A0A060WFU3_ONCMY Loading...

FAM3 metabolism regulating signaling molecule A

AlphaFold DB , UniProt , Accession A0A060WFU3, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110491944, Length 229 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.3	Very low	62.1	Low	232 Å²	232	120.5 Å²	120.5	100%	1.143	65%	0.646	S	S	*	*				0	106.2	0	-68.3	156.5	85.4	0	0	107.4	L3	M1-L3 PolarHBondContact O-N 3.43Å
2	R	51.3	Low	63.5	Low	249 Å²	249	117.3 Å²	117.3	94%	0.94	63%	0.633	S	S	*	*			trans	-80.1	103.8	-165	-70.5	-175.3	175.7	-177.9	-0.8	110.4	A4	R2-A4 PolarHBondContact O-N 3.22Å
3	L	55.9	Low	64.8	Low	140 Å²	140	117.6 Å²	117.6	73%	0.733	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	34.1	-177.8	-135.1	85.7	0	0	0	114	M1	M1-L3 PolarHBondContact O-N 3.43Å
4	A	58.5	Low	66	Low	57 Å²	57	117.2 Å²	117.2	47%	0.471	63%	0.63	S	S	.	*	H	α-helix	trans	-95.2	-21	-170.3	0	0	0	0	0	114.2	R2 R8	R2-A4 PolarHBondContact O-N 3.22Å; A4-R8 WeakPolarHBondContact O-CG 3.46Å
5	G	59.2	Low	67.1	Low	53 Å²	53	116.7 Å²	116.7	55%	0.546	63%	0.627	S	S	.	*	H	α-helix	trans	-70.3	-53.9	176.7	0	0	0	0	0	114.2	M7 R8 A9	G5-M7 PolarHBondContact O-N 3.04Å; G5-R8 PolarHBondContact O-N 2.82Å; G5-A9 PolarHBondContact O-N 3.45Å
6	P	63.2	Low	68.1	Low	82 Å²	82	116.1 Å²	116.1	53%	0.532	62%	0.622	S	S	.	*	H	α-helix	trans	-69.6	-32.8	-174.9	24.2	-31.3	0	0	0	112.7	R8 A9 V10	P6-R8 VanDerWaalsContact C-N 3.33Å; P6-R8 PolarHBondContact O-N 2.86Å; P6-A9 PolarHBondContact O-N 3.3Å; P6-V10 WeakPolarHBondContact O-CG2 3.23Å; P6-V10 PolarHBondContact O-N 3.43Å; P6-V10 VanDerWaalsContact O-N 3.07Å
7	M	61.6	Low	68.9	Low	135 Å²	135	111.3 Å²	111.3	67%	0.665	61%	0.607	S	S	*	*	H	α-helix	trans	-63.1	-35.8	176.1	-89.3	-79.6	-80.8	0	0	113.2	G5 A11	G5-M7 PolarHBondContact O-N 3.04Å; M7-A11 WeakPolarHBondContact O-CB 3.41Å; M7-A11 PolarHBondContact O-N 3.15Å
8	R	63.1	Low	69.5	Low	194 Å²	194	110.8 Å²	110.8	73%	0.732	60%	0.603	S	S	*	*	H	α-helix	trans	-71.8	-38.3	177.4	-73.9	179.5	173.5	-171.6	-2.3	112	A4 G5 P6 A11 V12	A4-R8 WeakPolarHBondContact O-CG 3.46Å; G5-R8 PolarHBondContact O-N 2.82Å; P6-R8 VanDerWaalsContact C-N 3.33Å; P6-R8 PolarHBondContact O-N 2.86Å; R8-A11 PolarHBondContact O-N 2.82Å; R8-V12 WeakPolarHBondContact O-CG2 3.42Å; R8-V12 PolarHBondContact O-N 3.07Å
9	A	69.7	Low	70	Confident	56 Å²	56	109.2 Å²	109.2	46%	0.463	60%	0.597	S	S	.	*	H	α-helix	trans	-64.3	-42.4	175.9	0	0	0	0	0	111.6	G5 P6 V12 L13	G5-A9 PolarHBondContact O-N 3.45Å; P6-A9 PolarHBondContact O-N 3.3Å; A9-V12 PolarHBondContact O-N 3.26Å; A9-L13 WeakPolarHBondContact O-CG 3.48Å; A9-L13 PolarHBondContact O-N 2.76Å
10	V	76.6	Confident	70.3	Confident	80 Å²	80	113.6 Å²	113.6	49%	0.485	61%	0.605	S	S	.	*	H	α-helix	trans	-64.3	-41.6	176	175.9	0	0	0	0	111.3	P6 V12 L13 L14	P6-V10 WeakPolarHBondContact O-CG2 3.23Å; P6-V10 PolarHBondContact O-N 3.43Å; P6-V10 VanDerWaalsContact O-N 3.07Å; V10-V12 VanDerWaalsContact C-N 3.35Å; V10-V12 PolarHBondContact O-N 3.23Å; V10-L13 PolarHBondContact O-N 2.86Å; V10-L14 HydrophobicContact CG1-CD1 4.05Å; V10-L14 HydrophobicContact CG1-CG 4.42Å; V10-L14 WeakPolarHBondContact O-CG 3.32Å; V10-L14 PolarHBondContact O-N 3.36Å
11	A	76.3	Confident	70.7	Confident	48 Å²	48	112.4 Å²	112.4	40%	0.397	60%	0.601	S	S	.	*	H	α-helix	trans	-62	-40.1	176.9	0	0	0	0	0	112.8	M7 R8 L14 L15	M7-A11 WeakPolarHBondContact O-CB 3.41Å; M7-A11 PolarHBondContact O-N 3.15Å; R8-A11 PolarHBondContact O-N 2.82Å; A11-L14 PolarHBondContact O-N 2.96Å; A11-L15 WeakPolarHBondContact O-CG 3.39Å; A11-L15 PolarHBondContact O-N 3.07Å
12	V	79	Confident	72	Confident	81 Å²	81	106 Å²	106	49%	0.491	57%	0.571	S	S	.	*	H	α-helix	trans	-67.5	-41.8	177.5	173.1	0	0	0	0	111.3	R8 A9 V10 L14 L15 L16	R8-V12 WeakPolarHBondContact O-CG2 3.42Å; R8-V12 PolarHBondContact O-N 3.07Å; A9-V12 PolarHBondContact O-N 3.26Å; V10-V12 VanDerWaalsContact C-N 3.35Å; V10-V12 PolarHBondContact O-N 3.23Å; V12-L14 VanDerWaalsContact C-N 3.34Å; V12-L14 PolarHBondContact O-N 2.9Å; V12-L15 PolarHBondContact O-N 2.83Å; V12-L16 HydrophobicContact CG1-CD1 4.04Å; V12-L16 HydrophobicContact CG1-CG 4.48Å; V12-L16 WeakPolarHBondContact O-CG 3.46Å; V12-L16 PolarHBondContact O-N 2.74Å
13	L	80.2	Confident	72.9	Confident	122 Å²	122	96.3 Å²	96.3	64%	0.639	54%	0.544	S	S	*	.	H	α-helix	trans	-65.2	-37.7	177	-70.8	173	0	0	0	112.1	A9 V10 L16 G17	A9-L13 WeakPolarHBondContact O-CG 3.48Å; A9-L13 PolarHBondContact O-N 2.76Å; V10-L13 PolarHBondContact O-N 2.86Å; L13-L16 PolarHBondContact O-N 3.12Å; L13-G17 PolarHBondContact O-N 3.29Å
14	L	82.1	Confident	73.5	Confident	112 Å²	112	92.3 Å²	92.3	59%	0.586	53%	0.528	S	S	*	.	H	α-helix	trans	-66.4	-38.9	174.5	-72.3	173.6	0	0	0	112.1	V10 A11 V12 G17 L18	V10-L14 HydrophobicContact CG1-CD1 4.05Å; V10-L14 HydrophobicContact CG1-CG 4.42Å; V10-L14 WeakPolarHBondContact O-CG 3.32Å; V10-L14 PolarHBondContact O-N 3.36Å; A11-L14 PolarHBondContact O-N 2.96Å; V12-L14 VanDerWaalsContact C-N 3.34Å; V12-L14 PolarHBondContact O-N 2.9Å; L14-G17 PolarHBondContact O-N 2.97Å; L14-L18 WeakPolarHBondContact O-CB 3.29Å; L14-L18 PolarHBondContact O-N 2.94Å
15	L	82.6	Confident	74	Confident	110 Å²	110	93.4 Å²	93.4	58%	0.576	53%	0.532	S	S	*	.	H	α-helix	trans	-67.1	-40.2	175.6	-74.3	167.7	0	0	0	112.2	A11 V12 L18 T19	A11-L15 WeakPolarHBondContact O-CG 3.39Å; A11-L15 PolarHBondContact O-N 3.07Å; V12-L15 PolarHBondContact O-N 2.83Å; L15-L18 PolarHBondContact O-N 3.42Å; L15-T19 WeakPolarHBondContact O-CB 3.43Å; L15-T19 VanDerWaalsContact O-CG2 3.3Å; L15-T19 WeakPolarHBondContact O-CG2 3.33Å; L15-T19 PolarHBondContact O-N 2.62Å; L15-T19 PolarHBondContact O-OG1 3.36Å
16	L	83.2	Confident	74.2	Confident	106 Å²	106	97.3 Å²	97.3	56%	0.555	54%	0.539	S	S	*	.	H	α-helix	trans	-66.5	-39.2	174.4	-70.5	172.3	0	0	0	111.5	V12 L13 T19 W20	V12-L16 HydrophobicContact CG1-CD1 4.04Å; V12-L16 HydrophobicContact CG1-CG 4.48Å; V12-L16 WeakPolarHBondContact O-CG 3.46Å; V12-L16 PolarHBondContact O-N 2.74Å; L13-L16 PolarHBondContact O-N 3.12Å; L16-T19 WeakPolarHBondContact CA-OG1 3.42Å; L16-T19 PolarHBondContact O-OG1 3.12Å; L16-W20 VanDerWaalsContact O-CB 3.31Å; L16-W20 WeakPolarHBondContact O-CB 3.46Å; L16-W20 PolarHBondContact O-N 2.8Å
17	G	80.8	Confident	74.1	Confident	35 Å²	35	100 Å²	100	36%	0.361	55%	0.549	S	S	.	.	H	α-helix	trans	-63.6	-45.6	173.1	0	0	0	0	0	112.6	L13 L14 W20 V21	L13-G17 PolarHBondContact O-N 3.29Å; L14-G17 PolarHBondContact O-N 2.97Å; G17-W20 PolarHBondContact O-N 3.01Å; G17-V21 WeakPolarHBondContact O-CB 3.34Å; G17-V21 VanDerWaalsContact O-CG2 3.27Å; G17-V21 WeakPolarHBondContact O-CG2 3.45Å; G17-V21 PolarHBondContact O-N 3.49Å
18	L	81.2	Confident	73.7	Confident	103 Å²	103	96.7 Å²	96.7	54%	0.539	55%	0.548	S	S	.	.	H	α-helix	trans	-63.9	-42.9	177.3	-99.1	148.6	0	0	0	112.2	L14 L15 V21 L22	L14-L18 WeakPolarHBondContact O-CB 3.29Å; L14-L18 PolarHBondContact O-N 2.94Å; L15-L18 PolarHBondContact O-N 3.42Å; L18-V21 PolarHBondContact O-N 3.41Å; L18-L22 WeakPolarHBondContact O-CB 3.32Å; L18-L22 VanDerWaalsContact O-CG 3.25Å; L18-L22 WeakPolarHBondContact O-CG 3.37Å; L18-L22 PolarHBondContact O-N 2.8Å
19	T	78.9	Confident	73	Confident	80 Å²	80	89.8 Å²	89.8	49%	0.491	54%	0.538	S	S	.	.	H	α-helix	trans	-66.3	-38.1	176.3	49	0	0	0	0	111.7	L15 L16 A23	L15-T19 WeakPolarHBondContact O-CB 3.43Å; L15-T19 VanDerWaalsContact O-CG2 3.3Å; L15-T19 WeakPolarHBondContact O-CG2 3.33Å; L15-T19 PolarHBondContact O-N 2.62Å; L15-T19 PolarHBondContact O-OG1 3.36Å; L16-T19 WeakPolarHBondContact CA-OG1 3.42Å; L16-T19 PolarHBondContact O-OG1 3.12Å; T19-A23 WeakPolarHBondContact O-CB 3.08Å; T19-A23 PolarHBondContact O-N 2.95Å
20	W	74.8	Confident	72.1	Confident	197 Å²	197	92.7 Å²	92.7	75%	0.746	55%	0.545	S	S	*	.	H	α-helix	trans	-65.8	-44	173.3	-171.9	-86.8	0	0	0	112.4	L16 G17 A23 S24	L16-W20 VanDerWaalsContact O-CB 3.31Å; L16-W20 WeakPolarHBondContact O-CB 3.46Å; L16-W20 PolarHBondContact O-N 2.8Å; G17-W20 PolarHBondContact O-N 3.01Å; W20-A23 PolarHBondContact O-N 3.34Å; W20-S24 VanDerWaalsContact O-CB 3.28Å; W20-S24 WeakPolarHBondContact O-CB 3.49Å; W20-S24 PolarHBondContact O-N 3.45Å; W20-S24 PolarHBondContact O-OG 2.92Å
21	V	78.2	Confident	70.8	Confident	89 Å²	89	93.6 Å²	93.6	54%	0.539	56%	0.555	S	S	.	*	H	α-helix	trans	-63	-46.5	177.2	170.3	0	0	0	0	110.4	G17 L18 S24 S25	G17-V21 WeakPolarHBondContact O-CB 3.34Å; G17-V21 VanDerWaalsContact O-CG2 3.27Å; G17-V21 WeakPolarHBondContact O-CG2 3.45Å; G17-V21 PolarHBondContact O-N 3.49Å; L18-V21 PolarHBondContact O-N 3.41Å; V21-S24 WeakPolarHBondContact CA-OG 3.47Å; V21-S24 PolarHBondContact O-N 3.02Å; V21-S24 PolarHBondContact O-OG 3.23Å; V21-S25 PolarHBondContact O-N 3.01Å; V21-S25 PolarHBondContact O-OG 2.86Å
22	L	75.4	Confident	69.5	Low	97 Å²	97	94.7 Å²	94.7	51%	0.508	56%	0.56	S	S	.	*	H	α-helix	trans	-61	-45.8	175.8	-73.8	168.8	0	0	0	111.8	L18 S24 S25 I26	L18-L22 WeakPolarHBondContact O-CB 3.32Å; L18-L22 VanDerWaalsContact O-CG 3.25Å; L18-L22 WeakPolarHBondContact O-CG 3.37Å; L18-L22 PolarHBondContact O-N 2.8Å; L22-S24 VanDerWaalsContact C-N 3.32Å; L22-S24 PolarHBondContact O-N 3.41Å; L22-S25 WeakPolarHBondContact CA-OG 3.49Å; L22-S25 PolarHBondContact O-N 3.3Å; L22-S25 PolarHBondContact O-OG 2.87Å; L22-I26 VanDerWaalsContact O-CG1 3.25Å; L22-I26 WeakPolarHBondContact O-CG1 3.36Å; L22-I26 PolarHBondContact O-N 3.18Å
23	A	70.8	Confident	68.2	Low	45 Å²	45	93.8 Å²	93.8	37%	0.372	56%	0.557	S	S	.	*	H	α-helix	trans	-61.3	-41.5	175.6	0	0	0	0	0	111.5	T19 W20 I26 L27	T19-A23 WeakPolarHBondContact O-CB 3.08Å; T19-A23 PolarHBondContact O-N 2.95Å; W20-A23 PolarHBondContact O-N 3.34Å; A23-I26 PolarHBondContact O-N 3.45Å; A23-L27 WeakPolarHBondContact O-CB 3.43Å; A23-L27 WeakPolarHBondContact O-CD1 3.39Å; A23-L27 PolarHBondContact O-N 3.17Å
24	S	69.1	Low	66.6	Low	56 Å²	56	93.8 Å²	93.8	39%	0.392	56%	0.558	S	S	.	*	H	α-helix	trans	-71.5	-29.1	178.4	71.4	0	0	0	0	113.3	W20 V21 L22 G28	W20-S24 VanDerWaalsContact O-CB 3.28Å; W20-S24 WeakPolarHBondContact O-CB 3.49Å; W20-S24 PolarHBondContact O-N 3.45Å; W20-S24 PolarHBondContact O-OG 2.92Å; V21-S24 WeakPolarHBondContact CA-OG 3.47Å; V21-S24 PolarHBondContact O-N 3.02Å; V21-S24 PolarHBondContact O-OG 3.23Å; L22-S24 VanDerWaalsContact C-N 3.32Å; L22-S24 PolarHBondContact O-N 3.41Å; S24-G28 WeakPolarHBondContact O-CA 3.39Å; S24-G28 PolarHBondContact O-N 3.41Å
25	S	68.3	Low	65	Low	81 Å²	81	92.4 Å²	92.4	57%	0.566	55%	0.553	S	S	*	*	H	α-helix	trans	-73.5	-28	171.2	58	0	0	0	0	112.9	V21 L22	V21-S25 PolarHBondContact O-N 3.01Å; V21-S25 PolarHBondContact O-OG 2.86Å; L22-S25 WeakPolarHBondContact CA-OG 3.49Å; L22-S25 PolarHBondContact O-N 3.3Å; L22-S25 PolarHBondContact O-OG 2.87Å
26	I	63.5	Low	63.4	Low	135 Å²	135	94.7 Å²	94.7	69%	0.692	56%	0.559	S	S	*	*	H	α-helix	trans	-84.8	-34.2	177.8	-64.2	167.4	0	0	0	111.2	L22 A23	L22-I26 VanDerWaalsContact O-CG1 3.25Å; L22-I26 WeakPolarHBondContact O-CG1 3.36Å; L22-I26 PolarHBondContact O-N 3.18Å; A23-I26 PolarHBondContact O-N 3.45Å
27	L	60.2	Low	61.6	Low	139 Å²	139	97.1 Å²	97.1	73%	0.728	57%	0.567	S	S	*	*	H	α-helix	trans	-101.5	-10.1	-178.8	-83.1	91.5	0	0	0	114.9	A23	A23-L27 WeakPolarHBondContact O-CB 3.43Å; A23-L27 WeakPolarHBondContact O-CD1 3.39Å; A23-L27 PolarHBondContact O-N 3.17Å
28	G	53.9	Low	59.7	Low	64 Å²	64	104.5 Å²	104.5	66%	0.66	59%	0.589	S	S	*	*	S	Bend	trans	-92.1	0.8	-179.1	0	0	0	0	0	115	S24 D30	S24-G28 WeakPolarHBondContact O-CA 3.39Å; S24-G28 PolarHBondContact O-N 3.41Å; G28-D30 PolarHBondContact O-N 3.34Å
29	G	48.6	Very low	58	Low	49 Å²	49	107.6 Å²	107.6	51%	0.505	60%	0.599	S	S	.	*	S	Bend	trans	-87.8	95.8	171.5	0	0	0	0	0	110.8	S31	G29-S31 PolarHBondContact O-N 2.84Å; G29-S31 VanDerWaalsContact O-N 3.16Å
30	D	49.9	Very low	56.5	Low	117 Å²	117	108.2 Å²	108.2	63%	0.626	61%	0.606	S	S	*	*			trans	21.4	79.1	163.6	-145	-17.6	0	0	0	115.5	G28 S32 S33	G28-D30 PolarHBondContact O-N 3.34Å; D30-S32 PolarHBondContact O-N 3.29Å; D30-S32 PolarHBondContact OD1-OG 3.26Å; D30-S33 PolarHBondContact O-N 3.09Å
31	S	49.9	Very low	54.8	Low	99 Å²	99	101.6 Å²	101.6	69%	0.692	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	15.6	-178	-179.7	0	0	0	0	114.5	G29	G29-S31 PolarHBondContact O-N 2.84Å; G29-S31 VanDerWaalsContact O-N 3.16Å
32	S	49	Very low	52.9	Low	71 Å²	71	103 Å²	103	50%	0.497	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.7	-17.6	-177.2	71.1	0	0	0	0	114.1	D30	D30-S32 PolarHBondContact O-N 3.29Å; D30-S32 PolarHBondContact OD1-OG 3.26Å
33	S	51.3	Low	51.3	Low	62 Å²	62	106.3 Å²	106.3	43%	0.434	63%	0.627	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.9	-33	-175.8	84.5	0	0	0	0	115	D30 K36 H37	D30-S33 PolarHBondContact O-N 3.09Å; S33-K36 PolarHBondContact O-N 3.47Å; S33-H37 PolarHBondContact O-N 2.83Å; S33-H37 VanDerWaalsContact O-N 3.13Å
34	L	46.8	Very low	50	Low	123 Å²	123	111.6 Å²	111.6	64%	0.644	64%	0.643	S	S	*	*	H	α-helix	trans	-77.5	-31.1	-179.4	-82.4	162.9	0	0	0	113.5	K36 H37 F38	L34-K36 VanDerWaalsContact C-N 3.28Å; L34-K36 PolarHBondContact O-N 2.05Å; L34-H37 PolarHBondContact O-N 2.95Å; L34-F38 PolarHBondContact O-N 2.85Å
35	V	47.8	Very low	48.8	Very low	82 Å²	82	116.7 Å²	116.7	50%	0.497	66%	0.661	S	S	.	*	H	α-helix	trans	-70.2	-27.5	170.7	-175.8	0	0	0	0	110.6	F39	V35-F39 HydrophobicContact CG1-CD2 3.8Å; V35-F39 HydrophobicContact CG1-CE2 3.82Å; V35-F39 WeakPolarHBondContact O-CB 3.45Å; V35-F39 WeakPolarHBondContact O-CD2 3.4Å; V35-F39 PolarHBondContact O-N 3.26Å
36	K	49.2	Very low	47.6	Very low	159 Å²	159	118.6 Å²	118.6	69%	0.691	67%	0.672	S	S	*	*	H	α-helix	trans	-77.1	-29.6	173.2	-74.8	-178.5	179.5	175.7	0	112.9	S33 L34 S40	S33-K36 PolarHBondContact O-N 3.47Å; L34-K36 VanDerWaalsContact C-N 3.28Å; L34-K36 PolarHBondContact O-N 2.05Å; K36-S40 WeakPolarHBondContact O-CB 3.24Å; K36-S40 PolarHBondContact O-N 2.68Å
37	H	46.8	Very low	46.6	Very low	156 Å²	156	118 Å²	118	72%	0.722	67%	0.674	S	S	*	*	H	α-helix	trans	-83.6	-22.5	178.4	-94.1	-74.3	0	0	0	114.8	S33 L34	S33-H37 PolarHBondContact O-N 2.83Å; S33-H37 VanDerWaalsContact O-N 3.13Å; L34-H37 PolarHBondContact O-N 2.95Å
38	F	39.7	Very low	46	Very low	190 Å²	190	114.9 Å²	114.9	83%	0.833	67%	0.668	S	S	*	*	H	α-helix	trans	-85.4	-18.5	171.4	-130.8	-91.2	0	0	0	113.3	L34	L34-F38 PolarHBondContact O-N 2.85Å
39	F	46.2	Very low	45.5	Very low	169 Å²	169	120.5 Å²	120.5	74%	0.741	68%	0.678	S	S	*	*	S	Bend	trans	-103.7	11.2	177	-73.9	-95.6	0	0	0	113.7	V35	V35-F39 HydrophobicContact CG1-CD2 3.8Å; V35-F39 HydrophobicContact CG1-CE2 3.82Å; V35-F39 WeakPolarHBondContact O-CB 3.45Å; V35-F39 WeakPolarHBondContact O-CD2 3.4Å; V35-F39 PolarHBondContact O-N 3.26Å
40	S	46.8	Very low	45.4	Very low	93 Å²	93	123.6 Å²	123.6	65%	0.65	69%	0.687	S	S	*	*			trans	-104.9	43.3	170.7	-163.1	0	0	0	0	110.9	K36 T42	K36-S40 WeakPolarHBondContact O-CB 3.24Å; K36-S40 PolarHBondContact O-N 2.68Å; S40-T42 PolarHBondContact O-N 3.39Å
41	G	40.3	Very low	45.6	Very low	58 Å²	58	126.6 Å²	126.6	60%	0.598	69%	0.694	S	S	*	*	S	Bend	trans	-68.7	120.6	149.6	0	0	0	0	0	106.3	N43	G41-N43 PolarHBondContact O-N 2.83Å
42	T	36.9	Very low	46.1	Very low	119 Å²	119	126.7 Å²	126.7	73%	0.73	69%	0.692	S	S	*	*			trans	-20.5	118.9	169.5	41.5	0	0	0	0	112.4	S40 E44	S40-T42 PolarHBondContact O-N 3.39Å; T42-E44 PolarHBondContact O-N 2.92Å
43	N	43	Very low	46.6	Very low	166 Å²	166	133.4 Å²	133.4	89%	0.888	71%	0.707	S	S	*	*			trans	-60.9	75.6	144.7	-73.6	-35.4	0	0	0	105.9	G41 E45	G41-N43 PolarHBondContact O-N 2.83Å; N43-E45 PolarHBondContact O-N 2.91Å; N43-E45 VanDerWaalsContact O-N 3.14Å
44	E	42.1	Very low	48.1	Very low	155 Å²	155	140.7 Å²	140.7	72%	0.724	73%	0.725	S	S	*	*			trans	-54.9	109.4	130.7	-75.6	-174.2	159	0	0	102.1	T42 P46	T42-E44 PolarHBondContact O-N 2.92Å; E44-P46 VanDerWaalsContact O-N 3.12Å
45	E	45.2	Very low	50.3	Low	164 Å²	164	139.4 Å²	139.4	77%	0.766	71%	0.712	S	S	*	*			trans	-34	127.8	151	-93.1	178.6	138.2	0	0	105.3	N43 T47	N43-E45 PolarHBondContact O-N 2.91Å; N43-E45 VanDerWaalsContact O-N 3.14Å; E45-T47 PolarHBondContact O-N 3.46Å
46	P	42	Very low	52.6	Low	121 Å²	121	140.1 Å²	140.1	79%	0.786	71%	0.709	S	S	*	*			trans	-55.5	102.6	164.4	22.3	-26.4	0	0	0	102.5	E44 A48	E44-P46 VanDerWaalsContact O-N 3.12Å; P46-A48 WeakPolarHBondContact O-CA 3.23Å; P46-A48 PolarHBondContact O-N 2.83Å
47	T	42.9	Very low	54.8	Low	122 Å²	122	133.1 Å²	133.1	75%	0.748	68%	0.68	S	S	*	*			trans	-47.6	108.1	168.4	-27.2	0	0	0	0	99.4	E45 E49	E45-T47 PolarHBondContact O-N 3.46Å; T47-E49 PolarHBondContact O-N 2.94Å
48	A	48.3	Very low	57.1	Low	73 Å²	73	126.8 Å²	126.8	60%	0.603	66%	0.657	S	S	*	*			trans	-51.4	108.2	-175.5	0	0	0	0	0	101.8	P46 T50	P46-A48 WeakPolarHBondContact O-CA 3.23Å; P46-A48 PolarHBondContact O-N 2.83Å; A48-T50 WeakPolarHBondContact O-CA 3.46Å; A48-T50 PolarHBondContact O-N 3.29Å; A48-T50 PolarHBondContact O-OG1 3.21Å
