A0A077YVU9_TRITR Loading...

Twinfilin

Actin-binding protein involved in motile and morphological processes. Inhibits actin polymerization, likely by sequestering G-actin.

AlphaFold DB , UniProt , Accession A0A077YVU9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 381 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	43.9	Very low	34.5	Very low	241 Å²	241	169.1 Å²	169.1	100%	1.187	83%	0.825	S	S	*	*				0	8.9	0	-133.9	-179.1	163.7	0	0	115.5
2	R	38.2	Very low	35	Very low	238 Å²	238	168.3 Å²	168.3	90%	0.898	82%	0.819	S	S	*	*			trans	-102.4	-3	174.7	-75.4	-177.2	180	175.2	0.2	114.4
3	L	36.6	Very low	36	Very low	159 Å²	159	159.9 Å²	159.9	83%	0.832	79%	0.793	S	S	*	*	S	Bend	trans	-91.5	-9	-177.5	-91.1	131.9	0	0	0	114.4
4	F	32.4	Very low	37.6	Very low	191 Å²	191	155.9 Å²	155.9	84%	0.838	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-2.9	179.7	-130.7	-93.8	0	0	0	114.2
5	K	32.7	Very low	40.1	Very low	183 Å²	183	147.2 Å²	147.2	80%	0.796	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	4.1	-176.5	-145.3	176.9	-175.2	-179.7	0	114.2
6	R	29.6	Very low	42.8	Very low	211 Å²	211	144.6 Å²	144.6	80%	0.796	72%	0.72	S	S	*	*	S	Bend	trans	-110.9	-0.1	-172.5	-126	176.6	-176.9	177.4	-0.9	114.3
7	I	35.3	Very low	45.3	Very low	145 Å²	145	136.8 Å²	136.8	74%	0.744	68%	0.683	S	S	*	*	S	Bend	trans	-99.9	-7.9	-177.2	-60.5	176.5	0	0	0	112.1	N9	I7-N9 VanDerWaalsContact C-N 3.35Å
8	T	33.9	Very low	47.7	Very low	121 Å²	121	129.7 Å²	129.7	74%	0.742	65%	0.649	S	S	*	*	S	Bend	trans	-87.9	6.7	173	50.7	0	0	0	0	114.4	G10	T8-G10 PolarHBondContact O-N 2.94Å
9	N	33.1	Very low	49.8	Very low	134 Å²	134	127.4 Å²	127.4	72%	0.717	65%	0.652	S	S	*	*			trans	-92	31.6	178.5	-70.2	-5.1	0	0	0	112.6	I7	I7-N9 VanDerWaalsContact C-N 3.35Å
10	G	29.8	Very low	51.8	Low	56 Å²	56	128.3 Å²	128.3	58%	0.577	65%	0.653	S	S	*	*	S	Bend	trans	-92.9	109.2	175.5	0	0	0	0	0	110.9	T8	T8-G10 PolarHBondContact O-N 2.94Å
11	L	34.1	Very low	53.7	Low	181 Å²	181	122.2 Å²	122.2	95%	0.948	62%	0.622	S	S	*	*	S	Bend	trans	66.8	36.5	155.8	-76.2	152.3	0	0	0	118.9
12	E	40.2	Very low	56	Low	160 Å²	160	114.2 Å²	114.2	75%	0.748	58%	0.584	S	S	*	*			trans	-93.8	98.7	156	-74.3	-170.6	172.1	0	0	109.4	L14	E12-L14 HydrophobicContact CB-CG 4.3Å; E12-L14 PolarHBondContact O-N 2.84Å
13	A	48.2	Very low	58.6	Low	59 Å²	59	108.2 Å²	108.2	49%	0.488	57%	0.565	S	S	.	*			trans	-66.6	87.6	162.9	0	0	0	0	0	107.8	F15	A13-F15 VanDerWaalsContact C-N 3.31Å; A13-F15 HydrophobicContact CB-CD2 4.3Å; A13-F15 HydrophobicContact CB-CE1 4.26Å; A13-F15 HydrophobicContact CB-CE2 3.61Å; A13-F15 HydrophobicContact CB-CZ 3.61Å; A13-F15 WeakPolarHBondContact O-CD2 3.35Å; A13-F15 WeakPolarHBondContact O-CE2 3.33Å; A13-F15 PolarHBondContact O-N 3.44Å
