56Å; H212-F232 WeakPolarHBondContact O-CA 3.13Å; H212-F232 WeakPolarHBondContact O-CB 3.37Å; F213-F232 HydrophobicContact CB-CD1 3.89Å; F213-F232 HydrophobicContact CB-CE1 3.72Å; F213-F232 HydrophobicContact CD2-CD1 4.23Å; F213-F232 AromaticContact CD2-CE1 3.82Å; F213-F232 HydrophobicContact CD2-CE1 3.82Å; F213-F232 HydrophobicContact CD2-CE2 4.37Å; F213-F232 AromaticContact CD2-CZ 3.9Å; F213-F232 HydrophobicContact CD2-CZ 3.9Å; F213-F232 HydrophobicContact CG-CE1 4.19Å; L230-F232 HydrophobicContact CB-CE2 3.82Å; L230-F232 HydrophobicContact CB-CZ 4.46Å; F232-F240 CarbonylContact O-C 3.59Å; F232-F240 WeakPolarHBondContact O-CA 3.48Å; F232-R241 HydrophobicContact CB-CB 4.33Å; F232-R241 PolarHBondContact N-O 3.36Å; F232-R241 PolarHBondContact O-N 3Å
233	A	92.4	Very high	89.7	Confident	9 Å²	9	35.6 Å²	35.6	7%	0.074	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	161.6	167.1	0	0	0	0	0	110.7	H212 M214 F240	H212-A233 WeakPolarHBondContact CA-O 3.5Å; H212-A233 WeakPolarHBondContact CB-O 3.37Å; H212-A233 PolarHBondContact O-N 3.44Å; M214-A233 HydrophobicContact CE-CB 3.37Å; M214-A233 HydrophobicContact SD-CB 3.56Å; M214-A233 VanDerWaalsContact SD-CB 3.56Å; A233-F240 HydrophobicContact CB-CD1 4.04Å; A233-F240 HydrophobicContact CB-CE1 4.11Å; A233-F240 HydrophobicContact CB-CG 4.45Å
234	K	85.6	Confident	90.2	Very high	38 Å²	38	30.5 Å²	30.5	17%	0.165	16%	0.162	C	C	.	.			trans	-92.8	158.1	170.1	-62.2	-166.9	174.1	-154.8	0	109.3	Q206 T207 Y208 D236 S237	Q206-K234 PolarHBondContact O-NZ 2.77Å; T207-K234 PolarHBondContact O-NZ 2.83Å; T207-K234 VanDerWaalsContact O-NZ 3.13Å; Y208-K234 HydrophobicContact CE1-CG 4.07Å; K234-D236 PolarHBondContact O-N 2.99Å; K234-S237 PolarHBondContact N-OG 2.93Å; K234-S237 PolarHBondContact O-N 2.76Å; K234-S237 VanDerWaalsContact O-N 3.15Å; K234-S237 PolarHBondContact O-OG 3.29Å
235	E	77.6	Confident	90.6	Very high	188 Å²	188	29 Å²	29	88%	0.879	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.1	131.1	-178	-70.7	-178.1	168.6	0	0	110.7	S237	E235-S237 PolarHBondContact O-N 3.1Å; E235-S237 VanDerWaalsContact O-N 3.11Å
236	D	66.2	Low	90.7	Very high	174 Å²	174	28.8 Å²	28.8	93%	0.93	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.3	18.9	178.7	-57.5	-36.2	0	0	0	116.5	K234	K234-D236 PolarHBondContact O-N 2.99Å
237	S	75.5	Confident	90.7	Very high	40 Å²	40	30.9 Å²	30.9	28%	0.28	16%	0.161	S	C	.	.			trans	-90.7	133.1	175.8	72.5	0	0	0	0	112.7	K234 E235 S239	K234-S237 PolarHBondContact N-OG 2.93Å; K234-S237 PolarHBondContact O-N 2.76Å; K234-S237 VanDerWaalsContact O-N 3.15Å; K234-S237 PolarHBondContact O-OG 3.29Å; E235-S237 PolarHBondContact O-N 3.1Å; E235-S237 VanDerWaalsContact O-N 3.11Å; S237-S239 PolarHBondContact O-N 2.99Å; S237-S239 PolarHBondContact OG-O 2.81Å
238	S	82.8	Confident	90.5	Very high	45 Å²	45	31 Å²	31	32%	0.315	16%	0.161	S	C	.	.	S	Bend	trans	-78	11.6	163.8	52.8	0	0	0	0	113.1	T262	S238-T262 PolarHBondContact O-N 3.07Å; S238-T262 PolarHBondContact O-OG1 2.92Å; S238-T262 VanDerWaalsContact O-OG1 3.12Å
239	S	90.4	Very high	89.9	Confident	34 Å²	34	37.9 Å²	37.9	24%	0.238	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	128.8	179.4	-169.6	0	0	0	0	109.8	S237	S237-S239 PolarHBondContact O-N 2.99Å; S237-S239 PolarHBondContact OG-O 2.81Å
240	F	93.1	Very high	89.5	Confident	4 Å²	4	39 Å²	39	2%	0.018	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	136.7	-171.3	-65.2	-108.7	0	0	0	109.1	M214 F232 A233 S259 V260 T262 N373 L377	M214-F240 HydrophobicContact CE-CD1 3.16Å; M214-F240 HydrophobicContact CE-CE1 3.22Å; M214-F240 HydrophobicContact CE-CG 4.39Å; M214-F240 HydrophobicContact CE-CZ 4.49Å; M214-F240 HydrophobicContact SD-CD1 4.32Å; M214-F240 HydrophobicContact SD-CE1 3.8Å; F232-F240 CarbonylContact O-C 3.59Å; F232-F240 WeakPolarHBondContact O-CA 3.48Å; A233-F240 HydrophobicContact CB-CD1 4.04Å; A233-F240 HydrophobicContact CB-CE1 4.11Å; A233-F240 HydrophobicContact CB-CG 4.45Å; F240-S259 CarbonylContact O-C 3.59Å; F240-S259 WeakPolarHBondContact O-CA 3.27Å; F240-V260 HydrophobicContact CB-CB 4.37Å; F240-V260 PolarHBondContact N-O 3.34Å; F240-V260 PolarHBondContact O-N 2.98Å; F240-T262 HydrophobicContact CD2-CG2 3.65Å; F240-T262 HydrophobicContact CE2-CG2 3.6Å; F240-T262 WeakPolarHBondContact CE2-OG1 3.45Å; F240-T262 HydrophobicContact CZ-CG2 4.44Å; F240-N373 HydrophobicContact CE1-CB 4.35Å; F240-N373 HydrophobicContact CZ-CB 4.18Å; F240-L377 HydrophobicContact CB-CD2 3.88Å; F240-L377 HydrophobicContact CD1-CD1 3.62Å; F240-L377 HydrophobicContact CD1-CD2 3.92Å; F240-L377 HydrophobicContact CD1-CG 4.32Å; F240-L377 HydrophobicContact CD2-CD2 4.29Å; F240-L377 HydrophobicContact CE1-CD1 3.88Å; F240-L377 HydrophobicContact CG-CD1 4.35Å; F240-L377 HydrophobicContact CG-CD2 3.78Å
241	R	93.8	Very high	89.1	Confident	38 Å²	38	42.9 Å²	42.9	14%	0.143	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	122.3	166.7	-66	-64.3	-66.1	-175.7	-1.2	108.6	I188 Y208 F231 F232 S257	I188-R241 HydrophobicContact CD1-CB 3.95Å; I188-R241 HydrophobicContact CG1-CB 4.31Å; I188-R241 HydrophobicContact CG2-CB 4.49Å; I188-R241 HydrophobicContact CG2-CG 4.19Å; Y208-R241 HydrophobicContact CE1-CB 4.43Å; Y208-R241 HydrophobicContact CE1-CG 3.94Å; Y208-R241 HydrophobicContact CE2-CG 3.98Å; Y208-R241 VanDerWaalsContact CZ-CG 3.5Å; Y208-R241 WeakPolarHBondContact OH-CG 3.41Å; F231-R241 WeakPolarHBondContact CA-O 3.46Å; F232-R241 HydrophobicContact CB-CB 4.33Å; F232-R241 PolarHBondContact N-O 3.36Å; F232-R241 PolarHBondContact O-N 3Å; R241-S257 PolarHBondContact NH2-OG 2.75Å
242	H	95.1	Very high	88.9	Confident	7 Å²	7	44.5 Å²	44.5	3%	0.032	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	124.6	177.1	173.7	-135.8	0	0	0	109.4	E229 L230 F231 S244 S257 T258 V260	E229-H242 IonicContact OE1-NE2 3.03Å; E229-H242 IonicContact OE2-CE1 3.33Å; E229-H242 PolarHBondContact OE2-CE1 2.76Å; E229-H242 IonicContact OE2-NE2 3.8Å; E229-H242 PolarHBondContact OE2-NE2 2.87Å; L230-H242 WeakPolarHBondContact O-CA 3.28Å; F231-H242 HydrophobicContact CD1-CB 3.92Å; F231-H242 AromaticContact CD1-CD2 3.9Å; F231-H242 HydrophobicContact CE1-CB 3.71Å; F231-H242 AromaticContact CE1-CD2 3.33Å; F231-H242 WeakPolarHBondContact CE1-CD2 3.39Å; F231-H242 AromaticContact CE1-CG 3.51Å; F231-H242 AromaticContact CE2-CD2 3.79Å; F231-H242 AromaticContact CZ-CD2 3.28Å; F231-H242 WeakPolarHBondContact CZ-CD2 3Å; F231-H242 AromaticContact CZ-CG 3.87Å; F231-H242 AromaticContact CZ-NE2 3.6Å; H242-S244 PolarHBondContact CE1-OG 3.27Å; H242-S244 VanDerWaalsContact CE1-OG 3.27Å; H242-S244 PolarHBondContact NE2-OG 2.89Å; H242-S257 WeakPolarHBondContact O-CA 3.29Å; H242-T258 PolarHBondContact N-O 2.99Å; H242-T258 PolarHBondContact O-N 3.1Å; H242-V260 HydrophobicContact CB-CG2 4.05Å
243	V	95.8	Very high	88.8	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	123.8	174.3	-177	0	0	0	0	109.1	A184 I187 I188 L230 L245 R256	A184-V243 HydrophobicContact CB-CB 4.03Å; A184-V243 HydrophobicContact CB-CG1 3.97Å; A184-V243 HydrophobicContact CB-CG2 4.27Å; I187-V243 HydrophobicContact CD1-CG1 4.29Å; I188-V243 HydrophobicContact CD1-CG2 3.62Å; I188-V243 HydrophobicContact CG1-CG2 3.5Å; I188-V243 VanDerWaalsContact CG1-CG2 3.5Å; L230-V243 PolarHBondContact N-O 2.81Å; L230-V243 PolarHBondContact O-N 3.27Å; V243-L245 HydrophobicContact CG1-CD2 3.55Å; V243-L245 HydrophobicContact CG1-CG 3.91Å; V243-R256 CarbonylContact C-O 3.59Å; V243-R256 WeakPolarHBondContact CA-O 3.39Å
244	S	95.5	Very high	88.8	Confident	6 Å²	6	48.5 Å²	48.5	4%	0.042	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	123.5	169.3	-61.9	0	0	0	0	108.8	Y228 E229 H242 V255 R256	Y228-S244 CarbonylContact O-C 3.58Å; Y228-S244 VanDerWaalsContact O-CA 3.31Å; Y228-S244 WeakPolarHBondContact O-CA 3.35Å; E229-S244 VanDerWaalsContact OE1-CB 3.32Å; E229-S244 WeakPolarHBondContact OE1-CB 3.25Å; E229-S244 PolarHBondContact OE1-OG 3.15Å; H242-S244 PolarHBondContact CE1-OG 3.27Å; H242-S244 VanDerWaalsContact CE1-OG 3.27Å; H242-S244 PolarHBondContact NE2-OG 2.89Å; S244-V255 WeakPolarHBondContact O-CB 3.14Å; S244-V255 PolarHBondContact O-N 3.32Å; S244-R256 PolarHBondContact N-O 3.28Å; S244-R256 PolarHBondContact O-N 2.71Å
245	L	95.5	Very high	89	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	146.3	174.7	-52	176.6	0	0	0	109.9	A180 A183 A184 I187 L227 Y228 L230 V243 I252 M253	A180-L245 VanDerWaalsContact O-CD1 3.26Å; A180-L245 WeakPolarHBondContact O-CD1 2.92Å; A183-L245 HydrophobicContact CB-CD1 4.1Å; A184-L245 HydrophobicContact CB-CD1 4.18Å; I187-L245 HydrophobicContact CD1-CD2 3.49Å; I187-L245 VanDerWaalsContact CD1-CD2 3.49Å; L227-L245 WeakPolarHBondContact CD1-O 3.36Å; Y228-L245 HydrophobicContact CD2-CB 4.46Å; Y228-L245 PolarHBondContact N-O 3.39Å; Y228-L245 PolarHBondContact O-N 3.37Å; L230-L245 HydrophobicContact CD1-CD1 3.79Å; L230-L245 HydrophobicContact CD1-CG 4.35Å; V243-L245 HydrophobicContact CG1-CD2 3.55Å; V243-L245 HydrophobicContact CG1-CG 3.91Å; L245-I252 HydrophobicContact CB-CG2 3.82Å; L245-I252 HydrophobicContact CD1-CG2 3.93Å; L245-I252 HydrophobicContact CD2-CG2 4.48Å; L245-I252 HydrophobicContact CG-CG2 4.31Å; L245-M253 CarbonylContact C-O 3.57Å; L245-M253 WeakPolarHBondContact CA-O 3.36Å
246	F	94.4	Very high	89.6	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	125.2	172.5	-170.5	-102.2	0	0	0	109.8	Q124 I125 A128 V130 K224 L227 P248 M253 V255	Q124-F246 HydrophobicContact CB-CE1 4.06Å; I125-F246 HydrophobicContact CB-CD1 4.43Å; I125-F246 HydrophobicContact CD1-CB 4.46Å; I125-F246 HydrophobicContact CD1-CD1 4.35Å; I125-F246 HydrophobicContact CG1-CB 4.03Å; I125-F246 HydrophobicContact CG1-CD1 3.4Å; I125-F246 HydrophobicContact CG1-CE1 4.1Å; I125-F246 HydrophobicContact CG1-CG 3.93Å; A128-F246 HydrophobicContact CB-CD2 4.32Å; A128-F246 HydrophobicContact CB-CE2 3.6Å; A128-F246 HydrophobicContact CB-CZ 3.86Å; V130-F246 HydrophobicContact CG2-CD2 4.26Å; K224-F246 HydrophobicContact CB-CZ 4.02Å; K224-F246 WeakPolarHBondContact O-CZ 3.48Å; L227-F246 HydrophobicContact CB-CD2 4.17Å; F246-P248 HydrophobicContact CD1-CB 4.29Å; F246-P248 HydrophobicContact CD1-CG 4.49Å; F246-P248 HydrophobicContact CE1-CB 3.94Å; F246-P248 VanDerWaalsContact O-CD 3.23Å; F246-P248 WeakPolarHBondContact O-CD 3.32Å; F246-M253 PolarHBondContact N-O 2.85Å; F246-M253 PolarHBondContact O-N 2.84Å; F246-V255 HydrophobicContact CB-CG2 3.6Å
247	R	93.3	Very high	90.8	Very high	54 Å²	54	36.5 Å²	36.5	20%	0.204	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	96.4	172	-168.6	178.4	-159.1	142	14.7	108.5	E179 G225 T226 Y228 I252	E179-R247 IonicContact OE1-CZ 3.79Å; E179-R247 IonicContact OE1-NH1 3.88Å; E179-R247 IonicContact OE1-NH2 3.07Å; E179-R247 PolarHBondContact OE1-NH2 2.81Å; E179-R247 IonicContact OE2-CZ 3.24Å; E179-R247 VanDerWaalsContact OE2-CZ 3.24Å; E179-R247 IonicContact OE2-NH1 2.72Å; E179-R247 PolarHBondContact OE2-NH1 3.41Å; E179-R247 IonicContact OE2-NH2 2.85Å; E179-R247 PolarHBondContact OE2-NH2 2.89Å; G225-R247 CarbonylContact C-O 3.47Å; G225-R247 WeakPolarHBondContact CA-O 3.34Å; T226-R247 PolarHBondContact N-O 2.89Å; T226-R247 PolarHBondContact O-N 3.49Å; Y228-R247 HydrophobicContact CE2-CB 3.95Å; R247-I252 HydrophobicContact CB-CG1 4.07Å; R247-I252 HydrophobicContact CG-CG1 3.91Å
248	P	89.8	Confident	91.6	Very high	5 Å²	5	36 Å²	36	3%	0.032	19%	0.188	C	C	.	.			trans	-64.6	-167.4	166.2	30.7	-36	0	0	0	110.1	L121 F246 G250 P251 M253	L121-P248 HydrophobicContact CB-CG 4.3Å; L121-P248 HydrophobicContact CD2-CB 3.69Å; L121-P248 HydrophobicContact CD2-CG 3.57Å; L121-P248 HydrophobicContact CG-CG 4.31Å; F246-P248 HydrophobicContact CD1-CB 4.29Å; F246-P248 HydrophobicContact CD1-CG 4.49Å; F246-P248 HydrophobicContact CE1-CB 3.94Å; F246-P248 VanDerWaalsContact O-CD 3.23Å; F246-P248 WeakPolarHBondContact O-CD 3.32Å; P248-G250 PolarHBondContact O-N 3.44Å; P248-P251 WeakPolarHBondContact CD-O 3.23Å; P248-M253 HydrophobicContact CG-SD 4.16Å
249	F	85.6	Confident	91.9	Very high	145 Å²	145	36.9 Å²	36.9	64%	0.636	19%	0.194	S	C	*	.	S	Bend	trans	-71.8	48.3	169.3	-54	-70.6	0	0	0	112.4	R222	R222-F249 WeakPolarHBondContact O-CZ 3.27Å
250	G	87	Confident	92	Very high	30 Å²	30	37 Å²	37	31%	0.309	19%	0.193	S	C	.	.	S	Bend	trans	-168.3	-151.7	-170.2	0	0	0	0	0	112.1	P248	P248-G250 PolarHBondContact O-N 3.44Å
251	P	90	Very high	91.9	Very high	82 Å²	82	43.2 Å²	43.2	53%	0.532	22%	0.222	S	C	.	.	S	Bend	trans	-70.3	153.8	-179.2	30	-34.7	0	0	0	112	L121 P248	L121-P251 HydrophobicContact CD1-CG 4.49Å; P248-P251 WeakPolarHBondContact CD-O 3.23Å
252	I	93.4	Very high	91.8	Very high	34 Å²	34	41.6 Å²	41.6	17%	0.174	22%	0.216	C	C	.	.			trans	-65.9	135.9	173.1	-60	-178.2	0	0	0	109.4	E179 A180 L245 R247	E179-I252 HydrophobicContact CB-CD1 4.49Å; E179-I252 HydrophobicContact CG-CD1 3.9Å; A180-I252 HydrophobicContact CB-CD1 4.34Å; L245-I252 HydrophobicContact CB-CG2 3.82Å; L245-I252 HydrophobicContact CD1-CG2 3.93Å; L245-I252 HydrophobicContact CD2-CG2 4.48Å; L245-I252 HydrophobicContact CG-CG2 4.31Å; R247-I252 HydrophobicContact CB-CG1 4.07Å; R247-I252 HydrophobicContact CG-CG1 3.91Å
253	M	91.6	Very high	91.6	Very high	28 Å²	28	46.8 Å²	46.8	14%	0.138	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	139.6	-179	-54.5	-174.1	71.9	0	0	110.3	L121 H122 I125 L245 F246 P248 V255	L121-M253 HydrophobicContact CB-CE 4.48Å; L121-M253 HydrophobicContact CB-SD 3.74Å; L121-M253 HydrophobicContact CD1-SD 4.32Å; H122-M253 WeakPolarHBondContact CD2-CE 3.49Å; H122-M253 WeakPolarHBondContact NE2-CE 3.35Å; I125-M253 HydrophobicContact CD1-CB 4.01Å; I125-M253 HydrophobicContact CD1-CE 4.23Å; I125-M253 HydrophobicContact CD1-SD 3.85Å; L245-M253 CarbonylContact C-O 3.57Å; L245-M253 WeakPolarHBondContact CA-O 3.36Å; F246-M253 PolarHBondContact N-O 2.85Å; F246-M253 PolarHBondContact O-N 2.84Å; P248-M253 HydrophobicContact CG-SD 4.16Å; M253-V255 PolarHBondContact O-N 3.23Å
254	K	92.3	Very high	91.3	Very high	65 Å²	65	49.4 Å²	49.4	28%	0.283	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	125.4	170.6	177.1	-178.5	167.7	-175.9	0	109	I187 D192 D195	I187-K254 HydrophobicContact CD1-CB 3.82Å; I187-K254 HydrophobicContact CD1-CD 4.14Å; I187-K254 HydrophobicContact CD1-CG 4Å; I187-K254 HydrophobicContact CG1-CD 4.22Å; I187-K254 HydrophobicContact CG2-CD 3.82Å; I187-K254 HydrophobicContact CG2-CG 4.43Å; D192-K254 IonicContact OD2-NZ 2.76Å; D192-K254 PolarHBondContact OD2-NZ 2.83Å; D195-K254 WeakPolarHBondContact OD1-CE 3.33Å; D195-K254 IonicContact OD1-NZ 2.71Å; D195-K254 PolarHBondContact OD1-NZ 3.12Å; D195-K254 IonicContact OD2-NZ 2.7Å; D195-K254 PolarHBondContact OD2-NZ 3.19Å
255	V	90.8	Very high	91.3	Very high	36 Å²	36	50.9 Å²	50.9	22%	0.218	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	-51.8	169.4	174.9	0	0	0	0	109.7	I125 V130 S244 F246 M253	I125-V255 HydrophobicContact CG2-CG2 4.15Å; V130-V255 HydrophobicContact CG1-CB 4.16Å; V130-V255 HydrophobicContact CG1-CG1 3.2Å; V130-V255 HydrophobicContact CG1-CG2 4.05Å; S244-V255 WeakPolarHBondContact O-CB 3.14Å; S244-V255 PolarHBondContact O-N 3.32Å; F246-V255 HydrophobicContact CB-CG2 3.6Å; M253-V255 PolarHBondContact O-N 3.23Å
256	R	90.3	Very high	91.4	Very high	107 Å²	107	54.5 Å²	54.5	40%	0.404	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	144.2	-172.9	-169.6	175.4	-173.9	-152.5	-1	110.7	V243 S244 T258	V243-R256 CarbonylContact C-O 3.59Å; V243-R256 WeakPolarHBondContact CA-O 3.39Å; S244-R256 PolarHBondContact N-O 3.28Å; S244-R256 PolarHBondContact O-N 2.71Å; R256-T258 HydrophobicContact CG-CG2 3.98Å
257	S	91.9	Very high	91.6	Very high	5 Å²	5	54.5 Å²	54.5	4%	0.035	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	119.8	170	-179.6	0	0	0	0	107.9	R241 H242	R241-S257 PolarHBondContact NH2-OG 2.75Å; H242-S257 WeakPolarHBondContact O-CA 3.29Å
258	T	91.1	Very high	91.8	Very high	30 Å²	30	52 Å²	52	18%	0.184	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	156.6	-177.6	45.6	0	0	0	0	112.8	H242 R256	H242-T258 PolarHBondContact N-O 2.99Å; H242-T258 PolarHBondContact O-N 3.1Å; R256-T258 HydrophobicContact CG-CG2 3.98Å
259	S	90.3	Very high	92.2	Very high	63 Å²	63	51.7 Å²	51.7	44%	0.441	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	134.5	166.3	-150.3	0	0	0	0	109.6	F240	F240-S259 CarbonylContact O-C 3.59Å; F240-S259 WeakPolarHBondContact O-CA 3.27Å
260	V	91.3	Very high	92.9	Very high	38 Å²	38	44.8 Å²	44.8	23%	0.23	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	116.5	177.1	-176.1	0	0	0	0	108	F240 H242 L377	F240-V260 HydrophobicContact CB-CB 4.37Å; F240-V260 PolarHBondContact N-O 3.34Å; F240-V260 PolarHBondContact O-N 2.98Å; H242-V260 HydrophobicContact CB-CG2 4.05Å; V260-L377 HydrophobicContact CB-CD2 4.29Å; V260-L377 HydrophobicContact CG1-CD2 4.01Å
261	E	91	Very high	93.4	Very high	134 Å²	134	43.4 Å²	43.4	63%	0.626	24%	0.24	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-94.9	122.4	173.1	-65	-168.4	173.4	0	0	109.8
262	T	91.9	Very high	93.8	Very high	3 Å²	3	39.8 Å²	39.8	2%	0.018	22%	0.217	C	C	.	.			trans	-92.6	-5.4	177.6	63.7	0	0	0	0	113	S238 F240 G264 M265 R376 L377	S238-T262 PolarHBondContact O-N 3.07Å; S238-T262 PolarHBondContact O-OG1 2.92Å; S238-T262 VanDerWaalsContact O-OG1 3.12Å; F240-T262 HydrophobicContact CD2-CG2 3.65Å; F240-T262 HydrophobicContact CE2-CG2 3.6Å; F240-T262 WeakPolarHBondContact CE2-OG1 3.45Å; F240-T262 HydrophobicContact CZ-CG2 4.44Å; T262-G264 PolarHBondContact O-N 3.37Å; T262-M265 HydrophobicContact CG2-SD 4.28Å; T262-M265 WeakPolarHBondContact O-CB 3.43Å; T262-M265 PolarHBondContact O-N 3.43Å; T262-M265 VanDerWaalsContact O-N 3.14Å; T262-R376 HydrophobicContact CG2-CB 4.07Å; T262-L377 HydrophobicContact CG2-CD2 4.17Å
263	L	90.1	Very high	94	Very high	116 Å²	116	38.3 Å²	38.3	61%	0.607	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	131.2	174.3	-165.4	70.2	0	0	0	110	M265	L263-M265 VanDerWaalsContact C-N 3.28Å; L263-M265 PolarHBondContact O-N 3.41Å
264	G	89.9	Confident	94.1	Very high	56 Å²	56	38.5 Å²	38.5	58%	0.577	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.9	-9.2	-174.4	0	0	0	0	0	114.9	T262 I266	T262-G264 PolarHBondContact O-N 3.37Å; G264-I266 PolarHBondContact O-N 3.21Å
265	M	95.6	Very high	94.1	Very high	37 Å²	37	36.6 Å²	36.6	18%	0.182	21%	0.214	C	C	.	.			trans	-79	87.4	176.6	-61.4	-179.3	83.1	0	0	110.6	T262 L263 R376 Y433	T262-M265 HydrophobicContact CG2-SD 4.28Å; T262-M265 WeakPolarHBondContact O-CB 3.43Å; T262-M265 PolarHBondContact O-N 3.43Å; T262-M265 VanDerWaalsContact O-N 3.14Å; L263-M265 VanDerWaalsContact C-N 3.28Å; L263-M265 PolarHBondContact O-N 3.41Å; M265-R376 HydrophobicContact CB-CG 4.17Å; M265-R376 HydrophobicContact CE-CB 4.22Å; M265-R376 PolarHBondContact O-NE 3.13Å; M265-R376 PolarHBondContact O-NH2 2.89Å; M265-R376 HydrophobicContact SD-CB 4.16Å; M265-Y433 WeakPolarHBondContact CE-OH 3.37Å
266	I	97.2	Very high	94.3	Very high	77 Å²	77	39.2 Å²	39.2	40%	0.395	22%	0.22	S	C	.	.			trans	-69.7	131.3	177.5	-60.9	171	0	0	0	110.2	G264 Q297 H299 W351 V356	G264-I266 PolarHBondContact O-N 3.21Å; I266-Q297 WeakPolarHBondContact CA-O 3.35Å; I266-H299 HydrophobicContact CG2-CB 4.37Å; I266-W351 HydrophobicContact CG2-CH2 4.24Å; I266-V356 HydrophobicContact CB-CG2 4.42Å; I266-V356 HydrophobicContact CG2-CG2 4.33Å; I266-V356 WeakPolarHBondContact O-CG2 3.43Å
267	I	98.5	Very high	94.6	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	120.4	169	-55.8	174	0	0	0	108.8	I269 Q297 V298 H299 L357 F359 L372 C375 R376	I267-I269 HydrophobicContact CG2-CG1 4Å; I267-Q297 PolarHBondContact N-O 2.81Å; I267-Q297 VanDerWaalsContact N-O 3.09Å; I267-V298 CarbonylContact O-C 3.53Å; I267-V298 WeakPolarHBondContact O-CA 3.46Å; I267-V298 WeakPolarHBondContact O-CG1 3.25Å; I267-H299 PolarHBondContact O-N 3Å; I267-L357 CarbonylContact C-O 3.55Å; I267-L357 WeakPolarHBondContact CA-O 3.14Å; I267-L357 HydrophobicContact CG1-CD2 4.07Å; I267-L357 HydrophobicContact CG1-CG 4.44Å; I267-F359 HydrophobicContact CG2-CB 3.8Å; I267-L372 HydrophobicContact CD1-CB 3.86Å; I267-L372 HydrophobicContact CD1-CD2 3.94Å; I267-L372 HydrophobicContact CD1-CG 4.42Å; I267-L372 WeakPolarHBondContact CD1-O 3.44Å; I267-C375 HydrophobicContact CD1-CB 4.35Å; I267-R376 HydrophobicContact CD1-CG 4Å; I267-R376 HydrophobicContact CG1-CG 4.17Å
268	N	98.7	Very high	94.8	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	103.9	166.6	-176.8	20.5	0	0	0	109.4	I270 H299 T301 W351 V356 L357 M358 F359	N268-I270 PolarHBondContact O-N 3.16Å; N268-H299 CarbonylContact C-O 3.38Å; N268-H299 WeakPolarHBondContact CA-O 3.21Å; N268-H299 PolarHBondContact OD1-CD2 3.42Å; N268-H299 PolarHBondContact OD1-O 2.93Å; N268-T301 PolarHBondContact ND2-OG1 3.36Å; N268-T301 PolarHBondContact OD1-OG1 3.31Å; N268-W351 HydrophobicContact CB-CE3 4.22Å; N268-W351 HydrophobicContact CB-CZ3 4.27Å; N268-V356 HydrophobicContact CB-CG1 4.29Å; N268-V356 HydrophobicContact CB-CG2 4.08Å; N268-L357 PolarHBondContact N-O 2.97Å; N268-M358 WeakPolarHBondContact O-CA 3.26Å; N268-F359 PolarHBondContact O-N 3.4Å
269	I	98.8	Very high	95	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	115.7	174.7	-55.3	-176.9	0	0	0	107.9	I267 V271 F283 F287 V298 H299 L300 T301 F359 C361 F367 L372	I267-I269 HydrophobicContact CG2-CG1 4Å; I269-V271 HydrophobicContact CG2-CG2 4.02Å; I269-F283 HydrophobicContact CG2-CZ 4.24Å; I269-F287 HydrophobicContact CD1-CD2 4.21Å; I269-F287 HydrophobicContact CD1-CE2 4.11Å; I269-V298 HydrophobicContact CD1-CG1 3.58Å; I269-V298 HydrophobicContact CG1-CG1 3.67Å; I269-H299 PolarHBondContact N-O 2.99Å; I269-L300 HydrophobicContact CB-CD1 4.4Å; I269-L300 HydrophobicContact CG2-CD1 4.43Å; I269-T301 PolarHBondContact O-N 3.4Å; I269-F359 WeakPolarHBondContact CA-O 3.32Å; I269-F359 HydrophobicContact CD1-CD1 4.39Å; I269-F359 HydrophobicContact CG1-CB 4.37Å; I269-F359 HydrophobicContact CG1-CD1 4.13Å; I269-F359 HydrophobicContact CG2-CD1 3.97Å; I269-C361 HydrophobicContact CG2-CB 3.71Å; I269-F367 HydrophobicContact CD1-CE1 4.38Å; I269-F367 HydrophobicContact CD1-CE2 4.31Å; I269-F367 HydrophobicContact CD1-CZ 3.77Å; I269-L372 HydrophobicContact CD1-CD2 4.36Å
270	I	98.8	Very high	95.4	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	118	-177.7	-59.4	162.4	0	0	0	108.7	N268 T301 L344 A348 M358 F359 F360 C361	N268-I270 PolarHBondContact O-N 3.16Å; I270-T301 WeakPolarHBondContact CA-O 3.4Å; I270-L344 HydrophobicContact CB-CD2 4.38Å; I270-L344 HydrophobicContact CG2-CD2 3.99Å; I270-A348 HydrophobicContact CD1-CB 4.3Å; I270-M358 HydrophobicContact CD1-CB 4.13Å; I270-M358 HydrophobicContact CD1-CG 4.12Å; I270-M358 HydrophobicContact CD1-SD 3.82Å; I270-F359 PolarHBondContact N-O 3.46Å; I270-F360 HydrophobicContact CB-CD1 4.34Å; I270-F360 HydrophobicContact CD1-CD1 4.05Å; I270-F360 HydrophobicContact CD1-CE1 3.71Å; I270-C361 PolarHBondContact O-N 3.05Å
271	V	98.6	Very high	95.7	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	107.4	-177	-174.9	0	0	0	0	109.8	I269 F283 L300 T301 V302 V303 C361 V363	I269-V271 HydrophobicContact CG2-CG2 4.02Å; V271-F283 HydrophobicContact CG2-CE1 3.94Å; V271-F283 HydrophobicContact CG2-CE2 4.19Å; V271-F283 HydrophobicContact CG2-CZ 3.58Å; V271-L300 HydrophobicContact CG2-CD1 4.02Å; V271-T301 PolarHBondContact N-O 3.29Å; V271-V302 WeakPolarHBondContact O-CA 3.17Å; V271-V303 PolarHBondContact O-N 3.44Å; V271-C361 HydrophobicContact CG2-CB 4.28Å; V271-V363 HydrophobicContact CG1-CB 4.02Å; V271-V363 HydrophobicContact CG1-CG2 4.47Å
272	P	97.3	Very high	96	Very high	7 Å²	7	36.9 Å²	36.9	5%	0.045	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	134.4	168.1	34.3	-33.4	0	0	0	109.2	V303 F338 R340 L344 C361	P272-V303 CarbonylContact C-O 3.53Å; P272-V303 WeakPolarHBondContact CA-O 3.26Å; P272-F338 HydrophobicContact CB-CE2 4.01Å; P272-F338 HydrophobicContact CB-CZ 4.42Å; P272-R340 HydrophobicContact CG-CG 4.08Å; P272-L344 HydrophobicContact CG-CD2 4.01Å; P272-L344 HydrophobicContact CG-CG 4.03Å; P272-C361 WeakPolarHBondContact CD-O 3.04Å
273	L	97.2	Very high	96.3	Very high	3 Å²	3	37 Å²	37	2%	0.016	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	141.9	-174.3	-175.6	63.2	0	0	0	111.6	R276 F280 V302 V303 Y304 F305 V313 V363	L273-R276 HydrophobicContact CD1-CB 4.09Å; L273-F280 HydrophobicContact CD2-CB 3.74Å; L273-F280 HydrophobicContact CD2-CD1 4.49Å; L273-F280 HydrophobicContact CD2-CD2 3.61Å; L273-F280 HydrophobicContact CD2-CE2 4.36Å; L273-F280 HydrophobicContact CD2-CG 3.67Å; L273-V302 HydrophobicContact CB-CG1 4.44Å; L273-V302 HydrophobicContact CD2-CG1 4.47Å; L273-V303 PolarHBondContact N-O 3.41Å; L273-Y304 HydrophobicContact CB-CD2 4.07Å; L273-Y304 HydrophobicContact CB-CE2 4.39Å; L273-Y304 HydrophobicContact CD2-CD2 3.78Å; L273-Y304 HydrophobicContact CD2-CE2 3.66Å; L273-Y304 HydrophobicContact CG-CD2 3.92Å; L273-Y304 HydrophobicContact CG-CE2 3.77Å; L273-Y304 CarbonylContact O-C 3.54Å; L273-Y304 WeakPolarHBondContact O-CA 3.41Å; L273-F305 PolarHBondContact O-N 3.15Å; L273-V313 HydrophobicContact CD2-CG1 4.5Å; L273-V313 HydrophobicContact CD2-CG2 3.93Å; L273-V363 HydrophobicContact CD1-CB 4.2Å; L273-V363 HydrophobicContact CD1-CG1 4.07Å; L273-V363 HydrophobicContact CD1-CG2 4.11Å
274	A	95.2	Very high	96.6	Very high	32 Å²	32	32.1 Å²	32.1	26%	0.264	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	129.7	165.8	0	0	0	0	0	108.6	R276 F305 F338	A274-R276 PolarHBondContact O-N 3.48Å; A274-F305 HydrophobicContact CB-CB 4.08Å; A274-F338 HydrophobicContact CB-CB 3.66Å; A274-F338 HydrophobicContact CB-CD2 3.59Å; A274-F338 HydrophobicContact CB-CE2 4.46Å; A274-F338 HydrophobicContact CB-CG 3.79Å
275	G	92.5	Very high	97	Very high	25 Å²	25	33.9 Å²	33.9	26%	0.258	18%	0.184	S	C	.	.	S	Bend	trans	55.4	-131.3	-172.3	0	0	0	0	0	111.6	V277 Y304	G275-V277 PolarHBondContact O-N 2.97Å; G275-Y304 WeakPolarHBondContact CA-OH 3.47Å; G275-Y304 PolarHBondContact N-OH 3.35Å
276	R	94.2	Very high	97.1	Very high	91 Å²	91	32.2 Å²	32.2	34%	0.343	18%	0.175	S	C	.	.			trans	44.5	38.6	173.1	-59.6	-170.1	72.5	-172.9	0.8	115.4	L273 A274 D278 T279 F280 D364	L273-R276 HydrophobicContact CD1-CB 4.09Å; A274-R276 PolarHBondContact O-N 3.48Å; R276-D278 PolarHBondContact O-N 3.31Å; R276-T279 PolarHBondContact O-N 2.84Å; R276-T279 VanDerWaalsContact O-N 3.09Å; R276-F280 PolarHBondContact O-N 3.4Å; R276-D364 IonicContact CZ-OD1 3.88Å; R276-D364 IonicContact NH1-OD1 3.5Å; R276-D364 PolarHBondContact NH1-OD1 3.04Å; R276-D364 IonicContact NH2-OD1 3.96Å; R276-D364 PolarHBondContact NH2-OD1 3.25Å
277	V	96.4	Very high	97.1	Very high	34 Å²	34	28.5 Å²	28.5	21%	0.206	16%	0.156	C	C	.	.	H	α-helix	trans	-56.1	-38.3	-176.9	-178.5	0	0	0	0	112.3	G275 F280 S281 E312 V313	G275-V277 PolarHBondContact O-N 2.97Å; V277-F280 PolarHBondContact O-N 3.02Å; V277-S281 PolarHBondContact O-N 2.83Å; V277-S281 PolarHBondContact O-OG 2.8Å; V277-E312 HydrophobicContact CG1-CB 3.68Å; V277-E312 HydrophobicContact CG2-CB 4.35Å; V277-V313 HydrophobicContact CG2-CG2 4.36Å
