A0A087YBN7_POEFO Loading...

Activin-binding protein

AlphaFold DB , UniProt , Accession A0A087YBN7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 349 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	35.7	Very low	43.8	Very low	222 Å²	222	152.5 Å²	152.5	100%	1.094	78%	0.78	S	S	*	*				0	116.7	0	-133.5	175.9	164.5	0	0	106.5
2	F	35.8	Very low	45	Very low	200 Å²	200	142.5 Å²	142.5	88%	0.877	74%	0.742	S	S	*	*			trans	59.2	126	172	-60	-82.4	0	0	0	117.2
3	G	33.6	Very low	46.5	Very low	65 Å²	65	138.9 Å²	138.9	67%	0.67	73%	0.73	S	S	*	*			cis	155.7	116	7.7	0	0	0	0	0	105.7	L5	G3-L5 PolarHBondContact O-N 3.07Å
4	M	40.3	Very low	47.4	Very low	196 Å²	196	135.6 Å²	135.6	97%	0.966	71%	0.712	S	S	*	*			trans	-63	112.5	176.3	-77.7	178.7	163.5	0	0	109.4	Q6	M4-Q6 PolarHBondContact O-N 3.35Å
5	L	39.1	Very low	48.7	Very low	143 Å²	143	135.2 Å²	135.2	75%	0.749	70%	0.703	S	S	*	*			trans	-88.7	95.3	167.5	-120.1	95.4	0	0	0	108.9	G3 H7	G3-L5 PolarHBondContact O-N 3.07Å; L5-H7 PolarHBondContact O-N 3.28Å
6	Q	42.9	Very low	49.7	Very low	156 Å²	156	136.1 Å²	136.1	73%	0.729	70%	0.7	S	S	*	*			trans	-77	93.8	170.4	-163.7	167.4	-8.8	0	0	107.6	M4 H8	M4-Q6 PolarHBondContact O-N 3.35Å; Q6-H8 PolarHBondContact O-N 3.26Å
7	H	48.2	Very low	50.8	Low	166 Å²	166	134.9 Å²	134.9	77%	0.769	69%	0.689	S	S	*	*			trans	-70	99.2	171.1	-89.1	-72.6	0	0	0	109	L5 L9	L5-H7 PolarHBondContact O-N 3.28Å; H7-L9 PolarHBondContact O-N 3.24Å
8	H	47.9	Very low	51.6	Low	158 Å²	158	135 Å²	135	73%	0.731	68%	0.683	S	S	*	*			trans	-60.5	101.2	166.9	-79	-89.1	0	0	0	109.4	Q6 H10	Q6-H8 PolarHBondContact O-N 3.26Å; H8-H10 PolarHBondContact O-N 3.34Å
9	L	49.4	Very low	52.3	Low	132 Å²	132	131.4 Å²	131.4	69%	0.691	67%	0.666	S	S	*	*			trans	-68.4	102.7	164	-152.5	75.8	0	0	0	106.8	H7 L14	H7-L9 PolarHBondContact O-N 3.24Å; L9-L14 HydrophobicContact CD2-CD1 3.69Å; L9-L14 HydrophobicContact CD2-CG 4.27Å
10	H	53.7	Low	52.9	Low	139 Å²	139	132.7 Å²	132.7	64%	0.644	66%	0.662	S	S	*	*			trans	-61.4	127.2	-173.6	-140.3	-17.8	0	0	0	109.3	H8 G12 V13	H8-H10 PolarHBondContact O-N 3.34Å; H10-G12 PolarHBondContact O-N 3.29Å; H10-V13 HydrophobicContact CB-CG2 4.38Å; H10-V13 PolarHBondContact O-N 3.01Å
11	P	55.5	Low	53.3	Low	101 Å²	101	130.2 Å²	130.2	66%	0.656	65%	0.651	S	S	*	*	H	α-helix	trans	-53.9	-25.6	-177.4	-28.2	34.7	0	0	0	114.1	F15	P11-F15 WeakPolarHBondContact O-CB 3.36Å; P11-F15 PolarHBondContact O-N 3.5Å; P11-F15 VanDerWaalsContact O-N 3.16Å
12	G	58.5	Low	54.3	Low	32 Å²	32	122.8 Å²	122.8	33%	0.33	62%	0.62	S	S	.	*	H	α-helix	trans	-63.7	-36.2	175.8	0	0	0	0	0	114.1	H10 F15 F16	H10-G12 PolarHBondContact O-N 3.29Å; G12-F15 PolarHBondContact O-N 2.91Å; G12-F16 WeakPolarHBondContact O-CD2 3.41Å; G12-F16 PolarHBondContact O-N 3.23Å
13	V	64.1	Low	55.3	Low	96 Å²	96	119.6 Å²	119.6	58%	0.582	61%	0.608	S	S	*	*	H	α-helix	trans	-72.8	-39.7	-175.5	-177.8	0	0	0	0	111.3	H10 F15 F16 F17	H10-V13 HydrophobicContact CB-CG2 4.38Å; H10-V13 PolarHBondContact O-N 3.01Å; V13-F15 VanDerWaalsContact C-N 3.35Å; V13-F16 PolarHBondContact O-N 3.48Å; V13-F17 WeakPolarHBondContact O-CB 3.48Å; V13-F17 PolarHBondContact O-N 2.88Å
14	L	58.9	Low	56.3	Low	93 Å²	93	122.2 Å²	122.2	49%	0.487	61%	0.606	S	S	.	*	H	α-helix	trans	-65.4	-37.9	171.7	-94.3	159.2	0	0	0	111.8	L9 F17 F18	L9-L14 HydrophobicContact CD2-CD1 3.69Å; L9-L14 HydrophobicContact CD2-CG 4.27Å; L14-F17 PolarHBondContact O-N 3.24Å; L14-F18 WeakPolarHBondContact O-CB 3.46Å; L14-F18 PolarHBondContact O-N 3.23Å
15	F	66.3	Low	56.8	Low	129 Å²	129	120.5 Å²	120.5	57%	0.566	60%	0.597	S	S	*	*	H	α-helix	trans	-67.4	-40.7	175.9	-174.7	-107	0	0	0	112.3	P11 G12 V13 F18 L19	P11-F15 WeakPolarHBondContact O-CB 3.36Å; P11-F15 PolarHBondContact O-N 3.5Å; P11-F15 VanDerWaalsContact O-N 3.16Å; G12-F15 PolarHBondContact O-N 2.91Å; V13-F15 VanDerWaalsContact C-N 3.35Å; F15-F18 PolarHBondContact O-N 3.15Å; F15-L19 HydrophobicContact CD1-CD1 3.56Å; F15-L19 HydrophobicContact CD1-CG 4.28Å; F15-L19 HydrophobicContact CE1-CD1 3.23Å; F15-L19 HydrophobicContact CE1-CG 4.05Å; F15-L19 HydrophobicContact CG-CD1 4.36Å; F15-L19 HydrophobicContact CZ-CD1 3.76Å; F15-L19 HydrophobicContact CZ-CD2 4.44Å; F15-L19 HydrophobicContact CZ-CG 4.16Å; F15-L19 VanDerWaalsContact O-CB 3.3Å; F15-L19 WeakPolarHBondContact O-CB 3.32Å; F15-L19 VanDerWaalsContact O-CG 3.3Å; F15-L19 WeakPolarHBondContact O-CG 3.48Å; F15-L19 PolarHBondContact O-N 2.92Å
16	F	65.3	Low	57.2	Low	149 Å²	149	121.4 Å²	121.4	65%	0.654	60%	0.595	S	S	*	*	H	α-helix	trans	-68	-36	173.7	-81.7	-67.8	0	0	0	112.3	G12 V13 L19 W20	G12-F16 WeakPolarHBondContact O-CD2 3.41Å; G12-F16 PolarHBondContact O-N 3.23Å; V13-F16 PolarHBondContact O-N 3.48Å; F16-L19 PolarHBondContact O-N 3.43Å; F16-W20 WeakPolarHBondContact O-CB 3.42Å; F16-W20 PolarHBondContact O-N 3.46Å
17	F	68.3	Low	57.4	Low	117 Å²	117	120.5 Å²	120.5	51%	0.513	60%	0.596	S	S	.	*	H	α-helix	trans	-69.4	-38.4	174.4	-146.8	-92.4	0	0	0	111.8	V13 L14 W20 L21	V13-F17 WeakPolarHBondContact O-CB 3.48Å; V13-F17 PolarHBondContact O-N 2.88Å; L14-F17 PolarHBondContact O-N 3.24Å; F17-W20 HydrophobicContact CD2-CE3 4.37Å; F17-W20 HydrophobicContact CE2-CE3 4.14Å; F17-W20 HydrophobicContact CE2-CZ3 4.07Å; F17-W20 HydrophobicContact CZ-CE3 4.33Å; F17-W20 HydrophobicContact CZ-CZ3 4.12Å; F17-W20 PolarHBondContact O-N 3.36Å; F17-L21 HydrophobicContact CD1-CD1 3.65Å; F17-L21 HydrophobicContact CD1-CG 4.41Å; F17-L21 HydrophobicContact CE1-CD1 3.92Å; F17-L21 WeakPolarHBondContact O-CB 3.03Å; F17-L21 PolarHBondContact O-N 2.56Å
18	F	64.9	Low	57.1	Low	136 Å²	136	121.2 Å²	121.2	60%	0.596	60%	0.599	S	S	*	*	H	α-helix	trans	-68.1	-39.2	172	-109.8	-85.7	0	0	0	112.4	L14 F15 W20 L21 C22	L14-F18 WeakPolarHBondContact O-CB 3.46Å; L14-F18 PolarHBondContact O-N 3.23Å; F15-F18 PolarHBondContact O-N 3.15Å; F18-W20 VanDerWaalsContact C-N 3.34Å; F18-L21 PolarHBondContact O-N 2.04Å; F18-C22 WeakPolarHBondContact O-CB 3.26Å; F18-C22 PolarHBondContact O-N 3.14Å; F18-C22 PolarHBondContact O-SG 2.89Å
19	L	65.3	Low	57.2	Low	67 Å²	67	122.7 Å²	122.7	35%	0.351	60%	0.604	S	S	.	*	H	α-helix	trans	-67	-36.6	173.3	-79.3	173.8	0	0	0	111.7	F15 F16 C22 H23	F15-L19 HydrophobicContact CD1-CD1 3.56Å; F15-L19 HydrophobicContact CD1-CG 4.28Å; F15-L19 HydrophobicContact CE1-CD1 3.23Å; F15-L19 HydrophobicContact CE1-CG 4.05Å; F15-L19 HydrophobicContact CG-CD1 4.36Å; F15-L19 HydrophobicContact CZ-CD1 3.76Å; F15-L19 HydrophobicContact CZ-CD2 4.44Å; F15-L19 HydrophobicContact CZ-CG 4.16Å; F15-L19 VanDerWaalsContact O-CB 3.3Å; F15-L19 WeakPolarHBondContact O-CB 3.32Å; F15-L19 VanDerWaalsContact O-CG 3.3Å; F15-L19 WeakPolarHBondContact O-CG 3.48Å; F15-L19 PolarHBondContact O-N 2.92Å; F16-L19 PolarHBondContact O-N 3.43Å; L19-C22 PolarHBondContact O-N 3.04Å; L19-H23 WeakPolarHBondContact O-CB 3.29Å; L19-H23 PolarHBondContact O-CD2 2.86Å; L19-H23 PolarHBondContact O-N 3.21Å
20	W	64.9	Low	57.4	Low	156 Å²	156	121.2 Å²	121.2	59%	0.591	60%	0.599	S	S	*	*	H	α-helix	trans	-69.6	-41	175.4	-170.2	55.3	0	0	0	111.7	F16 F17 F18 H23 L24	F16-W20 WeakPolarHBondContact O-CB 3.42Å; F16-W20 PolarHBondContact O-N 3.46Å; F17-W20 HydrophobicContact CD2-CE3 4.37Å; F17-W20 HydrophobicContact CE2-CE3 4.14Å; F17-W20 HydrophobicContact CE2-CZ3 4.07Å; F17-W20 HydrophobicContact CZ-CE3 4.33Å; F17-W20 HydrophobicContact CZ-CZ3 4.12Å; F17-W20 PolarHBondContact O-N 3.36Å; F18-W20 VanDerWaalsContact C-N 3.34Å; W20-H23 PolarHBondContact O-N 3.28Å; W20-L24 HydrophobicContact CZ2-CD1 4.45Å; W20-L24 WeakPolarHBondContact O-CB 3.34Å; W20-L24 PolarHBondContact O-N 3.41Å
21	L	60.3	Low	57.9	Low	81 Å²	81	119.9 Å²	119.9	42%	0.424	59%	0.594	S	S	.	*	H	α-helix	trans	-64.5	-41.4	169.5	-85.7	157.8	0	0	0	112.3	F17 F18 H23 L24 M25	F17-L21 HydrophobicContact CD1-CD1 3.65Å; F17-L21 HydrophobicContact CD1-CG 4.41Å; F17-L21 HydrophobicContact CE1-CD1 3.92Å; F17-L21 WeakPolarHBondContact O-CB 3.03Å; F17-L21 PolarHBondContact O-N 2.56Å; F18-L21 PolarHBondContact O-N 2.04Å; L21-H23 VanDerWaalsContact C-N 3.31Å; L21-H23 PolarHBondContact O-N 3.43Å; L21-L24 PolarHBondContact O-N 2.04Å; L21-M25 VanDerWaalsContact O-CG 3.27Å; L21-M25 WeakPolarHBondContact O-CG 3.27Å; L21-M25 PolarHBondContact O-N 2.94Å
22	C	58.1	Low	59.1	Low	67 Å²	67	116.8 Å²	116.8	45%	0.453	58%	0.576	S	S	.	*	H	α-helix	trans	-68	-28.8	174.9	-76.7	0	0	0	0	112.5	F18 L19 K26	F18-C22 WeakPolarHBondContact O-CB 3.26Å; F18-C22 PolarHBondContact O-N 3.14Å; F18-C22 PolarHBondContact O-SG 2.89Å; L19-C22 PolarHBondContact O-N 3.04Å; C22-K26 WeakPolarHBondContact O-CB 3.48Å; C22-K26 PolarHBondContact O-N 3.45Å
23	H	55.1	Low	60.6	Low	132 Å²	132	115.2 Å²	115.2	61%	0.611	56%	0.561	S	S	*	*	H	α-helix	trans	-75.7	-37.3	169.6	-96	-73.5	0	0	0	111.9	L19 W20 L21 M25 K26	L19-H23 WeakPolarHBondContact O-CB 3.29Å; L19-H23 PolarHBondContact O-CD2 2.86Å; L19-H23 PolarHBondContact O-N 3.21Å; W20-H23 PolarHBondContact O-N 3.28Å; L21-H23 VanDerWaalsContact C-N 3.31Å; L21-H23 PolarHBondContact O-N 3.43Å; H23-M25 VanDerWaalsContact C-N 3.33Å; H23-K26 PolarHBondContact O-N 2.94Å
24	L	54.6	Low	62	Low	121 Å²	121	110.7 Å²	110.7	63%	0.634	53%	0.533	S	S	*	.	H	α-helix	trans	-65.9	-34.8	174.2	-121.3	93.2	0	0	0	112.2	W20 L21 K26	W20-L24 HydrophobicContact CZ2-CD1 4.45Å; W20-L24 WeakPolarHBondContact O-CB 3.34Å; W20-L24 PolarHBondContact O-N 3.41Å; L21-L24 PolarHBondContact O-N 2.04Å; L24-K26 VanDerWaalsContact C-N 3.27Å; L24-K26 PolarHBondContact O-N 3.24Å
25	M	50.9	Low	63.7	Low	160 Å²	160	106.3 Å²	106.3	79%	0.788	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-2.9	176.3	-64.3	-135.4	-58.7	0	0	113.9	L21 H23	L21-M25 VanDerWaalsContact O-CG 3.27Å; L21-M25 WeakPolarHBondContact O-CG 3.27Å; L21-M25 PolarHBondContact O-N 2.94Å; H23-M25 VanDerWaalsContact C-N 3.33Å
26	K	48.2	Very low	65.1	Low	162 Å²	162	100.2 Å²	100.2	70%	0.704	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	1.5	-175.2	-121.9	176.4	-178.5	176.2	0	115.6	C22 H23 L24	C22-K26 WeakPolarHBondContact O-CB 3.48Å; C22-K26 PolarHBondContact O-N 3.45Å; H23-K26 PolarHBondContact O-N 2.94Å; L24-K26 VanDerWaalsContact C-N 3.27Å; L24-K26 PolarHBondContact O-N 3.24Å
27	D	46.1	Very low	66.5	Low	137 Å²	137	94.9 Å²	94.9	73%	0.733	46%	0.462	S	S	*	.			trans	-134.3	33.3	-178	-93.5	-35.6	0	0	0	114.7	K29	D27-K29 VanDerWaalsContact C-N 3.28Å; D27-K29 PolarHBondContact O-N 3.31Å
28	Q	43.2	Very low	67.6	Low	181 Å²	181	94.1 Å²	94.1	85%	0.846	46%	0.46	S	S	*	.			trans	-89.8	76.1	146.3	-78.7	-160.9	-30.2	0	0	108.3	V30	Q28-V30 PolarHBondContact O-N 2.97Å
29	K	48.6	Very low	68.9	Low	189 Å²	189	89.8 Å²	89.8	82%	0.822	44%	0.441	S	S	*	.			trans	-59.7	96.7	155.1	-89.9	-177.2	177.9	176	0	106.2	D27 Q31	D27-K29 VanDerWaalsContact C-N 3.28Å; D27-K29 PolarHBondContact O-N 3.31Å; K29-Q31 PolarHBondContact O-N 3.46Å
30	V	55.4	Low	70	Confident	100 Å²	100	86.9 Å²	86.9	61%	0.606	43%	0.428	S	S	*	.			trans	-56.1	116.2	163.8	176.5	0	0	0	0	105.2	Q28 A32 T54	Q28-V30 PolarHBondContact O-N 2.97Å; V30-A32 PolarHBondContact O-N 3.01Å; V30-T54 HydrophobicContact CG1-CG2 3.2Å
31	Q	63.7	Low	71.1	Confident	112 Å²	112	90.3 Å²	90.3	52%	0.523	45%	0.446	S	S	.	.			trans	-70.7	83	-175	-157	166	1.1	0	0	107.7	K29 W68 E70	K29-Q31 PolarHBondContact O-N 3.46Å; Q31-W68 HydrophobicContact CG-CH2 4.42Å; Q31-E70 HydrophobicContact CG-CG 4.13Å; Q31-E70 PolarHBondContact NE2-OE1 3.11Å
32	A	80.6	Confident	72.6	Confident	35 Å²	35	90.8 Å²	90.8	29%	0.289	45%	0.449	S	S	.	.			trans	-82.4	120	-178.7	0	0	0	0	0	108.1	V30	V30-A32 PolarHBondContact O-N 3.01Å
33	G	90.3	Very high	74.1	Confident	0 Å²	0	89 Å²	89	0%	0	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	-161.1	179.1	0	0	0	0	0	111.4	P51 G52 M53 T69	G33-P51 CarbonylContact O-C 3.5Å; G33-G52 CarbonylContact O-C 3.58Å; G33-G52 WeakPolarHBondContact O-CA 3.25Å; G33-G52 PolarHBondContact O-N 3.45Å; G33-M53 CarbonylContact C-O 3.52Å; G33-M53 PolarHBondContact N-O 3Å; G33-M53 PolarHBondContact O-N 3.3Å; G33-T69 CarbonylContact C-O 3.19Å; G33-T69 VanDerWaalsContact CA-O 3.22Å; G33-T69 WeakPolarHBondContact CA-O 3.33Å
34	N	93.1	Very high	76	Confident	0 Å²	0	86.2 Å²	86.2	0%	0	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	132	179.3	-70.1	-79.5	0	0	0	110.8	W36 L48 P51 W68 T69 E71	N34-W36 HydrophobicContact CB-CZ2 3.84Å; N34-W36 PolarHBondContact O-NE1 2.82Å; N34-W36 VanDerWaalsContact O-NE1 3.14Å; N34-L48 HydrophobicContact CB-CD1 3.9Å; N34-P51 VanDerWaalsContact OD1-CA 3.24Å; N34-P51 WeakPolarHBondContact OD1-CA 3.34Å; N34-P51 WeakPolarHBondContact OD1-CB 3.07Å; N34-W68 WeakPolarHBondContact O-CA 3.4Å; N34-T69 WeakPolarHBondContact CB-OG1 3.27Å; N34-T69 PolarHBondContact N-O 3.33Å; N34-T69 PolarHBondContact O-N 2.89Å; N34-E71 PolarHBondContact ND2-O 2.99Å
35	C	94.6	Very high	78	Confident	2 Å²	2	80.5 Å²	80.5	1%	0.014	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	136.8	175.1	-167.3	0	0	0	0	111.1	Y49 M50 M53 C58	C35-Y49 HydrophobicContact CB-CD1 4.39Å; C35-Y49 WeakPolarHBondContact O-CB 3.49Å; C35-Y49 PolarHBondContact O-N 2.94Å; C35-M50 PolarHBondContact N-O 2.03Å; C35-M50 PolarHBondContact O-N 2.95Å; C35-M53 HydrophobicContact CB-CB 4.39Å; C35-M53 HydrophobicContact CB-SD 3.79Å; C35-C58 WeakPolarHBondContact CA-SG 3.49Å; C35-C58 HydrophobicContact CB-CB 3.66Å; C35-C58 WeakPolarHBondContact CB-SG 3.47Å; C35-C58 VanDerWaalsContact SG-CA 3.51Å; C35-C58 WeakPolarHBondContact SG-CB 3.45Å; C35-C58 CovalentContact SG-SG 2.04Å; C35-C58 PolarHBondContact SG-SG 2.67Å
36	W	95.1	Very high	80.1	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	143.6	-171.2	-52.7	87.6	0	0	0	110.7	N34 C45 V47 L48 T66 S67 T69 L78 M82 A88	N34-W36 HydrophobicContact CB-CZ2 3.84Å; N34-W36 PolarHBondContact O-NE1 2.82Å; N34-W36 VanDerWaalsContact O-NE1 3.14Å; W36-C45 HydrophobicContact CB-CB 3.96Å; W36-C45 HydrophobicContact CD2-CB 3.59Å; W36-C45 HydrophobicContact CE3-CB 4.19Å; W36-C45 HydrophobicContact CG-CB 3.45Å; W36-C45 VanDerWaalsContact CG-CB 3.45Å; W36-V47 WeakPolarHBondContact CA-O 2.97Å; W36-L48 HydrophobicContact CD2-CD1 4.23Å; W36-L48 HydrophobicContact CE3-CB 3.95Å; W36-L48 HydrophobicContact CE3-CD1 4.2Å; W36-L48 HydrophobicContact CH2-CB 4.36Å; W36-L48 HydrophobicContact CH2-CD1 4.03Å; W36-L48 HydrophobicContact CZ2-CD1 4.05Å; W36-L48 HydrophobicContact CZ3-CB 3.74Å; W36-L48 HydrophobicContact CZ3-CD1 4.1Å; W36-T66 CarbonylContact O-C 3.39Å; W36-T66 VanDerWaalsContact O-CA 3.27Å; W36-T66 WeakPolarHBondContact O-CA 3.36Å; W36-S67 WeakPolarHBondContact CB-O 3.04Å; W36-S67 PolarHBondContact N-O 2.83Å; W36-S67 PolarHBondContact O-N 3.44Å; W36-T69 PolarHBondContact NE1-OG1 2.92Å; W36-L78 HydrophobicContact CH2-CD2 3.87Å; W36-L78 HydrophobicContact CZ2-CD2 4.01Å; W36-M82 HydrophobicContact CE3-SD 4.42Å; W36-M82 HydrophobicContact CH2-SD 4.31Å; W36-M82 HydrophobicContact CZ3-CG 4.24Å; W36-M82 HydrophobicContact CZ3-SD 3.58Å; W36-M82 VanDerWaalsContact CZ3-SD 3.58Å; W36-A88 HydrophobicContact CH2-CB 3.55Å; W36-A88 HydrophobicContact CZ2-CB 3.3Å; W36-A88 HydrophobicContact CZ3-CB 4.31Å
37	L	94.2	Very high	82.2	Confident	38 Å²	38	70.8 Å²	70.8	20%	0.199	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	-15.9	-177.4	-62.5	-173.9	0	0	0	114.1	V47 Y49 G65	L37-V47 HydrophobicContact CB-CB 4.15Å; L37-V47 HydrophobicContact CB-CG1 4.08Å; L37-V47 HydrophobicContact CD1-CG1 3.88Å; L37-V47 HydrophobicContact CG-CG1 4.21Å; L37-V47 PolarHBondContact N-O 2.76Å; L37-Y49 HydrophobicContact CD1-CD2 4.5Å; L37-Y49 HydrophobicContact CD2-CD2 3.83Å; L37-Y49 HydrophobicContact CD2-CG 3.78Å; L37-Y49 HydrophobicContact CG-CD2 4.39Å; L37-Y49 HydrophobicContact CG-CG 4.43Å; L37-G65 CarbonylContact C-O 3.58Å; L37-G65 CarbonylContact O-C 3.57Å; L37-G65 WeakPolarHBondContact O-CA 3.48Å
38	Q	92.9	Very high	84.4	Confident	101 Å²	101	67.5 Å²	67.5	47%	0.472	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	138.9	-173.7	-176.3	171.8	1.8	0	0	112.7	Q46 G65	Q38-Q46 PolarHBondContact N-O 3.44Å; Q38-Q46 PolarHBondContact O-N 3.19Å; Q38-Q46 VanDerWaalsContact O-O 3.07Å; Q38-G65 CarbonylContact C-O 3.59Å; Q38-G65 WeakPolarHBondContact CA-O 3.46Å; Q38-G65 PolarHBondContact N-O 2.85Å
39	Q	91.9	Very high	86.8	Confident	45 Å²	45	65.4 Å²	65.4	21%	0.21	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	121	160.1	-172.7	176.4	70.5	0	0	109.8	G43 R44 C91	Q39-G43 PolarHBondContact NE2-O 2.85Å; Q39-R44 CarbonylContact C-O 3.56Å; Q39-C91 PolarHBondContact NE2-O 3.42Å
40	G	88.4	Confident	88.7	Confident	6 Å²	6	60.5 Å²	60.5	6%	0.062	31%	0.305	C	S	.	.			trans	-63.6	164.7	175.5	0	0	0	0	0	112.6	N42 G43 R44	G40-N42 PolarHBondContact O-N 2.8Å; G40-G43 PolarHBondContact O-N 3.16Å; G40-R44 PolarHBondContact N-O 3.17Å
41	K	88.7	Confident	90.3	Very high	227 Å²	227	58.9 Å²	58.9	99%	0.987	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-26.5	176.8	-67.8	-177.8	-177.3	174.4	0	112.7	G43	K41-G43 PolarHBondContact O-N 3.35Å
42	N	90.7	Very high	91.5	Very high	91 Å²	91	55.7 Å²	55.7	49%	0.487	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	1.4	173.7	62.4	-5.3	0	0	0	113.6	G40 R44 G86	G40-N42 PolarHBondContact O-N 2.8Å; N42-R44 PolarHBondContact O-N 3.28Å; N42-R44 WeakPolarHBondContact OD1-CB 3.04Å; N42-R44 PolarHBondContact OD1-N 2.89Å; N42-R44 VanDerWaalsContact OD1-N 3.11Å; N42-G86 PolarHBondContact ND2-O 3.36Å
43	G	90.6	Very high	91.9	Very high	30 Å²	30	55.2 Å²	55.2	31%	0.309	29%	0.286	S	S	.	.	S	Bend	trans	78.7	1.8	-178.9	0	0	0	0	0	114.5	Q39 G40 K41 C91	Q39-G43 PolarHBondContact NE2-O 2.85Å; G40-G43 PolarHBondContact O-N 3.16Å; K41-G43 PolarHBondContact O-N 3.35Å; G43-C91 VanDerWaalsContact O-CB 3.28Å; G43-C91 WeakPolarHBondContact O-CB 3.4Å
44	R	95.1	Very high	92	Very high	74 Å²	74	56.1 Å²	56.1	28%	0.279	29%	0.291	S	S	.	.			trans	-88.8	152.7	178.7	-68.1	179.1	170.6	-112.8	1.6	111.6	Q39 G40 N42 N85 G87 A88	Q39-R44 CarbonylContact C-O 3.56Å; G40-R44 PolarHBondContact N-O 3.17Å; N42-R44 PolarHBondContact O-N 3.28Å; N42-R44 WeakPolarHBondContact OD1-CB 3.04Å; N42-R44 PolarHBondContact OD1-N 2.89Å; N42-R44 VanDerWaalsContact OD1-N 3.11Å; R44-N85 WeakPolarHBondContact CD-O 3.05Å; R44-N85 PolarHBondContact NE-O 3.43Å; R44-G87 WeakPolarHBondContact CD-O 3.33Å; R44-G87 PolarHBondContact NH1-O 3.33Å; R44-A88 WeakPolarHBondContact CA-O 3.38Å; R44-A88 VanDerWaalsContact CB-O 3.32Å; R44-A88 WeakPolarHBondContact CB-O 3.28Å
45	C	95.4	Very high	92	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	134.3	178.6	-89.9	0	0	0	0	110	W36 S67 T69 G87 A88 C91	W36-C45 HydrophobicContact CB-CB 3.96Å; W36-C45 HydrophobicContact CD2-CB 3.59Å; W36-C45 HydrophobicContact CE3-CB 4.19Å; W36-C45 HydrophobicContact CG-CB 3.45Å; W36-C45 VanDerWaalsContact CG-CB 3.45Å; C45-S67 WeakPolarHBondContact SG-CB 3.4Å; C45-T69 HydrophobicContact CB-CG2 4.11Å; C45-G87 CarbonylContact O-C 3.56Å; C45-G87 WeakPolarHBondContact O-CA 3.28Å; C45-A88 HydrophobicContact CB-CB 4.04Å; C45-A88 PolarHBondContact N-O 2.79Å; C45-A88 PolarHBondContact O-N 2.83Å; C45-C91 WeakPolarHBondContact CA-SG 3.39Å; C45-C91 HydrophobicContact CB-CB 3.68Å; C45-C91 WeakPolarHBondContact CB-SG 3.22Å; C45-C91 PolarHBondContact N-SG 2.89Å; C45-C91 VanDerWaalsContact SG-CA 3.52Å; C45-C91 WeakPolarHBondContact SG-CB 3.21Å; C45-C91 CovalentContact SG-SG 2.04Å; C45-C91 PolarHBondContact SG-SG 3.29Å
46	Q	94.4	Very high	91.9	Very high	50 Å²	50	67.2 Å²	67.2	23%	0.234	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	155.2	-174.5	-64	-179.5	-20.4	0	0	109.5	Q38 M82 G86	Q38-Q46 PolarHBondContact N-O 3.44Å; Q38-Q46 PolarHBondContact O-N 3.19Å; Q38-Q46 VanDerWaalsContact O-O 3.07Å; Q46-M82 HydrophobicContact CB-CE 4.48Å; Q46-G86 PolarHBondContact NE2-O 2.9Å
47	V	93.7	Very high	91.8	Very high	69 Å²	69	71.6 Å²	71.6	42%	0.418	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	59.4	81	-178.8	-168.2	0	0	0	0	111	W36 L37 Y49	W36-V47 WeakPolarHBondContact CA-O 2.97Å; L37-V47 HydrophobicContact CB-CB 4.15Å; L37-V47 HydrophobicContact CB-CG1 4.08Å; L37-V47 HydrophobicContact CD1-CG1 3.88Å; L37-V47 HydrophobicContact CG-CG1 4.21Å; L37-V47 PolarHBondContact N-O 2.76Å; V47-Y49 PolarHBondContact O-N 3.28Å
48	L	92.6	Very high	91.8	Very high	68 Å²	68	70 Å²	70	36%	0.356	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	125	175.3	-177.8	69.3	0	0	0	109.2	N34 W36 L78	N34-L48 HydrophobicContact CB-CD1 3.9Å; W36-L48 HydrophobicContact CD2-CD1 4.23Å; W36-L48 HydrophobicContact CE3-CB 3.95Å; W36-L48 HydrophobicContact CE3-CD1 4.2Å; W36-L48 HydrophobicContact CH2-CB 4.36Å; W36-L48 HydrophobicContact CH2-CD1 4.03Å; W36-L48 HydrophobicContact CZ2-CD1 4.05Å; W36-L48 HydrophobicContact CZ3-CB 3.74Å; W36-L48 HydrophobicContact CZ3-CD1 4.1Å; L48-L78 HydrophobicContact CD2-CD1 4.09Å