49	E	41.9	Very low	59.7	Low	183 Å²	183	118.2 Å²	118.2	86%	0.855	62%	0.62	S	S	*	*			trans	-52.8	106.4	169.6	-96.8	-165.2	166.6	0	0	99.2	T47 K51	T47-E49 PolarHBondContact O-N 2.94Å; E49-K51 PolarHBondContact O-N 3.43Å
50	T	47.4	Very low	61.9	Low	114 Å²	114	115.4 Å²	115.4	70%	0.699	62%	0.621	S	S	*	*			trans	-74.8	86.5	-170.1	-54.1	0	0	0	0	98.3	A48 P52	A48-T50 WeakPolarHBondContact O-CA 3.46Å; A48-T50 PolarHBondContact O-N 3.29Å; A48-T50 PolarHBondContact O-OG1 3.21Å; T50-P52 WeakPolarHBondContact O-CA 3.31Å; T50-P52 WeakPolarHBondContact O-CD 3.22Å
51	K	55.2	Low	64.1	Low	179 Å²	179	113.4 Å²	113.4	78%	0.778	61%	0.61	S	S	*	*			trans	-45.3	108.5	169.7	-88.7	-174.7	178.3	177	0	100.3	E49 R53	E49-K51 PolarHBondContact O-N 3.43Å; K51-R53 PolarHBondContact O-N 2.75Å
52	P	58.9	Low	66.7	Low	101 Å²	101	114.4 Å²	114.4	66%	0.656	61%	0.606	S	S	*	*			trans	-53.2	119.8	-168.1	15.3	-28.2	0	0	0	103.3	T50 R54	T50-P52 WeakPolarHBondContact O-CA 3.31Å; T50-P52 WeakPolarHBondContact O-CD 3.22Å; P52-R54 VanDerWaalsContact C-N 3.25Å; P52-R54 WeakPolarHBondContact O-CA 3.17Å; P52-R54 WeakPolarHBondContact O-CG 3.29Å; P52-R54 PolarHBondContact O-N 2.86Å
53	R	60.1	Low	69.6	Low	213 Å²	213	110.4 Å²	110.4	80%	0.804	58%	0.582	S	S	*	*			trans	-53.8	103.2	-171.4	-81.5	-174.1	176	179.8	-0.2	104.6	K51 Y55	K51-R53 PolarHBondContact O-N 2.75Å; R53-Y55 WeakPolarHBondContact O-CD2 3.37Å; R53-Y55 PolarHBondContact O-N 3.2Å
54	R	81.8	Confident	72.1	Confident	215 Å²	215	106.3 Å²	106.3	81%	0.811	57%	0.565	S	S	*	*			trans	-69.7	111.2	-170.5	-77.3	-170.7	-178.8	-180	-0.8	104.1	P52	P52-R54 VanDerWaalsContact C-N 3.25Å; P52-R54 WeakPolarHBondContact O-CA 3.17Å; P52-R54 WeakPolarHBondContact O-CG 3.29Å; P52-R54 PolarHBondContact O-N 2.86Å
55	Y	94.2	Very high	74.5	Confident	95 Å²	95	107.4 Å²	107.4	37%	0.373	57%	0.57	S	S	.	*			trans	-66.2	175.7	173.9	-61	-76.2	0	0	0	108.8	R53 C57 G58 L59 S60 A61 P62	R53-Y55 WeakPolarHBondContact O-CD2 3.37Å; R53-Y55 PolarHBondContact O-N 3.2Å; Y55-C57 PolarHBondContact O-N 2.96Å; Y55-G58 VanDerWaalsContact O-CA 3.22Å; Y55-G58 WeakPolarHBondContact O-CA 3.43Å; Y55-G58 PolarHBondContact O-N 3.34Å; Y55-L59 WeakPolarHBondContact CD2-O 3.48Å; Y55-L59 PolarHBondContact N-O 3.49Å; Y55-S60 WeakPolarHBondContact CE2-O 3.13Å; Y55-A61 VanDerWaalsContact CD2-CA 3.48Å; Y55-P62 HydrophobicContact CD1-CB 3.68Å; Y55-P62 HydrophobicContact CD1-CG 4.28Å; Y55-P62 HydrophobicContact CE1-CB 3.75Å; Y55-P62 HydrophobicContact CE1-CG 3.88Å; Y55-P62 HydrophobicContact CG-CB 4.31Å
56	K	95.9	Very high	76.8	Confident	97 Å²	97	107.8 Å²	107.8	42%	0.422	57%	0.569	S	S	.	*	G	3₁₀ helix	trans	-48.5	138.9	-178.5	-65.4	180	178.3	175.8	0	111.2	G58 L59 A69 E87 D88	K56-G58 PolarHBondContact O-N 2.95Å; K56-L59 WeakPolarHBondContact O-CD1 3.41Å; K56-L59 PolarHBondContact O-N 3.1Å; K56-L59 VanDerWaalsContact O-N 3.16Å; K56-A69 HydrophobicContact CB-CB 3.71Å; K56-A69 HydrophobicContact CD-CB 4.43Å; K56-E87 WeakPolarHBondContact CD-OE2 3.44Å; K56-E87 IonicContact NZ-OE1 3.77Å; K56-E87 IonicContact NZ-OE2 3.84Å; K56-E87 PolarHBondContact NZ-OE2 3.05Å; K56-D88 VanDerWaalsContact CA-OD1 3.25Å; K56-D88 WeakPolarHBondContact CA-OD1 3.35Å; K56-D88 WeakPolarHBondContact CA-OD2 3.49Å; K56-D88 WeakPolarHBondContact CG-OD2 3.24Å
57	C	95.1	Very high	79.4	Confident	13 Å²	13	105 Å²	105	9%	0.088	55%	0.545	C	S	.	.	G	3₁₀ helix	trans	56.9	13.2	-173.1	-66	0	0	0	0	115.8	Y55 L59 R71 C85 L86 D88	Y55-C57 PolarHBondContact O-N 2.96Å; C57-L59 HydrophobicContact CB-CD1 3.83Å; C57-R71 HydrophobicContact CB-CB 3.9Å; C57-R71 PolarHBondContact O-NH1 3.08Å; C57-C85 WeakPolarHBondContact CA-SG 3.12Å; C57-C85 HydrophobicContact CB-CB 3.76Å; C57-C85 WeakPolarHBondContact CB-SG 3.36Å; C57-C85 WeakPolarHBondContact SG-CB 3.02Å; C57-C85 CovalentContact SG-SG 2.05Å; C57-C85 PolarHBondContact SG-SG 2.93Å; C57-L86 PolarHBondContact SG-N 2.91Å; C57-D88 PolarHBondContact N-OD1 2.66Å; C57-D88 PolarHBondContact SG-N 2.97Å
58	G	94.6	Very high	81.9	Confident	23 Å²	23	99.7 Å²	99.7	24%	0.237	51%	0.512	C	S	.	.	G	3₁₀ helix	trans	77.5	21	-176.1	0	0	0	0	0	114.4	Y55 K56 R71	Y55-G58 VanDerWaalsContact O-CA 3.22Å; Y55-G58 WeakPolarHBondContact O-CA 3.43Å; Y55-G58 PolarHBondContact O-N 3.34Å; K56-G58 PolarHBondContact O-N 2.95Å; G58-R71 VanDerWaalsContact CA-NH1 3.29Å; G58-R71 VanDerWaalsContact O-CZ 3.22Å; G58-R71 PolarHBondContact O-NH1 2.64Å; G58-R71 PolarHBondContact O-NH2 3.41Å
59	L	95	Very high	84.3	Confident	10 Å²	10	96.3 Å²	96.3	5%	0.052	49%	0.485	C	S	.	.			trans	-56.1	153.9	176.6	-91.4	65.9	0	0	0	111.3	Y55 K56 C57 A61 A69 F70 D218	Y55-L59 WeakPolarHBondContact CD2-O 3.48Å; Y55-L59 PolarHBondContact N-O 3.49Å; K56-L59 WeakPolarHBondContact O-CD1 3.41Å; K56-L59 PolarHBondContact O-N 3.1Å; K56-L59 VanDerWaalsContact O-N 3.16Å; C57-L59 HydrophobicContact CB-CD1 3.83Å; L59-A61 WeakPolarHBondContact CB-O 3.38Å; L59-A69 HydrophobicContact CD2-CB 4.1Å; L59-F70 WeakPolarHBondContact CD1-O 3.41Å; L59-D218 HydrophobicContact CD1-CB 3.91Å; L59-D218 HydrophobicContact CG-CB 4.2Å
60	S	92.5	Very high	87	Confident	109 Å²	109	87.6 Å²	87.6	76%	0.762	44%	0.444	S	S	*	.	S	Bend	trans	-76.4	-23.5	177.9	57	0	0	0	0	113.3	Y55	Y55-S60 WeakPolarHBondContact CE2-O 3.13Å
61	A	93.4	Very high	89.4	Confident	51 Å²	51	84.4 Å²	84.4	42%	0.421	42%	0.419	S	S	.	.	S	Bend	trans	-139	157.1	-179.7	0	0	0	0	0	110.6	Y55 L59	Y55-A61 VanDerWaalsContact CD2-CA 3.48Å; L59-A61 WeakPolarHBondContact CB-O 3.38Å
62	P	95.1	Very high	91.5	Very high	80 Å²	80	75.9 Å²	75.9	52%	0.519	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-73.7	146.4	176	30.5	-30.9	0	0	0	110.8	Y55	Y55-P62 HydrophobicContact CD1-CB 3.68Å; Y55-P62 HydrophobicContact CD1-CG 4.28Å; Y55-P62 HydrophobicContact CE1-CB 3.75Å; Y55-P62 HydrophobicContact CE1-CG 3.88Å; Y55-P62 HydrophobicContact CG-CB 4.31Å
63	C	96.3	Very high	93.4	Very high	34 Å²	34	72.6 Å²	72.6	23%	0.23	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-71.6	149.7	171.2	-70.9	0	0	0	0	112	H67 A69 C220	C63-H67 HydrophobicContact CB-CB 4.15Å; C63-A69 VanDerWaalsContact SG-CA 3.54Å; C63-A69 VanDerWaalsContact SG-CB 3.52Å; C63-C220 WeakPolarHBondContact CA-SG 3.01Å; C63-C220 HydrophobicContact CB-CB 3.74Å; C63-C220 WeakPolarHBondContact CB-SG 3.47Å; C63-C220 WeakPolarHBondContact SG-CB 3.43Å; C63-C220 CovalentContact SG-SG 2.03Å; C63-C220 PolarHBondContact SG-SG 2.91Å
64	P	96.2	Very high	95.2	Very high	80 Å²	80	62.6 Å²	62.6	52%	0.519	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-58.9	165.6	171.1	-20.5	32.2	0	0	0	112.3	H67	P64-H67 WeakPolarHBondContact O-CB 3.44Å; P64-H67 PolarHBondContact O-N 2.85Å
65	Q	93.1	Very high	96	Very high	178 Å²	178	52.6 Å²	52.6	83%	0.832	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	148.8	173.4	-67.6	-171.7	-17.6	0	0	111.2	H67	Q65-H67 PolarHBondContact O-N 2.03Å; Q65-H67 PolarHBondContact O-ND1 2.98Å
66	K	92.8	Very high	96.2	Very high	173 Å²	173	48.6 Å²	48.6	75%	0.752	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	32.1	-178	-54.5	-179.1	178	-178.2	0	114	L223	K66-L223 WeakPolarHBondContact O-CB 3.42Å; K66-L223 PolarHBondContact O-N 3.07Å
67	H	96.1	Very high	96.2	Very high	61 Å²	61	44.5 Å²	44.5	28%	0.282	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	150.3	171.7	-69.5	62.8	0	0	0	110.9	C63 P64 Q65 C220 I221	C63-H67 HydrophobicContact CB-CB 4.15Å; P64-H67 WeakPolarHBondContact O-CB 3.44Å; P64-H67 PolarHBondContact O-N 2.85Å; Q65-H67 PolarHBondContact O-N 2.03Å; Q65-H67 PolarHBondContact O-ND1 2.98Å; H67-C220 HydrophobicContact CB-CB 4.03Å; H67-I221 CarbonylContact C-O 3.57Å; H67-I221 WeakPolarHBondContact CA-O 3.25Å
68	L	96.9	Very high	96.3	Very high	11 Å²	11	48 Å²	48	6%	0.058	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	124	172.2	-61.1	172.6	0	0	0	109.9	L86 E87 L143 C220 I221 L223	L68-L86 HydrophobicContact CB-CD1 3.91Å; L68-L86 HydrophobicContact CD1-CD1 4.45Å; L68-E87 WeakPolarHBondContact CA-OE1 3.5Å; L68-E87 HydrophobicContact CB-CG 4.41Å; L68-E87 HydrophobicContact CD2-CG 3.6Å; L68-L143 HydrophobicContact CD1-CD1 4Å; L68-C220 CarbonylContact O-C 3.59Å; L68-C220 VanDerWaalsContact O-CA 3.31Å; L68-C220 WeakPolarHBondContact O-CA 3.3Å; L68-I221 PolarHBondContact N-O 2.88Å; L68-I221 PolarHBondContact O-N 2.87Å; L68-L223 HydrophobicContact CD1-CD2 3.58Å; L68-L223 HydrophobicContact CD2-CD2 3.83Å; L68-L223 HydrophobicContact CD2-CG 4.38Å; L68-L223 HydrophobicContact CG-CD2 3.53Å; L68-L223 HydrophobicContact CG-CG 4.04Å
69	A	97.9	Very high	96.4	Very high	3 Å²	3	52.6 Å²	52.6	3%	0.025	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	130.6	172.5	0	0	0	0	0	110.4	K56 L59 C63 L86 E87	K56-A69 HydrophobicContact CB-CB 3.71Å; K56-A69 HydrophobicContact CD-CB 4.43Å; L59-A69 HydrophobicContact CD2-CB 4.1Å; C63-A69 VanDerWaalsContact SG-CA 3.54Å; C63-A69 VanDerWaalsContact SG-CB 3.52Å; A69-L86 CarbonylContact O-C 3.6Å; A69-L86 WeakPolarHBondContact O-CA 3.47Å; A69-E87 WeakPolarHBondContact CB-OE1 3.27Å; A69-E87 PolarHBondContact N-OE1 2.79Å; A69-E87 PolarHBondContact O-N 2.9Å
70	F	98.4	Very high	96.5	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	155.9	176.3	76.7	-90.8	0	0	0	112	L59 L72 C85 L86 F145 V184 F195 M217 D218 G219 I221	L59-F70 WeakPolarHBondContact CD1-O 3.41Å; F70-L72 HydrophobicContact CD2-CD1 3.5Å; F70-L72 VanDerWaalsContact CD2-CD1 3.5Å; F70-L72 HydrophobicContact CE2-CD1 4.09Å; F70-L72 HydrophobicContact CG-CD1 4.44Å; F70-C85 CarbonylContact C-O 3.46Å; F70-C85 VanDerWaalsContact CA-O 3.23Å; F70-C85 WeakPolarHBondContact CA-O 3.35Å; F70-C85 WeakPolarHBondContact CB-O 3.46Å; F70-L86 HydrophobicContact CB-CD1 4Å; F70-F145 HydrophobicContact CB-CE1 3.75Å; F70-F145 HydrophobicContact CB-CZ 4.49Å; F70-F145 HydrophobicContact CD1-CE1 4.44Å; F70-F145 HydrophobicContact CD2-CE1 4.28Å; F70-F145 AromaticContact CG-CE1 3.9Å; F70-F145 HydrophobicContact CG-CE1 3.9Å; F70-V184 HydrophobicContact CD2-CG2 4.15Å; F70-V184 HydrophobicContact CE2-CG2 3.78Å; F70-V184 HydrophobicContact CZ-CG2 4.07Å; F70-F195 AromaticContact CE1-CD1 3.88Å; F70-F195 HydrophobicContact CE1-CD1 3.88Å; F70-F195 HydrophobicContact CE1-CD2 4.26Å; F70-F195 AromaticContact CE1-CE1 3.89Å; F70-F195 HydrophobicContact CE1-CE1 3.89Å; F70-F195 HydrophobicContact CE1-CE2 4.29Å; F70-F195 HydrophobicContact CE1-CG 4.06Å; F70-F195 HydrophobicContact CE1-CZ 4.1Å; F70-F195 HydrophobicContact CZ-CB 4.1Å; F70-F195 AromaticContact CZ-CD1 3.52Å; F70-F195 HydrophobicContact CZ-CD1 3.52Å; F70-F195 HydrophobicContact CZ-CD2 4.35Å; F70-F195 AromaticContact CZ-CE1 3.98Å; F70-F195 HydrophobicContact CZ-CE1 3.98Å; F70-F195 AromaticContact CZ-CG 3.73Å; F70-F195 HydrophobicContact CZ-CG 3.73Å; F70-M217 HydrophobicContact CE2-CE 4.22Å; F70-M217 HydrophobicContact CE2-CG 4.33Å; F70-D218 VanDerWaalsContact O-CA 3.27Å; F70-D218 WeakPolarHBondContact O-CA 3.22Å; F70-D218 VanDerWaalsContact O-CB 3.27Å; F70-D218 WeakPolarHBondContact O-CB 3.45Å; F70-G219 WeakPolarHBondContact CD1-O 3.47Å; F70-G219 VanDerWaalsContact CE1-C 3.41Å; F70-G219 PolarHBondContact N-O 3.07Å; F70-G219 PolarHBondContact O-N 3.37Å; F70-G219 VanDerWaalsContact O-N 3.13Å; F70-I221 HydrophobicContact CD1-CD1 3.43Å; F70-I221 VanDerWaalsContact CD1-CD1 3.43Å; F70-I221 HydrophobicContact CD1-CG1 3.57Å; F70-I221 HydrophobicContact CE1-CD1 3.84Å; F70-I221 HydrophobicContact CE1-CG1 3.62Å; F70-I221 HydrophobicContact CG-CD1 4.13Å
71	R	98.5	Very high	96.7	Very high	47 Å²	47	52.5 Å²	52.5	18%	0.177	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	127.9	166.3	177.9	170.4	-76.7	164.2	-13.4	110.6	C57 G58 V73 C85 E216 M217 D218	C57-R71 HydrophobicContact CB-CB 3.9Å; C57-R71 PolarHBondContact O-NH1 3.08Å; G58-R71 VanDerWaalsContact CA-NH1 3.29Å; G58-R71 VanDerWaalsContact O-CZ 3.22Å; G58-R71 PolarHBondContact O-NH1 2.64Å; G58-R71 PolarHBondContact O-NH2 3.41Å; R71-V73 HydrophobicContact CG-CG2 4.4Å; R71-C85 HydrophobicContact CB-CB 4.43Å; R71-C85 PolarHBondContact N-O 3.27Å; R71-C85 PolarHBondContact O-N 2.81Å; R71-E216 WeakPolarHBondContact CD-OE1 3.34Å; R71-E216 HydrophobicContact CG-CG 4.34Å; R71-E216 IonicContact CZ-OE1 2.7Å; R71-E216 IonicContact NE-OE1 3.16Å; R71-E216 PolarHBondContact NE-OE1 3.07Å; R71-E216 IonicContact NH1-OE1 2.81Å; R71-E216 IonicContact NH2-OE1 3.84Å; R71-M217 WeakPolarHBondContact CA-O 3.49Å; R71-D218 HydrophobicContact CB-CB 3.99Å; R71-D218 HydrophobicContact CG-CB 4.15Å; R71-D218 IonicContact CZ-OD2 3.35Å; R71-D218 IonicContact NE-OD2 2.99Å; R71-D218 PolarHBondContact NE-OD2 3.41Å; R71-D218 IonicContact NH2-OD2 3.79Å; R71-D218 PolarHBondContact NH2-OD2 3.06Å
72	L	98.4	Very high	97	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	135.2	177.8	-91.2	66.2	0	0	0	109.1	F70 K83 I84 F145 V146 V182 F183 V184 E216 M217	F70-L72 HydrophobicContact CD2-CD1 3.5Å; F70-L72 VanDerWaalsContact CD2-CD1 3.5Å; F70-L72 HydrophobicContact CE2-CD1 4.09Å; F70-L72 HydrophobicContact CG-CD1 4.44Å; L72-K83 CarbonylContact C-O 3.59Å; L72-K83 WeakPolarHBondContact CA-O 3.04Å; L72-I84 HydrophobicContact CD1-CG2 4.09Å; L72-I84 HydrophobicContact CG-CG1 4.36Å; L72-F145 HydrophobicContact CD1-CB 4.47Å; L72-F145 HydrophobicContact CD1-CD1 3.57Å; L72-F145 HydrophobicContact CD1-CE1 4.3Å; L72-F145 HydrophobicContact CD1-CG 4.47Å; L72-V146 WeakPolarHBondContact CD2-O 3.26Å; L72-V182 HydrophobicContact CB-CB 4.17Å; L72-V182 HydrophobicContact CB-CG1 4.18Å; L72-V182 HydrophobicContact CD2-CB 4.18Å; L72-F183 WeakPolarHBondContact CD2-O 3.4Å; L72-V184 HydrophobicContact CD1-CG2 4.1Å; L72-V184 HydrophobicContact CD2-CG2 3.78Å; L72-E216 CarbonylContact O-C 3.55Å; L72-E216 WeakPolarHBondContact O-CA 3.23Å; L72-M217 HydrophobicContact CD2-CE 4.36Å; L72-M217 PolarHBondContact N-O 3Å; L72-M217 PolarHBondContact O-N 3.18Å
73	V	98.6	Very high	97.1	Very high	32 Å²	32	51.1 Å²	51.1	19%	0.194	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	125.8	171	-168.6	0	0	0	0	107.4	R71 P82 K83 L215 E216	R71-V73 HydrophobicContact CG-CG2 4.4Å; V73-P82 CarbonylContact O-C 3.52Å; V73-P82 VanDerWaalsContact O-CA 3.27Å; V73-P82 WeakPolarHBondContact O-CA 3.37Å; V73-P82 WeakPolarHBondContact O-CB 3.48Å; V73-K83 HydrophobicContact CB-CB 4.16Å; V73-K83 HydrophobicContact CG2-CB 4.36Å; V73-K83 PolarHBondContact N-O 3.23Å; V73-K83 PolarHBondContact O-N 3.23Å; V73-L215 CarbonylContact C-O 3.52Å; V73-L215 VanDerWaalsContact CA-O 3.26Å; V73-L215 WeakPolarHBondContact CA-O 3.23Å; V73-E216 HydrophobicContact CG2-CB 4.49Å; V73-E216 HydrophobicContact CG2-CG 4.13Å
74	S	98.6	Very high	97.3	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.014	26%	0.256	C	S	.	.			trans	-68.4	172.1	171.7	70.3	0	0	0	0	110.6	S214 L215	S74-S214 PolarHBondContact O-OG 3.25Å; S74-S214 WeakPolarHBondContact OG-CA 3.41Å; S74-S214 PolarHBondContact OG-OG 3.36Å; S74-L215 PolarHBondContact N-O 3.16Å; S74-L215 PolarHBondContact OG-N 3.32Å
75	G	98.2	Very high	97.4	Very high	5 Å²	5	45.9 Å²	45.9	5%	0.052	23%	0.232	C	C	.	.			trans	-69.5	155.4	169.1	0	0	0	0	0	111.9	I80 S148	G75-I80 CarbonylContact C-O 3.54Å; G75-I80 WeakPolarHBondContact CA-O 3.45Å; G75-S148 PolarHBondContact N-O 3.34Å
76	A	97.8	Very high	97.6	Very high	11 Å²	11	37.7 Å²	37.7	9%	0.091	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-102	108.5	168.4	0	0	0	0	0	109.1	N78 V79 I80 Y208	A76-N78 PolarHBondContact O-N 3.4Å; A76-V79 PolarHBondContact O-N 2.95Å; A76-I80 HydrophobicContact CB-CB 3.97Å; A76-I80 HydrophobicContact CB-CD1 4.31Å; A76-I80 HydrophobicContact CB-CG1 4.42Å; A76-I80 PolarHBondContact N-O 3.11Å; A76-I80 PolarHBondContact O-N 3.38Å; A76-Y208 HydrophobicContact CB-CE2 4.08Å
77	A	96.8	Very high	97.8	Very high	11 Å²	11	31.7 Å²	31.7	9%	0.091	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.8	-129.8	-169.4	0	0	0	0	0	111	F149 D150 Y208 W211	A77-F149 WeakPolarHBondContact O-CD2 3.3Å; A77-F149 WeakPolarHBondContact O-CE2 3.33Å; A77-D150 WeakPolarHBondContact O-CA 3.43Å; A77-D150 PolarHBondContact O-N 2.93Å; A77-Y208 HydrophobicContact CB-CD2 4.37Å; A77-Y208 HydrophobicContact CB-CG 4.45Å; A77-W211 HydrophobicContact CB-CB 3.96Å; A77-W211 HydrophobicContact CB-CD2 3.78Å; A77-W211 HydrophobicContact CB-CE3 4.1Å; A77-W211 HydrophobicContact CB-CG 3.74Å
78	N	96.4	Very high	97.8	Very high	88 Å²	88	33.4 Å²	33.4	47%	0.471	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	12.5	175.2	65.9	-23.6	0	0	0	113.1	A76 D150 W211	A76-N78 PolarHBondContact O-N 3.4Å; N78-D150 HydrophobicContact CB-CB 4Å; N78-W211 HydrophobicContact CB-CZ2 4.33Å