278	D	95.9	Very high	97.1	Very high	129 Å²	129	32.2 Å²	32.2	69%	0.69	17%	0.17	S	C	*	.	H	α-helix	trans	-67.3	-41.9	178.5	-63.7	-31.9	0	0	0	112.3	R276 F280 S281 Q282	R276-D278 PolarHBondContact O-N 3.31Å; D278-F280 VanDerWaalsContact C-N 3.34Å; D278-S281 PolarHBondContact O-N 3.38Å; D278-Q282 PolarHBondContact O-N 3.45Å
279	T	96.6	Very high	97	Very high	30 Å²	30	34.8 Å²	34.8	18%	0.184	18%	0.182	C	C	.	.	H	α-helix	trans	-65.1	-41.8	174.7	-48	0	0	0	0	110.3	R276 S281 Q282 F283 V363 D364	R276-T279 PolarHBondContact O-N 2.84Å; R276-T279 VanDerWaalsContact O-N 3.09Å; T279-S281 VanDerWaalsContact C-N 3.27Å; T279-S281 PolarHBondContact O-N 2.94Å; T279-Q282 PolarHBondContact O-N 2.82Å; T279-F283 PolarHBondContact O-N 2.9Å; T279-V363 HydrophobicContact CG2-CG1 3.91Å; T279-V363 HydrophobicContact CG2-CG2 4.26Å; T279-D364 HydrophobicContact CG2-CB 4.09Å
280	F	98.2	Very high	96.9	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.5	-35.9	175.3	-179.3	-103.6	0	0	0	112.6	L273 R276 V277 D278 Q282 F283 L284 V302 V313 L317 V363	L273-F280 HydrophobicContact CD2-CB 3.74Å; L273-F280 HydrophobicContact CD2-CD1 4.49Å; L273-F280 HydrophobicContact CD2-CD2 3.61Å; L273-F280 HydrophobicContact CD2-CE2 4.36Å; L273-F280 HydrophobicContact CD2-CG 3.67Å; R276-F280 PolarHBondContact O-N 3.4Å; V277-F280 PolarHBondContact O-N 3.02Å; D278-F280 VanDerWaalsContact C-N 3.34Å; F280-Q282 VanDerWaalsContact C-N 3.35Å; F280-Q282 PolarHBondContact O-N 3.21Å; F280-F283 HydrophobicContact CD2-CD1 4.31Å; F280-F283 HydrophobicContact CE2-CD1 4.21Å; F280-F283 WeakPolarHBondContact O-CB 3.41Å; F280-F283 PolarHBondContact O-N 3.2Å; F280-L284 HydrophobicContact CE1-CD2 4.21Å; F280-L284 HydrophobicContact CZ-CD1 4.27Å; F280-L284 VanDerWaalsContact O-CB 3.31Å; F280-L284 WeakPolarHBondContact O-CB 3.35Å; F280-L284 PolarHBondContact O-N 3.27Å; F280-V302 HydrophobicContact CE2-CG1 4.32Å; F280-V302 HydrophobicContact CE2-CG2 3.86Å; F280-V302 HydrophobicContact CZ-CG2 4.04Å; F280-V313 HydrophobicContact CD1-CB 4.31Å; F280-V313 HydrophobicContact CD1-CG1 4.04Å; F280-V313 HydrophobicContact CD1-CG2 3.81Å; F280-V313 HydrophobicContact CE1-CB 4.31Å; F280-V313 HydrophobicContact CE1-CG1 3.68Å; F280-V313 HydrophobicContact CE1-CG2 4.29Å; F280-V313 HydrophobicContact CG-CG2 4.28Å; F280-V313 HydrophobicContact CZ-CG1 4.02Å; F280-L317 HydrophobicContact CE1-CG 4.21Å; F280-L317 HydrophobicContact CZ-CD1 4.31Å; F280-L317 HydrophobicContact CZ-CD2 3.96Å; F280-L317 HydrophobicContact CZ-CG 3.98Å; F280-V363 HydrophobicContact CB-CG2 3.97Å; F280-V363 HydrophobicContact CD2-CG2 4.06Å
281	S	97.3	Very high	96.9	Very high	48 Å²	48	35.2 Å²	35.2	34%	0.336	19%	0.185	S	C	.	.	H	α-helix	trans	-64.8	-39.5	176.4	-60.2	0	0	0	0	111.9	V277 D278 T279 L284 Q285	V277-S281 PolarHBondContact O-N 2.83Å; V277-S281 PolarHBondContact O-OG 2.8Å; D278-S281 PolarHBondContact O-N 3.38Å; T279-S281 VanDerWaalsContact C-N 3.27Å; T279-S281 PolarHBondContact O-N 2.94Å; S281-L284 PolarHBondContact O-N 2.99Å; S281-Q285 PolarHBondContact O-N 3.03Å; S281-Q285 VanDerWaalsContact O-N 3.08Å
282	Q	96.1	Very high	96.8	Very high	86 Å²	86	35.9 Å²	35.9	40%	0.402	19%	0.189	S	C	.	.	H	α-helix	trans	-66.9	-41.9	173.8	-66.4	174.6	48.4	0	0	112	D278 T279 F280 L284 Q285 N286 I409	D278-Q282 PolarHBondContact O-N 3.45Å; T279-Q282 PolarHBondContact O-N 2.82Å; F280-Q282 VanDerWaalsContact C-N 3.35Å; F280-Q282 PolarHBondContact O-N 3.21Å; Q282-L284 VanDerWaalsContact C-N 3.35Å; Q282-Q285 WeakPolarHBondContact O-CB 3.47Å; Q282-Q285 PolarHBondContact O-N 3.33Å; Q282-N286 PolarHBondContact O-N 3.43Å; Q282-N286 VanDerWaalsContact O-N 3.13Å; Q282-I409 VanDerWaalsContact OE1-CD1 3.32Å
283	F	98.4	Very high	96.7	Very high	5 Å²	5	40 Å²	40	2%	0.022	21%	0.208	C	C	.	.	H	α-helix	trans	-58.2	-47.7	172.5	175.5	-93	0	0	0	111.5	I269 V271 T279 F280 Q285 N286 F287 L300 V363 F367	I269-F283 HydrophobicContact CG2-CZ 4.24Å; V271-F283 HydrophobicContact CG2-CE1 3.94Å; V271-F283 HydrophobicContact CG2-CE2 4.19Å; V271-F283 HydrophobicContact CG2-CZ 3.58Å; T279-F283 PolarHBondContact O-N 2.9Å; F280-F283 HydrophobicContact CD2-CD1 4.31Å; F280-F283 HydrophobicContact CE2-CD1 4.21Å; F280-F283 WeakPolarHBondContact O-CB 3.41Å; F280-F283 PolarHBondContact O-N 3.2Å; F283-Q285 PolarHBondContact O-N 2.98Å; F283-N286 WeakPolarHBondContact O-CA 3.28Å; F283-N286 WeakPolarHBondContact O-CB 3.4Å; F283-N286 PolarHBondContact O-N 3.48Å; F283-F287 HydrophobicContact CE1-CB 4.24Å; F283-F287 WeakPolarHBondContact O-CB 3.38Å; F283-F287 PolarHBondContact O-N 3.38Å; F283-L300 HydrophobicContact CE1-CD1 3.9Å; F283-L300 HydrophobicContact CE1-CD2 4.47Å; F283-L300 HydrophobicContact CZ-CD1 4.27Å; F283-V363 HydrophobicContact CB-CG2 3.9Å; F283-V363 WeakPolarHBondContact CB-O 3.45Å; F283-V363 HydrophobicContact CG-CG2 4.28Å; F283-F367 AromaticContact CE2-CE1 3.96Å; F283-F367 HydrophobicContact CE2-CE1 3.96Å; F283-F367 HydrophobicContact CZ-CE1 4.39Å
284	L	97.9	Very high	96.5	Very high	15 Å²	15	47.3 Å²	47.3	8%	0.079	24%	0.235	C	C	.	.	H	α-helix	trans	-63.7	-33.4	-178	-165.7	65.4	0	0	0	111.4	F280 S281 Q282 F287 R288 L300 L317 M320	F280-L284 HydrophobicContact CE1-CD2 4.21Å; F280-L284 HydrophobicContact CZ-CD1 4.27Å; F280-L284 VanDerWaalsContact O-CB 3.31Å; F280-L284 WeakPolarHBondContact O-CB 3.35Å; F280-L284 PolarHBondContact O-N 3.27Å; S281-L284 PolarHBondContact O-N 2.99Å; Q282-L284 VanDerWaalsContact C-N 3.35Å; L284-F287 HydrophobicContact CD1-CD1 4.43Å; L284-F287 PolarHBondContact O-N 3.45Å; L284-R288 WeakPolarHBondContact O-CB 3.42Å; L284-R288 PolarHBondContact O-N 3.16Å; L284-L300 HydrophobicContact CD1-CD2 4.12Å; L284-L317 HydrophobicContact CD1-CD2 3.93Å; L284-M320 HydrophobicContact CD1-CE 3.9Å; L284-M320 HydrophobicContact CD1-SD 3.49Å; L284-M320 WeakPolarHBondContact CD1-SD 3.17Å; L284-M320 HydrophobicContact CD2-CB 4.28Å; L284-M320 HydrophobicContact CG-SD 3.91Å
285	Q	97.1	Very high	96.5	Very high	93 Å²	93	46.6 Å²	46.6	44%	0.435	23%	0.227	S	C	.	.	H	α-helix	trans	-63.6	-46.5	170.8	-176.7	179	-6.4	0	0	111.8	S281 Q282 F283 F287 R288 E289	S281-Q285 PolarHBondContact O-N 3.03Å; S281-Q285 VanDerWaalsContact O-N 3.08Å; Q282-Q285 WeakPolarHBondContact O-CB 3.47Å; Q282-Q285 PolarHBondContact O-N 3.33Å; F283-Q285 PolarHBondContact O-N 2.98Å; Q285-F287 VanDerWaalsContact C-N 3.33Å; Q285-F287 PolarHBondContact O-N 3.18Å; Q285-R288 PolarHBondContact O-N 3.37Å; Q285-E289 VanDerWaalsContact CG-OE1 3.32Å; Q285-E289 WeakPolarHBondContact CG-OE1 3.43Å; Q285-E289 PolarHBondContact NE2-OE1 3.12Å; Q285-E289 WeakPolarHBondContact O-CG 3.35Å; Q285-E289 PolarHBondContact O-N 3.16Å
286	N	97.9	Very high	96.5	Very high	1 Å²	1	54.5 Å²	54.5	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-58.4	-47.6	174.6	-172.7	-161.7	0	0	0	111.5	Q282 F283 R288 E289 V290 R366 F367	Q282-N286 PolarHBondContact O-N 3.43Å; Q282-N286 VanDerWaalsContact O-N 3.13Å; F283-N286 WeakPolarHBondContact O-CA 3.28Å; F283-N286 WeakPolarHBondContact O-CB 3.4Å; F283-N286 PolarHBondContact O-N 3.48Å; N286-R288 VanDerWaalsContact C-N 3.31Å; N286-R288 PolarHBondContact O-N 3.42Å; N286-E289 PolarHBondContact O-N 3.19Å; N286-V290 WeakPolarHBondContact ND2-CG2 3.47Å; N286-V290 WeakPolarHBondContact O-CB 3.48Å; N286-V290 WeakPolarHBondContact O-CG2 3.46Å; N286-V290 PolarHBondContact O-N 3.39Å; N286-R366 VanDerWaalsContact CA-NH1 3.34Å; N286-R366 VanDerWaalsContact CG-CD 3.42Å; N286-R366 VanDerWaalsContact ND2-CZ 3.28Å; N286-R366 PolarHBondContact ND2-NE 3.04Å; N286-R366 WeakPolarHBondContact OD1-CA 3.3Å; N286-R366 WeakPolarHBondContact OD1-CD 3.49Å; N286-F367 PolarHBondContact ND2-O 3.29Å; N286-F367 PolarHBondContact OD1-N 3.23Å; N286-F367 PolarHBondContact OD1-O 2.94Å
287	F	98.5	Very high	96.5	Very high	0 Å²	0	52 Å²	52	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59.1	-43	178.9	-179.9	-89.8	0	0	0	111.1	I269 F283 L284 Q285 C291 V292 V298 L300 M320 F326	I269-F287 HydrophobicContact CD1-CD2 4.21Å; I269-F287 HydrophobicContact CD1-CE2 4.11Å; F283-F287 HydrophobicContact CE1-CB 4.24Å; F283-F287 WeakPolarHBondContact O-CB 3.38Å; F283-F287 PolarHBondContact O-N 3.38Å; L284-F287 HydrophobicContact CD1-CD1 4.43Å; L284-F287 PolarHBondContact O-N 3.45Å; Q285-F287 VanDerWaalsContact C-N 3.33Å; Q285-F287 PolarHBondContact O-N 3.18Å; F287-C291 HydrophobicContact CD1-CB 4.33Å; F287-C291 HydrophobicContact CD2-CB 3.77Å; F287-C291 VanDerWaalsContact CD2-SG 3.5Å; F287-C291 HydrophobicContact CE1-CB 4.16Å; F287-C291 HydrophobicContact CE2-CB 3.58Å; F287-C291 HydrophobicContact CG-CB 4.13Å; F287-C291 HydrophobicContact CZ-CB 3.77Å; F287-C291 VanDerWaalsContact O-CA 3.32Å; F287-C291 WeakPolarHBondContact O-CA 3.28Å; F287-C291 WeakPolarHBondContact O-CB 3.47Å; F287-C291 PolarHBondContact O-N 3.08Å; F287-V292 HydrophobicContact CD1-CG2 3.87Å; F287-V292 HydrophobicContact CE1-CG2 3.54Å; F287-V292 HydrophobicContact CZ-CG2 4.49Å; F287-V292 PolarHBondContact O-N 3.48Å; F287-V298 HydrophobicContact CE2-CB 4.49Å; F287-V298 HydrophobicContact CE2-CG1 3.71Å; F287-V298 HydrophobicContact CZ-CG1 4.18Å; F287-L300 HydrophobicContact CD1-CD2 4.27Å; F287-L300 HydrophobicContact CD2-CD1 4.41Å; F287-L300 HydrophobicContact CD2-CD2 4.43Å; F287-L300 HydrophobicContact CE1-CB 4.23Å; F287-L300 HydrophobicContact CE1-CD2 4.25Å; F287-L300 HydrophobicContact CE2-CB 3.76Å; F287-L300 HydrophobicContact CE2-CD1 4.31Å; F287-L300 HydrophobicContact CE2-CD2 4.39Å; F287-L300 HydrophobicContact CE2-CG 4.37Å; F287-L300 HydrophobicContact CG-CD2 4.38Å; F287-L300 HydrophobicContact CZ-CB 3.6Å; F287-L300 HydrophobicContact CZ-CD2 4.32Å; F287-L300 HydrophobicContact CZ-CG 4.46Å; F287-M320 HydrophobicContact CD1-CE 4.37Å; F287-M320 HydrophobicContact CD1-SD 3.87Å; F287-M320 HydrophobicContact CE1-CE 4.21Å; F287-M320 HydrophobicContact CE1-SD 4.21Å; F287-F326 HydrophobicContact CE1-CD1 4.47Å; F287-F326 AromaticContact CE1-CE1 3.74Å; F287-F326 HydrophobicContact CE1-CE1 3.74Å; F287-F326 AromaticContact CE1-CZ 3.88Å; F287-F326 HydrophobicContact CE1-CZ 3.88Å; F287-F326 AromaticContact CZ-CE1 4Å; F287-F326 HydrophobicContact CZ-CE1 4Å; F287-F326 AromaticContact CZ-CZ 3.79Å; F287-F326 HydrophobicContact CZ-CZ 3.79Å
288	R	97.8	Very high	96.6	Very high	78 Å²	78	50.5 Å²	50.5	29%	0.294	23%	0.232	S	C	.	.	I	π-helix	trans	-60.2	-52.7	176.5	-167.3	-170.6	82.3	179.9	-2.8	111.7	L284 Q285 N286 V290 V292 Q293 M320 E324	L284-R288 WeakPolarHBondContact O-CB 3.42Å; L284-R288 PolarHBondContact O-N 3.16Å; Q285-R288 PolarHBondContact O-N 3.37Å; N286-R288 VanDerWaalsContact C-N 3.31Å; N286-R288 PolarHBondContact O-N 3.42Å; R288-V290 VanDerWaalsContact C-N 3.34Å; R288-V290 PolarHBondContact O-N 3.23Å; R288-V292 WeakPolarHBondContact O-CB 3.37Å; R288-V292 PolarHBondContact O-N 3.01Å; R288-Q293 WeakPolarHBondContact O-CG 3.48Å; R288-Q293 PolarHBondContact O-N 3.07Å; R288-M320 HydrophobicContact CG-CG 4.45Å; R288-E324 WeakPolarHBondContact CD-OE1 3.34Å; R288-E324 HydrophobicContact CG-CG 3.81Å; R288-E324 IonicContact CZ-OE1 3.32Å; R288-E324 IonicContact NE-OE1 3.96Å; R288-E324 PolarHBondContact NE-OE1 3.18Å; R288-E324 IonicContact NH1-OE1 2.92Å
289	E	96.7	Very high	96.7	Very high	53 Å²	53	45.6 Å²	45.6	25%	0.248	21%	0.205	C	C	.	.	I	π-helix	trans	-63.5	-37.8	-176.7	-70.3	165.8	-176.8	0	0	112.5	Q285 N286 R294 R366	Q285-E289 VanDerWaalsContact CG-OE1 3.32Å; Q285-E289 WeakPolarHBondContact CG-OE1 3.43Å; Q285-E289 PolarHBondContact NE2-OE1 3.12Å; Q285-E289 WeakPolarHBondContact O-CG 3.35Å; Q285-E289 PolarHBondContact O-N 3.16Å; N286-E289 PolarHBondContact O-N 3.19Å; E289-R294 WeakPolarHBondContact O-CG 3.05Å; E289-R366 IonicContact OE2-CZ 2.77Å; E289-R366 IonicContact OE2-NH1 3.77Å; E289-R366 IonicContact OE2-NH2 3.87Å; E289-R366 PolarHBondContact OE2-NH2 3.46Å
290	V	97.3	Very high	96.8	Very high	10 Å²	10	44.2 Å²	44.2	6%	0.061	20%	0.196	C	C	.	.	I	π-helix	trans	-95.8	-51.8	-174.3	177.5	0	0	0	0	112.2	N286 R288 R294 D295 F367 L369 L372	N286-V290 WeakPolarHBondContact ND2-CG2 3.47Å; N286-V290 WeakPolarHBondContact O-CB 3.48Å; N286-V290 WeakPolarHBondContact O-CG2 3.46Å; N286-V290 PolarHBondContact O-N 3.39Å; R288-V290 VanDerWaalsContact C-N 3.34Å; R288-V290 PolarHBondContact O-N 3.23Å; V290-R294 WeakPolarHBondContact O-CB 3.16Å; V290-D295 PolarHBondContact O-N 3.02Å; V290-F367 HydrophobicContact CB-CE2 4.16Å; V290-F367 HydrophobicContact CG1-CD2 4Å; V290-F367 HydrophobicContact CG1-CE2 3.87Å; V290-L369 HydrophobicContact CG1-CB 4.38Å; V290-L372 HydrophobicContact CG1-CD1 3.9Å; V290-L372 HydrophobicContact CG1-CG 4.48Å
291	C	97.4	Very high	96.8	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	20%	0.197	C	C	.	.	I	π-helix	trans	-84.7	-42.9	-172.4	-56.5	0	0	0	0	112.5	F287 R296 V298 F367	F287-C291 HydrophobicContact CD1-CB 4.33Å; F287-C291 HydrophobicContact CD2-CB 3.77Å; F287-C291 VanDerWaalsContact CD2-SG 3.5Å; F287-C291 HydrophobicContact CE1-CB 4.16Å; F287-C291 HydrophobicContact CE2-CB 3.58Å; F287-C291 HydrophobicContact CG-CB 4.13Å; F287-C291 HydrophobicContact CZ-CB 3.77Å; F287-C291 VanDerWaalsContact O-CA 3.32Å; F287-C291 WeakPolarHBondContact O-CA 3.28Å; F287-C291 WeakPolarHBondContact O-CB 3.47Å; F287-C291 PolarHBondContact O-N 3.08Å; C291-R296 WeakPolarHBondContact O-CA 3.46Å; C291-R296 PolarHBondContact O-N 3.35Å; C291-V298 HydrophobicContact CB-CB 3.91Å; C291-V298 HydrophobicContact CB-CG1 4.13Å; C291-V298 HydrophobicContact CB-CG2 3.77Å; C291-F367 VanDerWaalsContact SG-CE2 3.52Å
292	V	96.3	Very high	96.9	Very high	14 Å²	14	42 Å²	42	9%	0.085	18%	0.181	C	C	.	.	I	π-helix	trans	-84	-45.1	-173.8	-176	0	0	0	0	111.5	F287 R288 R296 M320 E324 F326	F287-V292 HydrophobicContact CD1-CG2 3.87Å; F287-V292 HydrophobicContact CE1-CG2 3.54Å; F287-V292 HydrophobicContact CZ-CG2 4.49Å; F287-V292 PolarHBondContact O-N 3.48Å; R288-V292 WeakPolarHBondContact O-CB 3.37Å; R288-V292 PolarHBondContact O-N 3.01Å; V292-R296 WeakPolarHBondContact O-CG 3.5Å; V292-M320 HydrophobicContact CG2-SD 4.25Å; V292-E324 HydrophobicContact CG1-CB 3.64Å; V292-E324 HydrophobicContact CG1-CG 4.26Å; V292-F326 HydrophobicContact CB-CD2 4.38Å; V292-F326 HydrophobicContact CG1-CB 3.84Å; V292-F326 HydrophobicContact CG1-CD2 3.92Å; V292-F326 HydrophobicContact CG1-CG 4.04Å; V292-F326 HydrophobicContact CG2-CB 4.42Å; V292-F326 HydrophobicContact CG2-CD1 4.18Å; V292-F326 HydrophobicContact CG2-CD2 3.87Å; V292-F326 HydrophobicContact CG2-CE1 4.38Å; V292-F326 HydrophobicContact CG2-CE2 4.1Å; V292-F326 HydrophobicContact CG2-CG 3.89Å; V292-F326 HydrophobicContact CG2-CZ 4.34Å
293	Q	95.1	Very high	97	Very high	94 Å²	94	38 Å²	38	44%	0.439	16%	0.162	S	C	.	.	I	π-helix	trans	-85.1	-28.3	-173.8	-68.1	177.7	-10.7	0	0	113.6	R288 E324	R288-Q293 WeakPolarHBondContact O-CG 3.48Å; R288-Q293 PolarHBondContact O-N 3.07Å; Q293-E324 PolarHBondContact NE2-OE1 2.91Å; Q293-E324 PolarHBondContact NE2-OE2 3.18Å
294	R	94.3	Very high	97	Very high	155 Å²	155	37.7 Å²	37.7	59%	0.585	16%	0.161	S	C	*	.	I	π-helix	trans	-111.7	-62.9	-176.3	-59.1	-178.3	68.6	-167.7	-1.3	113.1	E289 V290 L369	E289-R294 WeakPolarHBondContact O-CG 3.05Å; V290-R294 WeakPolarHBondContact O-CB 3.16Å; R294-L369 HydrophobicContact CB-CD2 4.42Å
295	D	93.9	Very high	96.9	Very high	17 Å²	17	37.3 Å²	37.3	9%	0.091	16%	0.158	C	C	.	.	I	π-helix	trans	-72.6	-48.4	-170.2	-173.9	84.6	0	0	0	114	V290 Q297 V298 L369 L372 R376	V290-D295 PolarHBondContact O-N 3.02Å; D295-Q297 PolarHBondContact O-N 3.03Å; D295-Q297 WeakPolarHBondContact OD2-CA 3.34Å; D295-Q297 WeakPolarHBondContact OD2-CB 3.23Å; D295-Q297 PolarHBondContact OD2-N 3.22Å; D295-V298 HydrophobicContact CB-CG2 4.22Å; D295-V298 WeakPolarHBondContact OD2-CG2 3.34Å; D295-L369 HydrophobicContact CB-CD1 3.7Å; D295-L372 HydrophobicContact CB-CD1 3.89Å; D295-R376 VanDerWaalsContact CG-NH2 3.32Å; D295-R376 IonicContact OD1-CZ 2.71Å; D295-R376 IonicContact OD1-NH1 2.75Å; D295-R376 PolarHBondContact OD1-NH1 3.12Å; D295-R376 IonicContact OD1-NH2 3.44Å; D295-R376 PolarHBondContact OD1-NH2 2.9Å; D295-R376 VanDerWaalsContact OD1-NH2 3.1Å; D295-R376 IonicContact OD2-CZ 3.28Å; D295-R376 IonicContact OD2-NH1 3.63Å; D295-R376 IonicContact OD2-NH2 3.56Å; D295-R376 PolarHBondContact OD2-NH2 3.25Å
296	R	93.1	Very high	96.9	Very high	192 Å²	192	34 Å²	34	73%	0.725	15%	0.149	S	C	*	.			trans	60.4	3.3	-178.8	-53.8	-177.9	70.1	-178.2	2.2	116.1	C291 V292	C291-R296 WeakPolarHBondContact O-CA 3.46Å; C291-R296 PolarHBondContact O-N 3.35Å; V292-R296 WeakPolarHBondContact O-CG 3.5Å
297	Q	94.4	Very high	96.7	Very high	39 Å²	39	39.6 Å²	39.6	18%	0.182	18%	0.175	C	C	.	.			trans	-116.3	47.3	-179.4	-56.9	-174.5	103.3	0	0	110.9	I266 I267 D295 R376	I266-Q297 WeakPolarHBondContact CA-O 3.35Å; I267-Q297 PolarHBondContact N-O 2.81Å; I267-Q297 VanDerWaalsContact N-O 3.09Å; D295-Q297 PolarHBondContact O-N 3.03Å; D295-Q297 WeakPolarHBondContact OD2-CA 3.34Å; D295-Q297 WeakPolarHBondContact OD2-CB 3.23Å; D295-Q297 PolarHBondContact OD2-N 3.22Å; Q297-R376 PolarHBondContact O-NH2 2.83Å
298	V	97.4	Very high	96.6	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.006	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	145.4	-176.7	-170.1	0	0	0	0	109.9	I267 I269 F287 C291 D295 N328 L372	I267-V298 CarbonylContact O-C 3.53Å; I267-V298 WeakPolarHBondContact O-CA 3.46Å; I267-V298 WeakPolarHBondContact O-CG1 3.25Å; I269-V298 HydrophobicContact CD1-CG1 3.58Å; I269-V298 HydrophobicContact CG1-CG1 3.67Å; F287-V298 HydrophobicContact CE2-CB 4.49Å; F287-V298 HydrophobicContact CE2-CG1 3.71Å; F287-V298 HydrophobicContact CZ-CG1 4.18Å; C291-V298 HydrophobicContact CB-CB 3.91Å; C291-V298 HydrophobicContact CB-CG1 4.13Å; C291-V298 HydrophobicContact CB-CG2 3.77Å; D295-V298 HydrophobicContact CB-CG2 4.22Å; D295-V298 WeakPolarHBondContact OD2-CG2 3.34Å; V298-N328 WeakPolarHBondContact O-CB 3.48Å; V298-L372 HydrophobicContact CG2-CD1 4.05Å
299	H	98.1	Very high	96.4	Very high	27 Å²	27	44.6 Å²	44.6	13%	0.125	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	138.7	165.2	-171.9	95.7	0	0	0	109.5	I266 I267 N268 I269 T301 N328 T330 W351	I266-H299 HydrophobicContact CG2-CB 4.37Å; I267-H299 PolarHBondContact O-N 3Å; N268-H299 CarbonylContact C-O 3.38Å; N268-H299 WeakPolarHBondContact CA-O 3.21Å; N268-H299 PolarHBondContact OD1-CD2 3.42Å; N268-H299 PolarHBondContact OD1-O 2.93Å; I269-H299 PolarHBondContact N-O 2.99Å; H299-T301 PolarHBondContact CD2-OG1 3.38Å; H299-N328 VanDerWaalsContact CA-O 3.32Å; H299-N328 WeakPolarHBondContact CA-O 3.32Å; H299-N328 PolarHBondContact ND1-O 3.2Å; H299-T330 PolarHBondContact CE1-OG1 2.91Å; H299-T330 PolarHBondContact NE2-OG1 3.44Å; H299-W351 HydrophobicContact CB-CH2 4.35Å; H299-W351 HydrophobicContact CB-CZ3 3.83Å; H299-W351 AromaticContact CD2-CZ3 3.91Å; H299-W351 AromaticContact CG-CZ3 3.68Å
300	L	98.7	Very high	96.5	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	117.4	176.3	177.6	61.5	0	0	0	110.8	I269 V271 F283 L284 F287 V302 L317 N328 Y329 T330	I269-L300 HydrophobicContact CB-CD1 4.4Å; I269-L300 HydrophobicContact CG2-CD1 4.43Å; V271-L300 HydrophobicContact CG2-CD1 4.02Å; F283-L300 HydrophobicContact CE1-CD1 3.9Å; F283-L300 HydrophobicContact CE1-CD2 4.47Å; F283-L300 HydrophobicContact CZ-CD1 4.27Å; L284-L300 HydrophobicContact CD1-CD2 4.12Å; F287-L300 HydrophobicContact CD1-CD2 4.27Å; F287-L300 HydrophobicContact CD2-CD1 4.41Å; F287-L300 HydrophobicContact CD2-CD2 4.43Å; F287-L300 HydrophobicContact CE1-CB 4.23Å; F287-L300 HydrophobicContact CE1-CD2 4.25Å; F287-L300 HydrophobicContact CE2-CB 3.76Å; F287-L300 HydrophobicContact CE2-CD1 4.31Å; F287-L300 HydrophobicContact CE2-CD2 4.39Å; F287-L300 HydrophobicContact CE2-CG 4.37Å; F287-L300 HydrophobicContact CG-CD2 4.38Å; F287-L300 HydrophobicContact CZ-CB 3.6Å; F287-L300 HydrophobicContact CZ-CD2 4.32Å; F287-L300 HydrophobicContact CZ-CG 4.46Å; L300-V302 HydrophobicContact CD1-CG2 4.16Å; L300-V302 HydrophobicContact CD2-CG2 4.05Å; L300-V302 HydrophobicContact CG-CG2 3.87Å; L300-L317 HydrophobicContact CD2-CD2 3.88Å; L300-N328 PolarHBondContact N-O 3.33Å; L300-Y329 CarbonylContact O-C 3.54Å; L300-Y329 WeakPolarHBondContact O-CA 3.32Å; L300-Y329 WeakPolarHBondContact O-CB 3.14Å; L300-T330 PolarHBondContact O-N 2.86Å
301	T	98.8	Very high	96.5	Very high	3 Å²	3	47.9 Å²	47.9	2%	0.018	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	110.4	171.1	-58	0	0	0	0	109.6	N268 I269 I270 V271 H299 V303 T330 I332	N268-T301 PolarHBondContact ND2-OG1 3.36Å; N268-T301 PolarHBondContact OD1-OG1 3.31Å; I269-T301 PolarHBondContact O-N 3.4Å; I270-T301 WeakPolarHBondContact CA-O 3.4Å; V271-T301 PolarHBondContact N-O 3.29Å; H299-T301 PolarHBondContact CD2-OG1 3.38Å; T301-V303 HydrophobicContact CG2-CG2 4.21Å; T301-T330 CarbonylContact C-O 3.54Å; T301-T330 WeakPolarHBondContact CA-O 3.42Å; T301-I332 HydrophobicContact CG2-CD1 3.99Å
302	V	98.8	Very high	96.5	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	119.8	174	-175.9	0	0	0	0	108.8	V271 L273 F280 L300 V313 L317 T330 L331 I332	V271-V302 WeakPolarHBondContact O-CA 3.17Å; L273-V302 HydrophobicContact CB-CG1 4.44Å; L273-V302 HydrophobicContact CD2-CG1 4.47Å; F280-V302 HydrophobicContact CE2-CG1 4.32Å; F280-V302 HydrophobicContact CE2-CG2 3.86Å; F280-V302 HydrophobicContact CZ-CG2 4.04Å; L300-V302 HydrophobicContact CD1-CG2 4.16Å; L300-V302 HydrophobicContact CD2-CG2 4.05Å; L300-V302 HydrophobicContact CG-CG2 3.87Å; V302-V313 HydrophobicContact CG1-CG1 4.44Å; V302-L317 HydrophobicContact CG2-CD1 4.28Å; V302-T330 PolarHBondContact N-O 3.4Å; V302-L331 HydrophobicContact CB-CD1 3.94Å; V302-L331 HydrophobicContact CG1-CD1 3.88Å; V302-L331 CarbonylContact O-C 3.6Å; V302-L331 WeakPolarHBondContact O-CA 3.34Å; V302-I332 PolarHBondContact O-N 3.13Å
303	V	98.6	Very high	96.6	Very high	0 Å²	0	52 Å²	52	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	107.9	173.6	-173.4	0	0	0	0	108	V271 P272 L273 T301 F305 I332 V334 G343 I346	V271-V303 PolarHBondContact O-N 3.44Å; P272-V303 CarbonylContact C-O 3.53Å; P272-V303 WeakPolarHBondContact CA-O 3.26Å; L273-V303 PolarHBondContact N-O 3.41Å; T301-V303 HydrophobicContact CG2-CG2 4.21Å; V303-F305 HydrophobicContact CG1-CE2 3.87Å; V303-F305 HydrophobicContact CG1-CZ 4.4Å; V303-I332 CarbonylContact C-O 3.55Å; V303-I332 WeakPolarHBondContact CA-O 3.24Å; V303-I332 HydrophobicContact CG2-CB 4.41Å; V303-I332 HydrophobicContact CG2-CD1 4.3Å; V303-V334 HydrophobicContact CG1-CG2 3.63Å; V303-G343 WeakPolarHBondContact CG2-O 3.44Å; V303-I346 HydrophobicContact CG1-CB 4.21Å; V303-I346 HydrophobicContact CG1-CD1 4.49Å; V303-I346 HydrophobicContact CG1-CG2 3.97Å; V303-I346 HydrophobicContact CG2-CG2 4.32Å
304	Y	98.4	Very high	96.7	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	121.9	-170.5	-163	-86.8	0	0	0	111.5	L273 G275 G306 E308 G309 L310 V313 I332 P333 V334	L273-Y304 HydrophobicContact CB-CD2 4.07Å; L273-Y304 HydrophobicContact CB-CE2 4.39Å; L273-Y304 HydrophobicContact CD2-CD2 3.78Å; L273-Y304 HydrophobicContact CD2-CE2 3.66Å; L273-Y304 HydrophobicContact CG-CD2 3.92Å; L273-Y304 HydrophobicContact CG-CE2 3.77Å; L273-Y304 CarbonylContact O-C 3.54Å; L273-Y304 WeakPolarHBondContact O-CA 3.41Å; G275-Y304 WeakPolarHBondContact CA-OH 3.47Å; G275-Y304 PolarHBondContact N-OH 3.35Å; Y304-G306 WeakPolarHBondContact CD1-O 3.44Å; Y304-G306 WeakPolarHBondContact CE1-O 3.48Å; Y304-E308 PolarHBondContact OH-O 3.48Å; Y304-G309 VanDerWaalsContact OH-C 3.24Å; Y304-G309 WeakPolarHBondContact OH-CA 3.5Å; Y304-L310 HydrophobicContact CD1-CB 3.77Å; Y304-L310 HydrophobicContact CD1-CD1 3.58Å; Y304-L310 HydrophobicContact CD1-CG 4.17Å; Y304-L310 HydrophobicContact CE1-CB 3.63Å; Y304-L310 HydrophobicContact CE1-CD1 4.3Å; Y304-L310 HydrophobicContact CG-CD1 3.71Å; Y304-V313 HydrophobicContact CD2-CB 4.34Å; Y304-V313 HydrophobicContact CD2-CG1 4.18Å; Y304-V313 HydrophobicContact CD2-CG2 4.16Å; Y304-V313 HydrophobicContact CE2-CB 4.19Å; Y304-V313 HydrophobicContact CE2-CG1 4.47Å; Y304-V313 HydrophobicContact CE2-CG2 3.63Å; Y304-I332 PolarHBondContact N-O 2.96Å; Y304-P333 CarbonylContact O-C 3.6Å; Y304-P333 WeakPolarHBondContact O-CA 3.47Å; Y304-V334 PolarHBondContact O-N 3.36Å
305	F	97.3	Very high	96.9	Very high	6 Å²	6	47.5 Å²	47.5	3%	0.026	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	129.9	178.9	-70.3	-103.1	0	0	0	111.1	L273 A274 V303 V334 E336 E337 F338 R342	L273-F305 PolarHBondContact O-N 3.15Å; A274-F305 HydrophobicContact CB-CB 4.08Å; V303-F305 HydrophobicContact CG1-CE2 3.87Å; V303-F305 HydrophobicContact CG1-CZ 4.4Å; F305-V334 WeakPolarHBondContact CA-O 3.37Å; F305-V334 HydrophobicContact CD1-CB 4.16Å; F305-V334 HydrophobicContact CD1-CG1 3.96Å; F305-V334 HydrophobicContact CE1-CB 4.27Å; F305-V334 HydrophobicContact CE1-CG1 3.81Å; F305-V334 HydrophobicContact CG-CB 4.43Å; F305-V334 HydrophobicContact CZ-CG1 4.44Å; F305-E336 HydrophobicContact CD1-CB 4.13Å; F305-E336 HydrophobicContact CE1-CB 4.25Å; F305-E337 VanDerWaalsContact CD1-O 3.29Å; F305-E337 WeakPolarHBondContact CD1-O 3.37Å; F305-F338 HydrophobicContact CB-CB 4.26Å; F305-F338 HydrophobicContact CB-CD2 4.24Å; F305-F338 AromaticContact CD2-CD2 3.72Å; F305-F338 HydrophobicContact CD2-CD2 3.72Å; F305-F338 HydrophobicContact CD2-CE2 4.29Å; F305-F338 HydrophobicContact CE2-CD2 4.3Å; F305-F338 HydrophobicContact CG-CB 4.44Å; F305-F338 HydrophobicContact CG-CD2 4.05Å; F305-R342 HydrophobicContact CE1-CG 4.33Å; F305-R342 HydrophobicContact CZ-CB 4.39Å; F305-R342 HydrophobicContact CZ-CG 4.23Å
306	G	95.8	Very high	97.1	Very high	23 Å²	23	48.2 Å²	48.2	24%	0.237	24%	0.236	C	C	.	.	S	Bend	trans	83.7	179.5	179.2	0	0	0	0	0	114.3	Y304 V334	Y304-G306 WeakPolarHBondContact CD1-O 3.44Å; Y304-G306 WeakPolarHBondContact CE1-O 3.48Å; G306-V334 PolarHBondContact N-O 3.12Å
307	Q	94.4	Very high	97.3	Very high	119 Å²	119	39.1 Å²	39.1	56%	0.556	20%	0.201	S	C	*	.	S	Bend	trans	-101.4	-32.4	-176.1	-60.6	-58.3	-35.1	0	0	113.6	G309 L310	Q307-G309 PolarHBondContact O-N 2.82Å; Q307-L310 WeakPolarHBondContact O-CB 3.49Å; Q307-L310 PolarHBondContact O-N 3.22Å
308	E	95.1	Very high	97.4	Very high	174 Å²	174	40.5 Å²	40.5	81%	0.813	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	123.2	-179.8	-176.7	-177.9	-178.3	0	0	110	Y304 L310	Y304-E308 PolarHBondContact OH-O 3.48Å; E308-L310 VanDerWaalsContact C-N 3.32Å; E308-L310 PolarHBondContact O-N 3.05Å
309	G	95.6	Very high	97.4	Very high	9 Å²	9	45.6 Å²	45.6	9%	0.093	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.3	-8.9	179.4	0	0	0	0	0	115.6	Y304 Q307 Q311 E312 V313	Y304-G309 VanDerWaalsContact OH-C 3.24Å; Y304-G309 WeakPolarHBondContact OH-CA 3.5Å; Q307-G309 PolarHBondContact O-N 2.82Å; G309-Q311 PolarHBondContact O-N 3.44Å; G309-E312 WeakPolarHBondContact CA-OE2 3.39Å; G309-E312 PolarHBondContact O-N 3.39Å; G309-V313 WeakPolarHBondContact O-CG2 3.22Å; G309-V313 PolarHBondContact O-N 3.17Å