49	Y	92.3	Very high	91.8	Very high	137 Å²	137	66.2 Å²	66.2	54%	0.537	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	-55.4	173.4	177.9	-123.3	0	0	0	110.5	C35 L37 V47 M53	C35-Y49 HydrophobicContact CB-CD1 4.39Å; C35-Y49 WeakPolarHBondContact O-CB 3.49Å; C35-Y49 PolarHBondContact O-N 2.94Å; L37-Y49 HydrophobicContact CD1-CD2 4.5Å; L37-Y49 HydrophobicContact CD2-CD2 3.83Å; L37-Y49 HydrophobicContact CD2-CG 3.78Å; L37-Y49 HydrophobicContact CG-CD2 4.39Å; L37-Y49 HydrophobicContact CG-CG 4.43Å; V47-Y49 PolarHBondContact O-N 3.28Å; Y49-M53 HydrophobicContact CE1-CE 4.34Å
50	M	89.3	Confident	91.8	Very high	85 Å²	85	73 Å²	73	42%	0.419	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	129.8	-176	-163.7	166.4	-68.8	0	0	110.8	C35 M53	C35-M50 PolarHBondContact N-O 2.03Å; C35-M50 PolarHBondContact O-N 2.95Å; M50-M53 HydrophobicContact CB-CE 3.81Å; M50-M53 HydrophobicContact CG-CE 3.94Å; M50-M53 HydrophobicContact SD-CE 3.4Å; M50-M53 WeakPolarHBondContact SD-CE 3.34Å
51	P	89.2	Confident	91.9	Very high	67 Å²	67	75.3 Å²	75.3	44%	0.435	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	167.2	169.2	35	-35.5	0	0	0	111.7	G33 N34 M53	G33-P51 CarbonylContact O-C 3.5Å; N34-P51 VanDerWaalsContact OD1-CA 3.24Å; N34-P51 WeakPolarHBondContact OD1-CA 3.34Å; N34-P51 WeakPolarHBondContact OD1-CB 3.07Å; P51-M53 VanDerWaalsContact C-N 3.3Å; P51-M53 PolarHBondContact O-N 3Å
52	G	87.8	Confident	92	Very high	44 Å²	44	65.5 Å²	65.5	45%	0.454	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	67.5	24	174.8	0	0	0	0	0	115.1	G33	G33-G52 CarbonylContact O-C 3.58Å; G33-G52 WeakPolarHBondContact O-CA 3.25Å; G33-G52 PolarHBondContact O-N 3.45Å
53	M	89.6	Confident	92.1	Very high	26 Å²	26	67.4 Å²	67.4	13%	0.128	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	139.6	-174.4	-172.5	175.2	-75.4	0	0	111.4	G33 C35 Y49 M50 P51 E57 C58 W68	G33-M53 CarbonylContact C-O 3.52Å; G33-M53 PolarHBondContact N-O 3Å; G33-M53 PolarHBondContact O-N 3.3Å; C35-M53 HydrophobicContact CB-CB 4.39Å; C35-M53 HydrophobicContact CB-SD 3.79Å; Y49-M53 HydrophobicContact CE1-CE 4.34Å; M50-M53 HydrophobicContact CB-CE 3.81Å; M50-M53 HydrophobicContact CG-CE 3.94Å; M50-M53 HydrophobicContact SD-CE 3.4Å; M50-M53 WeakPolarHBondContact SD-CE 3.34Å; P51-M53 VanDerWaalsContact C-N 3.3Å; P51-M53 PolarHBondContact O-N 3Å; M53-E57 HydrophobicContact CG-CB 3.57Å; M53-E57 HydrophobicContact SD-CB 4.06Å; M53-C58 HydrophobicContact CG-CB 4.22Å; M53-C58 WeakPolarHBondContact SD-CA 3.33Å; M53-C58 HydrophobicContact SD-CB 3.8Å; M53-C58 PolarHBondContact SD-N 3.32Å; M53-W68 PolarHBondContact O-NE1 2.78Å
54	T	92.6	Very high	92.1	Very high	19 Å²	19	67.7 Å²	67.7	12%	0.117	33%	0.332	C	S	.	.			trans	-67.6	158.9	172.5	60.9	0	0	0	0	111.5	V30 E56 E57 C58	V30-T54 HydrophobicContact CG1-CG2 3.2Å; T54-E56 VanDerWaalsContact C-N 3.27Å; T54-E56 PolarHBondContact O-N 2.74Å; T54-E57 PolarHBondContact N-OE2 3.03Å; T54-E57 VanDerWaalsContact N-OE2 3.13Å; T54-E57 PolarHBondContact O-N 2.69Å; T54-E57 VanDerWaalsContact OG1-CB 3.28Å; T54-E57 WeakPolarHBondContact OG1-CB 3.47Å; T54-E57 WeakPolarHBondContact OG1-CG 3.26Å; T54-E57 PolarHBondContact OG1-N 3.34Å; T54-E57 PolarHBondContact OG1-OE2 3.44Å; T54-C58 WeakPolarHBondContact O-CB 3.29Å; T54-C58 PolarHBondContact O-N 2.89Å
55	R	92.6	Very high	91.9	Very high	99 Å²	99	65.5 Å²	65.5	37%	0.374	33%	0.332	S	S	.	.	H	α-helix	trans	-61.4	-40.7	175.5	-175.5	178.6	176.7	176.8	-0.5	111	C58 C59 W68	R55-C58 PolarHBondContact O-N 2.82Å; R55-C59 VanDerWaalsContact O-CB 3.22Å; R55-C59 WeakPolarHBondContact O-CB 3.12Å; R55-C59 PolarHBondContact O-N 3.31Å; R55-C59 PolarHBondContact O-SG 3.47Å; R55-W68 HydrophobicContact CB-CD2 3.87Å; R55-W68 HydrophobicContact CB-CE3 4.15Å; R55-W68 HydrophobicContact CB-CG 4.24Å; R55-W68 HydrophobicContact CB-CH2 4.41Å; R55-W68 HydrophobicContact CB-CZ2 4.21Å; R55-W68 HydrophobicContact CB-CZ3 4.41Å; R55-W68 HydrophobicContact CG-CD2 4.16Å; R55-W68 HydrophobicContact CG-CE3 4.22Å; R55-W68 HydrophobicContact CG-CG 4.31Å
56	E	92.4	Very high	91.9	Very high	136 Å²	136	65.7 Å²	65.7	64%	0.636	33%	0.333	S	S	*	.	H	α-helix	trans	-63.1	-43.7	-178.8	-66.6	66.9	-145.9	0	0	111.3	T54 R60	T54-E56 VanDerWaalsContact C-N 3.27Å; T54-E56 PolarHBondContact O-N 2.74Å; E56-R60 WeakPolarHBondContact O-CB 3.24Å; E56-R60 PolarHBondContact O-N 3.26Å; E56-R60 VanDerWaalsContact O-N 3.08Å
57	E	93.5	Very high	92	Very high	92 Å²	92	63.4 Å²	63.4	43%	0.43	32%	0.323	S	S	.	.	H	α-helix	trans	-65.7	-46.3	175.5	-73.9	162.7	157.8	0	0	111.9	M53 T54 C59 R60	M53-E57 HydrophobicContact CG-CB 3.57Å; M53-E57 HydrophobicContact SD-CB 4.06Å; T54-E57 PolarHBondContact N-OE2 3.03Å; T54-E57 VanDerWaalsContact N-OE2 3.13Å; T54-E57 PolarHBondContact O-N 2.69Å; T54-E57 VanDerWaalsContact OG1-CB 3.28Å; T54-E57 WeakPolarHBondContact OG1-CB 3.47Å; T54-E57 WeakPolarHBondContact OG1-CG 3.26Å; T54-E57 PolarHBondContact OG1-N 3.34Å; T54-E57 PolarHBondContact OG1-OE2 3.44Å; E57-C59 VanDerWaalsContact C-N 3.34Å; E57-C59 PolarHBondContact O-N 2.95Å; E57-R60 WeakPolarHBondContact O-CB 3.35Å; E57-R60 PolarHBondContact O-N 2.76Å
58	C	93.6	Very high	92.1	Very high	5 Å²	5	60.5 Å²	60.5	3%	0.034	30%	0.304	C	S	.	.	H	α-helix	trans	-61	-43.7	178.9	-179.1	0	0	0	0	111.7	C35 M53 T54 R55 T66 S67	C35-C58 WeakPolarHBondContact CA-SG 3.49Å; C35-C58 HydrophobicContact CB-CB 3.66Å; C35-C58 WeakPolarHBondContact CB-SG 3.47Å; C35-C58 VanDerWaalsContact SG-CA 3.51Å; C35-C58 WeakPolarHBondContact SG-CB 3.45Å; C35-C58 CovalentContact SG-SG 2.04Å; C35-C58 PolarHBondContact SG-SG 2.67Å; M53-C58 HydrophobicContact CG-CB 4.22Å; M53-C58 WeakPolarHBondContact SD-CA 3.33Å; M53-C58 HydrophobicContact SD-CB 3.8Å; M53-C58 PolarHBondContact SD-N 3.32Å; T54-C58 WeakPolarHBondContact O-CB 3.29Å; T54-C58 PolarHBondContact O-N 2.89Å; R55-C58 PolarHBondContact O-N 2.82Å; C58-T66 WeakPolarHBondContact O-CG2 3.4Å; C58-S67 PolarHBondContact SG-O 3.29Å
59	C	93.5	Very high	92.2	Very high	21 Å²	21	57.4 Å²	57.4	14%	0.142	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	4	-174.2	-58.5	0	0	0	0	114.5	R55 E57 S61 C94 K95	R55-C59 VanDerWaalsContact O-CB 3.22Å; R55-C59 WeakPolarHBondContact O-CB 3.12Å; R55-C59 PolarHBondContact O-N 3.31Å; R55-C59 PolarHBondContact O-SG 3.47Å; E57-C59 VanDerWaalsContact C-N 3.34Å; E57-C59 PolarHBondContact O-N 2.95Å; C59-S61 VanDerWaalsContact C-N 3.25Å; C59-S61 PolarHBondContact O-N 2.78Å; C59-C94 WeakPolarHBondContact CA-SG 3.35Å; C59-C94 HydrophobicContact CB-CB 3.49Å; C59-C94 VanDerWaalsContact CB-CB 3.49Å; C59-C94 WeakPolarHBondContact CB-SG 3.35Å; C59-C94 WeakPolarHBondContact SG-CA 3.37Å; C59-C94 WeakPolarHBondContact SG-CB 3.41Å; C59-C94 CovalentContact SG-SG 2.04Å; C59-C94 PolarHBondContact SG-SG 3.37Å; C59-K95 PolarHBondContact O-NZ 3.22Å
60	R	92.8	Very high	92.2	Very high	188 Å²	188	55.9 Å²	55.9	71%	0.709	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-34	176.6	-168.5	-179.8	-64.6	153.8	1.3	112.5	E56 E57	E56-R60 WeakPolarHBondContact O-CB 3.24Å; E56-R60 PolarHBondContact O-N 3.26Å; E56-R60 VanDerWaalsContact O-N 3.08Å; E57-R60 WeakPolarHBondContact O-CB 3.35Å; E57-R60 PolarHBondContact O-N 2.76Å
61	S	90.1	Very high	91.9	Very high	54 Å²	54	56 Å²	56	38%	0.378	29%	0.286	S	S	.	.	S	Bend	trans	-72.6	151.4	178.1	72.3	0	0	0	0	112.3	C59 R63 K95	C59-S61 VanDerWaalsContact C-N 3.25Å; C59-S61 PolarHBondContact O-N 2.78Å; S61-R63 PolarHBondContact O-N 2.94Å; S61-K95 WeakPolarHBondContact O-CE 3.36Å; S61-K95 PolarHBondContact O-NZ 2.03Å; S61-K95 VanDerWaalsContact O-NZ 3.12Å
62	G	90.4	Very high	91.4	Very high	21 Å²	21	57.9 Å²	57.9	22%	0.216	29%	0.292	C	S	.	.			trans	-75.4	3.3	172	0	0	0	0	0	114.3	L64 N100 V101 D102	G62-L64 PolarHBondContact O-N 2.89Å; G62-N100 VanDerWaalsContact CA-O 3.26Å; G62-N100 WeakPolarHBondContact CA-O 3.45Å; G62-V101 WeakPolarHBondContact O-CA 3.08Å; G62-D102 PolarHBondContact O-N 2.76Å
63	R	92.5	Very high	91.2	Very high	131 Å²	131	56.9 Å²	56.9	49%	0.494	28%	0.277	S	S	.	.	B	Isolated β-bridge	trans	-71.2	120.7	-172	179.6	179.1	-178.9	165.6	1.6	111.2	S61 G65 T66	S61-R63 PolarHBondContact O-N 2.94Å; R63-G65 VanDerWaalsContact C-N 3.34Å; R63-G65 PolarHBondContact O-N 2.98Å; R63-T66 WeakPolarHBondContact CB-OG1 2.99Å; R63-T66 PolarHBondContact O-N 3.25Å; R63-T66 PolarHBondContact O-OG1 3.32Å
64	L	91.3	Very high	91	Very high	36 Å²	36	59.7 Å²	59.7	19%	0.188	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-34.6	-176.2	-179.1	63.5	0	0	0	114.9	G62 T66 K95 V101 P117 C119	G62-L64 PolarHBondContact O-N 2.89Å; L64-T66 VanDerWaalsContact C-N 3.28Å; L64-T66 PolarHBondContact O-N 3.42Å; L64-K95 HydrophobicContact CD1-CB 4.29Å; L64-V101 HydrophobicContact CB-CG1 4.01Å; L64-V101 HydrophobicContact CD1-CG1 4.17Å; L64-V101 HydrophobicContact CD1-CG2 4.28Å; L64-P117 HydrophobicContact CD1-CB 3.6Å; L64-P117 HydrophobicContact CD1-CG 3.57Å; L64-C119 HydrophobicContact CD2-CB 4.27Å
65	G	90.9	Very high	90.8	Very high	27 Å²	27	65 Å²	65	28%	0.278	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-17.8	-176.3	0	0	0	0	0	114.1	L37 Q38 R63 S67	L37-G65 CarbonylContact C-O 3.58Å; L37-G65 CarbonylContact O-C 3.57Å; L37-G65 WeakPolarHBondContact O-CA 3.48Å; Q38-G65 CarbonylContact C-O 3.59Å; Q38-G65 WeakPolarHBondContact CA-O 3.46Å; Q38-G65 PolarHBondContact N-O 2.85Å; R63-G65 VanDerWaalsContact C-N 3.34Å; R63-G65 PolarHBondContact O-N 2.98Å; G65-S67 PolarHBondContact O-N 3.36Å; G65-S67 PolarHBondContact O-OG 3.01Å
66	T	95.1	Very high	90.7	Very high	4 Å²	4	64.5 Å²	64.5	3%	0.025	34%	0.337	C	S	.	.			trans	-65.7	133.5	-171	-49.8	0	0	0	0	111	W36 C58 R63 L64 C94	W36-T66 CarbonylContact O-C 3.39Å; W36-T66 VanDerWaalsContact O-CA 3.27Å; W36-T66 WeakPolarHBondContact O-CA 3.36Å; C58-T66 WeakPolarHBondContact O-CG2 3.4Å; R63-T66 WeakPolarHBondContact CB-OG1 2.99Å; R63-T66 PolarHBondContact O-N 3.25Å; R63-T66 PolarHBondContact O-OG1 3.32Å; L64-T66 VanDerWaalsContact C-N 3.28Å; L64-T66 PolarHBondContact O-N 3.42Å; T66-C94 VanDerWaalsContact O-CB 3.28Å; T66-C94 WeakPolarHBondContact O-CB 3.02Å; T66-C94 PolarHBondContact O-N 3.17Å
67	S	95.6	Very high	90.6	Very high	2 Å²	2	59.1 Å²	59.1	1%	0.014	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	160.8	-178.7	-56.2	0	0	0	0	109.8	W36 C45 C58 G65 C91 I92	W36-S67 WeakPolarHBondContact CB-O 3.04Å; W36-S67 PolarHBondContact N-O 2.83Å; W36-S67 PolarHBondContact O-N 3.44Å; C45-S67 WeakPolarHBondContact SG-CB 3.4Å; C58-S67 PolarHBondContact SG-O 3.29Å; G65-S67 PolarHBondContact O-N 3.36Å; G65-S67 PolarHBondContact O-OG 3.01Å; S67-C91 VanDerWaalsContact CB-SG 3.55Å; S67-I92 CarbonylContact C-O 3.43Å; S67-I92 VanDerWaalsContact CA-O 3.29Å; S67-I92 WeakPolarHBondContact CA-O 3.47Å; S67-I92 WeakPolarHBondContact CB-O 3.47Å
68	W	95.9	Very high	90.4	Very high	8 Å²	8	55.3 Å²	55.3	3%	0.03	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	149.8	-173.9	-175.7	84.2	0	0	0	110.6	Q31 N34 M53 R55 E70 I92	Q31-W68 HydrophobicContact CG-CH2 4.42Å; N34-W68 WeakPolarHBondContact O-CA 3.4Å; M53-W68 PolarHBondContact O-NE1 2.78Å; R55-W68 HydrophobicContact CB-CD2 3.87Å; R55-W68 HydrophobicContact CB-CE3 4.15Å; R55-W68 HydrophobicContact CB-CG 4.24Å; R55-W68 HydrophobicContact CB-CH2 4.41Å; R55-W68 HydrophobicContact CB-CZ2 4.21Å; R55-W68 HydrophobicContact CB-CZ3 4.41Å; R55-W68 HydrophobicContact CG-CD2 4.16Å; R55-W68 HydrophobicContact CG-CE3 4.22Å; R55-W68 HydrophobicContact CG-CG 4.31Å; W68-E70 HydrophobicContact CH2-CB 3.53Å; W68-E70 HydrophobicContact CH2-CG 3.75Å; W68-E70 HydrophobicContact CZ2-CB 4.42Å; W68-E70 HydrophobicContact CZ3-CB 3.57Å; W68-E70 HydrophobicContact CZ3-CG 4.2Å; W68-I92 HydrophobicContact CE3-CD1 3.97Å; W68-I92 HydrophobicContact CZ3-CD1 4.09Å; W68-I92 PolarHBondContact N-O 3.49Å; W68-I92 WeakPolarHBondContact O-CB 3.42Å; W68-I92 PolarHBondContact O-N 2.79Å
69	T	95.3	Very high	90.2	Very high	3 Å²	3	61 Å²	61	2%	0.018	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	137.7	171.2	55.8	0	0	0	0	109.2	G33 N34 W36 C45 A88 P89	G33-T69 CarbonylContact C-O 3.19Å; G33-T69 VanDerWaalsContact CA-O 3.22Å; G33-T69 WeakPolarHBondContact CA-O 3.33Å; N34-T69 WeakPolarHBondContact CB-OG1 3.27Å; N34-T69 PolarHBondContact N-O 3.33Å; N34-T69 PolarHBondContact O-N 2.89Å; W36-T69 PolarHBondContact NE1-OG1 2.92Å; C45-T69 HydrophobicContact CB-CG2 4.11Å; T69-A88 HydrophobicContact CG2-CB 4.21Å; T69-P89 WeakPolarHBondContact CG2-O 3.33Å
70	E	92.5	Very high	90.2	Very high	105 Å²	105	66.5 Å²	66.5	49%	0.491	34%	0.338	S	S	.	.			trans	-72	-34.2	-174.8	-174	175.5	165.7	0	0	114.2	Q31 W68 D72	Q31-E70 HydrophobicContact CG-CG 4.13Å; Q31-E70 PolarHBondContact NE2-OE1 3.11Å; W68-E70 HydrophobicContact CH2-CB 3.53Å; W68-E70 HydrophobicContact CH2-CG 3.75Å; W68-E70 HydrophobicContact CZ2-CB 4.42Å; W68-E70 HydrophobicContact CZ3-CB 3.57Å; W68-E70 HydrophobicContact CZ3-CG 4.2Å; E70-D72 PolarHBondContact O-N 2.83Å
71	E	82.8	Confident	90.2	Very high	87 Å²	87	58.8 Å²	58.8	41%	0.407	31%	0.309	S	S	.	.			trans	-68.4	116.1	-175.5	-69.7	176.8	-150.3	0	0	111.1	N34 V73 W81	N34-E71 PolarHBondContact ND2-O 2.99Å; E71-V73 HydrophobicContact CB-CG1 4Å; E71-W81 HydrophobicContact CB-CH2 4.35Å; E71-W81 VanDerWaalsContact OE2-CH2 3.27Å; E71-W81 WeakPolarHBondContact OE2-CH2 3.4Å
72	D	79.6	Confident	90.1	Very high	108 Å²	108	59.3 Å²	59.3	58%	0.578	31%	0.306	S	S	*	.			trans	-81.7	108.2	161.4	-167.3	16.2	0	0	0	108.6	E70	E70-D72 PolarHBondContact O-N 2.83Å
73	V	82.8	Confident	90.2	Very high	22 Å²	22	63.4 Å²	63.4	13%	0.133	32%	0.322	C	S	.	.			trans	-122.1	147.5	-173.1	-76.6	0	0	0	0	110.7	E71 T77 L78 W81	E71-V73 HydrophobicContact CB-CG1 4Å; V73-T77 HydrophobicContact CB-CG2 3.94Å; V73-T77 HydrophobicContact CG1-CG2 4.12Å; V73-T77 HydrophobicContact CG2-CG2 4.17Å; V73-L78 HydrophobicContact CG2-CD2 3.49Å; V73-L78 VanDerWaalsContact CG2-CD2 3.49Å; V73-L78 HydrophobicContact CG2-CG 3.77Å; V73-W81 HydrophobicContact CB-CH2 4.35Å; V73-W81 HydrophobicContact CG1-CH2 3.8Å; V73-W81 HydrophobicContact CG1-CZ2 4.35Å; V73-W81 HydrophobicContact CG1-CZ3 4.44Å; V73-W81 HydrophobicContact CG2-CE3 4.22Å; V73-W81 HydrophobicContact CG2-CH2 3.73Å; V73-W81 HydrophobicContact CG2-CZ3 3.5Å; V73-W81 VanDerWaalsContact CG2-CZ3 3.5Å
74	P	86.6	Confident	90.3	Very high	86 Å²	86	64.4 Å²	64.4	56%	0.558	33%	0.33	S	S	*	.			trans	-56.8	152.4	177.1	-23.3	32.1	0	0	0	112.4	S76 T77 L78	P74-S76 PolarHBondContact O-N 2.84Å; P74-T77 WeakPolarHBondContact O-CA 3.39Å; P74-T77 WeakPolarHBondContact O-CB 3.42Å; P74-T77 PolarHBondContact O-N 3.44Å; P74-L78 PolarHBondContact O-N 3.14Å
75	N	86.6	Confident	90.3	Very high	131 Å²	131	66.1 Å²	66.1	70%	0.701	34%	0.339	S	S	*	.	H	α-helix	trans	-52.2	-33.5	180	-70.7	-13.1	0	0	0	113.8	T77 L78 F79	N75-T77 VanDerWaalsContact C-N 3.32Å; N75-T77 PolarHBondContact O-N 3.29Å; N75-L78 PolarHBondContact O-N 3.41Å; N75-F79 WeakPolarHBondContact O-CB 3.18Å; N75-F79 PolarHBondContact O-N 2.04Å
76	S	90.6	Very high	90.4	Very high	87 Å²	87	66.3 Å²	66.3	61%	0.608	34%	0.341	S	S	*	.	H	α-helix	trans	-63.1	-35.8	175.8	56.5	0	0	0	0	113.1	P74 R80	P74-S76 PolarHBondContact O-N 2.84Å; S76-R80 WeakPolarHBondContact O-CB 3.37Å; S76-R80 PolarHBondContact O-N 2.04Å
77	T	90.8	Very high	90.4	Very high	23 Å²	23	66.1 Å²	66.1	14%	0.141	34%	0.34	C	S	.	.	H	α-helix	trans	-74.7	-42.7	177	-61.1	0	0	0	0	111.2	V73 P74 N75 F79 R80 W81	V73-T77 HydrophobicContact CB-CG2 3.94Å; V73-T77 HydrophobicContact CG1-CG2 4.12Å; V73-T77 HydrophobicContact CG2-CG2 4.17Å; P74-T77 WeakPolarHBondContact O-CA 3.39Å; P74-T77 WeakPolarHBondContact O-CB 3.42Å; P74-T77 PolarHBondContact O-N 3.44Å; N75-T77 VanDerWaalsContact C-N 3.32Å; N75-T77 PolarHBondContact O-N 3.29Å; T77-F79 VanDerWaalsContact C-N 3.3Å; T77-F79 PolarHBondContact O-N 2.78Å; T77-R80 PolarHBondContact O-N 2.93Å; T77-R80 VanDerWaalsContact O-N 3.17Å; T77-W81 HydrophobicContact CG2-CD2 4.05Å; T77-W81 HydrophobicContact CG2-CH2 4.28Å; T77-W81 HydrophobicContact CG2-CZ2 3.73Å; T77-W81 PolarHBondContact O-N 2.99Å
78	L	88.8	Confident	90.3	Very high	12 Å²	12	66 Å²	66	6%	0.063	34%	0.339	C	S	.	.	H	α-helix	trans	-57	-46.4	173.1	-67.8	174.2	0	0	0	110.9	W36 L48 V73 P74 N75 R80 W81 M82	W36-L78 HydrophobicContact CH2-CD2 3.87Å; W36-L78 HydrophobicContact CZ2-CD2 4.01Å; L48-L78 HydrophobicContact CD2-CD1 4.09Å; V73-L78 HydrophobicContact CG2-CD2 3.49Å; V73-L78 VanDerWaalsContact CG2-CD2 3.49Å; V73-L78 HydrophobicContact CG2-CG 3.77Å; P74-L78 PolarHBondContact O-N 3.14Å; N75-L78 PolarHBondContact O-N 3.41Å; L78-R80 PolarHBondContact O-N 2.92Å; L78-W81 HydrophobicContact CD2-CE3 4.24Å; L78-W81 HydrophobicContact CD2-CZ3 4.32Å; L78-W81 PolarHBondContact O-N 2.99Å; L78-M82 WeakPolarHBondContact O-CB 3.03Å; L78-M82 WeakPolarHBondContact O-CG 3.36Å; L78-M82 PolarHBondContact O-N 2.85Å
79	F	90.8	Very high	90.2	Very high	126 Å²	126	67 Å²	67	55%	0.553	35%	0.347	S	S	*	.	H	α-helix	trans	-58	-48.4	175.4	179.7	-94.5	0	0	0	111.3	N75 T77 W81 M82 I83 F84	N75-F79 WeakPolarHBondContact O-CB 3.18Å; N75-F79 PolarHBondContact O-N 2.04Å; T77-F79 VanDerWaalsContact C-N 3.3Å; T77-F79 PolarHBondContact O-N 2.78Å; F79-W81 VanDerWaalsContact C-N 3.35Å; F79-W81 PolarHBondContact O-N 3.35Å; F79-M82 PolarHBondContact O-N 3.02Å; F79-I83 HydrophobicContact CD1-CG1 4.42Å; F79-I83 HydrophobicContact CD2-CG1 3.99Å; F79-I83 HydrophobicContact CE1-CG1 4.13Å; F79-I83 HydrophobicContact CE2-CD1 4.39Å; F79-I83 HydrophobicContact CE2-CG1 3.68Å; F79-I83 HydrophobicContact CG-CG1 4.35Å; F79-I83 HydrophobicContact CZ-CG1 3.76Å; F79-I83 WeakPolarHBondContact O-CB 3.06Å; F79-I83 WeakPolarHBondContact O-CG1 3.33Å; F79-I83 PolarHBondContact O-N 3.09Å; F79-F84 HydrophobicContact CE1-CE2 4.21Å
80	R	92.9	Very high	90.2	Very high	135 Å²	135	72.5 Å²	72.5	51%	0.509	38%	0.376	S	S	.	.	H	α-helix	trans	-58	-46.9	179.3	-178.3	174.3	61.5	-161.3	-2.6	111.9	S76 T77 L78 F84 N85	S76-R80 WeakPolarHBondContact O-CB 3.37Å; S76-R80 PolarHBondContact O-N 2.04Å; T77-R80 PolarHBondContact O-N 2.93Å; T77-R80 VanDerWaalsContact O-N 3.17Å; L78-R80 PolarHBondContact O-N 2.92Å; R80-F84 HydrophobicContact CG-CD2 4.13Å; R80-F84 WeakPolarHBondContact O-CB 3.37Å; R80-F84 PolarHBondContact O-N 3.19Å; R80-N85 PolarHBondContact O-OD1 3.42Å
81	W	92.3	Very high	90.3	Very high	27 Å²	27	68.3 Å²	68.3	10%	0.102	36%	0.358	C	S	.	.	H	α-helix	trans	-62.9	-44.5	179.1	-69.8	-16.5	0	0	0	113	E71 V73 T77 L78 F79 N85 G86 G87 A88 P89	E71-W81 HydrophobicContact CB-CH2 4.35Å; E71-W81 VanDerWaalsContact OE2-CH2 3.27Å; E71-W81 WeakPolarHBondContact OE2-CH2 3.4Å; V73-W81 HydrophobicContact CB-CH2 4.35Å; V73-W81 HydrophobicContact CG1-CH2 3.8Å; V73-W81 HydrophobicContact CG1-CZ2 4.35Å; V73-W81 HydrophobicContact CG1-CZ3 4.44Å; V73-W81 HydrophobicContact CG2-CE3 4.22Å; V73-W81 HydrophobicContact CG2-CH2 3.73Å; V73-W81 HydrophobicContact CG2-CZ3 3.5Å; V73-W81 VanDerWaalsContact CG2-CZ3 3.5Å; T77-W81 HydrophobicContact CG2-CD2 4.05Å; T77-W81 HydrophobicContact CG2-CH2 4.28Å; T77-W81 HydrophobicContact CG2-CZ2 3.73Å; T77-W81 PolarHBondContact O-N 2.99Å; L78-W81 HydrophobicContact CD2-CE3 4.24Å; L78-W81 HydrophobicContact CD2-CZ3 4.32Å; L78-W81 PolarHBondContact O-N 2.99Å; F79-W81 VanDerWaalsContact C-N 3.35Å; F79-W81 PolarHBondContact O-N 3.35Å; W81-N85 CarbonylContact O-C 3.49Å; W81-N85 WeakPolarHBondContact O-CA 3.49Å; W81-N85 WeakPolarHBondContact O-CB 3.34Å; W81-N85 PolarHBondContact O-N 3.4Å; W81-G86 PolarHBondContact O-N 2.78Å; W81-G87 PolarHBondContact O-N 3.04Å; W81-A88 HydrophobicContact CD2-CB 4.46Å; W81-A88 HydrophobicContact CE3-CB 3.61Å; W81-A88 HydrophobicContact CZ3-CB 4.03Å; W81-P89 VanDerWaalsContact CD2-CD 3.45Å; W81-P89 HydrophobicContact CD2-CG 4.3Å; W81-P89 HydrophobicContact CH2-CG 4.08Å; W81-P89 HydrophobicContact CZ2-CG 3.78Å; W81-P89 HydrophobicContact CZ3-CG 4.47Å
82	M	89	Confident	90.8	Very high	65 Å²	65	66.4 Å²	66.4	32%	0.32	35%	0.35	S	S	.	.	H	α-helix	trans	-67.3	-40.9	-178.1	-74	-59.7	-64.6	0	0	112.5	W36 Q46 L78 F79	W36-M82 HydrophobicContact CE3-SD 4.42Å; W36-M82 HydrophobicContact CH2-SD 4.31Å; W36-M82 HydrophobicContact CZ3-CG 4.24Å; W36-M82 HydrophobicContact CZ3-SD 3.58Å; W36-M82 VanDerWaalsContact CZ3-SD 3.58Å; Q46-M82 HydrophobicContact CB-CE 4.48Å; L78-M82 WeakPolarHBondContact O-CB 3.03Å; L78-M82 WeakPolarHBondContact O-CG 3.36Å; L78-M82 PolarHBondContact O-N 2.85Å; F79-M82 PolarHBondContact O-N 3.02Å
83	I	92.4	Very high	91.5	Very high	106 Å²	106	62.9 Å²	62.9	54%	0.544	33%	0.333	S	S	.	.	H	α-helix	trans	-87.7	-46.1	-174.5	-59.1	-56.5	0	0	0	112.4	F79	F79-I83 HydrophobicContact CD1-CG1 4.42Å; F79-I83 HydrophobicContact CD2-CG1 3.99Å; F79-I83 HydrophobicContact CE1-CG1 4.13Å; F79-I83 HydrophobicContact CE2-CD1 4.39Å; F79-I83 HydrophobicContact CE2-CG1 3.68Å; F79-I83 HydrophobicContact CG-CG1 4.35Å; F79-I83 HydrophobicContact CZ-CG1 3.76Å; F79-I83 WeakPolarHBondContact O-CB 3.06Å; F79-I83 WeakPolarHBondContact O-CG1 3.33Å; F79-I83 PolarHBondContact O-N 3.09Å