79	V	96.4	Very high	97.8	Very high	119 Å²	119	39.8 Å²	39.8	72%	0.721	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.4	-47.2	-170.8	-175.4	0	0	0	0	111.7	A76	A76-V79 PolarHBondContact O-N 2.95Å
80	I	97.4	Very high	97.9	Very high	108 Å²	108	42.3 Å²	42.3	55%	0.554	22%	0.22	S	C	*	.	B	Isolated β-bridge	trans	-107	114.6	-179.1	-54.7	176.5	0	0	0	107.8	G75 A76 F149	G75-I80 CarbonylContact C-O 3.54Å; G75-I80 WeakPolarHBondContact CA-O 3.45Å; A76-I80 HydrophobicContact CB-CB 3.97Å; A76-I80 HydrophobicContact CB-CD1 4.31Å; A76-I80 HydrophobicContact CB-CG1 4.42Å; A76-I80 PolarHBondContact N-O 3.11Å; A76-I80 PolarHBondContact O-N 3.38Å; I80-F149 WeakPolarHBondContact O-CE2 3.36Å
81	G	98	Very high	97.9	Very high	9 Å²	9	43 Å²	43	9%	0.093	22%	0.223	C	C	.	.			trans	-66.7	161	176.1	0	0	0	0	0	113.3	S94	G81-S94 WeakPolarHBondContact CA-OG 3.46Å; G81-S94 PolarHBondContact N-OG 3.21Å
82	P	98.5	Very high	97.9	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.006	22%	0.215	C	C	.	.			trans	-71.4	167.2	-177.2	29.4	-34.2	0	0	0	111.9	V73 S93 V99 N104 A147 F149	V73-P82 CarbonylContact O-C 3.52Å; V73-P82 VanDerWaalsContact O-CA 3.27Å; V73-P82 WeakPolarHBondContact O-CA 3.37Å; V73-P82 WeakPolarHBondContact O-CB 3.48Å; P82-S93 WeakPolarHBondContact O-CA 3.39Å; P82-V99 HydrophobicContact CG-CG1 4.22Å; P82-N104 HydrophobicContact CG-CB 3.94Å; P82-N104 WeakPolarHBondContact CG-ND2 3.31Å; P82-A147 HydrophobicContact CB-CB 3.65Å; P82-A147 HydrophobicContact CG-CB 4.43Å; P82-F149 HydrophobicContact CG-CB 4.13Å
83	K	98.6	Very high	97.8	Very high	100 Å²	100	41.4 Å²	41.4	44%	0.435	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	128.8	176.9	-172.9	179.4	177.2	-177.2	0	110.9	L72 V73 V92	L72-K83 CarbonylContact C-O 3.59Å; L72-K83 WeakPolarHBondContact CA-O 3.04Å; V73-K83 HydrophobicContact CB-CB 4.16Å; V73-K83 HydrophobicContact CG2-CB 4.36Å; V73-K83 PolarHBondContact N-O 3.23Å; V73-K83 PolarHBondContact O-N 3.23Å; K83-V92 CarbonylContact C-O 3.55Å; K83-V92 VanDerWaalsContact CA-O 3.31Å; K83-V92 WeakPolarHBondContact CA-O 3.4Å
84	I	98.8	Very high	97.8	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	119	172.2	-56.4	-179.6	0	0	0	108	L72 L91 V92 A106 F145 A147	L72-I84 HydrophobicContact CD1-CG2 4.09Å; L72-I84 HydrophobicContact CG-CG1 4.36Å; I84-L91 HydrophobicContact CG2-CB 4.36Å; I84-L91 HydrophobicContact CG2-CD1 4.33Å; I84-L91 PolarHBondContact O-N 2.91Å; I84-V92 HydrophobicContact CB-CB 3.93Å; I84-V92 HydrophobicContact CB-CG2 4.31Å; I84-V92 HydrophobicContact CD1-CB 4.09Å; I84-V92 HydrophobicContact CD1-CG2 3.97Å; I84-V92 HydrophobicContact CG1-CB 3.97Å; I84-V92 HydrophobicContact CG1-CG2 4.35Å; I84-V92 PolarHBondContact N-O 3.46Å; I84-V92 PolarHBondContact O-N 2.82Å; I84-A106 HydrophobicContact CD1-CB 4.27Å; I84-A106 HydrophobicContact CG2-CB 4.34Å; I84-F145 HydrophobicContact CD1-CB 4.22Å; I84-F145 HydrophobicContact CG2-CB 4Å; I84-F145 HydrophobicContact CG2-CG 4.34Å; I84-A147 HydrophobicContact CD1-CB 4.24Å; I84-A147 HydrophobicContact CG1-CB 4.13Å
85	C	98.6	Very high	97.6	Very high	5 Å²	5	48.6 Å²	48.6	3%	0.034	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	136.6	174	-177.9	0	0	0	0	110.2	C57 F70 R71 K89 I90	C57-C85 WeakPolarHBondContact CA-SG 3.12Å; C57-C85 HydrophobicContact CB-CB 3.76Å; C57-C85 WeakPolarHBondContact CB-SG 3.36Å; C57-C85 WeakPolarHBondContact SG-CB 3.02Å; C57-C85 CovalentContact SG-SG 2.05Å; C57-C85 PolarHBondContact SG-SG 2.93Å; F70-C85 CarbonylContact C-O 3.46Å; F70-C85 VanDerWaalsContact CA-O 3.23Å; F70-C85 WeakPolarHBondContact CA-O 3.35Å; F70-C85 WeakPolarHBondContact CB-O 3.46Å; R71-C85 HydrophobicContact CB-CB 4.43Å; R71-C85 PolarHBondContact N-O 3.27Å; R71-C85 PolarHBondContact O-N 2.81Å; C85-K89 WeakPolarHBondContact CA-O 3.47Å; C85-I90 HydrophobicContact CB-CD1 3.73Å
86	L	98.4	Very high	97.5	Very high	5 Å²	5	53.9 Å²	53.9	3%	0.026	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	127.5	171.6	-177.8	72.7	0	0	0	109	C57 L68 A69 F70 D88 K89 L91 V108 F145	C57-L86 PolarHBondContact SG-N 2.91Å; L68-L86 HydrophobicContact CB-CD1 3.91Å; L68-L86 HydrophobicContact CD1-CD1 4.45Å; A69-L86 CarbonylContact O-C 3.6Å; A69-L86 WeakPolarHBondContact O-CA 3.47Å; F70-L86 HydrophobicContact CB-CD1 4Å; L86-D88 VanDerWaalsContact C-N 3.3Å; L86-D88 PolarHBondContact O-N 3.45Å; L86-K89 PolarHBondContact N-O 3.48Å; L86-K89 WeakPolarHBondContact O-CA 3.23Å; L86-K89 WeakPolarHBondContact O-CB 3.46Å; L86-K89 PolarHBondContact O-N 3.04Å; L86-L91 HydrophobicContact CB-CD1 3.73Å; L86-L91 HydrophobicContact CB-CG 4.2Å; L86-L91 HydrophobicContact CD2-CD1 4.25Å; L86-V108 HydrophobicContact CD2-CB 4.23Å; L86-V108 HydrophobicContact CD2-CG1 3.5Å; L86-V108 HydrophobicContact CD2-CG2 3.77Å; L86-F145 HydrophobicContact CD1-CE1 4.32Å; L86-F145 HydrophobicContact CD1-CE2 4.49Å; L86-F145 HydrophobicContact CD1-CZ 3.74Å; L86-F145 HydrophobicContact CD2-CE2 4.5Å
87	E	96.7	Very high	97.5	Very high	47 Å²	47	60.5 Å²	60.5	22%	0.22	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	47.8	176.6	-69.5	-67.2	105.6	0	0	113.1	K56 L68 A69 K89	K56-E87 WeakPolarHBondContact CD-OE2 3.44Å; K56-E87 IonicContact NZ-OE1 3.77Å; K56-E87 IonicContact NZ-OE2 3.84Å; K56-E87 PolarHBondContact NZ-OE2 3.05Å; L68-E87 WeakPolarHBondContact CA-OE1 3.5Å; L68-E87 HydrophobicContact CB-CG 4.41Å; L68-E87 HydrophobicContact CD2-CG 3.6Å; A69-E87 WeakPolarHBondContact CB-OE1 3.27Å; A69-E87 PolarHBondContact N-OE1 2.79Å; A69-E87 PolarHBondContact O-N 2.9Å; E87-K89 PolarHBondContact O-N 2.84Å; E87-K89 VanDerWaalsContact O-N 3.07Å
88	D	96.3	Very high	97.5	Very high	98 Å²	98	61.9 Å²	61.9	52%	0.524	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.1	0.6	-173.6	-86.1	-30.5	0	0	0	116.5	K56 C57 L86	K56-D88 VanDerWaalsContact CA-OD1 3.25Å; K56-D88 WeakPolarHBondContact CA-OD1 3.35Å; K56-D88 WeakPolarHBondContact CA-OD2 3.49Å; K56-D88 WeakPolarHBondContact CG-OD2 3.24Å; C57-D88 PolarHBondContact N-OD1 2.66Å; C57-D88 PolarHBondContact SG-N 2.97Å; L86-D88 VanDerWaalsContact C-N 3.3Å; L86-D88 PolarHBondContact O-N 3.45Å
89	K	97.5	Very high	97.6	Very high	145 Å²	145	59.5 Å²	59.5	63%	0.63	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.1	121.5	176.3	-60.8	174.1	-174.9	173	0	109.5	C85 L86 E87 L91	C85-K89 WeakPolarHBondContact CA-O 3.47Å; L86-K89 PolarHBondContact N-O 3.48Å; L86-K89 WeakPolarHBondContact O-CA 3.23Å; L86-K89 WeakPolarHBondContact O-CB 3.46Å; L86-K89 PolarHBondContact O-N 3.04Å; E87-K89 PolarHBondContact O-N 2.84Å; E87-K89 VanDerWaalsContact O-N 3.07Å; K89-L91 HydrophobicContact CB-CD2 4.22Å; K89-L91 PolarHBondContact O-N 3.13Å
90	I	98.2	Very high	97.7	Very high	56 Å²	56	54.7 Å²	54.7	29%	0.287	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	111.7	170.6	-53.7	-51.4	0	0	0	108.4	C85 S93 K96	C85-I90 HydrophobicContact CB-CD1 3.73Å; I90-S93 WeakPolarHBondContact CG2-OG 3.36Å; I90-K96 HydrophobicContact CB-CD 4.32Å; I90-K96 HydrophobicContact CG2-CD 3.99Å; I90-K96 WeakPolarHBondContact O-CD 3.22Å; I90-K96 VanDerWaalsContact O-CE 3.29Å; I90-K96 WeakPolarHBondContact O-CE 3.37Å
91	L	98.4	Very high	97.8	Very high	13 Å²	13	53.7 Å²	53.7	7%	0.068	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	-46.5	179.5	-52.7	-174.6	0	0	0	110.3	I84 L86 K89 N98 A106 V108 L115 T118	I84-L91 HydrophobicContact CG2-CB 4.36Å; I84-L91 HydrophobicContact CG2-CD1 4.33Å; I84-L91 PolarHBondContact O-N 2.91Å; L86-L91 HydrophobicContact CB-CD1 3.73Å; L86-L91 HydrophobicContact CB-CG 4.2Å; L86-L91 HydrophobicContact CD2-CD1 4.25Å; K89-L91 HydrophobicContact CB-CD2 4.22Å; K89-L91 PolarHBondContact O-N 3.13Å; L91-N98 PolarHBondContact O-ND2 2.87Å; L91-A106 HydrophobicContact CB-CB 4.29Å; L91-A106 HydrophobicContact CD1-CB 4.05Å; L91-V108 HydrophobicContact CD1-CG2 3.96Å; L91-L115 HydrophobicContact CB-CD1 4.49Å; L91-L115 HydrophobicContact CD1-CD1 4.04Å; L91-L115 HydrophobicContact CD2-CB 4.3Å; L91-L115 HydrophobicContact CD2-CD1 4.24Å; L91-L115 HydrophobicContact CD2-CD2 4.27Å; L91-L115 HydrophobicContact CG-CD1 4.48Å; L91-T118 HydrophobicContact CB-CG2 4.34Å
92	V	98.6	Very high	97.8	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.012	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	130.7	-179.6	177.1	0	0	0	0	109.4	K83 I84 N98 V99 N104 A106 T118	K83-V92 CarbonylContact C-O 3.55Å; K83-V92 VanDerWaalsContact CA-O 3.31Å; K83-V92 WeakPolarHBondContact CA-O 3.4Å; I84-V92 HydrophobicContact CB-CB 3.93Å; I84-V92 HydrophobicContact CB-CG2 4.31Å; I84-V92 HydrophobicContact CD1-CB 4.09Å; I84-V92 HydrophobicContact CD1-CG2 3.97Å; I84-V92 HydrophobicContact CG1-CB 3.97Å; I84-V92 HydrophobicContact CG1-CG2 4.35Å; I84-V92 PolarHBondContact N-O 3.46Å; I84-V92 PolarHBondContact O-N 2.82Å; V92-N98 WeakPolarHBondContact CA-OD1 3.45Å; V92-V99 HydrophobicContact CG1-CG1 3.6Å; V92-N104 HydrophobicContact CG1-CB 4.15Å; V92-A106 HydrophobicContact CG2-CB 4.36Å; V92-T118 HydrophobicContact CG2-CG2 4.01Å
93	S	98.1	Very high	97.8	Very high	12 Å²	12	53.2 Å²	53.2	8%	0.084	27%	0.274	C	S	.	.			trans	-168.9	157.5	171.5	64.1	0	0	0	0	112	P82 I90 V95 K96 N97 N98	P82-S93 WeakPolarHBondContact O-CA 3.39Å; I90-S93 WeakPolarHBondContact CG2-OG 3.36Å; S93-V95 PolarHBondContact O-N 2.94Å; S93-K96 PolarHBondContact O-N 2.83Å; S93-K96 WeakPolarHBondContact OG-CG 3.07Å; S93-K96 PolarHBondContact OG-N 2.85Å; S93-N97 PolarHBondContact O-N 3.16Å; S93-N98 PolarHBondContact N-OD1 3.4Å; S93-N98 VanDerWaalsContact N-OD1 3.09Å; S93-N98 PolarHBondContact O-OD1 2.95Å
94	S	96.7	Very high	97.8	Very high	50 Å²	50	48.5 Å²	48.5	35%	0.35	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-55.5	-36.4	171.8	-49	0	0	0	0	112.8	G81 K96 N97	G81-S94 WeakPolarHBondContact CA-OG 3.46Å; G81-S94 PolarHBondContact N-OG 3.21Å; S94-K96 VanDerWaalsContact C-N 3.26Å; S94-K96 PolarHBondContact O-N 2.77Å; S94-N97 PolarHBondContact O-N 2.78Å; S94-N97 PolarHBondContact O-OD1 2.97Å
95	V	95.6	Very high	97.9	Very high	135 Å²	135	48.5 Å²	48.5	82%	0.818	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-65.9	-29.3	178.8	-177	0	0	0	0	112.1	S93 N97	S93-V95 PolarHBondContact O-N 2.94Å; V95-N97 VanDerWaalsContact C-N 3.27Å
96	K	96.3	Very high	97.9	Very high	117 Å²	117	48.3 Å²	48.3	51%	0.509	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-83.1	-2.3	174.9	-72.4	-179.1	74.3	79.2	0	113.2	I90 S93 S94 N98	I90-K96 HydrophobicContact CB-CD 4.32Å; I90-K96 HydrophobicContact CG2-CD 3.99Å; I90-K96 WeakPolarHBondContact O-CD 3.22Å; I90-K96 VanDerWaalsContact O-CE 3.29Å; I90-K96 WeakPolarHBondContact O-CE 3.37Å; S93-K96 PolarHBondContact O-N 2.83Å; S93-K96 WeakPolarHBondContact OG-CG 3.07Å; S93-K96 PolarHBondContact OG-N 2.85Å; S94-K96 VanDerWaalsContact C-N 3.26Å; S94-K96 PolarHBondContact O-N 2.77Å; K96-N98 WeakPolarHBondContact CB-OD1 3.31Å; K96-N98 PolarHBondContact O-N 3.13Å; K96-N98 VanDerWaalsContact O-N 3.17Å
97	N	97.1	Very high	97.9	Very high	150 Å²	150	48.6 Å²	48.6	80%	0.802	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	32	-177.1	-60.7	-43.9	0	0	0	113.6	S93 S94 V95	S93-N97 PolarHBondContact O-N 3.16Å; S94-N97 PolarHBondContact O-N 2.78Å; S94-N97 PolarHBondContact O-OD1 2.97Å; V95-N97 VanDerWaalsContact C-N 3.27Å
98	N	98	Very high	98	Very high	39 Å²	39	46.4 Å²	46.4	21%	0.209	24%	0.243	C	C	.	.			trans	-121.8	29.5	-179.7	72.3	-21.3	0	0	0	112.8	L91 V92 S93 K96	L91-N98 PolarHBondContact O-ND2 2.87Å; V92-N98 WeakPolarHBondContact CA-OD1 3.45Å; S93-N98 PolarHBondContact N-OD1 3.4Å; S93-N98 VanDerWaalsContact N-OD1 3.09Å; S93-N98 PolarHBondContact O-OD1 2.95Å; K96-N98 WeakPolarHBondContact CB-OD1 3.31Å; K96-N98 PolarHBondContact O-N 3.13Å; K96-N98 VanDerWaalsContact O-N 3.17Å
99	V	98.4	Very high	98	Very high	39 Å²	39	44.4 Å²	44.4	24%	0.236	23%	0.233	C	C	.	.			trans	-108.9	146.9	176.1	-65.4	0	0	0	0	110.5	P82 V92 N104	P82-V99 HydrophobicContact CG-CG1 4.22Å; V92-V99 HydrophobicContact CG1-CG1 3.6Å; V99-N104 WeakPolarHBondContact CA-OD1 3.29Å
100	G	98.3	Very high	97.9	Very high	17 Å²	17	37.7 Å²	37.7	18%	0.175	20%	0.204	C	C	.	.			trans	-146.6	159.2	174.6	0	0	0	0	0	111.5	N104 F149	G100-N104 PolarHBondContact N-OD1 3.14Å; G100-N104 PolarHBondContact O-ND2 3.33Å; G100-N104 PolarHBondContact O-OD1 2.53Å; G100-F149 WeakPolarHBondContact O-CD1 3.45Å
101	R	98.6	Very high	97.6	Very high	88 Å²	88	38 Å²	38	33%	0.332	21%	0.209	S	C	.	.	S	Bend	trans	-54	147.2	171.4	172.1	170.3	68.1	-138.3	-3.9	110	F121 D122 W124 D150	R101-F121 CarbonylContact O-C 3.58Å; R101-D122 IonicContact CZ-OD1 2.95Å; R101-D122 IonicContact CZ-OD2 3.39Å; R101-D122 IonicContact NE-OD1 2.64Å; R101-D122 PolarHBondContact NE-OD1 2.85Å; R101-D122 IonicContact NE-OD2 3.2Å; R101-D122 PolarHBondContact NE-OD2 3.3Å; R101-D122 IonicContact NH2-OD1 3.07Å; R101-D122 IonicContact NH2-OD2 2.74Å; R101-D122 PolarHBondContact NH2-OD2 3.01Å; R101-D122 VanDerWaalsContact O-CA 3.25Å; R101-D122 WeakPolarHBondContact O-CA 3.33Å; R101-W124 HydrophobicContact CG-CB 4.49Å; R101-D150 WeakPolarHBondContact CD-OD2 3.32Å; R101-D150 HydrophobicContact CG-CB 4Å
102	G	98.7	Very high	97.4	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	97.2	-132.3	179.2	0	0	0	0	0	113.2	F121 S148 F149 D151	G102-F121 CarbonylContact C-O 3.57Å; G102-F121 VanDerWaalsContact CA-O 3.29Å; G102-F121 WeakPolarHBondContact CA-O 3.27Å; G102-S148 CarbonylContact O-C 3.59Å; G102-S148 WeakPolarHBondContact O-CA 3.17Å; G102-F149 PolarHBondContact N-O 3.2Å; G102-F149 PolarHBondContact O-N 3.43Å; G102-D151 VanDerWaalsContact CA-O 3.28Å; G102-D151 WeakPolarHBondContact CA-O 3.41Å
103	L	98.8	Very high	97.2	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	122	-177.8	-64.2	175.6	0	0	0	110	I105 S120 F121 M123 L131 V146 P152 L156 F164 W181	L103-I105 HydrophobicContact CB-CD1 4.47Å; L103-I105 HydrophobicContact CB-CG1 4.35Å; L103-S120 CarbonylContact O-C 3.56Å; L103-S120 VanDerWaalsContact O-CA 3.3Å; L103-S120 WeakPolarHBondContact O-CA 3.37Å; L103-F121 PolarHBondContact N-O 2.62Å; L103-F121 PolarHBondContact O-N 2.6Å; L103-M123 HydrophobicContact CD1-CG 3.97Å; L103-M123 HydrophobicContact CD1-SD 4.28Å; L103-M123 HydrophobicContact CG-CG 3.82Å; L103-L131 HydrophobicContact CD1-CD2 3.99Å; L103-V146 HydrophobicContact CB-CG1 4.44Å; L103-V146 HydrophobicContact CD2-CG1 3.86Å; L103-P152 HydrophobicContact CD2-CB 3.55Å; L103-P152 HydrophobicContact CG-CB 4.3Å; L103-L156 HydrophobicContact CD1-CD1 4Å; L103-F164 HydrophobicContact CD1-CE2 3.83Å; L103-F164 HydrophobicContact CD1-CZ 3.94Å; L103-W181 HydrophobicContact CD2-CE3 3.8Å; L103-W181 HydrophobicContact CD2-CZ3 3.78Å
104	N	98.9	Very high	97.1	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	118.3	173.6	-63.7	-99.7	0	0	0	108.2	P82 V92 V99 G100 S120 V146 A147	P82-N104 HydrophobicContact CG-CB 3.94Å; P82-N104 WeakPolarHBondContact CG-ND2 3.31Å; V92-N104 HydrophobicContact CG1-CB 4.15Å; V99-N104 WeakPolarHBondContact CA-OD1 3.29Å; G100-N104 PolarHBondContact N-OD1 3.14Å; G100-N104 PolarHBondContact O-ND2 3.33Å; G100-N104 PolarHBondContact O-OD1 2.53Å; N104-S120 WeakPolarHBondContact OD1-CB 3.22Å; N104-V146 WeakPolarHBondContact O-CA 3.25Å; N104-A147 WeakPolarHBondContact CB-O 3.18Å; N104-A147 PolarHBondContact N-O 2.52Å; N104-A147 PolarHBondContact ND2-O 3.49Å; N104-A147 PolarHBondContact O-N 3.05Å
105	I	98.9	Very high	97.2	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	132.2	-169.4	-53	-175.4	0	0	0	110.3	L103 L107 T118 K119 F121 L131 Y134 L135 V144 F145 V146 F164	L103-I105 HydrophobicContact CB-CD1 4.47Å; L103-I105 HydrophobicContact CB-CG1 4.35Å; I105-L107 HydrophobicContact CG2-CD2 4.09Å; I105-T118 CarbonylContact O-C 3.58Å; I105-T118 WeakPolarHBondContact O-CA 3.33Å; I105-K119 PolarHBondContact N-O 2.84Å; I105-K119 PolarHBondContact O-N 3.38Å; I105-F121 HydrophobicContact CB-CE2 4.45Å; I105-F121 HydrophobicContact CD1-CD2 3.92Å; I105-F121 HydrophobicContact CD1-CE2 3.93Å; I105-F121 HydrophobicContact CG1-CD2 4.25Å; I105-F121 HydrophobicContact CG1-CE2 4.31Å; I105-L131 HydrophobicContact CD1-CD1 3.55Å; I105-Y134 HydrophobicContact CB-CE1 4.23Å; I105-Y134 HydrophobicContact CG2-CE1 3.97Å; I105-L135 HydrophobicContact CD1-CD2 4.37Å; I105-V144 HydrophobicContact CG2-CG1 3.74Å; I105-F145 CarbonylContact C-O 3.58Å; I105-F145 WeakPolarHBondContact CA-O 3.42Å; I105-V146 HydrophobicContact CG1-CG1 4.36Å; I105-V146 HydrophobicContact CG1-CG2 4.23Å; I105-F164 HydrophobicContact CD1-CE1 4.47Å; I105-F164 HydrophobicContact CD1-CZ 4.04Å