310	L	97.3	Very high	97.3	Very high	13 Å²	13	44.6 Å²	44.6	7%	0.068	23%	0.225	C	C	.	.	H	α-helix	trans	-63.6	-40.5	-176.5	175.1	60.1	0	0	0	112.3	Y304 Q307 E308 E312 V313 K314 L331 P333	Y304-L310 HydrophobicContact CD1-CB 3.77Å; Y304-L310 HydrophobicContact CD1-CD1 3.58Å; Y304-L310 HydrophobicContact CD1-CG 4.17Å; Y304-L310 HydrophobicContact CE1-CB 3.63Å; Y304-L310 HydrophobicContact CE1-CD1 4.3Å; Y304-L310 HydrophobicContact CG-CD1 3.71Å; Q307-L310 WeakPolarHBondContact O-CB 3.49Å; Q307-L310 PolarHBondContact O-N 3.22Å; E308-L310 VanDerWaalsContact C-N 3.32Å; E308-L310 PolarHBondContact O-N 3.05Å; L310-E312 VanDerWaalsContact C-N 3.35Å; L310-V313 PolarHBondContact O-N 3.31Å; L310-K314 VanDerWaalsContact O-CB 3.31Å; L310-K314 WeakPolarHBondContact O-CB 3.4Å; L310-K314 PolarHBondContact O-N 2.75Å; L310-L331 HydrophobicContact CD1-CD1 4.4Å; L310-L331 HydrophobicContact CD1-CD2 4.12Å; L310-P333 HydrophobicContact CD1-CB 4.25Å; L310-P333 HydrophobicContact CD2-CB 3.86Å
311	Q	97.6	Very high	97.2	Very high	119 Å²	119	46 Å²	46	56%	0.556	24%	0.235	S	C	*	.	H	α-helix	trans	-69.2	-36.4	-178.9	-66.1	-55.5	-40	0	0	111.6	G309 K314 S315	G309-Q311 PolarHBondContact O-N 3.44Å; Q311-K314 PolarHBondContact O-N 3.23Å; Q311-S315 VanDerWaalsContact O-CB 3.27Å; Q311-S315 WeakPolarHBondContact O-CB 3.49Å; Q311-S315 PolarHBondContact O-N 2.95Å
312	E	97.9	Very high	97	Very high	102 Å²	102	53.3 Å²	53.3	48%	0.477	26%	0.262	S	S	.	.	H	α-helix	trans	-65.7	-46.3	176.1	-64.4	82.9	169.4	0	0	110.7	V277 G309 L310 S315 S316	V277-E312 HydrophobicContact CG1-CB 3.68Å; V277-E312 HydrophobicContact CG2-CB 4.35Å; G309-E312 WeakPolarHBondContact CA-OE2 3.39Å; G309-E312 PolarHBondContact O-N 3.39Å; L310-E312 VanDerWaalsContact C-N 3.35Å; E312-S315 PolarHBondContact O-N 3.14Å; E312-S316 WeakPolarHBondContact O-CB 3.42Å; E312-S316 PolarHBondContact O-N 3.29Å; E312-S316 PolarHBondContact O-OG 2.99Å
313	V	97.8	Very high	96.9	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60.3	-46.1	174.4	166.3	0	0	0	0	111.4	L273 V277 F280 V302 Y304 G309 L310 S315 S316 L317 L331	L273-V313 HydrophobicContact CD2-CG1 4.5Å; L273-V313 HydrophobicContact CD2-CG2 3.93Å; V277-V313 HydrophobicContact CG2-CG2 4.36Å; F280-V313 HydrophobicContact CD1-CB 4.31Å; F280-V313 HydrophobicContact CD1-CG1 4.04Å; F280-V313 HydrophobicContact CD1-CG2 3.81Å; F280-V313 HydrophobicContact CE1-CB 4.31Å; F280-V313 HydrophobicContact CE1-CG1 3.68Å; F280-V313 HydrophobicContact CE1-CG2 4.29Å; F280-V313 HydrophobicContact CG-CG2 4.28Å; F280-V313 HydrophobicContact CZ-CG1 4.02Å; V302-V313 HydrophobicContact CG1-CG1 4.44Å; Y304-V313 HydrophobicContact CD2-CB 4.34Å; Y304-V313 HydrophobicContact CD2-CG1 4.18Å; Y304-V313 HydrophobicContact CD2-CG2 4.16Å; Y304-V313 HydrophobicContact CE2-CB 4.19Å; Y304-V313 HydrophobicContact CE2-CG1 4.47Å; Y304-V313 HydrophobicContact CE2-CG2 3.63Å; G309-V313 WeakPolarHBondContact O-CG2 3.22Å; G309-V313 PolarHBondContact O-N 3.17Å; L310-V313 PolarHBondContact O-N 3.31Å; V313-S315 PolarHBondContact O-N 3.42Å; V313-S316 PolarHBondContact O-N 3.22Å; V313-L317 HydrophobicContact CG1-CD1 4.16Å; V313-L317 WeakPolarHBondContact O-CG 3.42Å; V313-L317 PolarHBondContact O-N 3.21Å; V313-L331 HydrophobicContact CG1-CD1 4.22Å
314	K	98	Very high	96.7	Very high	89 Å²	89	61 Å²	61	39%	0.387	30%	0.298	S	S	.	.	H	α-helix	trans	-59.2	-47.9	176.1	-176.8	178.9	174.4	-176.7	0	111.5	L310 Q311 S316 L317 E318 L331	L310-K314 VanDerWaalsContact O-CB 3.31Å; L310-K314 WeakPolarHBondContact O-CB 3.4Å; L310-K314 PolarHBondContact O-N 2.75Å; Q311-K314 PolarHBondContact O-N 3.23Å; K314-S316 VanDerWaalsContact C-N 3.33Å; K314-S316 PolarHBondContact O-N 2.94Å; K314-L317 PolarHBondContact O-N 3.16Å; K314-E318 WeakPolarHBondContact CE-OE1 3.38Å; K314-E318 HydrophobicContact CG-CG 4.48Å; K314-E318 WeakPolarHBondContact O-CB 3.32Å; K314-E318 WeakPolarHBondContact O-CG 3.4Å; K314-E318 PolarHBondContact O-N 2.93Å; K314-L331 HydrophobicContact CB-CD2 3.78Å; K314-L331 HydrophobicContact CG-CD2 4.06Å
315	S	97.9	Very high	96.4	Very high	65 Å²	65	67.4 Å²	67.4	46%	0.455	34%	0.337	S	S	.	.	H	α-helix	trans	-60.4	-41.7	178	176.6	0	0	0	0	112	Q311 E312 V313 E318 K319	Q311-S315 VanDerWaalsContact O-CB 3.27Å; Q311-S315 WeakPolarHBondContact O-CB 3.49Å; Q311-S315 PolarHBondContact O-N 2.95Å; E312-S315 PolarHBondContact O-N 3.14Å; V313-S315 PolarHBondContact O-N 3.42Å; S315-E318 PolarHBondContact O-N 3.21Å; S315-K319 VanDerWaalsContact O-CB 3.26Å; S315-K319 WeakPolarHBondContact O-CB 3.39Å; S315-K319 PolarHBondContact O-N 2.96Å
316	S	97.6	Very high	96.3	Very high	32 Å²	32	67.9 Å²	67.9	22%	0.224	34%	0.339	C	S	.	.	H	α-helix	trans	-63.7	-43.2	176.7	-69.6	0	0	0	0	112.5	E312 V313 K314 K319 M320	E312-S316 WeakPolarHBondContact O-CB 3.42Å; E312-S316 PolarHBondContact O-N 3.29Å; E312-S316 PolarHBondContact O-OG 2.99Å; V313-S316 PolarHBondContact O-N 3.22Å; K314-S316 VanDerWaalsContact C-N 3.33Å; K314-S316 PolarHBondContact O-N 2.94Å; S316-K319 PolarHBondContact O-N 3.32Å; S316-M320 PolarHBondContact O-N 3.46Å
317	L	97.9	Very high	96.2	Very high	1 Å²	1	71.1 Å²	71.1	1%	0.005	36%	0.358	C	S	.	.	H	α-helix	trans	-63.1	-46.8	174.6	-76	168.6	0	0	0	111.9	F280 L284 L300 V302 V313 K314 K319 M320 S321 Y329 L331	F280-L317 HydrophobicContact CE1-CG 4.21Å; F280-L317 HydrophobicContact CZ-CD1 4.31Å; F280-L317 HydrophobicContact CZ-CD2 3.96Å; F280-L317 HydrophobicContact CZ-CG 3.98Å; L284-L317 HydrophobicContact CD1-CD2 3.93Å; L300-L317 HydrophobicContact CD2-CD2 3.88Å; V302-L317 HydrophobicContact CG2-CD1 4.28Å; V313-L317 HydrophobicContact CG1-CD1 4.16Å; V313-L317 WeakPolarHBondContact O-CG 3.42Å; V313-L317 PolarHBondContact O-N 3.21Å; K314-L317 PolarHBondContact O-N 3.16Å; L317-K319 VanDerWaalsContact C-N 3.31Å; L317-K319 PolarHBondContact O-N 3.42Å; L317-M320 HydrophobicContact CD2-CE 4.31Å; L317-M320 PolarHBondContact O-N 3.11Å; L317-S321 WeakPolarHBondContact O-CB 3.36Å; L317-S321 PolarHBondContact O-N 3.42Å; L317-Y329 HydrophobicContact CB-CD2 4.24Å; L317-Y329 HydrophobicContact CB-CE2 3.88Å; L317-Y329 HydrophobicContact CD1-CD2 4.22Å; L317-Y329 HydrophobicContact CD1-CE2 4.37Å; L317-Y329 HydrophobicContact CD2-CD2 4.12Å; L317-Y329 HydrophobicContact CG-CD2 4.45Å; L317-L331 HydrophobicContact CD1-CB 4.15Å; L317-L331 HydrophobicContact CD1-CD1 4.23Å; L317-L331 HydrophobicContact CD1-CD2 4.31Å; L317-L331 HydrophobicContact CD1-CG 4.47Å
318	E	97.3	Very high	96.2	Very high	67 Å²	67	68.9 Å²	68.9	31%	0.313	35%	0.35	S	S	.	.	H	α-helix	trans	-64.2	-36.8	177.7	-72.9	-179.5	-176.4	0	0	112.2	K314 S315 S321 R322	K314-E318 WeakPolarHBondContact CE-OE1 3.38Å; K314-E318 HydrophobicContact CG-CG 4.48Å; K314-E318 WeakPolarHBondContact O-CB 3.32Å; K314-E318 WeakPolarHBondContact O-CG 3.4Å; K314-E318 PolarHBondContact O-N 2.93Å; S315-E318 PolarHBondContact O-N 3.21Å; E318-S321 PolarHBondContact O-N 3.29Å; E318-R322 WeakPolarHBondContact O-CG 3.29Å; E318-R322 PolarHBondContact O-N 3.49Å; E318-R322 IonicContact OE2-NH1 3.5Å; E318-R322 PolarHBondContact OE2-NH1 3.24Å
319	K	96.6	Very high	96.3	Very high	108 Å²	108	63.3 Å²	63.3	47%	0.47	32%	0.322	S	S	.	.	H	α-helix	trans	-61.2	-53.1	174.3	-179.7	-175	174.1	-173.6	0	110.7	S315 S316 L317 S321 R322 E323	S315-K319 VanDerWaalsContact O-CB 3.26Å; S315-K319 WeakPolarHBondContact O-CB 3.39Å; S315-K319 PolarHBondContact O-N 2.96Å; S316-K319 PolarHBondContact O-N 3.32Å; L317-K319 VanDerWaalsContact C-N 3.31Å; L317-K319 PolarHBondContact O-N 3.42Å; K319-S321 VanDerWaalsContact C-N 3.28Å; K319-S321 PolarHBondContact O-N 3.49Å; K319-R322 PolarHBondContact O-N 3.44Å; K319-E323 VanDerWaalsContact CE-CD 3.5Å; K319-E323 WeakPolarHBondContact CE-OE1 3.36Å; K319-E323 WeakPolarHBondContact CE-OE2 3.5Å; K319-E323 HydrophobicContact CG-CG 4.38Å; K319-E323 WeakPolarHBondContact CG-OE1 3.44Å; K319-E323 IonicContact NZ-OE1 3.36Å; K319-E323 WeakPolarHBondContact O-CB 3.33Å; K319-E323 WeakPolarHBondContact O-CG 3.48Å; K319-E323 PolarHBondContact O-N 3.39Å
320	M	96.1	Very high	96.4	Very high	7 Å²	7	65.4 Å²	65.4	3%	0.034	33%	0.333	C	S	.	.	H	α-helix	trans	-57	-43.9	176.3	179.6	-165.1	64.8	0	0	111.2	L284 F287 R288 V292 S316 L317 R322 E323 E324 F326	L284-M320 HydrophobicContact CD1-CE 3.9Å; L284-M320 HydrophobicContact CD1-SD 3.49Å; L284-M320 WeakPolarHBondContact CD1-SD 3.17Å; L284-M320 HydrophobicContact CD2-CB 4.28Å; L284-M320 HydrophobicContact CG-SD 3.91Å; F287-M320 HydrophobicContact CD1-CE 4.37Å; F287-M320 HydrophobicContact CD1-SD 3.87Å; F287-M320 HydrophobicContact CE1-CE 4.21Å; F287-M320 HydrophobicContact CE1-SD 4.21Å; R288-M320 HydrophobicContact CG-CG 4.45Å; V292-M320 HydrophobicContact CG2-SD 4.25Å; S316-M320 PolarHBondContact O-N 3.46Å; L317-M320 HydrophobicContact CD2-CE 4.31Å; L317-M320 PolarHBondContact O-N 3.11Å; M320-R322 VanDerWaalsContact C-N 3.34Å; M320-R322 PolarHBondContact O-N 2.78Å; M320-E323 PolarHBondContact O-N 3.11Å; M320-E324 HydrophobicContact CG-CG 4.39Å; M320-E324 WeakPolarHBondContact O-CB 3.38Å; M320-E324 PolarHBondContact O-N 2.99Å; M320-F326 HydrophobicContact CE-CD1 3.78Å; M320-F326 HydrophobicContact CE-CE1 4.19Å
321	S	95.9	Very high	96.5	Very high	28 Å²	28	66.8 Å²	66.8	20%	0.196	34%	0.34	C	S	.	.	H	α-helix	trans	-58.6	-43.6	178.9	-176.8	0	0	0	0	112.6	L317 E318 K319 T325 F326	L317-S321 WeakPolarHBondContact O-CB 3.36Å; L317-S321 PolarHBondContact O-N 3.42Å; E318-S321 PolarHBondContact O-N 3.29Å; K319-S321 VanDerWaalsContact C-N 3.28Å; K319-S321 PolarHBondContact O-N 3.49Å; S321-T325 VanDerWaalsContact O-CA 3.28Å; S321-T325 WeakPolarHBondContact O-CA 3.42Å; S321-T325 PolarHBondContact O-N 3.14Å; S321-T325 VanDerWaalsContact O-N 3.11Å; S321-F326 VanDerWaalsContact CA-O 3.29Å; S321-F326 WeakPolarHBondContact CA-O 3.21Å; S321-F326 VanDerWaalsContact CB-O 3.26Å; S321-F326 WeakPolarHBondContact CB-O 3.21Å; S321-F326 PolarHBondContact O-N 3.47Å; S321-F326 VanDerWaalsContact O-N 3.16Å; S321-F326 PolarHBondContact OG-O 3.26Å
322	R	96.1	Very high	96.5	Very high	158 Å²	158	62.7 Å²	62.7	60%	0.596	32%	0.322	S	S	*	.	H	α-helix	trans	-70.9	-42.9	177.2	-72	-173.9	-62	-99.1	-1.6	113	E318 K319 M320	E318-R322 WeakPolarHBondContact O-CG 3.29Å; E318-R322 PolarHBondContact O-N 3.49Å; E318-R322 IonicContact OE2-NH1 3.5Å; E318-R322 PolarHBondContact OE2-NH1 3.24Å; K319-R322 PolarHBondContact O-N 3.44Å; M320-R322 VanDerWaalsContact C-N 3.34Å; M320-R322 PolarHBondContact O-N 2.78Å
323	E	95.4	Very high	96.5	Very high	111 Å²	111	61.6 Å²	61.6	52%	0.519	32%	0.324	S	S	.	.	H	α-helix	trans	-71.6	-38.7	-175.6	-73	176.5	175.1	0	0	112.5	K319 M320	K319-E323 VanDerWaalsContact CE-CD 3.5Å; K319-E323 WeakPolarHBondContact CE-OE1 3.36Å; K319-E323 WeakPolarHBondContact CE-OE2 3.5Å; K319-E323 HydrophobicContact CG-CG 4.38Å; K319-E323 WeakPolarHBondContact CG-OE1 3.44Å; K319-E323 IonicContact NZ-OE1 3.36Å; K319-E323 WeakPolarHBondContact O-CB 3.33Å; K319-E323 WeakPolarHBondContact O-CG 3.48Å; K319-E323 PolarHBondContact O-N 3.39Å; M320-E323 PolarHBondContact O-N 3.11Å
324	E	93.8	Very high	96.5	Very high	51 Å²	51	62.3 Å²	62.3	24%	0.238	33%	0.328	C	S	.	.	H	α-helix	trans	-105.5	3.2	-173.6	-56.7	-73.7	161.4	0	0	112.7	R288 V292 Q293 M320 F326	R288-E324 WeakPolarHBondContact CD-OE1 3.34Å; R288-E324 HydrophobicContact CG-CG 3.81Å; R288-E324 IonicContact CZ-OE1 3.32Å; R288-E324 IonicContact NE-OE1 3.96Å; R288-E324 PolarHBondContact NE-OE1 3.18Å; R288-E324 IonicContact NH1-OE1 2.92Å; V292-E324 HydrophobicContact CG1-CB 3.64Å; V292-E324 HydrophobicContact CG1-CG 4.26Å; Q293-E324 PolarHBondContact NE2-OE1 2.91Å; Q293-E324 PolarHBondContact NE2-OE2 3.18Å; M320-E324 HydrophobicContact CG-CG 4.39Å; M320-E324 WeakPolarHBondContact O-CB 3.38Å; M320-E324 PolarHBondContact O-N 2.99Å; E324-F326 HydrophobicContact CB-CB 4.42Å; E324-F326 PolarHBondContact O-N 3.13Å
325	T	93.1	Very high	96.4	Very high	133 Å²	133	64.5 Å²	64.5	82%	0.816	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	39.8	-174.4	54.4	0	0	0	0	113.1	S321	S321-T325 VanDerWaalsContact O-CA 3.28Å; S321-T325 WeakPolarHBondContact O-CA 3.42Å; S321-T325 PolarHBondContact O-N 3.14Å; S321-T325 VanDerWaalsContact O-N 3.11Å
326	F	94.3	Very high	96.1	Very high	16 Å²	16	65.7 Å²	65.7	7%	0.07	34%	0.342	C	S	.	.			trans	-104.2	123.3	-176.6	-178.4	-100.1	0	0	0	111.6	F287 V292 M320 S321 E324 N328 Y329	F287-F326 HydrophobicContact CE1-CD1 4.47Å; F287-F326 AromaticContact CE1-CE1 3.74Å; F287-F326 HydrophobicContact CE1-CE1 3.74Å; F287-F326 AromaticContact CE1-CZ 3.88Å; F287-F326 HydrophobicContact CE1-CZ 3.88Å; F287-F326 AromaticContact CZ-CE1 4Å; F287-F326 HydrophobicContact CZ-CE1 4Å; F287-F326 AromaticContact CZ-CZ 3.79Å; F287-F326 HydrophobicContact CZ-CZ 3.79Å; V292-F326 HydrophobicContact CB-CD2 4.38Å; V292-F326 HydrophobicContact CG1-CB 3.84Å; V292-F326 HydrophobicContact CG1-CD2 3.92Å; V292-F326 HydrophobicContact CG1-CG 4.04Å; V292-F326 HydrophobicContact CG2-CB 4.42Å; V292-F326 HydrophobicContact CG2-CD1 4.18Å; V292-F326 HydrophobicContact CG2-CD2 3.87Å; V292-F326 HydrophobicContact CG2-CE1 4.38Å; V292-F326 HydrophobicContact CG2-CE2 4.1Å; V292-F326 HydrophobicContact CG2-CG 3.89Å; V292-F326 HydrophobicContact CG2-CZ 4.34Å; M320-F326 HydrophobicContact CE-CD1 3.78Å; M320-F326 HydrophobicContact CE-CE1 4.19Å; S321-F326 VanDerWaalsContact CA-O 3.29Å; S321-F326 WeakPolarHBondContact CA-O 3.21Å; S321-F326 VanDerWaalsContact CB-O 3.26Å; S321-F326 WeakPolarHBondContact CB-O 3.21Å; S321-F326 PolarHBondContact O-N 3.47Å; S321-F326 VanDerWaalsContact O-N 3.16Å; S321-F326 PolarHBondContact OG-O 3.26Å; E324-F326 HydrophobicContact CB-CB 4.42Å; E324-F326 PolarHBondContact O-N 3.13Å; F326-N328 HydrophobicContact CE1-CB 4.21Å; F326-N328 WeakPolarHBondContact CE1-O 3.4Å; F326-N328 HydrophobicContact CE2-CB 3.81Å; F326-N328 HydrophobicContact CZ-CB 3.59Å; F326-N328 WeakPolarHBondContact CZ-O 3.31Å; F326-Y329 HydrophobicContact CD1-CD1 4.34Å; F326-Y329 HydrophobicContact CE1-CD1 4.5Å
327	S	93.6	Very high	95.8	Very high	91 Å²	91	72.9 Å²	72.9	64%	0.636	37%	0.372	S	S	*	.			trans	-113.4	-5	-177.9	56.3	0	0	0	0	114.7	Y329	S327-Y329 VanDerWaalsContact C-N 3.26Å; S327-Y329 PolarHBondContact O-N 2.98Å
328	N	95.6	Very high	95.5	Very high	72 Å²	72	77.8 Å²	77.8	39%	0.385	39%	0.394	S	S	.	.			trans	-87.6	63.4	-172.3	-58.8	-15.6	0	0	0	111.1	V298 H299 L300 F326	V298-N328 WeakPolarHBondContact O-CB 3.48Å; H299-N328 VanDerWaalsContact CA-O 3.32Å; H299-N328 WeakPolarHBondContact CA-O 3.32Å; H299-N328 PolarHBondContact ND1-O 3.2Å; L300-N328 PolarHBondContact N-O 3.33Å; F326-N328 HydrophobicContact CE1-CB 4.21Å; F326-N328 WeakPolarHBondContact CE1-O 3.4Å; F326-N328 HydrophobicContact CE2-CB 3.81Å; F326-N328 HydrophobicContact CZ-CB 3.59Å; F326-N328 WeakPolarHBondContact CZ-O 3.31Å
329	Y	97.5	Very high	95.2	Very high	57 Å²	57	76.8 Å²	76.8	22%	0.224	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	162	172.3	73.2	-82	0	0	0	112.1	L300 L317 F326 S327	L300-Y329 CarbonylContact O-C 3.54Å; L300-Y329 WeakPolarHBondContact O-CA 3.32Å; L300-Y329 WeakPolarHBondContact O-CB 3.14Å; L317-Y329 HydrophobicContact CB-CD2 4.24Å; L317-Y329 HydrophobicContact CB-CE2 3.88Å; L317-Y329 HydrophobicContact CD1-CD2 4.22Å; L317-Y329 HydrophobicContact CD1-CE2 4.37Å; L317-Y329 HydrophobicContact CD2-CD2 4.12Å; L317-Y329 HydrophobicContact CG-CD2 4.45Å; F326-Y329 HydrophobicContact CD1-CD1 4.34Å; F326-Y329 HydrophobicContact CE1-CD1 4.5Å; S327-Y329 VanDerWaalsContact C-N 3.26Å; S327-Y329 PolarHBondContact O-N 2.98Å
330	T	98.1	Very high	95	Very high	53 Å²	53	73.3 Å²	73.3	33%	0.325	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	128.6	176.8	-57.1	0	0	0	0	108.8	H299 L300 T301 V302 I332	H299-T330 PolarHBondContact CE1-OG1 2.91Å; H299-T330 PolarHBondContact NE2-OG1 3.44Å; L300-T330 PolarHBondContact O-N 2.86Å; T301-T330 CarbonylContact C-O 3.54Å; T301-T330 WeakPolarHBondContact CA-O 3.42Å; V302-T330 PolarHBondContact N-O 3.4Å; T330-I332 HydrophobicContact CG2-CD1 4.28Å; T330-I332 HydrophobicContact CG2-CG1 3.86Å
331	L	98.4	Very high	94.9	Very high	42 Å²	42	73.2 Å²	73.2	22%	0.22	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	122.4	172.6	176.9	63.8	0	0	0	108.8	V302 L310 V313 K314 L317	V302-L331 HydrophobicContact CB-CD1 3.94Å; V302-L331 HydrophobicContact CG1-CD1 3.88Å; V302-L331 CarbonylContact O-C 3.6Å; V302-L331 WeakPolarHBondContact O-CA 3.34Å; L310-L331 HydrophobicContact CD1-CD1 4.4Å; L310-L331 HydrophobicContact CD1-CD2 4.12Å; V313-L331 HydrophobicContact CG1-CD1 4.22Å; K314-L331 HydrophobicContact CB-CD2 3.78Å; K314-L331 HydrophobicContact CG-CD2 4.06Å; L317-L331 HydrophobicContact CD1-CB 4.15Å; L317-L331 HydrophobicContact CD1-CD1 4.23Å; L317-L331 HydrophobicContact CD1-CD2 4.31Å; L317-L331 HydrophobicContact CD1-CG 4.47Å
332	I	98.6	Very high	94.8	Very high	34 Å²	34	75.7 Å²	75.7	17%	0.174	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	99.3	-178.5	-52.2	178.3	0	0	0	108.2	T301 V302 V303 Y304 T330 V334 I346 A350	T301-I332 HydrophobicContact CG2-CD1 3.99Å; V302-I332 PolarHBondContact O-N 3.13Å; V303-I332 CarbonylContact C-O 3.55Å; V303-I332 WeakPolarHBondContact CA-O 3.24Å; V303-I332 HydrophobicContact CG2-CB 4.41Å; V303-I332 HydrophobicContact CG2-CD1 4.3Å; Y304-I332 PolarHBondContact N-O 2.96Å; T330-I332 HydrophobicContact CG2-CD1 4.28Å; T330-I332 HydrophobicContact CG2-CG1 3.86Å; I332-V334 HydrophobicContact CG2-CG2 4.29Å; I332-I346 HydrophobicContact CD1-CG2 4.33Å; I332-I346 HydrophobicContact CG2-CG2 3.98Å; I332-A350 HydrophobicContact CD1-CB 3.3Å
333	P	97.8	Very high	94.8	Very high	79 Å²	79	68.1 Å²	68.1	51%	0.513	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	136.2	172.8	29.9	-32.6	0	0	0	110.5	Y304 L310	Y304-P333 CarbonylContact O-C 3.6Å; Y304-P333 WeakPolarHBondContact O-CA 3.47Å; L310-P333 HydrophobicContact CD1-CB 4.25Å; L310-P333 HydrophobicContact CD2-CB 3.86Å
334	V	97.2	Very high	94.9	Very high	15 Å²	15	62.9 Å²	62.9	9%	0.091	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	122.6	-178.8	-177	0	0	0	0	108.1	V303 Y304 F305 G306 I332 E336 I346	V303-V334 HydrophobicContact CG1-CG2 3.63Å; Y304-V334 PolarHBondContact O-N 3.36Å; F305-V334 WeakPolarHBondContact CA-O 3.37Å; F305-V334 HydrophobicContact CD1-CB 4.16Å; F305-V334 HydrophobicContact CD1-CG1 3.96Å; F305-V334 HydrophobicContact CE1-CB 4.27Å; F305-V334 HydrophobicContact CE1-CG1 3.81Å; F305-V334 HydrophobicContact CG-CB 4.43Å; F305-V334 HydrophobicContact CZ-CG1 4.44Å; G306-V334 PolarHBondContact N-O 3.12Å; I332-V334 HydrophobicContact CG2-CG2 4.29Å; V334-E336 VanDerWaalsContact C-N 3.27Å; V334-E336 HydrophobicContact CG1-CB 3.81Å; V334-E336 HydrophobicContact CG1-CG 3.71Å; V334-E336 PolarHBondContact O-N 2.9Å; V334-I346 HydrophobicContact CG1-CD1 4.26Å; V334-I346 HydrophobicContact CG2-CD1 3.93Å
335	D	95.3	Very high	95	Very high	134 Å²	134	61.5 Å²	61.5	72%	0.717	33%	0.325	S	S	*	.			trans	-91.9	59.8	178.9	-160	38.6	0	0	0	110.4
336	E	92.6	Very high	95.2	Very high	91 Å²	91	56.6 Å²	56.6	43%	0.425	29%	0.294	S	S	.	.	S	Bend	trans	-135.2	162.4	179.4	-62.3	175.7	-162.9	0	0	109.1	F305 V334 R342	F305-E336 HydrophobicContact CD1-CB 4.13Å; F305-E336 HydrophobicContact CE1-CB 4.25Å; V334-E336 VanDerWaalsContact C-N 3.27Å; V334-E336 HydrophobicContact CG1-CB 3.81Å; V334-E336 HydrophobicContact CG1-CG 3.71Å; V334-E336 PolarHBondContact O-N 2.9Å; E336-R342 IonicContact OE1-NH2 2.83Å; E336-R342 IonicContact OE2-NE 3.97Å
337	E	90.3	Very high	95.4	Very high	182 Å²	182	55.9 Å²	55.9	85%	0.85	29%	0.291	S	S	*	.			trans	-63.3	147.1	166.5	-73.2	-174.3	167.7	0	0	110.6	F305 S339	F305-E337 VanDerWaalsContact CD1-O 3.29Å; F305-E337 WeakPolarHBondContact CD1-O 3.37Å; E337-S339 PolarHBondContact O-N 3.32Å
338	F	91.6	Very high	95.6	Very high	104 Å²	104	51.5 Å²	51.5	46%	0.456	26%	0.26	S	S	.	.			trans	-61.2	121.8	-177.5	179	-101.9	0	0	0	111.8	P272 A274 F305 R340	P272-F338 HydrophobicContact CB-CE2 4.01Å; P272-F338 HydrophobicContact CB-CZ 4.42Å; A274-F338 HydrophobicContact CB-CB 3.66Å; A274-F338 HydrophobicContact CB-CD2 3.59Å; A274-F338 HydrophobicContact CB-CE2 4.46Å; A274-F338 HydrophobicContact CB-CG 3.79Å; F305-F338 HydrophobicContact CB-CB 4.26Å; F305-F338 HydrophobicContact CB-CD2 4.24Å; F305-F338 AromaticContact CD2-CD2 3.72Å; F305-F338 HydrophobicContact CD2-CD2 3.72Å; F305-F338 HydrophobicContact CD2-CE2 4.29Å; F305-F338 HydrophobicContact CE2-CD2 4.3Å; F305-F338 HydrophobicContact CG-CB 4.44Å; F305-F338 HydrophobicContact CG-CD2 4.05Å; F338-R340 HydrophobicContact CE1-CB 4.21Å; F338-R340 HydrophobicContact CZ-CB 4.12Å
339	S	91.3	Very high	95.7	Very high	47 Å²	47	50.7 Å²	50.7	33%	0.329	26%	0.256	S	S	.	.			trans	-132.7	120.4	166.4	166.9	0	0	0	0	109.2	E337 R342 G343	E337-S339 PolarHBondContact O-N 3.32Å; S339-R342 PolarHBondContact O-N 3.36Å; S339-R342 WeakPolarHBondContact OG-CB 3.44Å; S339-R342 PolarHBondContact OG-N 2.88Å; S339-G343 PolarHBondContact O-N 2.89Å
340	R	92.7	Very high	95.7	Very high	34 Å²	34	49.9 Å²	49.9	13%	0.128	26%	0.261	C	S	.	.	H	α-helix	trans	-60.4	-52.5	-176.6	-176.4	178.4	177.4	-77.1	-12.7	111.8	P272 F338 R342 G343 L344 D362 G428 E453	P272-R340 HydrophobicContact CG-CG 4.08Å; F338-R340 HydrophobicContact CE1-CB 4.21Å; F338-R340 HydrophobicContact CZ-CB 4.12Å; R340-R342 VanDerWaalsContact C-N 3.32Å; R340-R342 PolarHBondContact O-N 2.84Å; R340-G343 PolarHBondContact O-N 3.08Å; R340-L344 HydrophobicContact CG-CD1 4.17Å; R340-L344 WeakPolarHBondContact O-CG 3.43Å; R340-L344 PolarHBondContact O-N 3.07Å; R340-D362 IonicContact CZ-OD1 3.35Å; R340-D362 VanDerWaalsContact CZ-OD1 3.26Å; R340-D362 IonicContact NE-OD1 3.1Å; R340-D362 PolarHBondContact NE-OD1 3.43Å; R340-D362 IonicContact NE-OD2 3.77Å; R340-D362 IonicContact NH2-OD1 3.35Å; R340-D362 PolarHBondContact NH2-OD1 3.39Å; R340-D362 IonicContact NH2-OD2 3.38Å; R340-G428 VanDerWaalsContact NH2-CA 3.29Å; R340-G428 PolarHBondContact NH2-O 3.36Å; R340-E453 WeakPolarHBondContact CD-OE1 3.34Å; R340-E453 IonicContact CZ-OE1 3.89Å; R340-E453 IonicContact NH1-OE1 2.81Å; R340-E453 PolarHBondContact NH1-OE1 2.92Å
341	G	93.5	Very high	95.6	Very high	5 Å²	5	48.5 Å²	48.5	5%	0.052	25%	0.25	C	C	.	.	H	α-helix	trans	-59.8	-41	178.1	0	0	0	0	0	112.5	L344 D345 F443	G341-L344 PolarHBondContact O-N 2.91Å; G341-D345 WeakPolarHBondContact O-CB 3.27Å; G341-D345 PolarHBondContact O-N 3.26Å; G341-F443 WeakPolarHBondContact O-CD2 3.13Å
342	R	94.4	Very high	95.3	Very high	80 Å²	80	54 Å²	54	30%	0.302	27%	0.272	S	S	.	.	H	α-helix	trans	-62.4	-44.3	175	-179.6	59.3	173	158.6	1.3	112	F305 E336 S339 R340 D345 I346	F305-R342 HydrophobicContact CE1-CG 4.33Å; F305-R342 HydrophobicContact CZ-CB 4.39Å; F305-R342 HydrophobicContact CZ-CG 4.23Å; E336-R342 IonicContact OE1-NH2 2.83Å; E336-R342 IonicContact OE2-NE 3.97Å; S339-R342 PolarHBondContact O-N 3.36Å; S339-R342 WeakPolarHBondContact OG-CB 3.44Å; S339-R342 PolarHBondContact OG-N 2.88Å; R340-R342 VanDerWaalsContact C-N 3.32Å; R340-R342 PolarHBondContact O-N 2.84Å; R342-D345 PolarHBondContact O-N 3.33Å; R342-I346 HydrophobicContact CG-CD1 4.01Å; R342-I346 VanDerWaalsContact O-CG1 3.29Å; R342-I346 WeakPolarHBondContact O-CG1 3.45Å; R342-I346 PolarHBondContact O-N 3.07Å
343	G	95.8	Very high	95	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-63.8	-44.5	179.1	0	0	0	0	0	112.6	V303 S339 R340 I346 G347	V303-G343 WeakPolarHBondContact CG2-O 3.44Å; S339-G343 PolarHBondContact O-N 2.89Å; R340-G343 PolarHBondContact O-N 3.08Å; G343-I346 PolarHBondContact O-N 2.94Å; G343-G347 PolarHBondContact O-N 3.35Å
344	L	97.1	Very high	94.9	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-63.5	-41.2	175.7	-67	171.5	0	0	0	111.7	I270 P272 R340 G341 G347 A348 F360 F443	I270-L344 HydrophobicContact CB-CD2 4.38Å; I270-L344 HydrophobicContact CG2-CD2 3.99Å; P272-L344 HydrophobicContact CG-CD2 4.01Å; P272-L344 HydrophobicContact CG-CG 4.03Å; R340-L344 HydrophobicContact CG-CD1 4.17Å; R340-L344 WeakPolarHBondContact O-CG 3.43Å; R340-L344 PolarHBondContact O-N 3.07Å; G341-L344 PolarHBondContact O-N 2.91Å; L344-G347 PolarHBondContact O-N 3.39Å; L344-A348 WeakPolarHBondContact O-CB 3.39Å; L344-A348 PolarHBondContact O-N 3.01Å; L344-F360 HydrophobicContact CB-CD2 4.3Å; L344-F360 HydrophobicContact CB-CE2 4.2Å; L344-F360 HydrophobicContact CB-CG 4.48Å; L344-F360 HydrophobicContact CB-CZ 4.31Å; L344-F360 HydrophobicContact CD1-CB 4.2Å; L344-F360 HydrophobicContact CD1-CD2 3.92Å; L344-F360 HydrophobicContact CD1-CG 4.15Å; L344-F360 HydrophobicContact CD2-CB 3.83Å; L344-F360 HydrophobicContact CD2-CD1 3.97Å; L344-F360 HydrophobicContact CD2-CD2 4.33Å; L344-F360 HydrophobicContact CD2-CG 3.8Å; L344-F360 HydrophobicContact CG-CD2 4.42Å; L344-F360 HydrophobicContact CG-CG 4.37Å; L344-F443 HydrophobicContact CB-CD2 4.36Å; L344-F443 HydrophobicContact CB-CE2 3.45Å; L344-F443 VanDerWaalsContact CB-CE2 3.45Å; L344-F443 HydrophobicContact CB-CZ 3.95Å; L344-F443 HydrophobicContact CD1-CE2 4.14Å; L344-F443 HydrophobicContact CD1-CZ 3.71Å; L344-F443 HydrophobicContact CG-CE2 4.45Å; L344-F443 HydrophobicContact CG-CZ 4.49Å
345	D	96.9	Very high	94.9	Very high	22 Å²	22	59.8 Å²	59.8	12%	0.118	31%	0.31	C	S	.	.	H	α-helix	trans	-62.4	-45.8	175.6	-173.9	73.3	0	0	0	112.5	G341 R342 G347 A348 N349 F443 L445	G341-D345 WeakPolarHBondContact O-CB 3.27Å; G341-D345 PolarHBondContact O-N 3.26Å; R342-D345 PolarHBondContact O-N 3.33Å; D345-G347 VanDerWaalsContact C-N 3.33Å; D345-G347 PolarHBondContact O-N 3.45Å; D345-A348 PolarHBondContact O-N 3.12Å; D345-N349 WeakPolarHBondContact O-CB 2.98Å; D345-N349 PolarHBondContact O-N 2.73Å; D345-N349 PolarHBondContact O-ND2 3.43Å; D345-N349 PolarHBondContact OD1-ND2 3.32Å; D345-N349 PolarHBondContact OD2-ND2 2.95Å; D345-F443 HydrophobicContact CB-CD2 4.07Å; D345-L445 HydrophobicContact CB-CD2 4.1Å
346	I	97.8	Very high	95	Very high	31 Å²	31	53.7 Å²	53.7	16%	0.159	28%	0.277	C	S	.	.	H	α-helix	trans	-58.8	-46.9	175	-70.7	167.9	0	0	0	110.1	V303 I332 V334 R342 G343 A348 N349 A350	V303-I346 HydrophobicContact CG1-CB 4.21Å; V303-I346 HydrophobicContact CG1-CD1 4.49Å; V303-I346 HydrophobicContact CG1-CG2 3.97Å; V303-I346 HydrophobicContact CG2-CG2 4.32Å; I332-I346 HydrophobicContact CD1-CG2 4.33Å; I332-I346 HydrophobicContact CG2-CG2 3.98Å; V334-I346 HydrophobicContact CG1-CD1 4.26Å; V334-I346 HydrophobicContact CG2-CD1 3.93Å; R342-I346 HydrophobicContact CG-CD1 4.01Å; R342-I346 VanDerWaalsContact O-CG1 3.29Å; R342-I346 WeakPolarHBondContact O-CG1 3.45Å; R342-I346 PolarHBondContact O-N 3.07Å; G343-I346 PolarHBondContact O-N 2.94Å; I346-A348 PolarHBondContact O-N 3.43Å; I346-N349 PolarHBondContact O-N 3.23Å; I346-A350 WeakPolarHBondContact O-CB 3.31Å; I346-A350 PolarHBondContact O-N 3.24Å
347	G	98.1	Very high	95.3	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.9	-41.5	179.8	0	0	0	0	0	113.1	G343 L344 D345 A350	G343-G347 PolarHBondContact O-N 3.35Å; L344-G347 PolarHBondContact O-N 3.39Å; D345-G347 VanDerWaalsContact C-N 3.33Å; D345-G347 PolarHBondContact O-N 3.45Å; G347-A350 PolarHBondContact O-N 2.85Å
