A0A087XQX8_POEFO Loading...

EPH-related receptor tyrosine kinase ligand 7

AlphaFold DB , UniProt , Accession A0A087XQX8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 224 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	59.5	Low	72.5	Confident	184 Å²	184	119.8 Å²	119.8	91%	0.906	62%	0.623	S	S	*	*				0	-57.4	0	-87.8	172.3	54.9	0	0	112.2	Q3 V4 E5	M1-Q3 VanDerWaalsContact C-N 3.31Å; M1-Q3 PolarHBondContact O-N 3.12Å; M1-Q3 VanDerWaalsContact O-N 3.16Å; M1-V4 PolarHBondContact O-N 3.03Å; M1-V4 VanDerWaalsContact O-N 3.12Å; M1-E5 PolarHBondContact O-N 3.43Å
2	L	56.8	Low	73.3	Confident	145 Å²	145	117.6 Å²	117.6	76%	0.759	61%	0.612	S	S	*	*	H	α-helix	trans	-55.5	-34.8	-177.6	-83.8	94.2	0	0	0	116	M6	L2-M6 WeakPolarHBondContact O-CB 3.2Å; L2-M6 PolarHBondContact O-N 2.9Å
3	Q	64.7	Low	73.8	Confident	162 Å²	162	113.8 Å²	113.8	76%	0.757	60%	0.597	S	S	*	*	H	α-helix	trans	-67.4	-35.8	179.1	-78.1	-175.7	-41.7	0	0	113.1	M1 V7	M1-Q3 VanDerWaalsContact C-N 3.31Å; M1-Q3 PolarHBondContact O-N 3.12Å; M1-Q3 VanDerWaalsContact O-N 3.16Å; Q3-V7 VanDerWaalsContact O-CG2 3.23Å; Q3-V7 WeakPolarHBondContact O-CG2 3.06Å; Q3-V7 PolarHBondContact O-N 3.41Å; Q3-V7 VanDerWaalsContact O-N 3.13Å
4	V	73.2	Confident	74	Confident	111 Å²	111	113.1 Å²	113.1	67%	0.673	59%	0.593	S	S	*	*	H	α-helix	trans	-74.9	-37.9	-179.5	-178.6	0	0	0	0	110.3	M1 V7 L8	M1-V4 PolarHBondContact O-N 3.03Å; M1-V4 VanDerWaalsContact O-N 3.12Å; V4-V7 PolarHBondContact O-N 3.5Å; V4-L8 WeakPolarHBondContact O-CB 3.33Å; V4-L8 PolarHBondContact O-N 2.93Å
5	E	77.6	Confident	74.2	Confident	113 Å²	113	111.9 Å²	111.9	53%	0.528	59%	0.587	S	S	.	*	H	α-helix	trans	-66.9	-40.4	176.1	-68	176.2	168.7	0	0	112	M1 L8 F9	M1-E5 PolarHBondContact O-N 3.43Å; E5-L8 PolarHBondContact O-N 3.05Å; E5-F9 WeakPolarHBondContact O-CB 3.45Å; E5-F9 PolarHBondContact O-N 3.1Å
6	M	72.8	Confident	74.3	Confident	123 Å²	123	111.4 Å²	111.4	61%	0.606	58%	0.582	S	S	*	*	H	α-helix	trans	-65.1	-40.6	175.2	-169.4	-169.9	70.3	0	0	111.7	L2 F9 V10	L2-M6 WeakPolarHBondContact O-CB 3.2Å; L2-M6 PolarHBondContact O-N 2.9Å; M6-F9 PolarHBondContact O-N 3.24Å; M6-V10 VanDerWaalsContact O-CG2 3.28Å; M6-V10 WeakPolarHBondContact O-CG2 3.39Å; M6-V10 PolarHBondContact O-N 3.36Å
7	V	75.7	Confident	74.2	Confident	85 Å²	85	109.6 Å²	109.6	52%	0.515	58%	0.58	S	S	.	*	H	α-helix	trans	-64.7	-43.7	175.2	170.2	0	0	0	0	110.9	Q3 V4 F9 V10 C11	Q3-V7 VanDerWaalsContact O-CG2 3.23Å; Q3-V7 WeakPolarHBondContact O-CG2 3.06Å; Q3-V7 PolarHBondContact O-N 3.41Å; Q3-V7 VanDerWaalsContact O-N 3.13Å; V4-V7 PolarHBondContact O-N 3.5Å; V7-F9 PolarHBondContact O-N 3.35Å; V7-V10 PolarHBondContact O-N 3.27Å; V7-C11 WeakPolarHBondContact O-CB 3.39Å; V7-C11 PolarHBondContact O-N 3.1Å; V7-C11 PolarHBondContact O-SG 3.21Å
8	L	80.9	Confident	73.9	Confident	109 Å²	109	109.1 Å²	109.1	57%	0.571	58%	0.581	S	S	*	*	H	α-helix	trans	-62.9	-42.3	177.7	-173.7	67.1	0	0	0	111.7	V4 E5 C11 L12	V4-L8 WeakPolarHBondContact O-CB 3.33Å; V4-L8 PolarHBondContact O-N 2.93Å; E5-L8 PolarHBondContact O-N 3.05Å; L8-C11 PolarHBondContact O-N 3.15Å; L8-L12 HydrophobicContact CG-CD1 4.24Å; L8-L12 WeakPolarHBondContact O-CB 3.2Å; L8-L12 VanDerWaalsContact O-CG 3.3Å; L8-L12 WeakPolarHBondContact O-CG 3.31Å; L8-L12 PolarHBondContact O-N 3.34Å
9	F	79.4	Confident	73.5	Confident	143 Å²	143	109.5 Å²	109.5	63%	0.627	58%	0.583	S	S	*	*	H	α-helix	trans	-63.8	-44.2	177.6	-170.1	-98.6	0	0	0	111.8	E5 M6 V7 L12 V13	E5-F9 WeakPolarHBondContact O-CB 3.45Å; E5-F9 PolarHBondContact O-N 3.1Å; M6-F9 PolarHBondContact O-N 3.24Å; V7-F9 PolarHBondContact O-N 3.35Å; F9-L12 PolarHBondContact O-N 3.03Å; F9-V13 HydrophobicContact CD1-CG2 4.15Å; F9-V13 HydrophobicContact CE1-CG2 3.87Å; F9-V13 HydrophobicContact CZ-CG2 4.23Å; F9-V13 WeakPolarHBondContact O-CG2 3.49Å; F9-V13 PolarHBondContact O-N 3.09Å
10	V	78.7	Confident	72.9	Confident	73 Å²	73	107.8 Å²	107.8	44%	0.442	58%	0.58	S	S	.	*	H	α-helix	trans	-63.4	-42.6	175.3	172.2	0	0	0	0	111	M6 V7 L12 V13 L14	M6-V10 VanDerWaalsContact O-CG2 3.28Å; M6-V10 WeakPolarHBondContact O-CG2 3.39Å; M6-V10 PolarHBondContact O-N 3.36Å; V7-V10 PolarHBondContact O-N 3.27Å; V10-L12 VanDerWaalsContact C-N 3.34Å; V10-L12 PolarHBondContact O-N 2.75Å; V10-V13 PolarHBondContact O-N 3.11Å; V10-L14 HydrophobicContact CG1-CD1 3.87Å; V10-L14 HydrophobicContact CG1-CG 4.34Å; V10-L14 WeakPolarHBondContact O-CB 3.38Å; V10-L14 VanDerWaalsContact O-CG 3.24Å; V10-L14 WeakPolarHBondContact O-CG 3.49Å; V10-L14 PolarHBondContact O-N 3.32Å
11	C	78.1	Confident	71.8	Confident	70 Å²	70	109.9 Å²	109.9	47%	0.473	59%	0.586	S	S	.	*	H	α-helix	trans	-61.8	-40	174.9	-73.8	0	0	0	0	112.5	V7 L8 L15	V7-C11 WeakPolarHBondContact O-CB 3.39Å; V7-C11 PolarHBondContact O-N 3.1Å; V7-C11 PolarHBondContact O-SG 3.21Å; L8-C11 PolarHBondContact O-N 3.15Å; C11-L15 WeakPolarHBondContact O-CB 3.39Å; C11-L15 PolarHBondContact O-N 3.2Å
12	L	81.8	Confident	71.4	Confident	93 Å²	93	107.7 Å²	107.7	49%	0.487	57%	0.574	S	S	.	*	H	α-helix	trans	-67.3	-42.8	176.6	-74.1	170.3	0	0	0	111.8	L8 F9 V10 L15 M16	L8-L12 HydrophobicContact CG-CD1 4.24Å; L8-L12 WeakPolarHBondContact O-CB 3.2Å; L8-L12 VanDerWaalsContact O-CG 3.3Å; L8-L12 WeakPolarHBondContact O-CG 3.31Å; L8-L12 PolarHBondContact O-N 3.34Å; F9-L12 PolarHBondContact O-N 3.03Å; V10-L12 VanDerWaalsContact C-N 3.34Å; V10-L12 PolarHBondContact O-N 2.75Å; L12-L15 PolarHBondContact O-N 3.13Å; L12-M16 WeakPolarHBondContact O-CB 3.34Å; L12-M16 WeakPolarHBondContact O-CG 3.48Å; L12-M16 PolarHBondContact O-N 3.48Å
13	V	80.9	Confident	70.8	Confident	69 Å²	69	106.3 Å²	106.3	42%	0.418	57%	0.574	S	S	.	*	H	α-helix	trans	-62.9	-44.4	175.6	172.4	0	0	0	0	110.7	F9 V10 M16 C17	F9-V13 HydrophobicContact CD1-CG2 4.15Å; F9-V13 HydrophobicContact CE1-CG2 3.87Å; F9-V13 HydrophobicContact CZ-CG2 4.23Å; F9-V13 WeakPolarHBondContact O-CG2 3.49Å; F9-V13 PolarHBondContact O-N 3.09Å; V10-V13 PolarHBondContact O-N 3.11Å; V13-M16 PolarHBondContact O-N 3.35Å; V13-C17 PolarHBondContact O-N 3Å; V13-C17 PolarHBondContact O-SG 2.94Å
14	L	75.9	Confident	69.9	Low	104 Å²	104	101.2 Å²	101.2	55%	0.545	57%	0.565	S	S	.	*	H	α-helix	trans	-64.7	-41.3	176.7	-69.4	173.2	0	0	0	111.9	V10 M16 C17 V18	V10-L14 HydrophobicContact CG1-CD1 3.87Å; V10-L14 HydrophobicContact CG1-CG 4.34Å; V10-L14 WeakPolarHBondContact O-CB 3.38Å; V10-L14 VanDerWaalsContact O-CG 3.24Å; V10-L14 WeakPolarHBondContact O-CG 3.49Å; V10-L14 PolarHBondContact O-N 3.32Å; L14-M16 VanDerWaalsContact C-N 3.34Å; L14-C17 PolarHBondContact O-N 2.53Å; L14-V18 VanDerWaalsContact O-CG2 3.32Å; L14-V18 WeakPolarHBondContact O-CG2 3.29Å; L14-V18 PolarHBondContact O-N 3.17Å
15	L	77.1	Confident	68.7	Low	95 Å²	95	100.9 Å²	100.9	50%	0.497	57%	0.567	S	S	.	*	H	α-helix	trans	-63.4	-41.7	175.7	-171.6	69.2	0	0	0	111	C11 L12 V18 L19	C11-L15 WeakPolarHBondContact O-CB 3.39Å; C11-L15 PolarHBondContact O-N 3.2Å; L12-L15 PolarHBondContact O-N 3.13Å; L15-V18 PolarHBondContact O-N 2.82Å; L15-L19 HydrophobicContact CD1-CD1 4.36Å; L15-L19 HydrophobicContact CD2-CD1 4.39Å; L15-L19 HydrophobicContact CG-CD1 3.85Å; L15-L19 HydrophobicContact CG-CG 4.38Å; L15-L19 WeakPolarHBondContact O-CB 3.46Å; L15-L19 WeakPolarHBondContact O-CG 3.46Å; L15-L19 PolarHBondContact O-N 3.01Å
16	M	76.1	Confident	67.2	Low	104 Å²	104	104.1 Å²	104.1	51%	0.512	58%	0.579	S	S	.	*	H	α-helix	trans	-67.4	-35.2	175.1	-68.9	-58.5	-68.6	0	0	112.1	L12 V13 L14 L19 S20	L12-M16 WeakPolarHBondContact O-CB 3.34Å; L12-M16 WeakPolarHBondContact O-CG 3.48Å; L12-M16 PolarHBondContact O-N 3.48Å; V13-M16 PolarHBondContact O-N 3.35Å; L14-M16 VanDerWaalsContact C-N 3.34Å; M16-L19 PolarHBondContact O-N 3.39Å; M16-S20 WeakPolarHBondContact O-CA 3.48Å; M16-S20 WeakPolarHBondContact O-CB 3.09Å; M16-S20 PolarHBondContact O-N 2.89Å; M16-S20 PolarHBondContact O-OG 3.2Å
17	C	71.6	Confident	66.3	Low	80 Å²	80	103.5 Å²	103.5	54%	0.541	58%	0.583	S	S	.	*	H	α-helix	trans	-64.3	-40.1	172.5	-72.8	0	0	0	0	112.1	V13 L14 Q21	V13-C17 PolarHBondContact O-N 3Å; V13-C17 PolarHBondContact O-SG 2.94Å; L14-C17 PolarHBondContact O-N 2.53Å; C17-Q21 PolarHBondContact O-N 3.09Å
18	V	69.5	Low	66	Low	100 Å²	100	104 Å²	104	61%	0.606	59%	0.586	S	S	*	*	H	α-helix	trans	-70.8	-37.8	177.1	174	0	0	0	0	111.3	L14 L15 Q21	L14-V18 VanDerWaalsContact O-CG2 3.32Å; L14-V18 WeakPolarHBondContact O-CG2 3.29Å; L14-V18 PolarHBondContact O-N 3.17Å; L15-V18 PolarHBondContact O-N 2.82Å; V18-Q21 WeakPolarHBondContact O-CB 3Å
19	L	66.8	Low	66	Low	118 Å²	118	100.1 Å²	100.1	62%	0.618	57%	0.569	S	S	*	*	H	α-helix	trans	-80	-25.9	178.7	-66.7	174.2	0	0	0	113.5	L15 M16	L15-L19 HydrophobicContact CD1-CD1 4.36Å; L15-L19 HydrophobicContact CD2-CD1 4.39Å; L15-L19 HydrophobicContact CG-CD1 3.85Å; L15-L19 HydrophobicContact CG-CG 4.38Å; L15-L19 WeakPolarHBondContact O-CB 3.46Å; L15-L19 WeakPolarHBondContact O-CG 3.46Å; L15-L19 PolarHBondContact O-N 3.01Å; M16-L19 PolarHBondContact O-N 3.39Å
20	S	60.5	Low	66.6	Low	75 Å²	75	94.2 Å²	94.2	52%	0.524	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	3.1	175.1	-53.3	0	0	0	0	112.6	M16 E22	M16-S20 WeakPolarHBondContact O-CA 3.48Å; M16-S20 WeakPolarHBondContact O-CB 3.09Å; M16-S20 PolarHBondContact O-N 2.89Å; M16-S20 PolarHBondContact O-OG 3.2Å; S20-E22 PolarHBondContact O-N 2.69Å
21	Q	50.9	Low	67.4	Low	152 Å²	152	96.6 Å²	96.6	71%	0.71	55%	0.545	S	S	*	.			trans	-72.3	70.7	163.4	-154.7	160.9	1.6	0	0	107.3	C17 V18	C17-Q21 PolarHBondContact O-N 3.09Å; V18-Q21 WeakPolarHBondContact O-CB 3Å
22	E	49.6	Very low	68.2	Low	137 Å²	137	94.3 Å²	94.3	64%	0.64	53%	0.526	S	S	*	.			trans	-40.1	127.3	158.6	-69	-74.4	147.2	0	0	105.4	S20 G24	S20-E22 PolarHBondContact O-N 2.69Å; E22-G24 PolarHBondContact O-N 2.93Å
23	P	45.6	Very low	69	Low	117 Å²	117	92.3 Å²	92.3	76%	0.76	52%	0.524	S	S	*	.			trans	-65.5	80.1	160.8	28.5	-29.4	0	0	0	104.2	S25	P23-S25 WeakPolarHBondContact O-CA 3.28Å; P23-S25 PolarHBondContact O-N 2.03Å
24	G	45.1	Very low	69.8	Low	55 Å²	55	89.1 Å²	89.1	57%	0.567	50%	0.504	S	S	*	.			trans	-48.3	112.4	-179.4	0	0	0	0	0	104	E22 K26	E22-G24 PolarHBondContact O-N 2.93Å; G24-K26 VanDerWaalsContact C-N 3.34Å; G24-K26 PolarHBondContact O-N 2.89Å
25	S	49	Very low	70.8	Confident	103 Å²	103	89.2 Å²	89.2	72%	0.72	50%	0.5	S	S	*	.			trans	-35.5	105.9	-166.9	172.9	0	0	0	0	106.2	P23 V27	P23-S25 WeakPolarHBondContact O-CA 3.28Å; P23-S25 PolarHBondContact O-N 2.03Å; S25-V27 PolarHBondContact O-N 3.48Å
26	K	44.3	Very low	71.7	Confident	181 Å²	181	84.9 Å²	84.9	79%	0.787	48%	0.477	S	S	*	.			trans	-60.5	105.3	178.3	-74.1	-173.5	-179.4	175.7	0	101.2	G24 V28	G24-K26 VanDerWaalsContact C-N 3.34Å; G24-K26 PolarHBondContact O-N 2.89Å; K26-V28 HydrophobicContact CB-CG2 3.94Å; K26-V28 WeakPolarHBondContact O-CG2 3.46Å; K26-V28 PolarHBondContact O-N 3.33Å
27	V	55.5	Low	72.5	Confident	111 Å²	111	81.2 Å²	81.2	67%	0.673	46%	0.46	S	S	*	.			trans	-66.7	84.2	171.4	178.5	0	0	0	0	102.6	S25 A29	S25-V27 PolarHBondContact O-N 3.48Å; V27-A29 PolarHBondContact O-N 2.96Å
28	V	67.8	Low	73.5	Confident	96 Å²	96	83 Å²	83	58%	0.582	46%	0.455	S	S	*	.			trans	-72.4	94	178.6	175.6	0	0	0	0	103.7	K26 D30	K26-V28 HydrophobicContact CB-CG2 3.94Å; K26-V28 WeakPolarHBondContact O-CG2 3.46Å; K26-V28 PolarHBondContact O-N 3.33Å; V28-D30 PolarHBondContact O-N 3Å
29	A	82.6	Confident	74.5	Confident	26 Å²	26	83.2 Å²	83.2	22%	0.215	46%	0.457	C	S	.	.			trans	-58.6	125.5	168.4	0	0	0	0	0	108.4	V27 N55 Y57	V27-A29 PolarHBondContact O-N 2.96Å; A29-N55 WeakPolarHBondContact CB-O 3.1Å; A29-Y57 HydrophobicContact CB-CD2 3.92Å; A29-Y57 HydrophobicContact CB-CE2 3.7Å
30	D	90.8	Very high	75.9	Confident	19 Å²	19	78.9 Å²	78.9	10%	0.102	44%	0.435	C	S	.	.			trans	-74.6	152.1	175	-68.8	-33.2	0	0	0	109.6	V28 Y32 D56 Y57 K166 P193	V28-D30 PolarHBondContact O-N 3Å; D30-Y32 HydrophobicContact CB-CE2 3.87Å; D30-D56 PolarHBondContact N-OD1 2.94Å; D30-D56 WeakPolarHBondContact O-CA 3.29Å; D30-D56 WeakPolarHBondContact O-CB 3.46Å; D30-Y57 PolarHBondContact O-N 2.88Å; D30-K166 IonicContact OD1-NZ 3.59Å; D30-K166 PolarHBondContact OD1-NZ 3.3Å; D30-K166 WeakPolarHBondContact OD2-CE 3.47Å; D30-K166 IonicContact OD2-NZ 2.9Å; D30-K166 PolarHBondContact OD2-NZ 3.11Å; D30-P193 HydrophobicContact CB-CB 4.28Å
31	R	95.3	Very high	77.5	Confident	123 Å²	123	80.1 Å²	80.1	46%	0.464	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	124.9	177.4	-63.2	-169.7	162.2	-97.6	-5.9	109.7	Y57 D59	R31-Y57 WeakPolarHBondContact CA-O 3.48Å; R31-Y57 HydrophobicContact CG-CD2 4.38Å; R31-D59 IonicContact CZ-OD2 3.13Å; R31-D59 IonicContact NH1-OD1 2.76Å; R31-D59 PolarHBondContact NH1-OD1 2.77Å; R31-D59 IonicContact NH1-OD2 3.37Å; R31-D59 PolarHBondContact NH1-OD2 2.9Å
32	Y	96.7	Very high	79.6	Confident	22 Å²	22	77.3 Å²	77.3	9%	0.086	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	110.7	-179.8	-63.1	-97	0	0	0	109.1	D30 I50 D51 V52 D56 Y57 D59	D30-Y32 HydrophobicContact CB-CE2 3.87Å; Y32-I50 HydrophobicContact CG-CD1 4.37Å; Y32-D51 PolarHBondContact OH-O 2.98Å; Y32-V52 HydrophobicContact CD1-CG1 4.5Å; Y32-V52 HydrophobicContact CD2-CG1 3.76Å; Y32-V52 HydrophobicContact CE1-CG1 4.48Å; Y32-V52 HydrophobicContact CE2-CB 4.21Å; Y32-V52 HydrophobicContact CE2-CG1 3.76Å; Y32-V52 HydrophobicContact CG-CG1 4.16Å; Y32-D56 HydrophobicContact CD2-CB 4.44Å; Y32-D56 HydrophobicContact CE2-CB 4Å; Y32-D56 WeakPolarHBondContact CE2-OD2 3.04Å; Y32-Y57 PolarHBondContact N-O 2.96Å; Y32-D59 PolarHBondContact O-N 3.38Å
33	A	97.3	Very high	81.8	Confident	52 Å²	52	71.4 Å²	71.4	43%	0.43	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	123.4	178	0	0	0	0	0	111.1	D59 Y61	A33-D59 CarbonylContact C-O 3.57Å; A33-D59 WeakPolarHBondContact CA-O 2.82Å; A33-Y61 HydrophobicContact CB-CD2 4.42Å; A33-Y61 HydrophobicContact CB-CE2 3.88Å