84	F	94.1	Very high	92.1	Very high	153 Å²	153	62.7 Å²	62.7	67%	0.671	33%	0.333	S	S	*	.	H	α-helix	trans	-100	-23.6	-170.9	-59.7	-73.8	0	0	0	113.9	F79 R80	F79-F84 HydrophobicContact CE1-CE2 4.21Å; R80-F84 HydrophobicContact CG-CD2 4.13Å; R80-F84 WeakPolarHBondContact O-CB 3.37Å; R80-F84 PolarHBondContact O-N 3.19Å
85	N	92.1	Very high	92.4	Very high	71 Å²	71	60.1 Å²	60.1	38%	0.38	31%	0.313	S	S	.	.	S	Bend	trans	-112.1	4.7	-175.5	-55.6	75.9	0	0	0	113.5	R44 R80 W81 G87	R44-N85 WeakPolarHBondContact CD-O 3.05Å; R44-N85 PolarHBondContact NE-O 3.43Å; R80-N85 PolarHBondContact O-OD1 3.42Å; W81-N85 CarbonylContact O-C 3.49Å; W81-N85 WeakPolarHBondContact O-CA 3.49Å; W81-N85 WeakPolarHBondContact O-CB 3.34Å; W81-N85 PolarHBondContact O-N 3.4Å; N85-G87 VanDerWaalsContact C-N 3.26Å; N85-G87 PolarHBondContact O-N 3.29Å
86	G	91.6	Very high	92.7	Very high	31 Å²	31	60.2 Å²	60.2	32%	0.32	31%	0.309	S	S	.	.	S	Bend	trans	66.3	24.2	178.2	0	0	0	0	0	114.4	N42 Q46 W81	N42-G86 PolarHBondContact ND2-O 3.36Å; Q46-G86 PolarHBondContact NE2-O 2.9Å; W81-G86 PolarHBondContact O-N 2.78Å
87	G	94.6	Very high	92.9	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.297	C	S	.	.	S	Bend	trans	131.7	168.8	175.1	0	0	0	0	0	114.4	R44 C45 W81 N85	R44-G87 WeakPolarHBondContact CD-O 3.33Å; R44-G87 PolarHBondContact NH1-O 3.33Å; C45-G87 CarbonylContact O-C 3.56Å; C45-G87 WeakPolarHBondContact O-CA 3.28Å; W81-G87 PolarHBondContact O-N 3.04Å; N85-G87 VanDerWaalsContact C-N 3.26Å; N85-G87 PolarHBondContact O-N 3.29Å
88	A	94.4	Very high	93.2	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-68.8	137.5	177	0	0	0	0	0	111.8	W36 R44 C45 T69 W81	W36-A88 HydrophobicContact CH2-CB 3.55Å; W36-A88 HydrophobicContact CZ2-CB 3.3Å; W36-A88 HydrophobicContact CZ3-CB 4.31Å; R44-A88 WeakPolarHBondContact CA-O 3.38Å; R44-A88 VanDerWaalsContact CB-O 3.32Å; R44-A88 WeakPolarHBondContact CB-O 3.28Å; C45-A88 HydrophobicContact CB-CB 4.04Å; C45-A88 PolarHBondContact N-O 2.79Å; C45-A88 PolarHBondContact O-N 2.83Å; T69-A88 HydrophobicContact CG2-CB 4.21Å; W81-A88 HydrophobicContact CD2-CB 4.46Å; W81-A88 HydrophobicContact CE3-CB 3.61Å; W81-A88 HydrophobicContact CZ3-CB 4.03Å
89	P	94.3	Very high	93.5	Very high	29 Å²	29	65.3 Å²	65.3	19%	0.188	33%	0.331	C	S	.	.	S	Bend	trans	-71.6	176.4	176.4	34.2	-35.9	0	0	0	111.3	T69 W81 C91	T69-P89 WeakPolarHBondContact CG2-O 3.33Å; W81-P89 VanDerWaalsContact CD2-CD 3.45Å; W81-P89 HydrophobicContact CD2-CG 4.3Å; W81-P89 HydrophobicContact CH2-CG 4.08Å; W81-P89 HydrophobicContact CZ2-CG 3.78Å; W81-P89 HydrophobicContact CZ3-CG 4.47Å; P89-C91 PolarHBondContact O-N 3.14Å; P89-C91 VanDerWaalsContact O-N 3.1Å
90	N	94.1	Very high	93.5	Very high	118 Å²	118	65.1 Å²	65.1	63%	0.631	34%	0.336	S	S	*	.	S	Bend	trans	51.5	39.5	173.1	-56.4	-27.8	0	0	0	113.8	I92	N90-I92 PolarHBondContact O-N 2.81Å
91	C	94.7	Very high	93.6	Very high	17 Å²	17	59.9 Å²	59.9	12%	0.115	32%	0.319	C	S	.	.			trans	-76.9	115	-173.8	-176.6	0	0	0	0	111.6	Q39 G43 C45 S67 P89	Q39-C91 PolarHBondContact NE2-O 3.42Å; G43-C91 VanDerWaalsContact O-CB 3.28Å; G43-C91 WeakPolarHBondContact O-CB 3.4Å; C45-C91 WeakPolarHBondContact CA-SG 3.39Å; C45-C91 HydrophobicContact CB-CB 3.68Å; C45-C91 WeakPolarHBondContact CB-SG 3.22Å; C45-C91 PolarHBondContact N-SG 2.89Å; C45-C91 VanDerWaalsContact SG-CA 3.52Å; C45-C91 WeakPolarHBondContact SG-CB 3.21Å; C45-C91 CovalentContact SG-SG 2.04Å; C45-C91 PolarHBondContact SG-SG 3.29Å; S67-C91 VanDerWaalsContact CB-SG 3.55Å; P89-C91 PolarHBondContact O-N 3.14Å; P89-C91 VanDerWaalsContact O-N 3.1Å
92	I	94.8	Very high	93.7	Very high	47 Å²	47	64 Å²	64	24%	0.241	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	112.7	-178.1	-59.9	161.6	0	0	0	108.5	S67 W68 N90	S67-I92 CarbonylContact C-O 3.43Å; S67-I92 VanDerWaalsContact CA-O 3.29Å; S67-I92 WeakPolarHBondContact CA-O 3.47Å; S67-I92 WeakPolarHBondContact CB-O 3.47Å; W68-I92 HydrophobicContact CE3-CD1 3.97Å; W68-I92 HydrophobicContact CZ3-CD1 4.09Å; W68-I92 PolarHBondContact N-O 3.49Å; W68-I92 WeakPolarHBondContact O-CB 3.42Å; W68-I92 PolarHBondContact O-N 2.79Å; N90-I92 PolarHBondContact O-N 2.81Å
93	P	94.6	Very high	94	Very high	34 Å²	34	62 Å²	62	22%	0.221	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	140.9	177.7	28.8	-33.3	0	0	0	110.9	K95 E96	P93-K95 VanDerWaalsContact C-N 3.27Å; P93-K95 PolarHBondContact O-N 3.4Å; P93-E96 HydrophobicContact CG-CG 4.32Å
94	C	94.3	Very high	94	Very high	19 Å²	19	58.4 Å²	58.4	13%	0.128	32%	0.324	C	S	.	.	S	Bend	trans	-72.2	-22.3	176.8	-76.1	0	0	0	0	113.6	C59 T66	C59-C94 WeakPolarHBondContact CA-SG 3.35Å; C59-C94 HydrophobicContact CB-CB 3.49Å; C59-C94 VanDerWaalsContact CB-CB 3.49Å; C59-C94 WeakPolarHBondContact CB-SG 3.35Å; C59-C94 WeakPolarHBondContact SG-CA 3.37Å; C59-C94 WeakPolarHBondContact SG-CB 3.41Å; C59-C94 CovalentContact SG-SG 2.04Å; C59-C94 PolarHBondContact SG-SG 3.37Å; T66-C94 VanDerWaalsContact O-CB 3.28Å; T66-C94 WeakPolarHBondContact O-CB 3.02Å; T66-C94 PolarHBondContact O-N 3.17Å
95	K	93.8	Very high	93.9	Very high	32 Å²	32	57.3 Å²	57.3	14%	0.139	33%	0.332	C	S	.	.			trans	-127.5	113.4	-178	-55.8	-64.1	-179.3	-137.6	0	109.4	C59 S61 L64 P93 N100 V101 P117	C59-K95 PolarHBondContact O-NZ 3.22Å; S61-K95 WeakPolarHBondContact O-CE 3.36Å; S61-K95 PolarHBondContact O-NZ 2.03Å; S61-K95 VanDerWaalsContact O-NZ 3.12Å; L64-K95 HydrophobicContact CD1-CB 4.29Å; P93-K95 VanDerWaalsContact C-N 3.27Å; P93-K95 PolarHBondContact O-N 3.4Å; K95-N100 WeakPolarHBondContact CE-O 3.45Å; K95-V101 HydrophobicContact CB-CG2 3.96Å; K95-V101 HydrophobicContact CD-CG2 4.17Å; K95-V101 HydrophobicContact CG-CG2 3.95Å; K95-P117 WeakPolarHBondContact O-CG 3.41Å
96	E	92.4	Very high	93.9	Very high	133 Å²	133	55.7 Å²	55.7	62%	0.621	33%	0.332	S	S	*	.	S	Bend	trans	-99.1	-19.3	176.4	-64.3	-177.2	179.6	0	0	112.4	P93 M111 P117	P93-E96 HydrophobicContact CG-CG 4.32Å; E96-M111 WeakPolarHBondContact O-CE 3.47Å; E96-P117 WeakPolarHBondContact O-CD 3.44Å
97	S	94.5	Very high	94.1	Very high	49 Å²	49	58.7 Å²	58.7	34%	0.343	34%	0.337	S	S	.	.	S	Bend	trans	-125	-178.4	175.6	77.9	0	0	0	0	110.6	E99 V101 P117	S97-E99 VanDerWaalsContact OG-CB 3.24Å; S97-E99 WeakPolarHBondContact OG-CB 3.39Å; S97-E99 PolarHBondContact OG-N 3.41Å; S97-E99 VanDerWaalsContact OG-N 3.12Å; S97-V101 WeakPolarHBondContact O-CG2 3.33Å; S97-P117 WeakPolarHBondContact O-CB 3.47Å; S97-P117 WeakPolarHBondContact O-CG 3.09Å
98	C	96.1	Very high	94.2	Very high	41 Å²	41	65.6 Å²	65.6	28%	0.277	36%	0.363	S	S	.	.	S	Bend	trans	-82.8	2.1	172.1	-77.2	0	0	0	0	113.9	V101 C109 K110	C98-V101 PolarHBondContact O-N 3.49Å; C98-C109 WeakPolarHBondContact CA-SG 3.06Å; C98-C109 HydrophobicContact CB-CB 3.57Å; C98-C109 WeakPolarHBondContact CB-SG 3.3Å; C98-C109 WeakPolarHBondContact SG-CB 3.45Å; C98-C109 CovalentContact SG-SG 2.04Å; C98-C109 PolarHBondContact SG-SG 3Å; C98-K110 PolarHBondContact SG-N 2.78Å; C98-K110 VanDerWaalsContact SG-N 3.38Å
99	E	95.1	Very high	94.3	Very high	138 Å²	138	67.1 Å²	67.1	65%	0.645	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	131.5	178	-164.8	-178.6	167	0	0	110.5	S97 V101	S97-E99 VanDerWaalsContact OG-CB 3.24Å; S97-E99 WeakPolarHBondContact OG-CB 3.39Å; S97-E99 PolarHBondContact OG-N 3.41Å; S97-E99 VanDerWaalsContact OG-N 3.12Å; E99-V101 PolarHBondContact O-N 3.4Å; E99-V101 VanDerWaalsContact O-N 3.13Å
100	N	90.9	Very high	94.4	Very high	123 Å²	123	71.8 Å²	71.8	66%	0.658	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	28.6	-178.2	-57	-47.1	0	0	0	114.2	G62 K95	G62-N100 VanDerWaalsContact CA-O 3.26Å; G62-N100 WeakPolarHBondContact CA-O 3.45Å; K95-N100 WeakPolarHBondContact CE-O 3.45Å
101	V	95.2	Very high	94.5	Very high	24 Å²	24	70 Å²	70	15%	0.145	38%	0.379	C	S	.	.			trans	-91.9	121.5	173.5	176.4	0	0	0	0	109.9	G62 L64 K95 S97 C98 E99 C109	G62-V101 WeakPolarHBondContact O-CA 3.08Å; L64-V101 HydrophobicContact CB-CG1 4.01Å; L64-V101 HydrophobicContact CD1-CG1 4.17Å; L64-V101 HydrophobicContact CD1-CG2 4.28Å; K95-V101 HydrophobicContact CB-CG2 3.96Å; K95-V101 HydrophobicContact CD-CG2 4.17Å; K95-V101 HydrophobicContact CG-CG2 3.95Å; S97-V101 WeakPolarHBondContact O-CG2 3.33Å; C98-V101 PolarHBondContact O-N 3.49Å; E99-V101 PolarHBondContact O-N 3.4Å; E99-V101 VanDerWaalsContact O-N 3.13Å; V101-C109 HydrophobicContact CB-CB 4.19Å; V101-C109 HydrophobicContact CG1-CB 4.07Å
102	D	94.8	Very high	94.4	Very high	115 Å²	115	71.6 Å²	71.6	62%	0.615	39%	0.387	S	S	*	.	B	Isolated β-bridge	trans	-98.3	117.4	169.8	-178.1	12.1	0	0	0	110	G62 G104	G62-D102 PolarHBondContact O-N 2.76Å; D102-G104 PolarHBondContact OD1-N 3.24Å
103	C	94.5	Very high	94.4	Very high	22 Å²	22	81.9 Å²	81.9	15%	0.149	42%	0.422	C	S	.	.			trans	-98.4	-4.1	179	-69.8	0	0	0	0	113.5	K107 C119	C103-K107 HydrophobicContact CB-CB 3.65Å; C103-C119 WeakPolarHBondContact CA-SG 3.15Å; C103-C119 HydrophobicContact CB-CB 3.62Å; C103-C119 WeakPolarHBondContact CB-SG 3.27Å; C103-C119 WeakPolarHBondContact SG-CA 3.45Å; C103-C119 WeakPolarHBondContact SG-CB 3.28Å; C103-C119 CovalentContact SG-SG 2.03Å; C103-C119 PolarHBondContact SG-SG 2.86Å
104	G	92.6	Very high	94.3	Very high	31 Å²	31	88.9 Å²	88.9	32%	0.32	45%	0.449	S	S	.	.			trans	72.9	-178.3	-169.8	0	0	0	0	0	113.7	D102	D102-G104 PolarHBondContact OD1-N 3.24Å
105	P	92.3	Very high	94.1	Very high	130 Å²	130	90.2 Å²	90.2	84%	0.844	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	144	-173	26.3	-34.8	0	0	0	112.7	K107	P105-K107 PolarHBondContact O-N 2.91Å
106	G	92.5	Very high	94	Very high	37 Å²	37	92.8 Å²	92.8	38%	0.381	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.8	14.7	176.5	0	0	0	0	0	114.7	A122	G106-A122 CarbonylContact C-O 3.38Å; G106-A122 CarbonylContact O-C 3.6Å; G106-A122 WeakPolarHBondContact O-CA 3.34Å; G106-A122 PolarHBondContact O-N 3.24Å
107	K	96.3	Very high	94.1	Very high	94 Å²	94	87 Å²	87	41%	0.409	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	151.3	177.1	-65.2	179.3	-174	171.7	0	110.2	C103 P105 V120 C153	C103-K107 HydrophobicContact CB-CB 3.65Å; P105-K107 PolarHBondContact O-N 2.91Å; K107-V120 CarbonylContact C-O 3.49Å; K107-V120 VanDerWaalsContact CA-O 3.26Å; K107-V120 WeakPolarHBondContact CA-O 3.41Å; K107-C153 VanDerWaalsContact CE-SG 3.55Å
108	R	95.4	Very high	94.1	Very high	145 Å²	145	90.7 Å²	90.7	55%	0.547	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	153.4	173	74.3	-174	-177.7	-110.2	5.4	110.7	V120 A122	R108-V120 HydrophobicContact CG-CG2 3.97Å; R108-V120 PolarHBondContact N-O 3.07Å; R108-V120 WeakPolarHBondContact O-CG2 3.46Å; R108-V120 PolarHBondContact O-N 2.99Å; R108-A122 HydrophobicContact CB-CB 4.04Å; R108-A122 HydrophobicContact CG-CB 3.66Å
109	C	96.9	Very high	94.1	Very high	32 Å²	32	91 Å²	91	22%	0.216	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	136.9	173.5	-171	0	0	0	0	110.9	C98 V101 R118	C98-C109 WeakPolarHBondContact CA-SG 3.06Å; C98-C109 HydrophobicContact CB-CB 3.57Å; C98-C109 WeakPolarHBondContact CB-SG 3.3Å; C98-C109 WeakPolarHBondContact SG-CB 3.45Å; C98-C109 CovalentContact SG-SG 2.04Å; C98-C109 PolarHBondContact SG-SG 3Å; V101-C109 HydrophobicContact CB-CB 4.19Å; V101-C109 HydrophobicContact CG1-CB 4.07Å; C109-R118 CarbonylContact C-O 3.46Å; C109-R118 WeakPolarHBondContact CA-O 3.15Å
110	K	96.8	Very high	94.1	Very high	126 Å²	126	86.8 Å²	86.8	55%	0.548	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	139.5	170.8	-175.9	177	177.7	175.8	0	110.1	C98 R118 V120	C98-K110 PolarHBondContact SG-N 2.78Å; C98-K110 VanDerWaalsContact SG-N 3.38Å; K110-R118 PolarHBondContact N-O 3.19Å; K110-R118 PolarHBondContact O-N 2.91Å; K110-V120 HydrophobicContact CB-CG2 4.07Å
111	M	96	Very high	94.4	Very high	80 Å²	80	82 Å²	82	39%	0.394	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	131.4	171.3	-59.2	-56.4	-78.5	0	0	110.5	E96 G115 P117	E96-M111 WeakPolarHBondContact O-CE 3.47Å; M111-G115 VanDerWaalsContact CE-C 3.48Å; M111-G115 WeakPolarHBondContact CE-O 3.43Å; M111-P117 HydrophobicContact SD-CB 3.89Å
112	N	93.7	Very high	94.5	Very high	52 Å²	52	81.9 Å²	81.9	28%	0.278	42%	0.42	S	S	.	.			trans	-84.2	176.3	174.4	74.6	10.1	0	0	0	111.7	K114 G115 K116 R118	N112-K114 PolarHBondContact O-N 2.71Å; N112-K114 VanDerWaalsContact O-N 3.07Å; N112-K114 WeakPolarHBondContact OD1-CA 3.07Å; N112-K114 PolarHBondContact OD1-N 2.87Å; N112-G115 PolarHBondContact O-N 2.8Å; N112-G115 PolarHBondContact OD1-N 2.04Å; N112-K116 VanDerWaalsContact CG-O 3.25Å; N112-K116 PolarHBondContact N-O 3.43Å; N112-K116 PolarHBondContact OD1-N 3.26Å; N112-K116 PolarHBondContact OD1-O 3.27Å; N112-R118 HydrophobicContact CB-CG 4.03Å
113	R	94.3	Very high	94.5	Very high	263 Å²	263	78 Å²	78	99%	0.992	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-16.3	178.8	-65.7	-176	178.9	166.9	-1	114.7
114	K	91.1	Very high	94.5	Very high	181 Å²	181	82.1 Å²	82.1	79%	0.787	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	12.7	177.8	-59.9	-172.1	177.2	-171.3	0	112.3	N112 K116	N112-K114 PolarHBondContact O-N 2.71Å; N112-K114 VanDerWaalsContact O-N 3.07Å; N112-K114 WeakPolarHBondContact OD1-CA 3.07Å; N112-K114 PolarHBondContact OD1-N 2.87Å; K114-K116 PolarHBondContact O-N 3.13Å
115	G	91.2	Very high	94.6	Very high	47 Å²	47	82 Å²	82	49%	0.485	42%	0.416	S	S	.	.	S	Bend	trans	65.8	22.3	-177.5	0	0	0	0	0	114.1	M111 N112	M111-G115 VanDerWaalsContact CE-C 3.48Å; M111-G115 WeakPolarHBondContact CE-O 3.43Å; N112-G115 PolarHBondContact O-N 2.8Å; N112-G115 PolarHBondContact OD1-N 2.04Å
116	K	91.6	Very high	94.7	Very high	86 Å²	86	80.4 Å²	80.4	37%	0.374	41%	0.408	S	S	.	.			trans	-104.7	138.1	175.8	-66.9	-165	172.3	-165.7	0	111.5	N112 K114	N112-K116 VanDerWaalsContact CG-O 3.25Å; N112-K116 PolarHBondContact N-O 3.43Å; N112-K116 PolarHBondContact OD1-N 3.26Å; N112-K116 PolarHBondContact OD1-O 3.27Å; K114-K116 PolarHBondContact O-N 3.13Å
117	P	95	Very high	94.8	Very high	10 Å²	10	85.6 Å²	85.6	7%	0.065	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	139.9	176.7	24.2	-29.2	0	0	0	111.1	L64 K95 E96 S97 M111	L64-P117 HydrophobicContact CD1-CB 3.6Å; L64-P117 HydrophobicContact CD1-CG 3.57Å; K95-P117 WeakPolarHBondContact O-CG 3.41Å; E96-P117 WeakPolarHBondContact O-CD 3.44Å; S97-P117 WeakPolarHBondContact O-CB 3.47Å; S97-P117 WeakPolarHBondContact O-CG 3.09Å; M111-P117 HydrophobicContact SD-CB 3.89Å
118	R	94.7	Very high	94.8	Very high	128 Å²	128	82 Å²	82	48%	0.483	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	129.7	179.3	-65.7	-64	173.3	177.7	-3.2	111.1	C109 K110 N112 V120	C109-R118 CarbonylContact C-O 3.46Å; C109-R118 WeakPolarHBondContact CA-O 3.15Å; K110-R118 PolarHBondContact N-O 3.19Å; K110-R118 PolarHBondContact O-N 2.91Å; N112-R118 HydrophobicContact CB-CG 4.03Å; R118-V120 PolarHBondContact O-N 2.78Å
119	C	95.3	Very high	94.7	Very high	46 Å²	46	81.3 Å²	81.3	31%	0.311	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	119.2	167.7	-66.3	0	0	0	0	109.7	L64 C103	L64-C119 HydrophobicContact CD2-CB 4.27Å; C103-C119 WeakPolarHBondContact CA-SG 3.15Å; C103-C119 HydrophobicContact CB-CB 3.62Å; C103-C119 WeakPolarHBondContact CB-SG 3.27Å; C103-C119 WeakPolarHBondContact SG-CA 3.45Å; C103-C119 WeakPolarHBondContact SG-CB 3.28Å; C103-C119 CovalentContact SG-SG 2.03Å; C103-C119 PolarHBondContact SG-SG 2.86Å
120	V	95.8	Very high	94.7	Very high	51 Å²	51	84 Å²	84	31%	0.309	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	146.5	179.1	-62.1	0	0	0	0	110.3	K107 R108 K110 R118 A122	K107-V120 CarbonylContact C-O 3.49Å; K107-V120 VanDerWaalsContact CA-O 3.26Å; K107-V120 WeakPolarHBondContact CA-O 3.41Å; R108-V120 HydrophobicContact CG-CG2 3.97Å; R108-V120 PolarHBondContact N-O 3.07Å; R108-V120 WeakPolarHBondContact O-CG2 3.46Å; R108-V120 PolarHBondContact O-N 2.99Å; K110-V120 HydrophobicContact CB-CG2 4.07Å; R118-V120 PolarHBondContact O-N 2.78Å; V120-A122 PolarHBondContact O-N 2.86Å
121	C	97.1	Very high	94.6	Very high	21 Å²	21	85.3 Å²	85.3	14%	0.142	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	126	176	-70	0	0	0	0	111.5	K150 C153	C121-K150 HydrophobicContact CB-CG 4.13Å; C121-C153 WeakPolarHBondContact CA-SG 3.11Å; C121-C153 HydrophobicContact CB-CB 3.69Å; C121-C153 WeakPolarHBondContact CB-SG 3.47Å; C121-C153 WeakPolarHBondContact SG-CB 3.43Å; C121-C153 PolarHBondContact SG-O 2.96Å; C121-C153 VanDerWaalsContact SG-O 3.38Å; C121-C153 CovalentContact SG-SG 2.04Å; C121-C153 PolarHBondContact SG-SG 3.43Å
122	A	96.4	Very high	94.6	Very high	22 Å²	22	82.4 Å²	82.4	18%	0.182	43%	0.426	C	S	.	.			trans	-145.2	64.4	-176.2	0	0	0	0	0	108.9	G106 R108 V120	G106-A122 CarbonylContact C-O 3.38Å; G106-A122 CarbonylContact O-C 3.6Å; G106-A122 WeakPolarHBondContact O-CA 3.34Å; G106-A122 PolarHBondContact O-N 3.24Å; R108-A122 HydrophobicContact CB-CB 4.04Å; R108-A122 HydrophobicContact CG-CB 3.66Å; V120-A122 PolarHBondContact O-N 2.86Å
123	P	95.7	Very high	94.9	Very high	33 Å²	33	81.9 Å²	81.9	21%	0.214	43%	0.426	C	S	.	.			trans	-61.2	149	173.7	28.8	-34.7	0	0	0	110	C125 L149 K150	P123-C125 PolarHBondContact O-N 3.36Å; P123-L149 HydrophobicContact CB-CB 3.79Å; P123-L149 HydrophobicContact CB-CD1 4.36Å; P123-L149 HydrophobicContact CG-CB 3.86Å; P123-K150 HydrophobicContact CG-CB 4.45Å
124	D	94.3	Very high	95.1	Very high	109 Å²	109	69.4 Å²	69.4	58%	0.583	38%	0.379	S	S	*	.			trans	-73.2	124.1	168.4	-178.4	14.9	0	0	0	109	S126	D124-S126 VanDerWaalsContact OD1-CB 3.29Å; D124-S126 WeakPolarHBondContact OD1-CB 3.29Å; D124-S126 PolarHBondContact OD1-N 3.05Å; D124-S126 PolarHBondContact OD1-OG 3.1Å
125	C	95.3	Very high	95.4	Very high	29 Å²	29	60.8 Å²	60.8	20%	0.196	34%	0.341	C	S	.	.			trans	-119.4	10.8	-176.8	-60.2	0	0	0	0	112.1	P123 I128 C146	P123-C125 PolarHBondContact O-N 3.36Å; C125-I128 HydrophobicContact CB-CD1 3.81Å; C125-C146 HydrophobicContact CB-CB 3.68Å; C125-C146 WeakPolarHBondContact CB-SG 3.42Å; C125-C146 VanDerWaalsContact SG-CA 3.58Å; C125-C146 WeakPolarHBondContact SG-CB 3.37Å; C125-C146 CovalentContact SG-SG 2.04Å; C125-C146 PolarHBondContact SG-SG 3.39Å
126	S	94.4	Very high	95.7	Very high	96 Å²	96	58.5 Å²	58.5	67%	0.671	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-37.6	-173	-47.4	0	0	0	0	112.1	D124 I128	D124-S126 VanDerWaalsContact OD1-CB 3.29Å; D124-S126 WeakPolarHBondContact OD1-CB 3.29Å; D124-S126 PolarHBondContact OD1-N 3.05Å; D124-S126 PolarHBondContact OD1-OG 3.1Å; S126-I128 VanDerWaalsContact C-N 3.33Å; S126-I128 PolarHBondContact O-N 3.03Å
127	N	94.1	Very high	96	Very high	147 Å²	147	57 Å²	57	79%	0.786	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	9.8	-176.4	-66.9	-21.3	0	0	0	114.3	T129	N127-T129 PolarHBondContact O-N 3.06Å
128	I	95.1	Very high	96.1	Very high	18 Å²	18	58.9 Å²	58.9	9%	0.092	33%	0.328	C	S	.	.			trans	-80.1	113.2	178.2	-63.9	173.8	0	0	0	108.9	C125 S126 W130 K131 E145 C146 L149	C125-I128 HydrophobicContact CB-CD1 3.81Å; S126-I128 VanDerWaalsContact C-N 3.33Å; S126-I128 PolarHBondContact O-N 3.03Å; I128-W130 WeakPolarHBondContact CG2-O 3.48Å; I128-K131 WeakPolarHBondContact O-CE 3.48Å; I128-K131 PolarHBondContact O-NZ 3.18Å; I128-E145 HydrophobicContact CD1-CB 4.08Å; I128-E145 HydrophobicContact CD1-CG 4.01Å; I128-E145 HydrophobicContact CG1-CG 4.43Å; I128-E145 HydrophobicContact CG2-CB 3.94Å; I128-E145 HydrophobicContact CG2-CG 4.44Å; I128-C146 HydrophobicContact CD1-CB 4.04Å; I128-L149 HydrophobicContact CD1-CD1 4.04Å
129	T	94.9	Very high	96.2	Very high	130 Å²	130	53.9 Å²	53.9	80%	0.798	32%	0.316	S	S	*	.			trans	-79.6	-41	-179.3	54.1	0	0	0	0	112.2	N127 K131	N127-T129 PolarHBondContact O-N 3.06Å; T129-K131 PolarHBondContact O-N 2.05Å
130	W	95.2	Very high	96.3	Very high	90 Å²	90	57.6 Å²	57.6	34%	0.341	33%	0.327	S	S	.	.			trans	-77.7	118.8	178.9	179.6	-101.5	0	0	0	111.6	I128 G132 P133 Q164	I128-W130 WeakPolarHBondContact CG2-O 3.48Å; W130-G132 PolarHBondContact NE1-O 3.47Å; W130-G132 VanDerWaalsContact NE1-O 3.11Å; W130-P133 PolarHBondContact NE1-O 2.89Å; W130-Q164 HydrophobicContact CD2-CB 4.18Å; W130-Q164 HydrophobicContact CD2-CG 4.06Å; W130-Q164 HydrophobicContact CG-CG 4.05Å; W130-Q164 HydrophobicContact CZ2-CB 4.16Å
131	K	94.9	Very high	96.5	Very high	152 Å²	152	58.4 Å²	58.4	66%	0.661	33%	0.332	S	S	*	.			trans	-99.9	-4.8	-178.6	-58	-56.2	-174.3	-167.1	0	114.4	I128 T129	I128-K131 WeakPolarHBondContact O-CE 3.48Å; I128-K131 PolarHBondContact O-NZ 3.18Å; T129-K131 PolarHBondContact O-N 2.05Å
132	G	97.1	Very high	96.5	Very high	20 Å²	20	58.9 Å²	58.9	21%	0.206	33%	0.331	C	S	.	.	S	Bend	trans	-84.2	-177	178.8	0	0	0	0	0	113.6	W130 D144	W130-G132 PolarHBondContact NE1-O 3.47Å; W130-G132 VanDerWaalsContact NE1-O 3.11Å; G132-D144 WeakPolarHBondContact O-CA 3.44Å