348	A	97.9	Very high	95.7	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.1	-40.5	175.8	0	0	0	0	0	112	I270 L344 D345 I346 M358 F360 R434 F437	I270-A348 HydrophobicContact CD1-CB 4.3Å; L344-A348 WeakPolarHBondContact O-CB 3.39Å; L344-A348 PolarHBondContact O-N 3.01Å; D345-A348 PolarHBondContact O-N 3.12Å; I346-A348 PolarHBondContact O-N 3.43Å; A348-M358 HydrophobicContact CB-CE 4.02Å; A348-M358 HydrophobicContact CB-SD 3.6Å; A348-F360 HydrophobicContact CB-CE1 4.34Å; A348-F360 HydrophobicContact CB-CZ 4.31Å; A348-R434 PolarHBondContact O-NE 3.04Å; A348-F437 HydrophobicContact CB-CD1 3.97Å; A348-F437 HydrophobicContact CB-CE1 3.73Å; A348-F437 HydrophobicContact CB-CZ 4.48Å
349	N	97.1	Very high	96	Very high	55 Å²	55	35.8 Å²	35.8	29%	0.294	20%	0.195	S	C	.	.	H	α-helix	trans	-77.8	-21.3	-180	-78.6	-65.3	0	0	0	114	D345 I346 W351 K352	D345-N349 WeakPolarHBondContact O-CB 2.98Å; D345-N349 PolarHBondContact O-N 2.73Å; D345-N349 PolarHBondContact O-ND2 3.43Å; D345-N349 PolarHBondContact OD1-ND2 3.32Å; D345-N349 PolarHBondContact OD2-ND2 2.95Å; I346-N349 PolarHBondContact O-N 3.23Å; N349-W351 VanDerWaalsContact C-N 3.31Å; N349-K352 PolarHBondContact O-NZ 2.89Å
350	A	97.2	Very high	96.4	Very high	39 Å²	39	33.6 Å²	33.6	32%	0.322	18%	0.18	S	C	.	.	H	α-helix	trans	-69.3	-28.3	176.9	0	0	0	0	0	112.9	I332 I346 G347 K352	I332-A350 HydrophobicContact CD1-CB 3.3Å; I346-A350 WeakPolarHBondContact O-CB 3.31Å; I346-A350 PolarHBondContact O-N 3.24Å; G347-A350 PolarHBondContact O-N 2.85Å; A350-K352 PolarHBondContact O-N 2.85Å
351	W	96.4	Very high	96.6	Very high	24 Å²	24	32 Å²	32	9%	0.091	17%	0.174	C	C	.	.			trans	-65.8	125.5	175.6	-172.4	-91.2	0	0	0	111.7	I266 N268 H299 N349 N353 G354 V356 R434	I266-W351 HydrophobicContact CG2-CH2 4.24Å; N268-W351 HydrophobicContact CB-CE3 4.22Å; N268-W351 HydrophobicContact CB-CZ3 4.27Å; H299-W351 HydrophobicContact CB-CH2 4.35Å; H299-W351 HydrophobicContact CB-CZ3 3.83Å; H299-W351 AromaticContact CD2-CZ3 3.91Å; H299-W351 AromaticContact CG-CZ3 3.68Å; N349-W351 VanDerWaalsContact C-N 3.31Å; W351-N353 HydrophobicContact CZ2-CB 3.82Å; W351-N353 PolarHBondContact NE1-O 3.2Å; W351-N353 VanDerWaalsContact NE1-O 3.11Å; W351-G354 VanDerWaalsContact CD1-O 3.27Å; W351-G354 PolarHBondContact NE1-O 3.49Å; W351-V356 HydrophobicContact CB-CG1 4.44Å; W351-V356 HydrophobicContact CD2-CB 4.19Å; W351-V356 HydrophobicContact CD2-CG1 3.7Å; W351-V356 HydrophobicContact CD2-CG2 4.44Å; W351-V356 HydrophobicContact CE3-CG1 4.45Å; W351-V356 HydrophobicContact CG-CB 4.47Å; W351-V356 HydrophobicContact CG-CG1 3.66Å; W351-V356 HydrophobicContact CH2-CG2 4.04Å; W351-V356 HydrophobicContact CZ2-CB 3.83Å; W351-V356 HydrophobicContact CZ2-CG1 4.28Å; W351-V356 HydrophobicContact CZ2-CG2 3.66Å; W351-R434 PolarHBondContact O-NE 3.4Å
352	K	92.7	Very high	96.8	Very high	158 Å²	158	33.2 Å²	33.2	69%	0.687	18%	0.179	S	C	*	.			trans	-116	-8.9	-179.6	-56.3	-53.9	179.1	-164.5	0	114.4	N349 A350 G354	N349-K352 PolarHBondContact O-NZ 2.89Å; A350-K352 PolarHBondContact O-N 2.85Å; K352-G354 VanDerWaalsContact C-N 3.26Å; K352-G354 PolarHBondContact O-N 3.45Å
353	N	92.1	Very high	97	Very high	129 Å²	129	29.8 Å²	29.8	69%	0.69	17%	0.167	S	C	*	.	S	Bend	trans	-88.3	59	-172.3	-61.1	-17.9	0	0	0	111.3	W351	W351-N353 HydrophobicContact CZ2-CB 3.82Å; W351-N353 PolarHBondContact NE1-O 3.2Å; W351-N353 VanDerWaalsContact NE1-O 3.11Å
354	G	93.9	Very high	97	Very high	49 Å²	49	30.2 Å²	30.2	51%	0.505	17%	0.169	S	C	.	.	S	Bend	trans	69.1	-148.8	-179.6	0	0	0	0	0	113.7	W351 K352	W351-G354 VanDerWaalsContact CD1-O 3.27Å; W351-G354 PolarHBondContact NE1-O 3.49Å; K352-G354 VanDerWaalsContact C-N 3.26Å; K352-G354 PolarHBondContact O-N 3.45Å
355	D	97.1	Very high	97.1	Very high	71 Å²	71	30.3 Å²	30.3	38%	0.38	17%	0.17	S	C	.	.			trans	-86.3	145	176.3	-161.1	13.7	0	0	0	111	R434 S435	D355-R434 WeakPolarHBondContact OD1-CB 3.48Å; D355-R434 PolarHBondContact OD1-N 3.41Å; D355-R434 VanDerWaalsContact OD1-N 3.15Å; D355-S435 VanDerWaalsContact CG-OG 3.27Å; D355-S435 PolarHBondContact OD1-N 2.98Å; D355-S435 PolarHBondContact OD1-OG 2.89Å; D355-S435 VanDerWaalsContact OD2-CB 3.24Å; D355-S435 WeakPolarHBondContact OD2-CB 3.39Å; D355-S435 PolarHBondContact OD2-OG 3.08Å
356	V	98.1	Very high	97.1	Very high	6 Å²	6	31.2 Å²	31.2	4%	0.036	17%	0.172	C	C	.	.			trans	-148.1	146.8	-175.9	67.7	0	0	0	0	109.8	I266 N268 W351 M358 Y433 R434	I266-V356 HydrophobicContact CB-CG2 4.42Å; I266-V356 HydrophobicContact CG2-CG2 4.33Å; I266-V356 WeakPolarHBondContact O-CG2 3.43Å; N268-V356 HydrophobicContact CB-CG1 4.29Å; N268-V356 HydrophobicContact CB-CG2 4.08Å; W351-V356 HydrophobicContact CB-CG1 4.44Å; W351-V356 HydrophobicContact CD2-CB 4.19Å; W351-V356 HydrophobicContact CD2-CG1 3.7Å; W351-V356 HydrophobicContact CD2-CG2 4.44Å; W351-V356 HydrophobicContact CE3-CG1 4.45Å; W351-V356 HydrophobicContact CG-CB 4.47Å; W351-V356 HydrophobicContact CG-CG1 3.66Å; W351-V356 HydrophobicContact CH2-CG2 4.04Å; W351-V356 HydrophobicContact CZ2-CB 3.83Å; W351-V356 HydrophobicContact CZ2-CG1 4.28Å; W351-V356 HydrophobicContact CZ2-CG2 3.66Å; V356-M358 HydrophobicContact CG1-CG 3.97Å; V356-M358 PolarHBondContact O-N 3.44Å; V356-Y433 WeakPolarHBondContact O-CA 3.35Å; V356-R434 HydrophobicContact CG1-CB 4.12Å; V356-R434 PolarHBondContact O-N 3.45Å
357	L	98.7	Very high	97.1	Very high	1 Å²	1	30 Å²	30	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	120.7	168.7	178.6	56.3	0	0	0	108.6	I267 N268 R376 A379 C431 Y433	I267-L357 CarbonylContact C-O 3.55Å; I267-L357 WeakPolarHBondContact CA-O 3.14Å; I267-L357 HydrophobicContact CG1-CD2 4.07Å; I267-L357 HydrophobicContact CG1-CG 4.44Å; N268-L357 PolarHBondContact N-O 2.97Å; L357-R376 HydrophobicContact CD2-CB 4.37Å; L357-R376 HydrophobicContact CD2-CG 3.89Å; L357-A379 HydrophobicContact CD1-CB 3.54Å; L357-C431 HydrophobicContact CD1-CB 4.33Å; L357-Y433 HydrophobicContact CB-CE1 4.28Å; L357-Y433 HydrophobicContact CB-CE2 4.31Å; L357-Y433 HydrophobicContact CD1-CD2 4.13Å; L357-Y433 HydrophobicContact CD1-CE2 4.07Å
358	M	98.7	Very high	97.1	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	136	178.6	-57.6	-176.4	-55.2	0	0	109.8	N268 I270 A348 V356 F360 C431 Q432 R434 F437	N268-M358 WeakPolarHBondContact O-CA 3.26Å; I270-M358 HydrophobicContact CD1-CB 4.13Å; I270-M358 HydrophobicContact CD1-CG 4.12Å; I270-M358 HydrophobicContact CD1-SD 3.82Å; A348-M358 HydrophobicContact CB-CE 4.02Å; A348-M358 HydrophobicContact CB-SD 3.6Å; V356-M358 HydrophobicContact CG1-CG 3.97Å; V356-M358 PolarHBondContact O-N 3.44Å; M358-F360 HydrophobicContact CB-CD1 4.44Å; M358-F360 HydrophobicContact CB-CE1 4.22Å; M358-F360 HydrophobicContact CE-CE1 3.93Å; M358-F360 HydrophobicContact CE-CZ 4.09Å; M358-F360 HydrophobicContact SD-CE1 4.27Å; M358-C431 VanDerWaalsContact O-CA 3.31Å; M358-C431 WeakPolarHBondContact O-CA 3.39Å; M358-Q432 WeakPolarHBondContact CB-O 3.42Å; M358-Q432 HydrophobicContact CE-CG 4.11Å; M358-Q432 PolarHBondContact N-O 3.41Å; M358-Q432 PolarHBondContact O-N 2.9Å; M358-R434 HydrophobicContact CE-CB 4.09Å; M358-R434 HydrophobicContact CE-CG 4.44Å; M358-R434 HydrophobicContact CG-CB 4.3Å; M358-R434 HydrophobicContact SD-CB 3.83Å; M358-R434 HydrophobicContact SD-CG 4.03Å; M358-F437 HydrophobicContact CE-CB 3.69Å; M358-F437 HydrophobicContact CE-CD1 4.12Å; M358-F437 HydrophobicContact CE-CG 3.92Å
359	F	98.8	Very high	96.9	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	110.6	166	175.2	-137.1	0	0	0	109.2	I267 N268 I269 I270 C361 I365 F367 F371 M429 T430 L476	I267-F359 HydrophobicContact CG2-CB 3.8Å; N268-F359 PolarHBondContact O-N 3.4Å; I269-F359 WeakPolarHBondContact CA-O 3.32Å; I269-F359 HydrophobicContact CD1-CD1 4.39Å; I269-F359 HydrophobicContact CG1-CB 4.37Å; I269-F359 HydrophobicContact CG1-CD1 4.13Å; I269-F359 HydrophobicContact CG2-CD1 3.97Å; I270-F359 PolarHBondContact N-O 3.46Å; F359-C361 HydrophobicContact CD1-CB 3.77Å; F359-C361 HydrophobicContact CE1-CB 3.5Å; F359-C361 VanDerWaalsContact CE1-CB 3.5Å; F359-C361 WeakPolarHBondContact CE1-SG 3.29Å; F359-C361 HydrophobicContact CE2-CB 4.45Å; F359-C361 HydrophobicContact CG-CB 4.36Å; F359-C361 HydrophobicContact CZ-CB 3.86Å; F359-C361 PolarHBondContact O-N 2.91Å; F359-I365 HydrophobicContact CZ-CG2 4.45Å; F359-F367 HydrophobicContact CE1-CD1 4.45Å; F359-F371 AromaticContact CD1-CE1 3.79Å; F359-F371 HydrophobicContact CD1-CE1 3.79Å; F359-F371 HydrophobicContact CD1-CZ 4.35Å; F359-F371 HydrophobicContact CD2-CE1 4.14Å; F359-F371 AromaticContact CD2-CZ 3.87Å; F359-F371 HydrophobicContact CD2-CZ 3.87Å; F359-F371 HydrophobicContact CE1-CD1 4.46Å; F359-F371 AromaticContact CE1-CE1 3.44Å; F359-F371 HydrophobicContact CE1-CE1 3.44Å; F359-F371 VanDerWaalsContact CE1-CE1 3.44Å; F359-F371 HydrophobicContact CE1-CZ 4Å; F359-F371 AromaticContact CE2-CE1 3.85Å; F359-F371 HydrophobicContact CE2-CE1 3.85Å; F359-F371 AromaticContact CE2-CZ 3.5Å; F359-F371 HydrophobicContact CE2-CZ 3.5Å; F359-F371 VanDerWaalsContact CE2-CZ 3.5Å; F359-F371 HydrophobicContact CG-CE1 4.15Å; F359-F371 HydrophobicContact CG-CZ 4.31Å; F359-F371 AromaticContact CZ-CE1 3.48Å; F359-F371 HydrophobicContact CZ-CE1 3.48Å; F359-F371 VanDerWaalsContact CZ-CE1 3.48Å; F359-F371 AromaticContact CZ-CZ 3.57Å; F359-F371 HydrophobicContact CZ-CZ 3.57Å; F359-M429 HydrophobicContact CE2-CB 4.12Å; F359-M429 HydrophobicContact CE2-CG 4.32Å; F359-M429 HydrophobicContact CZ-CG 4.41Å; F359-T430 WeakPolarHBondContact CA-O 3.37Å; F359-T430 WeakPolarHBondContact CD2-O 3.34Å; F359-L476 HydrophobicContact CZ-CD1 4.38Å
360	F	98.7	Very high	96.8	Very high	1 Å²	1	34.9 Å²	34.9	0%	0.004	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	117.9	172	-70.8	-2.2	0	0	0	108.8	I270 L344 A348 M358 M429 T430 F437 F443 L457	I270-F360 HydrophobicContact CB-CD1 4.34Å; I270-F360 HydrophobicContact CD1-CD1 4.05Å; I270-F360 HydrophobicContact CD1-CE1 3.71Å; L344-F360 HydrophobicContact CB-CD2 4.3Å; L344-F360 HydrophobicContact CB-CE2 4.2Å; L344-F360 HydrophobicContact CB-CG 4.48Å; L344-F360 HydrophobicContact CB-CZ 4.31Å; L344-F360 HydrophobicContact CD1-CB 4.2Å; L344-F360 HydrophobicContact CD1-CD2 3.92Å; L344-F360 HydrophobicContact CD1-CG 4.15Å; L344-F360 HydrophobicContact CD2-CB 3.83Å; L344-F360 HydrophobicContact CD2-CD1 3.97Å; L344-F360 HydrophobicContact CD2-CD2 4.33Å; L344-F360 HydrophobicContact CD2-CG 3.8Å; L344-F360 HydrophobicContact CG-CD2 4.42Å; L344-F360 HydrophobicContact CG-CG 4.37Å; A348-F360 HydrophobicContact CB-CE1 4.34Å; A348-F360 HydrophobicContact CB-CZ 4.31Å; M358-F360 HydrophobicContact CB-CD1 4.44Å; M358-F360 HydrophobicContact CB-CE1 4.22Å; M358-F360 HydrophobicContact CE-CE1 3.93Å; M358-F360 HydrophobicContact CE-CZ 4.09Å; M358-F360 HydrophobicContact SD-CE1 4.27Å; F360-M429 WeakPolarHBondContact O-CA 3.49Å; F360-T430 HydrophobicContact CB-CG2 3.89Å; F360-T430 HydrophobicContact CD2-CG2 3.62Å; F360-T430 HydrophobicContact CE2-CG2 4.45Å; F360-T430 HydrophobicContact CG-CG2 3.95Å; F360-T430 PolarHBondContact N-O 2.95Å; F360-F437 HydrophobicContact CE2-CD2 4.13Å; F360-F437 AromaticContact CE2-CE2 3.84Å; F360-F437 HydrophobicContact CE2-CE2 3.84Å; F360-F437 HydrophobicContact CE2-CZ 4.49Å; F360-F437 AromaticContact CZ-CD2 4Å; F360-F437 HydrophobicContact CZ-CD2 4Å; F360-F437 AromaticContact CZ-CE2 3.82Å; F360-F437 HydrophobicContact CZ-CE2 3.82Å; F360-F437 HydrophobicContact CZ-CG 4.46Å; F360-F437 HydrophobicContact CZ-CZ 4.15Å; F360-F443 HydrophobicContact CD2-CE2 4.1Å; F360-F443 AromaticContact CD2-CZ 3.84Å; F360-F443 HydrophobicContact CD2-CZ 3.84Å; F360-F443 AromaticContact CE2-CE2 3.36Å; F360-F443 HydrophobicContact CE2-CE2 3.36Å; F360-F443 AromaticContact CE2-CZ 3.5Å; F360-F443 HydrophobicContact CE2-CZ 3.5Å; F360-F443 VanDerWaalsContact CE2-CZ 3.5Å; F360-F443 AromaticContact CZ-CE2 4Å; F360-F443 HydrophobicContact CZ-CE2 4Å; F360-L457 HydrophobicContact CD2-CD2 4.48Å; F360-L457 HydrophobicContact CE2-CD2 4.08Å
361	C	98.2	Very high	96.9	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.178	C	C	.	.			trans	-135.4	132.5	-164.9	-171.8	0	0	0	0	111.1	I269 I270 V271 P272 F359	I269-C361 HydrophobicContact CG2-CB 3.71Å; I270-C361 PolarHBondContact O-N 3.05Å; V271-C361 HydrophobicContact CG2-CB 4.28Å; P272-C361 WeakPolarHBondContact CD-O 3.04Å; F359-C361 HydrophobicContact CD1-CB 3.77Å; F359-C361 HydrophobicContact CE1-CB 3.5Å; F359-C361 VanDerWaalsContact CE1-CB 3.5Å; F359-C361 WeakPolarHBondContact CE1-SG 3.29Å; F359-C361 HydrophobicContact CE2-CB 4.45Å; F359-C361 HydrophobicContact CG-CB 4.36Å; F359-C361 HydrophobicContact CZ-CB 3.86Å; F359-C361 PolarHBondContact O-N 2.91Å
362	D	97.1	Very high	96.9	Very high	31 Å²	31	31.9 Å²	31.9	17%	0.166	17%	0.174	C	C	.	.			trans	-83	151.1	169.8	-62.7	-13.1	0	0	0	109.7	R340 D364 I365	R340-D362 IonicContact CZ-OD1 3.35Å; R340-D362 VanDerWaalsContact CZ-OD1 3.26Å; R340-D362 IonicContact NE-OD1 3.1Å; R340-D362 PolarHBondContact NE-OD1 3.43Å; R340-D362 IonicContact NE-OD2 3.77Å; R340-D362 IonicContact NH2-OD1 3.35Å; R340-D362 PolarHBondContact NH2-OD1 3.39Å; R340-D362 IonicContact NH2-OD2 3.38Å; D362-D364 PolarHBondContact O-N 3.3Å; D362-D364 VanDerWaalsContact O-N 3.14Å; D362-I365 HydrophobicContact CB-CG1 4.04Å; D362-I365 WeakPolarHBondContact O-CB 3.48Å; D362-I365 WeakPolarHBondContact O-CG1 3.39Å; D362-I365 PolarHBondContact O-N 3.41Å; D362-I365 VanDerWaalsContact O-N 3.12Å
363	V	97.6	Very high	97.1	Very high	9 Å²	9	25.8 Å²	25.8	6%	0.055	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-21.5	-175.9	68.9	0	0	0	0	113.2	V271 L273 T279 F280 F283	V271-V363 HydrophobicContact CG1-CB 4.02Å; V271-V363 HydrophobicContact CG1-CG2 4.47Å; L273-V363 HydrophobicContact CD1-CB 4.2Å; L273-V363 HydrophobicContact CD1-CG1 4.07Å; L273-V363 HydrophobicContact CD1-CG2 4.11Å; T279-V363 HydrophobicContact CG2-CG1 3.91Å; T279-V363 HydrophobicContact CG2-CG2 4.26Å; F280-V363 HydrophobicContact CB-CG2 3.97Å; F280-V363 HydrophobicContact CD2-CG2 4.06Å; F283-V363 HydrophobicContact CB-CG2 3.9Å; F283-V363 WeakPolarHBondContact CB-O 3.45Å; F283-V363 HydrophobicContact CG-CG2 4.28Å
364	D	96.9	Very high	97.3	Very high	8 Å²	8	19.9 Å²	19.9	4%	0.043	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	13.9	-180	32.2	-70.7	0	0	0	113.5	R276 T279 D362 H478 L479 H481	R276-D364 IonicContact CZ-OD1 3.88Å; R276-D364 IonicContact NH1-OD1 3.5Å; R276-D364 PolarHBondContact NH1-OD1 3.04Å; R276-D364 IonicContact NH2-OD1 3.96Å; R276-D364 PolarHBondContact NH2-OD1 3.25Å; T279-D364 HydrophobicContact CG2-CB 4.09Å; D362-D364 PolarHBondContact O-N 3.3Å; D362-D364 VanDerWaalsContact O-N 3.14Å; D364-H478 IonicContact OD2-CE1 3.26Å; D364-H478 PolarHBondContact OD2-CE1 3.35Å; D364-H478 IonicContact OD2-NE2 3.02Å; D364-H478 PolarHBondContact OD2-NE2 3.45Å; D364-L479 HydrophobicContact CB-CB 4.46Å; D364-L479 WeakPolarHBondContact O-CB 3.49Å; D364-L479 WeakPolarHBondContact O-CG 3.32Å; D364-L479 PolarHBondContact O-N 2.97Å; D364-H481 IonicContact OD2-CD2 3.96Å; D364-H481 PolarHBondContact OD2-CD2 2.88Å; D364-H481 IonicContact OD2-CG 2.72Å; D364-H481 IonicContact OD2-NE2 3.89Å; D364-H481 PolarHBondContact OD2-NE2 2.98Å
365	I	98.1	Very high	97.5	Very high	3 Å²	3	17.6 Å²	17.6	2%	0.015	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	131.9	168.7	-61	-60.9	0	0	0	110.5	F359 D362 F367 V390 M429 L476 F477 H478	F359-I365 HydrophobicContact CZ-CG2 4.45Å; D362-I365 HydrophobicContact CB-CG1 4.04Å; D362-I365 WeakPolarHBondContact O-CB 3.48Å; D362-I365 WeakPolarHBondContact O-CG1 3.39Å; D362-I365 PolarHBondContact O-N 3.41Å; D362-I365 VanDerWaalsContact O-N 3.12Å; I365-F367 HydrophobicContact CG2-CD1 4.27Å; I365-V390 HydrophobicContact CD1-CG1 4.32Å; I365-M429 HydrophobicContact CD1-CE 4.08Å; I365-M429 HydrophobicContact CD1-CG 3.99Å; I365-M429 HydrophobicContact CD1-SD 3.9Å; I365-M429 HydrophobicContact CG1-CG 4.09Å; I365-M429 HydrophobicContact CG1-SD 4.23Å; I365-L476 HydrophobicContact CG2-CD1 3.38Å; I365-L476 HydrophobicContact CG2-CG 4.31Å; I365-F477 CarbonylContact C-O 3.56Å; I365-F477 WeakPolarHBondContact CA-O 3.41Å; I365-H478 HydrophobicContact CD1-CB 3.89Å
366	R	98	Very high	97.5	Very high	40 Å²	40	14.3 Å²	14.3	15%	0.151	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127.7	168	-174.7	82.9	-171.2	-178.2	4.3	108.8	N286 E289 L413 F477 L479	N286-R366 VanDerWaalsContact CA-NH1 3.34Å; N286-R366 VanDerWaalsContact CG-CD 3.42Å; N286-R366 VanDerWaalsContact ND2-CZ 3.28Å; N286-R366 PolarHBondContact ND2-NE 3.04Å; N286-R366 WeakPolarHBondContact OD1-CA 3.3Å; N286-R366 WeakPolarHBondContact OD1-CD 3.49Å; E289-R366 IonicContact OE2-CZ 2.77Å; E289-R366 IonicContact OE2-NH1 3.77Å; E289-R366 IonicContact OE2-NH2 3.87Å; E289-R366 PolarHBondContact OE2-NH2 3.46Å; R366-L413 HydrophobicContact CG-CD1 4.06Å; R366-F477 HydrophobicContact CB-CB 4.38Å; R366-F477 PolarHBondContact N-O 2.9Å; R366-F477 PolarHBondContact O-N 3.31Å; R366-L479 HydrophobicContact CB-CD2 4.33Å; R366-L479 HydrophobicContact CB-CG 4.44Å
367	F	98.1	Very high	97.4	Very high	6 Å²	6	14.8 Å²	14.8	3%	0.026	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	161.4	-179.1	59	-94	0	0	0	112.7	I269 F283 N286 V290 C291 F359 I365 F371 L372 S475 L476	I269-F367 HydrophobicContact CD1-CE1 4.38Å; I269-F367 HydrophobicContact CD1-CE2 4.31Å; I269-F367 HydrophobicContact CD1-CZ 3.77Å; F283-F367 AromaticContact CE2-CE1 3.96Å; F283-F367 HydrophobicContact CE2-CE1 3.96Å; F283-F367 HydrophobicContact CZ-CE1 4.39Å; N286-F367 PolarHBondContact ND2-O 3.29Å; N286-F367 PolarHBondContact OD1-N 3.23Å; N286-F367 PolarHBondContact OD1-O 2.94Å; V290-F367 HydrophobicContact CB-CE2 4.16Å; V290-F367 HydrophobicContact CG1-CD2 4Å; V290-F367 HydrophobicContact CG1-CE2 3.87Å; C291-F367 VanDerWaalsContact SG-CE2 3.52Å; F359-F367 HydrophobicContact CE1-CD1 4.45Å; I365-F367 HydrophobicContact CG2-CD1 4.27Å; F367-F371 HydrophobicContact CB-CB 4.18Å; F367-F371 HydrophobicContact CB-CD1 3.62Å; F367-F371 HydrophobicContact CB-CE1 4.45Å; F367-F371 HydrophobicContact CB-CG 4.14Å; F367-F371 HydrophobicContact CD2-CD1 4.38Å; F367-F371 HydrophobicContact CG-CD1 4.1Å; F367-L372 HydrophobicContact CD2-CD2 4.08Å; F367-L372 HydrophobicContact CD2-CG 4.36Å; F367-L372 HydrophobicContact CE2-CD1 4.46Å; F367-L372 HydrophobicContact CE2-CD2 4.04Å; F367-L372 HydrophobicContact CE2-CG 4.43Å; F367-S475 WeakPolarHBondContact CA-O 3.49Å; F367-L476 HydrophobicContact CB-CD1 3.74Å
368	S	96.9	Very high	97.3	Very high	29 Å²	29	14.8 Å²	14.8	20%	0.203	8%	0.078	C	C	.	.			trans	-109.3	176	173.2	85.5	0	0	0	0	112.1	D370 F371 S475	S368-D370 PolarHBondContact O-N 2.95Å; S368-D370 WeakPolarHBondContact OG-CB 3.15Å; S368-D370 PolarHBondContact OG-N 3.26Å; S368-D370 VanDerWaalsContact OG-N 3.09Å; S368-D370 PolarHBondContact OG-OD2 3.34Å; S368-F371 PolarHBondContact O-N 2.83Å; S368-S475 PolarHBondContact N-O 2.96Å; S368-S475 WeakPolarHBondContact OG-CB 3.44Å
369	L	95.4	Very high	97.3	Very high	30 Å²	30	15 Å²	15	16%	0.157	8%	0.08	C	C	.	.	H	α-helix	trans	-59.9	-35.7	171.4	-179.7	63	0	0	0	111.5	V290 R294 D295 F371 L372 N373	V290-L369 HydrophobicContact CG1-CB 4.38Å; R294-L369 HydrophobicContact CB-CD2 4.42Å; D295-L369 HydrophobicContact CB-CD1 3.7Å; L369-F371 VanDerWaalsContact C-N 3.27Å; L369-F371 PolarHBondContact O-N 3.15Å; L369-L372 WeakPolarHBondContact O-CB 3.41Å; L369-L372 PolarHBondContact O-N 3.45Å; L369-L372 VanDerWaalsContact O-N 3.08Å; L369-N373 PolarHBondContact O-N 3.24Å; L369-N373 VanDerWaalsContact O-N 3.15Å
370	D	94.9	Very high	97.1	Very high	98 Å²	98	16.3 Å²	16.3	52%	0.524	9%	0.091	S	C	.	.	H	α-helix	trans	-60.2	-41.9	179.9	-43.8	-45	0	0	0	110.3	S368 L372 N373 T374	S368-D370 PolarHBondContact O-N 2.95Å; S368-D370 WeakPolarHBondContact OG-CB 3.15Å; S368-D370 PolarHBondContact OG-N 3.26Å; S368-D370 VanDerWaalsContact OG-N 3.09Å; S368-D370 PolarHBondContact OG-OD2 3.34Å; D370-L372 VanDerWaalsContact C-N 3.32Å; D370-L372 PolarHBondContact O-N 3.02Å; D370-N373 WeakPolarHBondContact O-CB 3.48Å; D370-N373 PolarHBondContact O-N 2.88Å; D370-N373 VanDerWaalsContact O-N 3.13Å; D370-T374 PolarHBondContact O-N 3.15Å; D370-T374 PolarHBondContact O-OG1 2.86Å
371	F	97.9	Very high	97	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-60.2	-40.5	175.6	170.6	-108.5	0	0	0	112.6	F359 F367 S368 L369 N373 T374 C375 F386 P388 V473 S475 L476	F359-F371 AromaticContact CD1-CE1 3.79Å; F359-F371 HydrophobicContact CD1-CE1 3.79Å; F359-F371 HydrophobicContact CD1-CZ 4.35Å; F359-F371 HydrophobicContact CD2-CE1 4.14Å; F359-F371 AromaticContact CD2-CZ 3.87Å; F359-F371 HydrophobicContact CD2-CZ 3.87Å; F359-F371 HydrophobicContact CE1-CD1 4.46Å; F359-F371 AromaticContact CE1-CE1 3.44Å; F359-F371 HydrophobicContact CE1-CE1 3.44Å; F359-F371 VanDerWaalsContact CE1-CE1 3.44Å; F359-F371 HydrophobicContact CE1-CZ 4Å; F359-F371 AromaticContact CE2-CE1 3.85Å; F359-F371 HydrophobicContact CE2-CE1 3.85Å; F359-F371 AromaticContact CE2-CZ 3.5Å; F359-F371 HydrophobicContact CE2-CZ 3.5Å; F359-F371 VanDerWaalsContact CE2-CZ 3.5Å; F359-F371 HydrophobicContact CG-CE1 4.15Å; F359-F371 HydrophobicContact CG-CZ 4.31Å; F359-F371 AromaticContact CZ-CE1 3.48Å; F359-F371 HydrophobicContact CZ-CE1 3.48Å; F359-F371 VanDerWaalsContact CZ-CE1 3.48Å; F359-F371 AromaticContact CZ-CZ 3.57Å; F359-F371 HydrophobicContact CZ-CZ 3.57Å; F367-F371 HydrophobicContact CB-CB 4.18Å; F367-F371 HydrophobicContact CB-CD1 3.62Å; F367-F371 HydrophobicContact CB-CE1 4.45Å; F367-F371 HydrophobicContact CB-CG 4.14Å; F367-F371 HydrophobicContact CD2-CD1 4.38Å; F367-F371 HydrophobicContact CG-CD1 4.1Å; S368-F371 PolarHBondContact O-N 2.83Å; L369-F371 VanDerWaalsContact C-N 3.27Å; L369-F371 PolarHBondContact O-N 3.15Å; F371-N373 VanDerWaalsContact C-N 3.26Å; F371-N373 PolarHBondContact O-N 3.41Å; F371-T374 PolarHBondContact O-N 3.4Å; F371-C375 HydrophobicContact CZ-CB 4.42Å; F371-C375 VanDerWaalsContact O-CB 3.29Å; F371-C375 WeakPolarHBondContact O-CB 3.28Å; F371-C375 PolarHBondContact O-N 3.44Å; F371-F386 HydrophobicContact CE2-CE1 4.4Å; F371-P388 HydrophobicContact CE2-CB 4.16Å; F371-P388 HydrophobicContact CE2-CG 4.03Å; F371-P388 HydrophobicContact CZ-CG 4.4Å; F371-V473 HydrophobicContact CD2-CG1 3.96Å; F371-S475 WeakPolarHBondContact CB-OG 3.35Å; F371-S475 PolarHBondContact N-OG 3.3Å; F371-L476 HydrophobicContact CD1-CD1 3.97Å; F371-L476 HydrophobicContact CD2-CB 4.22Å; F371-L476 HydrophobicContact CD2-CD1 4.13Å; F371-L476 HydrophobicContact CD2-CD2 3.97Å; F371-L476 HydrophobicContact CD2-CG 4.36Å; F371-L476 HydrophobicContact CE1-CD1 4.02Å; F371-L476 HydrophobicContact CE2-CD1 4.21Å; F371-L476 HydrophobicContact CE2-CD2 3.6Å; F371-L476 HydrophobicContact CE2-CG 4.4Å; F371-L476 HydrophobicContact CG-CD1 4.01Å; F371-L476 HydrophobicContact CZ-CD1 4.14Å; F371-L476 HydrophobicContact CZ-CD2 3.98Å
372	L	97.6	Very high	96.8	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-63.4	-36.1	177.7	-59.8	-177.1	0	0	0	111.2	I267 I269 V290 D295 V298 F367 L369 D370 C375 R376	I267-L372 HydrophobicContact CD1-CB 3.86Å; I267-L372 HydrophobicContact CD1-CD2 3.94Å; I267-L372 HydrophobicContact CD1-CG 4.42Å; I267-L372 WeakPolarHBondContact CD1-O 3.44Å; I269-L372 HydrophobicContact CD1-CD2 4.36Å; V290-L372 HydrophobicContact CG1-CD1 3.9Å; V290-L372 HydrophobicContact CG1-CG 4.48Å; D295-L372 HydrophobicContact CB-CD1 3.89Å; V298-L372 HydrophobicContact CG2-CD1 4.05Å; F367-L372 HydrophobicContact CD2-CD2 4.08Å; F367-L372 HydrophobicContact CD2-CG 4.36Å; F367-L372 HydrophobicContact CE2-CD1 4.46Å; F367-L372 HydrophobicContact CE2-CD2 4.04Å; F367-L372 HydrophobicContact CE2-CG 4.43Å; L369-L372 WeakPolarHBondContact O-CB 3.41Å; L369-L372 PolarHBondContact O-N 3.45Å; L369-L372 VanDerWaalsContact O-N 3.08Å; D370-L372 VanDerWaalsContact C-N 3.32Å; D370-L372 PolarHBondContact O-N 3.02Å; L372-C375 WeakPolarHBondContact O-CB 3.32Å; L372-R376 WeakPolarHBondContact O-CG 3.33Å; L372-R376 PolarHBondContact O-N 2.72Å
373	N	95.8	Very high	96.7	Very high	31 Å²	31	26.3 Å²	26.3	17%	0.166	14%	0.144	C	C	.	.	H	α-helix	trans	-69.1	-49.1	173.4	-69.2	-28	0	0	0	111.6	F240 L369 D370 F371 C375 R376 L377	F240-N373 HydrophobicContact CE1-CB 4.35Å; F240-N373 HydrophobicContact CZ-CB 4.18Å; L369-N373 PolarHBondContact O-N 3.24Å; L369-N373 VanDerWaalsContact O-N 3.15Å; D370-N373 WeakPolarHBondContact O-CB 3.48Å; D370-N373 PolarHBondContact O-N 2.88Å; D370-N373 VanDerWaalsContact O-N 3.13Å; F371-N373 VanDerWaalsContact C-N 3.26Å; F371-N373 PolarHBondContact O-N 3.41Å; N373-C375 PolarHBondContact O-N 2.96Å; N373-R376 PolarHBondContact O-N 3.35Å; N373-R376 PolarHBondContact OD1-NH1 2.94Å; N373-L377 VanDerWaalsContact O-CG 3.27Å; N373-L377 WeakPolarHBondContact O-CG 3.47Å; N373-L377 PolarHBondContact O-N 2.79Å
374	T	96.9	Very high	96.6	Very high	5 Å²	5	26.8 Å²	26.8	3%	0.031	15%	0.145	C	C	.	.	H	α-helix	trans	-51.8	-43	173.5	-54.9	0	0	0	0	110.9	E215 D370 F371 R376 L377 H378 F386 V473	E215-T374 PolarHBondContact OE2-OG1 2.96Å; D370-T374 PolarHBondContact O-N 3.15Å; D370-T374 PolarHBondContact O-OG1 2.86Å; F371-T374 PolarHBondContact O-N 3.4Å; T374-R376 PolarHBondContact O-N 2.58Å; T374-L377 PolarHBondContact O-N 3.4Å; T374-H378 WeakPolarHBondContact O-CB 3.47Å; T374-H378 PolarHBondContact O-CD2 2.96Å; T374-H378 VanDerWaalsContact O-CD2 3.27Å; T374-H378 PolarHBondContact O-N 2.94Å; T374-F386 HydrophobicContact CG2-CE1 3.72Å; T374-F386 HydrophobicContact CG2-CZ 3.68Å; T374-V473 HydrophobicContact CG2-CG2 4.42Å
375	C	97.6	Very high	96.7	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-58.8	-43.7	176.4	-174.6	0	0	0	0	112.6	I267 F371 L372 N373 A379 C431	I267-C375 HydrophobicContact CD1-CB 4.35Å; F371-C375 HydrophobicContact CZ-CB 4.42Å; F371-C375 VanDerWaalsContact O-CB 3.29Å; F371-C375 WeakPolarHBondContact O-CB 3.28Å; F371-C375 PolarHBondContact O-N 3.44Å; L372-C375 WeakPolarHBondContact O-CB 3.32Å; N373-C375 PolarHBondContact O-N 2.96Å; C375-A379 WeakPolarHBondContact O-CB 3.43Å; C375-A379 PolarHBondContact O-N 2.79Å; C375-C431 HydrophobicContact CB-CB 4.07Å; C375-C431 WeakPolarHBondContact CB-SG 3.45Å; C375-C431 WeakPolarHBondContact SG-CB 3.19Å; C375-C431 CovalentContact SG-SG 2.03Å; C375-C431 PolarHBondContact SG-SG 2.9Å
376	R	97.6	Very high	96.7	Very high	3 Å²	3	26.2 Å²	26.2	1%	0.011	14%	0.142	C	C	.	.	H	α-helix	trans	-71.1	-37.9	177.2	-68.7	173.5	-176.7	114.9	-0.8	113	T262 M265 I267 D295 Q297 L357 L372 N373 T374	T262-R376 HydrophobicContact CG2-CB 4.07Å; M265-R376 HydrophobicContact CB-CG 4.17Å; M265-R376 HydrophobicContact CE-CB 4.22Å; M265-R376 PolarHBondContact O-NE 3.13Å; M265-R376 PolarHBondContact O-NH2 2.89Å; M265-R376 HydrophobicContact SD-CB 4.16Å; I267-R376 HydrophobicContact CD1-CG 4Å; I267-R376 HydrophobicContact CG1-CG 4.17Å; D295-R376 VanDerWaalsContact CG-NH2 3.32Å; D295-R376 IonicContact OD1-CZ 2.71Å; D295-R376 IonicContact OD1-NH1 2.75Å; D295-R376 PolarHBondContact OD1-NH1 3.12Å; D295-R376 IonicContact OD1-NH2 3.44Å; D295-R376 PolarHBondContact OD1-NH2 2.9Å; D295-R376 VanDerWaalsContact OD1-NH2 3.1Å; D295-R376 IonicContact OD2-CZ 3.28Å; D295-R376 IonicContact OD2-NH1 3.63Å; D295-R376 IonicContact OD2-NH2 3.56Å; D295-R376 PolarHBondContact OD2-NH2 3.25Å; Q297-R376 PolarHBondContact O-NH2 2.83Å; L357-R376 HydrophobicContact CD2-CB 4.37Å; L357-R376 HydrophobicContact CD2-CG 3.89Å; L372-R376 WeakPolarHBondContact O-CG 3.33Å; L372-R376 PolarHBondContact O-N 2.72Å; N373-R376 PolarHBondContact O-N 3.35Å; N373-R376 PolarHBondContact OD1-NH1 2.94Å; T374-R376 PolarHBondContact O-N 2.58Å