34	V	97.8	Very high	83.9	Confident	1 Å²	1	71.8 Å²	71.8	1%	0.006	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	111.7	178.1	177.1	0	0	0	0	109.9	W36 F43 Y48 L58 D59 V60 Y61 L154	V34-W36 HydrophobicContact CG1-CE3 4.06Å; V34-W36 PolarHBondContact O-N 3.26Å; V34-F43 HydrophobicContact CG1-CE2 4.15Å; V34-F43 HydrophobicContact CG1-CZ 3.87Å; V34-Y48 HydrophobicContact CG1-CE1 3.97Å; V34-L58 HydrophobicContact CB-CD1 4.09Å; V34-L58 HydrophobicContact CG2-CD1 3.53Å; V34-D59 PolarHBondContact N-O 2.03Å; V34-V60 CarbonylContact O-C 3.59Å; V34-V60 WeakPolarHBondContact O-CA 3.44Å; V34-Y61 PolarHBondContact O-N 3.32Å; V34-L154 HydrophobicContact CG2-CD2 4.35Å
35	F	97	Very high	86	Confident	107 Å²	107	79 Å²	79	47%	0.469	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	108.2	172.6	-62.9	-87.5	0	0	0	109.7	N37 N40 F43 Y61	F35-N37 PolarHBondContact O-N 2.89Å; F35-N40 PolarHBondContact O-ND2 2.74Å; F35-F43 WeakPolarHBondContact O-CE2 3.4Å; F35-Y61 HydrophobicContact CD1-CD2 4.46Å; F35-Y61 HydrophobicContact CD1-CG 4.23Å; F35-Y61 HydrophobicContact CE1-CD2 4.25Å; F35-Y61 HydrophobicContact CE1-CG 4.09Å; F35-Y61 HydrophobicContact CZ-CD2 4.47Å
36	W	96.6	Very high	87.9	Confident	3 Å²	3	75.1 Å²	75.1	1%	0.011	37%	0.374	C	S	.	.			trans	-92.5	78.7	-170.1	-160.6	-73	0	0	0	111.7	V34 F43 V60 Y61 P63 L79 S140 L152 L154	V34-W36 HydrophobicContact CG1-CE3 4.06Å; V34-W36 PolarHBondContact O-N 3.26Å; W36-F43 HydrophobicContact CD2-CE1 4.48Å; W36-F43 AromaticContact CD2-CZ 3.92Å; W36-F43 HydrophobicContact CD2-CZ 3.92Å; W36-F43 HydrophobicContact CE3-CE1 4.35Å; W36-F43 AromaticContact CE3-CZ 3.73Å; W36-F43 HydrophobicContact CE3-CZ 3.73Å; W36-F43 HydrophobicContact CG-CZ 4.46Å; W36-F43 HydrophobicContact CH2-CE1 4.26Å; W36-F43 HydrophobicContact CH2-CZ 4.44Å; W36-F43 HydrophobicContact CZ2-CE1 4.39Å; W36-F43 HydrophobicContact CZ3-CE1 4.25Å; W36-F43 HydrophobicContact CZ3-CZ 4.02Å; W36-V60 HydrophobicContact CB-CG1 3.69Å; W36-V60 HydrophobicContact CD2-CG1 4.24Å; W36-V60 HydrophobicContact CE3-CG1 3.86Å; W36-V60 HydrophobicContact CG-CG1 4.21Å; W36-Y61 PolarHBondContact N-O 2.79Å; W36-P63 WeakPolarHBondContact O-CD 3.18Å; W36-P63 WeakPolarHBondContact O-CG 3.27Å; W36-L79 HydrophobicContact CD2-CD1 4.06Å; W36-L79 HydrophobicContact CE3-CD1 4.1Å; W36-L79 HydrophobicContact CH2-CD1 3.57Å; W36-L79 HydrophobicContact CZ2-CD1 3.49Å; W36-L79 VanDerWaalsContact CZ2-CD1 3.49Å; W36-L79 HydrophobicContact CZ3-CD1 3.87Å; W36-S140 VanDerWaalsContact NE1-CB 3.28Å; W36-S140 PolarHBondContact NE1-OG 2.75Å; W36-L152 HydrophobicContact CZ2-CB 4.13Å; W36-L154 HydrophobicContact CH2-CB 3.72Å; W36-L154 HydrophobicContact CZ3-CB 3.6Å; W36-L154 HydrophobicContact CZ3-CD2 3.98Å; W36-L154 HydrophobicContact CZ3-CG 4.44Å
37	N	93.1	Very high	90.3	Very high	27 Å²	27	69.8 Å²	69.8	14%	0.144	35%	0.354	C	S	.	.	S	Bend	trans	-145.5	164.3	179	59	47.8	0	0	0	110.4	F35 T39 N40 P63	F35-N37 PolarHBondContact O-N 2.89Å; N37-T39 VanDerWaalsContact C-N 3.3Å; N37-T39 PolarHBondContact O-N 2.86Å; N37-T39 PolarHBondContact OD1-N 3.4Å; N37-T39 PolarHBondContact OD1-OG1 3.22Å; N37-N40 WeakPolarHBondContact OD1-CB 3.45Å; N37-N40 PolarHBondContact OD1-N 2.73Å; N37-P63 HydrophobicContact CB-CB 4.39Å; N37-P63 HydrophobicContact CB-CG 4.05Å
38	R	90.9	Very high	92.3	Very high	117 Å²	117	65.2 Å²	65.2	44%	0.442	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-22	179.7	-72.7	169	-178.9	-159.6	0.9	113.8	N40 H44 E75 Y77 T142 L152	R38-N40 VanDerWaalsContact C-N 3.31Å; R38-H44 PolarHBondContact O-CD2 2.73Å; R38-H44 PolarHBondContact O-NE2 3.14Å; R38-E75 PolarHBondContact N-OE2 3.47Å; R38-Y77 WeakPolarHBondContact CD-OH 3.36Å; R38-Y77 WeakPolarHBondContact CG-OH 3.27Å; R38-Y77 PolarHBondContact NE-OH 2.85Å; R38-Y77 VanDerWaalsContact NE-OH 3.13Å; R38-T142 PolarHBondContact NH2-OG1 3.25Å; R38-L152 HydrophobicContact CG-CD1 4.32Å; R38-L152 HydrophobicContact CG-CD2 4.09Å; R38-L152 HydrophobicContact CG-CG 4.49Å
39	T	91.7	Very high	93.7	Very high	106 Å²	106	63.1 Å²	63.1	65%	0.65	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-21.2	179.9	51.9	0	0	0	0	112.6	N37 T41	N37-T39 VanDerWaalsContact C-N 3.3Å; N37-T39 PolarHBondContact O-N 2.86Å; N37-T39 PolarHBondContact OD1-N 3.4Å; N37-T39 PolarHBondContact OD1-OG1 3.22Å; T39-T41 PolarHBondContact O-N 3.1Å
40	N	94.8	Very high	94.4	Very high	27 Å²	27	62 Å²	62	14%	0.144	30%	0.3	C	S	.	.			trans	-68.4	112.7	175.2	-179.9	-5.1	0	0	0	110.9	F35 N37 R38 K42 F43	F35-N40 PolarHBondContact O-ND2 2.74Å; N37-N40 WeakPolarHBondContact OD1-CB 3.45Å; N37-N40 PolarHBondContact OD1-N 2.73Å; R38-N40 VanDerWaalsContact C-N 3.31Å; N40-K42 PolarHBondContact O-N 3Å; N40-K42 VanDerWaalsContact O-N 3.11Å; N40-K42 WeakPolarHBondContact OD1-CB 3.25Å; N40-K42 WeakPolarHBondContact OD1-CG 3.35Å; N40-K42 PolarHBondContact OD1-N 3.33Å; N40-K42 VanDerWaalsContact OD1-N 3.09Å; N40-F43 HydrophobicContact CB-CD2 4.04Å; N40-F43 PolarHBondContact O-N 2.92Å
41	T	95.3	Very high	94.7	Very high	101 Å²	101	63.4 Å²	63.4	62%	0.62	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-58.7	-26.1	-176.1	55.8	0	0	0	0	113.5	T39 F43 H44	T39-T41 PolarHBondContact O-N 3.1Å; T41-F43 PolarHBondContact O-N 3.29Å; T41-H44 WeakPolarHBondContact O-CB 3.38Å; T41-H44 PolarHBondContact O-N 3.49Å; T41-H44 VanDerWaalsContact O-N 3.1Å
42	K	95.4	Very high	94.7	Very high	93 Å²	93	57.6 Å²	57.6	40%	0.404	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-61.5	-27.5	177.3	-61.4	-174.2	-180	-178.5	0	112.3	N40 Y48	N40-K42 PolarHBondContact O-N 3Å; N40-K42 VanDerWaalsContact O-N 3.11Å; N40-K42 WeakPolarHBondContact OD1-CB 3.25Å; N40-K42 WeakPolarHBondContact OD1-CG 3.35Å; N40-K42 PolarHBondContact OD1-N 3.33Å; N40-K42 VanDerWaalsContact OD1-N 3.09Å; K42-Y48 HydrophobicContact CB-CD1 3.59Å; K42-Y48 HydrophobicContact CB-CD2 4.04Å; K42-Y48 HydrophobicContact CB-CE1 3.6Å; K42-Y48 HydrophobicContact CB-CE2 4.08Å; K42-Y48 HydrophobicContact CB-CG 3.84Å; K42-Y48 HydrophobicContact CD-CD2 4.36Å; K42-Y48 HydrophobicContact CD-CE1 3.86Å; K42-Y48 HydrophobicContact CD-CE2 3.61Å; K42-Y48 VanDerWaalsContact CD-OH 3.25Å; K42-Y48 WeakPolarHBondContact CD-OH 3.46Å; K42-Y48 HydrophobicContact CG-CE1 4.38Å; K42-Y48 HydrophobicContact CG-CE2 4.42Å; K42-Y48 WeakPolarHBondContact O-CB 3.42Å
43	F	94.4	Very high	94.7	Very high	12 Å²	12	57 Å²	57	5%	0.053	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-85.4	-13	177.5	-73.3	-73.7	0	0	0	114.5	V34 F35 W36 N40 T41 R45 G46 Y48 L152 K153 L154	V34-F43 HydrophobicContact CG1-CE2 4.15Å; V34-F43 HydrophobicContact CG1-CZ 3.87Å; F35-F43 WeakPolarHBondContact O-CE2 3.4Å; W36-F43 HydrophobicContact CD2-CE1 4.48Å; W36-F43 AromaticContact CD2-CZ 3.92Å; W36-F43 HydrophobicContact CD2-CZ 3.92Å; W36-F43 HydrophobicContact CE3-CE1 4.35Å; W36-F43 AromaticContact CE3-CZ 3.73Å; W36-F43 HydrophobicContact CE3-CZ 3.73Å; W36-F43 HydrophobicContact CG-CZ 4.46Å; W36-F43 HydrophobicContact CH2-CE1 4.26Å; W36-F43 HydrophobicContact CH2-CZ 4.44Å; W36-F43 HydrophobicContact CZ2-CE1 4.39Å; W36-F43 HydrophobicContact CZ3-CE1 4.25Å; W36-F43 HydrophobicContact CZ3-CZ 4.02Å; N40-F43 HydrophobicContact CB-CD2 4.04Å; N40-F43 PolarHBondContact O-N 2.92Å; T41-F43 PolarHBondContact O-N 3.29Å; F43-R45 VanDerWaalsContact C-N 3.32Å; F43-R45 PolarHBondContact O-N 3.22Å; F43-G46 PolarHBondContact O-N 3.3Å; F43-G46 VanDerWaalsContact O-N 3.1Å; F43-Y48 AromaticContact CD1-CD1 3.94Å; F43-Y48 HydrophobicContact CD1-CD1 3.94Å; F43-Y48 HydrophobicContact CD2-CD1 4.08Å; F43-Y48 HydrophobicContact CD2-CE1 4.45Å; F43-Y48 AromaticContact CE1-CD1 3.7Å; F43-Y48 HydrophobicContact CE1-CD1 3.7Å; F43-Y48 HydrophobicContact CE1-CE1 4.49Å; F43-Y48 AromaticContact CE2-CD1 3.82Å; F43-Y48 HydrophobicContact CE2-CD1 3.82Å; F43-Y48 AromaticContact CE2-CE1 3.95Å; F43-Y48 HydrophobicContact CE2-CE1 3.95Å; F43-Y48 HydrophobicContact CG-CD1 4.13Å; F43-Y48 AromaticContact CZ-CD1 3.64Å; F43-Y48 HydrophobicContact CZ-CD1 3.64Å; F43-Y48 AromaticContact CZ-CE1 3.98Å; F43-Y48 HydrophobicContact CZ-CE1 3.98Å; F43-L152 HydrophobicContact CB-CD2 3.75Å; F43-L152 HydrophobicContact CD1-CB 4.02Å; F43-L152 HydrophobicContact CD1-CD2 4.37Å; F43-L152 HydrophobicContact CE1-CB 4.25Å; F43-L152 HydrophobicContact CG-CB 4.44Å; F43-L152 HydrophobicContact CG-CD2 4.05Å; F43-K153 WeakPolarHBondContact CD1-O 3.45Å; F43-K153 WeakPolarHBondContact CE1-O 3.4Å; F43-L154 HydrophobicContact CE1-CB 4.45Å
44	H	90.7	Very high	94.5	Very high	126 Å²	126	55.9 Å²	55.9	58%	0.583	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-35.2	-171.5	-69.5	177.1	0	0	0	113.5	R38 T41 G46	R38-H44 PolarHBondContact O-CD2 2.73Å; R38-H44 PolarHBondContact O-NE2 3.14Å; T41-H44 WeakPolarHBondContact O-CB 3.38Å; T41-H44 PolarHBondContact O-N 3.49Å; T41-H44 VanDerWaalsContact O-N 3.1Å; H44-G46 VanDerWaalsContact C-N 3.34Å
45	R	89.2	Confident	94.2	Very high	207 Å²	207	58.9 Å²	58.9	78%	0.781	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-16	178.1	-69	-178.7	-174.7	178.4	2.3	113.2	F43 D47	F43-R45 VanDerWaalsContact C-N 3.32Å; F43-R45 PolarHBondContact O-N 3.22Å; R45-D47 WeakPolarHBondContact CB-OD1 3.44Å; R45-D47 PolarHBondContact O-N 2.99Å
46	G	89.6	Confident	94.2	Very high	21 Å²	21	54.1 Å²	54.1	22%	0.216	27%	0.266	C	S	.	.	S	Bend	trans	69.8	12.1	-176.6	0	0	0	0	0	114.6	F43 H44 Y87 K153	F43-G46 PolarHBondContact O-N 3.3Å; F43-G46 VanDerWaalsContact O-N 3.1Å; H44-G46 VanDerWaalsContact C-N 3.34Å; G46-Y87 PolarHBondContact O-OH 2.8Å; G46-K153 WeakPolarHBondContact O-CE 3.39Å
47	D	94.1	Very high	94.1	Very high	68 Å²	68	56.9 Å²	56.9	36%	0.364	28%	0.277	S	S	.	.			trans	-112.2	16.5	180	64.9	-12	0	0	0	112.6	R45 H49	R45-D47 WeakPolarHBondContact CB-OD1 3.44Å; R45-D47 PolarHBondContact O-N 2.99Å; D47-H49 PolarHBondContact O-N 2.77Å; D47-H49 VanDerWaalsContact O-N 3.11Å; D47-H49 PolarHBondContact O-ND1 2.96Å
48	Y	97.3	Very high	94.4	Very high	16 Å²	16	55.6 Å²	55.6	6%	0.063	27%	0.27	C	S	.	.			trans	-59	120.2	-179.1	-164.4	-176.6	0	0	0	110.1	V34 K42 F43 I50 L154 K155	V34-Y48 HydrophobicContact CG1-CE1 3.97Å; K42-Y48 HydrophobicContact CB-CD1 3.59Å; K42-Y48 HydrophobicContact CB-CD2 4.04Å; K42-Y48 HydrophobicContact CB-CE1 3.6Å; K42-Y48 HydrophobicContact CB-CE2 4.08Å; K42-Y48 HydrophobicContact CB-CG 3.84Å; K42-Y48 HydrophobicContact CD-CD2 4.36Å; K42-Y48 HydrophobicContact CD-CE1 3.86Å; K42-Y48 HydrophobicContact CD-CE2 3.61Å; K42-Y48 VanDerWaalsContact CD-OH 3.25Å; K42-Y48 WeakPolarHBondContact CD-OH 3.46Å; K42-Y48 HydrophobicContact CG-CE1 4.38Å; K42-Y48 HydrophobicContact CG-CE2 4.42Å; K42-Y48 WeakPolarHBondContact O-CB 3.42Å; F43-Y48 AromaticContact CD1-CD1 3.94Å; F43-Y48 HydrophobicContact CD1-CD1 3.94Å; F43-Y48 HydrophobicContact CD2-CD1 4.08Å; F43-Y48 HydrophobicContact CD2-CE1 4.45Å; F43-Y48 AromaticContact CE1-CD1 3.7Å; F43-Y48 HydrophobicContact CE1-CD1 3.7Å; F43-Y48 HydrophobicContact CE1-CE1 4.49Å; F43-Y48 AromaticContact CE2-CD1 3.82Å; F43-Y48 HydrophobicContact CE2-CD1 3.82Å; F43-Y48 AromaticContact CE2-CE1 3.95Å; F43-Y48 HydrophobicContact CE2-CE1 3.95Å; F43-Y48 HydrophobicContact CG-CD1 4.13Å; F43-Y48 AromaticContact CZ-CD1 3.64Å; F43-Y48 HydrophobicContact CZ-CD1 3.64Å; F43-Y48 AromaticContact CZ-CE1 3.98Å; F43-Y48 HydrophobicContact CZ-CE1 3.98Å; Y48-I50 HydrophobicContact CE2-CG2 4.08Å; Y48-L154 HydrophobicContact CD1-CD1 4.19Å; Y48-L154 HydrophobicContact CD2-CD1 4.19Å; Y48-L154 HydrophobicContact CE2-CD1 4.48Å; Y48-L154 HydrophobicContact CG-CD1 4Å; Y48-L154 WeakPolarHBondContact O-CA 3.45Å; Y48-K155 PolarHBondContact O-N 2.8Å
49	H	97.6	Very high	94.7	Very high	51 Å²	51	50.4 Å²	50.4	24%	0.236	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	157.4	175.8	65.5	-81.2	0	0	0	112.3	D47 K155	D47-H49 PolarHBondContact O-N 2.77Å; D47-H49 VanDerWaalsContact O-N 3.11Å; D47-H49 PolarHBondContact O-ND1 2.96Å; H49-K155 CarbonylContact C-O 3.54Å; H49-K155 WeakPolarHBondContact CA-O 3.47Å; H49-K155 HydrophobicContact CB-CB 3.91Å; H49-K155 WeakPolarHBondContact CB-O 3.45Å
50	I	97.5	Very high	95	Very high	4 Å²	4	45.5 Å²	45.5	2%	0.021	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	146.5	172.5	59.2	174	0	0	0	109.9	Y32 Y48 V52 L58 L154 K155 V156 F157	Y32-I50 HydrophobicContact CG-CD1 4.37Å; Y48-I50 HydrophobicContact CE2-CG2 4.08Å; I50-V52 HydrophobicContact CD1-CG1 3.85Å; I50-V52 HydrophobicContact CG1-CG1 4.07Å; I50-L58 HydrophobicContact CD1-CD1 3.9Å; I50-L154 HydrophobicContact CD1-CD2 4.47Å; I50-L154 HydrophobicContact CG1-CD1 4.38Å; I50-L154 HydrophobicContact CG2-CD1 4.49Å; I50-K155 PolarHBondContact N-O 3.41Å; I50-V156 HydrophobicContact CD1-CG1 4.5Å; I50-V156 HydrophobicContact CD1-CG2 4.09Å; I50-V156 HydrophobicContact CG1-CB 4.37Å; I50-V156 HydrophobicContact CG1-CG1 4.18Å; I50-V156 HydrophobicContact CG1-CG2 3.9Å; I50-V156 WeakPolarHBondContact O-CA 3.08Å; I50-F157 PolarHBondContact O-N 3.44Å
51	D	96.6	Very high	95.1	Very high	48 Å²	48	47 Å²	47	26%	0.257	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	117.6	175.8	-63.8	-23.6	0	0	0	108.9	Y32 F157 R159	Y32-D51 PolarHBondContact OH-O 2.98Å; D51-F157 WeakPolarHBondContact CA-O 3.41Å; D51-F157 WeakPolarHBondContact OD1-CB 3.22Å; D51-R159 HydrophobicContact CB-CG 4.02Å
52	V	95.9	Very high	95.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	158.6	-173.4	-57.4	0	0	0	0	110.6	Y32 I50 D56 F118 V156 F157 V158 R159	Y32-V52 HydrophobicContact CD1-CG1 4.5Å; Y32-V52 HydrophobicContact CD2-CG1 3.76Å; Y32-V52 HydrophobicContact CE1-CG1 4.48Å; Y32-V52 HydrophobicContact CE2-CB 4.21Å; Y32-V52 HydrophobicContact CE2-CG1 3.76Å; Y32-V52 HydrophobicContact CG-CG1 4.16Å; I50-V52 HydrophobicContact CD1-CG1 3.85Å; I50-V52 HydrophobicContact CG1-CG1 4.07Å; V52-D56 HydrophobicContact CB-CB 4.36Å; V52-F118 HydrophobicContact CB-CD2 3.96Å; V52-F118 HydrophobicContact CB-CE2 4.03Å; V52-F118 HydrophobicContact CG1-CD2 4.3Å; V52-F118 HydrophobicContact CG1-CE2 3.86Å; V52-F118 HydrophobicContact CG1-CZ 4.4Å; V52-F118 HydrophobicContact CG2-CD1 4Å; V52-F118 HydrophobicContact CG2-CD2 3.63Å; V52-F118 HydrophobicContact CG2-CE1 4.14Å; V52-F118 HydrophobicContact CG2-CE2 3.76Å; V52-F118 HydrophobicContact CG2-CG 3.76Å; V52-F118 HydrophobicContact CG2-CZ 4.04Å; V52-V156 HydrophobicContact CB-CG1 4.49Å; V52-V156 HydrophobicContact CG1-CG1 4.12Å; V52-V156 HydrophobicContact CG2-CG1 3.54Å; V52-F157 PolarHBondContact N-O 2.85Å; V52-V158 HydrophobicContact CG2-CB 4.47Å; V52-V158 HydrophobicContact CG2-CG2 3.91Å; V52-V158 CarbonylContact O-C 3.54Å; V52-V158 WeakPolarHBondContact O-CA 3.2Å; V52-R159 WeakPolarHBondContact O-CB 3.32Å; V52-R159 PolarHBondContact O-N 3.21Å