133	P	98.4	Very high	96.6	Very high	40 Å²	40	65.2 Å²	65.2	26%	0.26	35%	0.354	S	S	.	.			trans	-63.8	158.2	174.4	27.8	-34.1	0	0	0	111.8	W130 T141 Y142 K143 G165 K166	W130-P133 PolarHBondContact NE1-O 2.89Å; P133-T141 HydrophobicContact CB-CG2 4.19Å; P133-Y142 VanDerWaalsContact CA-O 3.28Å; P133-Y142 WeakPolarHBondContact CA-O 3.03Å; P133-Y142 WeakPolarHBondContact CB-O 3.28Å; P133-K143 WeakPolarHBondContact CA-O 3.31Å; P133-G165 CarbonylContact C-O 3.59Å; P133-G165 CarbonylContact O-C 3.01Å; P133-G165 VanDerWaalsContact O-CA 3.25Å; P133-G165 WeakPolarHBondContact O-CA 3.42Å; P133-G165 PolarHBondContact O-N 3.3Å; P133-K166 HydrophobicContact CB-CG 4.06Å; P133-K166 HydrophobicContact CG-CG 3.83Å
134	V	98.6	Very high	96.7	Very high	1 Å²	1	65.3 Å²	65.3	1%	0.006	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	148.9	176	-62.2	0	0	0	0	110.4	Y142 E145 L148 V161 G165	V134-Y142 PolarHBondContact N-O 3.08Å; V134-Y142 PolarHBondContact O-N 3.29Å; V134-E145 HydrophobicContact CG1-CB 4.21Å; V134-L148 HydrophobicContact CG2-CB 4.26Å; V134-L148 HydrophobicContact CG2-CD1 4.1Å; V134-V161 HydrophobicContact CB-CG1 4.03Å; V134-V161 HydrophobicContact CB-CG2 4.07Å; V134-V161 HydrophobicContact CG1-CG1 4.26Å; V134-V161 HydrophobicContact CG1-CG2 4.3Å; V134-V161 HydrophobicContact CG2-CG2 3.98Å; V134-G165 CarbonylContact C-O 3.52Å; V134-G165 WeakPolarHBondContact CA-O 3.43Å; V134-G165 PolarHBondContact N-O 3.3Å
135	C	98.6	Very high	96.9	Very high	0 Å²	0	63 Å²	63	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	121.8	171.6	-172.1	0	0	0	0	109.3	Q162 Y163 G165 C167	C135-Q162 HydrophobicContact CB-CG 4.26Å; C135-Q162 VanDerWaalsContact O-CG 3.25Å; C135-Q162 WeakPolarHBondContact O-CG 3.26Å; C135-Q162 PolarHBondContact O-N 3.47Å; C135-Q162 PolarHBondContact SG-NE2 3.46Å; C135-Y163 HydrophobicContact CB-CD1 4.16Å; C135-Y163 HydrophobicContact CB-CD2 3.77Å; C135-Y163 HydrophobicContact CB-CE1 3.84Å; C135-Y163 HydrophobicContact CB-CE2 3.43Å; C135-Y163 VanDerWaalsContact CB-CE2 3.43Å; C135-Y163 HydrophobicContact CB-CG 4.13Å; C135-Y163 VanDerWaalsContact CB-CZ 3.48Å; C135-Y163 PolarHBondContact N-O 3.4Å; C135-Y163 PolarHBondContact SG-OH 3.35Å; C135-Y163 VanDerWaalsContact SG-OH 3.4Å; C135-G165 PolarHBondContact N-O 3.42Å; C135-C167 WeakPolarHBondContact CA-SG 3.46Å; C135-C167 HydrophobicContact CB-CB 4.03Å; C135-C167 WeakPolarHBondContact CB-SG 3.47Å; C135-C167 WeakPolarHBondContact SG-CA 3.37Å; C135-C167 WeakPolarHBondContact SG-CB 3.35Å; C135-C167 CovalentContact SG-SG 2.04Å; C135-C167 PolarHBondContact SG-SG 3.43Å
136	G	98.3	Very high	97	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	156.7	176.5	0	0	0	0	0	112.3	D138 G139 K140 D160 Q162	G136-D138 PolarHBondContact O-N 2.99Å; G136-D138 VanDerWaalsContact O-N 3.15Å; G136-G139 PolarHBondContact O-N 2.98Å; G136-K140 PolarHBondContact N-O 3.24Å; G136-D160 CarbonylContact C-O 3.56Å; G136-D160 WeakPolarHBondContact CA-O 3.24Å; G136-Q162 WeakPolarHBondContact O-CG 3.06Å; G136-Q162 PolarHBondContact O-NE2 3.44Å
137	S	97.4	Very high	97.2	Very high	55 Å²	55	59.9 Å²	59.9	39%	0.385	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-14.8	173.2	56.1	0	0	0	0	113.3	G139 D158 D160	S137-G139 VanDerWaalsContact C-N 3.28Å; S137-D158 PolarHBondContact OG-O 2.69Å; S137-D160 PolarHBondContact N-O 3.1Å; S137-D160 PolarHBondContact OG-N 3.41Å; S137-D160 PolarHBondContact OG-O 3.02Å
138	D	96.8	Very high	97.4	Very high	49 Å²	49	52.9 Å²	52.9	26%	0.262	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	5.4	171.7	68.6	-16.6	0	0	0	113.8	G136 K140 Y142 L159	G136-D138 PolarHBondContact O-N 2.99Å; G136-D138 VanDerWaalsContact O-N 3.15Å; D138-K140 VanDerWaalsContact C-N 3.27Å; D138-K140 PolarHBondContact O-N 3.49Å; D138-K140 WeakPolarHBondContact OD1-CB 3Å; D138-K140 PolarHBondContact OD1-N 3.27Å; D138-K140 WeakPolarHBondContact OD2-CD 3.42Å; D138-Y142 WeakPolarHBondContact OD1-CE2 3.49Å; D138-Y142 PolarHBondContact OD2-OH 3.29Å; D138-L159 HydrophobicContact CB-CD1 3.85Å; D138-L159 VanDerWaalsContact CG-CD1 3.45Å
139	G	96.8	Very high	97.5	Very high	22 Å²	22	54.1 Å²	54.1	23%	0.227	29%	0.288	C	S	.	.	S	Bend	trans	74.4	11.3	-178.4	0	0	0	0	0	114.3	G136 S137 C167	G136-G139 PolarHBondContact O-N 2.98Å; S137-G139 VanDerWaalsContact C-N 3.28Å; G139-C167 VanDerWaalsContact C-SG 3.54Å; G139-C167 PolarHBondContact O-SG 2.91Å
140	K	97.8	Very high	97.6	Very high	124 Å²	124	52.6 Å²	52.6	54%	0.539	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-103.2	143.1	-179.5	-63.2	-177.5	-174.2	166.2	0	112.3	G136 D138 Y142 C167	G136-K140 PolarHBondContact N-O 3.24Å; D138-K140 VanDerWaalsContact C-N 3.27Å; D138-K140 PolarHBondContact O-N 3.49Å; D138-K140 WeakPolarHBondContact OD1-CB 3Å; D138-K140 PolarHBondContact OD1-N 3.27Å; D138-K140 WeakPolarHBondContact OD2-CD 3.42Å; K140-Y142 HydrophobicContact CB-CE2 3.91Å; K140-Y142 VanDerWaalsContact O-CD2 3.27Å; K140-Y142 WeakPolarHBondContact O-CD2 3.36Å; K140-Y142 WeakPolarHBondContact O-CE2 3.29Å; K140-C167 PolarHBondContact O-SG 2.98Å; K140-C167 VanDerWaalsContact O-SG 3.35Å
141	T	98.5	Very high	97.6	Very high	69 Å²	69	49.3 Å²	49.3	42%	0.423	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	124.9	172.2	-62.1	0	0	0	0	109.7	P133 K166 C167	P133-T141 HydrophobicContact CB-CG2 4.19Å; T141-K166 HydrophobicContact CG2-CB 3.95Å; T141-K166 HydrophobicContact CG2-CG 3.89Å; T141-C167 PolarHBondContact OG1-N 2.96Å
142	Y	98.5	Very high	97.8	Very high	30 Å²	30	44.9 Å²	44.9	12%	0.118	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	143.6	170.6	-66.7	-95.9	0	0	0	109.3	P133 V134 D138 K140 D144 L148 A151 L159	P133-Y142 VanDerWaalsContact CA-O 3.28Å; P133-Y142 WeakPolarHBondContact CA-O 3.03Å; P133-Y142 WeakPolarHBondContact CB-O 3.28Å; V134-Y142 PolarHBondContact N-O 3.08Å; V134-Y142 PolarHBondContact O-N 3.29Å; D138-Y142 WeakPolarHBondContact OD1-CE2 3.49Å; D138-Y142 PolarHBondContact OD2-OH 3.29Å; K140-Y142 HydrophobicContact CB-CE2 3.91Å; K140-Y142 VanDerWaalsContact O-CD2 3.27Å; K140-Y142 WeakPolarHBondContact O-CD2 3.36Å; K140-Y142 WeakPolarHBondContact O-CE2 3.29Å; Y142-D144 PolarHBondContact O-N 2.89Å; Y142-D144 VanDerWaalsContact O-N 3.14Å; Y142-L148 HydrophobicContact CD1-CB 4Å; Y142-L148 HydrophobicContact CD2-CB 4.15Å; Y142-L148 HydrophobicContact CD2-CD1 3.77Å; Y142-L148 HydrophobicContact CD2-CG 4.13Å; Y142-L148 HydrophobicContact CE2-CD1 4.1Å; Y142-L148 HydrophobicContact CE2-CG 4.32Å; Y142-L148 HydrophobicContact CG-CB 3.78Å; Y142-L148 HydrophobicContact CG-CD1 4.27Å; Y142-L148 HydrophobicContact CG-CG 4.26Å; Y142-A151 HydrophobicContact CD1-CB 4.45Å; Y142-A151 HydrophobicContact CE1-CB 3.58Å; Y142-L159 HydrophobicContact CE1-CD2 4.27Å; Y142-L159 HydrophobicContact CE2-CD1 4.24Å; Y142-L159 HydrophobicContact CE2-CD2 4.31Å; Y142-L159 WeakPolarHBondContact OH-CD2 3.26Å
143	K	98.1	Very high	97.8	Very high	155 Å²	155	45.7 Å²	45.7	67%	0.674	25%	0.245	S	C	*	.	S	Bend	trans	-54.4	-33.3	-179.6	59.8	163.5	-164.5	120	0	113.7	P133	P133-K143 WeakPolarHBondContact CA-O 3.31Å
144	D	98.1	Very high	97.6	Very high	36 Å²	36	51.1 Å²	51.1	19%	0.193	27%	0.265	C	S	.	.	S	Bend	trans	-166.4	168	-179.5	55	39.7	0	0	0	108.9	G132 Y142 C146 G147 L148	G132-D144 WeakPolarHBondContact O-CA 3.44Å; Y142-D144 PolarHBondContact O-N 2.89Å; Y142-D144 VanDerWaalsContact O-N 3.14Å; D144-C146 VanDerWaalsContact C-N 3.3Å; D144-C146 PolarHBondContact O-N 2.9Å; D144-C146 PolarHBondContact OD1-N 3.15Å; D144-G147 PolarHBondContact O-N 3.5Å; D144-G147 WeakPolarHBondContact OD1-CA 3.47Å; D144-G147 PolarHBondContact OD1-N 2.78Å; D144-L148 PolarHBondContact O-N 2.79Å
145	E	98.1	Very high	97.3	Very high	61 Å²	61	54 Å²	54	29%	0.285	30%	0.295	S	S	.	.	H	α-helix	trans	-63	-34.2	179.9	-178.5	174.9	173.2	0	0	112.6	I128 V134 G147 L148 L149 V161	I128-E145 HydrophobicContact CD1-CB 4.08Å; I128-E145 HydrophobicContact CD1-CG 4.01Å; I128-E145 HydrophobicContact CG1-CG 4.43Å; I128-E145 HydrophobicContact CG2-CB 3.94Å; I128-E145 HydrophobicContact CG2-CG 4.44Å; V134-E145 HydrophobicContact CG1-CB 4.21Å; E145-G147 VanDerWaalsContact C-N 3.3Å; E145-G147 PolarHBondContact O-N 3Å; E145-L148 WeakPolarHBondContact O-CB 3.45Å; E145-L148 PolarHBondContact O-N 3.37Å; E145-L148 VanDerWaalsContact O-N 3.15Å; E145-L149 WeakPolarHBondContact O-CG 3.5Å; E145-L149 PolarHBondContact O-N 3.39Å; E145-V161 HydrophobicContact CB-CG2 4.5Å; E145-V161 HydrophobicContact CG-CG2 3.97Å
146	C	97.4	Very high	97.2	Very high	42 Å²	42	57.5 Å²	57.5	28%	0.284	31%	0.311	S	S	.	.	H	α-helix	trans	-63.5	-36.9	176.1	-170.7	0	0	0	0	112.1	C125 I128 D144 L148 L149 K150	C125-C146 HydrophobicContact CB-CB 3.68Å; C125-C146 WeakPolarHBondContact CB-SG 3.42Å; C125-C146 VanDerWaalsContact SG-CA 3.58Å; C125-C146 WeakPolarHBondContact SG-CB 3.37Å; C125-C146 CovalentContact SG-SG 2.04Å; C125-C146 PolarHBondContact SG-SG 3.39Å; I128-C146 HydrophobicContact CD1-CB 4.04Å; D144-C146 VanDerWaalsContact C-N 3.3Å; D144-C146 PolarHBondContact O-N 2.9Å; D144-C146 PolarHBondContact OD1-N 3.15Å; C146-L148 VanDerWaalsContact C-N 3.35Å; C146-L149 PolarHBondContact O-N 3.25Å; C146-K150 WeakPolarHBondContact O-CB 3.44Å; C146-K150 PolarHBondContact O-N 3.38Å
147	G	97.5	Very high	97	Very high	16 Å²	16	62 Å²	62	17%	0.165	34%	0.34	C	S	.	.	H	α-helix	trans	-62.4	-41.7	173.6	0	0	0	0	0	111.9	D144 E145 K150 A151	D144-G147 PolarHBondContact O-N 3.5Å; D144-G147 WeakPolarHBondContact OD1-CA 3.47Å; D144-G147 PolarHBondContact OD1-N 2.78Å; E145-G147 VanDerWaalsContact C-N 3.3Å; E145-G147 PolarHBondContact O-N 3Å; G147-K150 PolarHBondContact O-N 2.92Å; G147-A151 PolarHBondContact O-N 2.94Å; G147-A151 VanDerWaalsContact O-N 3.11Å
148	L	98.3	Very high	97	Very high	1 Å²	1	65.8 Å²	65.8	1%	0.005	36%	0.356	C	S	.	.	H	α-helix	trans	-64.1	-49.9	173.6	-175.2	152.5	0	0	0	111.2	V134 Y142 D144 E145 C146 K150 A151 K152 L159 V161	V134-L148 HydrophobicContact CG2-CB 4.26Å; V134-L148 HydrophobicContact CG2-CD1 4.1Å; Y142-L148 HydrophobicContact CD1-CB 4Å; Y142-L148 HydrophobicContact CD2-CB 4.15Å; Y142-L148 HydrophobicContact CD2-CD1 3.77Å; Y142-L148 HydrophobicContact CD2-CG 4.13Å; Y142-L148 HydrophobicContact CE2-CD1 4.1Å; Y142-L148 HydrophobicContact CE2-CG 4.32Å; Y142-L148 HydrophobicContact CG-CB 3.78Å; Y142-L148 HydrophobicContact CG-CD1 4.27Å; Y142-L148 HydrophobicContact CG-CG 4.26Å; D144-L148 PolarHBondContact O-N 2.79Å; E145-L148 WeakPolarHBondContact O-CB 3.45Å; E145-L148 PolarHBondContact O-N 3.37Å; E145-L148 VanDerWaalsContact O-N 3.15Å; C146-L148 VanDerWaalsContact C-N 3.35Å; L148-K150 PolarHBondContact O-N 2.97Å; L148-A151 CarbonylContact O-C 3.56Å; L148-A151 WeakPolarHBondContact O-CA 3.42Å; L148-A151 WeakPolarHBondContact O-CB 3.28Å; L148-A151 PolarHBondContact O-N 2.7Å; L148-K152 PolarHBondContact O-N 3.19Å; L148-L159 HydrophobicContact CD1-CD1 4.48Å; L148-L159 HydrophobicContact CD1-CG 4.31Å; L148-L159 HydrophobicContact CD2-CD2 4.17Å; L148-L159 HydrophobicContact CD2-CG 3.91Å; L148-L159 HydrophobicContact CG-CD2 3.85Å; L148-L159 HydrophobicContact CG-CG 3.89Å; L148-V161 HydrophobicContact CD1-CG2 3.81Å; L148-V161 HydrophobicContact CD2-CG2 4.42Å
149	L	97.3	Very high	97	Very high	43 Å²	43	63.6 Å²	63.6	23%	0.225	35%	0.345	C	S	.	.	H	α-helix	trans	-58.3	-34.2	178	-68	176	0	0	0	112.5	P123 I128 E145 C146 K152 C153	P123-L149 HydrophobicContact CB-CB 3.79Å; P123-L149 HydrophobicContact CB-CD1 4.36Å; P123-L149 HydrophobicContact CG-CB 3.86Å; I128-L149 HydrophobicContact CD1-CD1 4.04Å; E145-L149 WeakPolarHBondContact O-CG 3.5Å; E145-L149 PolarHBondContact O-N 3.39Å; C146-L149 PolarHBondContact O-N 3.25Å; L149-K152 HydrophobicContact CD2-CD 4.44Å; L149-K152 WeakPolarHBondContact O-CB 3.44Å; L149-K152 PolarHBondContact O-N 2.87Å; L149-C153 WeakPolarHBondContact O-CB 3.04Å; L149-C153 PolarHBondContact O-N 2.77Å
150	K	97	Very high	97.1	Very high	99 Å²	99	66.4 Å²	66.4	43%	0.43	35%	0.354	S	S	.	.	H	α-helix	trans	-68.6	-37.1	173.8	-170.3	177.9	-175	177.8	0	112.1	C121 P123 C146 G147 L148 K154	C121-K150 HydrophobicContact CB-CG 4.13Å; P123-K150 HydrophobicContact CG-CB 4.45Å; C146-K150 WeakPolarHBondContact O-CB 3.44Å; C146-K150 PolarHBondContact O-N 3.38Å; G147-K150 PolarHBondContact O-N 2.92Å; L148-K150 PolarHBondContact O-N 2.97Å; K150-K154 VanDerWaalsContact O-CG 3.3Å; K150-K154 WeakPolarHBondContact O-CG 3.39Å; K150-K154 PolarHBondContact O-N 3.47Å
151	A	97.1	Very high	97.1	Very high	21 Å²	21	62.9 Å²	62.9	17%	0.174	34%	0.343	C	S	.	.	H	α-helix	trans	-67.6	-43	173.1	0	0	0	0	0	111.3	Y142 G147 L148 C153 K154 G155 L159	Y142-A151 HydrophobicContact CD1-CB 4.45Å; Y142-A151 HydrophobicContact CE1-CB 3.58Å; G147-A151 PolarHBondContact O-N 2.94Å; G147-A151 VanDerWaalsContact O-N 3.11Å; L148-A151 CarbonylContact O-C 3.56Å; L148-A151 WeakPolarHBondContact O-CA 3.42Å; L148-A151 WeakPolarHBondContact O-CB 3.28Å; L148-A151 PolarHBondContact O-N 2.7Å; A151-C153 PolarHBondContact O-N 2.97Å; A151-K154 PolarHBondContact O-N 2.87Å; A151-G155 PolarHBondContact O-N 3.15Å; A151-L159 HydrophobicContact CB-CD2 3.8Å
152	K	97.3	Very high	97.1	Very high	59 Å²	59	60.4 Å²	60.4	26%	0.257	33%	0.327	S	S	.	.	H	α-helix	trans	-50.6	-55.1	172.9	-173.1	178.7	-162	157.4	0	111.1	L148 L149 K154 G155 Q156 P157 L159 D160	L148-K152 PolarHBondContact O-N 3.19Å; L149-K152 HydrophobicContact CD2-CD 4.44Å; L149-K152 WeakPolarHBondContact O-CB 3.44Å; L149-K152 PolarHBondContact O-N 2.87Å; K152-K154 VanDerWaalsContact C-N 3.27Å; K152-K154 PolarHBondContact O-N 2.78Å; K152-G155 PolarHBondContact O-N 2.76Å; K152-Q156 VanDerWaalsContact CA-O 3.29Å; K152-Q156 WeakPolarHBondContact CA-O 3.46Å; K152-Q156 VanDerWaalsContact CG-O 3.32Å; K152-Q156 WeakPolarHBondContact CG-O 3.42Å; K152-Q156 CarbonylContact O-C 3.49Å; K152-Q156 PolarHBondContact O-N 2.04Å; K152-Q156 VanDerWaalsContact O-N 3.08Å; K152-P157 WeakPolarHBondContact CE-O 3.36Å; K152-L159 HydrophobicContact CB-CB 4.29Å; K152-L159 WeakPolarHBondContact CD-O 3.25Å; K152-L159 VanDerWaalsContact CE-O 3.25Å; K152-L159 WeakPolarHBondContact CE-O 3.39Å; K152-L159 HydrophobicContact CG-CB 4.45Å; K152-L159 PolarHBondContact NZ-O 3.39Å; K152-D160 IonicContact NZ-OD1 2.63Å; K152-D160 PolarHBondContact NZ-OD1 3.25Å; K152-D160 IonicContact NZ-OD2 3.71Å
153	C	96.9	Very high	97.1	Very high	36 Å²	36	59.3 Å²	59.3	24%	0.243	32%	0.322	C	S	.	.	H	α-helix	trans	-61	-29.2	178.6	168.7	0	0	0	0	114.5	K107 C121 L149 A151	K107-C153 VanDerWaalsContact CE-SG 3.55Å; C121-C153 WeakPolarHBondContact CA-SG 3.11Å; C121-C153 HydrophobicContact CB-CB 3.69Å; C121-C153 WeakPolarHBondContact CB-SG 3.47Å; C121-C153 WeakPolarHBondContact SG-CB 3.43Å; C121-C153 PolarHBondContact SG-O 2.96Å; C121-C153 VanDerWaalsContact SG-O 3.38Å; C121-C153 CovalentContact SG-SG 2.04Å; C121-C153 PolarHBondContact SG-SG 3.43Å; L149-C153 WeakPolarHBondContact O-CB 3.04Å; L149-C153 PolarHBondContact O-N 2.77Å; A151-C153 PolarHBondContact O-N 2.97Å
154	K	95.1	Very high	97	Very high	154 Å²	154	57.5 Å²	57.5	67%	0.67	32%	0.316	S	S	*	.	H	α-helix	trans	-76.2	-21.1	-177.2	-82	176.2	175.8	-174.9	0	113.7	K150 A151 K152	K150-K154 VanDerWaalsContact O-CG 3.3Å; K150-K154 WeakPolarHBondContact O-CG 3.39Å; K150-K154 PolarHBondContact O-N 3.47Å; A151-K154 PolarHBondContact O-N 2.87Å; K152-K154 VanDerWaalsContact C-N 3.27Å; K152-K154 PolarHBondContact O-N 2.78Å
155	G	93.4	Very high	97	Very high	61 Å²	61	56.7 Å²	56.7	63%	0.629	32%	0.316	S	S	*	.	H	α-helix	trans	156.7	18.2	179	0	0	0	0	0	116.2	A151 K152	A151-G155 PolarHBondContact O-N 3.15Å; K152-G155 PolarHBondContact O-N 2.76Å
156	Q	95.8	Very high	97	Very high	75 Å²	75	60.8 Å²	60.8	35%	0.35	33%	0.333	S	S	.	.			trans	-124.9	73.8	176	-61	-174.7	37	0	0	109.1	K152 D158 L159	K152-Q156 VanDerWaalsContact CA-O 3.29Å; K152-Q156 WeakPolarHBondContact CA-O 3.46Å; K152-Q156 VanDerWaalsContact CG-O 3.32Å; K152-Q156 WeakPolarHBondContact CG-O 3.42Å; K152-Q156 CarbonylContact O-C 3.49Å; K152-Q156 PolarHBondContact O-N 2.04Å; K152-Q156 VanDerWaalsContact O-N 3.08Å; Q156-D158 PolarHBondContact O-N 3.43Å; Q156-L159 HydrophobicContact CB-CB 3.76Å; Q156-L159 HydrophobicContact CB-CD2 4.29Å; Q156-L159 VanDerWaalsContact O-CB 3.25Å; Q156-L159 WeakPolarHBondContact O-CB 3.29Å; Q156-L159 PolarHBondContact O-N 2.04Å; Q156-L159 VanDerWaalsContact O-N 3.07Å
157	P	94.6	Very high	97.1	Very high	93 Å²	93	60.5 Å²	60.5	60%	0.604	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-26.9	-170	24.7	-34.4	0	0	0	114.2	K152	K152-P157 WeakPolarHBondContact CE-O 3.36Å
158	D	96.5	Very high	97.1	Very high	136 Å²	136	64.3 Å²	64.3	73%	0.727	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	6	-179.8	-50	-50.9	0	0	0	113.4	S137 Q156 D160	S137-D158 PolarHBondContact OG-O 2.69Å; Q156-D158 PolarHBondContact O-N 3.43Å; D158-D160 PolarHBondContact O-N 3.29Å
159	L	97.9	Very high	97	Very high	3 Å²	3	70.2 Å²	70.2	2%	0.016	37%	0.369	C	S	.	.			trans	-72.6	125.7	177.7	-178.5	67	0	0	0	110.2	D138 Y142 L148 A151 K152 Q156	D138-L159 HydrophobicContact CB-CD1 3.85Å; D138-L159 VanDerWaalsContact CG-CD1 3.45Å; Y142-L159 HydrophobicContact CE1-CD2 4.27Å; Y142-L159 HydrophobicContact CE2-CD1 4.24Å; Y142-L159 HydrophobicContact CE2-CD2 4.31Å; Y142-L159 WeakPolarHBondContact OH-CD2 3.26Å; L148-L159 HydrophobicContact CD1-CD1 4.48Å; L148-L159 HydrophobicContact CD1-CG 4.31Å; L148-L159 HydrophobicContact CD2-CD2 4.17Å; L148-L159 HydrophobicContact CD2-CG 3.91Å; L148-L159 HydrophobicContact CG-CD2 3.85Å; L148-L159 HydrophobicContact CG-CG 3.89Å; A151-L159 HydrophobicContact CB-CD2 3.8Å; K152-L159 HydrophobicContact CB-CB 4.29Å; K152-L159 WeakPolarHBondContact CD-O 3.25Å; K152-L159 VanDerWaalsContact CE-O 3.25Å; K152-L159 WeakPolarHBondContact CE-O 3.39Å; K152-L159 HydrophobicContact CG-CB 4.45Å; K152-L159 PolarHBondContact NZ-O 3.39Å; Q156-L159 HydrophobicContact CB-CB 3.76Å; Q156-L159 HydrophobicContact CB-CD2 4.29Å; Q156-L159 VanDerWaalsContact O-CB 3.25Å; Q156-L159 WeakPolarHBondContact O-CB 3.29Å; Q156-L159 PolarHBondContact O-N 2.04Å; Q156-L159 VanDerWaalsContact O-N 3.07Å
160	D	97.5	Very high	96.9	Very high	81 Å²	81	71.7 Å²	71.7	43%	0.433	38%	0.38	S	S	.	.			trans	-139.7	162.4	178.8	-76.9	-43.9	0	0	0	110.9	G136 S137 K152 D158 Q162	G136-D160 CarbonylContact C-O 3.56Å; G136-D160 WeakPolarHBondContact CA-O 3.24Å; S137-D160 PolarHBondContact N-O 3.1Å; S137-D160 PolarHBondContact OG-N 3.41Å; S137-D160 PolarHBondContact OG-O 3.02Å; K152-D160 IonicContact NZ-OD1 2.63Å; K152-D160 PolarHBondContact NZ-OD1 3.25Å; K152-D160 IonicContact NZ-OD2 3.71Å; D158-D160 PolarHBondContact O-N 3.29Å; D160-Q162 PolarHBondContact O-N 2.89Å
161	V	98	Very high	97	Very high	49 Å²	49	69 Å²	69	30%	0.297	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	123.5	170.5	176.1	0	0	0	0	108.3	V134 E145 L148	V134-V161 HydrophobicContact CB-CG1 4.03Å; V134-V161 HydrophobicContact CB-CG2 4.07Å; V134-V161 HydrophobicContact CG1-CG1 4.26Å; V134-V161 HydrophobicContact CG1-CG2 4.3Å; V134-V161 HydrophobicContact CG2-CG2 3.98Å; E145-V161 HydrophobicContact CB-CG2 4.5Å; E145-V161 HydrophobicContact CG-CG2 3.97Å; L148-V161 HydrophobicContact CD1-CG2 3.81Å; L148-V161 HydrophobicContact CD2-CG2 4.42Å
162	Q	97.9	Very high	96.9	Very high	18 Å²	18	75 Å²	75	8%	0.084	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	-31.9	172.7	56.3	166.1	-20	0	0	113.1	C135 G136 D160 P177 C192	C135-Q162 HydrophobicContact CB-CG 4.26Å; C135-Q162 VanDerWaalsContact O-CG 3.25Å; C135-Q162 WeakPolarHBondContact O-CG 3.26Å; C135-Q162 PolarHBondContact O-N 3.47Å; C135-Q162 PolarHBondContact SG-NE2 3.46Å; G136-Q162 WeakPolarHBondContact O-CG 3.06Å; G136-Q162 PolarHBondContact O-NE2 3.44Å; D160-Q162 PolarHBondContact O-N 2.89Å; Q162-P177 WeakPolarHBondContact O-CD 3.49Å; Q162-P177 WeakPolarHBondContact O-CG 3.41Å; Q162-C192 HydrophobicContact CB-CB 4.49Å; Q162-C192 WeakPolarHBondContact O-CB 3.31Å
163	Y	98.3	Very high	96.8	Very high	6 Å²	6	74.9 Å²	74.9	2%	0.024	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	160.2	170.4	55	-91.7	0	0	0	111.8	C135 C167 K168 V174 A190 C192	C135-Y163 HydrophobicContact CB-CD1 4.16Å; C135-Y163 HydrophobicContact CB-CD2 3.77Å; C135-Y163 HydrophobicContact CB-CE1 3.84Å; C135-Y163 HydrophobicContact CB-CE2 3.43Å; C135-Y163 VanDerWaalsContact CB-CE2 3.43Å; C135-Y163 HydrophobicContact CB-CG 4.13Å; C135-Y163 VanDerWaalsContact CB-CZ 3.48Å; C135-Y163 PolarHBondContact N-O 3.4Å; C135-Y163 PolarHBondContact SG-OH 3.35Å; C135-Y163 VanDerWaalsContact SG-OH 3.4Å; Y163-C167 VanDerWaalsContact OH-CA 3.3Å; Y163-C167 WeakPolarHBondContact OH-CA 3.25Å; Y163-K168 PolarHBondContact OH-N 2.9Å; Y163-V174 HydrophobicContact CD1-CG1 4.13Å; Y163-V174 HydrophobicContact CD2-CG1 4.31Å; Y163-V174 HydrophobicContact CE1-CG1 4.2Å; Y163-V174 HydrophobicContact CE2-CG1 4.38Å; Y163-V174 HydrophobicContact CG-CG1 4.18Å; Y163-A190 WeakPolarHBondContact CE1-O 3.02Å; Y163-A190 PolarHBondContact OH-O 3.48Å; Y163-A190 VanDerWaalsContact OH-O 3.09Å; Y163-C192 HydrophobicContact CD1-CB 4.25Å; Y163-C192 WeakPolarHBondContact CD1-SG 3.36Å