377	L	96.3	Very high	96.7	Very high	16 Å²	16	24.3 Å²	24.3	8%	0.084	14%	0.135	C	C	.	.	H	α-helix	trans	-74.1	-30.6	-175.8	-67.3	171.5	0	0	0	112.6	E215 F231 F240 V260 T262 N373 T374	E215-L377 WeakPolarHBondContact OE1-CD1 3.37Å; F231-L377 HydrophobicContact CB-CD1 4.37Å; F231-L377 HydrophobicContact CD1-CB 4.14Å; F231-L377 HydrophobicContact CD1-CD1 3.8Å; F231-L377 HydrophobicContact CD1-CD2 3.88Å; F231-L377 HydrophobicContact CD1-CG 4.14Å; F231-L377 HydrophobicContact CE1-CB 3.77Å; F231-L377 HydrophobicContact CE1-CD1 4.3Å; F231-L377 HydrophobicContact CE1-CD2 3.98Å; F231-L377 HydrophobicContact CE1-CG 4.22Å; F231-L377 HydrophobicContact CG-CD1 4.1Å; F231-L377 HydrophobicContact CZ-CB 4.18Å; F240-L377 HydrophobicContact CB-CD2 3.88Å; F240-L377 HydrophobicContact CD1-CD1 3.62Å; F240-L377 HydrophobicContact CD1-CD2 3.92Å; F240-L377 HydrophobicContact CD1-CG 4.32Å; F240-L377 HydrophobicContact CD2-CD2 4.29Å; F240-L377 HydrophobicContact CE1-CD1 3.88Å; F240-L377 HydrophobicContact CG-CD1 4.35Å; F240-L377 HydrophobicContact CG-CD2 3.78Å; V260-L377 HydrophobicContact CB-CD2 4.29Å; V260-L377 HydrophobicContact CG1-CD2 4.01Å; T262-L377 HydrophobicContact CG2-CD2 4.17Å; N373-L377 VanDerWaalsContact O-CG 3.27Å; N373-L377 WeakPolarHBondContact O-CG 3.47Å; N373-L377 PolarHBondContact O-N 2.79Å; T374-L377 PolarHBondContact O-N 3.4Å
378	H	96.9	Very high	96.7	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-102.6	-3.9	-174.8	-69.4	-67.8	0	0	0	115.3	E215 L217 F231 T374 K384 F386 I469	E215-H378 IonicContact OE1-CD2 3.92Å; E215-H378 IonicContact OE1-NE2 2.84Å; L217-H378 WeakPolarHBondContact CD1-CE1 3.3Å; F231-H378 AromaticContact CE2-CE1 3.27Å; F231-H378 WeakPolarHBondContact CE2-CE1 3.43Å; F231-H378 AromaticContact CE2-NE2 3.63Å; F231-H378 AromaticContact CZ-CE1 3.67Å; T374-H378 WeakPolarHBondContact O-CB 3.47Å; T374-H378 PolarHBondContact O-CD2 2.96Å; T374-H378 VanDerWaalsContact O-CD2 3.27Å; T374-H378 PolarHBondContact O-N 2.94Å; H378-K384 WeakPolarHBondContact O-CB 3.33Å; H378-F386 HydrophobicContact CB-CB 3.9Å; H378-F386 HydrophobicContact CB-CD1 4.12Å; H378-F386 HydrophobicContact CB-CD2 3.67Å; H378-F386 HydrophobicContact CB-CE2 4.17Å; H378-F386 HydrophobicContact CB-CG 3.64Å; H378-I469 HydrophobicContact CB-CG2 4.29Å
379	A	97.2	Very high	96.8	Very high	4 Å²	4	22.9 Å²	22.9	3%	0.033	13%	0.126	C	C	.	.			trans	-112.2	135.2	172.9	0	0	0	0	0	110.8	L357 C375 F386 C431 Y433	L357-A379 HydrophobicContact CD1-CB 3.54Å; C375-A379 WeakPolarHBondContact O-CB 3.43Å; C375-A379 PolarHBondContact O-N 2.79Å; A379-F386 HydrophobicContact CB-CB 4.42Å; A379-C431 HydrophobicContact CB-CB 4.38Å; A379-Y433 HydrophobicContact CB-CD2 4.49Å; A379-Y433 HydrophobicContact CB-CE2 4.38Å
380	A	95.7	Very high	96.8	Very high	28 Å²	28	21.6 Å²	21.6	23%	0.231	12%	0.119	C	C	.	.	B	Isolated β-bridge	trans	-147.8	132.2	179.3	0	0	0	0	0	110.4	N382 K383 K384	A380-N382 PolarHBondContact O-N 3.35Å; A380-K383 HydrophobicContact CB-CB 4.17Å; A380-K383 PolarHBondContact O-N 3.33Å; A380-K384 HydrophobicContact CB-CB 4.25Å; A380-K384 HydrophobicContact CB-CG 4.44Å; A380-K384 PolarHBondContact N-O 2.74Å; A380-K384 PolarHBondContact O-N 3.34Å; A380-K384 VanDerWaalsContact O-O 3.1Å
381	P	96.1	Very high	97	Very high	57 Å²	57	16.9 Å²	16.9	37%	0.37	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	134.9	-172.8	27.5	-32.8	0	0	0	110.5	K383 Y433 D436	P381-K383 PolarHBondContact O-N 3.1Å; P381-K383 VanDerWaalsContact O-N 3.12Å; P381-Y433 HydrophobicContact CB-CD1 3.98Å; P381-Y433 HydrophobicContact CB-CD2 4.1Å; P381-Y433 HydrophobicContact CB-CE1 4.43Å; P381-Y433 HydrophobicContact CB-CG 3.78Å; P381-Y433 VanDerWaalsContact CD-CE2 3.47Å; P381-Y433 HydrophobicContact CG-CD1 4.36Å; P381-Y433 HydrophobicContact CG-CD2 4.44Å; P381-Y433 HydrophobicContact CG-CE1 4.32Å; P381-Y433 HydrophobicContact CG-CE2 4.42Å; P381-Y433 HydrophobicContact CG-CG 4.41Å; P381-D436 WeakPolarHBondContact CA-OD2 3.32Å
382	N	95.1	Very high	96.9	Very high	113 Å²	113	16.9 Å²	16.9	60%	0.604	9%	0.094	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.7	17.5	-175.9	-53.5	-72.6	0	0	0	114.9	A380 D436	A380-N382 PolarHBondContact O-N 3.35Å; N382-D436 VanDerWaalsContact CA-OD1 3.26Å; N382-D436 WeakPolarHBondContact CA-OD1 3.33Å; N382-D436 PolarHBondContact N-OD1 2.86Å; N382-D436 PolarHBondContact N-OD2 3.17Å; N382-D436 VanDerWaalsContact N-OD2 3.16Å
383	K	94.8	Very high	96.9	Very high	72 Å²	72	17.1 Å²	17.1	31%	0.313	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	-136.5	-51	-179.4	-167.1	175.4	-176.7	169.7	0	114.7	A380 P381 L466 I467	A380-K383 HydrophobicContact CB-CB 4.17Å; A380-K383 PolarHBondContact O-N 3.33Å; P381-K383 PolarHBondContact O-N 3.1Å; P381-K383 VanDerWaalsContact O-N 3.12Å; K383-L466 VanDerWaalsContact N-CD2 3.32Å; K383-I467 PolarHBondContact O-N 3.47Å
384	K	95.9	Very high	97	Very high	18 Å²	18	17 Å²	17	8%	0.078	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	135.1	-173.1	-55.6	-168.4	178.3	-178	0	111.4	E229 H378 A380 I467 I469	E229-K384 IonicContact OE2-NZ 2.79Å; E229-K384 PolarHBondContact OE2-NZ 2.97Å; H378-K384 WeakPolarHBondContact O-CB 3.33Å; A380-K384 HydrophobicContact CB-CB 4.25Å; A380-K384 HydrophobicContact CB-CG 4.44Å; A380-K384 PolarHBondContact N-O 2.74Å; A380-K384 PolarHBondContact O-N 3.34Å; A380-K384 VanDerWaalsContact O-O 3.1Å; K384-I467 WeakPolarHBondContact CA-O 3.37Å; K384-I467 HydrophobicContact CG-CB 4.23Å; K384-I467 HydrophobicContact CG-CD1 4.46Å; K384-I469 HydrophobicContact CB-CG1 4.49Å; K384-I469 HydrophobicContact CD-CD1 4.43Å; K384-I469 HydrophobicContact CD-CG1 4.23Å
385	V	97.8	Very high	96.9	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	138.4	166.6	62.5	0	0	0	0	109.4	Y387 Q432 Y461 I467 V468 I469	V385-Y387 HydrophobicContact CG1-CD2 4.28Å; V385-Y387 HydrophobicContact CG1-CE2 4.1Å; V385-Y387 HydrophobicContact CG2-CD2 3.99Å; V385-Y387 HydrophobicContact CG2-CE2 3.61Å; V385-Q432 HydrophobicContact CG2-CB 3.67Å; V385-Y461 HydrophobicContact CB-CD1 4.09Å; V385-Y461 HydrophobicContact CB-CE1 4.12Å; V385-Y461 HydrophobicContact CG1-CD1 3.7Å; V385-Y461 HydrophobicContact CG1-CE1 4.25Å; V385-Y461 HydrophobicContact CG1-CG 3.93Å; V385-Y461 HydrophobicContact CG2-CD1 4.3Å; V385-Y461 HydrophobicContact CG2-CD2 4.5Å; V385-Y461 HydrophobicContact CG2-CE1 4.11Å; V385-Y461 HydrophobicContact CG2-CE2 4.3Å; V385-Y461 HydrophobicContact CG2-CG 4.49Å; V385-I467 PolarHBondContact N-O 2.99Å; V385-V468 HydrophobicContact CG1-CB 4.32Å; V385-V468 HydrophobicContact CG1-CG1 4.5Å; V385-V468 HydrophobicContact CG1-CG2 3.81Å; V385-I469 PolarHBondContact O-N 2.03Å
386	F	98.6	Very high	96.8	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	120.1	-175.8	179.3	-127.9	0	0	0	112.2	F371 T374 H378 A379 P388 T430 C431 I469 S471 V473	F371-F386 HydrophobicContact CE2-CE1 4.4Å; T374-F386 HydrophobicContact CG2-CE1 3.72Å; T374-F386 HydrophobicContact CG2-CZ 3.68Å; H378-F386 HydrophobicContact CB-CB 3.9Å; H378-F386 HydrophobicContact CB-CD1 4.12Å; H378-F386 HydrophobicContact CB-CD2 3.67Å; H378-F386 HydrophobicContact CB-CE2 4.17Å; H378-F386 HydrophobicContact CB-CG 3.64Å; A379-F386 HydrophobicContact CB-CB 4.42Å; F386-P388 HydrophobicContact CD1-CB 4.5Å; F386-P388 HydrophobicContact CD1-CG 4.49Å; F386-P388 HydrophobicContact CE1-CB 3.78Å; F386-P388 HydrophobicContact CE1-CG 4.18Å; F386-P388 HydrophobicContact CZ-CB 3.81Å; F386-P388 VanDerWaalsContact O-CD 3.28Å; F386-P388 WeakPolarHBondContact O-CD 3.42Å; F386-T430 CarbonylContact O-C 3.58Å; F386-T430 WeakPolarHBondContact O-CA 3.33Å; F386-T430 PolarHBondContact O-OG1 3.44Å; F386-C431 HydrophobicContact CB-CB 4.02Å; F386-C431 HydrophobicContact CD1-CB 3.95Å; F386-C431 HydrophobicContact CG-CB 4.47Å; F386-C431 PolarHBondContact N-O 2.9Å; F386-C431 PolarHBondContact O-N 3.47Å; F386-I469 CarbonylContact C-O 3.57Å; F386-I469 WeakPolarHBondContact CA-O 3.39Å; F386-I469 HydrophobicContact CD2-CB 3.9Å; F386-I469 HydrophobicContact CD2-CG2 3.68Å; F386-I469 WeakPolarHBondContact CD2-O 3.39Å; F386-I469 HydrophobicContact CE2-CG2 4Å; F386-S471 WeakPolarHBondContact CE2-OG 3.45Å; F386-V473 HydrophobicContact CE1-CG2 4.3Å; F386-V473 HydrophobicContact CZ-CG2 3.66Å
387	Y	98.3	Very high	96.6	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	85.1	177.7	-84.7	-91.8	0	0	0	110.1	V385 F427 T430 Y458 Y461 V468 I469 R470	V385-Y387 HydrophobicContact CG1-CD2 4.28Å; V385-Y387 HydrophobicContact CG1-CE2 4.1Å; V385-Y387 HydrophobicContact CG2-CD2 3.99Å; V385-Y387 HydrophobicContact CG2-CE2 3.61Å; Y387-F427 HydrophobicContact CD1-CB 4.25Å; Y387-F427 HydrophobicContact CD1-CD1 4.43Å; Y387-F427 HydrophobicContact CE1-CB 4.14Å; Y387-F427 WeakPolarHBondContact CE1-O 3.32Å; Y387-T430 HydrophobicContact CE1-CG2 4.32Å; Y387-Y458 AromaticContact CD1-CD2 3.68Å; Y387-Y458 HydrophobicContact CD1-CD2 3.68Å; Y387-Y458 HydrophobicContact CD1-CE2 4.07Å; Y387-Y458 AromaticContact CD2-CD2 3.77Å; Y387-Y458 HydrophobicContact CD2-CD2 3.77Å; Y387-Y458 AromaticContact CD2-CE2 3.83Å; Y387-Y458 HydrophobicContact CD2-CE2 3.83Å; Y387-Y458 AromaticContact CE1-CD2 3.59Å; Y387-Y458 HydrophobicContact CE1-CD2 3.59Å; Y387-Y458 HydrophobicContact CE1-CE2 4.4Å; Y387-Y458 HydrophobicContact CE1-CG 4.31Å; Y387-Y458 AromaticContact CE2-CD2 3.67Å; Y387-Y458 HydrophobicContact CE2-CD2 3.67Å; Y387-Y458 HydrophobicContact CE2-CE2 4.18Å; Y387-Y458 AromaticContact CG-CD2 3.76Å; Y387-Y458 HydrophobicContact CG-CD2 3.76Å; Y387-Y458 AromaticContact CG-CE2 3.76Å; Y387-Y458 HydrophobicContact CG-CE2 3.76Å; Y387-Y458 AromaticContact CZ-CD2 3.59Å; Y387-Y461 AromaticContact CE2-CD2 3.95Å; Y387-Y461 HydrophobicContact CE2-CD2 3.95Å; Y387-Y461 HydrophobicContact CE2-CE2 4.47Å; Y387-Y461 HydrophobicContact CE2-CG 4.41Å; Y387-Y461 WeakPolarHBondContact OH-CD2 3.43Å; Y387-V468 HydrophobicContact CD2-CG1 4.13Å; Y387-I469 PolarHBondContact N-O 3.1Å; Y387-R470 WeakPolarHBondContact O-CA 3.44Å
388	P	98	Very high	96.4	Very high	4 Å²	4	23.5 Å²	23.5	3%	0.026	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	140	178.7	29	-37.1	0	0	0	111.6	F371 F386 M429 V473 L476	F371-P388 HydrophobicContact CE2-CB 4.16Å; F371-P388 HydrophobicContact CE2-CG 4.03Å; F371-P388 HydrophobicContact CZ-CG 4.4Å; F386-P388 HydrophobicContact CD1-CB 4.5Å; F386-P388 HydrophobicContact CD1-CG 4.49Å; F386-P388 HydrophobicContact CE1-CB 3.78Å; F386-P388 HydrophobicContact CE1-CG 4.18Å; F386-P388 HydrophobicContact CZ-CB 3.81Å; F386-P388 VanDerWaalsContact O-CD 3.28Å; F386-P388 WeakPolarHBondContact O-CD 3.42Å; P388-M429 WeakPolarHBondContact CD-O 3.49Å; P388-M429 HydrophobicContact CG-CB 4.25Å; P388-V473 HydrophobicContact CB-CB 4.41Å; P388-V473 HydrophobicContact CB-CG2 3.62Å; P388-L476 HydrophobicContact CB-CD2 3.71Å; P388-L476 HydrophobicContact CG-CD2 3.81Å
389	V	97.9	Very high	96.3	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.006	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	115.1	170.1	-178.3	0	0	0	0	108.6	L156 W422 R470 S471 V473	L156-V389 HydrophobicContact CD1-CG2 4.19Å; L156-V389 HydrophobicContact CD2-CB 4.1Å; L156-V389 HydrophobicContact CD2-CG1 3.68Å; L156-V389 HydrophobicContact CD2-CG2 4.24Å; V389-W422 HydrophobicContact CG1-CB 4.11Å; V389-W422 HydrophobicContact CG1-CE3 4.4Å; V389-W422 WeakPolarHBondContact O-CZ3 3.33Å; V389-R470 HydrophobicContact CG2-CG 3.86Å; V389-S471 PolarHBondContact N-O 3.4Å; V389-V473 PolarHBondContact O-N 2.95Å; V389-V473 VanDerWaalsContact O-N 3.1Å
390	V	97.2	Very high	96.1	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.012	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	148.2	-177.5	-54.6	0	0	0	0	112	I365 R423 M429 L476 H478	I365-V390 HydrophobicContact CD1-CG1 4.32Å; V390-R423 HydrophobicContact CG2-CB 3.91Å; V390-R423 PolarHBondContact O-N 2.86Å; V390-M429 HydrophobicContact CB-CE 4.3Å; V390-M429 HydrophobicContact CG1-CB 4.29Å; V390-M429 HydrophobicContact CG1-CE 3.51Å; V390-M429 HydrophobicContact CG1-CG 4.11Å; V390-M429 HydrophobicContact CG2-CE 3.73Å; V390-L476 HydrophobicContact CB-CG 4.47Å; V390-L476 HydrophobicContact CG1-CD2 3.54Å; V390-L476 HydrophobicContact CG1-CG 3.77Å; V390-H478 HydrophobicContact CB-CB 4.44Å; V390-H478 HydrophobicContact CG2-CB 3.94Å
391	F	97.4	Very high	95.6	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	114.3	165.5	-163.9	-101.5	0	0	0	109.7	P164 L393 S414 H415 G420 W422 L476 F477 H478	P164-F391 HydrophobicContact CB-CD2 4.37Å; P164-F391 HydrophobicContact CB-CE2 3.55Å; P164-F391 HydrophobicContact CB-CZ 4.37Å; P164-F391 HydrophobicContact CG-CE2 3.77Å; P164-F391 HydrophobicContact CG-CZ 4.22Å; F391-L393 HydrophobicContact CD1-CD2 4Å; F391-L393 HydrophobicContact CE1-CD2 4.01Å; F391-S414 WeakPolarHBondContact CE1-O 3.27Å; F391-H415 AromaticContact CD2-CD2 3.78Å; F391-H415 HydrophobicContact CE2-CB 4.43Å; F391-H415 AromaticContact CG-CD2 3.67Å; F391-G420 WeakPolarHBondContact CZ-O 3.35Å; F391-W422 HydrophobicContact CB-CE3 3.93Å; F391-W422 HydrophobicContact CB-CH2 4.07Å; F391-W422 HydrophobicContact CB-CZ3 3.64Å; F391-W422 AromaticContact CD2-CD2 3.84Å; F391-W422 HydrophobicContact CD2-CD2 3.84Å; F391-W422 AromaticContact CD2-CE2 3.94Å; F391-W422 AromaticContact CD2-CE3 3.99Å; F391-W422 HydrophobicContact CD2-CE3 3.99Å; F391-W422 HydrophobicContact CD2-CG 4.34Å; F391-W422 HydrophobicContact CD2-CH2 4.28Å; F391-W422 HydrophobicContact CD2-CZ2 4.15Å; F391-W422 HydrophobicContact CD2-CZ3 4.23Å; F391-W422 HydrophobicContact CG-CE3 4.49Å; F391-W422 HydrophobicContact CG-CZ3 4.43Å; F391-L476 PolarHBondContact N-O 2.88Å; F391-F477 HydrophobicContact CB-CD1 4Å; F391-F477 HydrophobicContact CB-CE1 4.1Å; F391-F477 AromaticContact CD1-CD1 3.83Å; F391-F477 HydrophobicContact CD1-CD1 3.83Å; F391-F477 AromaticContact CD1-CE1 3.68Å; F391-F477 HydrophobicContact CD1-CE1 3.68Å; F391-F477 HydrophobicContact CG-CD1 4.37Å; F391-F477 HydrophobicContact CG-CE1 4.21Å; F391-F477 CarbonylContact O-C 3.6Å; F391-F477 WeakPolarHBondContact O-CA 3.48Å; F391-H478 PolarHBondContact O-N 3.14Å
392	S	97	Very high	95	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	121.6	180	-64.3	0	0	0	0	111	G420 F421 R423	S392-G420 CarbonylContact O-C 3.6Å; S392-G420 WeakPolarHBondContact O-CA 3.35Å; S392-F421 PolarHBondContact N-O 2.99Å; S392-F421 PolarHBondContact O-N 2.97Å; S392-R423 VanDerWaalsContact CB-NH2 3.33Å; S392-R423 WeakPolarHBondContact OG-CB 3.49Å; S392-R423 VanDerWaalsContact OG-CZ 3.23Å; S392-R423 PolarHBondContact OG-NE 3.14Å; S392-R423 PolarHBondContact OG-NH2 2.94Å
393	L	97.3	Very high	94.6	Very high	4 Å²	4	29.5 Å²	29.5	2%	0.021	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	145.2	176.3	-61.4	178.8	0	0	0	110.6	F391 Q412 L413 A419 F477 H478 L479	F391-L393 HydrophobicContact CD1-CD2 4Å; F391-L393 HydrophobicContact CE1-CD2 4.01Å; L393-Q412 HydrophobicContact CD1-CB 4.25Å; L393-L413 HydrophobicContact CD1-CD2 4.06Å; L393-A419 WeakPolarHBondContact CA-O 3.4Å; L393-F477 HydrophobicContact CD2-CD1 4.11Å; L393-F477 HydrophobicContact CD2-CE1 4.5Å; L393-F477 HydrophobicContact CG-CD1 4.38Å; L393-H478 PolarHBondContact N-O 3.41Å; L393-L479 HydrophobicContact CD1-CD2 3.82Å
394	Y	97.3	Very high	94.1	Very high	29 Å²	29	35.6 Å²	35.6	11%	0.114	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-75.8	169.8	172.2	-70.2	-43.4	0	0	0	112.1	P396 V399 A419 F421 W480 M503 N504 S507	Y394-P396 VanDerWaalsContact O-CD 3.28Å; Y394-P396 WeakPolarHBondContact O-CD 3.3Å; Y394-P396 VanDerWaalsContact O-N 3.12Å; Y394-V399 HydrophobicContact CD2-CG2 4.4Å; Y394-V399 HydrophobicContact CG-CG2 4.44Å; Y394-A419 VanDerWaalsContact CD2-C 3.46Å; Y394-A419 PolarHBondContact N-O 3.09Å; Y394-F421 HydrophobicContact CD1-CD1 4.15Å; Y394-F421 HydrophobicContact CD1-CE1 4.29Å; Y394-F421 AromaticContact CE1-CD1 3.37Å; Y394-F421 HydrophobicContact CE1-CD1 3.37Å; Y394-F421 AromaticContact CE1-CE1 3.78Å; Y394-F421 HydrophobicContact CE1-CE1 3.78Å; Y394-F421 HydrophobicContact CE1-CG 4.48Å; Y394-F421 AromaticContact CZ-CD1 3.83Å; Y394-W480 WeakPolarHBondContact O-CB 3.47Å; Y394-M503 WeakPolarHBondContact CE1-O 3.47Å; Y394-N504 CarbonylContact C-O 3.56Å; Y394-N504 VanDerWaalsContact CA-O 3.32Å; Y394-N504 WeakPolarHBondContact CA-O 3.34Å; Y394-S507 VanDerWaalsContact CE2-N 3.3Å
395	N	96.1	Very high	93.6	Very high	18 Å²	18	41.7 Å²	41.7	10%	0.096	25%	0.245	C	C	.	.			trans	-58.3	114	176.3	-172.3	-19.5	0	0	0	110.7	A397 I398 V399 W480 N504 E505	N395-A397 PolarHBondContact O-N 3.46Å; N395-A397 VanDerWaalsContact OD1-CB 3.28Å; N395-A397 WeakPolarHBondContact OD1-CB 3.48Å; N395-A397 PolarHBondContact OD1-N 2.97Å; N395-I398 HydrophobicContact CB-CB 4.39Å; N395-I398 HydrophobicContact CB-CD1 4.11Å; N395-I398 HydrophobicContact CB-CG1 4.19Å; N395-I398 PolarHBondContact O-N 3Å; N395-V399 WeakPolarHBondContact O-CG2 3.49Å; N395-V399 PolarHBondContact O-N 3.2Å; N395-W480 HydrophobicContact CB-CD2 3.96Å; N395-W480 HydrophobicContact CB-CG 4.2Å; N395-W480 HydrophobicContact CB-CZ2 3.92Å; N395-W480 VanDerWaalsContact CG-CZ2 3.41Å; N395-W480 VanDerWaalsContact N-CD1 3.33Å; N395-W480 WeakPolarHBondContact ND2-CZ2 3.36Å; N395-N504 PolarHBondContact N-O 3.33Å; N395-N504 VanDerWaalsContact N-O 3.1Å; N395-E505 WeakPolarHBondContact CB-O 3.26Å; N395-E505 PolarHBondContact N-O 3.26Å; N395-E505 PolarHBondContact ND2-OE2 3.21Å
396	P	94.4	Very high	93.2	Very high	31 Å²	31	44 Å²	44	20%	0.201	26%	0.264	C	S	.	.	H	α-helix	trans	-64	-26.7	-177.5	25.7	-34.1	0	0	0	112	Y394 I398 Y400 A406	Y394-P396 VanDerWaalsContact O-CD 3.28Å; Y394-P396 WeakPolarHBondContact O-CD 3.3Å; Y394-P396 VanDerWaalsContact O-N 3.12Å; P396-I398 PolarHBondContact O-N 3Å; P396-Y400 HydrophobicContact CB-CD2 3.9Å; P396-Y400 HydrophobicContact CB-CE2 4.25Å; P396-Y400 WeakPolarHBondContact O-CB 3.36Å; P396-Y400 WeakPolarHBondContact O-CD2 3.44Å; P396-Y400 PolarHBondContact O-N 2.86Å; P396-A406 HydrophobicContact CB-CB 4.21Å
397	A	92.8	Very high	92.9	Very high	72 Å²	72	45.3 Å²	45.3	60%	0.595	27%	0.272	S	S	*	.	H	α-helix	trans	-66.9	-26.4	176	0	0	0	0	0	112.6	N395 G401	N395-A397 PolarHBondContact O-N 3.46Å; N395-A397 VanDerWaalsContact OD1-CB 3.28Å; N395-A397 WeakPolarHBondContact OD1-CB 3.48Å; N395-A397 PolarHBondContact OD1-N 2.97Å; A397-G401 VanDerWaalsContact O-CA 3.24Å; A397-G401 WeakPolarHBondContact O-CA 3.46Å; A397-G401 PolarHBondContact O-N 2.83Å
398	I	93.5	Very high	92.6	Very high	40 Å²	40	48.7 Å²	48.7	21%	0.205	29%	0.294	C	S	.	.	H	α-helix	trans	-89.9	-50.6	175.7	-59.7	174.8	0	0	0	110.3	N395 P396 Y400 G401 E505 A506 H510 L514	N395-I398 HydrophobicContact CB-CB 4.39Å; N395-I398 HydrophobicContact CB-CD1 4.11Å; N395-I398 HydrophobicContact CB-CG1 4.19Å; N395-I398 PolarHBondContact O-N 3Å; P396-I398 PolarHBondContact O-N 3Å; I398-Y400 VanDerWaalsContact C-N 3.29Å; I398-Y400 PolarHBondContact O-N 3.01Å; I398-G401 PolarHBondContact O-N 2.88Å; I398-E505 HydrophobicContact CD1-CB 3.96Å; I398-A506 HydrophobicContact CB-CB 4.22Å; I398-A506 HydrophobicContact CG2-CB 3.56Å; I398-H510 HydrophobicContact CG2-CB 4.25Å; I398-L514 HydrophobicContact CD1-CD1 4.15Å; I398-L514 HydrophobicContact CG1-CD1 4.33Å; I398-L514 HydrophobicContact CG2-CD1 3.8Å; I398-L514 HydrophobicContact CG2-CG 4.42Å
399	V	93.9	Very high	92.3	Very high	21 Å²	21	50.7 Å²	50.7	13%	0.127	30%	0.304	C	S	.	.	H	α-helix	trans	-59.3	-41	-177.6	174.5	0	0	0	0	111.8	Y394 N395	Y394-V399 HydrophobicContact CD2-CG2 4.4Å; Y394-V399 HydrophobicContact CG-CG2 4.44Å; N395-V399 WeakPolarHBondContact O-CG2 3.49Å; N395-V399 PolarHBondContact O-N 3.2Å
400	Y	92.5	Very high	92	Very high	42 Å²	42	56 Å²	56	17%	0.165	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	18.5	-178.6	-53.3	-68.4	0	0	0	112.5	P396 I398 S402 L403 A406 P407 Q412	P396-Y400 HydrophobicContact CB-CD2 3.9Å; P396-Y400 HydrophobicContact CB-CE2 4.25Å; P396-Y400 WeakPolarHBondContact O-CB 3.36Å; P396-Y400 WeakPolarHBondContact O-CD2 3.44Å; P396-Y400 PolarHBondContact O-N 2.86Å; I398-Y400 VanDerWaalsContact C-N 3.29Å; I398-Y400 PolarHBondContact O-N 3.01Å; Y400-S402 PolarHBondContact O-N 3.25Å; Y400-L403 HydrophobicContact CD1-CD1 4.08Å; Y400-L403 WeakPolarHBondContact O-CB 3.26Å; Y400-L403 PolarHBondContact O-N 3.08Å; Y400-A406 HydrophobicContact CD2-CB 4.03Å; Y400-A406 HydrophobicContact CG-CB 4.45Å; Y400-P407 HydrophobicContact CD1-CG 3.99Å; Y400-P407 HydrophobicContact CD2-CG 4.25Å; Y400-P407 HydrophobicContact CE1-CG 3.67Å; Y400-P407 HydrophobicContact CE2-CG 3.95Å; Y400-P407 VanDerWaalsContact CG-CD 3.48Å; Y400-P407 HydrophobicContact CG-CG 4.27Å; Y400-Q412 HydrophobicContact CE2-CG 3.8Å
401	G	86.1	Confident	91.8	Very high	54 Å²	54	62.4 Å²	62.4	56%	0.557	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-13.4	-175.3	0	0	0	0	0	115.1	A397 I398	A397-G401 VanDerWaalsContact O-CA 3.24Å; A397-G401 WeakPolarHBondContact O-CA 3.46Å; A397-G401 PolarHBondContact O-N 2.83Å; I398-G401 PolarHBondContact O-N 2.88Å
402	S	82.9	Confident	91.7	Very high	117 Å²	117	63.5 Å²	63.5	82%	0.818	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-11.2	171.3	62.3	0	0	0	0	114.1	Y400	Y400-S402 PolarHBondContact O-N 3.25Å
403	L	86.4	Confident	91.6	Very high	94 Å²	94	65.9 Å²	65.9	49%	0.492	38%	0.376	S	S	.	.	S	Bend	trans	-97.8	148.7	177	-55.5	-178.8	0	0	0	109.3	Y400 L405	Y400-L403 HydrophobicContact CD1-CD1 4.08Å; Y400-L403 WeakPolarHBondContact O-CB 3.26Å; Y400-L403 PolarHBondContact O-N 3.08Å; L403-L405 WeakPolarHBondContact CB-O 3.37Å; L403-L405 PolarHBondContact O-N 3.1Å
404	E	84.3	Confident	91.4	Very high	200 Å²	200	67 Å²	67	94%	0.935	38%	0.384	S	S	*	.	S	Bend	trans	-64	-33.8	174.3	-67.8	-175.5	170.3	0	0	111.9
405	L	86.6	Confident	91.2	Very high	146 Å²	146	66.6 Å²	66.6	76%	0.764	38%	0.384	S	S	*	.	S	Bend	trans	-137.3	137.5	178.7	-69.7	167.4	0	0	0	109.6	L403	L403-L405 WeakPolarHBondContact CB-O 3.37Å; L403-L405 PolarHBondContact O-N 3.1Å
406	A	89.2	Confident	91	Very high	50 Å²	50	71.5 Å²	71.5	41%	0.413	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-61.7	143.8	169.6	0	0	0	0	0	109.8	P396 Y400	P396-A406 HydrophobicContact CB-CB 4.21Å; Y400-A406 HydrophobicContact CD2-CB 4.03Å; Y400-A406 HydrophobicContact CG-CB 4.45Å
407	P	92.3	Very high	90.8	Very high	26 Å²	26	75.2 Å²	75.2	17%	0.169	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-64.8	160.8	177.6	29.1	-34.4	0	0	0	110.9	Y400 Q411 Q412	Y400-P407 HydrophobicContact CD1-CG 3.99Å; Y400-P407 HydrophobicContact CD2-CG 4.25Å; Y400-P407 HydrophobicContact CE1-CG 3.67Å; Y400-P407 HydrophobicContact CE2-CG 3.95Å; Y400-P407 VanDerWaalsContact CG-CD 3.48Å; Y400-P407 HydrophobicContact CG-CG 4.27Å; P407-Q411 HydrophobicContact CB-CB 4.11Å; P407-Q412 HydrophobicContact CG-CG 3.96Å; P407-Q412 PolarHBondContact O-NE2 3.44Å
408	P	92.4	Very high	90.7	Very high	72 Å²	72	74.9 Å²	74.9	47%	0.468	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-54.3	151.9	173.7	-24.4	34.1	0	0	0	112.4	E410 Q411 Q412	P408-E410 WeakPolarHBondContact CB-OE2 3.35Å; P408-E410 PolarHBondContact O-N 2.78Å; P408-E410 VanDerWaalsContact O-N 3.14Å; P408-Q411 WeakPolarHBondContact O-CB 3.31Å; P408-Q411 PolarHBondContact O-N 3.17Å; P408-Q412 PolarHBondContact O-N 3.44Å
409	I	91.4	Very high	90.7	Very high	45 Å²	45	73.3 Å²	73.3	23%	0.231	40%	0.398	C	S	.	.	H	α-helix	trans	-52.6	-42	-174.8	-69.2	170.7	0	0	0	111	Q282 Q411 Q412 L413 L479	Q282-I409 VanDerWaalsContact OE1-CD1 3.32Å; I409-Q411 PolarHBondContact O-N 2.72Å; I409-Q411 VanDerWaalsContact O-N 3.14Å; I409-Q412 WeakPolarHBondContact O-CA 3.03Å; I409-Q412 WeakPolarHBondContact O-CB 3.37Å; I409-Q412 PolarHBondContact O-N 2.91Å; I409-L413 HydrophobicContact CG2-CD2 3.99Å; I409-L413 HydrophobicContact CG2-CG 4.41Å; I409-L413 WeakPolarHBondContact O-CG 3.09Å; I409-L413 PolarHBondContact O-N 2.89Å; I409-L479 HydrophobicContact CD1-CD1 4.25Å; I409-L479 HydrophobicContact CG2-CD1 4.41Å; I409-L479 HydrophobicContact CG2-CD2 3.91Å
410	E	91.9	Very high	90.8	Very high	112 Å²	112	72.4 Å²	72.4	52%	0.523	39%	0.393	S	S	.	.	H	α-helix	trans	-57.8	-31.5	-178.8	-60.9	71.1	-154.1	0	0	112.5	P408	P408-E410 WeakPolarHBondContact CB-OE2 3.35Å; P408-E410 PolarHBondContact O-N 2.78Å; P408-E410 VanDerWaalsContact O-N 3.14Å
411	Q	92.8	Very high	90.9	Very high	137 Å²	137	71.5 Å²	71.5	64%	0.64	39%	0.39	S	S	*	.	H	α-helix	trans	-85.4	-17.1	177.1	-62.7	-179.4	13.5	0	0	112.7	P407 P408 I409	P407-Q411 HydrophobicContact CB-CB 4.11Å; P408-Q411 WeakPolarHBondContact O-CB 3.31Å; P408-Q411 PolarHBondContact O-N 3.17Å; I409-Q411 PolarHBondContact O-N 2.72Å; I409-Q411 VanDerWaalsContact O-N 3.14Å
412	Q	94	Very high	91.4	Very high	24 Å²	24	69.3 Å²	69.3	11%	0.112	37%	0.365	C	S	.	.	H	α-helix	trans	-80.6	-25.3	174.8	-56.9	-177.4	28.2	0	0	112.2	L393 Y400 P407 P408 I409 S414	L393-Q412 HydrophobicContact CD1-CB 4.25Å; Y400-Q412 HydrophobicContact CE2-CG 3.8Å; P407-Q412 HydrophobicContact CG-CG 3.96Å; P407-Q412 PolarHBondContact O-NE2 3.44Å; P408-Q412 PolarHBondContact O-N 3.44Å; I409-Q412 WeakPolarHBondContact O-CA 3.03Å; I409-Q412 WeakPolarHBondContact O-CB 3.37Å; I409-Q412 PolarHBondContact O-N 2.91Å; Q412-S414 PolarHBondContact O-N 3.26Å
413	L	94.6	Very high	91.9	Very high	49 Å²	49	64.6 Å²	64.6	26%	0.257	33%	0.329	S	S	.	.			trans	-67.5	74.2	-178.5	-52.7	-172.5	0	0	0	111.9	R366 L393 I409 F477 L479	R366-L413 HydrophobicContact CG-CD1 4.06Å; L393-L413 HydrophobicContact CD1-CD2 4.06Å; I409-L413 HydrophobicContact CG2-CD2 3.99Å; I409-L413 HydrophobicContact CG2-CG 4.41Å; I409-L413 WeakPolarHBondContact O-CG 3.09Å; I409-L413 PolarHBondContact O-N 2.89Å; L413-F477 HydrophobicContact CB-CD1 4.39Å; L413-F477 HydrophobicContact CB-CD2 4.33Å; L413-F477 HydrophobicContact CB-CE1 4.12Å; L413-F477 HydrophobicContact CB-CE2 4.06Å; L413-F477 HydrophobicContact CB-CG 4.49Å; L413-F477 HydrophobicContact CB-CZ 3.94Å; L413-F477 HydrophobicContact CD1-CD2 4.48Å; L413-F477 HydrophobicContact CD2-CB 4.06Å; L413-F477 HydrophobicContact CD2-CD1 4.11Å; L413-F477 HydrophobicContact CD2-CD2 4.23Å; L413-F477 HydrophobicContact CD2-CG 3.87Å; L413-L479 HydrophobicContact CD2-CD2 4.09Å
414	S	93.2	Very high	92.1	Very high	27 Å²	27	64 Å²	64	19%	0.189	33%	0.327	C	S	.	.			trans	-139.4	136.4	-177.8	71.6	0	0	0	0	112.3	F391 Q412 K416	F391-S414 WeakPolarHBondContact CE1-O 3.27Å; Q412-S414 PolarHBondContact O-N 3.26Å; S414-K416 PolarHBondContact O-N 3.34Å