53	C	95.1	Very high	95.1	Very high	10 Å²	10	38.3 Å²	38.3	7%	0.068	18%	0.18	C	C	.	.			trans	-101.1	162.2	170.5	-74	0	0	0	0	112.1	N55 D56 R159 C164	C53-N55 PolarHBondContact O-N 3.25Å; C53-D56 WeakPolarHBondContact CB-OD2 3.45Å; C53-D56 PolarHBondContact N-OD2 2.95Å; C53-D56 VanDerWaalsContact O-CB 3.29Å; C53-D56 WeakPolarHBondContact O-CB 3.06Å; C53-D56 PolarHBondContact O-N 2.79Å; C53-D56 VanDerWaalsContact O-N 3.13Å; C53-R159 PolarHBondContact SG-NH2 3.35Å; C53-C164 WeakPolarHBondContact CA-SG 3.46Å; C53-C164 HydrophobicContact CB-CB 3.77Å; C53-C164 WeakPolarHBondContact CB-SG 3.24Å; C53-C164 WeakPolarHBondContact SG-CA 3.45Å; C53-C164 WeakPolarHBondContact SG-CB 3.46Å; C53-C164 CovalentContact SG-SG 2.03Å; C53-C164 PolarHBondContact SG-SG 3.03Å
54	I	93.4	Very high	95.1	Very high	29 Å²	29	40.4 Å²	40.4	15%	0.149	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	137.6	168.5	-66.4	-63.7	0	0	0	108.9	D56 F118 L120 F130 P132 V158	I54-D56 VanDerWaalsContact C-N 3.28Å; I54-F118 CarbonylContact C-O 3.54Å; I54-F118 WeakPolarHBondContact CA-O 3.49Å; I54-L120 HydrophobicContact CD1-CD2 3.92Å; I54-L120 HydrophobicContact CD1-CG 4.28Å; I54-L120 HydrophobicContact CG1-CD2 4.3Å; I54-L120 HydrophobicContact CG2-CD1 4.37Å; I54-L120 HydrophobicContact CG2-CG 3.97Å; I54-F130 HydrophobicContact CD1-CB 4.41Å; I54-P132 HydrophobicContact CD1-CG 4.26Å; I54-P132 HydrophobicContact CG1-CG 3.86Å; I54-V158 HydrophobicContact CD1-CG1 3.61Å; I54-V158 HydrophobicContact CG1-CG1 4.03Å
55	N	92.8	Very high	95.2	Very high	63 Å²	63	36.9 Å²	36.9	34%	0.337	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	76	-6	-173.2	-55.9	-51	0	0	0	116.5	A29 C53 Y57 F118	A29-N55 WeakPolarHBondContact CB-O 3.1Å; C53-N55 PolarHBondContact O-N 3.25Å; N55-Y57 WeakPolarHBondContact O-CE2 3.31Å; N55-F118 PolarHBondContact N-O 3.13Å
56	D	95.4	Very high	94.9	Very high	7 Å²	7	35.4 Å²	35.4	4%	0.037	17%	0.174	C	C	.	.			trans	-65.4	165.5	169.3	-70.7	-11.3	0	0	0	111.3	D30 Y32 V52 C53 I54 F118	D30-D56 PolarHBondContact N-OD1 2.94Å; D30-D56 WeakPolarHBondContact O-CA 3.29Å; D30-D56 WeakPolarHBondContact O-CB 3.46Å; Y32-D56 HydrophobicContact CD2-CB 4.44Å; Y32-D56 HydrophobicContact CE2-CB 4Å; Y32-D56 WeakPolarHBondContact CE2-OD2 3.04Å; V52-D56 HydrophobicContact CB-CB 4.36Å; C53-D56 WeakPolarHBondContact CB-OD2 3.45Å; C53-D56 PolarHBondContact N-OD2 2.95Å; C53-D56 VanDerWaalsContact O-CB 3.29Å; C53-D56 WeakPolarHBondContact O-CB 3.06Å; C53-D56 PolarHBondContact O-N 2.79Å; C53-D56 VanDerWaalsContact O-N 3.13Å; I54-D56 VanDerWaalsContact C-N 3.28Å; D56-F118 HydrophobicContact CB-CD2 4.36Å; D56-F118 WeakPolarHBondContact O-CD2 3.32Å; D56-F118 PolarHBondContact O-N 3.42Å
57	Y	96.3	Very high	94.5	Very high	61 Å²	61	40.2 Å²	40.2	24%	0.239	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	139.6	178.3	-61.6	-96.7	0	0	0	111.6	A29 D30 R31 Y32 N55 E116 K117	A29-Y57 HydrophobicContact CB-CD2 3.92Å; A29-Y57 HydrophobicContact CB-CE2 3.7Å; D30-Y57 PolarHBondContact O-N 2.88Å; R31-Y57 WeakPolarHBondContact CA-O 3.48Å; R31-Y57 HydrophobicContact CG-CD2 4.38Å; Y32-Y57 PolarHBondContact N-O 2.96Å; N55-Y57 WeakPolarHBondContact O-CE2 3.31Å; Y57-E116 CarbonylContact C-O 3.57Å; Y57-E116 VanDerWaalsContact CA-O 3.28Å; Y57-E116 WeakPolarHBondContact CA-O 3.41Å; Y57-K117 HydrophobicContact CD1-CB 3.9Å; Y57-K117 HydrophobicContact CD1-CG 4.1Å; Y57-K117 HydrophobicContact CE1-CB 3.72Å; Y57-K117 HydrophobicContact CE1-CD 3.79Å; Y57-K117 HydrophobicContact CE1-CG 3.66Å
58	L	97.5	Very high	93.6	Very high	1 Å²	1	43 Å²	43	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	118.5	163.8	167	62.7	0	0	0	108.3	V34 I50 V60 S115 E116 F118 Y138 L154 V156	V34-L58 HydrophobicContact CB-CD1 4.09Å; V34-L58 HydrophobicContact CG2-CD1 3.53Å; I50-L58 HydrophobicContact CD1-CD1 3.9Å; L58-V60 HydrophobicContact CD1-CG2 4.03Å; L58-V60 HydrophobicContact CD2-CG2 4.02Å; L58-V60 HydrophobicContact CG-CG2 3.79Å; L58-S115 CarbonylContact O-C 3.55Å; L58-S115 WeakPolarHBondContact O-CA 3.02Å; L58-E116 HydrophobicContact CB-CB 4.35Å; L58-E116 PolarHBondContact N-O 3.22Å; L58-E116 PolarHBondContact O-N 2.89Å; L58-F118 HydrophobicContact CB-CE2 3.61Å; L58-F118 HydrophobicContact CB-CZ 3.72Å; L58-F118 HydrophobicContact CD2-CZ 4.21Å; L58-Y138 HydrophobicContact CD2-CE2 4.48Å; L58-L154 HydrophobicContact CD1-CD2 4.4Å; L58-L154 HydrophobicContact CD2-CD2 4.09Å; L58-V156 HydrophobicContact CD2-CG2 4.42Å
59	D	97.6	Very high	93.1	Very high	7 Å²	7	43.7 Å²	43.7	4%	0.037	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	104.3	174.3	-73.4	-40.6	0	0	0	108.7	R31 Y32 A33 V34 Y61 K113 F114 S115	R31-D59 IonicContact CZ-OD2 3.13Å; R31-D59 IonicContact NH1-OD1 2.76Å; R31-D59 PolarHBondContact NH1-OD1 2.77Å; R31-D59 IonicContact NH1-OD2 3.37Å; R31-D59 PolarHBondContact NH1-OD2 2.9Å; Y32-D59 PolarHBondContact O-N 3.38Å; A33-D59 CarbonylContact C-O 3.57Å; A33-D59 WeakPolarHBondContact CA-O 2.82Å; V34-D59 PolarHBondContact N-O 2.03Å; D59-Y61 HydrophobicContact CB-CE2 3.91Å; D59-K113 HydrophobicContact CB-CD 4.24Å; D59-K113 HydrophobicContact CB-CG 4.47Å; D59-F114 CarbonylContact C-O 3.55Å; D59-F114 WeakPolarHBondContact CA-O 2.97Å; D59-S115 VanDerWaalsContact OD1-CB 3.29Å; D59-S115 WeakPolarHBondContact OD1-CB 3.49Å; D59-S115 PolarHBondContact OD1-OG 3.18Å
60	V	97.9	Very high	92.6	Very high	4 Å²	4	44.6 Å²	44.6	2%	0.024	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	122	176.5	-174.1	0	0	0	0	109.6	V34 W36 L58 L79 K113 F114	V34-V60 CarbonylContact O-C 3.59Å; V34-V60 WeakPolarHBondContact O-CA 3.44Å; W36-V60 HydrophobicContact CB-CG1 3.69Å; W36-V60 HydrophobicContact CD2-CG1 4.24Å; W36-V60 HydrophobicContact CE3-CG1 3.86Å; W36-V60 HydrophobicContact CG-CG1 4.21Å; L58-V60 HydrophobicContact CD1-CG2 4.03Å; L58-V60 HydrophobicContact CD2-CG2 4.02Å; L58-V60 HydrophobicContact CG-CG2 3.79Å; V60-L79 HydrophobicContact CG1-CD2 4.5Å; V60-L79 HydrophobicContact CG2-CD2 4.44Å; V60-K113 WeakPolarHBondContact O-CA 3.38Å; V60-F114 HydrophobicContact CB-CB 4.4Å; V60-F114 HydrophobicContact CB-CD1 4.36Å; V60-F114 HydrophobicContact CG2-CD1 4.22Å; V60-F114 PolarHBondContact N-O 3.38Å; V60-F114 PolarHBondContact O-N 3.11Å
61	Y	97.4	Very high	92	Very high	57 Å²	57	50.1 Å²	50.1	22%	0.224	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	123.6	177.5	-66.3	-90.5	0	0	0	110.4	A33 V34 F35 W36 D59 P111 K113	A33-Y61 HydrophobicContact CB-CD2 4.42Å; A33-Y61 HydrophobicContact CB-CE2 3.88Å; V34-Y61 PolarHBondContact O-N 3.32Å; F35-Y61 HydrophobicContact CD1-CD2 4.46Å; F35-Y61 HydrophobicContact CD1-CG 4.23Å; F35-Y61 HydrophobicContact CE1-CD2 4.25Å; F35-Y61 HydrophobicContact CE1-CG 4.09Å; F35-Y61 HydrophobicContact CZ-CD2 4.47Å; W36-Y61 PolarHBondContact N-O 2.79Å; D59-Y61 HydrophobicContact CB-CE2 3.91Å; Y61-P111 HydrophobicContact CD1-CB 4.34Å; Y61-P111 HydrophobicContact CD1-CG 3.95Å; Y61-K113 HydrophobicContact CD1-CB 4.28Å; Y61-K113 HydrophobicContact CD1-CD 4.5Å; Y61-K113 HydrophobicContact CD1-CG 4.23Å; Y61-K113 HydrophobicContact CE1-CB 4.23Å; Y61-K113 HydrophobicContact CE1-CD 3.73Å; Y61-K113 HydrophobicContact CE1-CG 3.95Å; Y61-K113 HydrophobicContact CE2-CD 4.48Å
62	C	95.9	Very high	91.4	Very high	7 Å²	7	56 Å²	56	5%	0.047	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-70	158.3	175.6	-66.6	0	0	0	0	112	H64 C102 P111 L112	C62-H64 PolarHBondContact O-N 2.76Å; C62-C102 VanDerWaalsContact CA-SG 3.59Å; C62-C102 HydrophobicContact CB-CB 3.57Å; C62-C102 WeakPolarHBondContact CB-SG 3.34Å; C62-C102 WeakPolarHBondContact SG-CA 3.38Å; C62-C102 WeakPolarHBondContact SG-CB 3.47Å; C62-C102 CovalentContact SG-SG 2.03Å; C62-C102 PolarHBondContact SG-SG 2.73Å; C62-P111 WeakPolarHBondContact O-CB 3.43Å; C62-L112 HydrophobicContact CB-CB 3.97Å; C62-L112 WeakPolarHBondContact CB-O 3.38Å; C62-L112 PolarHBondContact N-O 3.31Å
63	P	95.3	Very high	91	Very high	5 Å²	5	64.9 Å²	64.9	3%	0.032	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-56.5	134.8	169.9	-18.7	29.6	0	0	0	111.1	W36 N37 Y65 E75 Y77	W36-P63 WeakPolarHBondContact O-CD 3.18Å; W36-P63 WeakPolarHBondContact O-CG 3.27Å; N37-P63 HydrophobicContact CB-CB 4.39Å; N37-P63 HydrophobicContact CB-CG 4.05Å; P63-Y65 HydrophobicContact CB-CE2 3.93Å; P63-E75 HydrophobicContact CB-CB 4.01Å; P63-E75 HydrophobicContact CG-CB 3.81Å; P63-Y77 HydrophobicContact CG-CD2 3.86Å; P63-Y77 HydrophobicContact CG-CE2 3.77Å
64	H	94.5	Very high	90.8	Very high	57 Å²	57	65.1 Å²	65.1	26%	0.264	32%	0.318	S	S	.	.			trans	-137.2	141.8	180	-178.6	58.2	0	0	0	110.4	C62 P105 S107 P111	C62-H64 PolarHBondContact O-N 2.76Å; H64-P105 WeakPolarHBondContact CA-O 3.48Å; H64-P105 PolarHBondContact ND1-O 2.9Å; H64-S107 PolarHBondContact CE1-O 2.9Å; H64-P111 HydrophobicContact CB-CB 3.77Å
65	Y	92.5	Very high	90.7	Very high	51 Å²	51	65.5 Å²	65.5	20%	0.2	32%	0.32	C	S	.	.			trans	-134.9	123	-176.1	-54.4	-93.8	0	0	0	109	P63 V69 T74 E75 P105 H106	P63-Y65 HydrophobicContact CB-CE2 3.93Å; Y65-V69 HydrophobicContact CD1-CB 4.47Å; Y65-V69 HydrophobicContact CD1-CG1 4.48Å; Y65-V69 HydrophobicContact CD1-CG2 4.1Å; Y65-V69 HydrophobicContact CG-CG2 4.4Å; Y65-T74 HydrophobicContact CD2-CG2 3.95Å; Y65-T74 HydrophobicContact CE2-CG2 4.15Å; Y65-T74 HydrophobicContact CG-CG2 4.39Å; Y65-E75 WeakPolarHBondContact OH-CG 3.13Å; Y65-E75 PolarHBondContact OH-N 2.83Å; Y65-P105 HydrophobicContact CD2-CB 3.81Å; Y65-P105 HydrophobicContact CE2-CB 4.19Å; Y65-P105 PolarHBondContact N-O 2.84Å; Y65-P105 VanDerWaalsContact N-O 3.1Å; Y65-H106 PolarHBondContact O-ND1 2.54Å
66	E	83.4	Confident	90.6	Very high	177 Å²	177	67.6 Å²	67.6	83%	0.827	32%	0.323	S	S	*	.	S	Bend	trans	-80.2	-41.7	-176.6	-64.2	-178.8	173.1	0	0	112.2
67	D	80.5	Confident	90.4	Very high	121 Å²	121	67.8 Å²	67.8	65%	0.647	32%	0.323	S	S	*	.	S	Bend	trans	-82.3	162	179.3	-70.5	-41.6	0	0	0	112.4	V69	D67-V69 PolarHBondContact O-N 3.44Å
68	P	75	Confident	90.3	Very high	126 Å²	126	66.5 Å²	66.5	82%	0.818	32%	0.322	S	S	*	.			trans	-68.1	74.4	172.7	29.1	-34.9	0	0	0	110.8
69	V	86.9	Confident	90.2	Very high	32 Å²	32	66.7 Å²	66.7	19%	0.194	32%	0.323	C	S	.	.			trans	-76.1	126.8	167.4	180	0	0	0	0	107.2	Y65 D67 R73 T74	Y65-V69 HydrophobicContact CD1-CB 4.47Å; Y65-V69 HydrophobicContact CD1-CG1 4.48Å; Y65-V69 HydrophobicContact CD1-CG2 4.1Å; Y65-V69 HydrophobicContact CG-CG2 4.4Å; D67-V69 PolarHBondContact O-N 3.44Å; V69-R73 HydrophobicContact CG1-CB 3.65Å; V69-T74 HydrophobicContact CB-CG2 4.24Å; V69-T74 HydrophobicContact CG1-CG2 4.04Å
70	P	87.8	Confident	90	Very high	70 Å²	70	68.3 Å²	68.3	46%	0.455	33%	0.329	S	S	.	.			trans	-54.1	143.3	176.6	-25.5	33.4	0	0	0	111.6	E72 R73 T74	P70-E72 VanDerWaalsContact CB-OE2 3.29Å; P70-E72 WeakPolarHBondContact CB-OE2 3.5Å; P70-E72 PolarHBondContact O-N 3.49Å; P70-E72 VanDerWaalsContact O-N 3.09Å; P70-R73 WeakPolarHBondContact O-CB 3.4Å; P70-R73 PolarHBondContact O-N 2.89Å; P70-T74 PolarHBondContact O-N 3.47Å
71	E	83.9	Confident	89.9	Confident	119 Å²	119	68.4 Å²	68.4	56%	0.556	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-56.6	-33	-175.2	-68.5	-160.4	-179.9	0	0	112.4	R73 T74 R76	E71-R73 PolarHBondContact O-N 2.84Å; E71-T74 PolarHBondContact O-N 3.41Å; E71-T74 PolarHBondContact O-OG1 3.38Å; E71-R76 IonicContact OE1-NH2 2.74Å; E71-R76 IonicContact OE2-CZ 2.91Å; E71-R76 IonicContact OE2-NH1 2.73Å; E71-R76 IonicContact OE2-NH2 3.19Å; E71-R76 PolarHBondContact OE2-NH2 2.9Å
72	E	85.1	Confident	89.8	Confident	171 Å²	171	66.3 Å²	66.3	80%	0.799	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-63.1	-23.4	178.7	-58.5	74.9	-160.5	0	0	112.9	P70	P70-E72 VanDerWaalsContact CB-OE2 3.29Å; P70-E72 WeakPolarHBondContact CB-OE2 3.5Å; P70-E72 PolarHBondContact O-N 3.49Å; P70-E72 VanDerWaalsContact O-N 3.09Å
73	R	86.6	Confident	89.8	Confident	188 Å²	188	68.3 Å²	68.3	71%	0.709	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-97.5	-7.3	177.1	-74.3	-174.4	50.4	167.1	-6.4	113.1	V69 P70 E71	V69-R73 HydrophobicContact CG1-CB 3.65Å; P70-R73 WeakPolarHBondContact O-CB 3.4Å; P70-R73 PolarHBondContact O-N 2.89Å; E71-R73 PolarHBondContact O-N 2.84Å
74	T	90.5	Very high	89.8	Confident	14 Å²	14	74.6 Å²	74.6	9%	0.086	36%	0.356	C	S	.	.	S	Bend	trans	-85.6	133.3	178.5	65.6	0	0	0	0	111	Y65 V69 P70 E71 P105	Y65-T74 HydrophobicContact CD2-CG2 3.95Å; Y65-T74 HydrophobicContact CE2-CG2 4.15Å; Y65-T74 HydrophobicContact CG-CG2 4.39Å; V69-T74 HydrophobicContact CB-CG2 4.24Å; V69-T74 HydrophobicContact CG1-CG2 4.04Å; P70-T74 PolarHBondContact O-N 3.47Å; E71-T74 PolarHBondContact O-N 3.41Å; E71-T74 PolarHBondContact O-OG1 3.38Å; T74-P105 HydrophobicContact CG2-CB 4.12Å; T74-P105 HydrophobicContact CG2-CG 4.24Å
75	E	91.4	Very high	89.8	Confident	37 Å²	37	76.6 Å²	76.6	17%	0.173	37%	0.369	C	S	.	.			trans	-80.1	131.9	175.9	-68.4	177.1	-133.5	0	0	111	R38 P63 Y65 Y77	R38-E75 PolarHBondContact N-OE2 3.47Å; P63-E75 HydrophobicContact CB-CB 4.01Å; P63-E75 HydrophobicContact CG-CB 3.81Å; Y65-E75 WeakPolarHBondContact OH-CG 3.13Å; Y65-E75 PolarHBondContact OH-N 2.83Å; E75-Y77 HydrophobicContact CB-CD2 4.49Å; E75-Y77 HydrophobicContact CB-CE2 3.64Å; E75-Y77 HydrophobicContact CG-CE2 4.35Å; E75-Y77 VanDerWaalsContact OE2-CE2 3.31Å; E75-Y77 WeakPolarHBondContact OE2-CE2 3.34Å; E75-Y77 VanDerWaalsContact OE2-CZ 3.31Å; E75-Y77 PolarHBondContact OE2-OH 3.11Å