164	Q	98	Very high	96.8	Very high	118 Å²	118	74 Å²	74	55%	0.551	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	145.4	176.3	-67.9	175.4	-4.4	0	0	111.1	W130	W130-Q164 HydrophobicContact CD2-CB 4.18Å; W130-Q164 HydrophobicContact CD2-CG 4.06Å; W130-Q164 HydrophobicContact CG-CG 4.05Å; W130-Q164 HydrophobicContact CZ2-CB 4.16Å
165	G	97.7	Very high	96.9	Very high	18 Å²	18	74 Å²	74	19%	0.186	42%	0.417	C	S	.	.	S	Bend	trans	98.8	-179.9	-174.9	0	0	0	0	0	113.3	P133 V134 C135	P133-G165 CarbonylContact C-O 3.59Å; P133-G165 CarbonylContact O-C 3.01Å; P133-G165 VanDerWaalsContact O-CA 3.25Å; P133-G165 WeakPolarHBondContact O-CA 3.42Å; P133-G165 PolarHBondContact O-N 3.3Å; V134-G165 CarbonylContact C-O 3.52Å; V134-G165 WeakPolarHBondContact CA-O 3.43Å; V134-G165 PolarHBondContact N-O 3.3Å; C135-G165 PolarHBondContact N-O 3.42Å
166	K	98.3	Very high	97.1	Very high	147 Å²	147	72.6 Å²	72.6	64%	0.639	40%	0.397	S	S	*	.	S	Bend	trans	-71.2	152.6	173.9	-57.3	-175.1	-179	171.7	0	110.3	P133 T141	P133-K166 HydrophobicContact CB-CG 4.06Å; P133-K166 HydrophobicContact CG-CG 3.83Å; T141-K166 HydrophobicContact CG2-CB 3.95Å; T141-K166 HydrophobicContact CG2-CG 3.89Å
167	C	98.3	Very high	97.1	Very high	36 Å²	36	72.4 Å²	72.4	24%	0.243	40%	0.403	C	S	.	.			trans	-62.7	139.9	172.1	-60.3	0	0	0	0	111	C135 G139 K140 T141 Y163	C135-C167 WeakPolarHBondContact CA-SG 3.46Å; C135-C167 HydrophobicContact CB-CB 4.03Å; C135-C167 WeakPolarHBondContact CB-SG 3.47Å; C135-C167 WeakPolarHBondContact SG-CA 3.37Å; C135-C167 WeakPolarHBondContact SG-CB 3.35Å; C135-C167 CovalentContact SG-SG 2.04Å; C135-C167 PolarHBondContact SG-SG 3.43Å; G139-C167 VanDerWaalsContact C-SG 3.54Å; G139-C167 PolarHBondContact O-SG 2.91Å; K140-C167 PolarHBondContact O-SG 2.98Å; K140-C167 VanDerWaalsContact O-SG 3.35Å; T141-C167 PolarHBondContact OG1-N 2.96Å; Y163-C167 VanDerWaalsContact OH-CA 3.3Å; Y163-C167 WeakPolarHBondContact OH-CA 3.25Å
168	K	97.9	Very high	97.2	Very high	96 Å²	96	71.9 Å²	71.9	42%	0.417	41%	0.414	S	S	.	.			trans	-113.2	156.5	-176.7	-64.5	-174.4	-179.7	-94.2	0	112.3	Y163 G173 V174 A190	Y163-K168 PolarHBondContact OH-N 2.9Å; K168-G173 WeakPolarHBondContact CE-O 3.27Å; K168-V174 HydrophobicContact CB-CG2 3.94Å; K168-V174 HydrophobicContact CD-CG2 3.68Å; K168-V174 HydrophobicContact CG-CG2 4.21Å; K168-A190 HydrophobicContact CB-CB 4.49Å; K168-A190 WeakPolarHBondContact O-CB 3.25Å; K168-A190 PolarHBondContact O-N 2.89Å
169	K	95.9	Very high	97.1	Very high	126 Å²	126	70.9 Å²	70.9	55%	0.548	41%	0.413	S	S	.	.	S	Bend	trans	-91.1	2.1	176.4	-71.7	-63.8	-166.7	176.8	0	114.1	N188 N189	K169-N188 CarbonylContact C-O 3.51Å; K169-N188 VanDerWaalsContact CA-O 3.24Å; K169-N188 WeakPolarHBondContact CA-O 3.39Å; K169-N188 CarbonylContact O-C 3.57Å; K169-N188 VanDerWaalsContact O-CB 3.26Å; K169-N188 WeakPolarHBondContact O-CB 3.47Å; K169-N189 WeakPolarHBondContact CD-OD1 2.99Å; K169-N189 WeakPolarHBondContact CE-OD1 3.25Å; K169-N189 PolarHBondContact NZ-OD1 3.49Å
170	T	96.4	Very high	97	Very high	73 Å²	73	72.4 Å²	72.4	45%	0.448	42%	0.423	S	S	.	.	S	Bend	trans	-151	167.3	171.1	66.7	0	0	0	0	108	L172 V174 A190	T170-L172 PolarHBondContact O-N 2.8Å; T170-L172 WeakPolarHBondContact OG1-CB 3.45Å; T170-L172 PolarHBondContact OG1-N 3Å; T170-V174 WeakPolarHBondContact O-CG2 3.25Å; T170-A190 WeakPolarHBondContact O-CB 3.49Å
171	C	97.9	Very high	97	Very high	44 Å²	44	70 Å²	70	30%	0.297	41%	0.411	S	S	.	.	S	Bend	trans	-73.6	-1.4	171	-74.7	0	0	0	0	113.8	G173 V174 C182	C171-G173 PolarHBondContact O-N 2.97Å; C171-V174 PolarHBondContact O-N 3.38Å; C171-C182 WeakPolarHBondContact CA-SG 3.48Å; C171-C182 HydrophobicContact CB-CB 3.77Å; C171-C182 WeakPolarHBondContact CB-SG 3.4Å; C171-C182 WeakPolarHBondContact SG-CB 3.45Å; C171-C182 CovalentContact SG-SG 2.04Å; C171-C182 PolarHBondContact SG-SG 3.5Å
172	L	95.9	Very high	97.1	Very high	145 Å²	145	68.6 Å²	68.6	76%	0.759	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	120.1	179	-173.6	63.2	0	0	0	110.2	T170 V174	T170-L172 PolarHBondContact O-N 2.8Å; T170-L172 WeakPolarHBondContact OG1-CB 3.45Å; T170-L172 PolarHBondContact OG1-N 3Å; L172-V174 PolarHBondContact O-N 3.36Å
173	G	94.3	Very high	97.1	Very high	58 Å²	58	69 Å²	69	60%	0.598	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.4	17.1	-177.7	0	0	0	0	0	114.4	K168 C171	K168-G173 WeakPolarHBondContact CE-O 3.27Å; C171-G173 PolarHBondContact O-N 2.97Å
174	V	97.6	Very high	97.1	Very high	17 Å²	17	70.1 Å²	70.1	10%	0.103	41%	0.414	C	S	.	.			trans	-88	119.5	167.7	178.9	0	0	0	0	108.7	Y163 K168 T170 C171 L172 C182 A190	Y163-V174 HydrophobicContact CD1-CG1 4.13Å; Y163-V174 HydrophobicContact CD2-CG1 4.31Å; Y163-V174 HydrophobicContact CE1-CG1 4.2Å; Y163-V174 HydrophobicContact CE2-CG1 4.38Å; Y163-V174 HydrophobicContact CG-CG1 4.18Å; K168-V174 HydrophobicContact CB-CG2 3.94Å; K168-V174 HydrophobicContact CD-CG2 3.68Å; K168-V174 HydrophobicContact CG-CG2 4.21Å; T170-V174 WeakPolarHBondContact O-CG2 3.25Å; C171-V174 PolarHBondContact O-N 3.38Å; L172-V174 PolarHBondContact O-N 3.36Å; V174-C182 HydrophobicContact CG1-CB 4.4Å; V174-A190 HydrophobicContact CG2-CB 3.9Å
175	L	96.8	Very high	97	Very high	155 Å²	155	66 Å²	66	81%	0.812	40%	0.395	S	S	*	.			trans	-102.7	104.3	173.7	-63.1	179.6	0	0	0	109.5
176	C	97.7	Very high	96.7	Very high	30 Å²	30	73.3 Å²	73.3	20%	0.203	43%	0.425	C	S	.	.			trans	-79	134.5	-179.9	-71.7	0	0	0	0	111.8	T180 C182 C192	C176-T180 WeakPolarHBondContact CB-O 3.13Å; C176-T180 WeakPolarHBondContact CB-OG1 3.37Å; C176-C182 VanDerWaalsContact SG-CA 3.59Å; C176-C182 PolarHBondContact SG-N 3.19Å; C176-C182 VanDerWaalsContact SG-N 3.43Å; C176-C192 WeakPolarHBondContact CA-SG 3.05Å; C176-C192 HydrophobicContact CB-CB 3.71Å; C176-C192 WeakPolarHBondContact CB-SG 3.05Å; C176-C192 VanDerWaalsContact SG-CA 3.52Å; C176-C192 WeakPolarHBondContact SG-CB 3.47Å; C176-C192 CovalentContact SG-SG 2.04Å; C176-C192 PolarHBondContact SG-SG 3.41Å
177	P	96.4	Very high	96.4	Very high	72 Å²	72	69.8 Å²	69.8	47%	0.468	42%	0.416	S	S	.	.			trans	-72.7	144.3	-177.3	28.9	-34.4	0	0	0	112.4	Q162 T179 T180	Q162-P177 WeakPolarHBondContact O-CD 3.49Å; Q162-P177 WeakPolarHBondContact O-CG 3.41Å; P177-T179 PolarHBondContact O-N 3.38Å; P177-T180 PolarHBondContact O-N 3.01Å; P177-T180 PolarHBondContact O-OG1 3.18Å
178	G	95.3	Very high	96.2	Very high	82 Å²	82	72.7 Å²	72.7	85%	0.845	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.9	-122.7	173.7	0	0	0	0	0	113
179	T	94.4	Very high	96.2	Very high	114 Å²	114	69.9 Å²	69.9	70%	0.699	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	11	-177.8	56.7	0	0	0	0	113.3	P177	P177-T179 PolarHBondContact O-N 3.38Å
180	T	97.3	Very high	96.3	Very high	36 Å²	36	64 Å²	64	22%	0.221	39%	0.393	C	S	.	.			trans	-75.2	151.3	178.6	60.2	0	0	0	0	111	C176 P177 V193	C176-T180 WeakPolarHBondContact CB-O 3.13Å; C176-T180 WeakPolarHBondContact CB-OG1 3.37Å; P177-T180 PolarHBondContact O-N 3.01Å; P177-T180 PolarHBondContact O-OG1 3.18Å; T180-V193 CarbonylContact C-O 3.45Å; T180-V193 WeakPolarHBondContact CA-O 3.4Å; T180-V193 WeakPolarHBondContact CB-O 3.4Å
181	T	97.6	Very high	96.4	Very high	31 Å²	31	63 Å²	63	19%	0.19	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	142.5	-178.7	-59.3	0	0	0	0	109.2	V193	T181-V193 PolarHBondContact N-O 2.91Å; T181-V193 PolarHBondContact O-N 2.82Å
182	C	98.4	Very high	96.4	Very high	19 Å²	19	61.6 Å²	61.6	13%	0.128	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	131.9	174.4	-171.9	0	0	0	0	111.4	C171 V174 C176 Y191 G231	C171-C182 WeakPolarHBondContact CA-SG 3.48Å; C171-C182 HydrophobicContact CB-CB 3.77Å; C171-C182 WeakPolarHBondContact CB-SG 3.4Å; C171-C182 WeakPolarHBondContact SG-CB 3.45Å; C171-C182 CovalentContact SG-SG 2.04Å; C171-C182 PolarHBondContact SG-SG 3.5Å; V174-C182 HydrophobicContact CG1-CB 4.4Å; C176-C182 VanDerWaalsContact SG-CA 3.59Å; C176-C182 PolarHBondContact SG-N 3.19Å; C176-C182 VanDerWaalsContact SG-N 3.43Å; C182-Y191 CarbonylContact C-O 3.53Å; C182-Y191 VanDerWaalsContact CA-O 3.28Å; C182-Y191 WeakPolarHBondContact CA-O 3Å; C182-G231 VanDerWaalsContact O-CA 3.28Å; C182-G231 WeakPolarHBondContact O-CA 3.45Å
183	V	98.4	Very high	96.5	Very high	26 Å²	26	57.1 Å²	57.1	16%	0.158	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	154.6	172.4	-58.5	0	0	0	0	110.3	A190 Y191 V193 G231	V183-A190 CarbonylContact O-C 3.57Å; V183-A190 WeakPolarHBondContact O-CA 3.19Å; V183-Y191 PolarHBondContact N-O 3.18Å; V183-Y191 PolarHBondContact O-N 3Å; V183-V193 HydrophobicContact CB-CG2 4.31Å; V183-V193 HydrophobicContact CG1-CG2 3.65Å; V183-V193 HydrophobicContact CG2-CB 4.46Å; V183-V193 HydrophobicContact CG2-CG1 3.96Å; V183-V193 HydrophobicContact CG2-CG2 3.62Å; V183-G231 CarbonylContact C-O 3.54Å; V183-G231 WeakPolarHBondContact CA-O 3.44Å
184	V	98.1	Very high	96.7	Very high	29 Å²	29	59.5 Å²	59.5	18%	0.176	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	147.2	171.7	-61.3	0	0	0	0	112.8	N189 A190 G231 R232	V184-N189 VanDerWaalsContact CA-O 3.27Å; V184-N189 WeakPolarHBondContact CA-O 3.42Å; V184-A190 HydrophobicContact CG1-CB 4.38Å; V184-G231 PolarHBondContact N-O 3.32Å; V184-R232 HydrophobicContact CG2-CB 4.01Å
185	D	96.2	Very high	96.6	Very high	31 Å²	31	59.1 Å²	59.1	17%	0.166	35%	0.352	C	S	.	.			trans	-84.3	-178.8	170.5	72.1	21.4	0	0	0	112.7	T187 N188 N189 Y191	D185-T187 PolarHBondContact O-N 3.23Å; D185-T187 VanDerWaalsContact OD1-CA 3.26Å; D185-T187 WeakPolarHBondContact OD1-CA 3.37Å; D185-T187 PolarHBondContact OD1-N 3.2Å; D185-T187 PolarHBondContact OD1-OG1 3.1Å; D185-T187 PolarHBondContact OD2-OG1 3.28Å; D185-N188 WeakPolarHBondContact O-CA 3.39Å; D185-N188 PolarHBondContact O-N 2.69Å; D185-N188 PolarHBondContact OD1-N 3.48Å; D185-N189 PolarHBondContact N-O 3.44Å; D185-N189 PolarHBondContact OD1-N 2.63Å; D185-N189 WeakPolarHBondContact OD2-CB 3.5Å; D185-N189 PolarHBondContact OD2-ND2 3.44Å; D185-Y191 HydrophobicContact CB-CE2 3.76Å; D185-Y191 VanDerWaalsContact OD2-CE2 3.25Å; D185-Y191 WeakPolarHBondContact OD2-CE2 3.45Å; D185-Y191 PolarHBondContact OD2-OH 3.44Å
186	Q	92.1	Very high	96.6	Very high	173 Å²	173	56.4 Å²	56.4	81%	0.808	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-15.4	178.9	70.4	-77.7	-2.7	0	0	114.6
187	T	92.1	Very high	96.5	Very high	73 Å²	73	62.1 Å²	62.1	45%	0.448	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	16.7	174.4	62.2	0	0	0	0	112.1	D185 N189	D185-T187 PolarHBondContact O-N 3.23Å; D185-T187 VanDerWaalsContact OD1-CA 3.26Å; D185-T187 WeakPolarHBondContact OD1-CA 3.37Å; D185-T187 PolarHBondContact OD1-N 3.2Å; D185-T187 PolarHBondContact OD1-OG1 3.1Å; D185-T187 PolarHBondContact OD2-OG1 3.28Å; T187-N189 PolarHBondContact O-N 2.04Å; T187-N189 PolarHBondContact OG1-ND2 3.06Å
188	N	94.5	Very high	96.4	Very high	96 Å²	96	65.4 Å²	65.4	51%	0.513	37%	0.368	S	S	.	.			trans	61.7	13.2	-177.4	-67	-37.8	0	0	0	115.6	K169 D185 A190	K169-N188 CarbonylContact C-O 3.51Å; K169-N188 VanDerWaalsContact CA-O 3.24Å; K169-N188 WeakPolarHBondContact CA-O 3.39Å; K169-N188 CarbonylContact O-C 3.57Å; K169-N188 VanDerWaalsContact O-CB 3.26Å; K169-N188 WeakPolarHBondContact O-CB 3.47Å; D185-N188 WeakPolarHBondContact O-CA 3.39Å; D185-N188 PolarHBondContact O-N 2.69Å; D185-N188 PolarHBondContact OD1-N 3.48Å; N188-A190 PolarHBondContact O-N 3.25Å
189	N	96.9	Very high	96.5	Very high	38 Å²	38	62.4 Å²	62.4	20%	0.203	33%	0.333	C	S	.	.			trans	-67.6	135.2	175	-51.6	-52.9	0	0	0	110.1	K169 V184 D185 T187 Y191	K169-N189 WeakPolarHBondContact CD-OD1 2.99Å; K169-N189 WeakPolarHBondContact CE-OD1 3.25Å; K169-N189 PolarHBondContact NZ-OD1 3.49Å; V184-N189 VanDerWaalsContact CA-O 3.27Å; V184-N189 WeakPolarHBondContact CA-O 3.42Å; D185-N189 PolarHBondContact N-O 3.44Å; D185-N189 PolarHBondContact OD1-N 2.63Å; D185-N189 WeakPolarHBondContact OD2-CB 3.5Å; D185-N189 PolarHBondContact OD2-ND2 3.44Å; T187-N189 PolarHBondContact O-N 2.04Å; T187-N189 PolarHBondContact OG1-ND2 3.06Å; N189-Y191 HydrophobicContact CB-CE2 3.74Å; N189-Y191 WeakPolarHBondContact O-CD2 3.49Å; N189-Y191 WeakPolarHBondContact O-CE2 3.49Å
190	A	98.3	Very high	96.5	Very high	2 Å²	2	61.7 Å²	61.7	2%	0.017	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	136.6	-178.7	0	0	0	0	0	112.3	Y163 K168 T170 V174 V183 V184 N188	Y163-A190 WeakPolarHBondContact CE1-O 3.02Å; Y163-A190 PolarHBondContact OH-O 3.48Å; Y163-A190 VanDerWaalsContact OH-O 3.09Å; K168-A190 HydrophobicContact CB-CB 4.49Å; K168-A190 WeakPolarHBondContact O-CB 3.25Å; K168-A190 PolarHBondContact O-N 2.89Å; T170-A190 WeakPolarHBondContact O-CB 3.49Å; V174-A190 HydrophobicContact CG2-CB 3.9Å; V183-A190 CarbonylContact O-C 3.57Å; V183-A190 WeakPolarHBondContact O-CA 3.19Å; V184-A190 HydrophobicContact CG1-CB 4.38Å; N188-A190 PolarHBondContact O-N 3.25Å
191	Y	98.4	Very high	96.1	Very high	52 Å²	52	67.7 Å²	67.7	20%	0.204	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	145.8	-180	-56.6	-93.3	0	0	0	112.1	C182 V183 D185 N189	C182-Y191 CarbonylContact C-O 3.53Å; C182-Y191 VanDerWaalsContact CA-O 3.28Å; C182-Y191 WeakPolarHBondContact CA-O 3Å; V183-Y191 PolarHBondContact N-O 3.18Å; V183-Y191 PolarHBondContact O-N 3Å; D185-Y191 HydrophobicContact CB-CE2 3.76Å; D185-Y191 VanDerWaalsContact OD2-CE2 3.25Å; D185-Y191 WeakPolarHBondContact OD2-CE2 3.45Å; D185-Y191 PolarHBondContact OD2-OH 3.44Å; N189-Y191 HydrophobicContact CB-CE2 3.74Å; N189-Y191 WeakPolarHBondContact O-CD2 3.49Å; N189-Y191 WeakPolarHBondContact O-CE2 3.49Å
192	C	98.4	Very high	95.6	Very high	15 Å²	15	68.4 Å²	68.4	10%	0.101	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	114	171.4	-67.6	0	0	0	0	110	Q162 Y163 C176	Q162-C192 HydrophobicContact CB-CB 4.49Å; Q162-C192 WeakPolarHBondContact O-CB 3.31Å; Y163-C192 HydrophobicContact CD1-CB 4.25Å; Y163-C192 WeakPolarHBondContact CD1-SG 3.36Å; C176-C192 WeakPolarHBondContact CA-SG 3.05Å; C176-C192 HydrophobicContact CB-CB 3.71Å; C176-C192 WeakPolarHBondContact CB-SG 3.05Å; C176-C192 VanDerWaalsContact SG-CA 3.52Å; C176-C192 WeakPolarHBondContact SG-CB 3.47Å; C176-C192 CovalentContact SG-SG 2.04Å; C176-C192 PolarHBondContact SG-SG 3.41Å
193	V	97.6	Very high	94.7	Very high	51 Å²	51	73 Å²	73	31%	0.309	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	155.4	-172.6	-58.8	0	0	0	0	111.8	T180 T181 V183	T180-V193 CarbonylContact C-O 3.45Å; T180-V193 WeakPolarHBondContact CA-O 3.4Å; T180-V193 WeakPolarHBondContact CB-O 3.4Å; T181-V193 PolarHBondContact N-O 2.91Å; T181-V193 PolarHBondContact O-N 2.82Å; V183-V193 HydrophobicContact CB-CG2 4.31Å; V183-V193 HydrophobicContact CG1-CG2 3.65Å; V183-V193 HydrophobicContact CG2-CB 4.46Å; V183-V193 HydrophobicContact CG2-CG1 3.96Å; V183-V193 HydrophobicContact CG2-CG2 3.62Å
194	T	97.1	Very high	93.9	Very high	107 Å²	107	73.7 Å²	73.7	66%	0.656	41%	0.411	S	S	*	.			trans	-88.6	111.6	172.5	-56	0	0	0	0	110.1
195	C	97.3	Very high	93	Very high	9 Å²	9	76.4 Å²	76.4	6%	0.061	43%	0.431	C	S	.	.			trans	-71.6	130.4	175.2	-59.3	0	0	0	0	111.3	R197 C228 L229	C195-R197 PolarHBondContact O-N 3.11Å; C195-C228 WeakPolarHBondContact CA-SG 3.26Å; C195-C228 HydrophobicContact CB-CB 3.77Å; C195-C228 WeakPolarHBondContact CB-SG 3.24Å; C195-C228 WeakPolarHBondContact SG-CB 3.44Å; C195-C228 CovalentContact SG-SG 2.03Å; C195-C228 PolarHBondContact SG-SG 3.32Å; C195-L229 HydrophobicContact CB-CD2 4.25Å
196	N	96.3	Very high	92.3	Very high	99 Å²	99	83 Å²	83	53%	0.529	46%	0.461	S	S	.	.			trans	-68.3	115.2	168.2	-175.7	13	0	0	0	110	I198	N196-I198 PolarHBondContact ND2-O 3.35Å; N196-I198 PolarHBondContact OD1-N 3.06Å; N196-I198 VanDerWaalsContact OD1-N 3.1Å; N196-I198 PolarHBondContact OD1-O 3.05Å; N196-I198 VanDerWaalsContact OD1-O 3.05Å
197	R	94.8	Very high	92.2	Very high	150 Å²	150	79.8 Å²	79.8	57%	0.566	45%	0.446	S	S	*	.			trans	-95.1	-14.1	-178.8	-63.2	-172.9	-179.4	-157.4	0.1	113.4	C195 K225	C195-R197 PolarHBondContact O-N 3.11Å; R197-K225 WeakPolarHBondContact O-CE 3.48Å; R197-K225 PolarHBondContact O-NZ 2.65Å
198	I	95.9	Very high	92.4	Very high	141 Å²	141	79.2 Å²	79.2	72%	0.723	44%	0.436	S	S	*	.			trans	-106.1	119.2	-176.7	-56.1	175.4	0	0	0	108	N196	N196-I198 PolarHBondContact ND2-O 3.35Å; N196-I198 PolarHBondContact OD1-N 3.06Å; N196-I198 VanDerWaalsContact OD1-N 3.1Å; N196-I198 PolarHBondContact OD1-O 3.05Å; N196-I198 VanDerWaalsContact OD1-O 3.05Å
199	C	95.9	Very high	92.5	Very high	18 Å²	18	75.5 Å²	75.5	12%	0.122	42%	0.416	C	S	.	.			trans	-117.9	138.6	175	-71	0	0	0	0	109.1	C221 H222	C199-C221 WeakPolarHBondContact CA-SG 3.47Å; C199-C221 HydrophobicContact CB-CB 3.81Å; C199-C221 WeakPolarHBondContact CB-SG 3Å; C199-C221 WeakPolarHBondContact SG-CB 3.43Å; C199-C221 PolarHBondContact SG-O 2.87Å; C199-C221 CovalentContact SG-SG 2.05Å; C199-C221 PolarHBondContact SG-SG 2.04Å; C199-H222 WeakPolarHBondContact CB-CE1 3.19Å; C199-H222 WeakPolarHBondContact CB-NE2 3Å
200	P	94.3	Very high	92.6	Very high	99 Å²	99	73.9 Å²	73.9	64%	0.643	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-60.9	145	172.7	-21.5	32.6	0	0	0	111.4
201	D	90	Very high	92.6	Very high	162 Å²	162	73.9 Å²	73.9	87%	0.866	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-63.9	140.8	171.1	-67.7	-34.9	0	0	0	110.3
202	V	86.7	Confident	92.5	Very high	47 Å²	47	72.6 Å²	72.6	29%	0.285	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-97.2	122.8	179.7	-76.8	0	0	0	0	111	H207 A218	V202-H207 HydrophobicContact CG1-CB 4.27Å; V202-A218 HydrophobicContact CG2-CB 3.82Å
203	A	78.9	Confident	92.4	Very high	115 Å²	115	74 Å²	74	95%	0.95	41%	0.411	S	S	*	.			trans	-84.2	-19.2	176.5	0	0	0	0	0	113.5
204	S	81.2	Confident	92.4	Very high	41 Å²	41	73.1 Å²	73.1	29%	0.287	41%	0.411	S	S	.	.			trans	-123.2	141.6	-173.1	175.4	0	0	0	0	112.5	Q206	S204-Q206 PolarHBondContact O-N 2.05Å; S204-Q206 PolarHBondContact OG-N 3.09Å
205	S	79.2	Confident	92.4	Very high	85 Å²	85	72.2 Å²	72.2	59%	0.594	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-73.5	-4.2	174.7	62.5	0	0	0	0	114.5	H207 Y208	S205-H207 VanDerWaalsContact C-N 3.27Å; S205-H207 PolarHBondContact O-N 3.45Å; S205-Y208 WeakPolarHBondContact O-CD2 3.04Å
206	Q	82.4	Confident	92.4	Very high	169 Å²	169	74.3 Å²	74.3	79%	0.79	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-78.1	-12.3	179.5	-65.2	176.6	-4.5	0	0	113.1	S204	S204-Q206 PolarHBondContact O-N 2.05Å; S204-Q206 PolarHBondContact OG-N 3.09Å
207	H	90.5	Very high	92.5	Very high	106 Å²	106	70.6 Å²	70.6	49%	0.491	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-92.2	-5.6	-179	-58.3	-56.8	0	0	0	114.3	V202 S205 A218 S219	V202-H207 HydrophobicContact CG1-CB 4.27Å; S205-H207 VanDerWaalsContact C-N 3.27Å; S205-H207 PolarHBondContact O-N 3.45Å; H207-A218 CarbonylContact C-O 3.52Å; H207-S219 WeakPolarHBondContact O-CA 3.01Å
208	Y	96.2	Very high	92.6	Very high	62 Å²	62	64.6 Å²	64.6	24%	0.243	38%	0.376	C	S	.	.			trans	-62.7	146.9	179.9	-78.7	-89	0	0	0	110.9	S205 T216 Y217 A218 G240 K241	S205-Y208 WeakPolarHBondContact O-CD2 3.04Å; Y208-T216 HydrophobicContact CD1-CG2 3.42Å; Y208-T216 VanDerWaalsContact CD1-CG2 3.42Å; Y208-T216 HydrophobicContact CE1-CG2 4.02Å; Y208-T216 HydrophobicContact CG-CG2 4.34Å; Y208-Y217 CarbonylContact C-O 3.01Å; Y208-Y217 VanDerWaalsContact CA-O 3.26Å; Y208-Y217 WeakPolarHBondContact CA-O 3.45Å; Y208-Y217 WeakPolarHBondContact CD1-O 3.42Å; Y208-A218 HydrophobicContact CE1-CB 4.21Å; Y208-G240 CarbonylContact C-O 3.57Å; Y208-G240 VanDerWaalsContact O-CA 3.31Å; Y208-G240 WeakPolarHBondContact O-CA 3.13Å; Y208-G240 PolarHBondContact O-N 3.27Å; Y208-K241 HydrophobicContact CD1-CG 4.15Å; Y208-K241 HydrophobicContact CD2-CG 4.49Å; Y208-K241 HydrophobicContact CG-CG 3.98Å
209	L	97.1	Very high	92.6	Very high	18 Å²	18	58.7 Å²	58.7	9%	0.094	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	140.6	175.5	-60.5	173.9	0	0	0	109.4	Y217 A220 L223 V236 D239 G240	L209-Y217 PolarHBondContact N-O 3.38Å; L209-Y217 PolarHBondContact O-N 3.42Å; L209-A220 HydrophobicContact CD1-CB 3.99Å; L209-L223 HydrophobicContact CD1-CB 4.5Å; L209-V236 HydrophobicContact CD1-CG2 4.24Å; L209-V236 HydrophobicContact CD2-CG1 4.35Å; L209-D239 WeakPolarHBondContact CD2-OD1 3.5Å; L209-G240 CarbonylContact C-O 3.59Å; L209-G240 VanDerWaalsContact CA-O 3.24Å; L209-G240 WeakPolarHBondContact CA-O 3.49Å; L209-G240 PolarHBondContact N-O 2.81Å