106	A	98.8	Very high	97.3	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	128.4	166.9	0	0	0	0	0	109.9	I84 L91 V92 L115 T118 F145	I84-A106 HydrophobicContact CD1-CB 4.27Å; I84-A106 HydrophobicContact CG2-CB 4.34Å; L91-A106 HydrophobicContact CB-CB 4.29Å; L91-A106 HydrophobicContact CD1-CB 4.05Å; V92-A106 HydrophobicContact CG2-CB 4.36Å; A106-L115 HydrophobicContact CB-CD1 4.34Å; A106-T118 HydrophobicContact CB-CG2 3.95Å; A106-F145 HydrophobicContact CB-CB 4.29Å; A106-F145 PolarHBondContact N-O 3.22Å; A106-F145 PolarHBondContact O-N 2.95Å
107	L	98.7	Very high	97.4	Very high	12 Å²	12	44.1 Å²	44.1	6%	0.063	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	132.5	175.8	-59.4	179.2	0	0	0	109.3	I105 L115 L116 D117 Y134 L138 T142 L143 V144	I105-L107 HydrophobicContact CG2-CD2 4.09Å; L107-L115 WeakPolarHBondContact O-CD1 3.48Å; L107-L116 HydrophobicContact CB-CB 4.09Å; L107-L116 PolarHBondContact O-N 2.92Å; L107-D117 PolarHBondContact N-O 2.7Å; L107-D117 PolarHBondContact O-N 2.81Å; L107-Y134 HydrophobicContact CD1-CD1 4.5Å; L107-Y134 HydrophobicContact CD1-CE1 3.69Å; L107-Y134 HydrophobicContact CD1-CE2 4.03Å; L107-Y134 VanDerWaalsContact CD1-CZ 3.42Å; L107-Y134 WeakPolarHBondContact CD1-OH 3.33Å; L107-Y134 HydrophobicContact CD2-CE1 4.22Å; L107-Y134 HydrophobicContact CG-CE1 3.89Å; L107-Y134 WeakPolarHBondContact CG-OH 3.08Å; L107-L138 HydrophobicContact CD1-CD2 3.48Å; L107-L138 VanDerWaalsContact CD1-CD2 3.48Å; L107-L138 HydrophobicContact CD2-CD1 4.25Å; L107-L138 HydrophobicContact CD2-CD2 3.77Å; L107-L138 HydrophobicContact CG-CD2 4.24Å; L107-T142 HydrophobicContact CB-CG2 4.15Å; L107-T142 HydrophobicContact CD2-CG2 4.22Å; L107-L143 WeakPolarHBondContact CA-O 3.4Å; L107-V144 HydrophobicContact CD2-CB 4.34Å; L107-V144 HydrophobicContact CD2-CG1 4.07Å; L107-V144 HydrophobicContact CD2-CG2 3.85Å
108	V	98.3	Very high	97.5	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	140.5	-174.8	174	0	0	0	0	109.3	L86 L91 G110 E114 L115 L143 F145	L86-V108 HydrophobicContact CD2-CB 4.23Å; L86-V108 HydrophobicContact CD2-CG1 3.5Å; L86-V108 HydrophobicContact CD2-CG2 3.77Å; L91-V108 HydrophobicContact CD1-CG2 3.96Å; V108-G110 PolarHBondContact O-N 3.22Å; V108-E114 CarbonylContact C-O 3.56Å; V108-E114 WeakPolarHBondContact CA-O 3.42Å; V108-E114 WeakPolarHBondContact CG1-O 3.48Å; V108-L115 HydrophobicContact CG2-CD1 4.39Å; V108-L143 HydrophobicContact CB-CB 4.21Å; V108-L143 HydrophobicContact CG1-CD1 4.42Å; V108-L143 PolarHBondContact N-O 3.04Å; V108-L143 PolarHBondContact O-N 3.4Å; V108-F145 HydrophobicContact CB-CD2 4.42Å; V108-F145 HydrophobicContact CB-CE2 3.9Å; V108-F145 HydrophobicContact CG2-CD2 3.92Å; V108-F145 HydrophobicContact CG2-CE2 3.7Å
109	N	97.1	Very high	97.5	Very high	57 Å²	57	41.5 Å²	41.5	31%	0.305	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	120	173.4	-174.7	-53.1	0	0	0	110.1	V111 S112 G113 E114 L116	N109-V111 PolarHBondContact O-N 2.95Å; N109-V111 WeakPolarHBondContact OD1-CA 3.39Å; N109-V111 WeakPolarHBondContact OD1-CB 3.46Å; N109-V111 PolarHBondContact OD1-N 3.16Å; N109-S112 WeakPolarHBondContact CB-OG 3.49Å; N109-S112 PolarHBondContact OD1-N 3.15Å; N109-G113 VanDerWaalsContact O-CA 3.23Å; N109-G113 WeakPolarHBondContact O-CA 3.1Å; N109-G113 PolarHBondContact O-N 2.95Å; N109-E114 PolarHBondContact N-O 3.24Å; N109-L116 HydrophobicContact CB-CD1 4.46Å; N109-L116 HydrophobicContact CB-CD2 4.19Å; N109-L116 HydrophobicContact CB-CG 4.35Å
110	G	94.9	Very high	97.5	Very high	3 Å²	3	41.8 Å²	41.8	3%	0.031	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-7.9	-177.3	0	0	0	0	0	115.8	V108 G141 R224	V108-G110 PolarHBondContact O-N 3.22Å; G110-G141 WeakPolarHBondContact CA-O 3.27Å; G110-G141 PolarHBondContact N-O 3Å; G110-R224 PolarHBondContact O-N 3.4Å
111	V	92.7	Very high	97.5	Very high	63 Å²	63	41.4 Å²	41.4	38%	0.382	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-50.5	174.9	-177.6	0	0	0	0	110.6	N109 R224 P226	N109-V111 PolarHBondContact O-N 2.95Å; N109-V111 WeakPolarHBondContact OD1-CA 3.39Å; N109-V111 WeakPolarHBondContact OD1-CB 3.46Å; N109-V111 PolarHBondContact OD1-N 3.16Å; V111-R224 HydrophobicContact CG2-CB 4.12Å; V111-P226 HydrophobicContact CG1-CB 4.45Å; V111-P226 HydrophobicContact CG1-CG 4.13Å
112	S	93.2	Very high	97.5	Very high	59 Å²	59	39.3 Å²	39.3	41%	0.413	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-21.1	-177.5	67.3	0	0	0	0	114.1	N109 E114	N109-S112 WeakPolarHBondContact CB-OG 3.49Å; N109-S112 PolarHBondContact OD1-N 3.15Å; S112-E114 PolarHBondContact O-N 2.95Å; S112-E114 WeakPolarHBondContact OG-CB 3.48Å; S112-E114 WeakPolarHBondContact OG-CG 3.35Å; S112-E114 PolarHBondContact OG-N 3.26Å
113	G	95.1	Very high	97.5	Very high	15 Å²	15	39.4 Å²	39.4	16%	0.155	22%	0.216	C	C	.	.			trans	72.1	12.1	-171	0	0	0	0	0	113.9	N109	N109-G113 VanDerWaalsContact O-CA 3.23Å; N109-G113 WeakPolarHBondContact O-CA 3.1Å; N109-G113 PolarHBondContact O-N 2.95Å
114	E	96.4	Very high	97.5	Very high	132 Å²	132	45.1 Å²	45.1	62%	0.617	24%	0.238	S	C	*	.			trans	-83.1	144	-179.7	-66.7	-177.6	147.5	0	0	112.4	V108 N109 S112 L116	V108-E114 CarbonylContact C-O 3.56Å; V108-E114 WeakPolarHBondContact CA-O 3.42Å; V108-E114 WeakPolarHBondContact CG1-O 3.48Å; N109-E114 PolarHBondContact N-O 3.24Å; S112-E114 PolarHBondContact O-N 2.95Å; S112-E114 WeakPolarHBondContact OG-CB 3.48Å; S112-E114 WeakPolarHBondContact OG-CG 3.35Å; S112-E114 PolarHBondContact OG-N 3.26Å; E114-L116 PolarHBondContact O-N 2.89Å
115	L	98	Very high	97.4	Very high	82 Å²	82	48.2 Å²	48.2	43%	0.429	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	127.7	174.6	177.1	71.2	0	0	0	110	L91 A106 L107 V108 T118	L91-L115 HydrophobicContact CB-CD1 4.49Å; L91-L115 HydrophobicContact CD1-CD1 4.04Å; L91-L115 HydrophobicContact CD2-CB 4.3Å; L91-L115 HydrophobicContact CD2-CD1 4.24Å; L91-L115 HydrophobicContact CD2-CD2 4.27Å; L91-L115 HydrophobicContact CG-CD1 4.48Å; A106-L115 HydrophobicContact CB-CD1 4.34Å; L107-L115 WeakPolarHBondContact O-CD1 3.48Å; V108-L115 HydrophobicContact CG2-CD1 4.39Å; L115-T118 HydrophobicContact CD1-CG2 3.54Å; L115-T118 HydrophobicContact CD2-CG2 4.01Å; L115-T118 HydrophobicContact CG-CG2 4.34Å
116	L	98.1	Very high	97.3	Very high	94 Å²	94	49.4 Å²	49.4	49%	0.492	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-52.6	173.7	-60.8	176.6	0	0	0	111	L107 N109 E114 T142	L107-L116 HydrophobicContact CB-CB 4.09Å; L107-L116 PolarHBondContact O-N 2.92Å; N109-L116 HydrophobicContact CB-CD1 4.46Å; N109-L116 HydrophobicContact CB-CD2 4.19Å; N109-L116 HydrophobicContact CB-CG 4.35Å; E114-L116 PolarHBondContact O-N 2.89Å; L116-T142 HydrophobicContact CD1-CG2 3.96Å
117	D	98.4	Very high	97.3	Very high	76 Å²	76	53.7 Å²	53.7	41%	0.406	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	158	178.9	-163.9	16.1	0	0	0	112.1	L107 Y134	L107-D117 PolarHBondContact N-O 2.7Å; L107-D117 PolarHBondContact O-N 2.81Å; D117-Y134 HydrophobicContact CB-CE2 4.48Å; D117-Y134 WeakPolarHBondContact OD2-CE2 3.48Å
118	T	98.6	Very high	97.2	Very high	35 Å²	35	54 Å²	54	22%	0.215	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	131	171.4	61.2	0	0	0	0	110.7	L91 V92 I105 A106 L115	L91-T118 HydrophobicContact CB-CG2 4.34Å; V92-T118 HydrophobicContact CG2-CG2 4.01Å; I105-T118 CarbonylContact O-C 3.58Å; I105-T118 WeakPolarHBondContact O-CA 3.33Å; A106-T118 HydrophobicContact CB-CG2 3.95Å; L115-T118 HydrophobicContact CD1-CG2 3.54Å; L115-T118 HydrophobicContact CD2-CG2 4.01Å; L115-T118 HydrophobicContact CG-CG2 4.34Å
119	K	98.6	Very high	97.2	Very high	99 Å²	99	56.4 Å²	56.4	43%	0.43	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	148.4	179.8	-163.3	163.2	179.8	-177.4	0	112.3	I105 F121 Y134	I105-K119 PolarHBondContact N-O 2.84Å; I105-K119 PolarHBondContact O-N 3.38Å; K119-F121 HydrophobicContact CB-CE2 3.91Å; K119-F121 HydrophobicContact CB-CZ 3.92Å; K119-F121 HydrophobicContact CD-CE1 4Å; K119-F121 HydrophobicContact CD-CE2 4.47Å; K119-F121 HydrophobicContact CD-CZ 3.67Å; K119-F121 HydrophobicContact CG-CE1 4.22Å; K119-F121 HydrophobicContact CG-CE2 4.06Å; K119-F121 HydrophobicContact CG-CZ 3.72Å; K119-Y134 HydrophobicContact CB-CE2 4.11Å; K119-Y134 HydrophobicContact CD-CD2 4.25Å; K119-Y134 HydrophobicContact CD-CE2 4.22Å
120	S	98.6	Very high	97.3	Very high	45 Å²	45	57.5 Å²	57.5	32%	0.315	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	141.9	172.4	62.5	0	0	0	0	111.2	L103 N104	L103-S120 CarbonylContact O-C 3.56Å; L103-S120 VanDerWaalsContact O-CA 3.3Å; L103-S120 WeakPolarHBondContact O-CA 3.37Å; N104-S120 WeakPolarHBondContact OD1-CB 3.22Å
121	F	98.8	Very high	97.5	Very high	8 Å²	8	57.3 Å²	57.3	4%	0.035	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	116.2	179.2	-58	-87.1	0	0	0	110.1	R101 G102 L103 I105 K119 M123 D130 L131 Y134	R101-F121 CarbonylContact O-C 3.58Å; G102-F121 CarbonylContact C-O 3.57Å; G102-F121 VanDerWaalsContact CA-O 3.29Å; G102-F121 WeakPolarHBondContact CA-O 3.27Å; L103-F121 PolarHBondContact N-O 2.62Å; L103-F121 PolarHBondContact O-N 2.6Å; I105-F121 HydrophobicContact CB-CE2 4.45Å; I105-F121 HydrophobicContact CD1-CD2 3.92Å; I105-F121 HydrophobicContact CD1-CE2 3.93Å; I105-F121 HydrophobicContact CG1-CD2 4.25Å; I105-F121 HydrophobicContact CG1-CE2 4.31Å; K119-F121 HydrophobicContact CB-CE2 3.91Å; K119-F121 HydrophobicContact CB-CZ 3.92Å; K119-F121 HydrophobicContact CD-CE1 4Å; K119-F121 HydrophobicContact CD-CE2 4.47Å; K119-F121 HydrophobicContact CD-CZ 3.67Å; K119-F121 HydrophobicContact CG-CE1 4.22Å; K119-F121 HydrophobicContact CG-CE2 4.06Å; K119-F121 HydrophobicContact CG-CZ 3.72Å; F121-M123 HydrophobicContact CB-CE 3.75Å; F121-M123 PolarHBondContact O-N 2.99Å; F121-M123 VanDerWaalsContact O-N 3.13Å; F121-D130 HydrophobicContact CD1-CB 4.2Å; F121-D130 HydrophobicContact CE1-CB 4.26Å; F121-D130 WeakPolarHBondContact CE1-O 3.27Å; F121-L131 HydrophobicContact CB-CB 4.37Å; F121-L131 HydrophobicContact CB-CD1 4.45Å; F121-L131 HydrophobicContact CD1-CB 3.88Å; F121-L131 HydrophobicContact CD1-CD1 4.36Å; F121-L131 HydrophobicContact CD2-CD1 3.69Å; F121-L131 HydrophobicContact CE1-CB 4.37Å; F121-L131 HydrophobicContact CE2-CD1 3.99Å; F121-L131 HydrophobicContact CG-CB 4.05Å; F121-L131 HydrophobicContact CG-CD1 3.9Å; F121-L131 HydrophobicContact CZ-CD1 4.46Å; F121-Y134 HydrophobicContact CE1-CG 4.25Å; F121-Y134 AromaticContact CE2-CD1 3.58Å; F121-Y134 HydrophobicContact CE2-CD1 3.58Å; F121-Y134 AromaticContact CE2-CE1 3.9Å; F121-Y134 HydrophobicContact CE2-CE1 3.9Å; F121-Y134 HydrophobicContact CE2-CG 4.04Å; F121-Y134 VanDerWaalsContact CZ-CB 3.48Å; F121-Y134 AromaticContact CZ-CD1 3.4Å; F121-Y134 HydrophobicContact CZ-CD1 3.4Å; F121-Y134 VanDerWaalsContact CZ-CD1 3.4Å; F121-Y134 AromaticContact CZ-CD2 3.92Å; F121-Y134 HydrophobicContact CZ-CD2 3.92Å; F121-Y134 HydrophobicContact CZ-CE1 4.01Å; F121-Y134 HydrophobicContact CZ-CE2 4.45Å; F121-Y134 AromaticContact CZ-CG 3.34Å; F121-Y134 HydrophobicContact CZ-CG 3.34Å
122	D	98.6	Very high	97.8	Very high	45 Å²	45	54.6 Å²	54.6	24%	0.241	30%	0.303	C	S	.	.			trans	-72.6	103.2	-179.8	-174.1	-7.4	0	0	0	111.2	R101 W124 A125 G126	R101-D122 IonicContact CZ-OD1 2.95Å; R101-D122 IonicContact CZ-OD2 3.39Å; R101-D122 IonicContact NE-OD1 2.64Å; R101-D122 PolarHBondContact NE-OD1 2.85Å; R101-D122 IonicContact NE-OD2 3.2Å; R101-D122 PolarHBondContact NE-OD2 3.3Å; R101-D122 IonicContact NH2-OD1 3.07Å; R101-D122 IonicContact NH2-OD2 2.74Å; R101-D122 PolarHBondContact NH2-OD2 3.01Å; R101-D122 VanDerWaalsContact O-CA 3.25Å; R101-D122 WeakPolarHBondContact O-CA 3.33Å; D122-W124 VanDerWaalsContact C-N 3.28Å; D122-W124 PolarHBondContact O-N 2.72Å; D122-W124 WeakPolarHBondContact OD1-CB 3.45Å; D122-W124 PolarHBondContact OD1-N 3.01Å; D122-A125 PolarHBondContact OD1-N 2.77Å; D122-A125 VanDerWaalsContact OD1-N 3.08Å; D122-G126 WeakPolarHBondContact O-CA 3.23Å; D122-G126 PolarHBondContact O-N 3.08Å
123	M	98.5	Very high	98	Very high	1 Å²	1	58 Å²	58	1%	0.005	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	6.6	179.5	-62.8	-63.4	89.8	0	0	113.7	L103 F121 L131 P152 T154 K155 L156	L103-M123 HydrophobicContact CD1-CG 3.97Å; L103-M123 HydrophobicContact CD1-SD 4.28Å; L103-M123 HydrophobicContact CG-CG 3.82Å; F121-M123 HydrophobicContact CB-CE 3.75Å; F121-M123 PolarHBondContact O-N 2.99Å; F121-M123 VanDerWaalsContact O-N 3.13Å; M123-L131 HydrophobicContact CE-CD2 4.48Å; M123-L131 HydrophobicContact SD-CD2 4Å; M123-P152 VanDerWaalsContact CB-C 3.43Å; M123-P152 WeakPolarHBondContact CB-O 3.25Å; M123-P152 WeakPolarHBondContact CG-O 3.47Å; M123-T154 CarbonylContact O-C 3.55Å; M123-T154 WeakPolarHBondContact O-CB 3.24Å; M123-T154 PolarHBondContact O-N 2.85Å; M123-K155 VanDerWaalsContact O-CB 3.3Å; M123-K155 WeakPolarHBondContact O-CB 2.91Å; M123-K155 VanDerWaalsContact O-CG 3.29Å; M123-K155 WeakPolarHBondContact O-CG 3.33Å; M123-K155 PolarHBondContact O-N 3.24Å; M123-L156 HydrophobicContact SD-CD1 3.99Å
124	W	97.9	Very high	98.2	Very high	120 Å²	120	58.5 Å²	58.5	46%	0.455	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-55.8	173.1	174.8	-106.3	0	0	0	111.5	R101 D122 D151 T154 F177	R101-W124 HydrophobicContact CG-CB 4.49Å; D122-W124 VanDerWaalsContact C-N 3.28Å; D122-W124 PolarHBondContact O-N 2.72Å; D122-W124 WeakPolarHBondContact OD1-CB 3.45Å; D122-W124 PolarHBondContact OD1-N 3.01Å; W124-D151 HydrophobicContact CB-CB 4.43Å; W124-T154 HydrophobicContact CE3-CG2 3.83Å; W124-T154 HydrophobicContact CZ3-CG2 3.99Å; W124-F177 HydrophobicContact CE3-CD2 4.18Å; W124-F177 AromaticContact CE3-CE2 3.73Å; W124-F177 HydrophobicContact CE3-CE2 3.73Å; W124-F177 HydrophobicContact CH2-CE2 4Å; W124-F177 AromaticContact CZ3-CD2 3.79Å; W124-F177 HydrophobicContact CZ3-CD2 3.79Å; W124-F177 AromaticContact CZ3-CE2 3.27Å; W124-F177 HydrophobicContact CZ3-CE2 3.27Å; W124-F177 HydrophobicContact CZ3-CZ 4.16Å
125	A	97.5	Very high	98.2	Very high	66 Å²	66	52.4 Å²	52.4	55%	0.545	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	-11.1	-175	0	0	0	0	0	114.3	D122	D122-A125 PolarHBondContact OD1-N 2.77Å; D122-A125 VanDerWaalsContact OD1-N 3.08Å
126	G	97.3	Very high	98.2	Very high	25 Å²	25	54.2 Å²	54.2	26%	0.258	28%	0.281	S	S	.	.	S	Bend	trans	-81.5	-177.5	-177.2	0	0	0	0	0	114.6	D122 K155	D122-G126 WeakPolarHBondContact O-CA 3.23Å; D122-G126 PolarHBondContact O-N 3.08Å; G126-K155 VanDerWaalsContact O-CE 3.32Å; G126-K155 WeakPolarHBondContact O-CE 3.49Å
127	D	97.7	Very high	98.2	Very high	90 Å²	90	53.8 Å²	53.8	48%	0.481	28%	0.284	S	S	.	.			trans	-99.5	121.9	174.2	-172.3	-8.8	0	0	0	110.5	T129 D130	D127-T129 PolarHBondContact O-N 2.8Å; D127-T129 VanDerWaalsContact OD1-CB 3.23Å; D127-T129 WeakPolarHBondContact OD1-CB 3.38Å; D127-T129 PolarHBondContact OD1-N 2.86Å; D127-T129 PolarHBondContact OD1-OG1 3.36Å; D127-T129 PolarHBondContact OD2-OG1 2.78Å; D127-D130 PolarHBondContact O-N 2.93Å
128	V	98.1	Very high	98.1	Very high	20 Å²	20	51.2 Å²	51.2	12%	0.121	27%	0.27	C	S	.	.	H	α-helix	trans	-62.3	-22.3	177	69.4	0	0	0	0	112.5	D130 L131 L132 K155 A160	V128-D130 PolarHBondContact O-N 2.96Å; V128-L131 WeakPolarHBondContact O-CB 3.44Å; V128-L131 PolarHBondContact O-N 2.89Å; V128-L131 VanDerWaalsContact O-N 3.08Å; V128-L132 WeakPolarHBondContact O-CG 3.49Å; V128-L132 PolarHBondContact O-N 2.91Å; V128-L132 VanDerWaalsContact O-N 3.1Å; V128-K155 WeakPolarHBondContact CB-O 3.32Å; V128-A160 HydrophobicContact CG2-CB 4Å
129	T	98.3	Very high	97.9	Very high	50 Å²	50	56.7 Å²	56.7	31%	0.307	29%	0.293	S	S	.	.	H	α-helix	trans	-58.5	-32.8	178.4	-51.3	0	0	0	0	112.2	D127 L132 K133	D127-T129 PolarHBondContact O-N 2.8Å; D127-T129 VanDerWaalsContact OD1-CB 3.23Å; D127-T129 WeakPolarHBondContact OD1-CB 3.38Å; D127-T129 PolarHBondContact OD1-N 2.86Å; D127-T129 PolarHBondContact OD1-OG1 3.36Å; D127-T129 PolarHBondContact OD2-OG1 2.78Å; T129-L132 PolarHBondContact O-N 2.84Å; T129-K133 HydrophobicContact CG2-CD 4.34Å; T129-K133 WeakPolarHBondContact O-CG 3.13Å; T129-K133 PolarHBondContact O-N 2.9Å
130	D	98.3	Very high	97.7	Very high	79 Å²	79	58.9 Å²	58.9	42%	0.422	31%	0.305	S	S	.	.	H	α-helix	trans	-67.9	-37.8	178	-70.9	-21.4	0	0	0	111.8	F121 D127 V128 Y134	F121-D130 HydrophobicContact CD1-CB 4.2Å; F121-D130 HydrophobicContact CE1-CB 4.26Å; F121-D130 WeakPolarHBondContact CE1-O 3.27Å; D127-D130 PolarHBondContact O-N 2.93Å; V128-D130 PolarHBondContact O-N 2.96Å; D130-Y134 WeakPolarHBondContact O-CB 3.4Å; D130-Y134 PolarHBondContact O-N 3.16Å; D130-Y134 VanDerWaalsContact O-N 3.12Å