76	R	91.1	Very high	89.8	Confident	108 Å²	108	74.3 Å²	74.3	41%	0.408	36%	0.361	S	S	.	.			trans	-130.1	138.4	174.2	-60.9	-179.2	-172.8	177.9	1.9	109.5	E71 C102	E71-R76 IonicContact OE1-NH2 2.74Å; E71-R76 IonicContact OE2-CZ 2.91Å; E71-R76 IonicContact OE2-NH1 2.73Å; E71-R76 IonicContact OE2-NH2 3.19Å; E71-R76 PolarHBondContact OE2-NH2 2.9Å; R76-C102 WeakPolarHBondContact CA-O 3.41Å
77	Y	91.4	Very high	90.3	Very high	10 Å²	10	67 Å²	67	4%	0.039	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	146.6	-173.3	-64.6	-65.7	0	0	0	112	R38 P63 E75 C102 T142 L152	R38-Y77 WeakPolarHBondContact CD-OH 3.36Å; R38-Y77 WeakPolarHBondContact CG-OH 3.27Å; R38-Y77 PolarHBondContact NE-OH 2.85Å; R38-Y77 VanDerWaalsContact NE-OH 3.13Å; P63-Y77 HydrophobicContact CG-CD2 3.86Å; P63-Y77 HydrophobicContact CG-CE2 3.77Å; E75-Y77 HydrophobicContact CB-CD2 4.49Å; E75-Y77 HydrophobicContact CB-CE2 3.64Å; E75-Y77 HydrophobicContact CG-CE2 4.35Å; E75-Y77 VanDerWaalsContact OE2-CE2 3.31Å; E75-Y77 WeakPolarHBondContact OE2-CE2 3.34Å; E75-Y77 VanDerWaalsContact OE2-CZ 3.31Å; E75-Y77 PolarHBondContact OE2-OH 3.11Å; Y77-C102 PolarHBondContact N-O 3.19Å; Y77-C102 WeakPolarHBondContact O-CA 3.33Å; Y77-C102 WeakPolarHBondContact O-CB 3.29Å; Y77-C102 PolarHBondContact O-N 3.25Å; Y77-T142 HydrophobicContact CD1-CG2 3.65Å; Y77-T142 HydrophobicContact CE1-CG2 3.37Å; Y77-L152 HydrophobicContact CE1-CD1 4.37Å; Y77-L152 HydrophobicContact CE2-CD1 4.18Å
78	V	93.5	Very high	90.9	Very high	35 Å²	35	63.9 Å²	63.9	21%	0.212	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	126.3	160.4	-175.4	0	0	0	0	107.2	Y80 K98 E101 S140	V78-Y80 HydrophobicContact CB-CD2 4.45Å; V78-Y80 HydrophobicContact CB-CE2 3.59Å; V78-Y80 HydrophobicContact CG1-CD2 4.25Å; V78-Y80 HydrophobicContact CG1-CE1 3.98Å; V78-Y80 HydrophobicContact CG1-CE2 3.53Å; V78-Y80 WeakPolarHBondContact CG1-OH 3.49Å; V78-Y80 WeakPolarHBondContact O-CD2 3.35Å; V78-Y80 WeakPolarHBondContact O-CE2 3.42Å; V78-K98 HydrophobicContact CG1-CD 4.07Å; V78-K98 HydrophobicContact CG1-CG 3.78Å; V78-E101 HydrophobicContact CG1-CG 4.09Å; V78-E101 HydrophobicContact CG2-CG 4.08Å; V78-S140 WeakPolarHBondContact O-CA 3.47Å
79	L	95.2	Very high	91.7	Very high	5 Å²	5	62.1 Å²	62.1	3%	0.026	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	126.2	179.1	-171.6	67.9	0	0	0	109.1	W36 V60 R99 W100 F114 Y138	W36-L79 HydrophobicContact CD2-CD1 4.06Å; W36-L79 HydrophobicContact CE3-CD1 4.1Å; W36-L79 HydrophobicContact CH2-CD1 3.57Å; W36-L79 HydrophobicContact CZ2-CD1 3.49Å; W36-L79 VanDerWaalsContact CZ2-CD1 3.49Å; W36-L79 HydrophobicContact CZ3-CD1 3.87Å; V60-L79 HydrophobicContact CG1-CD2 4.5Å; V60-L79 HydrophobicContact CG2-CD2 4.44Å; L79-R99 PolarHBondContact O-N 3.04Å; L79-W100 HydrophobicContact CB-CB 4.15Å; L79-W100 HydrophobicContact CD2-CB 4.47Å; L79-W100 PolarHBondContact N-O 2.82Å; L79-W100 PolarHBondContact O-N 2.83Å; L79-F114 HydrophobicContact CD2-CD1 4.11Å; L79-F114 HydrophobicContact CD2-CE1 4.4Å; L79-Y138 HydrophobicContact CD2-CD1 4.31Å; L79-Y138 HydrophobicContact CG-CD1 4.34Å
80	Y	95.1	Very high	91.9	Very high	41 Å²	41	61.3 Å²	61.3	16%	0.161	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	141.6	177.7	-60	-90.6	0	0	0	110.4	V78 H92 F97 K98 Y138 I139	V78-Y80 HydrophobicContact CB-CD2 4.45Å; V78-Y80 HydrophobicContact CB-CE2 3.59Å; V78-Y80 HydrophobicContact CG1-CD2 4.25Å; V78-Y80 HydrophobicContact CG1-CE1 3.98Å; V78-Y80 HydrophobicContact CG1-CE2 3.53Å; V78-Y80 WeakPolarHBondContact CG1-OH 3.49Å; V78-Y80 WeakPolarHBondContact O-CD2 3.35Å; V78-Y80 WeakPolarHBondContact O-CE2 3.42Å; Y80-H92 HydrophobicContact CD1-CB 3.84Å; Y80-H92 AromaticContact CD1-CD2 3.74Å; Y80-H92 AromaticContact CD1-CG 3.94Å; Y80-H92 HydrophobicContact CD2-CB 4Å; Y80-H92 AromaticContact CD2-CG 3.83Å; Y80-H92 HydrophobicContact CE1-CB 4.35Å; Y80-H92 AromaticContact CE1-CD2 3.33Å; Y80-H92 WeakPolarHBondContact CE1-CD2 3.44Å; Y80-H92 AromaticContact CE1-CG 3.96Å; Y80-H92 AromaticContact CE1-NE2 4Å; Y80-H92 HydrophobicContact CE2-CB 4.48Å; Y80-H92 AromaticContact CE2-CD2 3.73Å; Y80-H92 AromaticContact CE2-CG 3.84Å; Y80-H92 AromaticContact CE2-NE2 3.88Å; Y80-H92 HydrophobicContact CG-CB 3.64Å; Y80-H92 AromaticContact CG-CG 3.88Å; Y80-H92 AromaticContact CZ-CD2 3.32Å; Y80-H92 AromaticContact CZ-CG 3.9Å; Y80-H92 AromaticContact CZ-NE2 3.52Å; Y80-H92 PolarHBondContact OH-NE2 2.97Å; Y80-F97 CarbonylContact C-O 3.55Å; Y80-F97 VanDerWaalsContact CA-O 3.3Å; Y80-F97 WeakPolarHBondContact CA-O 3.23Å; Y80-K98 HydrophobicContact CD1-CB 4.12Å; Y80-K98 HydrophobicContact CE1-CB 3.93Å; Y80-Y138 VanDerWaalsContact O-CA 3.29Å; Y80-Y138 WeakPolarHBondContact O-CA 3.42Å; Y80-I139 PolarHBondContact N-O 2.88Å; Y80-I139 PolarHBondContact O-N 3.34Å
81	M	95.3	Very high	92.1	Very high	6 Å²	6	60.2 Å²	60.2	3%	0.03	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	126.4	163.9	-170.9	172.7	-170.3	0	0	108.5	G96 F97 F128 F130 Y136 Y137 Y138	M81-G96 CarbonylContact O-C 3.6Å; M81-G96 WeakPolarHBondContact O-CA 3.14Å; M81-F97 PolarHBondContact N-O 3.04Å; M81-F97 PolarHBondContact O-N 2.69Å; M81-F128 HydrophobicContact CE-CD1 3.55Å; M81-F128 HydrophobicContact CE-CD2 4.25Å; M81-F128 HydrophobicContact CE-CE1 3.2Å; M81-F128 HydrophobicContact CE-CE2 3.95Å; M81-F128 HydrophobicContact CE-CG 4.06Å; M81-F128 HydrophobicContact CE-CZ 3.41Å; M81-F128 VanDerWaalsContact CE-CZ 3.41Å; M81-F128 HydrophobicContact SD-CD1 3.86Å; M81-F128 HydrophobicContact SD-CD2 3.68Å; M81-F128 HydrophobicContact SD-CE1 3.93Å; M81-F128 HydrophobicContact SD-CE2 3.73Å; M81-F128 HydrophobicContact SD-CG 3.73Å; M81-F128 HydrophobicContact SD-CZ 3.86Å; M81-F130 HydrophobicContact CE-CE1 3.86Å; M81-F130 HydrophobicContact CE-CZ 4.35Å; M81-Y136 HydrophobicContact CE-CD1 3.38Å; M81-Y136 HydrophobicContact CE-CE1 4.27Å; M81-Y136 HydrophobicContact CE-CG 3.97Å; M81-Y137 WeakPolarHBondContact CA-O 3.34Å; M81-Y138 HydrophobicContact CB-CD1 4.28Å; M81-Y138 HydrophobicContact CB-CE1 4.09Å; M81-Y138 HydrophobicContact CG-CE1 4.17Å; M81-Y138 HydrophobicContact SD-CE1 4.33Å
82	V	95.2	Very high	92.4	Very high	12 Å²	12	56.9 Å²	56.9	7%	0.073	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	168.1	-171.9	-65.1	0	0	0	0	111.4	H92 Y137 I139	V82-H92 HydrophobicContact CG1-CB 4.07Å; V82-Y137 PolarHBondContact N-O 2.92Å; V82-I139 HydrophobicContact CG1-CD1 3.88Å; V82-I139 HydrophobicContact CG1-CG1 3.9Å; V82-I139 HydrophobicContact CG2-CD1 4.23Å; V82-I139 HydrophobicContact CG2-CG1 4.08Å; V82-I139 HydrophobicContact CG2-CG2 3.96Å
83	N	95.3	Very high	92.5	Very high	50 Å²	50	54.1 Å²	54.1	27%	0.267	27%	0.266	S	S	.	.			trans	-80.1	175.5	166.2	71.2	-30.6	0	0	0	111.2	D85 G86 Y87	N83-D85 VanDerWaalsContact C-N 3.31Å; N83-D85 PolarHBondContact ND2-OD2 2.8Å; N83-D85 PolarHBondContact O-N 2.91Å; N83-G86 PolarHBondContact O-N 2.94Å; N83-G86 PolarHBondContact OD1-N 2.88Å; N83-G86 VanDerWaalsContact OD1-N 3.14Å; N83-Y87 PolarHBondContact O-N 3.48Å
84	Y	95.2	Very high	92.2	Very high	137 Å²	137	49.2 Å²	49.2	54%	0.537	27%	0.266	S	S	.	.	H	α-helix	trans	-56.7	-40.4	179.4	179.6	-101.4	0	0	0	113.7	G86 Y87 S88 Y137	Y84-G86 PolarHBondContact O-N 3.37Å; Y84-Y87 WeakPolarHBondContact O-CB 3.43Å; Y84-Y87 PolarHBondContact O-N 2.8Å; Y84-S88 WeakPolarHBondContact O-CB 3.41Å; Y84-S88 PolarHBondContact O-N 2.73Å; Y84-S88 PolarHBondContact O-OG 2.83Å; Y84-Y137 AromaticContact CD2-CE1 3.95Å; Y84-Y137 HydrophobicContact CD2-CE1 3.95Å; Y84-Y137 HydrophobicContact CD2-CE2 4.37Å; Y84-Y137 AromaticContact CD2-CZ 3.7Å; Y84-Y137 WeakPolarHBondContact CD2-OH 3.4Å
85	D	94.3	Very high	91.7	Very high	98 Å²	98	55.1 Å²	55.1	52%	0.524	29%	0.29	S	S	.	.	H	α-helix	trans	-63.9	-43.5	179.2	-52	-38.2	0	0	0	111.4	N83 S88 T89	N83-D85 VanDerWaalsContact C-N 3.31Å; N83-D85 PolarHBondContact ND2-OD2 2.8Å; N83-D85 PolarHBondContact O-N 2.91Å; D85-S88 PolarHBondContact O-N 2.9Å; D85-T89 WeakPolarHBondContact O-CB 3.33Å; D85-T89 WeakPolarHBondContact O-CG2 3.34Å; D85-T89 PolarHBondContact O-N 2.94Å; D85-T89 PolarHBondContact O-OG1 2.03Å
86	G	93.6	Very high	91.4	Very high	4 Å²	4	54.4 Å²	54.4	4%	0.041	29%	0.293	C	S	.	.	H	α-helix	trans	-66.3	-37	176	0	0	0	0	0	112.6	N83 Y84 S88 C90 D91	N83-G86 PolarHBondContact O-N 2.94Å; N83-G86 PolarHBondContact OD1-N 2.88Å; N83-G86 VanDerWaalsContact OD1-N 3.14Å; Y84-G86 PolarHBondContact O-N 3.37Å; G86-S88 VanDerWaalsContact C-N 3.35Å; G86-C90 CarbonylContact O-C 3.57Å; G86-C90 VanDerWaalsContact O-CA 3.28Å; G86-C90 WeakPolarHBondContact O-CA 3.41Å; G86-C90 PolarHBondContact O-N 2.81Å; G86-D91 CarbonylContact C-O 3.58Å; G86-D91 WeakPolarHBondContact CA-O 3.44Å; G86-D91 PolarHBondContact O-N 2.9Å
87	Y	94.3	Very high	91.4	Very high	22 Å²	22	56 Å²	56	9%	0.086	30%	0.303	C	S	.	.	H	α-helix	trans	-62.8	-40.6	172.7	173.4	-94.8	0	0	0	112.6	G46 N83 Y84 Y137 I139 K153	G46-Y87 PolarHBondContact O-OH 2.8Å; N83-Y87 PolarHBondContact O-N 3.48Å; Y84-Y87 WeakPolarHBondContact O-CB 3.43Å; Y84-Y87 PolarHBondContact O-N 2.8Å; Y87-Y137 AromaticContact CD1-CD1 3.83Å; Y87-Y137 HydrophobicContact CD1-CD1 3.83Å; Y87-Y137 HydrophobicContact CD1-CE1 4.16Å; Y87-Y137 AromaticContact CD2-CD1 3.66Å; Y87-Y137 HydrophobicContact CD2-CD1 3.66Å; Y87-Y137 HydrophobicContact CD2-CG 4.21Å; Y87-Y137 HydrophobicContact CE1-CD1 4.31Å; Y87-Y137 HydrophobicContact CE1-CE1 4.5Å; Y87-Y137 HydrophobicContact CE2-CD1 4.12Å; Y87-Y137 AromaticContact CG-CD1 3.49Å; Y87-Y137 HydrophobicContact CG-CD1 3.49Å; Y87-Y137 VanDerWaalsContact CG-CD1 3.49Å; Y87-Y137 HydrophobicContact CG-CE1 4.26Å; Y87-Y137 HydrophobicContact CG-CG 4.05Å; Y87-I139 HydrophobicContact CD2-CG2 4.14Å; Y87-K153 HydrophobicContact CD2-CB 3.87Å; Y87-K153 HydrophobicContact CD2-CD 4.06Å; Y87-K153 HydrophobicContact CD2-CG 4.25Å; Y87-K153 HydrophobicContact CE1-CD 4.16Å; Y87-K153 HydrophobicContact CE2-CB 3.51Å; Y87-K153 HydrophobicContact CE2-CD 3.62Å; Y87-K153 HydrophobicContact CE2-CG 3.55Å
88	S	92.7	Very high	91.5	Very high	56 Å²	56	61 Å²	61	39%	0.392	33%	0.325	S	S	.	.	H	α-helix	trans	-73.7	-35.9	-178.1	-59.7	0	0	0	0	112.1	Y84 D85 G86	Y84-S88 WeakPolarHBondContact O-CB 3.41Å; Y84-S88 PolarHBondContact O-N 2.73Å; Y84-S88 PolarHBondContact O-OG 2.83Å; D85-S88 PolarHBondContact O-N 2.9Å; G86-S88 VanDerWaalsContact C-N 3.35Å
89	T	91.2	Very high	91.4	Very high	89 Å²	89	62.4 Å²	62.4	55%	0.546	33%	0.327	S	S	.	.	H	α-helix	trans	-97.5	-1.3	-177.5	58.6	0	0	0	0	114.3	D85 D91	D85-T89 WeakPolarHBondContact O-CB 3.33Å; D85-T89 WeakPolarHBondContact O-CG2 3.34Å; D85-T89 PolarHBondContact O-N 2.94Å; D85-T89 PolarHBondContact O-OG1 2.03Å; T89-D91 PolarHBondContact O-N 3.15Å; T89-D91 WeakPolarHBondContact OG1-CB 3.3Å
90	C	91.4	Very high	91.4	Very high	15 Å²	15	66.7 Å²	66.7	10%	0.101	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.5	33.6	-171.3	-71.7	0	0	0	0	113.3	G86 C151	G86-C90 CarbonylContact O-C 3.57Å; G86-C90 VanDerWaalsContact O-CA 3.28Å; G86-C90 WeakPolarHBondContact O-CA 3.41Å; G86-C90 PolarHBondContact O-N 2.81Å; C90-C151 VanDerWaalsContact CA-SG 3.56Å; C90-C151 HydrophobicContact CB-CB 3.58Å; C90-C151 WeakPolarHBondContact CB-SG 2.9Å; C90-C151 WeakPolarHBondContact SG-CB 3.37Å; C90-C151 PolarHBondContact SG-N 2.84Å; C90-C151 CovalentContact SG-SG 2.03Å; C90-C151 PolarHBondContact SG-SG 3.33Å
91	D	91.1	Very high	91.4	Very high	48 Å²	48	68.2 Å²	68.2	26%	0.257	35%	0.351	S	S	.	.			trans	-110.9	127.6	-178.7	-170.5	15.8	0	0	0	111.9	G86 T89 T93	G86-D91 CarbonylContact C-O 3.58Å; G86-D91 WeakPolarHBondContact CA-O 3.44Å; G86-D91 PolarHBondContact O-N 2.9Å; T89-D91 PolarHBondContact O-N 3.15Å; T89-D91 WeakPolarHBondContact OG1-CB 3.3Å; D91-T93 WeakPolarHBondContact OD1-CB 3.07Å; D91-T93 PolarHBondContact OD1-N 2.8Å; D91-T93 PolarHBondContact OD1-OG1 2.58Å
92	H	90.8	Very high	91.3	Very high	49 Å²	49	68.4 Å²	68.4	23%	0.227	35%	0.353	C	S	.	.			trans	-110.2	-5.3	177.1	61.1	-81.3	0	0	0	112.5	Y80 V82 G96 I139	Y80-H92 HydrophobicContact CD1-CB 3.84Å; Y80-H92 AromaticContact CD1-CD2 3.74Å; Y80-H92 AromaticContact CD1-CG 3.94Å; Y80-H92 HydrophobicContact CD2-CB 4Å; Y80-H92 AromaticContact CD2-CG 3.83Å; Y80-H92 HydrophobicContact CE1-CB 4.35Å; Y80-H92 AromaticContact CE1-CD2 3.33Å; Y80-H92 WeakPolarHBondContact CE1-CD2 3.44Å; Y80-H92 AromaticContact CE1-CG 3.96Å; Y80-H92 AromaticContact CE1-NE2 4Å; Y80-H92 HydrophobicContact CE2-CB 4.48Å; Y80-H92 AromaticContact CE2-CD2 3.73Å; Y80-H92 AromaticContact CE2-CG 3.84Å; Y80-H92 AromaticContact CE2-NE2 3.88Å; Y80-H92 HydrophobicContact CG-CB 3.64Å; Y80-H92 AromaticContact CG-CG 3.88Å; Y80-H92 AromaticContact CZ-CD2 3.32Å; Y80-H92 AromaticContact CZ-CG 3.9Å; Y80-H92 AromaticContact CZ-NE2 3.52Å; Y80-H92 PolarHBondContact OH-NE2 2.97Å; V82-H92 HydrophobicContact CG1-CB 4.07Å; H92-G96 VanDerWaalsContact O-CA 3.23Å; H92-G96 WeakPolarHBondContact O-CA 3.45Å; H92-G96 PolarHBondContact O-N 2.72Å; H92-I139 HydrophobicContact CB-CD1 4.21Å
93	T	87.4	Confident	91.2	Very high	113 Å²	113	71.7 Å²	71.7	69%	0.693	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-37.4	-170.7	-54.9	0	0	0	0	112.8	D91	D91-T93 WeakPolarHBondContact OD1-CB 3.07Å; D91-T93 PolarHBondContact OD1-N 2.8Å; D91-T93 PolarHBondContact OD1-OG1 2.58Å
94	A	81.1	Confident	91	Very high	85 Å²	85	77 Å²	77	70%	0.702	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-44.1	-174.5	0	0	0	0	0	113.9
95	K	80.1	Confident	90.8	Very high	137 Å²	137	70.9 Å²	70.9	60%	0.596	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145.8	28	-171.6	-64.9	-173.9	-179.9	174.3	0	113.2
96	G	84.3	Confident	90.8	Very high	23 Å²	23	70.2 Å²	70.2	24%	0.237	36%	0.357	C	S	.	.			trans	-97.7	136.3	179.4	0	0	0	0	0	112.9	M81 H92	M81-G96 CarbonylContact O-C 3.6Å; M81-G96 WeakPolarHBondContact O-CA 3.14Å; H92-G96 VanDerWaalsContact O-CA 3.23Å; H92-G96 WeakPolarHBondContact O-CA 3.45Å; H92-G96 PolarHBondContact O-N 2.72Å
97	F	90.9	Very high	90.6	Very high	140 Å²	140	70.7 Å²	70.7	61%	0.614	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	125.5	170	-59.2	-81.2	0	0	0	109.5	Y80 M81 R99	Y80-F97 CarbonylContact C-O 3.55Å; Y80-F97 VanDerWaalsContact CA-O 3.3Å; Y80-F97 WeakPolarHBondContact CA-O 3.23Å; M81-F97 PolarHBondContact N-O 3.04Å; M81-F97 PolarHBondContact O-N 2.69Å; F97-R99 PolarHBondContact O-N 2.91Å