210	C	97.8	Very high	92.6	Very high	4 Å²	4	59.8 Å²	59.8	3%	0.027	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	122.8	165.8	-173.7	0	0	0	0	108.9	A237 Y238 G240 C242	C210-A237 HydrophobicContact CB-CB 4.39Å; C210-A237 WeakPolarHBondContact O-CB 3.48Å; C210-A237 PolarHBondContact O-N 3.01Å; C210-Y238 HydrophobicContact CB-CD1 4.4Å; C210-Y238 HydrophobicContact CB-CD2 3.72Å; C210-Y238 HydrophobicContact CB-CE1 4.16Å; C210-Y238 HydrophobicContact CB-CE2 3.44Å; C210-Y238 VanDerWaalsContact CB-CE2 3.44Å; C210-Y238 HydrophobicContact CB-CG 4.19Å; C210-Y238 PolarHBondContact N-O 3.33Å; C210-Y238 PolarHBondContact O-N 3.41Å; C210-Y238 VanDerWaalsContact SG-CZ 3.53Å; C210-G240 PolarHBondContact N-O 2.95Å; C210-C242 WeakPolarHBondContact CA-SG 3.28Å; C210-C242 HydrophobicContact CB-CB 3.99Å; C210-C242 WeakPolarHBondContact CB-SG 2.98Å; C210-C242 WeakPolarHBondContact SG-CA 3.01Å; C210-C242 WeakPolarHBondContact SG-CB 3.2Å; C210-C242 CovalentContact SG-SG 2.04Å; C210-C242 PolarHBondContact SG-SG 3.21Å
211	G	98	Very high	92.8	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.01	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	158.7	172.1	0	0	0	0	0	111.8	D213 G214 I215	G211-D213 WeakPolarHBondContact CA-OD1 2.96Å; G211-D213 PolarHBondContact O-N 3.17Å; G211-G214 PolarHBondContact O-N 3.44Å; G211-I215 PolarHBondContact N-O 2.94Å
212	N	96.6	Very high	93.2	Very high	26 Å²	26	51.2 Å²	51.2	14%	0.139	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-19.6	174.3	-64.4	-52.1	0	0	0	113.1	G214 I234 G235 A237 R267 R269	N212-G214 PolarHBondContact O-N 3.27Å; N212-I234 WeakPolarHBondContact CB-O 3.38Å; N212-I234 PolarHBondContact ND2-O 3.48Å; N212-G235 PolarHBondContact N-O 3.26Å; N212-G235 VanDerWaalsContact N-O 3.14Å; N212-G235 VanDerWaalsContact ND2-C 3.26Å; N212-G235 WeakPolarHBondContact ND2-CA 3.45Å; N212-G235 PolarHBondContact ND2-O 3.35Å; N212-A237 VanDerWaalsContact OD1-CA 3.29Å; N212-A237 WeakPolarHBondContact OD1-CA 3.45Å; N212-A237 WeakPolarHBondContact OD1-CB 3.29Å; N212-A237 PolarHBondContact OD1-N 3.08Å; N212-R267 PolarHBondContact O-NH1 3.43Å; N212-R269 PolarHBondContact ND2-NE 3.22Å; N212-R269 PolarHBondContact ND2-NH2 3.29Å; N212-R269 VanDerWaalsContact ND2-NH2 3.17Å; N212-R269 PolarHBondContact OD1-NE 3.47Å; N212-R269 PolarHBondContact OD1-NH2 3.07Å
213	D	96.7	Very high	93.7	Very high	45 Å²	45	49.7 Å²	49.7	24%	0.241	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-7.1	169.3	60.3	-1.7	0	0	0	113.6	G211 I215 Y217 I234 R267	G211-D213 WeakPolarHBondContact CA-OD1 2.96Å; G211-D213 PolarHBondContact O-N 3.17Å; D213-I215 VanDerWaalsContact C-N 3.32Å; D213-I215 HydrophobicContact CB-CD1 4.48Å; D213-I215 PolarHBondContact OD1-N 3.26Å; D213-I215 WeakPolarHBondContact OD2-CD1 3.3Å; D213-Y217 PolarHBondContact OD2-OH 2.88Å; D213-I234 HydrophobicContact CB-CG2 3.98Å; D213-I234 VanDerWaalsContact CG-CG2 3.49Å; D213-I234 WeakPolarHBondContact OD2-CG2 3.32Å; D213-R267 PolarHBondContact O-NH1 3.05Å; D213-R267 PolarHBondContact O-NH2 2.76Å
214	G	96.6	Very high	94.6	Very high	31 Å²	31	52.7 Å²	52.7	32%	0.32	28%	0.283	S	S	.	.	S	Bend	trans	81.3	12.2	-179.4	0	0	0	0	0	113.3	G211 N212 C242	G211-G214 PolarHBondContact O-N 3.44Å; N212-G214 PolarHBondContact O-N 3.27Å; G214-C242 PolarHBondContact O-SG 3.2Å
215	I	97.9	Very high	95.4	Very high	89 Å²	89	54.1 Å²	54.1	46%	0.456	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-96	136.5	179.3	-62.5	169.9	0	0	0	109.6	G211 D213 Y217 C242	G211-I215 PolarHBondContact N-O 2.94Å; D213-I215 VanDerWaalsContact C-N 3.32Å; D213-I215 HydrophobicContact CB-CD1 4.48Å; D213-I215 PolarHBondContact OD1-N 3.26Å; D213-I215 WeakPolarHBondContact OD2-CD1 3.3Å; I215-Y217 HydrophobicContact CB-CD2 4.48Å; I215-Y217 HydrophobicContact CB-CE2 3.75Å; I215-Y217 HydrophobicContact CG2-CD2 4.38Å; I215-Y217 HydrophobicContact CG2-CE1 4.24Å; I215-Y217 HydrophobicContact CG2-CE2 3.92Å; I215-Y217 WeakPolarHBondContact O-CD2 3.26Å; I215-Y217 WeakPolarHBondContact O-CE2 3.43Å; I215-C242 PolarHBondContact O-SG 2.04Å; I215-C242 VanDerWaalsContact O-SG 3.33Å
216	T	97.8	Very high	96.3	Very high	53 Å²	53	51.3 Å²	51.3	33%	0.325	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	118.6	172.7	-65.3	0	0	0	0	109.8	Y208 K241 C242	Y208-T216 HydrophobicContact CD1-CG2 3.42Å; Y208-T216 VanDerWaalsContact CD1-CG2 3.42Å; Y208-T216 HydrophobicContact CE1-CG2 4.02Å; Y208-T216 HydrophobicContact CG-CG2 4.34Å; T216-K241 HydrophobicContact CG2-CB 3.97Å; T216-K241 HydrophobicContact CG2-CG 3.85Å; T216-C242 WeakPolarHBondContact OG1-CB 2.95Å; T216-C242 PolarHBondContact OG1-N 2.87Å
217	Y	97.8	Very high	97.1	Very high	21 Å²	21	44.7 Å²	44.7	8%	0.082	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	133.5	177.5	-67.5	-83.2	0	0	0	110.5	Y208 L209 D213 I215 S219 H222 L223 A226 I234	Y208-Y217 CarbonylContact C-O 3.01Å; Y208-Y217 VanDerWaalsContact CA-O 3.26Å; Y208-Y217 WeakPolarHBondContact CA-O 3.45Å; Y208-Y217 WeakPolarHBondContact CD1-O 3.42Å; L209-Y217 PolarHBondContact N-O 3.38Å; L209-Y217 PolarHBondContact O-N 3.42Å; D213-Y217 PolarHBondContact OD2-OH 2.88Å; I215-Y217 HydrophobicContact CB-CD2 4.48Å; I215-Y217 HydrophobicContact CB-CE2 3.75Å; I215-Y217 HydrophobicContact CG2-CD2 4.38Å; I215-Y217 HydrophobicContact CG2-CE1 4.24Å; I215-Y217 HydrophobicContact CG2-CE2 3.92Å; I215-Y217 WeakPolarHBondContact O-CD2 3.26Å; I215-Y217 WeakPolarHBondContact O-CE2 3.43Å; Y217-S219 PolarHBondContact O-N 3.48Å; Y217-H222 HydrophobicContact CD1-CB 4.31Å; Y217-L223 HydrophobicContact CD1-CB 4.14Å; Y217-L223 HydrophobicContact CD2-CB 4.22Å; Y217-L223 HydrophobicContact CD2-CD1 3.41Å; Y217-L223 VanDerWaalsContact CD2-CD1 3.41Å; Y217-L223 HydrophobicContact CD2-CG 4.35Å; Y217-L223 HydrophobicContact CE2-CD1 3.68Å; Y217-L223 HydrophobicContact CG-CB 3.83Å; Y217-L223 HydrophobicContact CG-CD1 3.95Å; Y217-L223 HydrophobicContact CG-CG 4.46Å; Y217-A226 HydrophobicContact CD1-CB 4.43Å; Y217-A226 HydrophobicContact CE1-CB 3.44Å; Y217-A226 VanDerWaalsContact CE1-CB 3.44Å; Y217-I234 WeakPolarHBondContact OH-CD1 3.04Å
218	A	96.8	Very high	97.5	Very high	24 Å²	24	40.7 Å²	40.7	20%	0.198	22%	0.221	C	C	.	.	S	Bend	trans	-63.3	-29.2	-178.5	0	0	0	0	0	113.4	V202 H207 Y208	V202-A218 HydrophobicContact CG2-CB 3.82Å; H207-A218 CarbonylContact C-O 3.52Å; Y208-A218 HydrophobicContact CE1-CB 4.21Å
219	S	96.4	Very high	97.5	Very high	16 Å²	16	41.8 Å²	41.8	11%	0.112	23%	0.23	C	C	.	.	S	Bend	trans	-159.6	172.8	174.1	71	0	0	0	0	112.1	H207 Y217 C221 H222 L223	H207-S219 WeakPolarHBondContact O-CA 3.01Å; Y217-S219 PolarHBondContact O-N 3.48Å; S219-C221 PolarHBondContact O-N 3.38Å; S219-C221 PolarHBondContact OG-N 2.03Å; S219-H222 PolarHBondContact O-N 2.9Å; S219-H222 PolarHBondContact OG-ND1 2.95Å; S219-L223 PolarHBondContact O-N 3.24Å; S219-L223 VanDerWaalsContact O-N 3.08Å
220	A	96.8	Very high	97.6	Very high	41 Å²	41	44.6 Å²	44.6	34%	0.339	25%	0.245	S	C	.	.	H	α-helix	trans	-55.5	-32.8	170.1	0	0	0	0	0	113.2	L209 R224	L209-A220 HydrophobicContact CD1-CB 3.99Å; A220-R224 WeakPolarHBondContact O-CB 3Å; A220-R224 VanDerWaalsContact O-CG 3.25Å; A220-R224 WeakPolarHBondContact O-CG 3.36Å; A220-R224 PolarHBondContact O-N 3.02Å
221	C	97.4	Very high	97.6	Very high	29 Å²	29	44.9 Å²	44.9	20%	0.196	25%	0.249	C	C	.	.	H	α-helix	trans	-62.9	-46.3	174.6	-177.8	0	0	0	0	111	C199 S219 L223 R224 K225	C199-C221 WeakPolarHBondContact CA-SG 3.47Å; C199-C221 HydrophobicContact CB-CB 3.81Å; C199-C221 WeakPolarHBondContact CB-SG 3Å; C199-C221 WeakPolarHBondContact SG-CB 3.43Å; C199-C221 PolarHBondContact SG-O 2.87Å; C199-C221 CovalentContact SG-SG 2.05Å; C199-C221 PolarHBondContact SG-SG 2.04Å; S219-C221 PolarHBondContact O-N 3.38Å; S219-C221 PolarHBondContact OG-N 2.03Å; C221-L223 PolarHBondContact O-N 2.83Å; C221-R224 PolarHBondContact O-N 2.93Å; C221-K225 WeakPolarHBondContact O-CB 3.48Å; C221-K225 PolarHBondContact O-N 3.12Å
222	H	97.8	Very high	97.6	Very high	53 Å²	53	51.9 Å²	51.9	25%	0.245	28%	0.275	C	S	.	.	H	α-helix	trans	-64.9	-41	-179.2	-67	89.4	0	0	0	111.9	C199 Y217 S219 K225 A226	C199-H222 WeakPolarHBondContact CB-CE1 3.19Å; C199-H222 WeakPolarHBondContact CB-NE2 3Å; Y217-H222 HydrophobicContact CD1-CB 4.31Å; S219-H222 PolarHBondContact O-N 2.9Å; S219-H222 PolarHBondContact OG-ND1 2.95Å; H222-K225 PolarHBondContact O-N 3.13Å; H222-A226 PolarHBondContact O-N 2.86Å
223	L	98.1	Very high	97.6	Very high	15 Å²	15	55.4 Å²	55.4	8%	0.079	30%	0.301	C	S	.	.	H	α-helix	trans	-62.4	-45.4	173.4	-179.8	107.2	0	0	0	111.6	L209 Y217 S219 C221 A226 T227 V236	L209-L223 HydrophobicContact CD1-CB 4.5Å; Y217-L223 HydrophobicContact CD1-CB 4.14Å; Y217-L223 HydrophobicContact CD2-CB 4.22Å; Y217-L223 HydrophobicContact CD2-CD1 3.41Å; Y217-L223 VanDerWaalsContact CD2-CD1 3.41Å; Y217-L223 HydrophobicContact CD2-CG 4.35Å; Y217-L223 HydrophobicContact CE2-CD1 3.68Å; Y217-L223 HydrophobicContact CG-CB 3.83Å; Y217-L223 HydrophobicContact CG-CD1 3.95Å; Y217-L223 HydrophobicContact CG-CG 4.46Å; S219-L223 PolarHBondContact O-N 3.24Å; S219-L223 VanDerWaalsContact O-N 3.08Å; C221-L223 PolarHBondContact O-N 2.83Å; L223-A226 PolarHBondContact O-N 3.31Å; L223-T227 WeakPolarHBondContact O-CB 3.44Å; L223-T227 PolarHBondContact O-N 3.28Å; L223-T227 PolarHBondContact O-OG1 3.28Å; L223-V236 HydrophobicContact CD1-CG2 4.46Å; L223-V236 HydrophobicContact CD2-CG2 3.6Å
224	R	98.3	Very high	97.7	Very high	178 Å²	178	54.1 Å²	54.1	67%	0.672	29%	0.294	S	S	*	.	H	α-helix	trans	-64.9	-39.7	177.8	-74.5	172.6	-178.5	156.8	1.1	112.3	A220 C221 T227 C228	A220-R224 WeakPolarHBondContact O-CB 3Å; A220-R224 VanDerWaalsContact O-CG 3.25Å; A220-R224 WeakPolarHBondContact O-CG 3.36Å; A220-R224 PolarHBondContact O-N 3.02Å; C221-R224 PolarHBondContact O-N 2.93Å; R224-T227 PolarHBondContact O-N 3.07Å; R224-C228 WeakPolarHBondContact O-CB 3.47Å; R224-C228 PolarHBondContact O-N 3.12Å
225	K	98.1	Very high	97.6	Very high	70 Å²	70	54.1 Å²	54.1	30%	0.304	29%	0.294	S	S	.	.	H	α-helix	trans	-58.2	-52.1	173.4	173.5	179.2	172.4	176.6	0	110.4	R197 C221 H222 C228 L229	R197-K225 WeakPolarHBondContact O-CE 3.48Å; R197-K225 PolarHBondContact O-NZ 2.65Å; C221-K225 WeakPolarHBondContact O-CB 3.48Å; C221-K225 PolarHBondContact O-N 3.12Å; H222-K225 PolarHBondContact O-N 3.13Å; K225-C228 PolarHBondContact O-N 3.36Å; K225-L229 HydrophobicContact CG-CD1 4Å; K225-L229 VanDerWaalsContact O-CG 3.26Å; K225-L229 WeakPolarHBondContact O-CG 3.36Å; K225-L229 PolarHBondContact O-N 3.31Å
226	A	98.4	Very high	97.6	Very high	27 Å²	27	52.5 Å²	52.5	22%	0.223	29%	0.288	C	S	.	.	H	α-helix	trans	-62.5	-43.4	178.2	0	0	0	0	0	112.3	Y217 H222 L223 C228 L229 L230 I234	Y217-A226 HydrophobicContact CD1-CB 4.43Å; Y217-A226 HydrophobicContact CE1-CB 3.44Å; Y217-A226 VanDerWaalsContact CE1-CB 3.44Å; H222-A226 PolarHBondContact O-N 2.86Å; L223-A226 PolarHBondContact O-N 3.31Å; A226-C228 VanDerWaalsContact C-N 3.34Å; A226-C228 PolarHBondContact O-N 3.28Å; A226-L229 PolarHBondContact O-N 2.91Å; A226-L230 VanDerWaalsContact O-CB 3.27Å; A226-L230 WeakPolarHBondContact O-CB 3.39Å; A226-L230 PolarHBondContact O-N 3.25Å; A226-I234 HydrophobicContact CB-CD1 4.04Å
227	T	98.5	Very high	97.6	Very high	30 Å²	30	50.2 Å²	50.2	18%	0.184	27%	0.274	C	S	.	.	H	α-helix	trans	-56.1	-46.7	175	-60.8	0	0	0	0	111.6	L223 R224 L230 G231 R232	L223-T227 WeakPolarHBondContact O-CB 3.44Å; L223-T227 PolarHBondContact O-N 3.28Å; L223-T227 PolarHBondContact O-OG1 3.28Å; R224-T227 PolarHBondContact O-N 3.07Å; T227-L230 PolarHBondContact O-N 3.43Å; T227-G231 PolarHBondContact O-N 3.46Å; T227-G231 VanDerWaalsContact O-N 3.14Å; T227-R232 WeakPolarHBondContact CG2-O 3.37Å
228	C	98.4	Very high	97.6	Very high	22 Å²	22	50.1 Å²	50.1	15%	0.149	27%	0.274	C	S	.	.	H	α-helix	trans	-66.9	-41.8	179.7	-170.1	0	0	0	0	112.1	C195 R224 K225 A226 L230 G231	C195-C228 WeakPolarHBondContact CA-SG 3.26Å; C195-C228 HydrophobicContact CB-CB 3.77Å; C195-C228 WeakPolarHBondContact CB-SG 3.24Å; C195-C228 WeakPolarHBondContact SG-CB 3.44Å; C195-C228 CovalentContact SG-SG 2.03Å; C195-C228 PolarHBondContact SG-SG 3.32Å; R224-C228 WeakPolarHBondContact O-CB 3.47Å; R224-C228 PolarHBondContact O-N 3.12Å; K225-C228 PolarHBondContact O-N 3.36Å; A226-C228 VanDerWaalsContact C-N 3.34Å; A226-C228 PolarHBondContact O-N 3.28Å; C228-L230 VanDerWaalsContact C-N 3.29Å; C228-L230 PolarHBondContact O-N 2.95Å; C228-G231 PolarHBondContact O-N 3.05Å
229	L	97.5	Very high	97.5	Very high	84 Å²	84	52.7 Å²	52.7	44%	0.44	28%	0.284	S	S	.	.	H	α-helix	trans	-69.6	-27.7	177.4	-65.6	175.9	0	0	0	112.8	C195 K225 A226 G231	C195-L229 HydrophobicContact CB-CD2 4.25Å; K225-L229 HydrophobicContact CG-CD1 4Å; K225-L229 VanDerWaalsContact O-CG 3.26Å; K225-L229 WeakPolarHBondContact O-CG 3.36Å; K225-L229 PolarHBondContact O-N 3.31Å; A226-L229 PolarHBondContact O-N 2.91Å; L229-G231 VanDerWaalsContact C-N 3.35Å
230	L	98	Very high	97.4	Very high	77 Å²	77	53 Å²	53	40%	0.403	29%	0.29	S	S	.	.	H	α-helix	trans	-74.8	-25.1	174.2	-176.6	63.8	0	0	0	112.6	A226 T227 C228 R232 I234	A226-L230 VanDerWaalsContact O-CB 3.27Å; A226-L230 WeakPolarHBondContact O-CB 3.39Å; A226-L230 PolarHBondContact O-N 3.25Å; T227-L230 PolarHBondContact O-N 3.43Å; C228-L230 VanDerWaalsContact C-N 3.29Å; C228-L230 PolarHBondContact O-N 2.95Å; L230-R232 VanDerWaalsContact C-N 3.34Å; L230-R232 HydrophobicContact CD2-CG 3.97Å; L230-R232 HydrophobicContact CG-CG 4Å; L230-I234 HydrophobicContact CD2-CD1 3.97Å; L230-I234 HydrophobicContact CD2-CG1 3.52Å
231	G	97.7	Very high	97.4	Very high	10 Å²	10	56.8 Å²	56.8	10%	0.103	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.1	3.4	-178.9	0	0	0	0	0	115	C182 V183 V184 T227 C228 L229	C182-G231 VanDerWaalsContact O-CA 3.28Å; C182-G231 WeakPolarHBondContact O-CA 3.45Å; V183-G231 CarbonylContact C-O 3.54Å; V183-G231 WeakPolarHBondContact CA-O 3.44Å; V184-G231 PolarHBondContact N-O 3.32Å; T227-G231 PolarHBondContact O-N 3.46Å; T227-G231 VanDerWaalsContact O-N 3.14Å; C228-G231 PolarHBondContact O-N 3.05Å; L229-G231 VanDerWaalsContact C-N 3.35Å
232	R	97.7	Very high	97.4	Very high	149 Å²	149	57 Å²	57	56%	0.562	30%	0.3	S	S	*	.	S	Bend	trans	-153.6	159.5	178.3	65.5	179.1	-177	-81	3	111.7	V184 T227 L230 I234	V184-R232 HydrophobicContact CG2-CB 4.01Å; T227-R232 WeakPolarHBondContact CG2-O 3.37Å; L230-R232 VanDerWaalsContact C-N 3.34Å; L230-R232 HydrophobicContact CD2-CG 3.97Å; L230-R232 HydrophobicContact CG-CG 4Å; R232-I234 PolarHBondContact O-N 3.34Å
233	S	97.3	Very high	97.4	Very high	99 Å²	99	58.5 Å²	58.5	69%	0.692	31%	0.31	S	S	*	.			trans	-57.5	120.3	178.8	-66.6	0	0	0	0	112.8
234	I	97.7	Very high	97.3	Very high	19 Å²	19	68 Å²	68	10%	0.097	35%	0.35	C	S	.	.			trans	-82.2	-47.9	165.3	-60.5	173.8	0	0	0	109.1	N212 D213 Y217 A226 L230 R232	N212-I234 WeakPolarHBondContact CB-O 3.38Å; N212-I234 PolarHBondContact ND2-O 3.48Å; D213-I234 HydrophobicContact CB-CG2 3.98Å; D213-I234 VanDerWaalsContact CG-CG2 3.49Å; D213-I234 WeakPolarHBondContact OD2-CG2 3.32Å; Y217-I234 WeakPolarHBondContact OH-CD1 3.04Å; A226-I234 HydrophobicContact CB-CD1 4.04Å; L230-I234 HydrophobicContact CD2-CD1 3.97Å; L230-I234 HydrophobicContact CD2-CG1 3.52Å; R232-I234 PolarHBondContact O-N 3.34Å
235	G	96	Very high	97.2	Very high	30 Å²	30	60.4 Å²	60.4	31%	0.309	33%	0.325	S	S	.	.			trans	75.1	155.5	-176	0	0	0	0	0	113.3	N212	N212-G235 PolarHBondContact N-O 3.26Å; N212-G235 VanDerWaalsContact N-O 3.14Å; N212-G235 VanDerWaalsContact ND2-C 3.26Å; N212-G235 WeakPolarHBondContact ND2-CA 3.45Å; N212-G235 PolarHBondContact ND2-O 3.35Å
236	V	97.4	Very high	97.1	Very high	56 Å²	56	65.9 Å²	65.9	34%	0.339	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	129.6	176.5	179.1	0	0	0	0	108.7	L209 L223	L209-V236 HydrophobicContact CD1-CG2 4.24Å; L209-V236 HydrophobicContact CD2-CG1 4.35Å; L223-V236 HydrophobicContact CD1-CG2 4.46Å; L223-V236 HydrophobicContact CD2-CG2 3.6Å
237	A	97.5	Very high	97	Very high	4 Å²	4	66.2 Å²	66.2	3%	0.033	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	-55.9	169.2	0	0	0	0	0	110	C210 N212 R269 C270	C210-A237 HydrophobicContact CB-CB 4.39Å; C210-A237 WeakPolarHBondContact O-CB 3.48Å; C210-A237 PolarHBondContact O-N 3.01Å; N212-A237 VanDerWaalsContact OD1-CA 3.29Å; N212-A237 WeakPolarHBondContact OD1-CA 3.45Å; N212-A237 WeakPolarHBondContact OD1-CB 3.29Å; N212-A237 PolarHBondContact OD1-N 3.08Å; A237-R269 CarbonylContact O-C 3.58Å; A237-C270 PolarHBondContact O-N 3.3Å
238	Y	97.1	Very high	96.9	Very high	19 Å²	19	66.4 Å²	66.4	8%	0.075	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	164.5	177.4	48	-96.3	0	0	0	111.2	C210 C242 I243 I251	C210-Y238 HydrophobicContact CB-CD1 4.4Å; C210-Y238 HydrophobicContact CB-CD2 3.72Å; C210-Y238 HydrophobicContact CB-CE1 4.16Å; C210-Y238 HydrophobicContact CB-CE2 3.44Å; C210-Y238 VanDerWaalsContact CB-CE2 3.44Å; C210-Y238 HydrophobicContact CB-CG 4.19Å; C210-Y238 PolarHBondContact N-O 3.33Å; C210-Y238 PolarHBondContact O-N 3.41Å; C210-Y238 VanDerWaalsContact SG-CZ 3.53Å; Y238-C242 WeakPolarHBondContact OH-CA 3.42Å; Y238-I243 WeakPolarHBondContact OH-CG1 3.04Å; Y238-I243 PolarHBondContact OH-N 3.08Å; Y238-I251 HydrophobicContact CD1-CG2 3.92Å; Y238-I251 HydrophobicContact CE1-CD1 4.11Å; Y238-I251 HydrophobicContact CE1-CG1 4.41Å; Y238-I251 HydrophobicContact CE1-CG2 4.29Å; Y238-I251 HydrophobicContact CG-CG2 4.19Å
239	D	95.8	Very high	96.9	Very high	78 Å²	78	73.4 Å²	73.4	42%	0.417	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	140.1	178	-58.1	-54.6	0	0	0	110.1	L209 S254 K257	L209-D239 WeakPolarHBondContact CD2-OD1 3.5Å; D239-S254 PolarHBondContact OD2-OG 2.79Å; D239-K257 IonicContact OD2-NZ 2.89Å; D239-K257 PolarHBondContact OD2-NZ 3.37Å
240	G	95	Very high	96.8	Very high	23 Å²	23	73 Å²	73	24%	0.237	38%	0.381	C	S	.	.	S	Bend	trans	101.7	-170.2	-175.7	0	0	0	0	0	114.5	Y208 L209 C210	Y208-G240 CarbonylContact C-O 3.57Å; Y208-G240 VanDerWaalsContact O-CA 3.31Å; Y208-G240 WeakPolarHBondContact O-CA 3.13Å; Y208-G240 PolarHBondContact O-N 3.27Å; L209-G240 CarbonylContact C-O 3.59Å; L209-G240 VanDerWaalsContact CA-O 3.24Å; L209-G240 WeakPolarHBondContact CA-O 3.49Å; L209-G240 PolarHBondContact N-O 2.81Å; C210-G240 PolarHBondContact N-O 2.95Å
241	K	96.8	Very high	96.8	Very high	121 Å²	121	69.8 Å²	69.8	53%	0.526	36%	0.364	S	S	.	.	S	Bend	trans	-78.7	148.2	177.3	-61.4	-172.1	177.5	178.9	0	110.5	Y208 T216 I243	Y208-K241 HydrophobicContact CD1-CG 4.15Å; Y208-K241 HydrophobicContact CD2-CG 4.49Å; Y208-K241 HydrophobicContact CG-CG 3.98Å; T216-K241 HydrophobicContact CG2-CB 3.97Å; T216-K241 HydrophobicContact CG2-CG 3.85Å; K241-I243 PolarHBondContact O-N 3.41Å
242	C	96.9	Very high	96.7	Very high	32 Å²	32	77 Å²	77	22%	0.216	40%	0.395	C	S	.	.			trans	-63.1	136.5	171.9	-64.1	0	0	0	0	110.8	C210 G214 I215 T216 Y238	C210-C242 WeakPolarHBondContact CA-SG 3.28Å; C210-C242 HydrophobicContact CB-CB 3.99Å; C210-C242 WeakPolarHBondContact CB-SG 2.98Å; C210-C242 WeakPolarHBondContact SG-CA 3.01Å; C210-C242 WeakPolarHBondContact SG-CB 3.2Å; C210-C242 CovalentContact SG-SG 2.04Å; C210-C242 PolarHBondContact SG-SG 3.21Å; G214-C242 PolarHBondContact O-SG 3.2Å; I215-C242 PolarHBondContact O-SG 2.04Å; I215-C242 VanDerWaalsContact O-SG 3.33Å; T216-C242 WeakPolarHBondContact OG1-CB 2.95Å; T216-C242 PolarHBondContact OG1-N 2.87Å; Y238-C242 WeakPolarHBondContact OH-CA 3.42Å
243	I	96.8	Very high	96.6	Very high	86 Å²	86	71.7 Å²	71.7	44%	0.441	38%	0.38	S	S	.	.			trans	-114.3	153.7	173.7	58.5	168	0	0	0	110.2	Y238 K241 A245 D250 I251	Y238-I243 WeakPolarHBondContact OH-CG1 3.04Å; Y238-I243 PolarHBondContact OH-N 3.08Å; K241-I243 PolarHBondContact O-N 3.41Å; I243-A245 HydrophobicContact CD1-CB 4.18Å; I243-A245 HydrophobicContact CG1-CB 4.17Å; I243-A245 PolarHBondContact O-N 3.44Å; I243-D250 HydrophobicContact CD1-CB 4.17Å; I243-D250 WeakPolarHBondContact CD1-O 3.41Å; I243-I251 HydrophobicContact CD1-CG1 4.17Å
244	K	95.8	Very high	96.4	Very high	214 Å²	214	69.7 Å²	69.7	93%	0.93	37%	0.366	S	S	*	.			trans	-81.3	62.3	173	-65.5	-175.3	179.5	-178.3	0	110.3
245	A	96.3	Very high	96	Very high	18 Å²	18	73.9 Å²	73.9	15%	0.149	40%	0.403	C	S	.	.			trans	-63.1	146	177.1	0	0	0	0	0	111	I243 D250 I251 W261	I243-A245 HydrophobicContact CD1-CB 4.18Å; I243-A245 HydrophobicContact CG1-CB 4.17Å; I243-A245 PolarHBondContact O-N 3.44Å; A245-D250 WeakPolarHBondContact CA-OD2 3.48Å; A245-D250 HydrophobicContact CB-CB 3.74Å; A245-I251 HydrophobicContact CB-CD1 3.86Å; A245-I251 HydrophobicContact CB-CG1 3.75Å; A245-W261 HydrophobicContact CB-CH2 4.37Å; A245-W261 HydrophobicContact CB-CZ3 4.16Å
246	K	96	Very high	95.7	Very high	186 Å²	186	75.3 Å²	75.3	81%	0.809	42%	0.419	S	S	*	.	S	Bend	trans	-103.7	-23.8	172.2	-63.8	-179.5	-178.3	177	0	112.1	D250 W261	K246-D250 PolarHBondContact N-OD2 3.26Å; K246-W261 WeakPolarHBondContact O-CH2 3.07Å; K246-W261 WeakPolarHBondContact O-CZ2 3.32Å