131	L	98.6	Very high	97.5	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-64.8	-44.2	173.3	175.8	67.5	0	0	0	110.8	L103 I105 F121 M123 V128 K133 Y134 L135 L156 A160 F164	L103-L131 HydrophobicContact CD1-CD2 3.99Å; I105-L131 HydrophobicContact CD1-CD1 3.55Å; F121-L131 HydrophobicContact CB-CB 4.37Å; F121-L131 HydrophobicContact CB-CD1 4.45Å; F121-L131 HydrophobicContact CD1-CB 3.88Å; F121-L131 HydrophobicContact CD1-CD1 4.36Å; F121-L131 HydrophobicContact CD2-CD1 3.69Å; F121-L131 HydrophobicContact CE1-CB 4.37Å; F121-L131 HydrophobicContact CE2-CD1 3.99Å; F121-L131 HydrophobicContact CG-CB 4.05Å; F121-L131 HydrophobicContact CG-CD1 3.9Å; F121-L131 HydrophobicContact CZ-CD1 4.46Å; M123-L131 HydrophobicContact CE-CD2 4.48Å; M123-L131 HydrophobicContact SD-CD2 4Å; V128-L131 WeakPolarHBondContact O-CB 3.44Å; V128-L131 PolarHBondContact O-N 2.89Å; V128-L131 VanDerWaalsContact O-N 3.08Å; L131-K133 PolarHBondContact O-N 2.74Å; L131-Y134 WeakPolarHBondContact O-CB 3.37Å; L131-Y134 PolarHBondContact O-N 2.97Å; L131-Y134 VanDerWaalsContact O-N 3.12Å; L131-L135 HydrophobicContact CD1-CD1 3.74Å; L131-L135 HydrophobicContact CD1-CG 3.98Å; L131-L135 HydrophobicContact CG-CD1 3.97Å; L131-L135 HydrophobicContact CG-CG 4.42Å; L131-L135 WeakPolarHBondContact O-CG 3.36Å; L131-L135 PolarHBondContact O-N 3.2Å; L131-L156 HydrophobicContact CD2-CD1 4.01Å; L131-A160 HydrophobicContact CD2-CB 4.11Å; L131-F164 HydrophobicContact CD1-CZ 4.34Å; L131-F164 HydrophobicContact CD2-CE2 4.08Å
132	L	98.5	Very high	97.4	Very high	6 Å²	6	57.4 Å²	57.4	3%	0.031	30%	0.297	C	S	.	.	H	α-helix	trans	-62	-45.3	178.9	-63	175.5	0	0	0	111.7	V128 T129 Y134 L135 R136 E159 A160 L163	V128-L132 WeakPolarHBondContact O-CG 3.49Å; V128-L132 PolarHBondContact O-N 2.91Å; V128-L132 VanDerWaalsContact O-N 3.1Å; T129-L132 PolarHBondContact O-N 2.84Å; L132-Y134 PolarHBondContact O-N 3.16Å; L132-L135 PolarHBondContact O-N 2.99Å; L132-R136 WeakPolarHBondContact O-CB 3.36Å; L132-R136 VanDerWaalsContact O-CG 3.24Å; L132-R136 WeakPolarHBondContact O-CG 3.23Å; L132-R136 PolarHBondContact O-N 2.88Å; L132-E159 WeakPolarHBondContact CD1-OE2 3.43Å; L132-E159 HydrophobicContact CD2-CB 4.21Å; L132-E159 HydrophobicContact CD2-CG 4.01Å; L132-A160 HydrophobicContact CD2-CB 3.87Å; L132-L163 HydrophobicContact CD2-CD1 3.65Å
133	K	98.3	Very high	97.4	Very high	131 Å²	131	56 Å²	56	57%	0.57	29%	0.289	S	S	*	.	H	α-helix	trans	-61.6	-29.8	175.3	-74	171.1	-178.9	165.2	0	112.5	T129 L131 P137	T129-K133 HydrophobicContact CG2-CD 4.34Å; T129-K133 WeakPolarHBondContact O-CG 3.13Å; T129-K133 PolarHBondContact O-N 2.9Å; L131-K133 PolarHBondContact O-N 2.74Å; K133-P137 WeakPolarHBondContact O-CD 3.4Å; K133-P137 WeakPolarHBondContact O-CG 3.49Å
134	Y	98.3	Very high	97.4	Very high	25 Å²	25	55.9 Å²	55.9	10%	0.098	29%	0.289	C	S	.	.	H	α-helix	trans	-77.7	-38.6	178.3	-172	-110.5	0	0	0	113.3	I105 L107 D117 K119 F121 D130 L131 L132	I105-Y134 HydrophobicContact CB-CE1 4.23Å; I105-Y134 HydrophobicContact CG2-CE1 3.97Å; L107-Y134 HydrophobicContact CD1-CD1 4.5Å; L107-Y134 HydrophobicContact CD1-CE1 3.69Å; L107-Y134 HydrophobicContact CD1-CE2 4.03Å; L107-Y134 VanDerWaalsContact CD1-CZ 3.42Å; L107-Y134 WeakPolarHBondContact CD1-OH 3.33Å; L107-Y134 HydrophobicContact CD2-CE1 4.22Å; L107-Y134 HydrophobicContact CG-CE1 3.89Å; L107-Y134 WeakPolarHBondContact CG-OH 3.08Å; D117-Y134 HydrophobicContact CB-CE2 4.48Å; D117-Y134 WeakPolarHBondContact OD2-CE2 3.48Å; K119-Y134 HydrophobicContact CB-CE2 4.11Å; K119-Y134 HydrophobicContact CD-CD2 4.25Å; K119-Y134 HydrophobicContact CD-CE2 4.22Å; F121-Y134 HydrophobicContact CE1-CG 4.25Å; F121-Y134 AromaticContact CE2-CD1 3.58Å; F121-Y134 HydrophobicContact CE2-CD1 3.58Å; F121-Y134 AromaticContact CE2-CE1 3.9Å; F121-Y134 HydrophobicContact CE2-CE1 3.9Å; F121-Y134 HydrophobicContact CE2-CG 4.04Å; F121-Y134 VanDerWaalsContact CZ-CB 3.48Å; F121-Y134 AromaticContact CZ-CD1 3.4Å; F121-Y134 HydrophobicContact CZ-CD1 3.4Å; F121-Y134 VanDerWaalsContact CZ-CD1 3.4Å; F121-Y134 AromaticContact CZ-CD2 3.92Å; F121-Y134 HydrophobicContact CZ-CD2 3.92Å; F121-Y134 HydrophobicContact CZ-CE1 4.01Å; F121-Y134 HydrophobicContact CZ-CE2 4.45Å; F121-Y134 AromaticContact CZ-CG 3.34Å; F121-Y134 HydrophobicContact CZ-CG 3.34Å; D130-Y134 WeakPolarHBondContact O-CB 3.4Å; D130-Y134 PolarHBondContact O-N 3.16Å; D130-Y134 VanDerWaalsContact O-N 3.12Å; L131-Y134 WeakPolarHBondContact O-CB 3.37Å; L131-Y134 PolarHBondContact O-N 2.97Å; L131-Y134 VanDerWaalsContact O-N 3.12Å; L132-Y134 PolarHBondContact O-N 3.16Å
135	L	98.3	Very high	97.5	Very high	3 Å²	3	50.2 Å²	50.2	2%	0.016	27%	0.267	C	S	.	.	H	α-helix	trans	-88.5	-27	-175.4	-65.7	-178.6	0	0	0	114.4	I105 L131 L132 L138 L163 F164 L167	I105-L135 HydrophobicContact CD1-CD2 4.37Å; L131-L135 HydrophobicContact CD1-CD1 3.74Å; L131-L135 HydrophobicContact CD1-CG 3.98Å; L131-L135 HydrophobicContact CG-CD1 3.97Å; L131-L135 HydrophobicContact CG-CG 4.42Å; L131-L135 WeakPolarHBondContact O-CG 3.36Å; L131-L135 PolarHBondContact O-N 3.2Å; L132-L135 PolarHBondContact O-N 2.99Å; L135-L138 HydrophobicContact CD2-CD1 3.91Å; L135-L138 VanDerWaalsContact O-CG 3.23Å; L135-L138 WeakPolarHBondContact O-CG 3.34Å; L135-L163 HydrophobicContact CB-CD1 3.98Å; L135-L163 HydrophobicContact CD1-CB 4.39Å; L135-F164 HydrophobicContact CD1-CE1 4.01Å; L135-F164 HydrophobicContact CD1-CE2 4.01Å; L135-F164 HydrophobicContact CD1-CZ 3.73Å; L135-L167 HydrophobicContact CD2-CD1 4.44Å
136	R	97.1	Very high	97.6	Very high	120 Å²	120	47 Å²	47	45%	0.453	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-43.6	179.6	-76.3	177.4	-169.4	144.6	-3.9	114.6	L132 L138 E159 L163	L132-R136 WeakPolarHBondContact O-CB 3.36Å; L132-R136 VanDerWaalsContact O-CG 3.24Å; L132-R136 WeakPolarHBondContact O-CG 3.23Å; L132-R136 PolarHBondContact O-N 2.88Å; R136-L138 PolarHBondContact O-N 3.05Å; R136-E159 IonicContact CZ-OE1 2.62Å; R136-E159 VanDerWaalsContact CZ-OE1 3.3Å; R136-E159 IonicContact NE-OE1 3.91Å; R136-E159 PolarHBondContact NE-OE1 2.77Å; R136-E159 IonicContact NH2-OE1 3.18Å; R136-E159 PolarHBondContact NH2-OE1 3.36Å; R136-E159 IonicContact NH2-OE2 3.01Å; R136-E159 PolarHBondContact NH2-OE2 3.04Å; R136-E159 VanDerWaalsContact NH2-OE2 3.07Å; R136-L163 HydrophobicContact CG-CD1 4.18Å
137	P	97.3	Very high	97.6	Very high	86 Å²	86	45.9 Å²	45.9	56%	0.558	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.5	12.4	-175.4	34.4	-37	0	0	0	113.8	K133 H139	K133-P137 WeakPolarHBondContact O-CD 3.4Å; K133-P137 WeakPolarHBondContact O-CG 3.49Å; P137-H139 PolarHBondContact O-N 3.31Å
138	L	97.1	Very high	97.7	Very high	21 Å²	21	41.8 Å²	41.8	11%	0.11	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-64.7	129	-180	-64.5	-179.5	0	0	0	111.2	L107 L135 R136 T142 V144 L167 K187	L107-L138 HydrophobicContact CD1-CD2 3.48Å; L107-L138 VanDerWaalsContact CD1-CD2 3.48Å; L107-L138 HydrophobicContact CD2-CD1 4.25Å; L107-L138 HydrophobicContact CD2-CD2 3.77Å; L107-L138 HydrophobicContact CG-CD2 4.24Å; L135-L138 HydrophobicContact CD2-CD1 3.91Å; L135-L138 VanDerWaalsContact O-CG 3.23Å; L135-L138 WeakPolarHBondContact O-CG 3.34Å; R136-L138 PolarHBondContact O-N 3.05Å; L138-T142 HydrophobicContact CD2-CG2 4.2Å; L138-V144 HydrophobicContact CD1-CG2 3.78Å; L138-L167 HydrophobicContact CD1-CD2 4.33Å; L138-K187 HydrophobicContact CB-CB 4.33Å; L138-K187 HydrophobicContact CB-CG 4.23Å
139	H	94.4	Very high	97.7	Very high	151 Å²	151	42 Å²	42	70%	0.699	21%	0.206	S	C	*	.	P	Polyproline II helix	trans	-79.3	149.6	173.1	-59.8	-65.9	0	0	0	111	P137 T142 K187	P137-H139 PolarHBondContact O-N 3.31Å; H139-T142 VanDerWaalsContact O-CB 3.29Å; H139-T142 WeakPolarHBondContact O-CB 3.1Å; H139-T142 PolarHBondContact O-N 3.45Å; H139-T142 VanDerWaalsContact O-N 3.15Å; H139-T142 PolarHBondContact O-OG1 3.07Å; H139-K187 WeakPolarHBondContact O-CB 3.2Å
140	E	94.6	Very high	97.7	Very high	145 Å²	145	40.8 Å²	40.8	68%	0.678	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.7	142.4	173.3	-67.1	-170.3	179.2	0	0	111.8	T142	E140-T142 VanDerWaalsContact C-N 3.28Å; E140-T142 PolarHBondContact O-N 3.02Å
141	G	94	Very high	97.7	Very high	12 Å²	12	37 Å²	37	12%	0.124	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.6	-1.5	-175.2	0	0	0	0	0	114.5	G110 L143 K187	G110-G141 WeakPolarHBondContact CA-O 3.27Å; G110-G141 PolarHBondContact N-O 3Å; G141-L143 PolarHBondContact O-N 2.67Å; G141-K187 PolarHBondContact N-O 3.21Å
142	T	97.8	Very high	97.7	Very high	9 Å²	9	37 Å²	37	6%	0.055	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	123.8	168.9	-54.1	0	0	0	0	110.1	L107 L116 L138 H139 E140 A186 K187	L107-T142 HydrophobicContact CB-CG2 4.15Å; L107-T142 HydrophobicContact CD2-CG2 4.22Å; L116-T142 HydrophobicContact CD1-CG2 3.96Å; L138-T142 HydrophobicContact CD2-CG2 4.2Å; H139-T142 VanDerWaalsContact O-CB 3.29Å; H139-T142 WeakPolarHBondContact O-CB 3.1Å; H139-T142 PolarHBondContact O-N 3.45Å; H139-T142 VanDerWaalsContact O-N 3.15Å; H139-T142 PolarHBondContact O-OG1 3.07Å; E140-T142 VanDerWaalsContact C-N 3.28Å; E140-T142 PolarHBondContact O-N 3.02Å; T142-A186 CarbonylContact O-C 3.58Å; T142-A186 VanDerWaalsContact O-CA 3.31Å; T142-A186 WeakPolarHBondContact O-CA 3.41Å; T142-K187 PolarHBondContact O-N 3.23Å
143	L	98.3	Very high	97.7	Very high	15 Å²	15	37 Å²	37	8%	0.079	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	137.9	169.4	-58.4	176.8	0	0	0	109.6	L68 L107 V108 G141 F145 G185 A186 I221	L68-L143 HydrophobicContact CD1-CD1 4Å; L107-L143 WeakPolarHBondContact CA-O 3.4Å; V108-L143 HydrophobicContact CB-CB 4.21Å; V108-L143 HydrophobicContact CG1-CD1 4.42Å; V108-L143 PolarHBondContact N-O 3.04Å; V108-L143 PolarHBondContact O-N 3.4Å; G141-L143 PolarHBondContact O-N 2.67Å; L143-F145 HydrophobicContact CB-CD2 4.45Å; L143-F145 HydrophobicContact CB-CE2 3.81Å; L143-F145 HydrophobicContact CB-CZ 4.5Å; L143-F145 HydrophobicContact CD1-CE2 4.31Å; L143-F145 HydrophobicContact CD1-CZ 4.38Å; L143-G185 WeakPolarHBondContact CA-O 3.28Å; L143-A186 HydrophobicContact CD2-CB 3.93Å; L143-I221 HydrophobicContact CD1-CD1 4.42Å; L143-I221 HydrophobicContact CD1-CG2 4.1Å; L143-I221 HydrophobicContact CD2-CG2 4.13Å
144	V	98.7	Very high	97.7	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	106.2	-177.3	-173.4	0	0	0	0	108.8	I105 L107 L138 V146 L167 V184 G185	I105-V144 HydrophobicContact CG2-CG1 3.74Å; L107-V144 HydrophobicContact CD2-CB 4.34Å; L107-V144 HydrophobicContact CD2-CG1 4.07Å; L107-V144 HydrophobicContact CD2-CG2 3.85Å; L138-V144 HydrophobicContact CD1-CG2 3.78Å; V144-V146 HydrophobicContact CG1-CG2 4.01Å; V144-L167 HydrophobicContact CB-CD1 4.28Å; V144-L167 HydrophobicContact CG1-CD1 4.18Å; V144-L167 HydrophobicContact CG2-CD1 4.02Å; V144-L167 HydrophobicContact CG2-CD2 3.87Å; V144-V184 CarbonylContact O-C 3.51Å; V144-V184 WeakPolarHBondContact O-CA 3.49Å; V144-G185 PolarHBondContact N-O 3.34Å; V144-G185 PolarHBondContact O-N 2.94Å
145	F	98.9	Very high	97.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	131.2	175.9	-62	-96.4	0	0	0	109.4	F70 L72 I84 L86 I105 A106 V108 L143 V184 I221	F70-F145 HydrophobicContact CB-CE1 3.75Å; F70-F145 HydrophobicContact CB-CZ 4.49Å; F70-F145 HydrophobicContact CD1-CE1 4.44Å; F70-F145 HydrophobicContact CD2-CE1 4.28Å; F70-F145 AromaticContact CG-CE1 3.9Å; F70-F145 HydrophobicContact CG-CE1 3.9Å; L72-F145 HydrophobicContact CD1-CB 4.47Å; L72-F145 HydrophobicContact CD1-CD1 3.57Å; L72-F145 HydrophobicContact CD1-CE1 4.3Å; L72-F145 HydrophobicContact CD1-CG 4.47Å; I84-F145 HydrophobicContact CD1-CB 4.22Å; I84-F145 HydrophobicContact CG2-CB 4Å; I84-F145 HydrophobicContact CG2-CG 4.34Å; L86-F145 HydrophobicContact CD1-CE1 4.32Å; L86-F145 HydrophobicContact CD1-CE2 4.49Å; L86-F145 HydrophobicContact CD1-CZ 3.74Å; L86-F145 HydrophobicContact CD2-CE2 4.5Å; I105-F145 CarbonylContact C-O 3.58Å; I105-F145 WeakPolarHBondContact CA-O 3.42Å; A106-F145 HydrophobicContact CB-CB 4.29Å; A106-F145 PolarHBondContact N-O 3.22Å; A106-F145 PolarHBondContact O-N 2.95Å; V108-F145 HydrophobicContact CB-CD2 4.42Å; V108-F145 HydrophobicContact CB-CE2 3.9Å; V108-F145 HydrophobicContact CG2-CD2 3.92Å; V108-F145 HydrophobicContact CG2-CE2 3.7Å; L143-F145 HydrophobicContact CB-CD2 4.45Å; L143-F145 HydrophobicContact CB-CE2 3.81Å; L143-F145 HydrophobicContact CB-CZ 4.5Å; L143-F145 HydrophobicContact CD1-CE2 4.31Å; L143-F145 HydrophobicContact CD1-CZ 4.38Å; F145-V184 HydrophobicContact CD1-CB 4.19Å; F145-V184 HydrophobicContact CD1-CG1 3.67Å; F145-V184 HydrophobicContact CD1-CG2 3.48Å; F145-V184 VanDerWaalsContact CD1-CG2 3.48Å; F145-V184 HydrophobicContact CE1-CB 4.39Å; F145-V184 HydrophobicContact CE1-CG1 3.6Å; F145-V184 HydrophobicContact CE1-CG2 3.86Å; F145-V184 HydrophobicContact CE2-CG1 4.49Å; F145-V184 HydrophobicContact CG-CG1 4.22Å; F145-V184 HydrophobicContact CG-CG2 4.41Å; F145-V184 HydrophobicContact CZ-CG1 4.03Å; F145-I221 HydrophobicContact CE1-CD1 3.55Å; F145-I221 HydrophobicContact CZ-CD1 3.44Å; F145-I221 VanDerWaalsContact CZ-CD1 3.44Å
146	V	98.9	Very high	97.7	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	130.1	-176.6	-172.2	0	0	0	0	110.1	L72 L103 N104 I105 V144 F164 W181 V182 F183	L72-V146 WeakPolarHBondContact CD2-O 3.26Å; L103-V146 HydrophobicContact CB-CG1 4.44Å; L103-V146 HydrophobicContact CD2-CG1 3.86Å; N104-V146 WeakPolarHBondContact O-CA 3.25Å; I105-V146 HydrophobicContact CG1-CG1 4.36Å; I105-V146 HydrophobicContact CG1-CG2 4.23Å; V144-V146 HydrophobicContact CG1-CG2 4.01Å; V146-F164 HydrophobicContact CG2-CE1 3.84Å; V146-W181 HydrophobicContact CB-CZ3 4.34Å; V146-W181 HydrophobicContact CG1-CE3 3.99Å; V146-W181 HydrophobicContact CG1-CH2 4.26Å; V146-W181 HydrophobicContact CG1-CZ3 3.6Å; V146-V182 WeakPolarHBondContact O-CA 3.32Å; V146-F183 HydrophobicContact CB-CB 4.27Å; V146-F183 HydrophobicContact CB-CD1 4.33Å; V146-F183 HydrophobicContact CG2-CD1 3.87Å; V146-F183 PolarHBondContact N-O 3.38Å; V146-F183 PolarHBondContact O-N 3.44Å
147	A	98.8	Very high	97.7	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	127.1	170.6	0	0	0	0	0	110.2	P82 I84 N104 V182	P82-A147 HydrophobicContact CB-CB 3.65Å; P82-A147 HydrophobicContact CG-CB 4.43Å; I84-A147 HydrophobicContact CD1-CB 4.24Å; I84-A147 HydrophobicContact CG1-CB 4.13Å; N104-A147 WeakPolarHBondContact CB-O 3.18Å; N104-A147 PolarHBondContact N-O 2.52Å; N104-A147 PolarHBondContact ND2-O 3.49Å; N104-A147 PolarHBondContact O-N 3.05Å; A147-V182 HydrophobicContact CB-CG1 4.44Å
148	S	98.7	Very high	97.8	Very high	4 Å²	4	36.2 Å²	36.2	3%	0.028	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	153.6	178.3	71	0	0	0	0	112.5	G75 G102 S180 W181	G75-S148 PolarHBondContact N-O 3.34Å; G102-S148 CarbonylContact O-C 3.59Å; G102-S148 WeakPolarHBondContact O-CA 3.17Å; S148-S180 WeakPolarHBondContact OG-CA 3.29Å; S148-W181 PolarHBondContact N-O 3.06Å; S148-W181 PolarHBondContact OG-N 3.05Å; S148-W181 PolarHBondContact OG-O 3.43Å
149	F	98.8	Very high	97.8	Very high	24 Å²	24	39 Å²	39	11%	0.105	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	126.9	170.5	-173.5	-156.6	0	0	0	110.9	A77 I80 P82 G100 G102 D151	A77-F149 WeakPolarHBondContact O-CD2 3.3Å; A77-F149 WeakPolarHBondContact O-CE2 3.33Å; I80-F149 WeakPolarHBondContact O-CE2 3.36Å; P82-F149 HydrophobicContact CG-CB 4.13Å; G100-F149 WeakPolarHBondContact O-CD1 3.45Å; G102-F149 PolarHBondContact N-O 3.2Å; G102-F149 PolarHBondContact O-N 3.43Å; F149-D151 VanDerWaalsContact C-N 3.33Å; F149-D151 PolarHBondContact O-N 2.79Å
150	D	98.6	Very high	98	Very high	25 Å²	25	31.8 Å²	31.8	13%	0.134	16%	0.164	C	C	.	.	S	Bend	trans	60.5	-78.1	-176	179.2	20	0	0	0	113.9	A77 N78 R101 R178 W211	A77-D150 WeakPolarHBondContact O-CA 3.43Å; A77-D150 PolarHBondContact O-N 2.93Å; N78-D150 HydrophobicContact CB-CB 4Å; R101-D150 WeakPolarHBondContact CD-OD2 3.32Å; R101-D150 HydrophobicContact CG-CB 4Å; D150-R178 WeakPolarHBondContact O-CA 3.19Å; D150-R178 WeakPolarHBondContact O-CB 3.37Å; D150-R178 WeakPolarHBondContact O-CG 3.21Å; D150-R178 IonicContact OD1-NE 2.75Å; D150-W211 PolarHBondContact O-NE1 2.87Å; D150-W211 WeakPolarHBondContact OD1-CZ2 3.46Å; D150-W211 PolarHBondContact OD1-NE1 2.7Å
151	D	98.6	Very high	98.2	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	14%	0.138	C	C	.	.			trans	-137.2	112.8	178.4	174.4	49.2	0	0	0	112.9	G102 W124 F149 A153 T154 F177 R178	G102-D151 VanDerWaalsContact CA-O 3.28Å; G102-D151 WeakPolarHBondContact CA-O 3.41Å; W124-D151 HydrophobicContact CB-CB 4.43Å; F149-D151 VanDerWaalsContact C-N 3.33Å; F149-D151 PolarHBondContact O-N 2.79Å; D151-A153 PolarHBondContact OD1-N 2.61Å; D151-T154 WeakPolarHBondContact OD2-CB 3.5Å; D151-T154 PolarHBondContact OD2-N 3.14Å; D151-T154 PolarHBondContact OD2-OG1 2.63Å; D151-F177 HydrophobicContact CB-CD2 4.29Å; D151-F177 HydrophobicContact CB-CE2 4.3Å; D151-F177 WeakPolarHBondContact OD1-CA 3.07Å; D151-F177 WeakPolarHBondContact OD1-CD2 3.39Å; D151-R178 HydrophobicContact CB-CG 4.15Å; D151-R178 PolarHBondContact OD1-N 2.74Å