98	K	92.8	Very high	90.4	Very high	117 Å²	117	75.7 Å²	75.7	51%	0.509	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	121.6	172	174.3	178.8	165.5	-178.9	0	109	V78 Y80 E101	V78-K98 HydrophobicContact CG1-CD 4.07Å; V78-K98 HydrophobicContact CG1-CG 3.78Å; Y80-K98 HydrophobicContact CD1-CB 4.12Å; Y80-K98 HydrophobicContact CE1-CB 3.93Å; K98-E101 WeakPolarHBondContact CE-OE1 3.44Å; K98-E101 IonicContact NZ-OE1 3.98Å; K98-E101 PolarHBondContact NZ-OE1 3.32Å; K98-E101 IonicContact NZ-OE2 2.77Å; K98-E101 PolarHBondContact NZ-OE2 2.84Å
99	R	93.3	Very high	90.3	Very high	63 Å²	63	80.3 Å²	80.3	24%	0.238	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	-38.8	-176.7	-157	71.7	-174.8	116.1	0.1	113.1	L79 F97 F114 E116	L79-R99 PolarHBondContact O-N 3.04Å; F97-R99 PolarHBondContact O-N 2.91Å; R99-F114 HydrophobicContact CG-CE1 3.89Å; R99-F114 HydrophobicContact CG-CE2 4.11Å; R99-F114 HydrophobicContact CG-CZ 3.42Å; R99-F114 VanDerWaalsContact CG-CZ 3.42Å; R99-E116 IonicContact CZ-OE1 3.98Å; R99-E116 IonicContact CZ-OE2 3.89Å; R99-E116 IonicContact NE-OE1 2.94Å; R99-E116 IonicContact NE-OE2 3.98Å; R99-E116 PolarHBondContact NE-OE2 3.27Å; R99-E116 IonicContact NH2-OE1 3Å; R99-E116 PolarHBondContact NH2-OE1 2.83Å; R99-E116 IonicContact NH2-OE2 2.91Å; R99-E116 PolarHBondContact NH2-OE2 3.34Å; R99-E116 VanDerWaalsContact NH2-OE2 3.13Å
100	W	94.7	Very high	90.4	Very high	95 Å²	95	77 Å²	77	36%	0.36	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	160.8	-178.4	-165.6	-109.7	0	0	0	112.5	L79 F114	L79-W100 HydrophobicContact CB-CB 4.15Å; L79-W100 HydrophobicContact CD2-CB 4.47Å; L79-W100 PolarHBondContact N-O 2.82Å; L79-W100 PolarHBondContact O-N 2.83Å; W100-F114 HydrophobicContact CB-CB 4.14Å; W100-F114 HydrophobicContact CB-CD1 4.47Å; W100-F114 HydrophobicContact CB-CD2 4.05Å; W100-F114 HydrophobicContact CB-CG 3.95Å; W100-F114 HydrophobicContact CD2-CB 3.76Å; W100-F114 AromaticContact CD2-CD2 3.8Å; W100-F114 HydrophobicContact CD2-CD2 3.8Å; W100-F114 HydrophobicContact CD2-CG 4.08Å; W100-F114 HydrophobicContact CE3-CB 4.36Å; W100-F114 AromaticContact CE3-CD2 3.58Å; W100-F114 HydrophobicContact CE3-CD2 3.58Å; W100-F114 HydrophobicContact CE3-CE2 4.35Å; W100-F114 HydrophobicContact CE3-CG 4.32Å; W100-F114 HydrophobicContact CG-CB 3.63Å; W100-F114 HydrophobicContact CG-CD2 4.03Å; W100-F114 AromaticContact CG-CG 3.92Å; W100-F114 HydrophobicContact CG-CG 3.92Å; W100-F114 HydrophobicContact CZ3-CD2 4.28Å
101	E	94.3	Very high	90.5	Very high	73 Å²	73	78.7 Å²	78.7	34%	0.341	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	120.6	172.9	-65.5	-171	140.7	0	0	111.5	V78 K98 N103	V78-E101 HydrophobicContact CG1-CG 4.09Å; V78-E101 HydrophobicContact CG2-CG 4.08Å; K98-E101 WeakPolarHBondContact CE-OE1 3.44Å; K98-E101 IonicContact NZ-OE1 3.98Å; K98-E101 PolarHBondContact NZ-OE1 3.32Å; K98-E101 IonicContact NZ-OE2 2.77Å; K98-E101 PolarHBondContact NZ-OE2 2.84Å; E101-N103 PolarHBondContact O-N 2.84Å
102	C	93.8	Very high	90.7	Very high	10 Å²	10	77.9 Å²	77.9	7%	0.068	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	80.6	167.6	-64.2	0	0	0	0	109.1	C62 R76 Y77	C62-C102 VanDerWaalsContact CA-SG 3.59Å; C62-C102 HydrophobicContact CB-CB 3.57Å; C62-C102 WeakPolarHBondContact CB-SG 3.34Å; C62-C102 WeakPolarHBondContact SG-CA 3.38Å; C62-C102 WeakPolarHBondContact SG-CB 3.47Å; C62-C102 CovalentContact SG-SG 2.03Å; C62-C102 PolarHBondContact SG-SG 2.73Å; R76-C102 WeakPolarHBondContact CA-O 3.41Å; Y77-C102 PolarHBondContact N-O 3.19Å; Y77-C102 WeakPolarHBondContact O-CA 3.33Å; Y77-C102 WeakPolarHBondContact O-CB 3.29Å; Y77-C102 PolarHBondContact O-N 3.25Å
103	N	92	Very high	90.9	Very high	81 Å²	81	80.1 Å²	80.1	43%	0.433	41%	0.414	S	S	.	.			trans	-112.4	-2.9	-175.5	62.6	-1.5	0	0	0	114.5	E101 P105	E101-N103 PolarHBondContact O-N 2.84Å; N103-P105 WeakPolarHBondContact O-CD 3.45Å
104	R	91.9	Very high	91.2	Very high	163 Å²	163	75.5 Å²	75.5	62%	0.615	38%	0.384	S	S	*	.			trans	-120.4	82.6	179.1	-59.3	176.4	-174.5	162.8	1	111.7	H106 S107 L112	R104-H106 VanDerWaalsContact C-N 3.29Å; R104-H106 PolarHBondContact O-N 2.79Å; R104-S107 PolarHBondContact O-N 3.44Å; R104-L112 HydrophobicContact CB-CD1 3.79Å; R104-L112 HydrophobicContact CB-CG 4.25Å; R104-L112 HydrophobicContact CG-CD1 4.26Å
105	P	92.1	Very high	91.9	Very high	8 Å²	8	74 Å²	74	5%	0.052	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-28.9	178.9	23.7	-31.8	0	0	0	113.4	H64 Y65 T74 N103	H64-P105 WeakPolarHBondContact CA-O 3.48Å; H64-P105 PolarHBondContact ND1-O 2.9Å; Y65-P105 HydrophobicContact CD2-CB 3.81Å; Y65-P105 HydrophobicContact CE2-CB 4.19Å; Y65-P105 PolarHBondContact N-O 2.84Å; Y65-P105 VanDerWaalsContact N-O 3.1Å; T74-P105 HydrophobicContact CG2-CB 4.12Å; T74-P105 HydrophobicContact CG2-CG 4.24Å; N103-P105 WeakPolarHBondContact O-CD 3.45Å
106	H	92.3	Very high	92.6	Very high	83 Å²	83	67.9 Å²	67.9	38%	0.384	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	38.9	179.4	-55.1	-69.1	0	0	0	112.3	Y65 R104	Y65-H106 PolarHBondContact O-ND1 2.54Å; R104-H106 VanDerWaalsContact C-N 3.29Å; R104-H106 PolarHBondContact O-N 2.79Å
107	S	91.3	Very high	93.1	Very high	15 Å²	15	69.9 Å²	69.9	11%	0.105	34%	0.344	C	S	.	.			trans	-57.4	131.3	176.9	166.6	0	0	0	0	111	H64 R104 N109 G110	H64-S107 PolarHBondContact CE1-O 2.9Å; R104-S107 PolarHBondContact O-N 3.44Å; S107-N109 PolarHBondContact O-N 3.37Å; S107-G110 WeakPolarHBondContact CB-O 3.29Å; S107-G110 PolarHBondContact O-N 3.43Å; S107-G110 PolarHBondContact OG-O 3.43Å
108	P	89.7	Confident	93.3	Very high	126 Å²	126	63.2 Å²	63.2	82%	0.818	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-22.5	-174.9	26.6	-35.4	0	0	0	113.7
109	N	90.7	Very high	93.4	Very high	154 Å²	154	59.7 Å²	59.7	82%	0.824	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	30.1	-177.5	-61.3	-32.1	0	0	0	112.1	S107	S107-N109 PolarHBondContact O-N 3.37Å
110	G	92	Very high	93.4	Very high	19 Å²	19	59.5 Å²	59.5	20%	0.196	30%	0.304	C	S	.	.	S	Bend	trans	76.3	-164.9	-174.1	0	0	0	0	0	113.3	S107 L112	S107-G110 WeakPolarHBondContact CB-O 3.29Å; S107-G110 PolarHBondContact O-N 3.43Å; S107-G110 PolarHBondContact OG-O 3.43Å; G110-L112 PolarHBondContact O-N 3.47Å
111	P	94	Very high	93.2	Very high	51 Å²	51	61.4 Å²	61.4	33%	0.331	32%	0.315	S	S	.	.	S	Bend	trans	-60.8	136.7	-174.9	23.3	-32.9	0	0	0	112.1	Y61 C62 H64 K113	Y61-P111 HydrophobicContact CD1-CB 4.34Å; Y61-P111 HydrophobicContact CD1-CG 3.95Å; C62-P111 WeakPolarHBondContact O-CB 3.43Å; H64-P111 HydrophobicContact CB-CB 3.77Å; P111-K113 PolarHBondContact O-N 2.94Å
112	L	94.6	Very high	93	Very high	30 Å²	30	59.3 Å²	59.3	16%	0.157	31%	0.307	C	S	.	.			trans	-58.5	133.9	168.6	-66.9	-179.6	0	0	0	109.5	C62 R104 G110	C62-L112 HydrophobicContact CB-CB 3.97Å; C62-L112 WeakPolarHBondContact CB-O 3.38Å; C62-L112 PolarHBondContact N-O 3.31Å; R104-L112 HydrophobicContact CB-CD1 3.79Å; R104-L112 HydrophobicContact CB-CG 4.25Å; R104-L112 HydrophobicContact CG-CD1 4.26Å; G110-L112 PolarHBondContact O-N 3.47Å
113	K	95.4	Very high	92.7	Very high	96 Å²	96	65.2 Å²	65.2	42%	0.417	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	126.6	-178.7	-172.9	-177.7	71.8	171.6	0	110.8	D59 V60 Y61 P111	D59-K113 HydrophobicContact CB-CD 4.24Å; D59-K113 HydrophobicContact CB-CG 4.47Å; V60-K113 WeakPolarHBondContact O-CA 3.38Å; Y61-K113 HydrophobicContact CD1-CB 4.28Å; Y61-K113 HydrophobicContact CD1-CD 4.5Å; Y61-K113 HydrophobicContact CD1-CG 4.23Å; Y61-K113 HydrophobicContact CE1-CB 4.23Å; Y61-K113 HydrophobicContact CE1-CD 3.73Å; Y61-K113 HydrophobicContact CE1-CG 3.95Å; Y61-K113 HydrophobicContact CE2-CD 4.48Å; P111-K113 PolarHBondContact O-N 2.94Å
114	F	94.9	Very high	92.3	Very high	16 Å²	16	67 Å²	67	7%	0.07	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	131	167.1	170.9	-109.6	0	0	0	109.3	D59 V60 L79 R99 W100 E116	D59-F114 CarbonylContact C-O 3.55Å; D59-F114 WeakPolarHBondContact CA-O 2.97Å; V60-F114 HydrophobicContact CB-CB 4.4Å; V60-F114 HydrophobicContact CB-CD1 4.36Å; V60-F114 HydrophobicContact CG2-CD1 4.22Å; V60-F114 PolarHBondContact N-O 3.38Å; V60-F114 PolarHBondContact O-N 3.11Å; L79-F114 HydrophobicContact CD2-CD1 4.11Å; L79-F114 HydrophobicContact CD2-CE1 4.4Å; R99-F114 HydrophobicContact CG-CE1 3.89Å; R99-F114 HydrophobicContact CG-CE2 4.11Å; R99-F114 HydrophobicContact CG-CZ 3.42Å; R99-F114 VanDerWaalsContact CG-CZ 3.42Å; W100-F114 HydrophobicContact CB-CB 4.14Å; W100-F114 HydrophobicContact CB-CD1 4.47Å; W100-F114 HydrophobicContact CB-CD2 4.05Å; W100-F114 HydrophobicContact CB-CG 3.95Å; W100-F114 HydrophobicContact CD2-CB 3.76Å; W100-F114 AromaticContact CD2-CD2 3.8Å; W100-F114 HydrophobicContact CD2-CD2 3.8Å; W100-F114 HydrophobicContact CD2-CG 4.08Å; W100-F114 HydrophobicContact CE3-CB 4.36Å; W100-F114 AromaticContact CE3-CD2 3.58Å; W100-F114 HydrophobicContact CE3-CD2 3.58Å; W100-F114 HydrophobicContact CE3-CE2 4.35Å; W100-F114 HydrophobicContact CE3-CG 4.32Å; W100-F114 HydrophobicContact CG-CB 3.63Å; W100-F114 HydrophobicContact CG-CD2 4.03Å; W100-F114 AromaticContact CG-CG 3.92Å; W100-F114 HydrophobicContact CG-CG 3.92Å; W100-F114 HydrophobicContact CZ3-CD2 4.28Å; F114-E116 HydrophobicContact CE1-CB 3.87Å; F114-E116 HydrophobicContact CZ-CB 4.08Å; F114-E116 WeakPolarHBondContact CZ-OE2 3.36Å
115	S	95.2	Very high	91.8	Very high	55 Å²	55	64.9 Å²	64.9	39%	0.385	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	121	178.5	-61.8	0	0	0	0	109.6	L58 D59	L58-S115 CarbonylContact O-C 3.55Å; L58-S115 WeakPolarHBondContact O-CA 3.02Å; D59-S115 VanDerWaalsContact OD1-CB 3.29Å; D59-S115 WeakPolarHBondContact OD1-CB 3.49Å; D59-S115 PolarHBondContact OD1-OG 3.18Å
116	E	95	Very high	91.1	Very high	7 Å²	7	70.9 Å²	70.9	3%	0.033	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	134.7	171.5	-170.9	74	-103	0	0	109.2	Y57 L58 R99 F114 F130	Y57-E116 CarbonylContact C-O 3.57Å; Y57-E116 VanDerWaalsContact CA-O 3.28Å; Y57-E116 WeakPolarHBondContact CA-O 3.41Å; L58-E116 HydrophobicContact CB-CB 4.35Å; L58-E116 PolarHBondContact N-O 3.22Å; L58-E116 PolarHBondContact O-N 2.89Å; R99-E116 IonicContact CZ-OE1 3.98Å; R99-E116 IonicContact CZ-OE2 3.89Å; R99-E116 IonicContact NE-OE1 2.94Å; R99-E116 IonicContact NE-OE2 3.98Å; R99-E116 PolarHBondContact NE-OE2 3.27Å; R99-E116 IonicContact NH2-OE1 3Å; R99-E116 PolarHBondContact NH2-OE1 2.83Å; R99-E116 IonicContact NH2-OE2 2.91Å; R99-E116 PolarHBondContact NH2-OE2 3.34Å; R99-E116 VanDerWaalsContact NH2-OE2 3.13Å; F114-E116 HydrophobicContact CE1-CB 3.87Å; F114-E116 HydrophobicContact CZ-CB 4.08Å; F114-E116 WeakPolarHBondContact CZ-OE2 3.36Å; E116-F130 HydrophobicContact CG-CE2 4.02Å; E116-F130 HydrophobicContact CG-CZ 3.75Å
117	K	94.9	Very high	90.5	Very high	65 Å²	65	67.9 Å²	67.9	28%	0.283	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	127.1	173.9	-174.3	-175.6	179	-175.3	0	109.2	Y57 Q119 F130	Y57-K117 HydrophobicContact CD1-CB 3.9Å; Y57-K117 HydrophobicContact CD1-CG 4.1Å; Y57-K117 HydrophobicContact CE1-CB 3.72Å; Y57-K117 HydrophobicContact CE1-CD 3.79Å; Y57-K117 HydrophobicContact CE1-CG 3.66Å; K117-Q119 HydrophobicContact CD-CB 4.36Å; K117-Q119 HydrophobicContact CG-CB 4.37Å; K117-Q119 PolarHBondContact O-N 2.98Å; K117-F130 WeakPolarHBondContact O-CE2 3.38Å
118	F	95.2	Very high	90.4	Very high	0 Å²	0	70.2 Å²	70.2	0%	0	39%	0.39	C	S	.	.			trans	-78.9	70.6	178.4	-62	-73.9	0	0	0	111.6	V52 I54 N55 D56 L58 F130 V156 V158	V52-F118 HydrophobicContact CB-CD2 3.96Å; V52-F118 HydrophobicContact CB-CE2 4.03Å; V52-F118 HydrophobicContact CG1-CD2 4.3Å; V52-F118 HydrophobicContact CG1-CE2 3.86Å; V52-F118 HydrophobicContact CG1-CZ 4.4Å; V52-F118 HydrophobicContact CG2-CD1 4Å; V52-F118 HydrophobicContact CG2-CD2 3.63Å; V52-F118 HydrophobicContact CG2-CE1 4.14Å; V52-F118 HydrophobicContact CG2-CE2 3.76Å; V52-F118 HydrophobicContact CG2-CG 3.76Å; V52-F118 HydrophobicContact CG2-CZ 4.04Å; I54-F118 CarbonylContact C-O 3.54Å; I54-F118 WeakPolarHBondContact CA-O 3.49Å; N55-F118 PolarHBondContact N-O 3.13Å; D56-F118 HydrophobicContact CB-CD2 4.36Å; D56-F118 WeakPolarHBondContact O-CD2 3.32Å; D56-F118 PolarHBondContact O-N 3.42Å; L58-F118 HydrophobicContact CB-CE2 3.61Å; L58-F118 HydrophobicContact CB-CZ 3.72Å; L58-F118 HydrophobicContact CD2-CZ 4.21Å; F118-F130 HydrophobicContact CB-CB 4.48Å; F118-F130 HydrophobicContact CB-CD2 4.49Å; F118-F130 HydrophobicContact CB-CG 4.41Å; F118-F130 HydrophobicContact CD1-CB 4.48Å; F118-F130 AromaticContact CD1-CD1 3.58Å; F118-F130 HydrophobicContact CD1-CD1 3.58Å; F118-F130 HydrophobicContact CD1-CD2 4.13Å; F118-F130 AromaticContact CD1-CE1 3.7Å; F118-F130 HydrophobicContact CD1-CE1 3.7Å; F118-F130 HydrophobicContact CD1-CE2 4.22Å; F118-F130 AromaticContact CD1-CG 3.8Å; F118-F130 HydrophobicContact CD1-CG 3.8Å; F118-F130 HydrophobicContact CD1-CZ 4.02Å; F118-F130 HydrophobicContact CE1-CD1 4.08Å; F118-F130 AromaticContact CE1-CE1 3.77Å; F118-F130 HydrophobicContact CE1-CE1 3.77Å; F118-F130 HydrophobicContact CE1-CZ 4.12Å; F118-V156 HydrophobicContact CD1-CG1 4.49Å; F118-V156 HydrophobicContact CE1-CG1 3.63Å; F118-V156 HydrophobicContact CE2-CG1 4.46Å; F118-V156 HydrophobicContact CZ-CG1 3.62Å; F118-V156 HydrophobicContact CZ-CG2 4.49Å; F118-V158 HydrophobicContact CD1-CG2 4.09Å
119	Q	94.2	Very high	90.6	Very high	43 Å²	43	67.9 Å²	67.9	20%	0.201	37%	0.369	C	S	.	.			trans	-99.9	147.6	-177.2	63.8	-168.5	-11.1	0	0	112.6	K117 F121 T122 F130	K117-Q119 HydrophobicContact CD-CB 4.36Å; K117-Q119 HydrophobicContact CG-CB 4.37Å; K117-Q119 PolarHBondContact O-N 2.98Å; Q119-F121 VanDerWaalsContact C-N 3.34Å; Q119-F121 WeakPolarHBondContact CG-O 3.29Å; Q119-T122 PolarHBondContact NE2-OG1 3.13Å; Q119-F130 PolarHBondContact O-N 2.85Å