247	S	96.8	Very high	95.6	Very high	34 Å²	34	75.6 Å²	75.6	24%	0.238	42%	0.415	C	S	.	.	S	Bend	trans	-150.2	177.8	176	76.3	0	0	0	0	110.3	E249 D250 W261	S247-E249 PolarHBondContact O-N 2.86Å; S247-E249 WeakPolarHBondContact OG-CB 3.27Å; S247-E249 PolarHBondContact OG-N 3.27Å; S247-E249 VanDerWaalsContact OG-N 3.16Å; S247-E249 PolarHBondContact OG-OE2 2.04Å; S247-D250 PolarHBondContact N-OD2 2.81Å; S247-D250 PolarHBondContact O-N 3.46Å; S247-W261 VanDerWaalsContact C-CE3 3.5Å; S247-W261 VanDerWaalsContact CA-CZ3 3.5Å; S247-W261 WeakPolarHBondContact O-CZ3 3.44Å
248	C	97.3	Very high	95.5	Very high	33 Å²	33	81 Å²	81	22%	0.223	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-66	-14	172.6	-87.6	0	0	0	0	114.1	D250 I251 C259	C248-D250 PolarHBondContact O-N 2.04Å; C248-I251 PolarHBondContact O-N 2.78Å; C248-C259 WeakPolarHBondContact CA-SG 3.38Å; C248-C259 HydrophobicContact CB-CB 3.56Å; C248-C259 WeakPolarHBondContact CB-SG 3.42Å; C248-C259 WeakPolarHBondContact SG-CB 3.21Å; C248-C259 CovalentContact SG-SG 2.04Å; C248-C259 PolarHBondContact SG-SG 3.3Å
249	E	96.8	Very high	95.6	Very high	169 Å²	169	81 Å²	81	79%	0.79	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-67.5	-29.3	178	-60.6	167.9	161.5	0	0	111.7	S247 I251	S247-E249 PolarHBondContact O-N 2.86Å; S247-E249 WeakPolarHBondContact OG-CB 3.27Å; S247-E249 PolarHBondContact OG-N 3.27Å; S247-E249 VanDerWaalsContact OG-N 3.16Å; S247-E249 PolarHBondContact OG-OE2 2.04Å; E249-I251 VanDerWaalsContact C-N 3.29Å; E249-I251 PolarHBondContact O-N 2.79Å
250	D	97.1	Very high	95.7	Very high	77 Å²	77	77.8 Å²	77.8	41%	0.412	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-76.7	-16.7	177.7	-60.7	-44.8	0	0	0	112.6	I243 A245 K246 S247 C248	I243-D250 HydrophobicContact CD1-CB 4.17Å; I243-D250 WeakPolarHBondContact CD1-O 3.41Å; A245-D250 WeakPolarHBondContact CA-OD2 3.48Å; A245-D250 HydrophobicContact CB-CB 3.74Å; K246-D250 PolarHBondContact N-OD2 3.26Å; S247-D250 PolarHBondContact N-OD2 2.81Å; S247-D250 PolarHBondContact O-N 3.46Å; C248-D250 PolarHBondContact O-N 2.04Å
251	I	97.1	Very high	95.8	Very high	9 Å²	9	78.9 Å²	78.9	5%	0.046	42%	0.42	C	S	.	.			trans	-104.7	116.6	-169.8	-61.5	169.8	0	0	0	110.3	Y238 I243 A245 C248 E249 W261 G268	Y238-I251 HydrophobicContact CD1-CG2 3.92Å; Y238-I251 HydrophobicContact CE1-CD1 4.11Å; Y238-I251 HydrophobicContact CE1-CG1 4.41Å; Y238-I251 HydrophobicContact CE1-CG2 4.29Å; Y238-I251 HydrophobicContact CG-CG2 4.19Å; I243-I251 HydrophobicContact CD1-CG1 4.17Å; A245-I251 HydrophobicContact CB-CD1 3.86Å; A245-I251 HydrophobicContact CB-CG1 3.75Å; C248-I251 PolarHBondContact O-N 2.78Å; E249-I251 VanDerWaalsContact C-N 3.29Å; E249-I251 PolarHBondContact O-N 2.79Å; I251-W261 HydrophobicContact CD1-CZ3 4.18Å; I251-G268 VanDerWaalsContact CD1-CA 3.49Å
252	Q	95.8	Very high	95.7	Very high	162 Å²	162	73.8 Å²	73.8	76%	0.757	40%	0.399	S	S	*	.			trans	-92.5	106	177.7	-61	-59.3	-46.5	0	0	110.5
253	C	96.3	Very high	95.4	Very high	36 Å²	36	75.8 Å²	75.8	24%	0.243	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-83.4	143.7	176.4	-63.1	0	0	0	0	112	K257 C259 C270	C253-K257 HydrophobicContact CB-CB 3.97Å; C253-C259 PolarHBondContact SG-N 2.04Å; C253-C259 VanDerWaalsContact SG-N 3.43Å; C253-C270 WeakPolarHBondContact CA-SG 3.29Å; C253-C270 HydrophobicContact CB-CB 3.8Å; C253-C270 WeakPolarHBondContact CB-SG 3.28Å; C253-C270 VanDerWaalsContact SG-CA 3.57Å; C253-C270 WeakPolarHBondContact SG-CB 3.09Å; C253-C270 CovalentContact SG-SG 2.04Å; C253-C270 PolarHBondContact SG-SG 3.37Å
254	S	92.5	Very high	95.1	Very high	57 Å²	57	79.7 Å²	79.7	40%	0.399	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-61.9	160.4	171.6	-43.4	0	0	0	0	111.9	D239 G256 K257	D239-S254 PolarHBondContact OD2-OG 2.79Å; S254-G256 PolarHBondContact O-N 2.9Å; S254-K257 WeakPolarHBondContact O-CB 3.48Å; S254-K257 PolarHBondContact O-N 2.88Å
255	A	90.3	Very high	94.9	Very high	107 Å²	107	74.2 Å²	74.2	88%	0.884	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	132.1	-179.1	0	0	0	0	0	112.7	K257	A255-K257 VanDerWaalsContact C-N 3.3Å; A255-K257 PolarHBondContact O-N 3.36Å
256	G	88.8	Confident	94.8	Very high	61 Å²	61	77.2 Å²	77.2	63%	0.629	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.3	-4.6	-179.9	0	0	0	0	0	115.6	S254	S254-G256 PolarHBondContact O-N 2.9Å
257	K	95.1	Very high	94.8	Very high	62 Å²	62	73 Å²	73	27%	0.27	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	145.6	172.7	-60.9	176	-171.3	173.4	0	110.7	D239 C253 S254 A255 C270 S271 L272	D239-K257 IonicContact OD2-NZ 2.89Å; D239-K257 PolarHBondContact OD2-NZ 3.37Å; C253-K257 HydrophobicContact CB-CB 3.97Å; S254-K257 WeakPolarHBondContact O-CB 3.48Å; S254-K257 PolarHBondContact O-N 2.88Å; A255-K257 VanDerWaalsContact C-N 3.3Å; A255-K257 PolarHBondContact O-N 3.36Å; K257-C270 HydrophobicContact CB-CB 4.16Å; K257-C270 HydrophobicContact CD-CB 4.08Å; K257-S271 CarbonylContact C-O 3.56Å; K257-S271 WeakPolarHBondContact CA-O 3.01Å; K257-L272 HydrophobicContact CG-CD2 3.73Å; K257-L272 HydrophobicContact CG-CG 4.3Å
258	K	96.3	Very high	94.8	Very high	118 Å²	118	71.7 Å²	71.7	51%	0.513	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	149.3	168.6	-65.5	-175.6	177.2	-179.3	0	110.2	C270 S271 C273	K258-C270 WeakPolarHBondContact O-CA 3.48Å; K258-S271 PolarHBondContact N-O 3.42Å; K258-S271 PolarHBondContact O-N 3.48Å; K258-C273 HydrophobicContact CB-CB 4.43Å; K258-C273 HydrophobicContact CD-CB 4.07Å; K258-C273 HydrophobicContact CG-CB 4.2Å
259	C	97.8	Very high	94.8	Very high	19 Å²	19	73.1 Å²	73.1	13%	0.128	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	131.1	173.9	-178.9	0	0	0	0	110.2	C248 C253 R269	C248-C259 WeakPolarHBondContact CA-SG 3.38Å; C248-C259 HydrophobicContact CB-CB 3.56Å; C248-C259 WeakPolarHBondContact CB-SG 3.42Å; C248-C259 WeakPolarHBondContact SG-CB 3.21Å; C248-C259 CovalentContact SG-SG 2.04Å; C248-C259 PolarHBondContact SG-SG 3.3Å; C253-C259 PolarHBondContact SG-N 2.04Å; C253-C259 VanDerWaalsContact SG-N 3.43Å; C259-R269 CarbonylContact C-O 3.12Å; C259-R269 WeakPolarHBondContact CA-O 3.35Å
260	L	97.6	Very high	94.8	Very high	9 Å²	9	65.8 Å²	65.8	5%	0.047	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	124.9	170.9	-50.4	-174.7	0	0	0	108.4	G268 R269 S271 A304 L310	L260-G268 CarbonylContact O-C 3.33Å; L260-G268 WeakPolarHBondContact O-CA 3.49Å; L260-R269 PolarHBondContact N-O 2.81Å; L260-R269 PolarHBondContact O-N 3.03Å; L260-S271 WeakPolarHBondContact CD1-OG 3.16Å; L260-A304 HydrophobicContact CD1-CB 4.39Å; L260-A304 WeakPolarHBondContact CD2-O 3.22Å; L260-L310 HydrophobicContact CB-CB 4.29Å; L260-L310 HydrophobicContact CD1-CD1 4.32Å
261	W	97.6	Very high	94.7	Very high	46 Å²	46	63.4 Å²	63.4	17%	0.174	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	128.3	-178.5	-168.8	-104.2	0	0	0	111.9	A245 K246 S247 I251 G308 L310	A245-W261 HydrophobicContact CB-CH2 4.37Å; A245-W261 HydrophobicContact CB-CZ3 4.16Å; K246-W261 WeakPolarHBondContact O-CH2 3.07Å; K246-W261 WeakPolarHBondContact O-CZ2 3.32Å; S247-W261 VanDerWaalsContact C-CE3 3.5Å; S247-W261 VanDerWaalsContact CA-CZ3 3.5Å; S247-W261 WeakPolarHBondContact O-CZ3 3.44Å; I251-W261 HydrophobicContact CD1-CZ3 4.18Å; W261-G308 PolarHBondContact N-O 2.75Å; W261-L310 PolarHBondContact O-N 2.86Å
262	D	95.1	Very high	94.6	Very high	14 Å²	14	69 Å²	69	8%	0.075	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	104.2	166.7	-172.7	-20.1	0	0	0	109.1	R264 M265 S266 R267 L310	D262-R264 VanDerWaalsContact C-N 3.28Å; D262-R264 PolarHBondContact O-N 3.11Å; D262-R264 WeakPolarHBondContact OD1-CA 3.05Å; D262-R264 VanDerWaalsContact OD1-CB 3.29Å; D262-R264 WeakPolarHBondContact OD1-CB 3.47Å; D262-R264 PolarHBondContact OD1-N 2.91Å; D262-R264 IonicContact OD1-NE 3.28Å; D262-M265 HydrophobicContact CB-CB 4.41Å; D262-M265 PolarHBondContact O-N 3.34Å; D262-M265 PolarHBondContact OD1-N 2.93Å; D262-M265 WeakPolarHBondContact OD2-CG 3.48Å; D262-S266 WeakPolarHBondContact O-CA 3.29Å; D262-S266 PolarHBondContact O-N 3.19Å; D262-R267 WeakPolarHBondContact CB-O 3.01Å; D262-R267 PolarHBondContact N-O 2.98Å; D262-R267 PolarHBondContact O-N 3.38Å; D262-L310 HydrophobicContact CB-CB 4.16Å; D262-L310 HydrophobicContact CB-CD2 3.85Å
263	A	91.2	Very high	94.3	Very high	74 Å²	74	62.9 Å²	62.9	61%	0.612	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-29.7	178.7	0	0	0	0	0	112.9
264	R	89.4	Confident	93.5	Very high	169 Å²	169	68.4 Å²	68.4	64%	0.638	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-41.3	-178.7	-57.3	178.6	-66.5	178.9	1	110.7	D262 E312	D262-R264 VanDerWaalsContact C-N 3.28Å; D262-R264 PolarHBondContact O-N 3.11Å; D262-R264 WeakPolarHBondContact OD1-CA 3.05Å; D262-R264 VanDerWaalsContact OD1-CB 3.29Å; D262-R264 WeakPolarHBondContact OD1-CB 3.47Å; D262-R264 PolarHBondContact OD1-N 2.91Å; D262-R264 IonicContact OD1-NE 3.28Å; R264-E312 IonicContact NH2-OE2 2.69Å; R264-E312 PolarHBondContact NH2-OE2 3.42Å
265	M	91.6	Very high	92.7	Very high	99 Å²	99	71 Å²	71	49%	0.488	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-8.8	179.6	-60.4	-165.7	76.5	0	0	113.4	D262 R267	D262-M265 HydrophobicContact CB-CB 4.41Å; D262-M265 PolarHBondContact O-N 3.34Å; D262-M265 PolarHBondContact OD1-N 2.93Å; D262-M265 WeakPolarHBondContact OD2-CG 3.48Å; M265-R267 VanDerWaalsContact C-N 3.33Å; M265-R267 HydrophobicContact CB-CB 4.43Å; M265-R267 HydrophobicContact CB-CG 4.48Å; M265-R267 WeakPolarHBondContact O-CG 3.44Å; M265-R267 PolarHBondContact O-N 2.99Å
266	S	94.2	Very high	92.5	Very high	80 Å²	80	71.3 Å²	71.3	56%	0.559	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	49.3	-171.3	-62.8	0	0	0	0	112.3	D262	D262-S266 WeakPolarHBondContact O-CA 3.29Å; D262-S266 PolarHBondContact O-N 3.19Å
267	R	95.8	Very high	92.5	Very high	99 Å²	99	70.2 Å²	70.2	37%	0.374	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	147.6	-176.8	-70.1	175	-167.9	166.8	-1.5	111	N212 D213 D262 M265	N212-R267 PolarHBondContact O-NH1 3.43Å; D213-R267 PolarHBondContact O-NH1 3.05Å; D213-R267 PolarHBondContact O-NH2 2.76Å; D262-R267 WeakPolarHBondContact CB-O 3.01Å; D262-R267 PolarHBondContact N-O 2.98Å; D262-R267 PolarHBondContact O-N 3.38Å; M265-R267 VanDerWaalsContact C-N 3.33Å; M265-R267 HydrophobicContact CB-CB 4.43Å; M265-R267 HydrophobicContact CB-CG 4.48Å; M265-R267 WeakPolarHBondContact O-CG 3.44Å; M265-R267 PolarHBondContact O-N 2.99Å
268	G	96.8	Very high	92.1	Very high	6 Å²	6	72.2 Å²	72.2	6%	0.062	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	152.1	172.6	0	0	0	0	0	113.1	I251 L260	I251-G268 VanDerWaalsContact CD1-CA 3.49Å; L260-G268 CarbonylContact O-C 3.33Å; L260-G268 WeakPolarHBondContact O-CA 3.49Å
269	R	97.3	Very high	91.5	Very high	63 Å²	63	76.1 Å²	76.1	24%	0.238	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	129.8	175.6	176.9	-175.6	-65.2	164.8	6.9	109.9	N212 A237 C259 L260 S271	N212-R269 PolarHBondContact ND2-NE 3.22Å; N212-R269 PolarHBondContact ND2-NH2 3.29Å; N212-R269 VanDerWaalsContact ND2-NH2 3.17Å; N212-R269 PolarHBondContact OD1-NE 3.47Å; N212-R269 PolarHBondContact OD1-NH2 3.07Å; A237-R269 CarbonylContact O-C 3.58Å; C259-R269 CarbonylContact C-O 3.12Å; C259-R269 WeakPolarHBondContact CA-O 3.35Å; L260-R269 PolarHBondContact N-O 2.81Å; L260-R269 PolarHBondContact O-N 3.03Å; R269-S271 PolarHBondContact O-N 3.13Å
270	C	97.5	Very high	90.6	Very high	15 Å²	15	77.4 Å²	77.4	10%	0.101	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	111	171.8	-68.1	0	0	0	0	110.5	A237 C253 K257 K258	A237-C270 PolarHBondContact O-N 3.3Å; C253-C270 WeakPolarHBondContact CA-SG 3.29Å; C253-C270 HydrophobicContact CB-CB 3.8Å; C253-C270 WeakPolarHBondContact CB-SG 3.28Å; C253-C270 VanDerWaalsContact SG-CA 3.57Å; C253-C270 WeakPolarHBondContact SG-CB 3.09Å; C253-C270 CovalentContact SG-SG 2.04Å; C253-C270 PolarHBondContact SG-SG 3.37Å; K257-C270 HydrophobicContact CB-CB 4.16Å; K257-C270 HydrophobicContact CD-CB 4.08Å; K258-C270 WeakPolarHBondContact O-CA 3.48Å
271	S	95.8	Very high	89.7	Confident	26 Å²	26	85.3 Å²	85.3	18%	0.182	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	148.9	-177.7	-55.9	0	0	0	0	111.2	K257 K258 L260 R269	K257-S271 CarbonylContact C-O 3.56Å; K257-S271 WeakPolarHBondContact CA-O 3.01Å; K258-S271 PolarHBondContact N-O 3.42Å; K258-S271 PolarHBondContact O-N 3.48Å; L260-S271 WeakPolarHBondContact CD1-OG 3.16Å; R269-S271 PolarHBondContact O-N 3.13Å
272	L	93.8	Very high	88.6	Confident	127 Å²	127	89.7 Å²	89.7	67%	0.665	48%	0.478	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	130.3	170.4	-68	171	0	0	0	108.9	K257	K257-L272 HydrophobicContact CG-CD2 3.73Å; K257-L272 HydrophobicContact CG-CG 4.3Å
273	C	90.3	Very high	87.9	Confident	33 Å²	33	94.6 Å²	94.6	22%	0.223	51%	0.505	C	S	.	.			trans	-123.6	35.7	-173.5	-72.8	0	0	0	0	112.9	K258 C305	K258-C273 HydrophobicContact CB-CB 4.43Å; K258-C273 HydrophobicContact CD-CB 4.07Å; K258-C273 HydrophobicContact CG-CB 4.2Å; C273-C305 WeakPolarHBondContact CA-SG 3.49Å; C273-C305 HydrophobicContact CB-CB 3.59Å; C273-C305 WeakPolarHBondContact CB-SG 3.27Å; C273-C305 WeakPolarHBondContact SG-CB 3.45Å; C273-C305 CovalentContact SG-SG 2.04Å; C273-C305 PolarHBondContact SG-SG 3.24Å
274	N	78.9	Confident	87.8	Confident	153 Å²	153	95.6 Å²	95.6	82%	0.818	50%	0.496	S	S	*	.			trans	-111	30	-175.5	-163.9	28	0	0	0	113.1
275	E	75.5	Confident	88	Confident	111 Å²	111	88.7 Å²	88.7	52%	0.519	47%	0.474	S	S	.	.			trans	-88.4	113.8	-177.7	-60.7	-151.8	168.6	0	0	111.1
276	S	86.9	Confident	88.2	Confident	114 Å²	114	84.4 Å²	84.4	80%	0.797	45%	0.454	S	S	*	.			trans	-78.8	112.7	158.7	56.3	0	0	0	0	108.3
277	C	87.3	Confident	88.3	Confident	38 Å²	38	80.6 Å²	80.6	26%	0.257	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-81.9	130.4	-179.6	-61.7	0	0	0	0	111	C298	C277-C298 WeakPolarHBondContact CA-SG 3.4Å; C277-C298 HydrophobicContact CB-CB 3.91Å; C277-C298 WeakPolarHBondContact CB-SG 3.48Å; C277-C298 WeakPolarHBondContact SG-CB 3.47Å; C277-C298 PolarHBondContact SG-O 2.84Å; C277-C298 VanDerWaalsContact SG-O 3.4Å; C277-C298 CovalentContact SG-SG 2.05Å; C277-C298 PolarHBondContact SG-SG 3Å
278	P	88	Confident	88.3	Confident	104 Å²	104	75.9 Å²	75.9	68%	0.675	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-66.4	163.3	169.5	29.5	-33.5	0	0	0	110.9	S280	P278-S280 PolarHBondContact O-N 2.92Å
279	E	83.4	Confident	88.2	Confident	199 Å²	199	77.4 Å²	77.4	93%	0.93	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-58.3	126.8	169.8	-72	-172.3	169	0	0	109.5
280	S	77.9	Confident	88.1	Confident	46 Å²	46	77.1 Å²	77.1	32%	0.322	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-96.8	150.8	-174.9	36.1	0	0	0	0	111	P278 E284	P278-S280 PolarHBondContact O-N 2.92Å; S280-E284 WeakPolarHBondContact CA-OE2 3.37Å
281	R	79.4	Confident	88	Confident	175 Å²	175	81.1 Å²	81.1	66%	0.66	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-86.3	156.8	174.9	-53.3	179.9	88.4	-175	3.5	109.6	D283 E284	R281-D283 WeakPolarHBondContact CB-OD1 3.17Å; R281-D283 PolarHBondContact O-N 2.88Å; R281-E284 HydrophobicContact CB-CG 4.29Å; R281-E284 PolarHBondContact N-OE2 2.85Å; R281-E284 VanDerWaalsContact N-OE2 3.09Å; R281-E284 WeakPolarHBondContact O-CB 3.5Å; R281-E284 PolarHBondContact O-N 3.33Å; R281-E284 VanDerWaalsContact O-N 3.1Å
282	T	74	Confident	88	Confident	138 Å²	138	82.9 Å²	82.9	85%	0.847	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-64.2	-26.4	-175.7	51.9	0	0	0	0	113.7	E284 S285	T282-E284 VanDerWaalsContact C-N 3.28Å; T282-E284 PolarHBondContact O-N 2.96Å; T282-S285 PolarHBondContact O-OG 3.14Å
283	D	81.4	Confident	88.1	Confident	118 Å²	118	79.6 Å²	79.6	63%	0.631	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-77.6	-8.2	177.3	56.2	-38.8	0	0	0	113.8	R281	R281-D283 WeakPolarHBondContact CB-OD1 3.17Å; R281-D283 PolarHBondContact O-N 2.88Å
284	E	89.3	Confident	88.3	Confident	94 Å²	94	79.2 Å²	79.2	44%	0.439	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-93.2	2.4	179.2	-62.5	175.5	161.5	0	0	113.1	S280 R281 T282 P295 S296	S280-E284 WeakPolarHBondContact CA-OE2 3.37Å; R281-E284 HydrophobicContact CB-CG 4.29Å; R281-E284 PolarHBondContact N-OE2 2.85Å; R281-E284 VanDerWaalsContact N-OE2 3.09Å; R281-E284 WeakPolarHBondContact O-CB 3.5Å; R281-E284 PolarHBondContact O-N 3.33Å; R281-E284 VanDerWaalsContact O-N 3.1Å; T282-E284 VanDerWaalsContact C-N 3.28Å; T282-E284 PolarHBondContact O-N 2.96Å; E284-P295 CarbonylContact C-O 3.18Å; E284-S296 WeakPolarHBondContact O-CA 3.32Å
285	S	94	Very high	89.1	Confident	25 Å²	25	75.4 Å²	75.4	18%	0.175	42%	0.415	C	S	.	.			trans	-60.6	149	-179.6	61.6	0	0	0	0	112.5	T282 Y294 P295 G317	T282-S285 PolarHBondContact O-OG 3.14Å; S285-Y294 VanDerWaalsContact CA-O 3.28Å; S285-Y294 WeakPolarHBondContact CA-O 3.13Å; S285-Y294 WeakPolarHBondContact CB-O 3.49Å; S285-P295 WeakPolarHBondContact CA-O 3.28Å; S285-P295 PolarHBondContact N-O 2.91Å; S285-G317 WeakPolarHBondContact O-CA 3.4Å; S285-G317 PolarHBondContact O-N 3.46Å
286	V	95.4	Very high	90	Very high	9 Å²	9	70.7 Å²	70.7	6%	0.055	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	144.5	179.3	-63.2	0	0	0	0	111.1	T293 Y294 E297 M300 V313 G317	V286-T293 WeakPolarHBondContact O-CA 3.4Å; V286-Y294 PolarHBondContact N-O 2.77Å; V286-Y294 PolarHBondContact O-N 3.1Å; V286-E297 HydrophobicContact CG1-CB 4.45Å; V286-M300 HydrophobicContact CG2-CB 4.28Å; V286-M300 HydrophobicContact CG2-SD 4.34Å; V286-V313 HydrophobicContact CB-CG1 4.18Å; V286-V313 HydrophobicContact CB-CG2 4.33Å; V286-V313 HydrophobicContact CG1-CG1 4.23Å; V286-V313 HydrophobicContact CG1-CG2 4.32Å; V286-V313 HydrophobicContact CG2-CG2 4.4Å; V286-G317 CarbonylContact C-O 3.52Å; V286-G317 WeakPolarHBondContact CA-O 3.05Å
287	C	96.3	Very high	90.3	Very high	0 Å²	0	69.7 Å²	69.7	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	122	166.2	-175.7	0	0	0	0	109	K314 H315 G317 C319	C287-K314 WeakPolarHBondContact O-CB 3.16Å; C287-K314 PolarHBondContact O-N 2.84Å; C287-H315 VanDerWaalsContact CB-CE1 3.4Å; C287-H315 WeakPolarHBondContact CB-CE1 3.32Å; C287-H315 WeakPolarHBondContact CB-NE2 3.15Å; C287-H315 PolarHBondContact N-O 3.36Å; C287-H315 PolarHBondContact O-N 2.81Å; C287-G317 PolarHBondContact N-O 2.78Å; C287-C319 WeakPolarHBondContact CA-SG 3.3Å; C287-C319 HydrophobicContact CB-CB 3.94Å; C287-C319 WeakPolarHBondContact CB-SG 3.3Å; C287-C319 WeakPolarHBondContact SG-CA 3.49Å; C287-C319 WeakPolarHBondContact SG-CB 3.4Å; C287-C319 CovalentContact SG-SG 2.03Å; C287-C319 PolarHBondContact SG-SG 3.46Å
288	A	96.1	Very high	90.6	Very high	0 Å²	0	69 Å²	69	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	172	-179.3	0	0	0	0	0	112.6	D290 N291 T292 Y294 M300 E312	A288-D290 VanDerWaalsContact CB-OD1 3.29Å; A288-D290 WeakPolarHBondContact CB-OD1 3.43Å; A288-D290 PolarHBondContact O-N 3.3Å; A288-N291 WeakPolarHBondContact O-CA 3.37Å; A288-N291 PolarHBondContact O-N 3.19Å; A288-T292 PolarHBondContact N-O 2.96Å; A288-Y294 HydrophobicContact CB-CD2 3.61Å; A288-Y294 HydrophobicContact CB-CE2 3.51Å; A288-M300 HydrophobicContact CB-CG 3.8Å; A288-M300 HydrophobicContact CB-SD 3.6Å; A288-M300 VanDerWaalsContact CB-SD 3.6Å; A288-E312 CarbonylContact C-O 2.89Å; A288-E312 WeakPolarHBondContact CA-O 3.39Å
289	S	94.9	Very high	90.9	Very high	37 Å²	37	65 Å²	65	26%	0.259	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-17.1	-179.2	53.6	0	0	0	0	115	N291 L311 E312	S289-N291 VanDerWaalsContact C-N 3.27Å; S289-L311 WeakPolarHBondContact OG-CA 3.45Å; S289-E312 PolarHBondContact N-O 2.87Å; S289-E312 PolarHBondContact OG-N 3.49Å; S289-E312 VanDerWaalsContact OG-N 3.13Å
290	D	94.2	Very high	91.4	Very high	57 Å²	57	55.7 Å²	55.7	31%	0.305	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	3.3	172.1	69.7	-23.3	0	0	0	112.9	A288 T292 Y294 L311	A288-D290 VanDerWaalsContact CB-OD1 3.29Å; A288-D290 WeakPolarHBondContact CB-OD1 3.43Å; A288-D290 PolarHBondContact O-N 3.3Å; D290-T292 PolarHBondContact O-N 3.2Å; D290-T292 WeakPolarHBondContact OD1-CB 3.33Å; D290-T292 PolarHBondContact OD1-N 3.37Å; D290-T292 PolarHBondContact OD1-OG1 2.9Å; D290-T292 VanDerWaalsContact OD2-CB 3.27Å; D290-T292 WeakPolarHBondContact OD2-CB 3.36Å; D290-T292 PolarHBondContact OD2-OG1 2.91Å; D290-Y294 PolarHBondContact OD2-OH 2.98Å; D290-L311 HydrophobicContact CB-CD2 3.86Å
291	N	94.8	Very high	92.2	Very high	100 Å²	100	57.8 Å²	57.8	54%	0.535	31%	0.308	S	S	.	.	S	Bend	trans	61.3	26.2	-172.4	-48.6	-70.6	0	0	0	113.8	A288 S289 K314 C319	A288-N291 WeakPolarHBondContact O-CA 3.37Å; A288-N291 PolarHBondContact O-N 3.19Å; S289-N291 VanDerWaalsContact C-N 3.27Å; N291-K314 PolarHBondContact OD1-NZ 3.43Å; N291-C319 PolarHBondContact O-SG 3.32Å