415	H	93.6	Very high	92.3	Very high	22 Å²	22	58 Å²	58	10%	0.102	30%	0.298	C	S	.	.			trans	-81.6	54.7	-179.3	-52.7	104.7	0	0	0	112.4	Y154 E165 F391 W422 S474 F477	Y154-H415 AromaticContact CE1-ND1 3.81Å; E165-H415 HydrophobicContact CB-CB 3.64Å; E165-H415 IonicContact OE2-CG 3.07Å; E165-H415 IonicContact OE2-ND1 2.77Å; E165-H415 PolarHBondContact OE2-ND1 3.43Å; F391-H415 AromaticContact CD2-CD2 3.78Å; F391-H415 HydrophobicContact CE2-CB 4.43Å; F391-H415 AromaticContact CG-CD2 3.67Å; H415-W422 AromaticContact CD2-CH2 3.63Å; H415-W422 AromaticContact CD2-CZ2 3.68Å; H415-W422 AromaticContact NE2-CH2 3.76Å; H415-S474 PolarHBondContact CE1-O 3.35Å; H415-S474 WeakPolarHBondContact NE2-CA 3.37Å; H415-S474 PolarHBondContact NE2-O 3.48Å; H415-F477 AromaticContact CE1-CZ 3.59Å; H415-F477 AromaticContact NE2-CE1 3.82Å; H415-F477 AromaticContact NE2-CZ 3.32Å; H415-F477 VanDerWaalsContact NE2-CZ 3.32Å; H415-F477 WeakPolarHBondContact NE2-CZ 3.5Å
416	K	91.5	Very high	92.4	Very high	121 Å²	121	51.7 Å²	51.7	53%	0.526	27%	0.267	S	S	.	.			trans	-103.6	147	178	-57.2	179.9	-178.4	172.6	0	111	S414 D418 A419 G420	S414-K416 PolarHBondContact O-N 3.34Å; K416-D418 WeakPolarHBondContact CB-OD1 3.37Å; K416-D418 PolarHBondContact O-N 3.2Å; K416-D418 VanDerWaalsContact O-N 3.1Å; K416-A419 HydrophobicContact CB-CB 4.05Å; K416-A419 PolarHBondContact O-N 2.94Å; K416-G420 PolarHBondContact O-N 3.4Å; K416-G420 VanDerWaalsContact O-N 3.08Å
417	K	90.5	Very high	92.6	Very high	108 Å²	108	50.1 Å²	50.1	47%	0.47	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-22.4	178.9	69.6	175.9	-179	-175.2	0	114.3	S507	K417-S507 WeakPolarHBondContact O-CB 3.48Å
418	D	91.6	Very high	92.6	Very high	66 Å²	66	49.2 Å²	49.2	35%	0.353	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-12.9	179.4	59.3	-17.7	0	0	0	112.8	K416 H510	K416-D418 WeakPolarHBondContact CB-OD1 3.37Å; K416-D418 PolarHBondContact O-N 3.2Å; K416-D418 VanDerWaalsContact O-N 3.1Å; D418-H510 PolarHBondContact O-CE1 2.82Å
419	A	94.1	Very high	92.8	Very high	7 Å²	7	46.3 Å²	46.3	6%	0.058	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-30.7	178.1	0	0	0	0	0	113	L393 Y394 K416	L393-A419 WeakPolarHBondContact CA-O 3.4Å; Y394-A419 VanDerWaalsContact CD2-C 3.46Å; Y394-A419 PolarHBondContact N-O 3.09Å; K416-A419 HydrophobicContact CB-CB 4.05Å; K416-A419 PolarHBondContact O-N 2.94Å
420	G	95.3	Very high	93.2	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.8	-162.4	-178.5	0	0	0	0	0	114.2	F391 S392 K416	F391-G420 WeakPolarHBondContact CZ-O 3.35Å; S392-G420 CarbonylContact O-C 3.6Å; S392-G420 WeakPolarHBondContact O-CA 3.35Å; K416-G420 PolarHBondContact O-N 3.4Å; K416-G420 VanDerWaalsContact O-N 3.08Å
421	F	94.8	Very high	93.5	Very high	23 Å²	23	38.9 Å²	38.9	10%	0.101	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	158.3	-179.8	66.4	-78	0	0	0	112.1	S392 Y394 R423 F425 M503	S392-F421 PolarHBondContact N-O 2.99Å; S392-F421 PolarHBondContact O-N 2.97Å; Y394-F421 HydrophobicContact CD1-CD1 4.15Å; Y394-F421 HydrophobicContact CD1-CE1 4.29Å; Y394-F421 AromaticContact CE1-CD1 3.37Å; Y394-F421 HydrophobicContact CE1-CD1 3.37Å; Y394-F421 AromaticContact CE1-CE1 3.78Å; Y394-F421 HydrophobicContact CE1-CE1 3.78Å; Y394-F421 HydrophobicContact CE1-CG 4.48Å; Y394-F421 AromaticContact CZ-CD1 3.83Å; F421-R423 HydrophobicContact CE2-CB 4.22Å; F421-R423 HydrophobicContact CE2-CG 4.44Å; F421-R423 PolarHBondContact O-N 3.34Å; F421-F425 AromaticContact CE2-CE1 3.64Å; F421-F425 HydrophobicContact CE2-CE1 3.64Å; F421-F425 HydrophobicContact CE2-CZ 4.02Å; F421-F425 HydrophobicContact CZ-CE1 4.29Å; F421-F425 HydrophobicContact CZ-CZ 4.27Å; F421-M503 WeakPolarHBondContact CE1-O 3.49Å; F421-M503 HydrophobicContact CZ-CB 4.31Å
422	W	95.3	Very high	93.8	Very high	9 Å²	9	32.3 Å²	32.3	3%	0.034	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	121.1	170.2	-66.8	120.3	0	0	0	110.6	Y154 Q155 L156 P164 V389 F391 H415 D424 P472	Y154-W422 HydrophobicContact CD1-CH2 4.45Å; Y154-W422 AromaticContact CD1-CZ2 3.72Å; Y154-W422 HydrophobicContact CD1-CZ2 3.72Å; Y154-W422 HydrophobicContact CG-CZ2 4.04Å; Q155-W422 VanDerWaalsContact O-CD1 3.24Å; L156-W422 HydrophobicContact CD2-CB 3.75Å; L156-W422 HydrophobicContact CD2-CG 4.13Å; P164-W422 PolarHBondContact O-NE1 2.85Å; V389-W422 HydrophobicContact CG1-CB 4.11Å; V389-W422 HydrophobicContact CG1-CE3 4.4Å; V389-W422 WeakPolarHBondContact O-CZ3 3.33Å; F391-W422 HydrophobicContact CB-CE3 3.93Å; F391-W422 HydrophobicContact CB-CH2 4.07Å; F391-W422 HydrophobicContact CB-CZ3 3.64Å; F391-W422 AromaticContact CD2-CD2 3.84Å; F391-W422 HydrophobicContact CD2-CD2 3.84Å; F391-W422 AromaticContact CD2-CE2 3.94Å; F391-W422 AromaticContact CD2-CE3 3.99Å; F391-W422 HydrophobicContact CD2-CE3 3.99Å; F391-W422 HydrophobicContact CD2-CG 4.34Å; F391-W422 HydrophobicContact CD2-CH2 4.28Å; F391-W422 HydrophobicContact CD2-CZ2 4.15Å; F391-W422 HydrophobicContact CD2-CZ3 4.23Å; F391-W422 HydrophobicContact CG-CE3 4.49Å; F391-W422 HydrophobicContact CG-CZ3 4.43Å; H415-W422 AromaticContact CD2-CH2 3.63Å; H415-W422 AromaticContact CD2-CZ2 3.68Å; H415-W422 AromaticContact NE2-CH2 3.76Å; W422-D424 VanDerWaalsContact C-N 3.3Å; W422-D424 PolarHBondContact O-N 3.13Å; W422-P472 HydrophobicContact CD2-CB 3.92Å; W422-P472 HydrophobicContact CE3-CB 3.92Å; W422-P472 HydrophobicContact CH2-CB 4.02Å; W422-P472 HydrophobicContact CZ2-CB 4.01Å; W422-P472 HydrophobicContact CZ3-CB 3.96Å
423	R	93.9	Very high	94	Very high	17 Å²	17	32.6 Å²	32.6	6%	0.064	16%	0.161	C	C	.	.			trans	-84.2	71.8	-179	-170.2	-169.7	-65.8	-85	-0.5	111.4	V390 S392 F421 F425 G426 N504	V390-R423 HydrophobicContact CG2-CB 3.91Å; V390-R423 PolarHBondContact O-N 2.86Å; S392-R423 VanDerWaalsContact CB-NH2 3.33Å; S392-R423 WeakPolarHBondContact OG-CB 3.49Å; S392-R423 VanDerWaalsContact OG-CZ 3.23Å; S392-R423 PolarHBondContact OG-NE 3.14Å; S392-R423 PolarHBondContact OG-NH2 2.94Å; F421-R423 HydrophobicContact CE2-CB 4.22Å; F421-R423 HydrophobicContact CE2-CG 4.44Å; F421-R423 PolarHBondContact O-N 3.34Å; R423-F425 HydrophobicContact CG-CD1 4.36Å; R423-F425 HydrophobicContact CG-CD2 4.22Å; R423-F425 HydrophobicContact CG-CE1 3.98Å; R423-F425 HydrophobicContact CG-CE2 3.8Å; R423-F425 HydrophobicContact CG-CG 4.48Å; R423-F425 HydrophobicContact CG-CZ 3.67Å; R423-F425 PolarHBondContact O-N 3.02Å; R423-G426 PolarHBondContact O-N 3.47Å; R423-N504 PolarHBondContact NH1-ND2 3.06Å; R423-N504 VanDerWaalsContact NH1-ND2 3.12Å; R423-N504 PolarHBondContact NH2-ND2 3.29Å; R423-N504 PolarHBondContact NH2-OD1 2.85Å
424	D	90.5	Very high	94.2	Very high	83 Å²	83	32.4 Å²	32.4	44%	0.444	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-12.1	-177.9	67.7	-15	0	0	0	114.9	L156 W422 R470	L156-D424 HydrophobicContact CD1-CB 4.48Å; L156-D424 HydrophobicContact CD2-CB 4.22Å; W422-D424 VanDerWaalsContact C-N 3.3Å; W422-D424 PolarHBondContact O-N 3.13Å; D424-R470 VanDerWaalsContact C-NH2 3.35Å; D424-R470 PolarHBondContact O-NH2 3.37Å
425	F	88	Confident	94.4	Very high	73 Å²	73	32.4 Å²	32.4	32%	0.32	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-4.5	175.8	60.7	-97.1	0	0	0	114.7	F421 R423 M503	F421-F425 AromaticContact CE2-CE1 3.64Å; F421-F425 HydrophobicContact CE2-CE1 3.64Å; F421-F425 HydrophobicContact CE2-CZ 4.02Å; F421-F425 HydrophobicContact CZ-CE1 4.29Å; F421-F425 HydrophobicContact CZ-CZ 4.27Å; R423-F425 HydrophobicContact CG-CD1 4.36Å; R423-F425 HydrophobicContact CG-CD2 4.22Å; R423-F425 HydrophobicContact CG-CE1 3.98Å; R423-F425 HydrophobicContact CG-CE2 3.8Å; R423-F425 HydrophobicContact CG-CG 4.48Å; R423-F425 HydrophobicContact CG-CZ 3.67Å; R423-F425 PolarHBondContact O-N 3.02Å; F425-M503 HydrophobicContact CD1-CE 3.96Å; F425-M503 HydrophobicContact CE1-CE 3.25Å; F425-M503 HydrophobicContact CE1-SD 3.96Å; F425-M503 HydrophobicContact CE2-CE 3.99Å; F425-M503 HydrophobicContact CZ-CE 3.28Å; F425-M503 HydrophobicContact CZ-SD 4.45Å
426	G	88.7	Confident	94.6	Very high	13 Å²	13	31.4 Å²	31.4	13%	0.134	15%	0.152	C	C	.	.			trans	-99.7	143.5	179.3	0	0	0	0	0	112.9	R423 R470	R423-G426 PolarHBondContact O-N 3.47Å; G426-R470 PolarHBondContact O-NH1 3.46Å; G426-R470 PolarHBondContact O-NH2 3.38Å
427	F	94.4	Very high	94.9	Very high	17 Å²	17	25.6 Å²	25.6	8%	0.075	13%	0.127	C	C	.	.			trans	-126.7	9.9	179.1	-54.1	-81.5	0	0	0	112.9	E139 Y387 M429 D454 V455 Y458	E139-F427 HydrophobicContact CB-CZ 3.96Å; E139-F427 HydrophobicContact CG-CZ 4.33Å; Y387-F427 HydrophobicContact CD1-CB 4.25Å; Y387-F427 HydrophobicContact CD1-CD1 4.43Å; Y387-F427 HydrophobicContact CE1-CB 4.14Å; Y387-F427 WeakPolarHBondContact CE1-O 3.32Å; F427-M429 VanDerWaalsContact C-N 3.35Å; F427-M429 PolarHBondContact O-N 3.13Å; F427-D454 HydrophobicContact CB-CB 4.05Å; F427-D454 PolarHBondContact N-OD2 3.03Å; F427-V455 HydrophobicContact CD2-CG2 3.89Å; F427-V455 HydrophobicContact CE2-CG2 4.23Å; F427-Y458 HydrophobicContact CB-CG 4.32Å; F427-Y458 AromaticContact CD1-CD1 3.42Å; F427-Y458 HydrophobicContact CD1-CD1 3.42Å; F427-Y458 VanDerWaalsContact CD1-CD1 3.42Å; F427-Y458 AromaticContact CD1-CD2 3.73Å; F427-Y458 HydrophobicContact CD1-CD2 3.73Å; F427-Y458 AromaticContact CD1-CE1 3.6Å; F427-Y458 HydrophobicContact CD1-CE1 3.6Å; F427-Y458 AromaticContact CD1-CE2 3.89Å; F427-Y458 HydrophobicContact CD1-CE2 3.89Å; F427-Y458 AromaticContact CD1-CG 3.47Å; F427-Y458 HydrophobicContact CD1-CG 3.47Å; F427-Y458 VanDerWaalsContact CD1-CG 3.47Å; F427-Y458 AromaticContact CD1-CZ 3.82Å; F427-Y458 HydrophobicContact CD2-CD1 4.43Å; F427-Y458 AromaticContact CE1-CD1 3.37Å; F427-Y458 HydrophobicContact CE1-CD1 3.37Å; F427-Y458 HydrophobicContact CE1-CD2 4.28Å; F427-Y458 AromaticContact CE1-CE1 3.14Å; F427-Y458 HydrophobicContact CE1-CE1 3.14Å; F427-Y458 HydrophobicContact CE1-CE2 4.11Å; F427-Y458 AromaticContact CE1-CG 3.94Å; F427-Y458 HydrophobicContact CE1-CG 3.94Å; F427-Y458 AromaticContact CE1-CZ 3.55Å; F427-Y458 HydrophobicContact CE2-CD1 4.39Å; F427-Y458 AromaticContact CG-CD1 3.98Å; F427-Y458 HydrophobicContact CG-CD1 3.98Å; F427-Y458 HydrophobicContact CG-CD2 4.45Å; F427-Y458 AromaticContact CG-CG 3.91Å; F427-Y458 HydrophobicContact CG-CG 3.91Å; F427-Y458 AromaticContact CZ-CD1 3.89Å; F427-Y458 HydrophobicContact CZ-CD1 3.89Å; F427-Y458 AromaticContact CZ-CE1 3.8Å; F427-Y458 HydrophobicContact CZ-CE1 3.8Å
428	G	92.8	Very high	95.2	Very high	7 Å²	7	23.5 Å²	23.5	7%	0.072	12%	0.121	C	C	.	.			trans	-65.8	-31.9	-174.7	0	0	0	0	0	114.8	R340 D454	R340-G428 VanDerWaalsContact NH2-CA 3.29Å; R340-G428 PolarHBondContact NH2-O 3.36Å; G428-D454 PolarHBondContact N-OD2 3.12Å; G428-D454 VanDerWaalsContact N-OD2 3.15Å
429	M	97.2	Very high	95.5	Very high	11 Å²	11	26 Å²	26	5%	0.054	13%	0.134	C	C	.	.			trans	-94.7	121.1	179.9	-74	63.3	69.8	0	0	108.9	F359 F360 I365 P388 V390 F427	F359-M429 HydrophobicContact CE2-CB 4.12Å; F359-M429 HydrophobicContact CE2-CG 4.32Å; F359-M429 HydrophobicContact CZ-CG 4.41Å; F360-M429 WeakPolarHBondContact O-CA 3.49Å; I365-M429 HydrophobicContact CD1-CE 4.08Å; I365-M429 HydrophobicContact CD1-CG 3.99Å; I365-M429 HydrophobicContact CD1-SD 3.9Å; I365-M429 HydrophobicContact CG1-CG 4.09Å; I365-M429 HydrophobicContact CG1-SD 4.23Å; P388-M429 WeakPolarHBondContact CD-O 3.49Å; P388-M429 HydrophobicContact CG-CB 4.25Å; V390-M429 HydrophobicContact CB-CE 4.3Å; V390-M429 HydrophobicContact CG1-CB 4.29Å; V390-M429 HydrophobicContact CG1-CE 3.51Å; V390-M429 HydrophobicContact CG1-CG 4.11Å; V390-M429 HydrophobicContact CG2-CE 3.73Å; F427-M429 VanDerWaalsContact C-N 3.35Å; F427-M429 PolarHBondContact O-N 3.13Å
430	T	98.3	Very high	95.5	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.006	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	142.6	-179	177.4	0	0	0	0	111.3	F359 F360 F386 Y387 Q432	F359-T430 WeakPolarHBondContact CA-O 3.37Å; F359-T430 WeakPolarHBondContact CD2-O 3.34Å; F360-T430 HydrophobicContact CB-CG2 3.89Å; F360-T430 HydrophobicContact CD2-CG2 3.62Å; F360-T430 HydrophobicContact CE2-CG2 4.45Å; F360-T430 HydrophobicContact CG-CG2 3.95Å; F360-T430 PolarHBondContact N-O 2.95Å; F386-T430 CarbonylContact O-C 3.58Å; F386-T430 WeakPolarHBondContact O-CA 3.33Å; F386-T430 PolarHBondContact O-OG1 3.44Å; Y387-T430 HydrophobicContact CE1-CG2 4.32Å; T430-Q432 HydrophobicContact CG2-CG 4.47Å; T430-Q432 PolarHBondContact OG1-OE1 3.35Å
431	C	98.7	Very high	95.6	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	113.2	171	-74.4	0	0	0	0	108.6	L357 M358 C375 A379 F386	L357-C431 HydrophobicContact CD1-CB 4.33Å; M358-C431 VanDerWaalsContact O-CA 3.31Å; M358-C431 WeakPolarHBondContact O-CA 3.39Å; C375-C431 HydrophobicContact CB-CB 4.07Å; C375-C431 WeakPolarHBondContact CB-SG 3.45Å; C375-C431 WeakPolarHBondContact SG-CB 3.19Å; C375-C431 CovalentContact SG-SG 2.03Å; C375-C431 PolarHBondContact SG-SG 2.9Å; A379-C431 HydrophobicContact CB-CB 4.38Å; F386-C431 HydrophobicContact CB-CB 4.02Å; F386-C431 HydrophobicContact CD1-CB 3.95Å; F386-C431 HydrophobicContact CG-CB 4.47Å; F386-C431 PolarHBondContact N-O 2.9Å; F386-C431 PolarHBondContact O-N 3.47Å
432	Q	98.4	Very high	95.6	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	145.4	-172	67.1	-164.2	-2.6	0	0	112.1	M358 V385 T430 F437 Y461	M358-Q432 WeakPolarHBondContact CB-O 3.42Å; M358-Q432 HydrophobicContact CE-CG 4.11Å; M358-Q432 PolarHBondContact N-O 3.41Å; M358-Q432 PolarHBondContact O-N 2.9Å; V385-Q432 HydrophobicContact CG2-CB 3.67Å; T430-Q432 HydrophobicContact CG2-CG 4.47Å; T430-Q432 PolarHBondContact OG1-OE1 3.35Å; Q432-F437 HydrophobicContact CG-CB 4.49Å; Q432-Y461 VanDerWaalsContact OE1-CZ 3.25Å; Q432-Y461 PolarHBondContact OE1-OH 2.76Å
433	Y	98.5	Very high	95.6	Very high	29 Å²	29	28.9 Å²	28.9	11%	0.114	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	144.1	174.5	-83.5	-93.7	0	0	0	111.1	M265 V356 L357 A379 P381 S435 D436 F437	M265-Y433 WeakPolarHBondContact CE-OH 3.37Å; V356-Y433 WeakPolarHBondContact O-CA 3.35Å; L357-Y433 HydrophobicContact CB-CE1 4.28Å; L357-Y433 HydrophobicContact CB-CE2 4.31Å; L357-Y433 HydrophobicContact CD1-CD2 4.13Å; L357-Y433 HydrophobicContact CD1-CE2 4.07Å; A379-Y433 HydrophobicContact CB-CD2 4.49Å; A379-Y433 HydrophobicContact CB-CE2 4.38Å; P381-Y433 HydrophobicContact CB-CD1 3.98Å; P381-Y433 HydrophobicContact CB-CD2 4.1Å; P381-Y433 HydrophobicContact CB-CE1 4.43Å; P381-Y433 HydrophobicContact CB-CG 3.78Å; P381-Y433 VanDerWaalsContact CD-CE2 3.47Å; P381-Y433 HydrophobicContact CG-CD1 4.36Å; P381-Y433 HydrophobicContact CG-CD2 4.44Å; P381-Y433 HydrophobicContact CG-CE1 4.32Å; P381-Y433 HydrophobicContact CG-CE2 4.42Å; P381-Y433 HydrophobicContact CG-CG 4.41Å; Y433-S435 VanDerWaalsContact C-N 3.28Å; Y433-S435 PolarHBondContact O-N 2.89Å; Y433-D436 PolarHBondContact O-N 2.85Å; Y433-F437 PolarHBondContact O-N 3.47Å
434	R	98.3	Very high	95.4	Very high	45 Å²	45	31 Å²	31	17%	0.17	17%	0.174	C	C	.	.	H	α-helix	trans	-59.2	-40.9	178.7	-176.6	-177.9	174.5	-77.1	-6.7	111.5	A348 W351 D355 V356 M358 F437 L438	A348-R434 PolarHBondContact O-NE 3.04Å; W351-R434 PolarHBondContact O-NE 3.4Å; D355-R434 WeakPolarHBondContact OD1-CB 3.48Å; D355-R434 PolarHBondContact OD1-N 3.41Å; D355-R434 VanDerWaalsContact OD1-N 3.15Å; V356-R434 HydrophobicContact CG1-CB 4.12Å; V356-R434 PolarHBondContact O-N 3.45Å; M358-R434 HydrophobicContact CE-CB 4.09Å; M358-R434 HydrophobicContact CE-CG 4.44Å; M358-R434 HydrophobicContact CG-CB 4.3Å; M358-R434 HydrophobicContact SD-CB 3.83Å; M358-R434 HydrophobicContact SD-CG 4.03Å; R434-F437 PolarHBondContact O-N 3.45Å; R434-L438 HydrophobicContact CG-CD1 4.25Å; R434-L438 VanDerWaalsContact NH1-CD1 3.35Å; R434-L438 VanDerWaalsContact O-CG 3.31Å; R434-L438 WeakPolarHBondContact O-CG 3.28Å; R434-L438 PolarHBondContact O-N 2.04Å
435	S	97.8	Very high	95.2	Very high	27 Å²	27	31 Å²	31	19%	0.189	17%	0.174	C	C	.	.	H	α-helix	trans	-55.3	-51	174.5	55.9	0	0	0	0	111.9	D355 Y433 F437 L438 N439	D355-S435 VanDerWaalsContact CG-OG 3.27Å; D355-S435 PolarHBondContact OD1-N 2.98Å; D355-S435 PolarHBondContact OD1-OG 2.89Å; D355-S435 VanDerWaalsContact OD2-CB 3.24Å; D355-S435 WeakPolarHBondContact OD2-CB 3.39Å; D355-S435 PolarHBondContact OD2-OG 3.08Å; Y433-S435 VanDerWaalsContact C-N 3.28Å; Y433-S435 PolarHBondContact O-N 2.89Å; S435-F437 PolarHBondContact O-N 3.49Å; S435-L438 PolarHBondContact O-N 3.02Å; S435-N439 WeakPolarHBondContact O-CB 3.44Å; S435-N439 PolarHBondContact O-N 3.39Å; S435-N439 PolarHBondContact O-ND2 3.39Å
436	D	98	Very high	95	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-60.8	-45.7	179.2	-66.4	-26	0	0	0	112	P381 N382 Y433 L438 N439 I440 Y461 L466	P381-D436 WeakPolarHBondContact CA-OD2 3.32Å; N382-D436 VanDerWaalsContact CA-OD1 3.26Å; N382-D436 WeakPolarHBondContact CA-OD1 3.33Å; N382-D436 PolarHBondContact N-OD1 2.86Å; N382-D436 PolarHBondContact N-OD2 3.17Å; N382-D436 VanDerWaalsContact N-OD2 3.16Å; Y433-D436 PolarHBondContact O-N 2.85Å; D436-L438 VanDerWaalsContact C-N 3.31Å; D436-L438 PolarHBondContact O-N 2.77Å; D436-N439 PolarHBondContact O-N 2.84Å; D436-I440 VanDerWaalsContact O-CG1 3.31Å; D436-I440 WeakPolarHBondContact O-CG1 3.43Å; D436-I440 PolarHBondContact O-N 2.83Å; D436-Y461 HydrophobicContact CB-CE1 4.33Å; D436-L466 HydrophobicContact CB-CD1 3.96Å
437	F	98.1	Very high	94.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-58.4	-41.6	177.1	173.5	-100.1	0	0	0	112.6	A348 M358 F360 Q432 Y433 R434 S435 I440 G442 F443 L457 Y461	A348-F437 HydrophobicContact CB-CD1 3.97Å; A348-F437 HydrophobicContact CB-CE1 3.73Å; A348-F437 HydrophobicContact CB-CZ 4.48Å; M358-F437 HydrophobicContact CE-CB 3.69Å; M358-F437 HydrophobicContact CE-CD1 4.12Å; M358-F437 HydrophobicContact CE-CG 3.92Å; F360-F437 HydrophobicContact CE2-CD2 4.13Å; F360-F437 AromaticContact CE2-CE2 3.84Å; F360-F437 HydrophobicContact CE2-CE2 3.84Å; F360-F437 HydrophobicContact CE2-CZ 4.49Å; F360-F437 AromaticContact CZ-CD2 4Å; F360-F437 HydrophobicContact CZ-CD2 4Å; F360-F437 AromaticContact CZ-CE2 3.82Å; F360-F437 HydrophobicContact CZ-CE2 3.82Å; F360-F437 HydrophobicContact CZ-CG 4.46Å; F360-F437 HydrophobicContact CZ-CZ 4.15Å; Q432-F437 HydrophobicContact CG-CB 4.49Å; Y433-F437 PolarHBondContact O-N 3.47Å; R434-F437 PolarHBondContact O-N 3.45Å; S435-F437 PolarHBondContact O-N 3.49Å; F437-I440 WeakPolarHBondContact O-CG1 3.39Å; F437-G442 VanDerWaalsContact CZ-CA 3.49Å; F437-G442 WeakPolarHBondContact O-CA 3.38Å; F437-G442 PolarHBondContact O-N 2.89Å; F437-F443 AromaticContact CE2-CD2 3.79Å; F437-F443 HydrophobicContact CE2-CD2 3.79Å; F437-F443 AromaticContact CE2-CE2 3.81Å; F437-F443 HydrophobicContact CE2-CE2 3.81Å; F437-F443 AromaticContact CZ-CD2 3.65Å; F437-F443 HydrophobicContact CZ-CD2 3.65Å; F437-F443 AromaticContact CZ-CE2 3.96Å; F437-F443 HydrophobicContact CZ-CE2 3.96Å; F437-L457 HydrophobicContact CD2-CD1 4Å; F437-L457 HydrophobicContact CD2-CD2 4.34Å; F437-L457 HydrophobicContact CE2-CD1 3.82Å; F437-L457 HydrophobicContact CE2-CD2 4.11Å; F437-Y461 WeakPolarHBondContact CA-OH 3.44Å; F437-Y461 PolarHBondContact N-OH 3Å
438	L	96.8	Very high	92.8	Very high	64 Å²	64	44.4 Å²	44.4	34%	0.335	23%	0.233	S	C	.	.	H	α-helix	trans	-71.6	-40	176.7	-65.9	177.5	0	0	0	112	R434 S435 D436 I440 G441	R434-L438 HydrophobicContact CG-CD1 4.25Å; R434-L438 VanDerWaalsContact NH1-CD1 3.35Å; R434-L438 VanDerWaalsContact O-CG 3.31Å; R434-L438 WeakPolarHBondContact O-CG 3.28Å; R434-L438 PolarHBondContact O-N 2.04Å; S435-L438 PolarHBondContact O-N 3.02Å; D436-L438 VanDerWaalsContact C-N 3.31Å; D436-L438 PolarHBondContact O-N 2.77Å; L438-I440 VanDerWaalsContact C-N 3.34Å; L438-I440 PolarHBondContact O-N 3.07Å; L438-G441 PolarHBondContact O-N 3.45Å
439	N	96.9	Very high	91.4	Very high	117 Å²	117	46.7 Å²	46.7	63%	0.626	26%	0.257	S	S	*	.	H	α-helix	trans	-64.1	-36.5	-178.3	-73.3	-18	0	0	0	112.7	S435 D436 G441	S435-N439 WeakPolarHBondContact O-CB 3.44Å; S435-N439 PolarHBondContact O-N 3.39Å; S435-N439 PolarHBondContact O-ND2 3.39Å; D436-N439 PolarHBondContact O-N 2.84Å; N439-G441 PolarHBondContact O-N 2.9Å
440	I	95.9	Very high	90.1	Very high	33 Å²	33	51 Å²	51	17%	0.169	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	0.5	174.9	65.3	133.5	0	0	0	113.3	D436 F437 L438 L457 K460 Y461	D436-I440 VanDerWaalsContact O-CG1 3.31Å; D436-I440 WeakPolarHBondContact O-CG1 3.43Å; D436-I440 PolarHBondContact O-N 2.83Å; F437-I440 WeakPolarHBondContact O-CG1 3.39Å; L438-I440 VanDerWaalsContact C-N 3.34Å; L438-I440 PolarHBondContact O-N 3.07Å; I440-L457 HydrophobicContact CD1-CD1 3.51Å; I440-L457 HydrophobicContact CD1-CG 4.45Å; I440-K460 HydrophobicContact CB-CB 4.48Å; I440-K460 HydrophobicContact CD1-CB 3.75Å; I440-K460 HydrophobicContact CD1-CD 4.33Å; I440-Y461 HydrophobicContact CD1-CD1 4.26Å; I440-Y461 HydrophobicContact CD1-CD2 3.69Å; I440-Y461 HydrophobicContact CD1-CE1 4Å; I440-Y461 HydrophobicContact CD1-CE2 3.39Å; I440-Y461 HydrophobicContact CD1-CG 4.11Å; I440-Y461 HydrophobicContact CG1-CE1 4.06Å; I440-Y461 HydrophobicContact CG1-CE2 4.22Å; I440-Y461 HydrophobicContact CG2-CD1 4.16Å; I440-Y461 HydrophobicContact CG2-CE1 4.05Å
441	G	95.7	Very high	88.8	Confident	49 Å²	49	51.2 Å²	51.2	51%	0.505	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.4	25	177	0	0	0	0	0	114.9	L438 N439 K460	L438-G441 PolarHBondContact O-N 3.45Å; N439-G441 PolarHBondContact O-N 2.9Å; G441-K460 PolarHBondContact O-NZ 2.95Å; G441-K460 VanDerWaalsContact O-NZ 3.12Å
442	G	95.6	Very high	88.1	Confident	5 Å²	5	52.7 Å²	52.7	5%	0.052	29%	0.285	C	S	.	.			trans	55.1	-153	168.9	0	0	0	0	0	116.1	F437 L457 K460	F437-G442 VanDerWaalsContact CZ-CA 3.49Å; F437-G442 WeakPolarHBondContact O-CA 3.38Å; F437-G442 PolarHBondContact O-N 2.89Å; G442-L457 WeakPolarHBondContact O-CD1 3.37Å; G442-K460 PolarHBondContact O-NZ 2.81Å
443	F	95.2	Very high	87.8	Confident	14 Å²	14	53.7 Å²	53.7	6%	0.061	29%	0.289	C	S	.	.			trans	-73.8	151.2	174.7	-73.4	-74	0	0	0	112.1	G341 L344 D345 F360 F437 L445 E453 L457	G341-F443 WeakPolarHBondContact O-CD2 3.13Å; L344-F443 HydrophobicContact CB-CD2 4.36Å; L344-F443 HydrophobicContact CB-CE2 3.45Å; L344-F443 VanDerWaalsContact CB-CE2 3.45Å; L344-F443 HydrophobicContact CB-CZ 3.95Å; L344-F443 HydrophobicContact CD1-CE2 4.14Å; L344-F443 HydrophobicContact CD1-CZ 3.71Å; L344-F443 HydrophobicContact CG-CE2 4.45Å; L344-F443 HydrophobicContact CG-CZ 4.49Å; D345-F443 HydrophobicContact CB-CD2 4.07Å; F360-F443 HydrophobicContact CD2-CE2 4.1Å; F360-F443 AromaticContact CD2-CZ 3.84Å; F360-F443 HydrophobicContact CD2-CZ 3.84Å; F360-F443 AromaticContact CE2-CE2 3.36Å; F360-F443 HydrophobicContact CE2-CE2 3.36Å; F360-F443 AromaticContact CE2-CZ 3.5Å; F360-F443 HydrophobicContact CE2-CZ 3.5Å; F360-F443 VanDerWaalsContact CE2-CZ 3.5Å; F360-F443 AromaticContact CZ-CE2 4Å; F360-F443 HydrophobicContact CZ-CE2 4Å; F437-F443 AromaticContact CE2-CD2 3.79Å; F437-F443 HydrophobicContact CE2-CD2 3.79Å; F437-F443 AromaticContact CE2-CE2 3.81Å; F437-F443 HydrophobicContact CE2-CE2 3.81Å; F437-F443 AromaticContact CZ-CD2 3.65Å; F437-F443 HydrophobicContact CZ-CD2 3.65Å; F437-F443 AromaticContact CZ-CE2 3.96Å; F437-F443 HydrophobicContact CZ-CE2 3.96Å; F443-L445 HydrophobicContact CB-CD2 3.99Å; F443-L445 PolarHBondContact O-N 2.81Å; F443-E453 HydrophobicContact CD1-CB 4.23Å; F443-E453 HydrophobicContact CD1-CG 4.27Å; F443-E453 HydrophobicContact CE1-CG 4.12Å; F443-L457 HydrophobicContact CD1-CB 4.17Å; F443-L457 HydrophobicContact CD1-CD2 4.31Å; F443-L457 HydrophobicContact CE1-CB 4.01Å; F443-L457 HydrophobicContact CE1-CD2 3.66Å; F443-L457 HydrophobicContact CE1-CG 4.35Å; F443-L457 HydrophobicContact CE2-CD2 4.32Å; F443-L457 HydrophobicContact CZ-CD2 3.67Å
444	D	89.7	Confident	87.5	Confident	62 Å²	62	53.3 Å²	53.3	33%	0.332	29%	0.289	S	S	.	.			trans	-83.3	104.5	162.8	-176.4	-4.9	0	0	0	108.8	E446 V447	D444-E446 VanDerWaalsContact C-N 3.27Å; D444-E446 PolarHBondContact O-N 3.47Å; D444-E446 WeakPolarHBondContact OD1-CB 3.4Å; D444-E446 PolarHBondContact OD1-N 3.43Å; D444-E446 VanDerWaalsContact OD1-N 3.08Å; D444-V447 HydrophobicContact CB-CG2 4.06Å
445	L	86.8	Confident	87.2	Confident	83 Å²	83	52 Å²	52	44%	0.435	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-5.5	-175.9	-57.9	-178.5	0	0	0	113.2	D345 F443 V447	D345-L445 HydrophobicContact CB-CD2 4.1Å; F443-L445 HydrophobicContact CB-CD2 3.99Å; F443-L445 PolarHBondContact O-N 2.81Å; L445-V447 VanDerWaalsContact C-N 3.27Å
446	E	82.5	Confident	87	Confident	171 Å²	171	53.6 Å²	53.6	80%	0.799	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-16.1	174.4	-59.7	-169.1	167.7	0	0	112	D444 K448	D444-E446 VanDerWaalsContact C-N 3.27Å; D444-E446 PolarHBondContact O-N 3.47Å; D444-E446 WeakPolarHBondContact OD1-CB 3.4Å; D444-E446 PolarHBondContact OD1-N 3.43Å; D444-E446 VanDerWaalsContact OD1-N 3.08Å; E446-K448 PolarHBondContact O-N 2.87Å; E446-K448 VanDerWaalsContact O-N 3.1Å
447	V	71.3	Confident	86.9	Confident	29 Å²	29	53.7 Å²	53.7	18%	0.176	29%	0.291	C	S	.	.			trans	-62.8	111.1	174.1	175.9	0	0	0	0	109.6	D444 L445 V452	D444-V447 HydrophobicContact CB-CG2 4.06Å; L445-V447 VanDerWaalsContact C-N 3.27Å; V447-V452 HydrophobicContact CB-CG2 4.48Å; V447-V452 HydrophobicContact CG1-CG2 3.28Å; V447-V452 HydrophobicContact CG2-CG2 4.37Å
448	K	66.7	Low	86.8	Confident	184 Å²	184	53.8 Å²	53.8	80%	0.8	29%	0.291	S	S	*	.			trans	-97	140	171.4	-61.8	-173.6	-178.7	-175.6	0	110.4	E446 Q493	E446-K448 PolarHBondContact O-N 2.87Å; E446-K448 VanDerWaalsContact O-N 3.1Å; K448-Q493 PolarHBondContact O-NE2 3.01Å
449	G	62.7	Low	86.7	Confident	55 Å²	55	54.2 Å²	54.2	57%	0.567	29%	0.288	S	S	*	.	S	Bend	trans	92.2	-164.9	178.9	0	0	0	0	0	114.1
450	W	70.3	Confident	86.7	Confident	101 Å²	101	51.4 Å²	51.4	38%	0.383	27%	0.271	S	S	.	.	S	Bend	trans	-101.2	143	-170.1	-176.7	85.5	0	0	0	113.2	K483 L489 M496 C497	W450-K483 VanDerWaalsContact CH2-NZ 3.35Å; W450-K483 HydrophobicContact CZ2-CD 4.45Å; W450-L489 HydrophobicContact CB-CD2 4.31Å; W450-M496 HydrophobicContact CZ3-CB 4.4Å; W450-C497 HydrophobicContact CE3-CB 3.91Å; W450-C497 HydrophobicContact CZ3-CB 3.94Å
451	G	70.9	Confident	86.8	Confident	7 Å²	7	49.9 Å²	49.9	7%	0.072	26%	0.263	C	S	.	.	S	Bend	trans	92.7	20.6	149.6	0	0	0	0	0	117.6	E453 M496	G451-E453 PolarHBondContact N-OE2 3.44Å; G451-M496 WeakPolarHBondContact O-CE 3.17Å
452	V	85.1	Confident	86.8	Confident	31 Å²	31	47.6 Å²	47.6	19%	0.188	24%	0.239	C	C	.	.	S	Bend	trans	-134.5	-10.1	175.8	-57.2	0	0	0	0	113.8	V447 D454 V455 H456 M496	V447-V452 HydrophobicContact CB-CG2 4.48Å; V447-V452 HydrophobicContact CG1-CG2 3.28Å; V447-V452 HydrophobicContact CG2-CG2 4.37Å; V452-D454 VanDerWaalsContact C-N 3.33Å; V452-D454 PolarHBondContact O-N 3.36Å; V452-V455 PolarHBondContact O-N 3.14Å; V452-H456 WeakPolarHBondContact O-CB 3.24Å; V452-H456 PolarHBondContact O-CD2 2.88Å; V452-H456 VanDerWaalsContact O-CG 3.26Å; V452-H456 PolarHBondContact O-N 3.09Å; V452-M496 HydrophobicContact CG1-SD 4.48Å