120	L	93.3	Very high	90.9	Very high	59 Å²	59	60.5 Å²	60.5	31%	0.309	33%	0.329	S	S	.	.	S	Bend	trans	-69.4	-32.8	178.4	-70.3	171.4	0	0	0	113.2	I54 F130 P132	I54-L120 HydrophobicContact CD1-CD2 3.92Å; I54-L120 HydrophobicContact CD1-CG 4.28Å; I54-L120 HydrophobicContact CG1-CD2 4.3Å; I54-L120 HydrophobicContact CG2-CD1 4.37Å; I54-L120 HydrophobicContact CG2-CG 3.97Å; L120-F130 WeakPolarHBondContact CD2-O 3.39Å; L120-P132 HydrophobicContact CD2-CG 4.36Å
121	F	90.8	Very high	91.1	Very high	136 Å²	136	63.8 Å²	63.8	60%	0.596	34%	0.336	S	S	*	.			trans	-138.2	140.4	-175.6	-56.1	-71.3	0	0	0	108.5	Q119	Q119-F121 VanDerWaalsContact C-N 3.34Å; Q119-F121 WeakPolarHBondContact CG-O 3.29Å
122	T	89.8	Confident	91.2	Very high	28 Å²	28	63.4 Å²	63.4	17%	0.172	33%	0.333	C	S	.	.			trans	-125.3	130.2	178.5	-175.2	0	0	0	0	109.6	Q119 F124 E129	Q119-T122 PolarHBondContact NE2-OG1 3.13Å; T122-F124 PolarHBondContact O-N 2.76Å; T122-F124 PolarHBondContact OG1-N 2.91Å; T122-E129 HydrophobicContact CG2-CG 3.91Å
123	P	87.4	Confident	91.2	Very high	135 Å²	135	64 Å²	64	88%	0.877	35%	0.346	S	S	*	.	S	Bend	trans	-74.8	-6.5	176.3	32	-35.6	0	0	0	112.3
124	F	83.9	Confident	91.3	Very high	119 Å²	119	66.6 Å²	66.6	52%	0.522	35%	0.353	S	S	.	.	S	Bend	trans	-92.2	127.2	-179.9	-175.7	-129.8	0	0	0	110	T122 L126 G127	T122-F124 PolarHBondContact O-N 2.76Å; T122-F124 PolarHBondContact OG1-N 2.91Å; F124-L126 VanDerWaalsContact CD1-C 3.47Å; F124-L126 HydrophobicContact CD1-CB 4.07Å; F124-L126 HydrophobicContact CE1-CB 3.5Å; F124-L126 VanDerWaalsContact CE1-CB 3.5Å; F124-L126 HydrophobicContact CZ-CB 3.81Å; F124-L126 HydrophobicContact CZ-CD1 4.19Å; F124-L126 HydrophobicContact CZ-CG 4.36Å; F124-L126 PolarHBondContact O-N 3Å; F124-G127 WeakPolarHBondContact O-CA 3.5Å; F124-G127 PolarHBondContact O-N 2.98Å
125	S	80.9	Confident	91.5	Very high	117 Å²	117	69.7 Å²	69.7	82%	0.818	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-26.6	-177	52.6	0	0	0	0	114.2
126	L	78	Confident	91.6	Very high	135 Å²	135	68.1 Å²	68.1	71%	0.707	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	12.3	173	-57.5	170.8	0	0	0	112.1	F124	F124-L126 VanDerWaalsContact CD1-C 3.47Å; F124-L126 HydrophobicContact CD1-CB 4.07Å; F124-L126 HydrophobicContact CE1-CB 3.5Å; F124-L126 VanDerWaalsContact CE1-CB 3.5Å; F124-L126 HydrophobicContact CZ-CB 3.81Å; F124-L126 HydrophobicContact CZ-CD1 4.19Å; F124-L126 HydrophobicContact CZ-CG 4.36Å; F124-L126 PolarHBondContact O-N 3Å
127	G	79.3	Confident	91.7	Very high	20 Å²	20	68.8 Å²	68.8	21%	0.206	36%	0.356	C	S	.	.			trans	-72.5	158.4	174.5	0	0	0	0	0	110.5	F124	F124-G127 WeakPolarHBondContact O-CA 3.5Å; F124-G127 PolarHBondContact O-N 2.98Å
128	F	89.3	Confident	91.8	Very high	63 Å²	63	65.7 Å²	65.7	28%	0.276	34%	0.343	S	S	.	.			trans	-105.1	139.1	176.6	-155.9	-88.6	0	0	0	110.5	M81 F130 Y136	M81-F128 HydrophobicContact CE-CD1 3.55Å; M81-F128 HydrophobicContact CE-CD2 4.25Å; M81-F128 HydrophobicContact CE-CE1 3.2Å; M81-F128 HydrophobicContact CE-CE2 3.95Å; M81-F128 HydrophobicContact CE-CG 4.06Å; M81-F128 HydrophobicContact CE-CZ 3.41Å; M81-F128 VanDerWaalsContact CE-CZ 3.41Å; M81-F128 HydrophobicContact SD-CD1 3.86Å; M81-F128 HydrophobicContact SD-CD2 3.68Å; M81-F128 HydrophobicContact SD-CE1 3.93Å; M81-F128 HydrophobicContact SD-CE2 3.73Å; M81-F128 HydrophobicContact SD-CG 3.73Å; M81-F128 HydrophobicContact SD-CZ 3.86Å; F128-F130 HydrophobicContact CB-CE2 4.19Å; F128-F130 HydrophobicContact CB-CZ 4.28Å; F128-F130 HydrophobicContact CD1-CD1 4.13Å; F128-F130 HydrophobicContact CD1-CD2 4.31Å; F128-F130 AromaticContact CD1-CE1 3.75Å; F128-F130 HydrophobicContact CD1-CE1 3.75Å; F128-F130 AromaticContact CD1-CE2 3.95Å; F128-F130 HydrophobicContact CD1-CE2 3.95Å; F128-F130 HydrophobicContact CD1-CG 4.41Å; F128-F130 AromaticContact CD1-CZ 3.66Å; F128-F130 HydrophobicContact CD1-CZ 3.66Å; F128-F130 HydrophobicContact CE1-CD1 4.37Å; F128-F130 HydrophobicContact CE1-CE1 4.17Å; F128-F130 HydrophobicContact CG-CZ 4.35Å; F128-Y136 AromaticContact CE1-CD1 3.78Å; F128-Y136 HydrophobicContact CE1-CD1 3.78Å; F128-Y136 AromaticContact CE1-CE1 3.5Å; F128-Y136 HydrophobicContact CE1-CE1 3.5Å; F128-Y136 HydrophobicContact CZ-CD1 4.32Å; F128-Y136 HydrophobicContact CZ-CE1 4.15Å
129	E	93.9	Very high	91.9	Very high	77 Å²	77	65.7 Å²	65.7	36%	0.36	34%	0.343	S	S	.	.			trans	-105	133.5	177	-65.9	-171.3	169.2	0	0	110.9	T122 R131	T122-E129 HydrophobicContact CG2-CG 3.91Å; E129-R131 IonicContact OE2-CZ 3.63Å; E129-R131 IonicContact OE2-NH2 2.58Å; E129-R131 PolarHBondContact OE2-NH2 2.88Å
130	F	95.8	Very high	91.8	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.333	C	S	.	.			trans	-108.7	146.1	-178.9	-61.3	-88.4	0	0	0	110.8	I54 M81 E116 K117 F118 Q119 L120 F128 Y136 V158	I54-F130 HydrophobicContact CD1-CB 4.41Å; M81-F130 HydrophobicContact CE-CE1 3.86Å; M81-F130 HydrophobicContact CE-CZ 4.35Å; E116-F130 HydrophobicContact CG-CE2 4.02Å; E116-F130 HydrophobicContact CG-CZ 3.75Å; K117-F130 WeakPolarHBondContact O-CE2 3.38Å; F118-F130 HydrophobicContact CB-CB 4.48Å; F118-F130 HydrophobicContact CB-CD2 4.49Å; F118-F130 HydrophobicContact CB-CG 4.41Å; F118-F130 HydrophobicContact CD1-CB 4.48Å; F118-F130 AromaticContact CD1-CD1 3.58Å; F118-F130 HydrophobicContact CD1-CD1 3.58Å; F118-F130 HydrophobicContact CD1-CD2 4.13Å; F118-F130 AromaticContact CD1-CE1 3.7Å; F118-F130 HydrophobicContact CD1-CE1 3.7Å; F118-F130 HydrophobicContact CD1-CE2 4.22Å; F118-F130 AromaticContact CD1-CG 3.8Å; F118-F130 HydrophobicContact CD1-CG 3.8Å; F118-F130 HydrophobicContact CD1-CZ 4.02Å; F118-F130 HydrophobicContact CE1-CD1 4.08Å; F118-F130 AromaticContact CE1-CE1 3.77Å; F118-F130 HydrophobicContact CE1-CE1 3.77Å; F118-F130 HydrophobicContact CE1-CZ 4.12Å; Q119-F130 PolarHBondContact O-N 2.85Å; L120-F130 WeakPolarHBondContact CD2-O 3.39Å; F128-F130 HydrophobicContact CB-CE2 4.19Å; F128-F130 HydrophobicContact CB-CZ 4.28Å; F128-F130 HydrophobicContact CD1-CD1 4.13Å; F128-F130 HydrophobicContact CD1-CD2 4.31Å; F128-F130 AromaticContact CD1-CE1 3.75Å; F128-F130 HydrophobicContact CD1-CE1 3.75Å; F128-F130 AromaticContact CD1-CE2 3.95Å; F128-F130 HydrophobicContact CD1-CE2 3.95Å; F128-F130 HydrophobicContact CD1-CG 4.41Å; F128-F130 AromaticContact CD1-CZ 3.66Å; F128-F130 HydrophobicContact CD1-CZ 3.66Å; F128-F130 HydrophobicContact CE1-CD1 4.37Å; F128-F130 HydrophobicContact CE1-CE1 4.17Å; F128-F130 HydrophobicContact CG-CZ 4.35Å; F130-Y136 WeakPolarHBondContact CA-OH 3.4Å; F130-Y136 HydrophobicContact CB-CE2 4.28Å; F130-Y136 HydrophobicContact CD1-CD1 4.03Å; F130-Y136 AromaticContact CD1-CD2 3.69Å; F130-Y136 HydrophobicContact CD1-CD2 3.69Å; F130-Y136 AromaticContact CD1-CE1 3.99Å; F130-Y136 HydrophobicContact CD1-CE1 3.99Å; F130-Y136 AromaticContact CD1-CE2 3.65Å; F130-Y136 HydrophobicContact CD1-CE2 3.65Å; F130-Y136 AromaticContact CD1-CG 3.86Å; F130-Y136 HydrophobicContact CD1-CG 3.86Å; F130-Y136 AromaticContact CD1-CZ 3.77Å; F130-Y136 HydrophobicContact CE1-CD1 4.13Å; F130-Y136 HydrophobicContact CE1-CD2 4.24Å; F130-Y136 HydrophobicContact CE1-CE1 4.46Å; F130-Y136 AromaticContact CE1-CG 3.98Å; F130-Y136 HydrophobicContact CE1-CG 3.98Å; F130-Y136 HydrophobicContact CG-CE2 4.45Å; F130-V158 HydrophobicContact CB-CG2 4.44Å; F130-V158 HydrophobicContact CD1-CG2 4.48Å
131	R	96.6	Very high	91.3	Very high	88 Å²	88	62.1 Å²	62.1	33%	0.332	33%	0.327	S	S	.	.			trans	-124.1	138.4	179.3	-58.9	-66.9	174.7	-178.4	-9.9	109.6	E129 R134 Y136	E129-R131 IonicContact OE2-CZ 3.63Å; E129-R131 IonicContact OE2-NH2 2.58Å; E129-R131 PolarHBondContact OE2-NH2 2.88Å; R131-R134 HydrophobicContact CB-CG 4.05Å; R131-R134 WeakPolarHBondContact O-CB 3.42Å; R131-R134 PolarHBondContact O-N 3.42Å; R131-Y136 PolarHBondContact N-OH 2.9Å
132	P	96.3	Very high	90.5	Very high	43 Å²	43	57 Å²	57	28%	0.279	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	147.6	173.9	-19.8	30	0	0	0	112.1	I54 L120 R134	I54-P132 HydrophobicContact CD1-CG 4.26Å; I54-P132 HydrophobicContact CG1-CG 3.86Å; L120-P132 HydrophobicContact CD2-CG 4.36Å; P132-R134 PolarHBondContact O-N 2.66Å
133	G	95.8	Very high	89.2	Confident	41 Å²	41	61.1 Å²	61.1	42%	0.423	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.8	16	-178.3	0	0	0	0	0	114.2	V158	G133-V158 WeakPolarHBondContact CA-O 3.42Å; G133-V158 PolarHBondContact N-O 3.45Å
134	R	97.3	Very high	88.2	Confident	152 Å²	152	55.5 Å²	55.5	57%	0.574	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.6	149.5	178.6	-62.4	-159.4	-178	-169.8	-4.9	112.2	R131 P132 Y136 V158	R131-R134 HydrophobicContact CB-CG 4.05Å; R131-R134 WeakPolarHBondContact O-CB 3.42Å; R131-R134 PolarHBondContact O-N 3.42Å; P132-R134 PolarHBondContact O-N 2.66Å; R134-Y136 HydrophobicContact CB-CE2 3.74Å; R134-V158 PolarHBondContact O-N 3.48Å
135	E	97.6	Very high	87	Confident	80 Å²	80	56.8 Å²	56.8	37%	0.374	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	143.1	173.8	-64.2	178.6	135	0	0	110.9	Y137 K155 V156 F157	E135-Y137 HydrophobicContact CB-CE2 4.04Å; E135-Y137 PolarHBondContact OE2-OH 2.78Å; E135-K155 WeakPolarHBondContact OE1-CD 3.43Å; E135-K155 WeakPolarHBondContact OE1-CE 3.28Å; E135-K155 IonicContact OE1-NZ 3.57Å; E135-K155 PolarHBondContact OE1-NZ 2.79Å; E135-V156 CarbonylContact C-O 3.59Å; E135-V156 WeakPolarHBondContact CA-O 3.1Å; E135-F157 HydrophobicContact CG-CB 4.35Å; E135-F157 HydrophobicContact CG-CD2 3.63Å; E135-F157 HydrophobicContact CG-CE2 4.43Å; E135-F157 HydrophobicContact CG-CG 4.42Å
136	Y	97.5	Very high	86.3	Confident	22 Å²	22	56.6 Å²	56.6	9%	0.086	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	145.3	-179.5	-63.9	-79.4	0	0	0	109.4	M81 F128 F130 R131 R134 V156 V158	M81-Y136 HydrophobicContact CE-CD1 3.38Å; M81-Y136 HydrophobicContact CE-CE1 4.27Å; M81-Y136 HydrophobicContact CE-CG 3.97Å; F128-Y136 AromaticContact CE1-CD1 3.78Å; F128-Y136 HydrophobicContact CE1-CD1 3.78Å; F128-Y136 AromaticContact CE1-CE1 3.5Å; F128-Y136 HydrophobicContact CE1-CE1 3.5Å; F128-Y136 HydrophobicContact CZ-CD1 4.32Å; F128-Y136 HydrophobicContact CZ-CE1 4.15Å; F130-Y136 WeakPolarHBondContact CA-OH 3.4Å; F130-Y136 HydrophobicContact CB-CE2 4.28Å; F130-Y136 HydrophobicContact CD1-CD1 4.03Å; F130-Y136 AromaticContact CD1-CD2 3.69Å; F130-Y136 HydrophobicContact CD1-CD2 3.69Å; F130-Y136 AromaticContact CD1-CE1 3.99Å; F130-Y136 HydrophobicContact CD1-CE1 3.99Å; F130-Y136 AromaticContact CD1-CE2 3.65Å; F130-Y136 HydrophobicContact CD1-CE2 3.65Å; F130-Y136 AromaticContact CD1-CG 3.86Å; F130-Y136 HydrophobicContact CD1-CG 3.86Å; F130-Y136 AromaticContact CD1-CZ 3.77Å; F130-Y136 HydrophobicContact CE1-CD1 4.13Å; F130-Y136 HydrophobicContact CE1-CD2 4.24Å; F130-Y136 HydrophobicContact CE1-CE1 4.46Å; F130-Y136 AromaticContact CE1-CG 3.98Å; F130-Y136 HydrophobicContact CE1-CG 3.98Å; F130-Y136 HydrophobicContact CG-CE2 4.45Å; R131-Y136 PolarHBondContact N-OH 2.9Å; R134-Y136 HydrophobicContact CB-CE2 3.74Å; Y136-V156 PolarHBondContact N-O 2.77Å; Y136-V156 PolarHBondContact O-N 3.38Å; Y136-V158 HydrophobicContact CD2-CG2 3.7Å; Y136-V158 HydrophobicContact CE2-CB 4.36Å; Y136-V158 HydrophobicContact CE2-CG2 3.64Å
137	Y	97.5	Very high	85.8	Confident	21 Å²	21	52.8 Å²	52.8	8%	0.082	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	131.8	-167.1	-54	-86.3	0	0	0	111.5	M81 V82 Y84 Y87 E135 K155	M81-Y137 WeakPolarHBondContact CA-O 3.34Å; V82-Y137 PolarHBondContact N-O 2.92Å; Y84-Y137 AromaticContact CD2-CE1 3.95Å; Y84-Y137 HydrophobicContact CD2-CE1 3.95Å; Y84-Y137 HydrophobicContact CD2-CE2 4.37Å; Y84-Y137 AromaticContact CD2-CZ 3.7Å; Y84-Y137 WeakPolarHBondContact CD2-OH 3.4Å; Y87-Y137 AromaticContact CD1-CD1 3.83Å; Y87-Y137 HydrophobicContact CD1-CD1 3.83Å; Y87-Y137 HydrophobicContact CD1-CE1 4.16Å; Y87-Y137 AromaticContact CD2-CD1 3.66Å; Y87-Y137 HydrophobicContact CD2-CD1 3.66Å; Y87-Y137 HydrophobicContact CD2-CG 4.21Å; Y87-Y137 HydrophobicContact CE1-CD1 4.31Å; Y87-Y137 HydrophobicContact CE1-CE1 4.5Å; Y87-Y137 HydrophobicContact CE2-CD1 4.12Å; Y87-Y137 AromaticContact CG-CD1 3.49Å; Y87-Y137 HydrophobicContact CG-CD1 3.49Å; Y87-Y137 VanDerWaalsContact CG-CD1 3.49Å; Y87-Y137 HydrophobicContact CG-CE1 4.26Å; Y87-Y137 HydrophobicContact CG-CG 4.05Å; E135-Y137 HydrophobicContact CB-CE2 4.04Å; E135-Y137 PolarHBondContact OE2-OH 2.78Å; Y137-K155 HydrophobicContact CD1-CB 4.34Å; Y137-K155 HydrophobicContact CD1-CG 4.07Å; Y137-K155 HydrophobicContact CE1-CB 4.39Å; Y137-K155 HydrophobicContact CE1-CD 3.92Å; Y137-K155 HydrophobicContact CE1-CG 3.73Å
138	Y	97.4	Very high	85.3	Confident	1 Å²	1	59 Å²	59	0%	0.004	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	139.3	176.5	-64.4	-93.5	0	0	0	110.1	L58 L79 Y80 M81 K153 L154 V156	L58-Y138 HydrophobicContact CD2-CE2 4.48Å; L79-Y138 HydrophobicContact CD2-CD1 4.31Å; L79-Y138 HydrophobicContact CG-CD1 4.34Å; Y80-Y138 VanDerWaalsContact O-CA 3.29Å; Y80-Y138 WeakPolarHBondContact O-CA 3.42Å; M81-Y138 HydrophobicContact CB-CD1 4.28Å; M81-Y138 HydrophobicContact CB-CE1 4.09Å; M81-Y138 HydrophobicContact CG-CE1 4.17Å; M81-Y138 HydrophobicContact SD-CE1 4.33Å; Y138-K153 CarbonylContact O-C 3.6Å; Y138-K153 VanDerWaalsContact O-CA 3.27Å; Y138-K153 WeakPolarHBondContact O-CA 3.45Å; Y138-L154 PolarHBondContact N-O 3.3Å; Y138-L154 PolarHBondContact O-N 3.08Å; Y138-V156 HydrophobicContact CD2-CG2 4.04Å; Y138-V156 HydrophobicContact CE2-CG2 3.96Å
139	I	96.3	Very high	84.4	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	152.5	173.9	66.9	172.4	0	0	0	111.2	Y80 V82 Y87 H92 L152 K153	Y80-I139 PolarHBondContact N-O 2.88Å; Y80-I139 PolarHBondContact O-N 3.34Å; V82-I139 HydrophobicContact CG1-CD1 3.88Å; V82-I139 HydrophobicContact CG1-CG1 3.9Å; V82-I139 HydrophobicContact CG2-CD1 4.23Å; V82-I139 HydrophobicContact CG2-CG1 4.08Å; V82-I139 HydrophobicContact CG2-CG2 3.96Å; Y87-I139 HydrophobicContact CD2-CG2 4.14Å; H92-I139 HydrophobicContact CB-CD1 4.21Å; I139-L152 CarbonylContact C-O 3.54Å; I139-L152 VanDerWaalsContact CA-O 3.31Å; I139-L152 WeakPolarHBondContact CA-O 3.46Å; I139-K153 HydrophobicContact CG2-CB 3.79Å