292	T	96.1	Very high	92.9	Very high	62 Å²	62	54.2 Å²	54.2	38%	0.38	30%	0.299	S	S	.	.			trans	-95.9	138	169.7	-54.3	0	0	0	0	110.2	A288 D290 Y294 C319	A288-T292 PolarHBondContact N-O 2.96Å; D290-T292 PolarHBondContact O-N 3.2Å; D290-T292 WeakPolarHBondContact OD1-CB 3.33Å; D290-T292 PolarHBondContact OD1-N 3.37Å; D290-T292 PolarHBondContact OD1-OG1 2.9Å; D290-T292 VanDerWaalsContact OD2-CB 3.27Å; D290-T292 WeakPolarHBondContact OD2-CB 3.36Å; D290-T292 PolarHBondContact OD2-OG1 2.91Å; T292-Y294 HydrophobicContact CG2-CD2 4.42Å; T292-Y294 HydrophobicContact CG2-CE2 3.93Å; T292-Y294 WeakPolarHBondContact O-CD2 3.46Å; T292-C319 PolarHBondContact O-SG 3.16Å
293	T	96.1	Very high	93.9	Very high	58 Å²	58	48.8 Å²	48.8	36%	0.356	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	123.2	171.9	-55.8	0	0	0	0	109.7	V286 C319	V286-T293 WeakPolarHBondContact O-CA 3.4Å; T293-C319 PolarHBondContact OG1-N 2.96Å
294	Y	95.1	Very high	94.6	Very high	26 Å²	26	43.3 Å²	43.3	10%	0.102	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	146.6	174.1	-68.5	-88.1	0	0	0	110.1	S285 V286 A288 D290 T292 S296 M300 A303 L311	S285-Y294 VanDerWaalsContact CA-O 3.28Å; S285-Y294 WeakPolarHBondContact CA-O 3.13Å; S285-Y294 WeakPolarHBondContact CB-O 3.49Å; V286-Y294 PolarHBondContact N-O 2.77Å; V286-Y294 PolarHBondContact O-N 3.1Å; A288-Y294 HydrophobicContact CB-CD2 3.61Å; A288-Y294 HydrophobicContact CB-CE2 3.51Å; D290-Y294 PolarHBondContact OD2-OH 2.98Å; T292-Y294 HydrophobicContact CG2-CD2 4.42Å; T292-Y294 HydrophobicContact CG2-CE2 3.93Å; T292-Y294 WeakPolarHBondContact O-CD2 3.46Å; Y294-S296 PolarHBondContact O-N 3.37Å; Y294-M300 HydrophobicContact CD1-CB 4.19Å; Y294-M300 HydrophobicContact CD2-CB 3.85Å; Y294-M300 HydrophobicContact CD2-CG 3.76Å; Y294-M300 HydrophobicContact CE2-CB 4.45Å; Y294-M300 HydrophobicContact CE2-CG 4.02Å; Y294-M300 HydrophobicContact CG-CB 3.67Å; Y294-M300 HydrophobicContact CG-CG 4.12Å; Y294-A303 HydrophobicContact CD1-CB 4.24Å; Y294-A303 HydrophobicContact CE1-CB 3.39Å; Y294-L311 HydrophobicContact CE2-CD1 4.05Å; Y294-L311 VanDerWaalsContact OH-CD1 3.31Å; Y294-L311 WeakPolarHBondContact OH-CD1 3.44Å
295	P	94.6	Very high	94.9	Very high	73 Å²	73	39.5 Å²	39.5	47%	0.474	22%	0.223	S	C	.	.	S	Bend	trans	-66.6	-21.8	-178.7	27.2	-34.9	0	0	0	113	E284 S285 A299	E284-P295 CarbonylContact C-O 3.18Å; S285-P295 WeakPolarHBondContact CA-O 3.28Å; S285-P295 PolarHBondContact N-O 2.91Å; P295-A299 HydrophobicContact CG-CB 3.65Å
296	S	94.2	Very high	94.9	Very high	12 Å²	12	42.9 Å²	42.9	8%	0.084	25%	0.246	C	C	.	.	S	Bend	trans	-157.8	164.7	170.3	64.5	0	0	0	0	111.8	E284 Y294 C298 A299 M300	E284-S296 WeakPolarHBondContact O-CA 3.32Å; Y294-S296 PolarHBondContact O-N 3.37Å; S296-C298 PolarHBondContact O-N 3.19Å; S296-A299 PolarHBondContact O-N 2.86Å; S296-A299 PolarHBondContact OG-N 3.48Å; S296-M300 PolarHBondContact O-N 2.87Å
297	E	93.3	Very high	94.9	Very high	92 Å²	92	48 Å²	48	43%	0.43	27%	0.271	S	S	.	.	H	α-helix	trans	-58.2	-32.4	171	-169.2	-173.7	152.4	0	0	112	V286 M300 K301 V313	V286-E297 HydrophobicContact CG1-CB 4.45Å; E297-M300 HydrophobicContact CG-CE 4.05Å; E297-M300 WeakPolarHBondContact O-CB 3.24Å; E297-M300 PolarHBondContact O-N 2.65Å; E297-K301 WeakPolarHBondContact O-CG 3.17Å; E297-K301 PolarHBondContact O-N 3.17Å; E297-K301 WeakPolarHBondContact OE1-CE 3.22Å; E297-K301 IonicContact OE1-NZ 3.77Å; E297-K301 PolarHBondContact OE1-NZ 2.92Å; E297-V313 HydrophobicContact CB-CG2 4.49Å; E297-V313 HydrophobicContact CG-CG2 3.8Å
298	C	93.8	Very high	94.9	Very high	25 Å²	25	49.2 Å²	49.2	17%	0.169	28%	0.284	C	S	.	.	H	α-helix	trans	-64.1	-49.8	174.5	-172.3	0	0	0	0	111.2	C277 S296 M300 K301 Q302	C277-C298 WeakPolarHBondContact CA-SG 3.4Å; C277-C298 HydrophobicContact CB-CB 3.91Å; C277-C298 WeakPolarHBondContact CB-SG 3.48Å; C277-C298 WeakPolarHBondContact SG-CB 3.47Å; C277-C298 PolarHBondContact SG-O 2.84Å; C277-C298 VanDerWaalsContact SG-O 3.4Å; C277-C298 CovalentContact SG-SG 2.05Å; C277-C298 PolarHBondContact SG-SG 3Å; S296-C298 PolarHBondContact O-N 3.19Å; C298-M300 VanDerWaalsContact C-N 3.27Å; C298-M300 PolarHBondContact O-N 2.8Å; C298-K301 PolarHBondContact O-N 3.43Å; C298-K301 VanDerWaalsContact O-N 3.1Å; C298-Q302 PolarHBondContact O-N 3.35Å
299	A	94.3	Very high	94.9	Very high	20 Å²	20	52 Å²	52	17%	0.165	30%	0.3	C	S	.	.	H	α-helix	trans	-61.9	-36.9	179	0	0	0	0	0	111.9	P295 S296 Q302 A303	P295-A299 HydrophobicContact CG-CB 3.65Å; S296-A299 PolarHBondContact O-N 2.86Å; S296-A299 PolarHBondContact OG-N 3.48Å; A299-Q302 PolarHBondContact O-N 3.44Å; A299-A303 WeakPolarHBondContact O-CB 3.46Å; A299-A303 PolarHBondContact O-N 2.86Å
300	M	95.3	Very high	95	Very high	3 Å²	3	51.1 Å²	51.1	2%	0.015	29%	0.293	C	S	.	.	H	α-helix	trans	-59.3	-48.7	171.5	-177.5	-162	73.2	0	0	111.6	V286 A288 Y294 S296 E297 C298 Q302 A303 A304 L311 V313	V286-M300 HydrophobicContact CG2-CB 4.28Å; V286-M300 HydrophobicContact CG2-SD 4.34Å; A288-M300 HydrophobicContact CB-CG 3.8Å; A288-M300 HydrophobicContact CB-SD 3.6Å; A288-M300 VanDerWaalsContact CB-SD 3.6Å; Y294-M300 HydrophobicContact CD1-CB 4.19Å; Y294-M300 HydrophobicContact CD2-CB 3.85Å; Y294-M300 HydrophobicContact CD2-CG 3.76Å; Y294-M300 HydrophobicContact CE2-CB 4.45Å; Y294-M300 HydrophobicContact CE2-CG 4.02Å; Y294-M300 HydrophobicContact CG-CB 3.67Å; Y294-M300 HydrophobicContact CG-CG 4.12Å; S296-M300 PolarHBondContact O-N 2.87Å; E297-M300 HydrophobicContact CG-CE 4.05Å; E297-M300 WeakPolarHBondContact O-CB 3.24Å; E297-M300 PolarHBondContact O-N 2.65Å; C298-M300 VanDerWaalsContact C-N 3.27Å; C298-M300 PolarHBondContact O-N 2.8Å; M300-Q302 VanDerWaalsContact C-N 3.33Å; M300-Q302 PolarHBondContact O-N 3.2Å; M300-A303 PolarHBondContact O-N 3.42Å; M300-A304 WeakPolarHBondContact O-CB 3.43Å; M300-A304 PolarHBondContact O-N 2.94Å; M300-L311 HydrophobicContact CG-CB 3.96Å; M300-L311 HydrophobicContact CG-CD1 4.21Å; M300-L311 HydrophobicContact SD-CB 4.26Å; M300-V313 HydrophobicContact CE-CG2 3.84Å; M300-V313 HydrophobicContact SD-CG2 3.94Å
301	K	94.4	Very high	95	Very high	90 Å²	90	49.1 Å²	49.1	39%	0.391	28%	0.282	S	S	.	.	H	α-helix	trans	-62.7	-38.4	177.6	-74.1	171.3	-177.5	166	0	112.2	E297 C298 A304 C305	E297-K301 WeakPolarHBondContact O-CG 3.17Å; E297-K301 PolarHBondContact O-N 3.17Å; E297-K301 WeakPolarHBondContact OE1-CE 3.22Å; E297-K301 IonicContact OE1-NZ 3.77Å; E297-K301 PolarHBondContact OE1-NZ 2.92Å; C298-K301 PolarHBondContact O-N 3.43Å; C298-K301 VanDerWaalsContact O-N 3.1Å; K301-A304 WeakPolarHBondContact O-CB 3.42Å; K301-A304 PolarHBondContact O-N 3.03Å; K301-C305 WeakPolarHBondContact O-CB 3.48Å; K301-C305 PolarHBondContact O-N 3.03Å; K301-C305 PolarHBondContact O-SG 3.47Å; K301-C305 VanDerWaalsContact O-SG 3.41Å
302	Q	94.2	Very high	94.9	Very high	100 Å²	100	48.2 Å²	48.2	47%	0.467	27%	0.274	S	S	.	.	H	α-helix	trans	-63.7	-42.3	175.5	-170	-178.9	20.3	0	0	111.6	C298 A299 M300 C305 S306	C298-Q302 PolarHBondContact O-N 3.35Å; A299-Q302 PolarHBondContact O-N 3.44Å; M300-Q302 VanDerWaalsContact C-N 3.33Å; M300-Q302 PolarHBondContact O-N 3.2Å; Q302-C305 PolarHBondContact O-N 3.45Å; Q302-S306 PolarHBondContact O-N 3.39Å; Q302-S306 PolarHBondContact O-OG 3.23Å
303	A	94.9	Very high	94.8	Very high	23 Å²	23	48 Å²	48	19%	0.19	27%	0.273	C	S	.	.	H	α-helix	trans	-64.6	-46.9	175	0	0	0	0	0	111.8	Y294 A299 M300 C305 S306 M307	Y294-A303 HydrophobicContact CD1-CB 4.24Å; Y294-A303 HydrophobicContact CE1-CB 3.39Å; A299-A303 WeakPolarHBondContact O-CB 3.46Å; A299-A303 PolarHBondContact O-N 2.86Å; M300-A303 PolarHBondContact O-N 3.42Å; A303-C305 VanDerWaalsContact C-N 3.28Å; A303-C305 PolarHBondContact O-N 3.42Å; A303-S306 WeakPolarHBondContact O-CB 3.27Å; A303-S306 PolarHBondContact O-N 3.05Å; A303-M307 WeakPolarHBondContact O-CB 3.34Å; A303-M307 WeakPolarHBondContact O-CG 3.38Å; A303-M307 PolarHBondContact O-N 2.84Å
304	A	96.3	Very high	94.7	Very high	3 Å²	3	51.3 Å²	51.3	3%	0.025	28%	0.282	C	S	.	.	H	α-helix	trans	-51.5	-48.1	173.8	0	0	0	0	0	111.4	L260 M300 K301 S306 M307 G308 V309 L311	L260-A304 HydrophobicContact CD1-CB 4.39Å; L260-A304 WeakPolarHBondContact CD2-O 3.22Å; M300-A304 WeakPolarHBondContact O-CB 3.43Å; M300-A304 PolarHBondContact O-N 2.94Å; K301-A304 WeakPolarHBondContact O-CB 3.42Å; K301-A304 PolarHBondContact O-N 3.03Å; A304-S306 VanDerWaalsContact C-N 3.33Å; A304-S306 PolarHBondContact O-N 2.88Å; A304-M307 PolarHBondContact O-N 2.83Å; A304-G308 PolarHBondContact O-N 3.34Å; A304-V309 WeakPolarHBondContact CA-O 3.48Å; A304-V309 VanDerWaalsContact CB-O 3.28Å; A304-V309 WeakPolarHBondContact CB-O 3.47Å; A304-V309 PolarHBondContact O-N 3.45Å; A304-L311 HydrophobicContact CB-CB 3.98Å; A304-L311 HydrophobicContact CB-CD1 4.02Å; A304-L311 HydrophobicContact CB-CG 3.91Å
305	C	95.3	Very high	94.5	Very high	15 Å²	15	52 Å²	52	10%	0.101	29%	0.286	C	S	.	.	H	α-helix	trans	-63.6	-31.9	176	-80.7	0	0	0	0	114.9	C273 K301 Q302 A303	C273-C305 WeakPolarHBondContact CA-SG 3.49Å; C273-C305 HydrophobicContact CB-CB 3.59Å; C273-C305 WeakPolarHBondContact CB-SG 3.27Å; C273-C305 WeakPolarHBondContact SG-CB 3.45Å; C273-C305 CovalentContact SG-SG 2.04Å; C273-C305 PolarHBondContact SG-SG 3.24Å; K301-C305 WeakPolarHBondContact O-CB 3.48Å; K301-C305 PolarHBondContact O-N 3.03Å; K301-C305 PolarHBondContact O-SG 3.47Å; K301-C305 VanDerWaalsContact O-SG 3.41Å; Q302-C305 PolarHBondContact O-N 3.45Å; A303-C305 VanDerWaalsContact C-N 3.28Å; A303-C305 PolarHBondContact O-N 3.42Å
306	S	94.2	Very high	94.4	Very high	96 Å²	96	53.8 Å²	53.8	67%	0.671	30%	0.296	S	S	*	.	H	α-helix	trans	-77.8	-34.9	179.2	-57.3	0	0	0	0	111.3	Q302 A303 A304	Q302-S306 PolarHBondContact O-N 3.39Å; Q302-S306 PolarHBondContact O-OG 3.23Å; A303-S306 WeakPolarHBondContact O-CB 3.27Å; A303-S306 PolarHBondContact O-N 3.05Å; A304-S306 VanDerWaalsContact C-N 3.33Å; A304-S306 PolarHBondContact O-N 2.88Å
307	M	95.2	Very high	94.3	Very high	117 Å²	117	54.1 Å²	54.1	58%	0.576	30%	0.301	S	S	*	.	H	α-helix	trans	-87.1	-19.8	-179.6	-65.3	171.3	61.9	0	0	113.5	A303 A304 V309	A303-M307 WeakPolarHBondContact O-CB 3.34Å; A303-M307 WeakPolarHBondContact O-CG 3.38Å; A303-M307 PolarHBondContact O-N 2.84Å; A304-M307 PolarHBondContact O-N 2.83Å; M307-V309 VanDerWaalsContact C-N 3.29Å; M307-V309 HydrophobicContact CB-CB 4.48Å; M307-V309 HydrophobicContact CB-CG2 4.38Å
308	G	96	Very high	94.3	Very high	25 Å²	25	51.8 Å²	51.8	26%	0.258	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.6	23.1	-173.9	0	0	0	0	0	113.4	W261 A304	W261-G308 PolarHBondContact N-O 2.75Å; A304-G308 PolarHBondContact O-N 3.34Å
309	V	96.4	Very high	94.3	Very high	58 Å²	58	52.1 Å²	52.1	35%	0.352	30%	0.297	S	S	.	.	B	Isolated β-bridge	trans	-118.6	140	-178.7	179.1	0	0	0	0	108.9	A304 M307 L311	A304-V309 WeakPolarHBondContact CA-O 3.48Å; A304-V309 VanDerWaalsContact CB-O 3.28Å; A304-V309 WeakPolarHBondContact CB-O 3.47Å; A304-V309 PolarHBondContact O-N 3.45Å; M307-V309 VanDerWaalsContact C-N 3.29Å; M307-V309 HydrophobicContact CB-CB 4.48Å; M307-V309 HydrophobicContact CB-CG2 4.38Å; V309-L311 PolarHBondContact O-N 3.23Å
310	L	95.8	Very high	94.1	Very high	19 Å²	19	58.1 Å²	58.1	10%	0.099	33%	0.326	C	S	.	.			trans	-74	122.1	175.4	-176.7	68.8	0	0	0	109.9	L260 W261 D262 E312	L260-L310 HydrophobicContact CB-CB 4.29Å; L260-L310 HydrophobicContact CD1-CD1 4.32Å; W261-L310 PolarHBondContact O-N 2.86Å; D262-L310 HydrophobicContact CB-CB 4.16Å; D262-L310 HydrophobicContact CB-CD2 3.85Å; L310-E312 HydrophobicContact CG-CG 4.42Å
311	L	95.3	Very high	93.5	Very high	14 Å²	14	60.4 Å²	60.4	7%	0.073	34%	0.343	C	S	.	.			trans	-114.9	135.2	170.3	-59	178.2	0	0	0	109.9	S289 D290 Y294 M300 A304 V309	S289-L311 WeakPolarHBondContact OG-CA 3.45Å; D290-L311 HydrophobicContact CB-CD2 3.86Å; Y294-L311 HydrophobicContact CE2-CD1 4.05Å; Y294-L311 VanDerWaalsContact OH-CD1 3.31Å; Y294-L311 WeakPolarHBondContact OH-CD1 3.44Å; M300-L311 HydrophobicContact CG-CB 3.96Å; M300-L311 HydrophobicContact CG-CD1 4.21Å; M300-L311 HydrophobicContact SD-CB 4.26Å; A304-L311 HydrophobicContact CB-CB 3.98Å; A304-L311 HydrophobicContact CB-CD1 4.02Å; A304-L311 HydrophobicContact CB-CG 3.91Å; V309-L311 PolarHBondContact O-N 3.23Å
312	E	92.9	Very high	92.1	Very high	81 Å²	81	63.5 Å²	63.5	38%	0.379	36%	0.362	S	S	.	.			trans	-123.2	150.3	175.5	-65.4	-177.2	148	0	0	109.9	R264 A288 S289 L310 K314	R264-E312 IonicContact NH2-OE2 2.69Å; R264-E312 PolarHBondContact NH2-OE2 3.42Å; A288-E312 CarbonylContact C-O 2.89Å; A288-E312 WeakPolarHBondContact CA-O 3.39Å; S289-E312 PolarHBondContact N-O 2.87Å; S289-E312 PolarHBondContact OG-N 3.49Å; S289-E312 VanDerWaalsContact OG-N 3.13Å; L310-E312 HydrophobicContact CG-CG 4.42Å; E312-K314 PolarHBondContact O-N 3.49Å
313	V	93.9	Very high	90.3	Very high	57 Å²	57	62.1 Å²	62.1	35%	0.345	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	123.9	174.7	178.7	0	0	0	0	108.7	V286 E297 M300	V286-V313 HydrophobicContact CB-CG1 4.18Å; V286-V313 HydrophobicContact CB-CG2 4.33Å; V286-V313 HydrophobicContact CG1-CG1 4.23Å; V286-V313 HydrophobicContact CG1-CG2 4.32Å; V286-V313 HydrophobicContact CG2-CG2 4.4Å; E297-V313 HydrophobicContact CB-CG2 4.49Å; E297-V313 HydrophobicContact CG-CG2 3.8Å; M300-V313 HydrophobicContact CE-CG2 3.84Å; M300-V313 HydrophobicContact SD-CG2 3.94Å
314	K	93.3	Very high	88.1	Confident	129 Å²	129	69.5 Å²	69.5	56%	0.561	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.1	-46.9	173.4	-170.6	-175.1	-178.8	-173.1	0	110.5	C287 N291 E312	C287-K314 WeakPolarHBondContact O-CB 3.16Å; C287-K314 PolarHBondContact O-N 2.84Å; N291-K314 PolarHBondContact OD1-NZ 3.43Å; E312-K314 PolarHBondContact O-N 3.49Å
315	H	91.2	Very high	85.7	Confident	41 Å²	41	75.8 Å²	75.8	19%	0.19	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	163.8	170.9	58.7	89.2	0	0	0	110.3	C287 S318	C287-H315 VanDerWaalsContact CB-CE1 3.4Å; C287-H315 WeakPolarHBondContact CB-CE1 3.32Å; C287-H315 WeakPolarHBondContact CB-NE2 3.15Å; C287-H315 PolarHBondContact N-O 3.36Å; C287-H315 PolarHBondContact O-N 2.81Å; H315-S318 PolarHBondContact CE1-O 2.8Å; H315-S318 VanDerWaalsContact CE1-O 3.28Å
316	T	92.4	Very high	83.3	Confident	110 Å²	110	84.1 Å²	84.1	68%	0.675	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.5	153.1	171	50.6	0	0	0	0	110.7
317	G	92.3	Very high	80.6	Confident	19 Å²	19	88.5 Å²	88.5	20%	0.196	47%	0.472	C	S	.	.	S	Bend	trans	85.6	-168.8	-178.1	0	0	0	0	0	114.1	S285 V286 C287	S285-G317 WeakPolarHBondContact O-CA 3.4Å; S285-G317 PolarHBondContact O-N 3.46Å; V286-G317 CarbonylContact C-O 3.52Å; V286-G317 WeakPolarHBondContact CA-O 3.05Å; C287-G317 PolarHBondContact N-O 2.78Å
318	S	93.2	Very high	77.9	Confident	42 Å²	42	91.8 Å²	91.8	29%	0.294	49%	0.485	S	S	.	.			trans	-76.3	145.6	-178.5	176.6	0	0	0	0	111.6	H315 N320 S321	H315-S318 PolarHBondContact CE1-O 2.8Å; H315-S318 VanDerWaalsContact CE1-O 3.28Å; S318-N320 PolarHBondContact O-N 3.16Å; S318-N320 PolarHBondContact OG-N 3.42Å; S318-S321 PolarHBondContact N-OG 3.2Å; S318-S321 PolarHBondContact O-N 2.86Å; S318-S321 PolarHBondContact O-OG 3.01Å
319	C	93.2	Very high	75.1	Confident	32 Å²	32	98.6 Å²	98.6	22%	0.216	52%	0.516	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-18.9	173.6	-64.3	0	0	0	0	113.5	C287 N291 T292 T293	C287-C319 WeakPolarHBondContact CA-SG 3.3Å; C287-C319 HydrophobicContact CB-CB 3.94Å; C287-C319 WeakPolarHBondContact CB-SG 3.3Å; C287-C319 WeakPolarHBondContact SG-CA 3.49Å; C287-C319 WeakPolarHBondContact SG-CB 3.4Å; C287-C319 CovalentContact SG-SG 2.03Å; C287-C319 PolarHBondContact SG-SG 3.46Å; N291-C319 PolarHBondContact O-SG 3.32Å; T292-C319 PolarHBondContact O-SG 3.16Å; T293-C319 PolarHBondContact OG1-N 2.96Å
320	N	91.1	Very high	72.5	Confident	146 Å²	146	104.9 Å²	104.9	78%	0.781	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-12.4	176.6	-64.7	-21	0	0	0	113.2	S318 I322	S318-N320 PolarHBondContact O-N 3.16Å; S318-N320 PolarHBondContact OG-N 3.42Å; N320-I322 PolarHBondContact O-N 3Å
321	S	81.4	Confident	70.1	Confident	51 Å²	51	113 Å²	113	36%	0.357	58%	0.579	S	S	.	*	S	Bend	trans	-77.1	106	170.3	53.7	0	0	0	0	108	S318 T323	S318-S321 PolarHBondContact N-OG 3.2Å; S318-S321 PolarHBondContact O-N 2.86Å; S318-S321 PolarHBondContact O-OG 3.01Å; S321-T323 PolarHBondContact O-N 3.05Å; S321-T323 VanDerWaalsContact O-N 3.15Å
322	I	65.5	Low	67.3	Low	156 Å²	156	120.4 Å²	120.4	80%	0.8	62%	0.619	S	S	*	*			trans	-63.1	110.3	168.6	-55.8	168	0	0	0	105.7	N320 E324	N320-I322 PolarHBondContact O-N 3Å; I322-E324 PolarHBondContact O-N 2.96Å
323	T	57	Low	64.8	Low	71 Å²	71	120.7 Å²	120.7	44%	0.436	64%	0.643	S	S	.	*			trans	-75.1	108.4	171.5	49.2	0	0	0	0	107.7	S321 D325	S321-T323 PolarHBondContact O-N 3.05Å; S321-T323 VanDerWaalsContact O-N 3.15Å; T323-D325 PolarHBondContact O-N 2.95Å
324	E	47.3	Very low	62	Low	177 Å²	177	125.1 Å²	125.1	83%	0.827	67%	0.665	S	S	*	*			trans	-67.4	38.1	166.5	-68.6	176.3	159.6	0	0	111.7	I322	I322-E324 PolarHBondContact O-N 2.96Å
325	D	47.9	Very low	59.8	Low	135 Å²	135	124.6 Å²	124.6	72%	0.722	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	39.5	-172.8	-66.4	-34.1	0	0	0	112.4	T323	T323-D325 PolarHBondContact O-N 2.95Å
326	Q	43.8	Very low	57.6	Low	191 Å²	191	129.1 Å²	129.1	89%	0.893	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.4	10.3	168.7	-75.2	-165.7	-10	0	0	115.2
327	E	38.4	Very low	55	Low	187 Å²	187	134.1 Å²	134.1	87%	0.874	71%	0.711	S	S	*	*	S	Bend	trans	-127	24.9	-179.9	-70.9	-171	178	0	0	115.6
328	E	36.7	Very low	52.4	Low	186 Å²	186	143.6 Å²	143.6	87%	0.869	75%	0.747	S	S	*	*	S	Bend	trans	-121.9	33.2	174.1	-71.7	-166.5	173.9	0	0	114.6
329	D	37.7	Very low	50	Low	169 Å²	169	144.7 Å²	144.7	90%	0.904	76%	0.758	S	S	*	*	S	Bend	trans	-118.3	18.7	168.9	-86.2	-27.4	0	0	0	113.3
330	E	42.3	Very low	47.5	Very low	190 Å²	190	153.6 Å²	153.6	89%	0.888	79%	0.789	S	S	*	*	S	Bend	trans	-129.6	54.2	170	-70.7	-163.8	-173.5	0	0	112.4
331	E	45.1	Very low	44.8	Very low	190 Å²	190	153.5 Å²	153.5	89%	0.888	79%	0.793	S	S	*	*			trans	-155.4	69	158.9	-118.3	177.4	-148	0	0	111.9
332	D	37.2	Very low	42.7	Very low	169 Å²	169	159.1 Å²	159.1	90%	0.904	81%	0.813	S	S	*	*			trans	-133.6	96.7	150.2	-99.8	-26	0	0	0	107.2	D334	D332-D334 PolarHBondContact O-N 3.19Å
333	G	39.2	Very low	41.6	Very low	86 Å²	86	160.1 Å²	160.1	89%	0.887	82%	0.82	S	S	*	*			trans	-62.6	119.7	176.3	0	0	0	0	0	111.1
334	D	35.9	Very low	40.7	Very low	151 Å²	151	162.5 Å²	162.5	81%	0.807	84%	0.839	S	S	*	*			trans	-115	106.9	151.2	-159.8	6.1	0	0	0	108.7	D332 D336	D332-D334 PolarHBondContact O-N 3.19Å; D334-D336 VanDerWaalsContact C-N 3.26Å; D334-D336 PolarHBondContact O-N 3.41Å
335	S	46.4	Very low	40.4	Very low	117 Å²	117	159 Å²	159	82%	0.818	83%	0.834	S	S	*	*			trans	-80.8	62.5	-178.5	66.5	0	0	0	0	110.7
336	D	45.8	Very low	40.3	Very low	137 Å²	137	160.4 Å²	160.4	73%	0.733	84%	0.841	S	S	*	*			trans	-163.6	59.3	168.1	-143.6	6.1	0	0	0	114.9	D334	D334-D336 VanDerWaalsContact C-N 3.26Å; D334-D336 PolarHBondContact O-N 3.41Å
337	Y	37.5	Very low	40.4	Very low	215 Å²	215	159.3 Å²	159.3	84%	0.843	84%	0.84	S	S	*	*			trans	-155.3	53.6	159.4	-121.5	-84.3	0	0	0	112.3
338	K	37.2	Very low	40.7	Very low	218 Å²	218	159 Å²	159	95%	0.948	85%	0.845	S	S	*	*			trans	-108.7	59.7	167	-129.4	-177.7	-168.3	176.2	0	110.8
339	A	43.7	Very low	40.8	Very low	64 Å²	64	157.4 Å²	157.4	53%	0.529	88%	0.878	S	S	.	*	S	Bend	trans	-148.2	137.6	158.9	0	0	0	0	0	106.7
340	Y	40.3	Very low	41	Very low	219 Å²	219	156.9 Å²	156.9	86%	0.859	88%	0.877	S	S	*	*	S	Bend	trans	92.6	35.6	-175	-56.6	-76.1	0	0	0	119
341	V	34.5	Very low	40.9	Very low	144 Å²	144	155.1 Å²	155.1	87%	0.873	88%	0.876	S	S	*	*	S	Bend	trans	-143.8	65.1	143	-165.7	0	0	0	0	109.4
342	H	36.3	Very low	40.7	Very low	169 Å²	169	153.2 Å²	153.2	78%	0.782	88%	0.876	S	S	*	*	S	Bend	trans	-149.1	54.6	163.7	-137.5	-56.6	0	0	0	109.5
343	L	42.6	Very low	40.9	Very low	178 Å²	178	152.2 Å²	152.2	93%	0.932	87%	0.874	S	S	*	*			trans	-155.6	61.8	171.5	-144.3	84	0	0	0	111.7
344	S	38.8	Very low	41	Very low	120 Å²	120	156.4 Å²	156.4	84%	0.839	87%	0.873	S	S	*	*	S	Bend	trans	-153.1	34	163.5	84.5	0	0	0	0	114.5
345	S	40.8	Very low	41.3	Very low	104 Å²	104	156.7 Å²	156.7	73%	0.727	88%	0.878	S	S	*	*	S	Bend	trans	-132.5	29.5	175.6	45.5	0	0	0	0	113.7
346	L	46.3	Very low	40.9	Very low	164 Å²	164	159.6 Å²	159.6	86%	0.859	88%	0.882	S	S	*	*	S	Bend	trans	-136	44.8	175.7	-95.3	170.6	0	0	0	113.3
347	L	45.3	Very low	40.6	Very low	169 Å²	169	161.3 Å²	161.3	89%	0.885	89%	0.894	S	S	*	*			trans	-148.1	71.4	159.9	-74.1	-179.9	0	0	0	109.5
348	D	44.8	Very low	40.8	Very low	180 Å²	180	156.8 Å²	156.8	96%	0.963	90%	0.898	S	S	*	*			trans	-148.6	93.9	145.9	-91.8	-30.5	0	0	0	106
349	G	39.3	Very low	41.2	Very low	153 Å²	153	151.3 Å²	151.3	100%	1.577	89%	0.893	S	S	*	*			trans	-158.1	0	176.1	0	0	0	0	0	107.9

Retrieved 349 of 349 residues in 66.1 ms (Link to these results)

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