453	E	90.3	Very high	86.8	Confident	20 Å²	20	54.2 Å²	54.2	9%	0.093	26%	0.262	C	S	.	.	H	α-helix	trans	-67.4	-36.8	-176.5	80.6	-68.1	171.6	0	0	112.2	R340 F443 G451 L457	R340-E453 WeakPolarHBondContact CD-OE1 3.34Å; R340-E453 IonicContact CZ-OE1 3.89Å; R340-E453 IonicContact NH1-OE1 2.81Å; R340-E453 PolarHBondContact NH1-OE1 2.92Å; F443-E453 HydrophobicContact CD1-CB 4.23Å; F443-E453 HydrophobicContact CD1-CG 4.27Å; F443-E453 HydrophobicContact CE1-CG 4.12Å; G451-E453 PolarHBondContact N-OE2 3.44Å; E453-L457 PolarHBondContact O-N 3.32Å
454	D	92.3	Very high	86.7	Confident	21 Å²	21	54.6 Å²	54.6	11%	0.112	27%	0.267	C	S	.	.	H	α-helix	trans	-71.7	-41.8	178.4	66.4	-25.8	0	0	0	111.4	F427 G428 V452 H456 L457 Y458	F427-D454 HydrophobicContact CB-CB 4.05Å; F427-D454 PolarHBondContact N-OD2 3.03Å; G428-D454 PolarHBondContact N-OD2 3.12Å; G428-D454 VanDerWaalsContact N-OD2 3.15Å; V452-D454 VanDerWaalsContact C-N 3.33Å; V452-D454 PolarHBondContact O-N 3.36Å; D454-H456 VanDerWaalsContact C-N 3.34Å; D454-H456 PolarHBondContact O-N 3.01Å; D454-L457 PolarHBondContact O-N 3.34Å; D454-Y458 VanDerWaalsContact O-CB 3.25Å; D454-Y458 WeakPolarHBondContact O-CB 3.38Å; D454-Y458 PolarHBondContact O-N 3.35Å
455	V	92.4	Very high	86.8	Confident	17 Å²	17	58.1 Å²	58.1	10%	0.103	28%	0.281	C	S	.	.	H	α-helix	trans	-60.5	-44	173.1	179.6	0	0	0	0	110.8	F427 V452 Y458 R459	F427-V455 HydrophobicContact CD2-CG2 3.89Å; F427-V455 HydrophobicContact CE2-CG2 4.23Å; V452-V455 PolarHBondContact O-N 3.14Å; V455-Y458 PolarHBondContact O-N 2.82Å; V455-R459 HydrophobicContact CG1-CG 4.48Å; V455-R459 WeakPolarHBondContact O-CB 3.32Å; V455-R459 VanDerWaalsContact O-CG 3.29Å; V455-R459 WeakPolarHBondContact O-CG 3.38Å; V455-R459 PolarHBondContact O-N 2.84Å
456	H	93.3	Very high	87.2	Confident	61 Å²	61	55 Å²	55	28%	0.282	27%	0.265	S	S	.	.	H	α-helix	trans	-64.3	-46	178.4	-72.6	180	0	0	0	111.9	V452 D454 Y458 R459 K460	V452-H456 WeakPolarHBondContact O-CB 3.24Å; V452-H456 PolarHBondContact O-CD2 2.88Å; V452-H456 VanDerWaalsContact O-CG 3.26Å; V452-H456 PolarHBondContact O-N 3.09Å; D454-H456 VanDerWaalsContact C-N 3.34Å; D454-H456 PolarHBondContact O-N 3.01Å; H456-Y458 VanDerWaalsContact C-N 3.35Å; H456-R459 PolarHBondContact O-N 2.98Å; H456-K460 WeakPolarHBondContact O-CG 3.47Å; H456-K460 PolarHBondContact O-N 3.37Å; H456-K460 VanDerWaalsContact O-N 3.1Å
457	L	95.8	Very high	87.8	Confident	4 Å²	4	47.1 Å²	47.1	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-60	-46.9	175.7	-176.5	68.7	0	0	0	111.1	F360 F437 I440 G442 F443 E453 D454 R459 K460 Y461	F360-L457 HydrophobicContact CD2-CD2 4.48Å; F360-L457 HydrophobicContact CE2-CD2 4.08Å; F437-L457 HydrophobicContact CD2-CD1 4Å; F437-L457 HydrophobicContact CD2-CD2 4.34Å; F437-L457 HydrophobicContact CE2-CD1 3.82Å; F437-L457 HydrophobicContact CE2-CD2 4.11Å; I440-L457 HydrophobicContact CD1-CD1 3.51Å; I440-L457 HydrophobicContact CD1-CG 4.45Å; G442-L457 WeakPolarHBondContact O-CD1 3.37Å; F443-L457 HydrophobicContact CD1-CB 4.17Å; F443-L457 HydrophobicContact CD1-CD2 4.31Å; F443-L457 HydrophobicContact CE1-CB 4.01Å; F443-L457 HydrophobicContact CE1-CD2 3.66Å; F443-L457 HydrophobicContact CE1-CG 4.35Å; F443-L457 HydrophobicContact CE2-CD2 4.32Å; F443-L457 HydrophobicContact CZ-CD2 3.67Å; E453-L457 PolarHBondContact O-N 3.32Å; D454-L457 PolarHBondContact O-N 3.34Å; L457-R459 PolarHBondContact O-N 3.02Å; L457-K460 WeakPolarHBondContact O-CB 3.39Å; L457-K460 PolarHBondContact O-N 2.74Å; L457-K460 VanDerWaalsContact O-N 3.07Å; L457-Y461 HydrophobicContact CD1-CE2 4.14Å; L457-Y461 HydrophobicContact CD2-CE2 4.46Å; L457-Y461 HydrophobicContact CG-CD2 4.3Å; L457-Y461 HydrophobicContact CG-CE2 4.02Å; L457-Y461 WeakPolarHBondContact O-CD2 3.35Å; L457-Y461 PolarHBondContact O-N 2.91Å
458	Y	96.6	Very high	89	Confident	1 Å²	1	46.1 Å²	46.1	0%	0.004	22%	0.222	C	C	.	.	H	α-helix	trans	-58.9	-44.5	178.3	-177.4	-115.9	0	0	0	112.5	E139 L142 Y387 F427 D454 V455 H456 K460 Y461 L462 V468 R470	E139-Y458 HydrophobicContact CB-CD1 3.92Å; E139-Y458 HydrophobicContact CB-CE1 3.58Å; L142-Y458 WeakPolarHBondContact CD2-OH 3.44Å; Y387-Y458 AromaticContact CD1-CD2 3.68Å; Y387-Y458 HydrophobicContact CD1-CD2 3.68Å; Y387-Y458 HydrophobicContact CD1-CE2 4.07Å; Y387-Y458 AromaticContact CD2-CD2 3.77Å; Y387-Y458 HydrophobicContact CD2-CD2 3.77Å; Y387-Y458 AromaticContact CD2-CE2 3.83Å; Y387-Y458 HydrophobicContact CD2-CE2 3.83Å; Y387-Y458 AromaticContact CE1-CD2 3.59Å; Y387-Y458 HydrophobicContact CE1-CD2 3.59Å; Y387-Y458 HydrophobicContact CE1-CE2 4.4Å; Y387-Y458 HydrophobicContact CE1-CG 4.31Å; Y387-Y458 AromaticContact CE2-CD2 3.67Å; Y387-Y458 HydrophobicContact CE2-CD2 3.67Å; Y387-Y458 HydrophobicContact CE2-CE2 4.18Å; Y387-Y458 AromaticContact CG-CD2 3.76Å; Y387-Y458 HydrophobicContact CG-CD2 3.76Å; Y387-Y458 AromaticContact CG-CE2 3.76Å; Y387-Y458 HydrophobicContact CG-CE2 3.76Å; Y387-Y458 AromaticContact CZ-CD2 3.59Å; F427-Y458 HydrophobicContact CB-CG 4.32Å; F427-Y458 AromaticContact CD1-CD1 3.42Å; F427-Y458 HydrophobicContact CD1-CD1 3.42Å; F427-Y458 VanDerWaalsContact CD1-CD1 3.42Å; F427-Y458 AromaticContact CD1-CD2 3.73Å; F427-Y458 HydrophobicContact CD1-CD2 3.73Å; F427-Y458 AromaticContact CD1-CE1 3.6Å; F427-Y458 HydrophobicContact CD1-CE1 3.6Å; F427-Y458 AromaticContact CD1-CE2 3.89Å; F427-Y458 HydrophobicContact CD1-CE2 3.89Å; F427-Y458 AromaticContact CD1-CG 3.47Å; F427-Y458 HydrophobicContact CD1-CG 3.47Å; F427-Y458 VanDerWaalsContact CD1-CG 3.47Å; F427-Y458 AromaticContact CD1-CZ 3.82Å; F427-Y458 HydrophobicContact CD2-CD1 4.43Å; F427-Y458 AromaticContact CE1-CD1 3.37Å; F427-Y458 HydrophobicContact CE1-CD1 3.37Å; F427-Y458 HydrophobicContact CE1-CD2 4.28Å; F427-Y458 AromaticContact CE1-CE1 3.14Å; F427-Y458 HydrophobicContact CE1-CE1 3.14Å; F427-Y458 HydrophobicContact CE1-CE2 4.11Å; F427-Y458 AromaticContact CE1-CG 3.94Å; F427-Y458 HydrophobicContact CE1-CG 3.94Å; F427-Y458 AromaticContact CE1-CZ 3.55Å; F427-Y458 HydrophobicContact CE2-CD1 4.39Å; F427-Y458 AromaticContact CG-CD1 3.98Å; F427-Y458 HydrophobicContact CG-CD1 3.98Å; F427-Y458 HydrophobicContact CG-CD2 4.45Å; F427-Y458 AromaticContact CG-CG 3.91Å; F427-Y458 HydrophobicContact CG-CG 3.91Å; F427-Y458 AromaticContact CZ-CD1 3.89Å; F427-Y458 HydrophobicContact CZ-CD1 3.89Å; F427-Y458 AromaticContact CZ-CE1 3.8Å; F427-Y458 HydrophobicContact CZ-CE1 3.8Å; D454-Y458 VanDerWaalsContact O-CB 3.25Å; D454-Y458 WeakPolarHBondContact O-CB 3.38Å; D454-Y458 PolarHBondContact O-N 3.35Å; V455-Y458 PolarHBondContact O-N 2.82Å; H456-Y458 VanDerWaalsContact C-N 3.35Å; Y458-K460 VanDerWaalsContact C-N 3.28Å; Y458-K460 PolarHBondContact O-N 3.24Å; Y458-Y461 WeakPolarHBondContact O-CB 3.48Å; Y458-Y461 PolarHBondContact O-N 2.94Å; Y458-Y461 VanDerWaalsContact O-N 3.13Å; Y458-L462 HydrophobicContact CD1-CD1 3.78Å; Y458-L462 HydrophobicContact CD1-CG 4.33Å; Y458-L462 HydrophobicContact CE1-CD1 3.52Å; Y458-L462 HydrophobicContact CE1-CD2 4.34Å; Y458-L462 HydrophobicContact CE1-CG 4.08Å; Y458-L462 WeakPolarHBondContact O-CG 3.47Å; Y458-L462 PolarHBondContact O-N 3.42Å; Y458-V468 HydrophobicContact CD2-CG1 4.46Å; Y458-V468 HydrophobicContact CE2-CG1 3.51Å; Y458-R470 WeakPolarHBondContact OH-CD 3.43Å
459	R	95.6	Very high	90.5	Very high	73 Å²	73	37.5 Å²	37.5	28%	0.275	19%	0.185	S	C	.	.	H	α-helix	trans	-62.7	-30.5	175	-74.7	173	176.7	166.8	1.8	113.2	E139 V455 H456 L457 R463	E139-R459 IonicContact OE1-CZ 3.29Å; E139-R459 IonicContact OE1-NE 2.81Å; E139-R459 IonicContact OE1-NH2 3.51Å; E139-R459 PolarHBondContact OE1-NH2 3.33Å; E139-R459 IonicContact OE2-CZ 3.83Å; E139-R459 IonicContact OE2-NE 2.81Å; E139-R459 PolarHBondContact OE2-NE 3.18Å; E139-R459 IonicContact OE2-NH2 3.85Å; E139-R459 PolarHBondContact OE2-NH2 2.87Å; V455-R459 HydrophobicContact CG1-CG 4.48Å; V455-R459 WeakPolarHBondContact O-CB 3.32Å; V455-R459 VanDerWaalsContact O-CG 3.29Å; V455-R459 WeakPolarHBondContact O-CG 3.38Å; V455-R459 PolarHBondContact O-N 2.84Å; H456-R459 PolarHBondContact O-N 2.98Å; L457-R459 PolarHBondContact O-N 3.02Å; R459-R463 WeakPolarHBondContact O-CD 3.41Å; R459-R463 VanDerWaalsContact O-CG 3.29Å; R459-R463 WeakPolarHBondContact O-CG 3.36Å; R459-R463 PolarHBondContact O-N 2.95Å
460	K	96.2	Very high	92.1	Very high	59 Å²	59	35.5 Å²	35.5	26%	0.257	16%	0.16	S	C	.	.	H	α-helix	trans	-64.9	-44.1	172.7	-69.8	175.5	177.5	-173.6	0	110.6	I440 G441 G442 H456 L457 Y458 R463 S464	I440-K460 HydrophobicContact CB-CB 4.48Å; I440-K460 HydrophobicContact CD1-CB 3.75Å; I440-K460 HydrophobicContact CD1-CD 4.33Å; G441-K460 PolarHBondContact O-NZ 2.95Å; G441-K460 VanDerWaalsContact O-NZ 3.12Å; G442-K460 PolarHBondContact O-NZ 2.81Å; H456-K460 WeakPolarHBondContact O-CG 3.47Å; H456-K460 PolarHBondContact O-N 3.37Å; H456-K460 VanDerWaalsContact O-N 3.1Å; L457-K460 WeakPolarHBondContact O-CB 3.39Å; L457-K460 PolarHBondContact O-N 2.74Å; L457-K460 VanDerWaalsContact O-N 3.07Å; Y458-K460 VanDerWaalsContact C-N 3.28Å; Y458-K460 PolarHBondContact O-N 3.24Å; K460-R463 PolarHBondContact O-N 2.79Å; K460-S464 PolarHBondContact O-N 2.83Å
461	Y	97	Very high	93.4	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-62.5	-44.8	174.9	-79.6	-69.3	0	0	0	112.9	V385 Y387 Q432 D436 F437 I440 L457 Y458 R463 S464 L466	V385-Y461 HydrophobicContact CB-CD1 4.09Å; V385-Y461 HydrophobicContact CB-CE1 4.12Å; V385-Y461 HydrophobicContact CG1-CD1 3.7Å; V385-Y461 HydrophobicContact CG1-CE1 4.25Å; V385-Y461 HydrophobicContact CG1-CG 3.93Å; V385-Y461 HydrophobicContact CG2-CD1 4.3Å; V385-Y461 HydrophobicContact CG2-CD2 4.5Å; V385-Y461 HydrophobicContact CG2-CE1 4.11Å; V385-Y461 HydrophobicContact CG2-CE2 4.3Å; V385-Y461 HydrophobicContact CG2-CG 4.49Å; Y387-Y461 AromaticContact CE2-CD2 3.95Å; Y387-Y461 HydrophobicContact CE2-CD2 3.95Å; Y387-Y461 HydrophobicContact CE2-CE2 4.47Å; Y387-Y461 HydrophobicContact CE2-CG 4.41Å; Y387-Y461 WeakPolarHBondContact OH-CD2 3.43Å; Q432-Y461 VanDerWaalsContact OE1-CZ 3.25Å; Q432-Y461 PolarHBondContact OE1-OH 2.76Å; D436-Y461 HydrophobicContact CB-CE1 4.33Å; F437-Y461 WeakPolarHBondContact CA-OH 3.44Å; F437-Y461 PolarHBondContact N-OH 3Å; I440-Y461 HydrophobicContact CD1-CD1 4.26Å; I440-Y461 HydrophobicContact CD1-CD2 3.69Å; I440-Y461 HydrophobicContact CD1-CE1 4Å; I440-Y461 HydrophobicContact CD1-CE2 3.39Å; I440-Y461 HydrophobicContact CD1-CG 4.11Å; I440-Y461 HydrophobicContact CG1-CE1 4.06Å; I440-Y461 HydrophobicContact CG1-CE2 4.22Å; I440-Y461 HydrophobicContact CG2-CD1 4.16Å; I440-Y461 HydrophobicContact CG2-CE1 4.05Å; L457-Y461 HydrophobicContact CD1-CE2 4.14Å; L457-Y461 HydrophobicContact CD2-CE2 4.46Å; L457-Y461 HydrophobicContact CG-CD2 4.3Å; L457-Y461 HydrophobicContact CG-CE2 4.02Å; L457-Y461 WeakPolarHBondContact O-CD2 3.35Å; L457-Y461 PolarHBondContact O-N 2.91Å; Y458-Y461 WeakPolarHBondContact O-CB 3.48Å; Y458-Y461 PolarHBondContact O-N 2.94Å; Y458-Y461 VanDerWaalsContact O-N 3.13Å; Y461-R463 PolarHBondContact O-N 3.41Å; Y461-R463 VanDerWaalsContact O-N 3.15Å; Y461-S464 WeakPolarHBondContact O-CB 3.42Å; Y461-S464 PolarHBondContact O-N 3.14Å; Y461-S464 PolarHBondContact O-OG 3.19Å; Y461-L466 HydrophobicContact CD1-CD1 3.72Å; Y461-L466 HydrophobicContact CE1-CD1 3.65Å
462	L	96.4	Very high	94.6	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.01	14%	0.139	C	C	.	.	H	α-helix	trans	-59.3	-26.9	177	-70	175.7	0	0	0	113.5	R135 L136 E139 L142 Y458 V468	R135-L462 CarbonylContact C-O 3.53Å; R135-L462 WeakPolarHBondContact CA-O 3.24Å; L136-L462 HydrophobicContact CB-CB 4.25Å; L136-L462 HydrophobicContact CB-CD2 4.31Å; L136-L462 HydrophobicContact CD1-CD2 3.87Å; L136-L462 PolarHBondContact N-O 2.91Å; E139-L462 HydrophobicContact CB-CD1 4.28Å; L142-L462 HydrophobicContact CB-CD2 4.19Å; L142-L462 HydrophobicContact CD1-CD2 4.28Å; L142-L462 HydrophobicContact CD2-CD2 4.49Å; Y458-L462 HydrophobicContact CD1-CD1 3.78Å; Y458-L462 HydrophobicContact CD1-CG 4.33Å; Y458-L462 HydrophobicContact CE1-CD1 3.52Å; Y458-L462 HydrophobicContact CE1-CD2 4.34Å; Y458-L462 HydrophobicContact CE1-CG 4.08Å; Y458-L462 WeakPolarHBondContact O-CG 3.47Å; Y458-L462 PolarHBondContact O-N 3.42Å; L462-V468 HydrophobicContact CD2-CB 4.24Å; L462-V468 HydrophobicContact CD2-CG1 4.31Å; L462-V468 HydrophobicContact CD2-CG2 3.99Å
463	R	95.5	Very high	95.2	Very high	143 Å²	143	29.2 Å²	29.2	54%	0.54	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-6	177.6	-67.1	170.4	-171.2	156.5	2	113.3	R459 K460 Y461	R459-R463 WeakPolarHBondContact O-CD 3.41Å; R459-R463 VanDerWaalsContact O-CG 3.29Å; R459-R463 WeakPolarHBondContact O-CG 3.36Å; R459-R463 PolarHBondContact O-N 2.95Å; K460-R463 PolarHBondContact O-N 2.79Å; Y461-R463 PolarHBondContact O-N 3.41Å; Y461-R463 VanDerWaalsContact O-N 3.15Å
464	S	94.1	Very high	95.4	Very high	23 Å²	23	30 Å²	30	16%	0.161	14%	0.14	C	C	.	.	S	Bend	trans	-85.1	-176.8	176	81.4	0	0	0	0	111.3	K460 Y461 L466	K460-S464 PolarHBondContact O-N 2.83Å; Y461-S464 WeakPolarHBondContact O-CB 3.42Å; Y461-S464 PolarHBondContact O-N 3.14Å; Y461-S464 PolarHBondContact O-OG 3.19Å; S464-L466 WeakPolarHBondContact OG-CB 3.29Å; S464-L466 PolarHBondContact OG-N 3.3Å
465	E	91.9	Very high	95.6	Very high	135 Å²	135	29.7 Å²	29.7	63%	0.631	14%	0.139	S	C	*	.	S	Bend	trans	-94.1	0.6	175.2	-61	-177.5	168.7	0	0	112.5	G133 R135	G133-E465 PolarHBondContact N-O 2.95Å; R135-E465 IonicContact CZ-OE1 3.85Å; R135-E465 IonicContact NH2-OE1 3.01Å; R135-E465 PolarHBondContact NH2-OE1 3.36Å
466	L	94.9	Very high	95.9	Very high	18 Å²	18	28.9 Å²	28.9	9%	0.094	13%	0.134	C	C	.	.	S	Bend	trans	-72.7	141.5	177.4	-59	175.8	0	0	0	110.7	K383 D436 Y461 S464 V468	K383-L466 VanDerWaalsContact N-CD2 3.32Å; D436-L466 HydrophobicContact CB-CD1 3.96Å; Y461-L466 HydrophobicContact CD1-CD1 3.72Å; Y461-L466 HydrophobicContact CE1-CD1 3.65Å; S464-L466 WeakPolarHBondContact OG-CB 3.29Å; S464-L466 PolarHBondContact OG-N 3.3Å; L466-V468 PolarHBondContact O-N 3.28Å
467	I	95	Very high	96.1	Very high	5 Å²	5	26.6 Å²	26.6	3%	0.026	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	121.8	172	-57.5	168.1	0	0	0	108.2	K383 K384 V385 I469	K383-I467 PolarHBondContact O-N 3.47Å; K384-I467 WeakPolarHBondContact CA-O 3.37Å; K384-I467 HydrophobicContact CG-CB 4.23Å; K384-I467 HydrophobicContact CG-CD1 4.46Å; V385-I467 PolarHBondContact N-O 2.99Å; I467-I469 HydrophobicContact CG2-CD1 3.62Å; I467-I469 HydrophobicContact CG2-CG1 4.36Å
468	V	96.5	Very high	96.2	Very high	8 Å²	8	27 Å²	27	5%	0.048	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	106.5	175.4	179.2	0	0	0	0	109.1	L142 V385 Y387 Y458 L462 L466	L142-V468 HydrophobicContact CD1-CB 4.47Å; L142-V468 HydrophobicContact CD2-CG1 3.98Å; V385-V468 HydrophobicContact CG1-CB 4.32Å; V385-V468 HydrophobicContact CG1-CG1 4.5Å; V385-V468 HydrophobicContact CG1-CG2 3.81Å; Y387-V468 HydrophobicContact CD2-CG1 4.13Å; Y458-V468 HydrophobicContact CD2-CG1 4.46Å; Y458-V468 HydrophobicContact CE2-CG1 3.51Å; L462-V468 HydrophobicContact CD2-CB 4.24Å; L462-V468 HydrophobicContact CD2-CG1 4.31Å; L462-V468 HydrophobicContact CD2-CG2 3.99Å; L466-V468 PolarHBondContact O-N 3.28Å
469	I	96.8	Very high	96.2	Very high	4 Å²	4	28.2 Å²	28.2	2%	0.021	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	115.5	173.6	-53	-61.5	0	0	0	108	F145 L217 H378 K384 V385 F386 Y387 I467	F145-I469 HydrophobicContact CD2-CG2 4.35Å; F145-I469 HydrophobicContact CE2-CD1 3.79Å; F145-I469 HydrophobicContact CZ-CD1 4.15Å; L217-I469 HydrophobicContact CD1-CG2 3.78Å; H378-I469 HydrophobicContact CB-CG2 4.29Å; K384-I469 HydrophobicContact CB-CG1 4.49Å; K384-I469 HydrophobicContact CD-CD1 4.43Å; K384-I469 HydrophobicContact CD-CG1 4.23Å; V385-I469 PolarHBondContact O-N 2.03Å; F386-I469 CarbonylContact C-O 3.57Å; F386-I469 WeakPolarHBondContact CA-O 3.39Å; F386-I469 HydrophobicContact CD2-CB 3.9Å; F386-I469 HydrophobicContact CD2-CG2 3.68Å; F386-I469 WeakPolarHBondContact CD2-O 3.39Å; F386-I469 HydrophobicContact CE2-CG2 4Å; Y387-I469 PolarHBondContact N-O 3.1Å; I467-I469 HydrophobicContact CG2-CD1 3.62Å; I467-I469 HydrophobicContact CG2-CG1 4.36Å
470	R	96.9	Very high	96.2	Very high	12 Å²	12	28 Å²	28	5%	0.045	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	119.9	175.7	179.5	170.4	-172.8	77.4	-9.2	109.7	L142 P144 F145 Y387 V389 D424 G426 Y458	L142-R470 HydrophobicContact CD2-CB 3.81Å; P144-R470 HydrophobicContact CB-CB 4.42Å; P144-R470 HydrophobicContact CB-CG 4.25Å; F145-R470 PolarHBondContact N-O 2.86Å; Y387-R470 WeakPolarHBondContact O-CA 3.44Å; V389-R470 HydrophobicContact CG2-CG 3.86Å; D424-R470 VanDerWaalsContact C-NH2 3.35Å; D424-R470 PolarHBondContact O-NH2 3.37Å; G426-R470 PolarHBondContact O-NH1 3.46Å; G426-R470 PolarHBondContact O-NH2 3.38Å; Y458-R470 WeakPolarHBondContact OH-CD 3.43Å
471	S	97.1	Very high	96.1	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	153.7	-178.7	59.9	0	0	0	0	113.4	F145 F386 V389	F145-S471 VanDerWaalsContact O-CA 3.3Å; F145-S471 WeakPolarHBondContact O-CA 3.28Å; F145-S471 WeakPolarHBondContact O-CB 3.34Å; F386-S471 WeakPolarHBondContact CE2-OG 3.45Å; V389-S471 PolarHBondContact N-O 3.4Å
472	P	97.1	Very high	95.9	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.006	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	136.9	165.7	-13.6	22.8	0	0	0	111.7	F145 S147 L156 W422	F145-P472 WeakPolarHBondContact O-CD 3.47Å; S147-P472 VanDerWaalsContact CB-O 3.28Å; S147-P472 WeakPolarHBondContact CB-O 3.37Å; S147-P472 PolarHBondContact OG-O 3.45Å; L156-P472 HydrophobicContact CD2-CB 4.38Å; L156-P472 HydrophobicContact CD2-CG 3.63Å; L156-P472 HydrophobicContact CG-CG 3.77Å; W422-P472 HydrophobicContact CD2-CB 3.92Å; W422-P472 HydrophobicContact CE3-CB 3.92Å; W422-P472 HydrophobicContact CH2-CB 4.02Å; W422-P472 HydrophobicContact CZ2-CB 4.01Å; W422-P472 HydrophobicContact CZ3-CB 3.96Å
473	V	97.1	Very high	95.6	Very high	7 Å²	7	35 Å²	35	4%	0.042	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	112.1	175.2	-175.8	0	0	0	0	111	F371 T374 F386 P388 V389 S475 L476	F371-V473 HydrophobicContact CD2-CG1 3.96Å; T374-V473 HydrophobicContact CG2-CG2 4.42Å; F386-V473 HydrophobicContact CE1-CG2 4.3Å; F386-V473 HydrophobicContact CZ-CG2 3.66Å; P388-V473 HydrophobicContact CB-CB 4.41Å; P388-V473 HydrophobicContact CB-CG2 3.62Å; V389-V473 PolarHBondContact O-N 2.95Å; V389-V473 VanDerWaalsContact O-N 3.1Å; V473-S475 VanDerWaalsContact CG1-OG 3.28Å; V473-S475 WeakPolarHBondContact CG1-OG 3.47Å; V473-S475 PolarHBondContact O-N 3.37Å; V473-L476 HydrophobicContact CB-CB 4.05Å; V473-L476 HydrophobicContact CG1-CB 4.02Å; V473-L476 PolarHBondContact O-N 3.4Å
474	S	95.4	Very high	95.2	Very high	36 Å²	36	36.1 Å²	36.1	25%	0.252	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	-15.3	-175.3	60.4	0	0	0	0	115.3	Y154 H415 F477	Y154-S474 VanDerWaalsContact CE2-CB 3.47Å; Y154-S474 WeakPolarHBondContact OH-CB 3.32Å; H415-S474 PolarHBondContact CE1-O 3.35Å; H415-S474 WeakPolarHBondContact NE2-CA 3.37Å; H415-S474 PolarHBondContact NE2-O 3.48Å; S474-F477 VanDerWaalsContact O-CE2 3.32Å; S474-F477 WeakPolarHBondContact O-CE2 3.14Å
475	S	96.1	Very high	95	Very high	15 Å²	15	36.1 Å²	36.1	11%	0.105	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	7.4	177.6	45.5	0	0	0	0	113	F367 S368 F371 V473	F367-S475 WeakPolarHBondContact CA-O 3.49Å; S368-S475 PolarHBondContact N-O 2.96Å; S368-S475 WeakPolarHBondContact OG-CB 3.44Å; F371-S475 WeakPolarHBondContact CB-OG 3.35Å; F371-S475 PolarHBondContact N-OG 3.3Å; V473-S475 VanDerWaalsContact CG1-OG 3.28Å; V473-S475 WeakPolarHBondContact CG1-OG 3.47Å; V473-S475 PolarHBondContact O-N 3.37Å
476	L	97.9	Very high	94.8	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	110.7	-173	-168.1	65.9	0	0	0	111.9	F359 I365 F367 F371 P388 V390 F391 V473	F359-L476 HydrophobicContact CZ-CD1 4.38Å; I365-L476 HydrophobicContact CG2-CD1 3.38Å; I365-L476 HydrophobicContact CG2-CG 4.31Å; F367-L476 HydrophobicContact CB-CD1 3.74Å; F371-L476 HydrophobicContact CD1-CD1 3.97Å; F371-L476 HydrophobicContact CD2-CB 4.22Å; F371-L476 HydrophobicContact CD2-CD1 4.13Å; F371-L476 HydrophobicContact CD2-CD2 3.97Å; F371-L476 HydrophobicContact CD2-CG 4.36Å; F371-L476 HydrophobicContact CE1-CD1 4.02Å; F371-L476 HydrophobicContact CE2-CD1 4.21Å; F371-L476 HydrophobicContact CE2-CD2 3.6Å; F371-L476 HydrophobicContact CE2-CG 4.4Å; F371-L476 HydrophobicContact CG-CD1 4.01Å; F371-L476 HydrophobicContact CZ-CD1 4.14Å; F371-L476 HydrophobicContact CZ-CD2 3.98Å; P388-L476 HydrophobicContact CB-CD2 3.71Å; P388-L476 HydrophobicContact CG-CD2 3.81Å; V390-L476 HydrophobicContact CB-CG 4.47Å; V390-L476 HydrophobicContact CG1-CD2 3.54Å; V390-L476 HydrophobicContact CG1-CG 3.77Å; F391-L476 PolarHBondContact N-O 2.88Å; V473-L476 HydrophobicContact CB-CB 4.05Å; V473-L476 HydrophobicContact CG1-CB 4.02Å; V473-L476 PolarHBondContact O-N 3.4Å
477	F	98.3	Very high	94.5	Very high	12 Å²	12	37.8 Å²	37.8	5%	0.053	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	140.6	-177	-68.5	-96.2	0	0	0	111.3	I365 R366 F391 L393 L413 H415 S474	I365-F477 CarbonylContact C-O 3.56Å; I365-F477 WeakPolarHBondContact CA-O 3.41Å; R366-F477 HydrophobicContact CB-CB 4.38Å; R366-F477 PolarHBondContact N-O 2.9Å; R366-F477 PolarHBondContact O-N 3.31Å; F391-F477 HydrophobicContact CB-CD1 4Å; F391-F477 HydrophobicContact CB-CE1 4.1Å; F391-F477 AromaticContact CD1-CD1 3.83Å; F391-F477 HydrophobicContact CD1-CD1 3.83Å; F391-F477 AromaticContact CD1-CE1 3.68Å; F391-F477 HydrophobicContact CD1-CE1 3.68Å; F391-F477 HydrophobicContact CG-CD1 4.37Å; F391-F477 HydrophobicContact CG-CE1 4.21Å; F391-F477 CarbonylContact O-C 3.6Å; F391-F477 WeakPolarHBondContact O-CA 3.48Å; L393-F477 HydrophobicContact CD2-CD1 4.11Å; L393-F477 HydrophobicContact CD2-CE1 4.5Å; L393-F477 HydrophobicContact CG-CD1 4.38Å; L413-F477 HydrophobicContact CB-CD1 4.39Å; L413-F477 HydrophobicContact CB-CD2 4.33Å; L413-F477 HydrophobicContact CB-CE1 4.12Å; L413-F477 HydrophobicContact CB-CE2 4.06Å; L413-F477 HydrophobicContact CB-CG 4.49Å; L413-F477 HydrophobicContact CB-CZ 3.94Å; L413-F477 HydrophobicContact CD1-CD2 4.48Å; L413-F477 HydrophobicContact CD2-CB 4.06Å; L413-F477 HydrophobicContact CD2-CD1 4.11Å; L413-F477 HydrophobicContact CD2-CD2 4.23Å; L413-F477 HydrophobicContact CD2-CG 3.87Å; H415-F477 AromaticContact CE1-CZ 3.59Å; H415-F477 AromaticContact NE2-CE1 3.82Å; H415-F477 AromaticContact NE2-CZ 3.32Å; H415-F477 VanDerWaalsContact NE2-CZ 3.32Å; H415-F477 WeakPolarHBondContact NE2-CZ 3.5Å; S474-F477 VanDerWaalsContact O-CE2 3.32Å; S474-F477 WeakPolarHBondContact O-CE2 3.14Å
478	H	97.5	Very high	94.1	Very high	14 Å²	14	45.5 Å²	45.5	7%	0.065	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	114.1	166	-178.9	-67	0	0	0	108.1	D364 I365 V390 F391 L393 H481	D364-H478 IonicContact OD2-CE1 3.26Å; D364-H478 PolarHBondContact OD2-CE1 3.35Å; D364-H478 IonicContact OD2-NE2 3.02Å; D364-H478 PolarHBondContact OD2-NE2 3.45Å; I365-H478 HydrophobicContact CD1-CB 3.89Å; V390-H478 HydrophobicContact CB-CB 4.44Å; V390-H478 HydrophobicContact CG2-CB 3.94Å; F391-H478 PolarHBondContact O-N 3.14Å; L393-H478 PolarHBondContact N-O 3.41Å; H478-H481 AromaticContact CE1-CD2 3.61Å; H478-H481 AromaticContact CE1-NE2 3.72Å
479	L	97.2	Very high	93.6	Very high	26 Å²	26	46.4 Å²	46.4	14%	0.136	24%	0.235	C	C	.	.			trans	-68.7	143.2	177.5	-57.2	-176.2	0	0	0	109.4	D364 R366 L393 I409 L413 H481	D364-L479 HydrophobicContact CB-CB 4.46Å; D364-L479 WeakPolarHBondContact O-CB 3.49Å; D364-L479 WeakPolarHBondContact O-CG 3.32Å; D364-L479 PolarHBondContact O-N 2.97Å; R366-L479 HydrophobicContact CB-CD2 4.33Å; R366-L479 HydrophobicContact CB-CG 4.44Å; L393-L479 HydrophobicContact CD1-CD2 3.82Å; I409-L479 HydrophobicContact CD1-CD1 4.25Å; I409-L479 HydrophobicContact CG2-CD1 4.41Å; I409-L479 HydrophobicContact CG2-CD2 3.91Å; L413-L479 HydrophobicContact CD2-CD2 4.09Å; L479-H481 PolarHBondContact O-N 2.78Å
480	W	96.1	Very high	93.2	Very high	69 Å²	69	49.6 Å²	49.6	26%	0.261	26%	0.255	S	S	.	.			trans	-66	136.6	176.6	-179.1	91	0	0	0	110	Y394 N395 E482 N504	Y394-W480 WeakPolarHBondContact O-CB 3.47Å; N395-W480 HydrophobicContact CB-CD2 3.96Å; N395-W480 HydrophobicContact CB-CG 4.2Å; N395-W480 HydrophobicContact CB-CZ2 3.92Å; N395-W480 VanDerWaalsContact CG-CZ2 3.41Å; N395-W480 VanDerWaalsContact N-CD1 3.33Å; N395-W480 WeakPolarHBondContact ND2-CZ2 3.36Å; W480-E482 HydrophobicContact CH2-CB 4.19Å; W480-N504 PolarHBondContact NE1-O 3.43Å
481	H	94.1	Very high	92.9	Very high	51 Å²	51	54.6 Å²	54.6	24%	0.236	29%	0.289	C	S	.	.			trans	-141.3	155.8	167	71.8	87.4	0	0	0	109	D364 H478 L479 K483	D364-H481 IonicContact OD2-CD2 3.96Å; D364-H481 PolarHBondContact OD2-CD2 2.88Å; D364-H481 IonicContact OD2-CG 2.72Å; D364-H481 IonicContact OD2-NE2 3.89Å; D364-H481 PolarHBondContact OD2-NE2 2.98Å; H478-H481 AromaticContact CE1-CD2 3.61Å; H478-H481 AromaticContact CE1-NE2 3.72Å; L479-H481 PolarHBondContact O-N 2.78Å; H481-K483 PolarHBondContact O-N 2.97Å
482	E	91.4	Very high	92.4	Very high	124 Å²	124	60.8 Å²	60.8	58%	0.579	32%	0.318	S	S	*	.			trans	-64.4	134	175.1	-175.1	170.7	-163.5	0	0	110.4	W480 K501	W480-E482 HydrophobicContact CH2-CB 4.19Å; E482-K501 IonicContact OE1-NZ 2.78Å
483	K	89.5	Confident	91.9	Very high	31 Å²	31	61.7 Å²	61.7	14%	0.135	32%	0.322	C	S	.	.			trans	-104.1	129.9	173.5	-176.8	169.5	-73.2	-170.7	0	109.9	W450 H481 S500 K501	W450-K483 VanDerWaalsContact CH2-NZ 3.35Å; W450-K483 HydrophobicContact CZ2-CD 4.45Å; H481-K483 PolarHBondContact O-N 2.97Å; K483-S500 PolarHBondContact NZ-OG 3.42Å; K483-K501 HydrophobicContact CB-CB 4.35Å; K483-K501 HydrophobicContact CB-CG 4.36Å; K483-K501 HydrophobicContact CD-CB 4.46Å; K483-K501 WeakPolarHBondContact O-CD 3.44Å; K483-K501 WeakPolarHBondContact O-CE 3.34Å; K483-K501 PolarHBondContact O-NZ 3.3Å
484	Q	88.1	Confident	91.6	Very high	167 Å²	167	65.8 Å²	65.8	78%	0.78	34%	0.337	S	S	*	.			trans	-101.2	128.1	171.7	-65.7	-179.9	-3.8	0	0	108.9
485	C	90.3	Very high	91.3	Very high	23 Å²	23	70.2 Å²	70.2	16%	0.155	35%	0.349	C	S	.	.			trans	-107.8	104	175.6	-60	0	0	0	0	107.6	Y494 C497	C485-Y494 HydrophobicContact CB-CD2 4.1Å; C485-Y494 HydrophobicContact CB-CE2 3.88Å; C485-C497 WeakPolarHBondContact CA-SG 3.49Å; C485-C497 HydrophobicContact CB-CB 3.88Å; C485-C497 WeakPolarHBondContact CB-SG 3.42Å; C485-C497 WeakPolarHBondContact SG-CB 3.33Å; C485-C497 CovalentContact SG-SG 2.04Å; C485-C497 PolarHBondContact SG-SG 3.35Å
486	A	88	Confident	90.9	Very high	47 Å²	47	72.3 Å²	72.3	39%	0.388	36%	0.357	S	S	.	.			trans	-67.1	147.6	-175.9	0	0	0	0	0	111.7	E488 L489	A486-E488 WeakPolarHBondContact CB-OE2 3.4Å; A486-E488 PolarHBondContact O-N 3.2Å; A486-L489 HydrophobicContact CB-CG 4.3Å; A486-L489 WeakPolarHBondContact O-CB 3.41Å; A486-L489 WeakPolarHBondContact O-CG 3.41Å; A486-L489 PolarHBondContact O-N 2.9Å
487	D	86.9	Confident	90.6	Very high	142 Å²	142	72.4 Å²	72.4	76%	0.759	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-20.6	-176.7	-70.3	-29.2	0	0	0	112.1	L489	D487-L489 VanDerWaalsContact C-N 3.28Å; D487-L489 PolarHBondContact O-N 3.49Å