152	P	98.2	Very high	98.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.161	C	C	.	.	S	Bend	trans	-92.5	-2.8	179.8	36	-35.3	0	0	0	115.1	L103 M123 L175 D179	L103-P152 HydrophobicContact CD2-CB 3.55Å; L103-P152 HydrophobicContact CG-CB 4.3Å; M123-P152 VanDerWaalsContact CB-C 3.43Å; M123-P152 WeakPolarHBondContact CB-O 3.25Å; M123-P152 WeakPolarHBondContact CG-O 3.47Å; P152-L175 HydrophobicContact CB-CD2 3.93Å; P152-L175 HydrophobicContact CG-CD1 4.45Å; P152-L175 HydrophobicContact CG-CD2 3.85Å; P152-L175 HydrophobicContact CG-CG 4.2Å; P152-D179 WeakPolarHBondContact CD-O 3.34Å; P152-D179 WeakPolarHBondContact CG-O 3.36Å
153	A	98.3	Very high	98.4	Very high	5 Å²	5	34.2 Å²	34.2	4%	0.041	16%	0.163	C	C	.	.	S	Bend	trans	-123.2	-26.7	-158.2	0	0	0	0	0	116.2	D151 K155 L156 L175 T176	D151-A153 PolarHBondContact OD1-N 2.61Å; A153-K155 VanDerWaalsContact C-N 3.28Å; A153-K155 PolarHBondContact O-N 3.21Å; A153-K155 VanDerWaalsContact O-N 3.16Å; A153-L156 WeakPolarHBondContact O-CB 3.2Å; A153-L156 PolarHBondContact O-N 3.23Å; A153-L175 HydrophobicContact CB-CD2 4.49Å; A153-L175 HydrophobicContact CB-CG 4.21Å; A153-T176 VanDerWaalsContact CB-O 3.29Å; A153-T176 WeakPolarHBondContact CB-O 3.42Å
154	T	98.3	Very high	98.4	Very high	69 Å²	69	33.5 Å²	33.5	42%	0.423	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-36.3	-167.8	-75.4	0	0	0	0	114.1	M123 W124 D151 F177	M123-T154 CarbonylContact O-C 3.55Å; M123-T154 WeakPolarHBondContact O-CB 3.24Å; M123-T154 PolarHBondContact O-N 2.85Å; W124-T154 HydrophobicContact CE3-CG2 3.83Å; W124-T154 HydrophobicContact CZ3-CG2 3.99Å; D151-T154 WeakPolarHBondContact OD2-CB 3.5Å; D151-T154 PolarHBondContact OD2-N 3.14Å; D151-T154 PolarHBondContact OD2-OG1 2.63Å; T154-F177 WeakPolarHBondContact OG1-CD2 3.09Å
155	K	98.3	Very high	98.4	Very high	98 Å²	98	36.2 Å²	36.2	43%	0.426	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-1.2	177.2	-66.9	-63.9	-145.9	174.5	0	114	M123 G126 V128 A153 N157	M123-K155 VanDerWaalsContact O-CB 3.3Å; M123-K155 WeakPolarHBondContact O-CB 2.91Å; M123-K155 VanDerWaalsContact O-CG 3.29Å; M123-K155 WeakPolarHBondContact O-CG 3.33Å; M123-K155 PolarHBondContact O-N 3.24Å; G126-K155 VanDerWaalsContact O-CE 3.32Å; G126-K155 WeakPolarHBondContact O-CE 3.49Å; V128-K155 WeakPolarHBondContact CB-O 3.32Å; A153-K155 VanDerWaalsContact C-N 3.28Å; A153-K155 PolarHBondContact O-N 3.21Å; A153-K155 VanDerWaalsContact O-N 3.16Å; K155-N157 PolarHBondContact O-N 2.77Å; K155-N157 VanDerWaalsContact O-N 3.16Å
156	L	97.8	Very high	98.4	Very high	11 Å²	11	41.1 Å²	41.1	6%	0.058	20%	0.195	C	C	.	.			trans	-74	107.4	-174.9	-159.2	81.4	0	0	0	110.7	L103 M123 L131 A153 A160 R161 F164 V172 L175	L103-L156 HydrophobicContact CD1-CD1 4Å; M123-L156 HydrophobicContact SD-CD1 3.99Å; L131-L156 HydrophobicContact CD2-CD1 4.01Å; A153-L156 WeakPolarHBondContact O-CB 3.2Å; A153-L156 PolarHBondContact O-N 3.23Å; L156-A160 HydrophobicContact CD1-CB 3.85Å; L156-A160 HydrophobicContact CG-CB 4.22Å; L156-R161 HydrophobicContact CD2-CG 3.62Å; L156-R161 HydrophobicContact CG-CG 3.99Å; L156-R161 PolarHBondContact O-NE 3.45Å; L156-R161 PolarHBondContact O-NH2 2.76Å; L156-F164 HydrophobicContact CD1-CE2 4.34Å; L156-V172 HydrophobicContact CD2-CG2 3.75Å; L156-L175 HydrophobicContact CD2-CD2 4.38Å
157	N	97.8	Very high	98.3	Very high	55 Å²	55	41.2 Å²	41.2	29%	0.294	20%	0.196	S	C	.	.			trans	-89.6	171.8	-178.9	72.2	1.3	0	0	0	112.7	K155 E159 A160 R161	K155-N157 PolarHBondContact O-N 2.77Å; K155-N157 VanDerWaalsContact O-N 3.16Å; N157-E159 PolarHBondContact O-N 2.89Å; N157-E159 PolarHBondContact OD1-N 2.96Å; N157-A160 PolarHBondContact O-N 3.29Å; N157-A160 WeakPolarHBondContact OD1-CB 3.48Å; N157-A160 PolarHBondContact OD1-N 3.2Å; N157-R161 VanDerWaalsContact O-CG 3.32Å; N157-R161 WeakPolarHBondContact O-CG 2.81Å; N157-R161 PolarHBondContact O-N 3.37Å
158	D	98.3	Very high	98.3	Very high	116 Å²	116	41.5 Å²	41.5	62%	0.62	20%	0.198	S	C	*	.	H	α-helix	trans	-59.3	-33.6	-178	-66.4	-13.5	0	0	0	113.1	R162	D158-R162 WeakPolarHBondContact O-CB 3.47Å; D158-R162 VanDerWaalsContact O-CG 3.23Å; D158-R162 WeakPolarHBondContact O-CG 3.42Å; D158-R162 PolarHBondContact O-N 2.84Å
159	E	98.2	Very high	98.3	Very high	79 Å²	79	41.6 Å²	41.6	37%	0.369	20%	0.199	S	C	.	.	H	α-helix	trans	-68.2	-46.8	177.8	-168.3	-177.3	176.7	0	0	111.7	L132 R136 N157 R161 R162 L163	L132-E159 WeakPolarHBondContact CD1-OE2 3.43Å; L132-E159 HydrophobicContact CD2-CB 4.21Å; L132-E159 HydrophobicContact CD2-CG 4.01Å; R136-E159 IonicContact CZ-OE1 2.62Å; R136-E159 VanDerWaalsContact CZ-OE1 3.3Å; R136-E159 IonicContact NE-OE1 3.91Å; R136-E159 PolarHBondContact NE-OE1 2.77Å; R136-E159 IonicContact NH2-OE1 3.18Å; R136-E159 PolarHBondContact NH2-OE1 3.36Å; R136-E159 IonicContact NH2-OE2 3.01Å; R136-E159 PolarHBondContact NH2-OE2 3.04Å; R136-E159 VanDerWaalsContact NH2-OE2 3.07Å; N157-E159 PolarHBondContact O-N 2.89Å; N157-E159 PolarHBondContact OD1-N 2.96Å; E159-R161 VanDerWaalsContact C-N 3.28Å; E159-R161 PolarHBondContact O-N 3.33Å; E159-R162 PolarHBondContact O-N 2.87Å; E159-L163 PolarHBondContact O-N 3.28Å
160	A	98.4	Very high	98.2	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.5	-40	176.4	0	0	0	0	0	111.1	V128 L131 L132 L156 N157 L163 F164	V128-A160 HydrophobicContact CG2-CB 4Å; L131-A160 HydrophobicContact CD2-CB 4.11Å; L132-A160 HydrophobicContact CD2-CB 3.87Å; L156-A160 HydrophobicContact CD1-CB 3.85Å; L156-A160 HydrophobicContact CG-CB 4.22Å; N157-A160 PolarHBondContact O-N 3.29Å; N157-A160 WeakPolarHBondContact OD1-CB 3.48Å; N157-A160 PolarHBondContact OD1-N 3.2Å; A160-L163 PolarHBondContact O-N 3.24Å; A160-F164 VanDerWaalsContact O-CD2 3.25Å; A160-F164 WeakPolarHBondContact O-CD2 3.47Å; A160-F164 PolarHBondContact O-N 2.87Å; A160-F164 VanDerWaalsContact O-N 3.14Å
161	R	98.6	Very high	98.2	Very high	37 Å²	37	43.7 Å²	43.7	14%	0.14	22%	0.215	C	C	.	.	H	α-helix	trans	-60.6	-47	174.9	-67.3	175	-171.7	-95.8	2.9	111.1	L156 N157 E159 L163 F164 E165 V172 K173 L175	L156-R161 HydrophobicContact CD2-CG 3.62Å; L156-R161 HydrophobicContact CG-CG 3.99Å; L156-R161 PolarHBondContact O-NE 3.45Å; L156-R161 PolarHBondContact O-NH2 2.76Å; N157-R161 VanDerWaalsContact O-CG 3.32Å; N157-R161 WeakPolarHBondContact O-CG 2.81Å; N157-R161 PolarHBondContact O-N 3.37Å; E159-R161 VanDerWaalsContact C-N 3.28Å; E159-R161 PolarHBondContact O-N 3.33Å; R161-L163 VanDerWaalsContact C-N 3.35Å; R161-L163 PolarHBondContact O-N 2.78Å; R161-F164 PolarHBondContact O-N 3.44Å; R161-F164 VanDerWaalsContact O-N 3.16Å; R161-E165 WeakPolarHBondContact O-CG 3.49Å; R161-E165 PolarHBondContact O-N 2.95Å; R161-V172 HydrophobicContact CB-CG2 4.38Å; R161-V172 HydrophobicContact CG-CG2 4.15Å; R161-V172 PolarHBondContact NH1-O 2.92Å; R161-V172 WeakPolarHBondContact O-CG1 3.09Å; R161-K173 PolarHBondContact NH1-O 2.89Å; R161-L175 PolarHBondContact NH1-O 2.75Å; R161-L175 PolarHBondContact NH2-O 3.27Å
162	R	98.4	Very high	98.2	Very high	161 Å²	161	43.7 Å²	43.7	61%	0.608	22%	0.215	S	C	*	.	H	α-helix	trans	-59	-42	175.8	-73.9	171.5	-171	-171.2	3.7	112.6	D158 E159 F164 E165 E166	D158-R162 WeakPolarHBondContact O-CB 3.47Å; D158-R162 VanDerWaalsContact O-CG 3.23Å; D158-R162 WeakPolarHBondContact O-CG 3.42Å; D158-R162 PolarHBondContact O-N 2.84Å; E159-R162 PolarHBondContact O-N 2.87Å; R162-F164 VanDerWaalsContact C-N 3.32Å; R162-F164 PolarHBondContact O-N 3.17Å; R162-E165 WeakPolarHBondContact O-CB 3.38Å; R162-E165 PolarHBondContact O-N 3.47Å; R162-E165 VanDerWaalsContact O-N 3.15Å; R162-E166 WeakPolarHBondContact O-CG 3.38Å; R162-E166 PolarHBondContact O-N 2.78Å
163	L	98.3	Very high	98.1	Very high	19 Å²	19	49.9 Å²	49.9	10%	0.099	24%	0.241	C	C	.	.	H	α-helix	trans	-61	-40.7	176.2	-70.3	176.4	0	0	0	111.9	L132 L135 R136 E159 A160 R161 E166 L167	L132-L163 HydrophobicContact CD2-CD1 3.65Å; L135-L163 HydrophobicContact CB-CD1 3.98Å; L135-L163 HydrophobicContact CD1-CB 4.39Å; R136-L163 HydrophobicContact CG-CD1 4.18Å; E159-L163 PolarHBondContact O-N 3.28Å; A160-L163 PolarHBondContact O-N 3.24Å; R161-L163 VanDerWaalsContact C-N 3.35Å; R161-L163 PolarHBondContact O-N 2.78Å; L163-E166 PolarHBondContact O-N 3.16Å; L163-L167 VanDerWaalsContact O-CG 3.27Å; L163-L167 WeakPolarHBondContact O-CG 3.44Å; L163-L167 PolarHBondContact O-N 3.5Å
164	F	98.6	Very high	98	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-69.7	-31.9	175	-77.8	-62	0	0	0	113.2	L103 I105 L131 L135 V146 L156 A160 R161 R162 L167 G168 S169 V172 W181 F183	L103-F164 HydrophobicContact CD1-CE2 3.83Å; L103-F164 HydrophobicContact CD1-CZ 3.94Å; I105-F164 HydrophobicContact CD1-CE1 4.47Å; I105-F164 HydrophobicContact CD1-CZ 4.04Å; L131-F164 HydrophobicContact CD1-CZ 4.34Å; L131-F164 HydrophobicContact CD2-CE2 4.08Å; L135-F164 HydrophobicContact CD1-CE1 4.01Å; L135-F164 HydrophobicContact CD1-CE2 4.01Å; L135-F164 HydrophobicContact CD1-CZ 3.73Å; V146-F164 HydrophobicContact CG2-CE1 3.84Å; L156-F164 HydrophobicContact CD1-CE2 4.34Å; A160-F164 VanDerWaalsContact O-CD2 3.25Å; A160-F164 WeakPolarHBondContact O-CD2 3.47Å; A160-F164 PolarHBondContact O-N 2.87Å; A160-F164 VanDerWaalsContact O-N 3.14Å; R161-F164 PolarHBondContact O-N 3.44Å; R161-F164 VanDerWaalsContact O-N 3.16Å; R162-F164 VanDerWaalsContact C-N 3.32Å; R162-F164 PolarHBondContact O-N 3.17Å; F164-L167 HydrophobicContact CD1-CD1 3.96Å; F164-L167 HydrophobicContact CE1-CD1 4.37Å; F164-L167 CarbonylContact O-C 3.45Å; F164-L167 WeakPolarHBondContact O-CB 3.45Å; F164-L167 PolarHBondContact O-N 3.32Å; F164-L167 VanDerWaalsContact O-N 3.16Å; F164-G168 PolarHBondContact O-N 2.9Å; F164-S169 VanDerWaalsContact O-CB 3.23Å; F164-S169 WeakPolarHBondContact O-CB 3.29Å; F164-S169 PolarHBondContact O-N 3.31Å; F164-V172 HydrophobicContact CB-CB 3.99Å; F164-V172 HydrophobicContact CB-CG1 3.79Å; F164-V172 HydrophobicContact CB-CG2 3.76Å; F164-V172 HydrophobicContact CD2-CG2 3.88Å; F164-V172 HydrophobicContact CG-CG2 4.13Å; F164-W181 AromaticContact CD1-CH2 3.98Å; F164-W181 HydrophobicContact CD1-CH2 3.98Å; F164-W181 HydrophobicContact CD2-CH2 4.42Å; F164-W181 HydrophobicContact CE1-CH2 4.2Å; F164-W181 HydrophobicContact CG-CH2 4.11Å; F164-W181 HydrophobicContact CZ-CH2 4.5Å; F164-F183 HydrophobicContact CD1-CD1 4.39Å; F164-F183 HydrophobicContact CD1-CE1 4.12Å
165	E	98.1	Very high	98	Very high	57 Å²	57	52.4 Å²	52.4	27%	0.266	25%	0.248	S	C	.	.	H	α-helix	trans	-62.8	-43.7	171.4	-68	168.2	-175.9	0	0	112	R161 R162 L167 G168 V172 K173	R161-E165 WeakPolarHBondContact O-CG 3.49Å; R161-E165 PolarHBondContact O-N 2.95Å; R162-E165 WeakPolarHBondContact O-CB 3.38Å; R162-E165 PolarHBondContact O-N 3.47Å; R162-E165 VanDerWaalsContact O-N 3.15Å; E165-L167 PolarHBondContact O-N 3.38Å; E165-G168 WeakPolarHBondContact O-CA 3.34Å; E165-G168 PolarHBondContact O-N 3.13Å; E165-V172 HydrophobicContact CG-CG1 3.8Å; E165-K173 HydrophobicContact CG-CG 4.49Å; E165-K173 WeakPolarHBondContact OE1-CD 3.31Å; E165-K173 WeakPolarHBondContact OE1-CE 3.38Å; E165-K173 WeakPolarHBondContact OE1-CG 3.26Å; E165-K173 IonicContact OE1-NZ 3.42Å; E165-K173 PolarHBondContact OE1-NZ 2.91Å; E165-K173 IonicContact OE2-NZ 4Å; E165-K173 PolarHBondContact OE2-NZ 2.93Å
166	E	97.5	Very high	98	Very high	102 Å²	102	50.8 Å²	50.8	48%	0.477	25%	0.246	S	C	.	.	H	α-helix	trans	-62.2	-24	173.3	-70.3	177.7	-160.9	0	0	112.8	R162 L163 G168 K187	R162-E166 WeakPolarHBondContact O-CG 3.38Å; R162-E166 PolarHBondContact O-N 2.78Å; L163-E166 PolarHBondContact O-N 3.16Å; E166-G168 VanDerWaalsContact C-N 3.28Å; E166-K187 IonicContact OE2-NZ 3.3Å; E166-K187 PolarHBondContact OE2-NZ 2.81Å
167	L	98.3	Very high	98	Very high	3 Å²	3	54 Å²	54	2%	0.016	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-2.5	173.1	-64.8	170.8	0	0	0	112.8	L135 L138 V144 L163 F164 E165 F183 G185 A186 K187	L135-L167 HydrophobicContact CD2-CD1 4.44Å; L138-L167 HydrophobicContact CD1-CD2 4.33Å; V144-L167 HydrophobicContact CB-CD1 4.28Å; V144-L167 HydrophobicContact CG1-CD1 4.18Å; V144-L167 HydrophobicContact CG2-CD1 4.02Å; V144-L167 HydrophobicContact CG2-CD2 3.87Å; L163-L167 VanDerWaalsContact O-CG 3.27Å; L163-L167 WeakPolarHBondContact O-CG 3.44Å; L163-L167 PolarHBondContact O-N 3.5Å; F164-L167 HydrophobicContact CD1-CD1 3.96Å; F164-L167 HydrophobicContact CE1-CD1 4.37Å; F164-L167 CarbonylContact O-C 3.45Å; F164-L167 WeakPolarHBondContact O-CB 3.45Å; F164-L167 PolarHBondContact O-N 3.32Å; F164-L167 VanDerWaalsContact O-N 3.16Å; E165-L167 PolarHBondContact O-N 3.38Å; L167-F183 HydrophobicContact CB-CE1 4.16Å; L167-F183 HydrophobicContact CB-CZ 4.13Å; L167-F183 WeakPolarHBondContact O-CZ 3.38Å; L167-G185 WeakPolarHBondContact O-CA 3.37Å; L167-A186 PolarHBondContact O-N 2.97Å; L167-A186 VanDerWaalsContact O-N 3.11Å; L167-K187 HydrophobicContact CD2-CB 3.98Å; L167-K187 HydrophobicContact CD2-CD 4.08Å
168	G	98.1	Very high	98	Very high	5 Å²	5	54 Å²	54	5%	0.052	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	103	7.9	176	0	0	0	0	0	115.3	F164 E165 E166 S193	F164-G168 PolarHBondContact O-N 2.9Å; E165-G168 WeakPolarHBondContact O-CA 3.34Å; E165-G168 PolarHBondContact O-N 3.13Å; E166-G168 VanDerWaalsContact C-N 3.28Å; G168-S193 PolarHBondContact O-N 2.79Å
169	S	98.4	Very high	98	Very high	7 Å²	7	48.6 Å²	48.6	5%	0.049	23%	0.227	C	C	.	.			trans	-74.1	137.6	176.4	176	0	0	0	0	111.6	F164 V171 V172 E196	F164-S169 VanDerWaalsContact O-CB 3.23Å; F164-S169 WeakPolarHBondContact O-CB 3.29Å; F164-S169 PolarHBondContact O-N 3.31Å; S169-V171 PolarHBondContact OG-N 3.48Å; S169-V172 WeakPolarHBondContact OG-CB 3.38Å; S169-V172 WeakPolarHBondContact OG-CG1 3.4Å; S169-V172 PolarHBondContact OG-N 3Å; S169-E196 WeakPolarHBondContact CB-OE1 3.39Å; S169-E196 PolarHBondContact OG-OE1 3.43Å
170	T	97.7	Very high	98	Very high	62 Å²	62	45.2 Å²	45.2	38%	0.38	21%	0.212	S	C	.	.	S	Bend	trans	-105.4	-28.7	170.1	56.8	0	0	0	0	112.5	K192 E196	T170-K192 HydrophobicContact CG2-CB 4.03Å; T170-K192 HydrophobicContact CG2-CD 3.43Å; T170-K192 VanDerWaalsContact CG2-CD 3.43Å; T170-K192 HydrophobicContact CG2-CG 3.53Å; T170-E196 PolarHBondContact N-OE2 3.24Å; T170-E196 PolarHBondContact OG1-OE2 2.8Å
171	V	97.6	Very high	98	Very high	31 Å²	31	45.2 Å²	45.2	19%	0.188	21%	0.212	C	C	.	.	S	Bend	trans	-86.5	-21.7	-172.2	178.5	0	0	0	0	112.4	S169 K173 E174 L175 E196 R198	S169-V171 PolarHBondContact OG-N 3.48Å; V171-K173 PolarHBondContact O-N 3.41Å; V171-E174 PolarHBondContact O-N 3.12Å; V171-L175 PolarHBondContact O-N 3.48Å; V171-E196 HydrophobicContact CB-CG 4.21Å; V171-E196 WeakPolarHBondContact CB-OE1 3.38Å; V171-E196 HydrophobicContact CG2-CG 4Å; V171-E196 PolarHBondContact N-OE1 2.83Å; V171-E196 PolarHBondContact N-OE2 3.45Å; V171-R198 HydrophobicContact CG1-CB 3.59Å; V171-R198 HydrophobicContact CG1-CG 3.96Å
172	V	98.1	Very high	98.1	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-57.6	-27.6	-177.1	71.2	0	0	0	0	113.4	L156 R161 F164 E165 S169 E174 L175 W181	L156-V172 HydrophobicContact CD2-CG2 3.75Å; R161-V172 HydrophobicContact CB-CG2 4.38Å; R161-V172 HydrophobicContact CG-CG2 4.15Å; R161-V172 PolarHBondContact NH1-O 2.92Å; R161-V172 WeakPolarHBondContact O-CG1 3.09Å; F164-V172 HydrophobicContact CB-CB 3.99Å; F164-V172 HydrophobicContact CB-CG1 3.79Å; F164-V172 HydrophobicContact CB-CG2 3.76Å; F164-V172 HydrophobicContact CD2-CG2 3.88Å; F164-V172 HydrophobicContact CG-CG2 4.13Å; E165-V172 HydrophobicContact CG-CG1 3.8Å; S169-V172 WeakPolarHBondContact OG-CB 3.38Å; S169-V172 WeakPolarHBondContact OG-CG1 3.4Å; S169-V172 PolarHBondContact OG-N 3Å; V172-E174 PolarHBondContact O-N 2.62Å; V172-L175 PolarHBondContact O-N 3.43Å; V172-W181 HydrophobicContact CB-CZ2 4.37Å; V172-W181 HydrophobicContact CG2-CH2 4.36Å
173	K	96.6	Very high	98.1	Very high	130 Å²	130	35.8 Å²	35.8	57%	0.565	18%	0.176	S	C	*	.	G	3₁₀ helix	trans	-58.7	-36.7	173.4	-76	-172.2	158.3	86.1	0	113	R161 E165 V171	R161-K173 PolarHBondContact NH1-O 2.89Å; E165-K173 HydrophobicContact CG-CG 4.49Å; E165-K173 WeakPolarHBondContact OE1-CD 3.31Å; E165-K173 WeakPolarHBondContact OE1-CE 3.38Å; E165-K173 WeakPolarHBondContact OE1-CG 3.26Å; E165-K173 IonicContact OE1-NZ 3.42Å; E165-K173 PolarHBondContact OE1-NZ 2.91Å; E165-K173 IonicContact OE2-NZ 4Å; E165-K173 PolarHBondContact OE2-NZ 2.93Å; V171-K173 PolarHBondContact O-N 3.41Å