140	S	94.1	Very high	83.9	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	114.8	160.7	68.5	0	0	0	0	109.1	W36 V78 C151 L152	W36-S140 VanDerWaalsContact NE1-CB 3.28Å; W36-S140 PolarHBondContact NE1-OG 2.75Å; V78-S140 WeakPolarHBondContact O-CA 3.47Å; S140-C151 VanDerWaalsContact O-CA 3.27Å; S140-C151 WeakPolarHBondContact O-CA 3.48Å; S140-C151 WeakPolarHBondContact O-CB 3.36Å; S140-L152 PolarHBondContact N-O 3.43Å; S140-L152 PolarHBondContact O-N 3.32Å
141	S	82.1	Confident	83.7	Confident	27 Å²	27	62.7 Å²	62.7	19%	0.189	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	134.9	-179.2	-161.8	0	0	0	0	110.6
142	T	74.3	Confident	83.6	Confident	29 Å²	29	59.4 Å²	59.4	18%	0.178	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	134.8	166.4	47.4	0	0	0	0	107.9	R38 Y77 A144 T150	R38-T142 PolarHBondContact NH2-OG1 3.25Å; Y77-T142 HydrophobicContact CD1-CG2 3.65Å; Y77-T142 HydrophobicContact CE1-CG2 3.37Å; T142-A144 PolarHBondContact O-N 2.69Å; T142-T150 VanDerWaalsContact O-O 3.11Å; T142-T150 PolarHBondContact OG1-O 3.5Å
143	V	62.6	Low	83.6	Confident	114 Å²	114	59.6 Å²	59.6	69%	0.691	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	113.7	173.8	-176.1	0	0	0	0	107.2
144	A	65.1	Low	83.7	Confident	16 Å²	16	57.6 Å²	57.6	13%	0.132	31%	0.311	C	S	.	.			trans	-69.3	153.7	173.3	0	0	0	0	0	109.9	T142 N146 G147 K148	T142-A144 PolarHBondContact O-N 2.69Å; A144-N146 WeakPolarHBondContact CB-OD1 3.47Å; A144-N146 PolarHBondContact O-N 2.94Å; A144-G147 PolarHBondContact O-N 3.31Å; A144-K148 WeakPolarHBondContact CB-O 3.32Å; A144-K148 PolarHBondContact N-O 2.81Å
145	P	59.3	Low	83.7	Confident	147 Å²	147	53.1 Å²	53.1	96%	0.955	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-24.7	-178.7	-26	34.2	0	0	0	114.4	G147	P145-G147 PolarHBondContact O-N 2.85Å
146	N	65.5	Low	83.8	Confident	113 Å²	113	49.3 Å²	49.3	60%	0.604	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	8.4	177.3	63.6	3.9	0	0	0	113.8	A144 K148	A144-N146 WeakPolarHBondContact CB-OD1 3.47Å; A144-N146 PolarHBondContact O-N 2.94Å; N146-K148 PolarHBondContact O-N 3.46Å; N146-K148 VanDerWaalsContact O-N 3.12Å; N146-K148 WeakPolarHBondContact OD1-CB 3.17Å; N146-K148 PolarHBondContact OD1-N 3.2Å
147	G	68.1	Low	83.8	Confident	55 Å²	55	51.1 Å²	51.1	57%	0.567	29%	0.286	S	S	*	.	S	Bend	trans	72.6	-4.4	-178.3	0	0	0	0	0	114.9	A144 P145 K149	A144-G147 PolarHBondContact O-N 3.31Å; P145-G147 PolarHBondContact O-N 2.85Å; G147-K149 PolarHBondContact O-N 3.04Å
148	K	68.6	Low	83.8	Confident	149 Å²	149	50.1 Å²	50.1	65%	0.648	28%	0.282	S	S	*	.			trans	-72.6	126.1	173.8	-69.4	-172	175.7	-177.6	0	109.3	A144 N146 T150	A144-K148 WeakPolarHBondContact CB-O 3.32Å; A144-K148 PolarHBondContact N-O 2.81Å; N146-K148 PolarHBondContact O-N 3.46Å; N146-K148 VanDerWaalsContact O-N 3.12Å; N146-K148 WeakPolarHBondContact OD1-CB 3.17Å; N146-K148 PolarHBondContact OD1-N 3.2Å; K148-T150 PolarHBondContact O-N 2.63Å
149	K	71.4	Confident	83.7	Confident	122 Å²	122	53.2 Å²	53.2	53%	0.53	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	108	171.5	-66	-175.9	-179.2	-178.6	0	108.4	G147	G147-K149 PolarHBondContact O-N 3.04Å
150	T	82.6	Confident	83.6	Confident	73 Å²	73	55.5 Å²	55.5	45%	0.448	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	131.8	168.1	58.2	0	0	0	0	108	T142 K148	T142-T150 VanDerWaalsContact O-O 3.11Å; T142-T150 PolarHBondContact OG1-O 3.5Å; K148-T150 PolarHBondContact O-N 2.63Å
151	C	91.3	Very high	83.2	Confident	24 Å²	24	59.4 Å²	59.4	16%	0.162	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	147.2	178.1	72.8	0	0	0	0	111.4	C90 S140	C90-C151 VanDerWaalsContact CA-SG 3.56Å; C90-C151 HydrophobicContact CB-CB 3.58Å; C90-C151 WeakPolarHBondContact CB-SG 2.9Å; C90-C151 WeakPolarHBondContact SG-CB 3.37Å; C90-C151 PolarHBondContact SG-N 2.84Å; C90-C151 CovalentContact SG-SG 2.03Å; C90-C151 PolarHBondContact SG-SG 3.33Å; S140-C151 VanDerWaalsContact O-CA 3.27Å; S140-C151 WeakPolarHBondContact O-CA 3.48Å; S140-C151 WeakPolarHBondContact O-CB 3.36Å
152	L	95.2	Very high	83.4	Confident	19 Å²	19	64.1 Å²	64.1	10%	0.099	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	138.4	159.5	-55.9	174.3	0	0	0	107.1	W36 R38 F43 Y77 I139 S140	W36-L152 HydrophobicContact CZ2-CB 4.13Å; R38-L152 HydrophobicContact CG-CD1 4.32Å; R38-L152 HydrophobicContact CG-CD2 4.09Å; R38-L152 HydrophobicContact CG-CG 4.49Å; F43-L152 HydrophobicContact CB-CD2 3.75Å; F43-L152 HydrophobicContact CD1-CB 4.02Å; F43-L152 HydrophobicContact CD1-CD2 4.37Å; F43-L152 HydrophobicContact CE1-CB 4.25Å; F43-L152 HydrophobicContact CG-CB 4.44Å; F43-L152 HydrophobicContact CG-CD2 4.05Å; Y77-L152 HydrophobicContact CE1-CD1 4.37Å; Y77-L152 HydrophobicContact CE2-CD1 4.18Å; I139-L152 CarbonylContact C-O 3.54Å; I139-L152 VanDerWaalsContact CA-O 3.31Å; I139-L152 WeakPolarHBondContact CA-O 3.46Å; S140-L152 PolarHBondContact N-O 3.43Å; S140-L152 PolarHBondContact O-N 3.32Å
153	K	95.9	Very high	83.8	Confident	46 Å²	46	65 Å²	65	20%	0.2	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	144	-175.2	67.7	-173.9	-170.5	177.3	0	111.8	F43 G46 Y87 Y138 I139	F43-K153 WeakPolarHBondContact CD1-O 3.45Å; F43-K153 WeakPolarHBondContact CE1-O 3.4Å; G46-K153 WeakPolarHBondContact O-CE 3.39Å; Y87-K153 HydrophobicContact CD2-CB 3.87Å; Y87-K153 HydrophobicContact CD2-CD 4.06Å; Y87-K153 HydrophobicContact CD2-CG 4.25Å; Y87-K153 HydrophobicContact CE1-CD 4.16Å; Y87-K153 HydrophobicContact CE2-CB 3.51Å; Y87-K153 HydrophobicContact CE2-CD 3.62Å; Y87-K153 HydrophobicContact CE2-CG 3.55Å; Y138-K153 CarbonylContact O-C 3.6Å; Y138-K153 VanDerWaalsContact O-CA 3.27Å; Y138-K153 WeakPolarHBondContact O-CA 3.45Å; I139-K153 HydrophobicContact CG2-CB 3.79Å
154	L	98.1	Very high	84.7	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	130.4	-179.3	174.8	68.3	0	0	0	109.1	V34 W36 F43 Y48 I50 L58 Y138 V156	V34-L154 HydrophobicContact CG2-CD2 4.35Å; W36-L154 HydrophobicContact CH2-CB 3.72Å; W36-L154 HydrophobicContact CZ3-CB 3.6Å; W36-L154 HydrophobicContact CZ3-CD2 3.98Å; W36-L154 HydrophobicContact CZ3-CG 4.44Å; F43-L154 HydrophobicContact CE1-CB 4.45Å; Y48-L154 HydrophobicContact CD1-CD1 4.19Å; Y48-L154 HydrophobicContact CD2-CD1 4.19Å; Y48-L154 HydrophobicContact CE2-CD1 4.48Å; Y48-L154 HydrophobicContact CG-CD1 4Å; Y48-L154 WeakPolarHBondContact O-CA 3.45Å; I50-L154 HydrophobicContact CD1-CD2 4.47Å; I50-L154 HydrophobicContact CG1-CD1 4.38Å; I50-L154 HydrophobicContact CG2-CD1 4.49Å; L58-L154 HydrophobicContact CD1-CD2 4.4Å; L58-L154 HydrophobicContact CD2-CD2 4.09Å; Y138-L154 PolarHBondContact N-O 3.3Å; Y138-L154 PolarHBondContact O-N 3.08Å; L154-V156 HydrophobicContact CD2-CG2 4.01Å; L154-V156 HydrophobicContact CG-CG2 4.07Å
155	K	98.3	Very high	85.2	Confident	57 Å²	57	66.7 Å²	66.7	25%	0.248	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	132.6	168	-175.7	-179.8	80.6	154.9	0	109.6	Y48 H49 I50 E135 Y137	Y48-K155 PolarHBondContact O-N 2.8Å; H49-K155 CarbonylContact C-O 3.54Å; H49-K155 WeakPolarHBondContact CA-O 3.47Å; H49-K155 HydrophobicContact CB-CB 3.91Å; H49-K155 WeakPolarHBondContact CB-O 3.45Å; I50-K155 PolarHBondContact N-O 3.41Å; E135-K155 WeakPolarHBondContact OE1-CD 3.43Å; E135-K155 WeakPolarHBondContact OE1-CE 3.28Å; E135-K155 IonicContact OE1-NZ 3.57Å; E135-K155 PolarHBondContact OE1-NZ 2.79Å; Y137-K155 HydrophobicContact CD1-CB 4.34Å; Y137-K155 HydrophobicContact CD1-CG 4.07Å; Y137-K155 HydrophobicContact CE1-CB 4.39Å; Y137-K155 HydrophobicContact CE1-CD 3.92Å; Y137-K155 HydrophobicContact CE1-CG 3.73Å
156	V	98.3	Very high	85.2	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	117.7	175.2	-178.3	0	0	0	0	108.4	I50 V52 L58 F118 E135 Y136 Y138 L154	I50-V156 HydrophobicContact CD1-CG1 4.5Å; I50-V156 HydrophobicContact CD1-CG2 4.09Å; I50-V156 HydrophobicContact CG1-CB 4.37Å; I50-V156 HydrophobicContact CG1-CG1 4.18Å; I50-V156 HydrophobicContact CG1-CG2 3.9Å; I50-V156 WeakPolarHBondContact O-CA 3.08Å; V52-V156 HydrophobicContact CB-CG1 4.49Å; V52-V156 HydrophobicContact CG1-CG1 4.12Å; V52-V156 HydrophobicContact CG2-CG1 3.54Å; L58-V156 HydrophobicContact CD2-CG2 4.42Å; F118-V156 HydrophobicContact CD1-CG1 4.49Å; F118-V156 HydrophobicContact CE1-CG1 3.63Å; F118-V156 HydrophobicContact CE2-CG1 4.46Å; F118-V156 HydrophobicContact CZ-CG1 3.62Å; F118-V156 HydrophobicContact CZ-CG2 4.49Å; E135-V156 CarbonylContact C-O 3.59Å; E135-V156 WeakPolarHBondContact CA-O 3.1Å; Y136-V156 PolarHBondContact N-O 2.77Å; Y136-V156 PolarHBondContact O-N 3.38Å; Y138-V156 HydrophobicContact CD2-CG2 4.04Å; Y138-V156 HydrophobicContact CE2-CG2 3.96Å; L154-V156 HydrophobicContact CD2-CG2 4.01Å; L154-V156 HydrophobicContact CG-CG2 4.07Å
157	F	98	Very high	84.2	Confident	61 Å²	61	64 Å²	64	27%	0.268	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	118.5	172.4	178.4	-121.1	0	0	0	109.5	I50 D51 V52 E135 R159	I50-F157 PolarHBondContact O-N 3.44Å; D51-F157 WeakPolarHBondContact CA-O 3.41Å; D51-F157 WeakPolarHBondContact OD1-CB 3.22Å; V52-F157 PolarHBondContact N-O 2.85Å; E135-F157 HydrophobicContact CG-CB 4.35Å; E135-F157 HydrophobicContact CG-CD2 3.63Å; E135-F157 HydrophobicContact CG-CE2 4.43Å; E135-F157 HydrophobicContact CG-CG 4.42Å; F157-R159 HydrophobicContact CD1-CG 4.17Å; F157-R159 HydrophobicContact CE1-CG 4.23Å; F157-R159 PolarHBondContact O-N 2.75Å
158	V	97.2	Very high	82.9	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	108.5	173.6	-177	0	0	0	0	107.3	V52 I54 F118 F130 G133 R134 Y136	V52-V158 HydrophobicContact CG2-CB 4.47Å; V52-V158 HydrophobicContact CG2-CG2 3.91Å; V52-V158 CarbonylContact O-C 3.54Å; V52-V158 WeakPolarHBondContact O-CA 3.2Å; I54-V158 HydrophobicContact CD1-CG1 3.61Å; I54-V158 HydrophobicContact CG1-CG1 4.03Å; F118-V158 HydrophobicContact CD1-CG2 4.09Å; F130-V158 HydrophobicContact CB-CG2 4.44Å; F130-V158 HydrophobicContact CD1-CG2 4.48Å; G133-V158 WeakPolarHBondContact CA-O 3.42Å; G133-V158 PolarHBondContact N-O 3.45Å; R134-V158 PolarHBondContact O-N 3.48Å; Y136-V158 HydrophobicContact CD2-CG2 3.7Å; Y136-V158 HydrophobicContact CE2-CB 4.36Å; Y136-V158 HydrophobicContact CE2-CG2 3.64Å
159	R	95.6	Very high	81.8	Confident	66 Å²	66	69.9 Å²	69.9	25%	0.249	36%	0.357	C	S	.	.			trans	-58.7	143	-177.4	-76.2	-166.3	-68	156.3	-6.3	111.7	D51 V52 C53 F157 S163 C164	D51-R159 HydrophobicContact CB-CG 4.02Å; V52-R159 WeakPolarHBondContact O-CB 3.32Å; V52-R159 PolarHBondContact O-N 3.21Å; C53-R159 PolarHBondContact SG-NH2 3.35Å; F157-R159 HydrophobicContact CD1-CG 4.17Å; F157-R159 HydrophobicContact CE1-CG 4.23Å; F157-R159 PolarHBondContact O-N 2.75Å; R159-S163 WeakPolarHBondContact CB-OG 3.34Å; R159-S163 PolarHBondContact NH1-O 3.41Å; R159-C164 VanDerWaalsContact CB-SG 3.58Å
160	P	94	Very high	80.3	Confident	48 Å²	48	69.4 Å²	69.4	31%	0.312	37%	0.365	S	S	.	.			trans	-56.1	147.6	170.7	-26.8	36.1	0	0	0	112.2	N162 S163 C164	P160-N162 VanDerWaalsContact CB-OD1 3.29Å; P160-N162 WeakPolarHBondContact CB-OD1 3.32Å; P160-N162 PolarHBondContact O-N 3.32Å; P160-N162 VanDerWaalsContact O-N 3.11Å; P160-S163 WeakPolarHBondContact CD-OG 3.3Å; P160-S163 PolarHBondContact O-N 3.39Å; P160-S163 PolarHBondContact O-OG 3.05Å; P160-C164 PolarHBondContact O-N 3Å
161	S	86.3	Confident	78.4	Confident	81 Å²	81	74.7 Å²	74.7	57%	0.566	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-56.2	-34.7	-172	-51.7	0	0	0	0	114.3	S163 C164	S161-S163 VanDerWaalsContact C-N 3.33Å; S161-S163 PolarHBondContact O-N 3.12Å; S161-C164 PolarHBondContact O-N 2.64Å
162	N	85.4	Confident	75.8	Confident	126 Å²	126	81 Å²	81	67%	0.674	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-65.9	-33.4	177.3	61.8	-18.5	0	0	0	112.9	P160 C164	P160-N162 VanDerWaalsContact CB-OD1 3.29Å; P160-N162 WeakPolarHBondContact CB-OD1 3.32Å; P160-N162 PolarHBondContact O-N 3.32Å; P160-N162 VanDerWaalsContact O-N 3.11Å; N162-C164 VanDerWaalsContact C-N 3.31Å
163	S	83	Confident	73.3	Confident	48 Å²	48	87 Å²	87	34%	0.336	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-83.2	-8.7	179.7	66.4	0	0	0	0	113.7	R159 P160 S161	R159-S163 WeakPolarHBondContact CB-OG 3.34Å; R159-S163 PolarHBondContact NH1-O 3.41Å; P160-S163 WeakPolarHBondContact CD-OG 3.3Å; P160-S163 PolarHBondContact O-N 3.39Å; P160-S163 PolarHBondContact O-OG 3.05Å; S161-S163 VanDerWaalsContact C-N 3.33Å; S161-S163 PolarHBondContact O-N 3.12Å
164	C	82.6	Confident	70.6	Confident	33 Å²	33	91 Å²	91	22%	0.223	47%	0.468	C	S	.	.	G	3₁₀ helix	trans	-91	-8.2	176.5	-77.5	0	0	0	0	114	C53 R159 P160 S161 N162 K166	C53-C164 WeakPolarHBondContact CA-SG 3.46Å; C53-C164 HydrophobicContact CB-CB 3.77Å; C53-C164 WeakPolarHBondContact CB-SG 3.24Å; C53-C164 WeakPolarHBondContact SG-CA 3.45Å; C53-C164 WeakPolarHBondContact SG-CB 3.46Å; C53-C164 CovalentContact SG-SG 2.03Å; C53-C164 PolarHBondContact SG-SG 3.03Å; R159-C164 VanDerWaalsContact CB-SG 3.58Å; P160-C164 PolarHBondContact O-N 3Å; S161-C164 PolarHBondContact O-N 2.64Å; N162-C164 VanDerWaalsContact C-N 3.31Å; C164-K166 PolarHBondContact O-N 3.32Å
165	L	74.4	Confident	67.6	Low	133 Å²	133	98.6 Å²	98.6	70%	0.696	51%	0.509	S	S	*	.	S	Bend	trans	-62	108.1	166.2	-62.7	173.8	0	0	0	106.4	T167	L165-T167 PolarHBondContact O-N 2.85Å
166	K	59.8	Low	64.9	Low	92 Å²	92	106.2 Å²	106.2	40%	0.4	54%	0.536	S	S	.	.			trans	-59.4	97.6	165.2	-85.4	174.1	176.1	163.5	0	105.4	D30 C164 D168	D30-K166 IonicContact OD1-NZ 3.59Å; D30-K166 PolarHBondContact OD1-NZ 3.3Å; D30-K166 WeakPolarHBondContact OD2-CE 3.47Å; D30-K166 IonicContact OD2-NZ 2.9Å; D30-K166 PolarHBondContact OD2-NZ 3.11Å; C164-K166 PolarHBondContact O-N 3.32Å; K166-D168 PolarHBondContact O-N 2.87Å
167	T	44.1	Very low	61.8	Low	110 Å²	110	112.9 Å²	112.9	68%	0.675	58%	0.576	S	S	*	*			trans	-55.2	108	149.3	-34.1	0	0	0	0	102.6	L165 R169	L165-T167 PolarHBondContact O-N 2.85Å; T167-R169 PolarHBondContact O-N 2.98Å