488	E	87.4	Confident	90.3	Very high	166 Å²	166	75 Å²	75	78%	0.776	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-7.2	179.3	-55.4	77.5	-169.2	0	0	113.3	A486	A486-E488 WeakPolarHBondContact CB-OE2 3.4Å; A486-E488 PolarHBondContact O-N 3.2Å
489	L	85.9	Confident	90	Very high	28 Å²	28	78.7 Å²	78.7	15%	0.147	39%	0.389	C	S	.	.	S	Bend	trans	-62.8	145.3	176.7	-69.2	176.8	0	0	0	110.8	W450 A486 D487 Q493 C497	W450-L489 HydrophobicContact CB-CD2 4.31Å; A486-L489 HydrophobicContact CB-CG 4.3Å; A486-L489 WeakPolarHBondContact O-CB 3.41Å; A486-L489 WeakPolarHBondContact O-CG 3.41Å; A486-L489 PolarHBondContact O-N 2.9Å; D487-L489 VanDerWaalsContact C-N 3.28Å; D487-L489 PolarHBondContact O-N 3.49Å; L489-Q493 HydrophobicContact CB-CB 4.08Å; L489-Q493 HydrophobicContact CD2-CB 4.13Å; L489-Q493 HydrophobicContact CG-CB 4.49Å; L489-C497 HydrophobicContact CD1-CB 4.18Å
490	T	88.2	Confident	89.8	Confident	70 Å²	70	77.7 Å²	77.7	43%	0.429	38%	0.384	S	S	.	.			trans	-59.4	154.4	169.7	62.9	0	0	0	0	110.3	E492 Q493 Y494	T490-E492 PolarHBondContact O-N 2.88Å; T490-E492 VanDerWaalsContact O-N 3.07Å; T490-Q493 PolarHBondContact O-N 2.99Å; T490-Q493 VanDerWaalsContact O-N 3.07Å; T490-Q493 WeakPolarHBondContact OG1-CB 3.29Å; T490-Q493 VanDerWaalsContact OG1-CG 3.26Å; T490-Q493 WeakPolarHBondContact OG1-CG 3.45Å; T490-Q493 PolarHBondContact OG1-N 3.33Å; T490-Q493 PolarHBondContact OG1-OE1 2.95Å; T490-Y494 PolarHBondContact O-N 3.34Å
491	P	90.4	Very high	89.6	Confident	118 Å²	118	76.9 Å²	76.9	77%	0.766	38%	0.383	S	S	*	.	H	α-helix	trans	-53.5	-34.6	-179.7	-29	35.7	0	0	0	113.9	R495	P491-R495 WeakPolarHBondContact O-CB 3.34Å; P491-R495 PolarHBondContact O-N 3.41Å; P491-R495 VanDerWaalsContact O-N 3.08Å
492	E	86.6	Confident	89.6	Confident	130 Å²	130	77.3 Å²	77.3	61%	0.607	40%	0.395	S	S	*	.	H	α-helix	trans	-70.3	-49.2	176.5	-175	169.4	-163.5	0	0	112.1	T490 Y494 R495 M496	T490-E492 PolarHBondContact O-N 2.88Å; T490-E492 VanDerWaalsContact O-N 3.07Å; E492-Y494 VanDerWaalsContact C-N 3.34Å; E492-Y494 PolarHBondContact O-N 3.29Å; E492-R495 WeakPolarHBondContact O-CB 3.44Å; E492-R495 PolarHBondContact O-N 3.37Å; E492-M496 HydrophobicContact CG-SD 4.38Å; E492-M496 WeakPolarHBondContact O-CG 3.19Å; E492-M496 PolarHBondContact O-N 3.47Å
493	Q	87.2	Confident	89.6	Confident	20 Å²	20	75.3 Å²	75.3	9%	0.093	39%	0.387	C	S	.	.	H	α-helix	trans	-61.9	-41.4	177	-72.9	169.4	-43.8	0	0	111.9	K448 L489 T490 M496 C497	K448-Q493 PolarHBondContact O-NE2 3.01Å; L489-Q493 HydrophobicContact CB-CB 4.08Å; L489-Q493 HydrophobicContact CD2-CB 4.13Å; L489-Q493 HydrophobicContact CG-CB 4.49Å; T490-Q493 PolarHBondContact O-N 2.99Å; T490-Q493 VanDerWaalsContact O-N 3.07Å; T490-Q493 WeakPolarHBondContact OG1-CB 3.29Å; T490-Q493 VanDerWaalsContact OG1-CG 3.26Å; T490-Q493 WeakPolarHBondContact OG1-CG 3.45Å; T490-Q493 PolarHBondContact OG1-N 3.33Å; T490-Q493 PolarHBondContact OG1-OE1 2.95Å; Q493-M496 PolarHBondContact O-N 3.43Å; Q493-C497 WeakPolarHBondContact O-CB 3.37Å; Q493-C497 PolarHBondContact O-N 3.38Å
494	Y	90.1	Very high	89.8	Confident	92 Å²	92	74.4 Å²	74.4	36%	0.361	38%	0.383	S	S	.	.	H	α-helix	trans	-61.8	-45.4	176.1	-174.9	-89.9	0	0	0	111	C485 T490 E492 M496 C497 I498	C485-Y494 HydrophobicContact CB-CD2 4.1Å; C485-Y494 HydrophobicContact CB-CE2 3.88Å; T490-Y494 PolarHBondContact O-N 3.34Å; E492-Y494 VanDerWaalsContact C-N 3.34Å; E492-Y494 PolarHBondContact O-N 3.29Å; Y494-M496 VanDerWaalsContact C-N 3.34Å; Y494-M496 PolarHBondContact O-N 3.45Å; Y494-C497 PolarHBondContact O-N 2.86Å; Y494-I498 HydrophobicContact CD1-CG2 4.4Å; Y494-I498 HydrophobicContact CE1-CB 4.27Å; Y494-I498 HydrophobicContact CE1-CG2 4.27Å; Y494-I498 WeakPolarHBondContact O-CG2 3.45Å; Y494-I498 PolarHBondContact O-N 2.71Å
495	R	90.4	Very high	90.1	Very high	129 Å²	129	68.2 Å²	68.2	49%	0.487	35%	0.354	S	S	.	.	H	α-helix	trans	-59	-44.8	176.2	-172.3	-179.3	71.4	93.2	-2.2	111.5	P491 E492 I498 Q499	P491-R495 WeakPolarHBondContact O-CB 3.34Å; P491-R495 PolarHBondContact O-N 3.41Å; P491-R495 VanDerWaalsContact O-N 3.08Å; E492-R495 WeakPolarHBondContact O-CB 3.44Å; E492-R495 PolarHBondContact O-N 3.37Å; R495-I498 WeakPolarHBondContact O-CG2 3.37Å; R495-Q499 HydrophobicContact CG-CG 4.46Å; R495-Q499 VanDerWaalsContact O-CB 3.26Å; R495-Q499 WeakPolarHBondContact O-CB 3.46Å; R495-Q499 WeakPolarHBondContact O-CG 3.48Å; R495-Q499 PolarHBondContact O-N 2.99Å
496	M	87.7	Confident	90.3	Very high	59 Å²	59	67.4 Å²	67.4	29%	0.291	35%	0.349	S	S	.	.	H	α-helix	trans	-62.6	-44.1	175.8	-69.5	175.1	65.9	0	0	111.6	W450 G451 V452 E492 Q493 Y494 S500	W450-M496 HydrophobicContact CZ3-CB 4.4Å; G451-M496 WeakPolarHBondContact O-CE 3.17Å; V452-M496 HydrophobicContact CG1-SD 4.48Å; E492-M496 HydrophobicContact CG-SD 4.38Å; E492-M496 WeakPolarHBondContact O-CG 3.19Å; E492-M496 PolarHBondContact O-N 3.47Å; Q493-M496 PolarHBondContact O-N 3.43Å; Y494-M496 VanDerWaalsContact C-N 3.34Å; Y494-M496 PolarHBondContact O-N 3.45Å; M496-S500 VanDerWaalsContact O-CB 3.27Å; M496-S500 WeakPolarHBondContact O-CB 3.11Å; M496-S500 PolarHBondContact O-N 3.19Å
497	C	90.9	Very high	90.6	Very high	2 Å²	2	65.5 Å²	65.5	1%	0.014	33%	0.333	C	S	.	.	H	α-helix	trans	-61.3	-51.5	178.8	-177.3	0	0	0	0	111.7	W450 C485 L489 Q493 Y494 S500 K501	W450-C497 HydrophobicContact CE3-CB 3.91Å; W450-C497 HydrophobicContact CZ3-CB 3.94Å; C485-C497 WeakPolarHBondContact CA-SG 3.49Å; C485-C497 HydrophobicContact CB-CB 3.88Å; C485-C497 WeakPolarHBondContact CB-SG 3.42Å; C485-C497 WeakPolarHBondContact SG-CB 3.33Å; C485-C497 CovalentContact SG-SG 2.04Å; C485-C497 PolarHBondContact SG-SG 3.35Å; L489-C497 HydrophobicContact CD1-CB 4.18Å; Q493-C497 WeakPolarHBondContact O-CB 3.37Å; Q493-C497 PolarHBondContact O-N 3.38Å; Y494-C497 PolarHBondContact O-N 2.86Å; C497-S500 WeakPolarHBondContact O-CB 3.31Å; C497-S500 PolarHBondContact O-N 3.36Å; C497-K501 PolarHBondContact O-N 3.11Å
498	I	92.6	Very high	90.8	Very high	68 Å²	68	66.2 Å²	66.2	35%	0.349	33%	0.331	S	S	.	.	H	α-helix	trans	-70.1	-35.6	-175.8	-161.2	64	0	0	0	111.9	Y494 R495 K501 A502	Y494-I498 HydrophobicContact CD1-CG2 4.4Å; Y494-I498 HydrophobicContact CE1-CB 4.27Å; Y494-I498 HydrophobicContact CE1-CG2 4.27Å; Y494-I498 WeakPolarHBondContact O-CG2 3.45Å; Y494-I498 PolarHBondContact O-N 2.71Å; R495-I498 WeakPolarHBondContact O-CG2 3.37Å; I498-K501 HydrophobicContact CD1-CD 4.31Å; I498-K501 PolarHBondContact O-N 2.71Å; I498-A502 WeakPolarHBondContact O-CB 3.22Å; I498-A502 PolarHBondContact O-N 2.82Å
499	Q	91.7	Very high	91	Very high	91 Å²	91	62.4 Å²	62.4	43%	0.425	32%	0.321	S	S	.	.	H	α-helix	trans	-63.6	-44.9	172.5	-75.8	-179.3	-18.9	0	0	111	R495 K501 A502 M503	R495-Q499 HydrophobicContact CG-CG 4.46Å; R495-Q499 VanDerWaalsContact O-CB 3.26Å; R495-Q499 WeakPolarHBondContact O-CB 3.46Å; R495-Q499 WeakPolarHBondContact O-CG 3.48Å; R495-Q499 PolarHBondContact O-N 2.99Å; Q499-K501 VanDerWaalsContact C-N 3.35Å; Q499-K501 PolarHBondContact O-N 2.94Å; Q499-A502 PolarHBondContact O-N 3.33Å; Q499-M503 WeakPolarHBondContact O-CG 3.48Å; Q499-M503 PolarHBondContact O-N 3.13Å
500	S	91.1	Very high	91.3	Very high	4 Å²	4	63.2 Å²	63.2	3%	0.028	32%	0.324	C	S	.	.	H	α-helix	trans	-59.8	-45.6	174.4	-172	0	0	0	0	111.1	K483 M496 C497 M503 N504	K483-S500 PolarHBondContact NZ-OG 3.42Å; M496-S500 VanDerWaalsContact O-CB 3.27Å; M496-S500 WeakPolarHBondContact O-CB 3.11Å; M496-S500 PolarHBondContact O-N 3.19Å; C497-S500 WeakPolarHBondContact O-CB 3.31Å; C497-S500 PolarHBondContact O-N 3.36Å; S500-M503 PolarHBondContact O-N 3.33Å; S500-N504 PolarHBondContact O-N 2.81Å; S500-N504 PolarHBondContact O-ND2 3.08Å
501	K	93.6	Very high	91.5	Very high	53 Å²	53	62.9 Å²	62.9	23%	0.23	32%	0.319	C	S	.	.	H	α-helix	trans	-57.6	-54.1	176.3	-176	173.6	-175.2	158.4	0	111.1	E482 K483 C497 I498 Q499 M503 N504 E505	E482-K501 IonicContact OE1-NZ 2.78Å; K483-K501 HydrophobicContact CB-CB 4.35Å; K483-K501 HydrophobicContact CB-CG 4.36Å; K483-K501 HydrophobicContact CD-CB 4.46Å; K483-K501 WeakPolarHBondContact O-CD 3.44Å; K483-K501 WeakPolarHBondContact O-CE 3.34Å; K483-K501 PolarHBondContact O-NZ 3.3Å; C497-K501 PolarHBondContact O-N 3.11Å; I498-K501 HydrophobicContact CD1-CD 4.31Å; I498-K501 PolarHBondContact O-N 2.71Å; Q499-K501 VanDerWaalsContact C-N 3.35Å; Q499-K501 PolarHBondContact O-N 2.94Å; K501-M503 VanDerWaalsContact C-N 3.31Å; K501-M503 PolarHBondContact O-N 3.46Å; K501-N504 PolarHBondContact O-N 2.84Å; K501-E505 PolarHBondContact O-N 3.03Å
502	A	92.8	Very high	91.6	Very high	59 Å²	59	58.4 Å²	58.4	49%	0.488	29%	0.294	S	S	.	.	H	α-helix	trans	-57.5	-41.4	-178.8	0	0	0	0	0	112.9	I498 Q499 N504 E505	I498-A502 WeakPolarHBondContact O-CB 3.22Å; I498-A502 PolarHBondContact O-N 2.82Å; Q499-A502 PolarHBondContact O-N 3.33Å; A502-N504 PolarHBondContact O-N 3.47Å; A502-E505 PolarHBondContact O-N 2.97Å
503	M	91.8	Very high	91.8	Very high	83 Å²	83	57.6 Å²	57.6	41%	0.409	29%	0.292	S	S	.	.	H	α-helix	trans	-66.1	-24.8	176.7	-73.2	-170.4	-65	0	0	113.4	Y394 F421 F425 Q499 S500 K501	Y394-M503 WeakPolarHBondContact CE1-O 3.47Å; F421-M503 WeakPolarHBondContact CE1-O 3.49Å; F421-M503 HydrophobicContact CZ-CB 4.31Å; F425-M503 HydrophobicContact CD1-CE 3.96Å; F425-M503 HydrophobicContact CE1-CE 3.25Å; F425-M503 HydrophobicContact CE1-SD 3.96Å; F425-M503 HydrophobicContact CE2-CE 3.99Å; F425-M503 HydrophobicContact CZ-CE 3.28Å; F425-M503 HydrophobicContact CZ-SD 4.45Å; Q499-M503 WeakPolarHBondContact O-CG 3.48Å; Q499-M503 PolarHBondContact O-N 3.13Å; S500-M503 PolarHBondContact O-N 3.33Å; K501-M503 VanDerWaalsContact C-N 3.31Å; K501-M503 PolarHBondContact O-N 3.46Å
504	N	93.9	Very high	92	Very high	11 Å²	11	60.8 Å²	60.8	6%	0.059	31%	0.309	C	S	.	.	H	α-helix	trans	-88.3	-5.8	-179.5	-77.6	-79	0	0	0	113.5	Y394 N395 R423 W480 S500 K501 A502	Y394-N504 CarbonylContact C-O 3.56Å; Y394-N504 VanDerWaalsContact CA-O 3.32Å; Y394-N504 WeakPolarHBondContact CA-O 3.34Å; N395-N504 PolarHBondContact N-O 3.33Å; N395-N504 VanDerWaalsContact N-O 3.1Å; R423-N504 PolarHBondContact NH1-ND2 3.06Å; R423-N504 VanDerWaalsContact NH1-ND2 3.12Å; R423-N504 PolarHBondContact NH2-ND2 3.29Å; R423-N504 PolarHBondContact NH2-OD1 2.85Å; W480-N504 PolarHBondContact NE1-O 3.43Å; S500-N504 PolarHBondContact O-N 2.81Å; S500-N504 PolarHBondContact O-ND2 3.08Å; K501-N504 PolarHBondContact O-N 2.84Å; A502-N504 PolarHBondContact O-N 3.47Å
505	E	95.1	Very high	92.2	Very high	38 Å²	38	61.9 Å²	61.9	18%	0.178	33%	0.325	C	S	.	.	H	α-helix	trans	-72.6	-56.9	-177.4	-68.4	-56.1	152.6	0	0	112.1	N395 I398 K501 A502 L511	N395-E505 WeakPolarHBondContact CB-O 3.26Å; N395-E505 PolarHBondContact N-O 3.26Å; N395-E505 PolarHBondContact ND2-OE2 3.21Å; I398-E505 HydrophobicContact CD1-CB 3.96Å; K501-E505 PolarHBondContact O-N 3.03Å; A502-E505 PolarHBondContact O-N 2.97Å; E505-L511 HydrophobicContact CB-CD2 4.44Å
506	A	94.8	Very high	92.3	Very high	6 Å²	6	60.8 Å²	60.8	5%	0.05	32%	0.324	C	S	.	.			trans	-165.2	170.4	178.9	0	0	0	0	0	113.1	I398 H510 L511	I398-A506 HydrophobicContact CB-CB 4.22Å; I398-A506 HydrophobicContact CG2-CB 3.56Å; A506-H510 HydrophobicContact CB-CB 3.56Å; A506-L511 HydrophobicContact CB-CD2 4.01Å; A506-L511 HydrophobicContact CB-CG 4.1Å
507	S	93.2	Very high	92.5	Very high	6 Å²	6	64.8 Å²	64.8	4%	0.042	34%	0.336	C	S	.	.			trans	-61.9	156.7	168.7	76.2	0	0	0	0	111.8	Y394 K417 H510 L511	Y394-S507 VanDerWaalsContact CE2-N 3.3Å; K417-S507 WeakPolarHBondContact O-CB 3.48Å; S507-H510 PolarHBondContact O-N 3.36Å; S507-H510 PolarHBondContact OG-N 2.84Å; S507-H510 PolarHBondContact OG-ND1 2.96Å; S507-L511 PolarHBondContact O-N 2.82Å
508	H	91.6	Very high	92.5	Very high	158 Å²	158	70.9 Å²	70.9	73%	0.731	37%	0.368	S	S	*	.	H	α-helix	trans	-54.5	-44.3	178.3	-177.5	81.3	0	0	0	113.4	L511 G512	H508-L511 PolarHBondContact O-N 3.2Å; H508-G512 PolarHBondContact O-N 3.26Å
509	P	90.8	Very high	92.6	Very high	85 Å²	85	74 Å²	74	55%	0.552	38%	0.381	S	S	*	.	H	α-helix	trans	-59.7	-43.4	172.7	-25.9	35.7	0	0	0	114.1	L511 G512 M513	P509-L511 PolarHBondContact O-N 3.17Å; P509-G512 PolarHBondContact O-N 2.94Å; P509-M513 WeakPolarHBondContact O-CG 3.29Å; P509-M513 PolarHBondContact O-N 3.09Å
510	H	92.6	Very high	92.5	Very high	45 Å²	45	72.5 Å²	72.5	21%	0.208	38%	0.375	C	S	.	.	H	α-helix	trans	-62.1	-43.6	178.6	-75.5	149.8	0	0	0	112	I398 D418 A506 S507 G512 M513 L514	I398-H510 HydrophobicContact CG2-CB 4.25Å; D418-H510 PolarHBondContact O-CE1 2.82Å; A506-H510 HydrophobicContact CB-CB 3.56Å; S507-H510 PolarHBondContact O-N 3.36Å; S507-H510 PolarHBondContact OG-N 2.84Å; S507-H510 PolarHBondContact OG-ND1 2.96Å; H510-G512 VanDerWaalsContact C-N 3.31Å; H510-G512 PolarHBondContact O-N 3.37Å; H510-M513 WeakPolarHBondContact O-CB 3.44Å; H510-M513 PolarHBondContact O-N 3.21Å; H510-L514 PolarHBondContact O-N 2.76Å; H510-L514 VanDerWaalsContact O-N 3.12Å
511	L	92.4	Very high	92.5	Very high	64 Å²	64	75 Å²	75	34%	0.335	39%	0.387	S	S	.	.	H	α-helix	trans	-62	-40.7	174.3	-65.5	177.7	0	0	0	111.6	E505 A506 S507 H508 P509 M513 L514 V515	E505-L511 HydrophobicContact CB-CD2 4.44Å; A506-L511 HydrophobicContact CB-CD2 4.01Å; A506-L511 HydrophobicContact CB-CG 4.1Å; S507-L511 PolarHBondContact O-N 2.82Å; H508-L511 PolarHBondContact O-N 3.2Å; P509-L511 PolarHBondContact O-N 3.17Å; L511-M513 VanDerWaalsContact C-N 3.32Å; L511-M513 PolarHBondContact O-N 2.94Å; L511-L514 HydrophobicContact CD2-CD1 4.4Å; L511-L514 WeakPolarHBondContact O-CB 3.4Å; L511-L514 PolarHBondContact O-N 2.99Å; L511-L514 VanDerWaalsContact O-N 3.16Å; L511-V515 WeakPolarHBondContact O-CG2 3.28Å; L511-V515 PolarHBondContact O-N 3.2Å
512	G	92.6	Very high	92.5	Very high	23 Å²	23	74.6 Å²	74.6	24%	0.237	39%	0.393	C	S	.	.	H	α-helix	trans	-57.6	-43.5	173.1	0	0	0	0	0	112.5	H508 P509 H510 L514 V515 F516	H508-G512 PolarHBondContact O-N 3.26Å; P509-G512 PolarHBondContact O-N 2.94Å; H510-G512 VanDerWaalsContact C-N 3.31Å; H510-G512 PolarHBondContact O-N 3.37Å; G512-L514 VanDerWaalsContact C-N 3.28Å; G512-L514 PolarHBondContact O-N 3.49Å; G512-V515 PolarHBondContact O-N 3.28Å; G512-V515 VanDerWaalsContact O-N 3.16Å; G512-F516 WeakPolarHBondContact O-CD2 3.5Å; G512-F516 PolarHBondContact O-N 3.5Å
513	M	91	Very high	92.5	Very high	113 Å²	113	76.8 Å²	76.8	56%	0.557	39%	0.393	S	S	*	.	H	α-helix	trans	-63.3	-32.9	176.8	-66.4	-58.3	-70.4	0	0	113	P509 H510 L511 R517 I520	P509-M513 WeakPolarHBondContact O-CG 3.29Å; P509-M513 PolarHBondContact O-N 3.09Å; H510-M513 WeakPolarHBondContact O-CB 3.44Å; H510-M513 PolarHBondContact O-N 3.21Å; L511-M513 VanDerWaalsContact C-N 3.32Å; L511-M513 PolarHBondContact O-N 2.94Å; M513-R517 PolarHBondContact O-N 3.36Å; M513-I520 HydrophobicContact CE-CD1 3.41Å; M513-I520 VanDerWaalsContact CE-CD1 3.41Å; M513-I520 HydrophobicContact SD-CD1 4.06Å
514	L	91.1	Very high	92.4	Very high	88 Å²	88	77.6 Å²	77.6	46%	0.461	40%	0.399	S	S	.	.	H	α-helix	trans	-69.1	-41.6	172.7	-66.7	177.9	0	0	0	112	I398 H510 L511 G512 R517	I398-L514 HydrophobicContact CD1-CD1 4.15Å; I398-L514 HydrophobicContact CG1-CD1 4.33Å; I398-L514 HydrophobicContact CG2-CD1 3.8Å; I398-L514 HydrophobicContact CG2-CG 4.42Å; H510-L514 PolarHBondContact O-N 2.76Å; H510-L514 VanDerWaalsContact O-N 3.12Å; L511-L514 HydrophobicContact CD2-CD1 4.4Å; L511-L514 WeakPolarHBondContact O-CB 3.4Å; L511-L514 PolarHBondContact O-N 2.99Å; L511-L514 VanDerWaalsContact O-N 3.16Å; G512-L514 VanDerWaalsContact C-N 3.28Å; G512-L514 PolarHBondContact O-N 3.49Å; L514-R517 VanDerWaalsContact O-CB 3.3Å; L514-R517 WeakPolarHBondContact O-CB 3.47Å; L514-R517 PolarHBondContact O-N 2.89Å
515	V	94.1	Very high	92.3	Very high	115 Å²	115	85.4 Å²	85.4	70%	0.697	43%	0.427	S	S	*	.	H	α-helix	trans	-63.5	-41.9	178.3	172	0	0	0	0	111.6	L511 G512 R517	L511-V515 WeakPolarHBondContact O-CG2 3.28Å; L511-V515 PolarHBondContact O-N 3.2Å; G512-V515 PolarHBondContact O-N 3.28Å; G512-V515 VanDerWaalsContact O-N 3.16Å; V515-R517 VanDerWaalsContact C-N 3.33Å; V515-R517 PolarHBondContact O-N 3.27Å
516	F	93.8	Very high	92.2	Very high	106 Å²	106	90.6 Å²	90.6	47%	0.465	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	14.3	-179	-62.6	-67.2	0	0	0	114	G512 D518 E519 I520	G512-F516 WeakPolarHBondContact O-CD2 3.5Å; G512-F516 PolarHBondContact O-N 3.5Å; F516-D518 PolarHBondContact O-N 2.9Å; F516-E519 PolarHBondContact O-N 3.16Å; F516-E519 VanDerWaalsContact O-N 3.17Å; F516-I520 HydrophobicContact CB-CD1 4.31Å; F516-I520 WeakPolarHBondContact O-CD1 3.39Å; F516-I520 WeakPolarHBondContact O-CG1 3.5Å; F516-I520 PolarHBondContact O-N 2.8Å
517	R	90.4	Very high	91.8	Very high	143 Å²	143	95.2 Å²	95.2	54%	0.54	47%	0.47	S	S	.	.	H	α-helix	trans	-54.3	-47.9	-174.3	-180	179.7	173.7	171.2	1.4	113	M513 L514 V515 E519 I520 E521	M513-R517 PolarHBondContact O-N 3.36Å; L514-R517 VanDerWaalsContact O-CB 3.3Å; L514-R517 WeakPolarHBondContact O-CB 3.47Å; L514-R517 PolarHBondContact O-N 2.89Å; V515-R517 VanDerWaalsContact C-N 3.33Å; V515-R517 PolarHBondContact O-N 3.27Å; R517-E519 VanDerWaalsContact C-N 3.31Å; R517-E519 PolarHBondContact O-N 3.5Å; R517-I520 PolarHBondContact O-N 2.74Å; R517-E521 HydrophobicContact CG-CG 4.42Å; R517-E521 IonicContact CZ-OE1 2.71Å; R517-E521 IonicContact NE-OE1 3.51Å; R517-E521 PolarHBondContact NE-OE1 3.24Å; R517-E521 IonicContact NH2-OE1 3.68Å; R517-E521 PolarHBondContact NH2-OE1 2.68Å; R517-E521 WeakPolarHBondContact O-CG 3.44Å; R517-E521 PolarHBondContact O-N 2.84Å
518	D	92.3	Very high	91.4	Very high	129 Å²	129	97.4 Å²	97.4	69%	0.69	49%	0.488	S	S	*	.	H	α-helix	trans	-64.4	-36.4	-177.6	-68.8	-19.2	0	0	0	112.2	F516 A522	F516-D518 PolarHBondContact O-N 2.9Å; D518-A522 VanDerWaalsContact O-CB 3.23Å; D518-A522 WeakPolarHBondContact O-CB 3.12Å; D518-A522 PolarHBondContact O-N 3.02Å
519	E	94.2	Very high	91	Very high	134 Å²	134	97.1 Å²	97.1	63%	0.626	49%	0.485	S	S	*	.	H	α-helix	trans	-66.7	-42.5	175.7	-65.5	-176.1	-161.6	0	0	111.5	F516 R517 A522 H523	F516-E519 PolarHBondContact O-N 3.16Å; F516-E519 VanDerWaalsContact O-N 3.17Å; R517-E519 VanDerWaalsContact C-N 3.31Å; R517-E519 PolarHBondContact O-N 3.5Å; E519-A522 PolarHBondContact O-N 3.2Å; E519-H523 WeakPolarHBondContact O-CB 2.84Å; E519-H523 PolarHBondContact O-N 2.93Å
520	I	89.6	Confident	90.4	Very high	59 Å²	59	100 Å²	100	30%	0.303	49%	0.489	S	S	.	.	H	α-helix	trans	-62.9	-49.3	176.5	-65.1	159.9	0	0	0	110	M513 F516 R517 A522 H523 L524	M513-I520 HydrophobicContact CE-CD1 3.41Å; M513-I520 VanDerWaalsContact CE-CD1 3.41Å; M513-I520 HydrophobicContact SD-CD1 4.06Å; F516-I520 HydrophobicContact CB-CD1 4.31Å; F516-I520 WeakPolarHBondContact O-CD1 3.39Å; F516-I520 WeakPolarHBondContact O-CG1 3.5Å; F516-I520 PolarHBondContact O-N 2.8Å; R517-I520 PolarHBondContact O-N 2.74Å; I520-A522 VanDerWaalsContact C-N 3.35Å; I520-A522 PolarHBondContact O-N 3.05Å; I520-H523 WeakPolarHBondContact O-CB 3.31Å; I520-H523 PolarHBondContact O-N 3.45Å; I520-H523 VanDerWaalsContact O-N 3.16Å; I520-L524 HydrophobicContact CG2-CD1 4.05Å; I520-L524 HydrophobicContact CG2-CG 4.47Å; I520-L524 WeakPolarHBondContact O-CG 3.27Å; I520-L524 PolarHBondContact O-N 3.42Å
521	E	90.8	Very high	89.5	Confident	57 Å²	57	101.9 Å²	101.9	27%	0.266	50%	0.504	S	S	.	.	H	α-helix	trans	-61.4	-42.5	178.3	-73.2	-170.6	-162.6	0	0	111.7	R517 H523 L524 R525	R517-E521 HydrophobicContact CG-CG 4.42Å; R517-E521 IonicContact CZ-OE1 2.71Å; R517-E521 IonicContact NE-OE1 3.51Å; R517-E521 PolarHBondContact NE-OE1 3.24Å; R517-E521 IonicContact NH2-OE1 3.68Å; R517-E521 PolarHBondContact NH2-OE1 2.68Å; R517-E521 WeakPolarHBondContact O-CG 3.44Å; R517-E521 PolarHBondContact O-N 2.84Å; E521-H523 VanDerWaalsContact C-N 3.31Å; E521-H523 PolarHBondContact O-N 2.92Å; E521-L524 PolarHBondContact O-N 3.31Å; E521-R525 VanDerWaalsContact O-CG 3.32Å; E521-R525 WeakPolarHBondContact O-CG 3.04Å; E521-R525 PolarHBondContact O-N 2.91Å; E521-R525 IonicContact OE2-NH2 3.67Å; E521-R525 PolarHBondContact OE2-NH2 3.43Å
522	A	93.7	Very high	88.3	Confident	44 Å²	44	104.7 Å²	104.7	36%	0.364	52%	0.515	S	S	.	.	H	α-helix	trans	-61.9	-38.2	175.5	0	0	0	0	0	112.1	D518 E519 I520 K526	D518-A522 VanDerWaalsContact O-CB 3.23Å; D518-A522 WeakPolarHBondContact O-CB 3.12Å; D518-A522 PolarHBondContact O-N 3.02Å; E519-A522 PolarHBondContact O-N 3.2Å; I520-A522 VanDerWaalsContact C-N 3.35Å; I520-A522 PolarHBondContact O-N 3.05Å; A522-K526 WeakPolarHBondContact O-CG 3.36Å; A522-K526 PolarHBondContact O-N 3.48Å
523	H	92.8	Very high	87.1	Confident	106 Å²	106	106.2 Å²	106.2	49%	0.491	52%	0.523	S	S	.	.	H	α-helix	trans	-65.4	-47.1	174.9	-174.2	88.4	0	0	0	112	E519 I520 E521 R525 K526 Q527	E519-H523 WeakPolarHBondContact O-CB 2.84Å; E519-H523 PolarHBondContact O-N 2.93Å; I520-H523 WeakPolarHBondContact O-CB 3.31Å; I520-H523 PolarHBondContact O-N 3.45Å; I520-H523 VanDerWaalsContact O-N 3.16Å; E521-H523 VanDerWaalsContact C-N 3.31Å; E521-H523 PolarHBondContact O-N 2.92Å; H523-R525 PolarHBondContact O-N 3Å; H523-K526 WeakPolarHBondContact O-CB 3.26Å; H523-K526 PolarHBondContact O-N 3.29Å; H523-Q527 PolarHBondContact NE2-NE2 3.04Å; H523-Q527 PolarHBondContact O-N 3.16Å
524	L	90.4	Very high	85.9	Confident	100 Å²	100	108.9 Å²	108.9	52%	0.524	53%	0.531	S	S	.	.	H	α-helix	trans	-62.4	-41.6	179.7	-69.2	173.4	0	0	0	112	I520 E521 K526 Q527 A528	I520-L524 HydrophobicContact CG2-CD1 4.05Å; I520-L524 HydrophobicContact CG2-CG 4.47Å; I520-L524 WeakPolarHBondContact O-CG 3.27Å; I520-L524 PolarHBondContact O-N 3.42Å; E521-L524 PolarHBondContact O-N 3.31Å; L524-K526 VanDerWaalsContact C-N 3.34Å; L524-K526 PolarHBondContact O-N 3.5Å; L524-Q527 PolarHBondContact O-N 3.44Å; L524-A528 PolarHBondContact O-N 2.89Å
525	R	91.7	Very high	84.5	Confident	174 Å²	174	112.2 Å²	112.2	66%	0.657	55%	0.546	S	S	*	.	H	α-helix	trans	-60.2	-42.6	174.5	-70.5	176.4	-164.4	179.8	10.4	111.8	E521 H523 A528 F529	E521-R525 VanDerWaalsContact O-CG 3.32Å; E521-R525 WeakPolarHBondContact O-CG 3.04Å; E521-R525 PolarHBondContact O-N 2.91Å; E521-R525 IonicContact OE2-NH2 3.67Å; E521-R525 PolarHBondContact OE2-NH2 3.43Å; H523-R525 PolarHBondContact O-N 3Å; R525-A528 PolarHBondContact O-N 3.36Å; R525-F529 PolarHBondContact O-N 3.44Å; R525-F529 VanDerWaalsContact O-N 3.13Å
526	K	91.7	Very high	82.8	Confident	147 Å²	147	114.8 Å²	114.8	64%	0.639	55%	0.55	S	S	*	*	H	α-helix	trans	-64.4	-38	175.9	-73.1	174	-175.8	175.4	0	112.3	A522 H523 L524 K530	A522-K526 WeakPolarHBondContact O-CG 3.36Å; A522-K526 PolarHBondContact O-N 3.48Å; H523-K526 WeakPolarHBondContact O-CB 3.26Å; H523-K526 PolarHBondContact O-N 3.29Å; L524-K526 VanDerWaalsContact C-N 3.34Å; L524-K526 PolarHBondContact O-N 3.5Å; K526-K530 WeakPolarHBondContact O-CG 3.49Å; K526-K530 PolarHBondContact O-N 2.92Å
527	Q	87.2	Confident	80.8	Confident	104 Å²	104	116 Å²	116	49%	0.486	58%	0.58	S	S	.	*	H	α-helix	trans	-66.7	-46	175.2	-74	-162.8	-1.6	0	0	112	H523 L524 F529 K530 T531	H523-Q527 PolarHBondContact NE2-NE2 3.04Å; H523-Q527 PolarHBondContact O-N 3.16Å; L524-Q527 PolarHBondContact O-N 3.44Å; Q527-F529 VanDerWaalsContact C-N 3.31Å; Q527-F529 PolarHBondContact O-N 2.68Å; Q527-K530 PolarHBondContact O-N 3.42Å; Q527-K530 VanDerWaalsContact O-N 3.14Å; Q527-T531 PolarHBondContact O-N 2.93Å; Q527-T531 PolarHBondContact O-OG1 2.99Å; Q527-T531 VanDerWaalsContact O-OG1 3.11Å
528	A	85.4	Confident	80.3	Confident	52 Å²	52	114.7 Å²	114.7	43%	0.43	58%	0.582	S	S	.	*	H	α-helix	trans	-57.9	-43.9	179.2	0	0	0	0	0	112	L524 R525 K530 T531 Q532	L524-A528 PolarHBondContact O-N 2.89Å; R525-A528 PolarHBondContact O-N 3.36Å; A528-K530 PolarHBondContact O-N 2.94Å; A528-T531 PolarHBondContact O-N 3.21Å; A528-Q532 PolarHBondContact O-N 3.47Å
529	F	81.6	Confident	79.7	Confident	151 Å²	151	113.9 Å²	113.9	66%	0.662	58%	0.577	S	S	*	*	H	α-helix	trans	-62.1	-41.8	176.3	-170.9	-96.5	0	0	0	112.5	R525 Q527 T531 Q532 S533	R525-F529 PolarHBondContact O-N 3.44Å; R525-F529 VanDerWaalsContact O-N 3.13Å; Q527-F529 VanDerWaalsContact C-N 3.31Å; Q527-F529 PolarHBondContact O-N 2.68Å; F529-T531 PolarHBondContact O-N 3.11Å; F529-Q532 PolarHBondContact O-N 3.36Å; F529-S533 PolarHBondContact O-N 3.29Å; F529-S533 PolarHBondContact O-OG 3.32Å
530	K	78.1	Confident	78.9	Confident	146 Å²	146	112.8 Å²	112.8	64%	0.635	57%	0.574	S	S	*	*	H	α-helix	trans	-63.6	-40.4	175.9	-77.7	-178.9	177.9	-178	0	112.4	K526 Q527 A528 S533 K534	K526-K530 WeakPolarHBondContact O-CG 3.49Å; K526-K530 PolarHBondContact O-N 2.92Å; Q527-K530 PolarHBondContact O-N 3.42Å; Q527-K530 VanDerWaalsContact O-N 3.14Å; A528-K530 PolarHBondContact O-N 2.94Å; K530-S533 WeakPolarHBondContact CA-OG 3.37Å; K530-S533 PolarHBondContact O-N 3.36Å; K530-S533 PolarHBondContact O-OG 3.37Å; K530-K534 PolarHBondContact O-N 3.41Å
531	T	73.8	Confident	78.2	Confident	85 Å²	85	115.9 Å²	115.9	52%	0.521	59%	0.59	S	S	.	*	H	α-helix	trans	-67.8	-41.5	179.3	-53.8	0	0	0	0	111.6	Q527 A528 F529 K534 M535	Q527-T531 PolarHBondContact O-N 2.93Å; Q527-T531 PolarHBondContact O-OG1 2.99Å; Q527-T531 VanDerWaalsContact O-OG1 3.11Å; A528-T531 PolarHBondContact O-N 3.21Å; F529-T531 PolarHBondContact O-N 3.11Å; T531-K534 PolarHBondContact O-N 3.44Å; T531-M535 PolarHBondContact O-N 2.84Å
532	Q	68.6	Low	77.5	Confident	122 Å²	122	119.6 Å²	119.6	57%	0.57	61%	0.61	S	S	*	*	H	α-helix	trans	-61.8	-46.8	173.9	-76.3	177.8	-16.9	0	0	111.7	A528 F529 K534 M535 E536	A528-Q532 PolarHBondContact O-N 3.47Å; F529-Q532 PolarHBondContact O-N 3.36Å; Q532-K534 PolarHBondContact O-N 2.84Å; Q532-K534 VanDerWaalsContact O-N 3.13Å; Q532-M535 PolarHBondContact O-N 3.32Å; Q532-E536 PolarHBondContact O-N 3.5Å; Q532-E536 VanDerWaalsContact O-N 3.13Å
533	S	67	Low	76.4	Confident	56 Å²	56	124.7 Å²	124.7	39%	0.392	63%	0.626	S	S	.	*	H	α-helix	trans	-61.5	-24.2	177.8	70.9	0	0	0	0	114.2	F529 K530	F529-S533 PolarHBondContact O-N 3.29Å; F529-S533 PolarHBondContact O-OG 3.32Å; K530-S533 WeakPolarHBondContact CA-OG 3.37Å; K530-S533 PolarHBondContact O-N 3.36Å; K530-S533 PolarHBondContact O-OG 3.37Å
534	K	65.2	Low	75.2	Confident	169 Å²	169	126 Å²	126	74%	0.735	64%	0.636	S	S	*	*	H	α-helix	trans	-85.8	-17.8	174.9	-87.2	-171.8	174.8	-174.1	0	114.2	K530 T531 Q532	K530-K534 PolarHBondContact O-N 3.41Å; T531-K534 PolarHBondContact O-N 3.44Å; Q532-K534 PolarHBondContact O-N 2.84Å; Q532-K534 VanDerWaalsContact O-N 3.13Å
535	M	61.9	Low	74	Confident	157 Å²	157	128 Å²	128	77%	0.773	65%	0.645	S	S	*	*	H	α-helix	trans	-89.7	-23	175.2	-73.4	-179	66.4	0	0	112	T531 Q532	T531-M535 PolarHBondContact O-N 2.84Å; Q532-M535 PolarHBondContact O-N 3.32Å
536	E	58.1	Low	72.6	Confident	169 Å²	169	124.2 Å²	124.2	79%	0.79	64%	0.644	S	S	*	*			trans	-88.2	-11.9	177.1	-67.5	178.6	165.6	0	0	113.7	Q532	Q532-E536 PolarHBondContact O-N 3.5Å; Q532-E536 VanDerWaalsContact O-N 3.13Å
537	A	52.3	Low	70.8	Confident	132 Å²	132	122.1 Å²	122.1	100%	1.091	64%	0.644	S	S	*	*			trans	-101.8	0	172.4	0	0	0	0	0	110.3

Retrieved 537 of 537 residues in 320.9 ms (Link to these results)

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