174	E	96.5	Very high	98.1	Very high	127 Å²	127	35 Å²	35	59%	0.593	17%	0.172	S	C	*	.	G	3₁₀ helix	trans	-103.5	1.3	-171.2	-59.8	-176.5	-176.7	0	0	112.9	V171 V172 T176 R198	V171-E174 PolarHBondContact O-N 3.12Å; V172-E174 PolarHBondContact O-N 2.62Å; E174-T176 PolarHBondContact O-N 3.45Å; E174-R198 VanDerWaalsContact O-CZ 3.24Å; E174-R198 PolarHBondContact O-NH1 2.81Å; E174-R198 PolarHBondContact O-NH2 3.3Å; E174-R198 IonicContact OE2-NH1 2.72Å; E174-R198 PolarHBondContact OE2-NH1 3.22Å; E174-R198 VanDerWaalsContact OE2-NH1 3.17Å
175	L	97.8	Very high	98.1	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	17%	0.174	C	C	.	.			trans	-63.8	123.4	-176.9	-161.7	70.8	0	0	0	110.4	P152 A153 L156 R161 V171 V172 D179 W181	P152-L175 HydrophobicContact CB-CD2 3.93Å; P152-L175 HydrophobicContact CG-CD1 4.45Å; P152-L175 HydrophobicContact CG-CD2 3.85Å; P152-L175 HydrophobicContact CG-CG 4.2Å; A153-L175 HydrophobicContact CB-CD2 4.49Å; A153-L175 HydrophobicContact CB-CG 4.21Å; L156-L175 HydrophobicContact CD2-CD2 4.38Å; R161-L175 PolarHBondContact NH1-O 2.75Å; R161-L175 PolarHBondContact NH2-O 3.27Å; V171-L175 PolarHBondContact O-N 3.48Å; V172-L175 PolarHBondContact O-N 3.43Å; L175-D179 HydrophobicContact CD1-CB 3.71Å; L175-D179 HydrophobicContact CG-CB 4.45Å; L175-W181 HydrophobicContact CD1-CB 3.67Å; L175-W181 HydrophobicContact CD1-CD2 4.37Å; L175-W181 HydrophobicContact CD1-CG 3.9Å; L175-W181 HydrophobicContact CD2-CD2 4.18Å; L175-W181 HydrophobicContact CD2-CE3 3.84Å; L175-W181 HydrophobicContact CD2-CZ3 4.41Å
176	T	97.9	Very high	98	Very high	63 Å²	63	33.3 Å²	33.3	39%	0.387	17%	0.168	S	C	.	.			trans	-121.3	171.4	-176.6	49.9	0	0	0	0	112.5	A153 E174 R178 D179 R198	A153-T176 VanDerWaalsContact CB-O 3.29Å; A153-T176 WeakPolarHBondContact CB-O 3.42Å; E174-T176 PolarHBondContact O-N 3.45Å; T176-R178 PolarHBondContact O-N 3.35Å; T176-D179 PolarHBondContact N-OD2 2.96Å; T176-D179 WeakPolarHBondContact O-CB 3.38Å; T176-D179 VanDerWaalsContact O-CG 3.26Å; T176-D179 PolarHBondContact O-N 3.09Å; T176-D179 VanDerWaalsContact OG1-CG 3.3Å; T176-D179 PolarHBondContact OG1-OD1 2.77Å; T176-D179 VanDerWaalsContact OG1-OD1 3.12Å; T176-D179 PolarHBondContact OG1-OD2 3.25Å; T176-R198 PolarHBondContact OG1-NH2 3.06Å
177	F	98.4	Very high	98	Very high	79 Å²	79	30.5 Å²	30.5	35%	0.346	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.5	121.2	-176.9	173.4	-112.4	0	0	0	113.1	W124 D151 T154 D179 N201	W124-F177 HydrophobicContact CE3-CD2 4.18Å; W124-F177 AromaticContact CE3-CE2 3.73Å; W124-F177 HydrophobicContact CE3-CE2 3.73Å; W124-F177 HydrophobicContact CH2-CE2 4Å; W124-F177 AromaticContact CZ3-CD2 3.79Å; W124-F177 HydrophobicContact CZ3-CD2 3.79Å; W124-F177 AromaticContact CZ3-CE2 3.27Å; W124-F177 HydrophobicContact CZ3-CE2 3.27Å; W124-F177 HydrophobicContact CZ3-CZ 4.16Å; D151-F177 HydrophobicContact CB-CD2 4.29Å; D151-F177 HydrophobicContact CB-CE2 4.3Å; D151-F177 WeakPolarHBondContact OD1-CA 3.07Å; D151-F177 WeakPolarHBondContact OD1-CD2 3.39Å; T154-F177 WeakPolarHBondContact OG1-CD2 3.09Å; F177-D179 PolarHBondContact O-N 3.44Å; F177-N201 VanDerWaalsContact O-CB 3.29Å; F177-N201 WeakPolarHBondContact O-CB 3.37Å; F177-N201 PolarHBondContact O-ND2 3.06Å
178	R	98.3	Very high	97.8	Very high	56 Å²	56	32.3 Å²	32.3	21%	0.211	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	19.1	-179.2	-56.6	177.9	169.1	178.5	2	116.6	D150 D151 T176 S180 N201 G210 W211 P212	D150-R178 WeakPolarHBondContact O-CA 3.19Å; D150-R178 WeakPolarHBondContact O-CB 3.37Å; D150-R178 WeakPolarHBondContact O-CG 3.21Å; D150-R178 IonicContact OD1-NE 2.75Å; D151-R178 HydrophobicContact CB-CG 4.15Å; D151-R178 PolarHBondContact OD1-N 2.74Å; T176-R178 PolarHBondContact O-N 3.35Å; R178-S180 PolarHBondContact O-N 2.79Å; R178-N201 HydrophobicContact CB-CB 4.33Å; R178-G210 WeakPolarHBondContact CD-O 3.3Å; R178-G210 PolarHBondContact NH1-O 3.35Å; R178-W211 VanDerWaalsContact CZ-CH2 3.4Å; R178-W211 VanDerWaalsContact NH1-CH2 3.28Å; R178-W211 VanDerWaalsContact NH1-CZ2 3.32Å; R178-W211 VanDerWaalsContact NH2-CH2 3.3Å; R178-P212 WeakPolarHBondContact O-CD 3.45Å; R178-P212 WeakPolarHBondContact O-CG 3.27Å
179	D	98.4	Very high	97.6	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	19%	0.185	C	C	.	.			trans	-59.5	136.9	167.6	-71.4	-6.5	0	0	0	109.7	P152 L175 T176 F177 R198 M199 K200 N201	P152-D179 WeakPolarHBondContact CD-O 3.34Å; P152-D179 WeakPolarHBondContact CG-O 3.36Å; L175-D179 HydrophobicContact CD1-CB 3.71Å; L175-D179 HydrophobicContact CG-CB 4.45Å; T176-D179 PolarHBondContact N-OD2 2.96Å; T176-D179 WeakPolarHBondContact O-CB 3.38Å; T176-D179 VanDerWaalsContact O-CG 3.26Å; T176-D179 PolarHBondContact O-N 3.09Å; T176-D179 VanDerWaalsContact OG1-CG 3.3Å; T176-D179 PolarHBondContact OG1-OD1 2.77Å; T176-D179 VanDerWaalsContact OG1-OD1 3.12Å; T176-D179 PolarHBondContact OG1-OD2 3.25Å; F177-D179 PolarHBondContact O-N 3.44Å; D179-R198 HydrophobicContact CB-CG 4.42Å; D179-R198 IonicContact OD2-CZ 2.76Å; D179-R198 IonicContact OD2-NE 2.62Å; D179-R198 PolarHBondContact OD2-NE 2.97Å; D179-R198 IonicContact OD2-NH2 3.17Å; D179-R198 PolarHBondContact OD2-NH2 3.48Å; D179-M199 WeakPolarHBondContact CA-O 3.4Å; D179-K200 WeakPolarHBondContact OD1-CA 3.18Å; D179-N201 PolarHBondContact OD1-N 3.06Å
180	S	98.5	Very high	97.1	Very high	8 Å²	8	43.3 Å²	43.3	6%	0.056	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	133.2	165.6	-61.2	0	0	0	0	107.8	S148 R178 R198 M199 E213 L215	S148-S180 WeakPolarHBondContact OG-CA 3.29Å; R178-S180 PolarHBondContact O-N 2.79Å; S180-R198 CarbonylContact O-C 3.59Å; S180-R198 VanDerWaalsContact O-CA 3.26Å; S180-R198 WeakPolarHBondContact O-CA 3.18Å; S180-M199 PolarHBondContact N-O 3.06Å; S180-M199 PolarHBondContact O-N 3.07Å; S180-E213 WeakPolarHBondContact CB-O 3.04Å; S180-E213 PolarHBondContact OG-O 3.01Å; S180-L215 VanDerWaalsContact O-CD1 3.31Å; S180-L215 WeakPolarHBondContact O-CD1 3.45Å
181	W	98.7	Very high	96.8	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	131.8	-179.4	-179.1	56.9	0	0	0	110.6	L103 V146 S148 F164 V172 L175 F183 E196 Q197	L103-W181 HydrophobicContact CD2-CE3 3.8Å; L103-W181 HydrophobicContact CD2-CZ3 3.78Å; V146-W181 HydrophobicContact CB-CZ3 4.34Å; V146-W181 HydrophobicContact CG1-CE3 3.99Å; V146-W181 HydrophobicContact CG1-CH2 4.26Å; V146-W181 HydrophobicContact CG1-CZ3 3.6Å; S148-W181 PolarHBondContact N-O 3.06Å; S148-W181 PolarHBondContact OG-N 3.05Å; S148-W181 PolarHBondContact OG-O 3.43Å; F164-W181 AromaticContact CD1-CH2 3.98Å; F164-W181 HydrophobicContact CD1-CH2 3.98Å; F164-W181 HydrophobicContact CD2-CH2 4.42Å; F164-W181 HydrophobicContact CE1-CH2 4.2Å; F164-W181 HydrophobicContact CG-CH2 4.11Å; F164-W181 HydrophobicContact CZ-CH2 4.5Å; V172-W181 HydrophobicContact CB-CZ2 4.37Å; V172-W181 HydrophobicContact CG2-CH2 4.36Å; L175-W181 HydrophobicContact CD1-CB 3.67Å; L175-W181 HydrophobicContact CD1-CD2 4.37Å; L175-W181 HydrophobicContact CD1-CG 3.9Å; L175-W181 HydrophobicContact CD2-CD2 4.18Å; L175-W181 HydrophobicContact CD2-CE3 3.84Å; L175-W181 HydrophobicContact CD2-CZ3 4.41Å; W181-F183 HydrophobicContact CD2-CB 4.33Å; W181-F183 HydrophobicContact CH2-CB 4.05Å; W181-F183 AromaticContact CH2-CD1 3.93Å; W181-F183 HydrophobicContact CH2-CD1 3.93Å; W181-F183 HydrophobicContact CH2-CG 4.19Å; W181-F183 HydrophobicContact CZ2-CB 3.38Å; W181-F183 AromaticContact CZ2-CD1 3.77Å; W181-F183 HydrophobicContact CZ2-CD1 3.77Å; W181-F183 HydrophobicContact CZ2-CD2 4.34Å; W181-F183 AromaticContact CZ2-CG 3.59Å; W181-F183 HydrophobicContact CZ2-CG 3.59Å; W181-E196 PolarHBondContact NE1-OE1 3.4Å; W181-Q197 WeakPolarHBondContact CA-O 3.35Å; W181-Q197 VanDerWaalsContact CD1-O 3.24Å
182	V	98.8	Very high	96.7	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	136.3	170.5	-67.2	0	0	0	0	108.5	L72 V146 A147 Q197 L215 M217	L72-V182 HydrophobicContact CB-CB 4.17Å; L72-V182 HydrophobicContact CB-CG1 4.18Å; L72-V182 HydrophobicContact CD2-CB 4.18Å; V146-V182 WeakPolarHBondContact O-CA 3.32Å; A147-V182 HydrophobicContact CB-CG1 4.44Å; V182-Q197 HydrophobicContact CG2-CB 3.85Å; V182-Q197 PolarHBondContact N-O 2.84Å; V182-Q197 PolarHBondContact O-N 2.79Å; V182-L215 HydrophobicContact CG1-CB 4.26Å; V182-L215 HydrophobicContact CG2-CB 4.03Å; V182-L215 HydrophobicContact CG2-CD1 4.25Å; V182-M217 HydrophobicContact CB-CE 4.3Å; V182-M217 HydrophobicContact CG2-CB 3.78Å; V182-M217 HydrophobicContact CG2-CE 4.02Å; V182-M217 HydrophobicContact CG2-SD 4.43Å
183	F	98.8	Very high	96.6	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	140.1	-173.4	167	-113.3	0	0	0	110.5	L72 V146 F164 L167 W181 F195 E196	L72-F183 WeakPolarHBondContact CD2-O 3.4Å; V146-F183 HydrophobicContact CB-CB 4.27Å; V146-F183 HydrophobicContact CB-CD1 4.33Å; V146-F183 HydrophobicContact CG2-CD1 3.87Å; V146-F183 PolarHBondContact N-O 3.38Å; V146-F183 PolarHBondContact O-N 3.44Å; F164-F183 HydrophobicContact CD1-CD1 4.39Å; F164-F183 HydrophobicContact CD1-CE1 4.12Å; L167-F183 HydrophobicContact CB-CE1 4.16Å; L167-F183 HydrophobicContact CB-CZ 4.13Å; L167-F183 WeakPolarHBondContact O-CZ 3.38Å; W181-F183 HydrophobicContact CD2-CB 4.33Å; W181-F183 HydrophobicContact CH2-CB 4.05Å; W181-F183 AromaticContact CH2-CD1 3.93Å; W181-F183 HydrophobicContact CH2-CD1 3.93Å; W181-F183 HydrophobicContact CH2-CG 4.19Å; W181-F183 HydrophobicContact CZ2-CB 3.38Å; W181-F183 AromaticContact CZ2-CD1 3.77Å; W181-F183 HydrophobicContact CZ2-CD1 3.77Å; W181-F183 HydrophobicContact CZ2-CD2 4.34Å; W181-F183 AromaticContact CZ2-CG 3.59Å; W181-F183 HydrophobicContact CZ2-CG 3.59Å; F183-F195 CarbonylContact C-O 3.59Å; F183-F195 WeakPolarHBondContact CA-O 3.29Å; F183-E196 HydrophobicContact CD2-CB 4.04Å; F183-E196 HydrophobicContact CD2-CG 4.05Å
184	V	98.6	Very high	96.7	Very high	3 Å²	3	51.8 Å²	51.8	2%	0.018	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	117.8	166.1	-171.4	0	0	0	0	108.1	F70 L72 V144 F145 S193 F195 M217 I221	F70-V184 HydrophobicContact CD2-CG2 4.15Å; F70-V184 HydrophobicContact CE2-CG2 3.78Å; F70-V184 HydrophobicContact CZ-CG2 4.07Å; L72-V184 HydrophobicContact CD1-CG2 4.1Å; L72-V184 HydrophobicContact CD2-CG2 3.78Å; V144-V184 CarbonylContact O-C 3.51Å; V144-V184 WeakPolarHBondContact O-CA 3.49Å; F145-V184 HydrophobicContact CD1-CB 4.19Å; F145-V184 HydrophobicContact CD1-CG1 3.67Å; F145-V184 HydrophobicContact CD1-CG2 3.48Å; F145-V184 VanDerWaalsContact CD1-CG2 3.48Å; F145-V184 HydrophobicContact CE1-CB 4.39Å; F145-V184 HydrophobicContact CE1-CG1 3.6Å; F145-V184 HydrophobicContact CE1-CG2 3.86Å; F145-V184 HydrophobicContact CE2-CG1 4.49Å; F145-V184 HydrophobicContact CG-CG1 4.22Å; F145-V184 HydrophobicContact CG-CG2 4.41Å; F145-V184 HydrophobicContact CZ-CG1 4.03Å; V184-S193 VanDerWaalsContact O-CB 3.24Å; V184-S193 WeakPolarHBondContact O-CB 3.44Å; V184-S193 PolarHBondContact O-OG 2.8Å; V184-F195 HydrophobicContact CB-CB 3.8Å; V184-F195 HydrophobicContact CB-CD2 4.47Å; V184-F195 HydrophobicContact CB-CG 4.5Å; V184-F195 HydrophobicContact CG2-CB 4.14Å; V184-F195 PolarHBondContact N-O 3.15Å; V184-M217 HydrophobicContact CG2-CE 4.06Å; V184-I221 HydrophobicContact CG1-CD1 3.76Å
185	G	98.1	Very high	96.7	Very high	3 Å²	3	47.7 Å²	47.7	3%	0.031	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	-179.7	176.9	0	0	0	0	0	112.4	L143 V144 L167	L143-G185 WeakPolarHBondContact CA-O 3.28Å; V144-G185 PolarHBondContact N-O 3.34Å; V144-G185 PolarHBondContact O-N 2.94Å; L167-G185 WeakPolarHBondContact O-CA 3.37Å
186	A	97.6	Very high	96.8	Very high	18 Å²	18	49 Å²	49	15%	0.149	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	142	171.8	0	0	0	0	0	111	T142 L143 L167 G188 I189	T142-A186 CarbonylContact O-C 3.58Å; T142-A186 VanDerWaalsContact O-CA 3.31Å; T142-A186 WeakPolarHBondContact O-CA 3.41Å; L143-A186 HydrophobicContact CD2-CB 3.93Å; L167-A186 PolarHBondContact O-N 2.97Å; L167-A186 VanDerWaalsContact O-N 3.11Å; A186-G188 PolarHBondContact O-N 2.87Å; A186-I189 HydrophobicContact CB-CB 4.34Å; A186-I189 WeakPolarHBondContact O-CB 3.46Å; A186-I189 WeakPolarHBondContact O-CG2 3.28Å; A186-I189 PolarHBondContact O-N 3.26Å
187	K	97.3	Very high	96.8	Very high	44 Å²	44	49.8 Å²	49.8	19%	0.191	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	127.1	171.9	-171.8	65.5	177	177.9	0	109.8	L138 H139 G141 T142 E166 L167	L138-K187 HydrophobicContact CB-CB 4.33Å; L138-K187 HydrophobicContact CB-CG 4.23Å; H139-K187 WeakPolarHBondContact O-CB 3.2Å; G141-K187 PolarHBondContact N-O 3.21Å; T142-K187 PolarHBondContact O-N 3.23Å; E166-K187 IonicContact OE2-NZ 3.3Å; E166-K187 PolarHBondContact OE2-NZ 2.81Å; L167-K187 HydrophobicContact CD2-CB 3.98Å; L167-K187 HydrophobicContact CD2-CD 4.08Å
188	G	94	Very high	96.8	Very high	40 Å²	40	48.8 Å²	48.8	41%	0.412	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.5	22.7	-175.1	0	0	0	0	0	113.4	A186	A186-G188 PolarHBondContact O-N 2.87Å
189	I	93.6	Very high	96.7	Very high	57 Å²	57	49.5 Å²	49.5	29%	0.292	26%	0.258	S	S	.	.			trans	-73.5	131.2	170	-161	176.2	0	0	0	109.5	A186 N191	A186-I189 HydrophobicContact CB-CB 4.34Å; A186-I189 WeakPolarHBondContact O-CB 3.46Å; A186-I189 WeakPolarHBondContact O-CG2 3.28Å; A186-I189 PolarHBondContact O-N 3.26Å; I189-N191 VanDerWaalsContact CD1-O 3.24Å; I189-N191 WeakPolarHBondContact CD1-O 3.31Å; I189-N191 VanDerWaalsContact CG1-O 3.23Å; I189-N191 WeakPolarHBondContact CG1-O 3.38Å
190	E	89	Confident	96.7	Very high	187 Å²	187	55.5 Å²	55.5	87%	0.874	28%	0.284	S	S	*	.	S	Bend	trans	-82.5	-29.8	177.7	-64.1	-177.9	168.1	0	0	112.2
191	N	90.9	Very high	96.7	Very high	124 Å²	124	56.8 Å²	56.8	66%	0.663	29%	0.29	S	S	*	.	S	Bend	trans	-111.7	169.3	-175.4	-69.4	-56.5	0	0	0	111.7	I189	I189-N191 VanDerWaalsContact CD1-O 3.24Å; I189-N191 WeakPolarHBondContact CD1-O 3.31Å; I189-N191 VanDerWaalsContact CG1-O 3.23Å; I189-N191 WeakPolarHBondContact CG1-O 3.38Å
192	K	95	Very high	96.5	Very high	156 Å²	156	58.8 Å²	58.8	68%	0.678	30%	0.304	S	S	*	.			trans	-61.8	143.9	170.9	-64	166.9	169.5	-170.7	0	110	T170	T170-K192 HydrophobicContact CG2-CB 4.03Å; T170-K192 HydrophobicContact CG2-CD 3.43Å; T170-K192 VanDerWaalsContact CG2-CD 3.43Å; T170-K192 HydrophobicContact CG2-CG 3.53Å
193	S	96.9	Very high	96.3	Very high	14 Å²	14	69 Å²	69	10%	0.098	35%	0.349	C	S	.	.			trans	-69.4	135.4	173.9	-179.1	0	0	0	0	110.6	G168 V184 F195	G168-S193 PolarHBondContact O-N 2.79Å; V184-S193 VanDerWaalsContact O-CB 3.24Å; V184-S193 WeakPolarHBondContact O-CB 3.44Å; V184-S193 PolarHBondContact O-OG 2.8Å; S193-F195 PolarHBondContact O-N 3.04Å; S193-F195 PolarHBondContact OG-N 3.29Å
194	P	96.8	Very high	96	Very high	106 Å²	106	74.4 Å²	74.4	69%	0.688	39%	0.386	S	S	*	.	S	Bend	trans	-75.6	-8.9	170.2	33.1	-35.3	0	0	0	112.7
195	F	98.1	Very high	95.8	Very high	41 Å²	41	78 Å²	78	18%	0.18	41%	0.412	C	S	.	.			trans	-108.1	75.2	-173.8	-55.4	-59	0	0	0	110.4	F70 F183 V184 S193 M217 C220 I221	F70-F195 AromaticContact CE1-CD1 3.88Å; F70-F195 HydrophobicContact CE1-CD1 3.88Å; F70-F195 HydrophobicContact CE1-CD2 4.26Å; F70-F195 AromaticContact CE1-CE1 3.89Å; F70-F195 HydrophobicContact CE1-CE1 3.89Å; F70-F195 HydrophobicContact CE1-CE2 4.29Å; F70-F195 HydrophobicContact CE1-CG 4.06Å; F70-F195 HydrophobicContact CE1-CZ 4.1Å; F70-F195 HydrophobicContact CZ-CB 4.1Å; F70-F195 AromaticContact CZ-CD1 3.52Å; F70-F195 HydrophobicContact CZ-CD1 3.52Å; F70-F195 HydrophobicContact CZ-CD2 4.35Å; F70-F195 AromaticContact CZ-CE1 3.98Å; F70-F195 HydrophobicContact CZ-CE1 3.98Å; F70-F195 AromaticContact CZ-CG 3.73Å; F70-F195 HydrophobicContact CZ-CG 3.73Å; F183-F195 CarbonylContact C-O 3.59Å; F183-F195 WeakPolarHBondContact CA-O 3.29Å; V184-F195 HydrophobicContact CB-CB 3.8Å; V184-F195 HydrophobicContact CB-CD2 4.47Å; V184-F195 HydrophobicContact CB-CG 4.5Å; V184-F195 HydrophobicContact CG2-CB 4.14Å; V184-F195 PolarHBondContact N-O 3.15Å; S193-F195 PolarHBondContact O-N 3.04Å; S193-F195 PolarHBondContact OG-N 3.29Å; F195-M217 HydrophobicContact CB-CE 3.91Å; F195-M217 HydrophobicContact CB-SD 4.05Å; F195-M217 WeakPolarHBondContact O-CE 3.36Å; F195-C220 WeakPolarHBondContact CZ-O 3.34Å; F195-I221 HydrophobicContact CD2-CG1 4.21Å; F195-I221 HydrophobicContact CE2-CG1 3.78Å; F195-I221 HydrophobicContact CZ-CG1 4.37Å
196	E	98.6	Very high	95.7	Very high	29 Å²	29	79.4 Å²	79.4	14%	0.136	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	130.9	177.3	-172.5	165.8	-139.6	0	0	110.7	S169 T170 V171 W181 F183 M217	S169-E196 WeakPolarHBondContact CB-OE1 3.39Å; S169-E196 PolarHBondContact OG-OE1 3.43Å; T170-E196 PolarHBondContact N-OE2 3.24Å; T170-E196 PolarHBondContact OG1-OE2 2.8Å; V171-E196 HydrophobicContact CB-CG 4.21Å; V171-E196 WeakPolarHBondContact CB-OE1 3.38Å; V171-E196 HydrophobicContact CG2-CG 4Å; V171-E196 PolarHBondContact N-OE1 2.83Å; V171-E196 PolarHBondContact N-OE2 3.45Å; W181-E196 PolarHBondContact NE1-OE1 3.4Å; F183-E196 HydrophobicContact CD2-CB 4.04Å; F183-E196 HydrophobicContact CD2-CG 4.05Å; E196-M217 PolarHBondContact N-SD 3.32Å