168	D	41.5	Very low	58.8	Low	113 Å²	113	117.4 Å²	117.4	60%	0.604	60%	0.598	S	S	*	*			trans	-57.8	93.4	160	-82.9	-31.9	0	0	0	104.4	K166 V170 R195	K166-D168 PolarHBondContact O-N 2.87Å; D168-V170 PolarHBondContact O-N 2.85Å; D168-R195 IonicContact OD1-NH2 3.44Å; D168-R195 PolarHBondContact OD1-NH2 3.26Å
169	R	43.8	Very low	55.7	Low	215 Å²	215	123 Å²	123	81%	0.811	64%	0.637	S	S	*	*			trans	-69.1	77.7	171.9	-65.8	-170.8	-169.7	-171.6	3.2	105.4	T167 F171	T167-R169 PolarHBondContact O-N 2.98Å; R169-F171 PolarHBondContact O-N 3.12Å
170	V	41	Very low	52.8	Low	113 Å²	113	125.4 Å²	125.4	69%	0.685	66%	0.66	S	S	*	*			trans	-57.4	117.6	146	177.8	0	0	0	0	104.1	D168 D172	D168-V170 PolarHBondContact O-N 2.85Å; V170-D172 VanDerWaalsContact C-N 3.28Å; V170-D172 PolarHBondContact O-N 3.4Å
171	F	43.1	Very low	49.9	Very low	184 Å²	184	131 Å²	131	81%	0.807	69%	0.686	S	S	*	*			trans	-59.6	95.2	168.4	-76.1	-96.7	0	0	0	107.6	R169 I173	R169-F171 PolarHBondContact O-N 3.12Å; F171-I173 VanDerWaalsContact C-N 3.33Å; F171-I173 PolarHBondContact O-N 3.35Å
172	D	35.2	Very low	47.5	Very low	157 Å²	157	132.7 Å²	132.7	84%	0.84	70%	0.695	S	S	*	*			trans	-76.3	96.8	155.1	-87.8	-35.3	0	0	0	106.2	V170	V170-D172 VanDerWaalsContact C-N 3.28Å; V170-D172 PolarHBondContact O-N 3.4Å
173	I	44.1	Very low	44.8	Very low	145 Å²	145	138.5 Å²	138.5	74%	0.744	71%	0.708	S	S	*	*			trans	-82.5	127.2	158.8	-70.1	174.6	0	0	0	106.9	F171	F171-I173 VanDerWaalsContact C-N 3.33Å; F171-I173 PolarHBondContact O-N 3.35Å
174	D	39.1	Very low	42.2	Very low	129 Å²	129	143.3 Å²	143.3	69%	0.69	73%	0.729	S	S	*	*			trans	87.6	100.8	163.9	-121.7	4.5	0	0	0	117.6
175	D	34.1	Very low	39.5	Very low	160 Å²	160	149.8 Å²	149.8	86%	0.856	76%	0.756	S	S	*	*				-156.1	134.2	102.2	-106.2	-33	0	0	0	112
176	R	41.7	Very low	37.6	Very low	216 Å²	216	148 Å²	148	82%	0.815	75%	0.751	S	S	*	*			trans	-72.9	119.9	-172	-179.3	-173.1	-169.9	166.7	2.9	112.4
177	V	34	Very low	36	Very low	141 Å²	141	149.7 Å²	149.7	86%	0.855	77%	0.774	S	S	*	*			trans	-143.3	123	146.9	-177	0	0	0	0	111.1
178	E	35.1	Very low	35.7	Very low	155 Å²	155	149.9 Å²	149.9	72%	0.724	77%	0.767	S	S	*	*			trans	-54.4	130	171.5	-166.3	105.5	-164	0	0	113
179	S	31.5	Very low	35.3	Very low	117 Å²	117	154 Å²	154	82%	0.818	78%	0.783	S	S	*	*			trans	-152.7	114	144.5	45.9	0	0	0	0	110.1
180	T	35.8	Very low	35.3	Very low	118 Å²	118	147.3 Å²	147.3	72%	0.724	77%	0.766	S	S	*	*			trans	-63.8	136.7	-179.5	-12	0	0	0	0	111.5
181	L	31.9	Very low	35.3	Very low	166 Å²	166	143.5 Å²	143.5	87%	0.869	75%	0.746	S	S	*	*			trans	171.3	145	131.7	-88.6	162.4	0	0	0	111.1
182	P	35.4	Very low	35.3	Very low	116 Å²	116	139.1 Å²	139.1	75%	0.753	75%	0.745	S	S	*	*			trans	-93.2	141.7	-162.8	35.6	-31.9	0	0	0	112.7
183	R	29.9	Very low	35.7	Very low	248 Å²	248	134.5 Å²	134.5	94%	0.936	72%	0.723	S	S	*	*			trans	-143.8	119	157.9	-136.8	174.1	-176.3	161	0.6	111.2
184	D	27.5	Very low	35.5	Very low	148 Å²	148	133.2 Å²	133.2	79%	0.791	73%	0.727	S	S	*	*			trans	-59	139.7	171.7	-165.4	11.4	0	0	0	111.1
185	E	26.7	Very low	36.2	Very low	169 Å²	169	134.6 Å²	134.6	79%	0.79	72%	0.722	S	S	*	*			trans	154.7	111.5	136	-79	-152.2	145.8	0	0	113.1
186	T	33.6	Very low	36.1	Very low	96 Å²	96	132.8 Å²	132.8	59%	0.589	72%	0.723	S	S	*	*			trans	56.4	90.8	137.2	-32	0	0	0	0	118.6	H188	T186-H188 PolarHBondContact O-N 3.48Å; T186-H188 VanDerWaalsContact O-N 3.15Å
187	S	26.3	Very low	35.8	Very low	127 Å²	127	129.3 Å²	129.3	89%	0.888	72%	0.716	S	S	*	*			trans	-68.9	103.5	165	55.1	0	0	0	0	111.2
188	H	37.4	Very low	35.7	Very low	114 Å²	114	129.7 Å²	129.7	53%	0.528	72%	0.718	S	S	.	*			trans	-91.4	123.6	164.9	-81.1	-82.3	0	0	0	109.9	T186 T190	T186-H188 PolarHBondContact O-N 3.48Å; T186-H188 VanDerWaalsContact O-N 3.15Å; H188-T190 PolarHBondContact O-N 3.48Å
189	E	33.3	Very low	35.6	Very low	201 Å²	201	129.6 Å²	129.6	94%	0.939	72%	0.723	S	S	*	*			trans	-81.3	99.3	-178.2	-164.4	173.8	128	0	0	110.3
190	T	44.3	Very low	35.9	Very low	73 Å²	73	129 Å²	129	45%	0.448	73%	0.725	S	S	.	*	P	Polyproline II helix	trans	-75.6	139.1	173.3	-47.2	0	0	0	0	110.4	H188 A192	H188-T190 PolarHBondContact O-N 3.48Å; T190-A192 PolarHBondContact O-N 3.3Å
191	A	42.2	Very low	35.9	Very low	33 Å²	33	128.2 Å²	128.2	27%	0.273	73%	0.73	S	S	.	*	P	Polyproline II helix	trans	-68.2	129	178.3	0	0	0	0	0	112.1
192	A	41.7	Very low	36.2	Very low	93 Å²	93	130 Å²	130	77%	0.769	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-83.4	146.9	-178.7	0	0	0	0	0	113.3	T190	T190-A192 PolarHBondContact O-N 3.3Å
193	P	44.9	Very low	36.3	Very low	60 Å²	60	135.3 Å²	135.3	39%	0.39	74%	0.739	S	S	.	*	P	Polyproline II helix	trans	-77.2	148.6	172.3	30.3	-31.8	0	0	0	112.1	D30	D30-P193 HydrophobicContact CB-CB 4.28Å
194	S	38.5	Very low	37.2	Very low	117 Å²	117	129.4 Å²	129.4	82%	0.818	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-82.9	125.6	174.6	57.3	0	0	0	0	111.4
195	R	54.8	Low	37.9	Very low	158 Å²	158	131.5 Å²	131.5	60%	0.596	73%	0.73	S	S	*	*			trans	-117.8	147.4	-171	-145.7	175	-177.8	174.4	-3.9	112.8	D168	D168-R195 IonicContact OD1-NH2 3.44Å; D168-R195 PolarHBondContact OD1-NH2 3.26Å
196	S	32.4	Very low	38.6	Very low	123 Å²	123	132 Å²	132	86%	0.86	73%	0.73	S	S	*	*			trans	-127.4	133	168.7	174	0	0	0	0	108.3
197	E	33.6	Very low	39.4	Very low	143 Å²	143	130.4 Å²	130.4	67%	0.668	72%	0.72	S	S	*	*			trans	-114.5	146.1	-162.1	-64.2	-178.6	151	0	0	113.7
198	T	33.4	Very low	40.6	Very low	149 Å²	149	128.4 Å²	128.4	91%	0.914	71%	0.706	S	S	*	*			trans	-154.4	129.3	154.6	30	0	0	0	0	110.2
199	N	33.1	Very low	41.3	Very low	153 Å²	153	127.3 Å²	127.3	82%	0.818	71%	0.711	S	S	*	*			trans	-101.4	135.1	-169.9	-68.7	-41.9	0	0	0	112.7
200	A	37.6	Very low	42.3	Very low	105 Å²	105	123.3 Å²	123.3	87%	0.868	70%	0.696	S	S	*	*			trans	-175.7	88.9	153.8	0	0	0	0	0	112.3
201	A	36	Very low	42.9	Very low	100 Å²	100	124.9 Å²	124.9	83%	0.826	70%	0.701	S	S	*	*			trans	-161.2	76.5	168.6	0	0	0	0	0	114.1
202	Q	37.1	Very low	43.6	Very low	203 Å²	203	126 Å²	126	95%	0.949	71%	0.71	S	S	*	*	S	Bend	trans	-133.9	7.7	162.7	-142.1	168	-12.8	0	0	113.8
203	R	38.5	Very low	44.3	Very low	228 Å²	228	127.2 Å²	127.2	86%	0.86	70%	0.703	S	S	*	*	S	Bend	trans	-109.4	-4	-174.7	-138.9	177.3	-168.6	-137.8	2.5	115.6
204	L	48	Very low	45.1	Very low	125 Å²	125	129.7 Å²	129.7	65%	0.654	71%	0.713	S	S	*	*	S	Bend	trans	-96	-18.7	-159.3	-144.7	74.7	0	0	0	116	T207	L204-T207 PolarHBondContact O-OG1 3.35Å; L204-T207 VanDerWaalsContact O-OG1 3.04Å
205	Q	42.9	Very low	46	Very low	191 Å²	191	129.2 Å²	129.2	89%	0.893	70%	0.7	S	S	*	*	H	α-helix	trans	-81.2	-22.6	-174	-154.9	151.5	-13.9	0	0	113.4
206	K	40.8	Very low	46.4	Very low	180 Å²	180	126.7 Å²	126.7	78%	0.783	70%	0.702	S	S	*	*	H	α-helix	trans	-87.4	-18.2	179.9	-150.3	169.9	-174.3	175.7	0	113.2
207	T	49.8	Very low	47.7	Very low	62 Å²	62	124.5 Å²	124.5	38%	0.38	68%	0.683	S	S	.	*	H	α-helix	trans	-84.5	-31.2	-175.9	52.8	0	0	0	0	113.2	L204 S209 L210 L211	L204-T207 PolarHBondContact O-OG1 3.35Å; L204-T207 VanDerWaalsContact O-OG1 3.04Å; T207-S209 PolarHBondContact O-N 3.33Å; T207-L210 PolarHBondContact O-N 3.36Å; T207-L211 PolarHBondContact O-N 3.45Å
208	S	52.5	Low	48.9	Very low	86 Å²	86	121.7 Å²	121.7	60%	0.601	67%	0.673	S	S	*	*	H	α-helix	trans	-63.6	-41.6	-178.3	179.1	0	0	0	0	113.2	L210 A212	S208-L210 PolarHBondContact O-N 3.29Å; S208-A212 PolarHBondContact O-N 2.88Å
209	S	52	Low	50.1	Low	90 Å²	90	119.1 Å²	119.1	63%	0.629	66%	0.657	S	S	*	*	H	α-helix	trans	-71.7	-26.9	-179.1	-171.4	0	0	0	0	113.8	T207	T207-S209 PolarHBondContact O-N 3.33Å
210	L	54.9	Low	51.1	Low	117 Å²	117	113.5 Å²	113.5	61%	0.613	63%	0.634	S	S	*	*	H	α-helix	trans	-79.4	-35.8	179.8	-74	164.5	0	0	0	111.7	T207 S208 L213 L214	T207-L210 PolarHBondContact O-N 3.36Å; S208-L210 PolarHBondContact O-N 3.29Å; L210-L213 PolarHBondContact O-N 2.89Å; L210-L214 PolarHBondContact O-N 2.91Å; L210-L214 VanDerWaalsContact O-N 3.08Å
211	L	55.3	Low	52	Low	107 Å²	107	114.9 Å²	114.9	56%	0.56	63%	0.627	S	S	*	*	H	α-helix	trans	-67.9	-39.5	176.7	-91.8	150.9	0	0	0	112.4	T207 L213 L214 L215	T207-L211 PolarHBondContact O-N 3.45Å; L211-L213 VanDerWaalsContact C-N 3.34Å; L211-L213 PolarHBondContact O-N 2.91Å; L211-L214 PolarHBondContact O-N 3.46Å; L211-L215 WeakPolarHBondContact O-CD1 3.41Å; L211-L215 WeakPolarHBondContact O-CG 3.25Å; L211-L215 PolarHBondContact O-N 3.4Å
212	A	57.5	Low	52.7	Low	56 Å²	56	118.5 Å²	118.5	46%	0.463	62%	0.624	S	S	.	*	H	α-helix	trans	-62.8	-40	175.4	0	0	0	0	0	112.2	S208 V216	S208-A212 PolarHBondContact O-N 2.88Å; A212-V216 WeakPolarHBondContact O-CG2 3.42Å; A212-V216 PolarHBondContact O-N 3.27Å
213	L	57.3	Low	53.3	Low	119 Å²	119	114 Å²	114	62%	0.623	61%	0.611	S	S	*	*	H	α-helix	trans	-70.2	-38.6	178.7	-160	69.8	0	0	0	111.8	L210 L211 V216 T217	L210-L213 PolarHBondContact O-N 2.89Å; L211-L213 VanDerWaalsContact C-N 3.34Å; L211-L213 PolarHBondContact O-N 2.91Å; L213-V216 PolarHBondContact O-N 3.31Å; L213-T217 WeakPolarHBondContact O-CG2 3.37Å; L213-T217 PolarHBondContact O-N 2.94Å; L213-T217 VanDerWaalsContact O-N 3.12Å; L213-T217 PolarHBondContact O-OG1 2.89Å
214	L	60.8	Low	53.6	Low	112 Å²	112	113.6 Å²	113.6	59%	0.586	63%	0.625	S	S	*	*	H	α-helix	trans	-64	-41	176.7	-141.7	94	0	0	0	111.8	L210 L211 T217 L218	L210-L214 PolarHBondContact O-N 2.91Å; L210-L214 VanDerWaalsContact O-N 3.08Å; L211-L214 PolarHBondContact O-N 3.46Å; L214-T217 WeakPolarHBondContact CA-OG1 3.28Å; L214-T217 PolarHBondContact O-N 3.47Å; L214-T217 PolarHBondContact O-OG1 3.48Å; L214-L218 HydrophobicContact CD2-CD1 4.4Å; L214-L218 HydrophobicContact CG-CD1 4.42Å; L214-L218 WeakPolarHBondContact O-CD1 3.48Å; L214-L218 PolarHBondContact O-N 3.23Å
215	L	58.1	Low	53.9	Low	106 Å²	106	113.1 Å²	113.1	56%	0.555	62%	0.623	S	S	*	*	H	α-helix	trans	-64.4	-41.6	177.7	-78.8	161.8	0	0	0	112.2	L211 T217 L218 V219	L211-L215 WeakPolarHBondContact O-CD1 3.41Å; L211-L215 WeakPolarHBondContact O-CG 3.25Å; L211-L215 PolarHBondContact O-N 3.4Å; L215-T217 VanDerWaalsContact C-N 3.34Å; L215-T217 PolarHBondContact O-N 3.41Å; L215-L218 PolarHBondContact O-N 3.46Å; L215-V219 VanDerWaalsContact O-CG2 3.32Å; L215-V219 WeakPolarHBondContact O-CG2 3.49Å; L215-V219 PolarHBondContact O-N 3.36Å; L215-V219 VanDerWaalsContact O-N 3.12Å
216	V	63.6	Low	54.5	Low	106 Å²	106	108.9 Å²	108.9	64%	0.642	61%	0.609	S	S	*	*	H	α-helix	trans	-64.9	-38.9	176.2	174.2	0	0	0	0	111.3	A212 L213 G220	A212-V216 WeakPolarHBondContact O-CG2 3.42Å; A212-V216 PolarHBondContact O-N 3.27Å; L213-V216 PolarHBondContact O-N 3.31Å; V216-G220 PolarHBondContact O-N 3.3Å
217	T	58.3	Low	55.2	Low	76 Å²	76	105 Å²	105	47%	0.466	60%	0.599	S	S	.	*	H	α-helix	trans	-68.5	-37.6	177	55.5	0	0	0	0	113.3	L213 L214 L215 G220 L221	L213-T217 WeakPolarHBondContact O-CG2 3.37Å; L213-T217 PolarHBondContact O-N 2.94Å; L213-T217 VanDerWaalsContact O-N 3.12Å; L213-T217 PolarHBondContact O-OG1 2.89Å; L214-T217 WeakPolarHBondContact CA-OG1 3.28Å; L214-T217 PolarHBondContact O-N 3.47Å; L214-T217 PolarHBondContact O-OG1 3.48Å; L215-T217 VanDerWaalsContact C-N 3.34Å; L215-T217 PolarHBondContact O-N 3.41Å; T217-G220 PolarHBondContact O-N 3.38Å; T217-L221 PolarHBondContact O-N 3.27Å
218	L	59.1	Low	55.6	Low	85 Å²	85	107.5 Å²	107.5	45%	0.445	61%	0.612	S	S	.	*	H	α-helix	trans	-66.8	-41	176.7	-102.3	94.1	0	0	0	111.8	L214 L215 G220 L221 F222	L214-L218 HydrophobicContact CD2-CD1 4.4Å; L214-L218 HydrophobicContact CG-CD1 4.42Å; L214-L218 WeakPolarHBondContact O-CD1 3.48Å; L214-L218 PolarHBondContact O-N 3.23Å; L215-L218 PolarHBondContact O-N 3.46Å; L218-G220 VanDerWaalsContact C-N 3.3Å; L218-G220 PolarHBondContact O-N 3.4Å; L218-L221 PolarHBondContact O-N 3.32Å; L218-F222 HydrophobicContact CD2-CE2 4.28Å; L218-F222 VanDerWaalsContact O-CD2 3.25Å; L218-F222 WeakPolarHBondContact O-CD2 3.35Å; L218-F222 PolarHBondContact O-N 3.16Å
219	V	58.5	Low	55.7	Low	95 Å²	95	108.9 Å²	108.9	58%	0.576	61%	0.613	S	S	*	*	H	α-helix	trans	-62.7	-38.2	179.3	173.3	0	0	0	0	111.5	L215 L221 F222 T223	L215-V219 VanDerWaalsContact O-CG2 3.32Å; L215-V219 WeakPolarHBondContact O-CG2 3.49Å; L215-V219 PolarHBondContact O-N 3.36Å; L215-V219 VanDerWaalsContact O-N 3.12Å; V219-L221 PolarHBondContact O-N 3.12Å; V219-F222 PolarHBondContact O-N 3.01Å; V219-T223 WeakPolarHBondContact O-CG2 3.4Å; V219-T223 PolarHBondContact O-N 3.37Å; V219-T223 PolarHBondContact O-OG1 2.92Å
220	G	55.2	Low	56	Low	34 Å²	34	110.1 Å²	110.1	35%	0.351	61%	0.612	S	S	.	*	H	α-helix	trans	-65.9	-33.2	176.3	0	0	0	0	0	114.4	V216 T217 L218 T223	V216-G220 PolarHBondContact O-N 3.3Å; T217-G220 PolarHBondContact O-N 3.38Å; L218-G220 VanDerWaalsContact C-N 3.3Å; L218-G220 PolarHBondContact O-N 3.4Å; G220-T223 WeakPolarHBondContact CA-OG1 3.23Å; G220-T223 PolarHBondContact O-N 3.13Å; G220-T223 PolarHBondContact O-OG1 3.01Å
221	L	56.7	Low	56.1	Low	135 Å²	135	109.6 Å²	109.6	71%	0.707	61%	0.612	S	S	*	*	H	α-helix	trans	-73.3	-26.4	177.7	-90.8	148.3	0	0	0	113.3	T217 L218 V219	T217-L221 PolarHBondContact O-N 3.27Å; L218-L221 PolarHBondContact O-N 3.32Å; V219-L221 PolarHBondContact O-N 3.12Å
222	F	49.3	Very low	56.1	Low	175 Å²	175	109.8 Å²	109.8	77%	0.768	62%	0.616	S	S	*	*	H	α-helix	trans	-86.2	-8.8	176.1	-80.6	-71.3	0	0	0	113.7	L218 V219	L218-F222 HydrophobicContact CD2-CE2 4.28Å; L218-F222 VanDerWaalsContact O-CD2 3.25Å; L218-F222 WeakPolarHBondContact O-CD2 3.35Å; L218-F222 PolarHBondContact O-N 3.16Å; V219-F222 PolarHBondContact O-N 3.01Å
223	T	50.8	Low	56	Low	109 Å²	109	114.3 Å²	114.3	67%	0.669	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	6.3	177.3	51.4	0	0	0	0	114.3	V219 G220	V219-T223 WeakPolarHBondContact O-CG2 3.4Å; V219-T223 PolarHBondContact O-N 3.37Å; V219-T223 PolarHBondContact O-OG1 2.92Å; G220-T223 WeakPolarHBondContact CA-OG1 3.23Å; G220-T223 PolarHBondContact O-N 3.13Å; G220-T223 PolarHBondContact O-OG1 3.01Å
224	L	44.4	Very low	55.9	Low	220 Å²	220	113.9 Å²	113.9	100%	1.152	63%	0.629	S	S	*	*			trans	-106.5	0	173.1	-108.7	113.5	0	0	0	111.8

Retrieved 224 of 224 residues in 199.7 ms (Link to these results)

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