197	Q	98.3	Very high	95.7	Very high	80 Å²	80	84.3 Å²	84.3	37%	0.374	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	146.7	172.2	-64	-174.8	35.8	0	0	111.1	W181 V182 L215 E216 M217	W181-Q197 WeakPolarHBondContact CA-O 3.35Å; W181-Q197 VanDerWaalsContact CD1-O 3.24Å; V182-Q197 HydrophobicContact CG2-CB 3.85Å; V182-Q197 PolarHBondContact N-O 2.84Å; V182-Q197 PolarHBondContact O-N 2.79Å; Q197-L215 HydrophobicContact CB-CD1 4.12Å; Q197-L215 HydrophobicContact CB-CD2 4.5Å; Q197-L215 WeakPolarHBondContact O-CD1 3.36Å; Q197-E216 PolarHBondContact NE2-O 3.43Å; Q197-M217 HydrophobicContact CG-SD 4.02Å
198	R	97.9	Very high	95.6	Very high	57 Å²	57	86 Å²	86	22%	0.215	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	141.5	175	169	-176.3	169.2	-155.3	11.5	111.2	V171 E174 T176 D179 S180	V171-R198 HydrophobicContact CG1-CB 3.59Å; V171-R198 HydrophobicContact CG1-CG 3.96Å; E174-R198 VanDerWaalsContact O-CZ 3.24Å; E174-R198 PolarHBondContact O-NH1 2.81Å; E174-R198 PolarHBondContact O-NH2 3.3Å; E174-R198 IonicContact OE2-NH1 2.72Å; E174-R198 PolarHBondContact OE2-NH1 3.22Å; E174-R198 VanDerWaalsContact OE2-NH1 3.17Å; T176-R198 PolarHBondContact OG1-NH2 3.06Å; D179-R198 HydrophobicContact CB-CG 4.42Å; D179-R198 IonicContact OD2-CZ 2.76Å; D179-R198 IonicContact OD2-NE 2.62Å; D179-R198 PolarHBondContact OD2-NE 2.97Å; D179-R198 IonicContact OD2-NH2 3.17Å; D179-R198 PolarHBondContact OD2-NH2 3.48Å; S180-R198 CarbonylContact O-C 3.59Å; S180-R198 VanDerWaalsContact O-CA 3.26Å; S180-R198 WeakPolarHBondContact O-CA 3.18Å
199	M	97.8	Very high	95.6	Very high	72 Å²	72	93 Å²	93	36%	0.355	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	115.9	165.4	-166.8	65.4	75.6	0	0	107.7	D179 S180 P212 L215	D179-M199 WeakPolarHBondContact CA-O 3.4Å; S180-M199 PolarHBondContact N-O 3.06Å; S180-M199 PolarHBondContact O-N 3.07Å; M199-P212 HydrophobicContact CB-CB 4Å; M199-P212 HydrophobicContact CG-CB 3.51Å; M199-L215 HydrophobicContact CB-CD1 4.35Å; M199-L215 HydrophobicContact CB-CD2 4.01Å; M199-L215 HydrophobicContact CB-CG 4.16Å; M199-L215 HydrophobicContact CE-CD2 4.23Å
200	K	97.8	Very high	95.7	Very high	126 Å²	126	91.7 Å²	91.7	55%	0.548	47%	0.465	S	S	.	.			trans	-72.3	135.2	-179.3	-174.9	176.4	179.8	177.7	0	110.4	D179 S202	D179-K200 WeakPolarHBondContact OD1-CA 3.18Å; K200-S202 PolarHBondContact O-N 3.26Å
201	N	97.4	Very high	96.1	Very high	36 Å²	36	84.7 Å²	84.7	19%	0.193	43%	0.43	C	S	.	.			trans	-67.1	117.8	169.1	177.7	17.1	0	0	0	110.1	F177 R178 D179 N206 P212	F177-N201 VanDerWaalsContact O-CB 3.29Å; F177-N201 WeakPolarHBondContact O-CB 3.37Å; F177-N201 PolarHBondContact O-ND2 3.06Å; R178-N201 HydrophobicContact CB-CB 4.33Å; D179-N201 PolarHBondContact OD1-N 3.06Å; N201-N206 PolarHBondContact OD1-ND2 3.34Å; N201-N206 PolarHBondContact OD1-OD1 3.35Å; N201-P212 HydrophobicContact CB-CG 4.37Å
202	S	96.2	Very high	96.4	Very high	42 Å²	42	78.9 Å²	78.9	29%	0.294	40%	0.399	S	S	.	.			trans	-146.8	131	176	176.3	0	0	0	0	111.1	K200 S204 S205 N206	K200-S202 PolarHBondContact O-N 3.26Å; S202-S204 PolarHBondContact O-N 2.94Å; S202-S204 PolarHBondContact OG-OG 3.28Å; S202-S204 VanDerWaalsContact OG-OG 3.06Å; S202-S205 WeakPolarHBondContact CB-OG 3.21Å; S202-S205 PolarHBondContact O-N 3.46Å; S202-S205 VanDerWaalsContact O-N 3.07Å; S202-N206 PolarHBondContact N-OD1 3.45Å; S202-N206 WeakPolarHBondContact O-CB 3.25Å; S202-N206 PolarHBondContact O-N 3.02Å; S202-N206 PolarHBondContact O-ND2 3.48Å; S202-N206 PolarHBondContact O-OD1 3.4Å; S202-N206 VanDerWaalsContact O-OD1 3.06Å
203	K	93.6	Very high	96.5	Very high	214 Å²	214	75.5 Å²	75.5	93%	0.93	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-27.8	179.8	-66.5	-173.7	179.6	-177.2	0	113.6
204	S	93.5	Very high	96.5	Very high	113 Å²	113	76.3 Å²	76.3	79%	0.79	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-19.5	-178.1	57.1	0	0	0	0	114.9	S202	S202-S204 PolarHBondContact O-N 2.94Å; S202-S204 PolarHBondContact OG-OG 3.28Å; S202-S204 VanDerWaalsContact OG-OG 3.06Å
205	S	93.8	Very high	96.6	Very high	79 Å²	79	71.9 Å²	71.9	55%	0.552	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.5	-2.1	-173.4	65	0	0	0	0	114	S202 K207	S202-S205 WeakPolarHBondContact CB-OG 3.21Å; S202-S205 PolarHBondContact O-N 3.46Å; S202-S205 VanDerWaalsContact O-N 3.07Å; S205-K207 PolarHBondContact O-N 2.88Å
206	N	96.3	Very high	96.6	Very high	32 Å²	32	74.8 Å²	74.8	17%	0.171	38%	0.376	C	S	.	.			trans	-64.8	133.7	-179.9	-79.1	-11.6	0	0	0	111.7	N201 S202 Y208 W211 P212	N201-N206 PolarHBondContact OD1-ND2 3.34Å; N201-N206 PolarHBondContact OD1-OD1 3.35Å; S202-N206 PolarHBondContact N-OD1 3.45Å; S202-N206 WeakPolarHBondContact O-CB 3.25Å; S202-N206 PolarHBondContact O-N 3.02Å; S202-N206 PolarHBondContact O-ND2 3.48Å; S202-N206 PolarHBondContact O-OD1 3.4Å; S202-N206 VanDerWaalsContact O-OD1 3.06Å; N206-Y208 WeakPolarHBondContact CB-O 3.41Å; N206-W211 WeakPolarHBondContact CB-O 3.43Å; N206-P212 WeakPolarHBondContact OD1-CA 3.32Å
207	K	96.3	Very high	96.5	Very high	122 Å²	122	73.9 Å²	73.9	53%	0.53	37%	0.372	S	S	.	.	S	Bend	trans	-76	-31.9	173.6	180	168.5	-179.1	160.6	0	112.4	S205 E213	S205-K207 PolarHBondContact O-N 2.88Å; K207-E213 HydrophobicContact CB-CB 3.88Å; K207-E213 HydrophobicContact CD-CB 3.82Å; K207-E213 HydrophobicContact CD-CG 3.68Å; K207-E213 WeakPolarHBondContact CD-OE1 3.17Å; K207-E213 IonicContact NZ-OE1 3.3Å; K207-E213 PolarHBondContact NZ-OE1 2.84Å
208	Y	95.7	Very high	96.5	Very high	80 Å²	80	73 Å²	73	31%	0.314	37%	0.37	S	S	.	.	B	Isolated β-bridge	trans	-111.2	163.3	177.3	-47.4	-68.5	0	0	0	110.4	A76 A77 N206 G210 W211 P212	A76-Y208 HydrophobicContact CB-CE2 4.08Å; A77-Y208 HydrophobicContact CB-CD2 4.37Å; A77-Y208 HydrophobicContact CB-CG 4.45Å; N206-Y208 WeakPolarHBondContact CB-O 3.41Å; Y208-G210 PolarHBondContact O-N 3.44Å; Y208-W211 HydrophobicContact CD2-CB 4.25Å; Y208-W211 PolarHBondContact N-O 2.83Å; Y208-W211 VanDerWaalsContact N-O 3.09Å; Y208-W211 PolarHBondContact O-N 2.9Å; Y208-P212 WeakPolarHBondContact CD2-O 3.32Å; Y208-P212 WeakPolarHBondContact CE2-O 3.35Å
209	E	94.7	Very high	96.5	Very high	187 Å²	187	70.8 Å²	70.8	87%	0.874	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	89.3	179.7	-170.3	-178.5	175	0	0	111.7	W211	E209-W211 WeakPolarHBondContact O-CZ3 3.25Å
210	G	94.9	Very high	96.4	Very high	29 Å²	29	69.1 Å²	69.1	30%	0.299	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.1	13	-179.8	0	0	0	0	0	115.4	R178 Y208	R178-G210 WeakPolarHBondContact CD-O 3.3Å; R178-G210 PolarHBondContact NH1-O 3.35Å; Y208-G210 PolarHBondContact O-N 3.44Å
211	W	97.8	Very high	96.4	Very high	39 Å²	39	63.6 Å²	63.6	15%	0.148	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-135.7	142.4	168.7	-68.8	-101.3	0	0	0	111.4	A77 N78 D150 R178 N206 Y208 E209	A77-W211 HydrophobicContact CB-CB 3.96Å; A77-W211 HydrophobicContact CB-CD2 3.78Å; A77-W211 HydrophobicContact CB-CE3 4.1Å; A77-W211 HydrophobicContact CB-CG 3.74Å; N78-W211 HydrophobicContact CB-CZ2 4.33Å; D150-W211 PolarHBondContact O-NE1 2.87Å; D150-W211 WeakPolarHBondContact OD1-CZ2 3.46Å; D150-W211 PolarHBondContact OD1-NE1 2.7Å; R178-W211 VanDerWaalsContact CZ-CH2 3.4Å; R178-W211 VanDerWaalsContact NH1-CH2 3.28Å; R178-W211 VanDerWaalsContact NH1-CZ2 3.32Å; R178-W211 VanDerWaalsContact NH2-CH2 3.3Å; N206-W211 WeakPolarHBondContact CB-O 3.43Å; Y208-W211 HydrophobicContact CD2-CB 4.25Å; Y208-W211 PolarHBondContact N-O 2.83Å; Y208-W211 VanDerWaalsContact N-O 3.09Å; Y208-W211 PolarHBondContact O-N 2.9Å; E209-W211 WeakPolarHBondContact O-CZ3 3.25Å
212	P	97.6	Very high	96.2	Very high	3 Å²	3	65.8 Å²	65.8	2%	0.019	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-69	170.4	172.9	27.5	-31	0	0	0	112.3	R178 M199 N201 N206 Y208	R178-P212 WeakPolarHBondContact O-CD 3.45Å; R178-P212 WeakPolarHBondContact O-CG 3.27Å; M199-P212 HydrophobicContact CB-CB 4Å; M199-P212 HydrophobicContact CG-CB 3.51Å; N201-P212 HydrophobicContact CB-CG 4.37Å; N206-P212 WeakPolarHBondContact OD1-CA 3.32Å; Y208-P212 WeakPolarHBondContact CD2-O 3.32Å; Y208-P212 WeakPolarHBondContact CE2-O 3.35Å
213	E	97.2	Very high	95.9	Very high	84 Å²	84	66.6 Å²	66.6	39%	0.393	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-60.7	149.3	173.2	178	159.4	-145.8	0	0	112.2	S180 K207	S180-E213 WeakPolarHBondContact CB-O 3.04Å; S180-E213 PolarHBondContact OG-O 3.01Å; K207-E213 HydrophobicContact CB-CB 3.88Å; K207-E213 HydrophobicContact CD-CB 3.82Å; K207-E213 HydrophobicContact CD-CG 3.68Å; K207-E213 WeakPolarHBondContact CD-OE1 3.17Å; K207-E213 IonicContact NZ-OE1 3.3Å; K207-E213 PolarHBondContact NZ-OE1 2.84Å
214	S	97.3	Very high	95.5	Very high	32 Å²	32	61.4 Å²	61.4	22%	0.224	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-66	135.3	171.1	-177.3	0	0	0	0	110.5	S74	S74-S214 PolarHBondContact O-OG 3.25Å; S74-S214 WeakPolarHBondContact OG-CA 3.41Å; S74-S214 PolarHBondContact OG-OG 3.36Å
215	L	97.6	Very high	94.8	Very high	13 Å²	13	59.5 Å²	59.5	7%	0.068	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-89.4	148.1	174.8	-68.3	171	0	0	0	111	V73 S74 S180 V182 Q197 M199	V73-L215 CarbonylContact C-O 3.52Å; V73-L215 VanDerWaalsContact CA-O 3.26Å; V73-L215 WeakPolarHBondContact CA-O 3.23Å; S74-L215 PolarHBondContact N-O 3.16Å; S74-L215 PolarHBondContact OG-N 3.32Å; S180-L215 VanDerWaalsContact O-CD1 3.31Å; S180-L215 WeakPolarHBondContact O-CD1 3.45Å; V182-L215 HydrophobicContact CG1-CB 4.26Å; V182-L215 HydrophobicContact CG2-CB 4.03Å; V182-L215 HydrophobicContact CG2-CD1 4.25Å; Q197-L215 HydrophobicContact CB-CD1 4.12Å; Q197-L215 HydrophobicContact CB-CD2 4.5Å; Q197-L215 WeakPolarHBondContact O-CD1 3.36Å; M199-L215 HydrophobicContact CB-CD1 4.35Å; M199-L215 HydrophobicContact CB-CD2 4.01Å; M199-L215 HydrophobicContact CB-CG 4.16Å; M199-L215 HydrophobicContact CE-CD2 4.23Å
216	E	97.8	Very high	93.7	Very high	102 Å²	102	60.2 Å²	60.2	48%	0.477	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	132.8	167.2	-178.8	169.2	165.2	0	0	108.9	R71 L72 V73 Q197	R71-E216 WeakPolarHBondContact CD-OE1 3.34Å; R71-E216 HydrophobicContact CG-CG 4.34Å; R71-E216 IonicContact CZ-OE1 2.7Å; R71-E216 IonicContact NE-OE1 3.16Å; R71-E216 PolarHBondContact NE-OE1 3.07Å; R71-E216 IonicContact NH1-OE1 2.81Å; R71-E216 IonicContact NH2-OE1 3.84Å; L72-E216 CarbonylContact O-C 3.55Å; L72-E216 WeakPolarHBondContact O-CA 3.23Å; V73-E216 HydrophobicContact CG2-CB 4.49Å; V73-E216 HydrophobicContact CG2-CG 4.13Å; Q197-E216 PolarHBondContact NE2-O 3.43Å
217	M	97.9	Very high	92.3	Very high	10 Å²	10	65.3 Å²	65.3	5%	0.049	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	127.9	176.3	-179.1	175	64.9	0	0	108.6	F70 R71 L72 V182 V184 F195 E196 Q197	F70-M217 HydrophobicContact CE2-CE 4.22Å; F70-M217 HydrophobicContact CE2-CG 4.33Å; R71-M217 WeakPolarHBondContact CA-O 3.49Å; L72-M217 HydrophobicContact CD2-CE 4.36Å; L72-M217 PolarHBondContact N-O 3Å; L72-M217 PolarHBondContact O-N 3.18Å; V182-M217 HydrophobicContact CB-CE 4.3Å; V182-M217 HydrophobicContact CG2-CB 3.78Å; V182-M217 HydrophobicContact CG2-CE 4.02Å; V182-M217 HydrophobicContact CG2-SD 4.43Å; V184-M217 HydrophobicContact CG2-CE 4.06Å; F195-M217 HydrophobicContact CB-CE 3.91Å; F195-M217 HydrophobicContact CB-SD 4.05Å; F195-M217 WeakPolarHBondContact O-CE 3.36Å; E196-M217 PolarHBondContact N-SD 3.32Å; Q197-M217 HydrophobicContact CG-SD 4.02Å
218	D	97.4	Very high	90.3	Very high	60 Å²	60	68.9 Å²	68.9	32%	0.321	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	164.7	172.4	61	50.8	0	0	0	111.1	L59 F70 R71	L59-D218 HydrophobicContact CD1-CB 3.91Å; L59-D218 HydrophobicContact CG-CB 4.2Å; F70-D218 VanDerWaalsContact O-CA 3.27Å; F70-D218 WeakPolarHBondContact O-CA 3.22Å; F70-D218 VanDerWaalsContact O-CB 3.27Å; F70-D218 WeakPolarHBondContact O-CB 3.45Å; R71-D218 HydrophobicContact CB-CB 3.99Å; R71-D218 HydrophobicContact CG-CB 4.15Å; R71-D218 IonicContact CZ-OD2 3.35Å; R71-D218 IonicContact NE-OD2 2.99Å; R71-D218 PolarHBondContact NE-OD2 3.41Å; R71-D218 IonicContact NH2-OD2 3.79Å; R71-D218 PolarHBondContact NH2-OD2 3.06Å
219	G	97.1	Very high	87.9	Confident	12 Å²	12	75.9 Å²	75.9	12%	0.124	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.5	-172.6	-178.3	0	0	0	0	0	113.6	F70	F70-G219 WeakPolarHBondContact CD1-O 3.47Å; F70-G219 VanDerWaalsContact CE1-C 3.41Å; F70-G219 PolarHBondContact N-O 3.07Å; F70-G219 PolarHBondContact O-N 3.37Å; F70-G219 VanDerWaalsContact O-N 3.13Å
220	C	97.6	Very high	87.5	Confident	36 Å²	36	70.3 Å²	70.3	24%	0.243	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	117.3	-177	-56.5	0	0	0	0	109.2	C63 H67 L68 F195	C63-C220 WeakPolarHBondContact CA-SG 3.01Å; C63-C220 HydrophobicContact CB-CB 3.74Å; C63-C220 WeakPolarHBondContact CB-SG 3.47Å; C63-C220 WeakPolarHBondContact SG-CB 3.43Å; C63-C220 CovalentContact SG-SG 2.03Å; C63-C220 PolarHBondContact SG-SG 2.91Å; H67-C220 HydrophobicContact CB-CB 4.03Å; L68-C220 CarbonylContact O-C 3.59Å; L68-C220 VanDerWaalsContact O-CA 3.31Å; L68-C220 WeakPolarHBondContact O-CA 3.3Å; F195-C220 WeakPolarHBondContact CZ-O 3.34Å
221	I	96.4	Very high	87.1	Confident	11 Å²	11	72.5 Å²	72.5	6%	0.056	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	125.9	-179.8	-60.2	156.2	0	0	0	108.5	H67 L68 F70 L143 F145 V184 F195 L223	H67-I221 CarbonylContact C-O 3.57Å; H67-I221 WeakPolarHBondContact CA-O 3.25Å; L68-I221 PolarHBondContact N-O 2.88Å; L68-I221 PolarHBondContact O-N 2.87Å; F70-I221 HydrophobicContact CD1-CD1 3.43Å; F70-I221 VanDerWaalsContact CD1-CD1 3.43Å; F70-I221 HydrophobicContact CD1-CG1 3.57Å; F70-I221 HydrophobicContact CE1-CD1 3.84Å; F70-I221 HydrophobicContact CE1-CG1 3.62Å; F70-I221 HydrophobicContact CG-CD1 4.13Å; L143-I221 HydrophobicContact CD1-CD1 4.42Å; L143-I221 HydrophobicContact CD1-CG2 4.1Å; L143-I221 HydrophobicContact CD2-CG2 4.13Å; F145-I221 HydrophobicContact CE1-CD1 3.55Å; F145-I221 HydrophobicContact CZ-CD1 3.44Å; F145-I221 VanDerWaalsContact CZ-CD1 3.44Å; V184-I221 HydrophobicContact CG1-CD1 3.76Å; F195-I221 HydrophobicContact CD2-CG1 4.21Å; F195-I221 HydrophobicContact CE2-CG1 3.78Å; F195-I221 HydrophobicContact CZ-CG1 4.37Å; I221-L223 PolarHBondContact O-N 3.43Å
222	P	94.1	Very high	86.6	Confident	81 Å²	81	74.3 Å²	74.3	53%	0.526	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	132.6	175	26	-32.9	0	0	0	110.4
223	L	90.1	Very high	85.9	Confident	59 Å²	59	78.5 Å²	78.5	31%	0.309	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-66.7	137.6	172	-77.1	172.7	0	0	0	109.9	K66 L68 I221	K66-L223 WeakPolarHBondContact O-CB 3.42Å; K66-L223 PolarHBondContact O-N 3.07Å; L68-L223 HydrophobicContact CD1-CD2 3.58Å; L68-L223 HydrophobicContact CD2-CD2 3.83Å; L68-L223 HydrophobicContact CD2-CG 4.38Å; L68-L223 HydrophobicContact CG-CD2 3.53Å; L68-L223 HydrophobicContact CG-CG 4.04Å; I221-L223 PolarHBondContact O-N 3.43Å
224	R	84.3	Confident	85.2	Confident	106 Å²	106	78.2 Å²	78.2	40%	0.4	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-68.9	135.4	172.5	-166	175	-180	133.2	-6.3	108.5	G110 V111	G110-R224 PolarHBondContact O-N 3.4Å; V111-R224 HydrophobicContact CG2-CB 4.12Å
225	A	78.8	Confident	84.4	Confident	73 Å²	73	81.3 Å²	81.3	60%	0.603	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-60.4	138.5	169.4	0	0	0	0	0	108.9	L227	A225-L227 PolarHBondContact O-N 3.22Å
226	P	71.3	Confident	83.5	Confident	93 Å²	93	86.1 Å²	86.1	60%	0.604	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-53.1	139.5	167.3	-20.3	31.4	0	0	0	108.8	V111 E228	V111-P226 HydrophobicContact CG1-CB 4.45Å; V111-P226 HydrophobicContact CG1-CG 4.13Å; P226-E228 PolarHBondContact O-N 2.97Å
227	L	65.8	Low	82.3	Confident	139 Å²	139	84.9 Å²	84.9	73%	0.728	47%	0.469	S	S	*	.			trans	-61.3	113.9	168.9	-66.9	171.4	0	0	0	106.8	A225 N229	A225-L227 PolarHBondContact O-N 3.22Å; L227-N229 PolarHBondContact O-N 2.89Å
228	E	54.3	Low	81	Confident	198 Å²	198	91.2 Å²	91.2	93%	0.925	50%	0.504	S	S	*	.			trans	-69.5	110.1	167.8	-68.2	-174.9	165.6	0	0	106.5	P226	P226-E228 PolarHBondContact O-N 2.97Å
229	N	45.7	Very low	79.6	Confident	226 Å²	226	94 Å²	94	100%	1.209	52%	0.521	S	S	*	.			trans	-81.9	0	171.9	-80.9	-11.2	0	0	0	110.6	L227	L227-N229 PolarHBondContact O-N 2.89Å

Retrieved 229 of 229 residues in 1515.6 ms (Link to these results)

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