14	L	59	Low	61.2	Low	104 Å²	104	101.8 Å²	101.8	55%	0.545	53%	0.533	S	S	.	.			trans	-72.1	87	177.4	-75.6	162.1	0	0	0	108.9	E12 L16	E12-L14 HydrophobicContact CB-CG 4.3Å; E12-L14 PolarHBondContact O-N 2.84Å; L14-L16 PolarHBondContact O-N 3.47Å
15	F	74.3	Confident	64.1	Low	25 Å²	25	92.9 Å²	92.9	11%	0.11	49%	0.494	C	S	.	.			trans	-73.1	112.8	170.4	-55.2	-70.6	0	0	0	109.1	A13 E49 L114 T118 T121	A13-F15 VanDerWaalsContact C-N 3.31Å; A13-F15 HydrophobicContact CB-CD2 4.3Å; A13-F15 HydrophobicContact CB-CE1 4.26Å; A13-F15 HydrophobicContact CB-CE2 3.61Å; A13-F15 HydrophobicContact CB-CZ 3.61Å; A13-F15 WeakPolarHBondContact O-CD2 3.35Å; A13-F15 WeakPolarHBondContact O-CE2 3.33Å; A13-F15 PolarHBondContact O-N 3.44Å; F15-E49 HydrophobicContact CD1-CB 3.57Å; F15-E49 HydrophobicContact CD1-CG 4.39Å; F15-E49 VanDerWaalsContact CD1-O 3.24Å; F15-E49 WeakPolarHBondContact CD1-O 3.15Å; F15-E49 HydrophobicContact CE1-CB 3.45Å; F15-E49 VanDerWaalsContact CE1-CB 3.45Å; F15-E49 HydrophobicContact CE1-CG 3.76Å; F15-E49 WeakPolarHBondContact CE1-OE2 3.17Å; F15-E49 HydrophobicContact CZ-CB 4.35Å; F15-E49 HydrophobicContact CZ-CG 4.45Å; F15-E49 VanDerWaalsContact CZ-OE2 3.24Å; F15-E49 WeakPolarHBondContact CZ-OE2 3.42Å; F15-L114 HydrophobicContact CE1-CD2 4.49Å; F15-L114 HydrophobicContact CE2-CD2 3.44Å; F15-L114 VanDerWaalsContact CE2-CD2 3.44Å; F15-L114 HydrophobicContact CZ-CD2 3.32Å; F15-T118 HydrophobicContact CB-CG2 3.85Å; F15-T118 HydrophobicContact CD2-CG2 4.14Å; F15-T118 WeakPolarHBondContact CD2-OG1 3.34Å; F15-T118 HydrophobicContact CG-CG2 4.47Å; F15-T121 WeakPolarHBondContact O-CG2 3.29Å
16	L	83.2	Confident	66.9	Low	105 Å²	105	88.1 Å²	88.1	55%	0.55	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-83.3	157.2	-179.6	-64	172.3	0	0	0	111.1	L14 L51	L14-L16 PolarHBondContact O-N 3.47Å; L16-L51 PolarHBondContact O-N 3.35Å; L16-L51 VanDerWaalsContact O-N 3.14Å
17	A	85.4	Confident	69.8	Low	12 Å²	12	81.7 Å²	81.7	10%	0.099	46%	0.456	C	S	.	.	B	Isolated β-bridge	trans	-67.5	136.9	170.1	0	0	0	0	0	111	L21 I22 F25 E125	A17-L21 HydrophobicContact CB-CB 4.45Å; A17-L21 HydrophobicContact CB-CD2 3.96Å; A17-L21 HydrophobicContact CB-CG 4.34Å; A17-I22 HydrophobicContact CB-CD1 4.37Å; A17-I22 HydrophobicContact CB-CG1 3.86Å; A17-F25 HydrophobicContact CB-CE2 4.34Å; A17-E125 HydrophobicContact CB-CB 4.36Å; A17-E125 HydrophobicContact CB-CG 4.21Å
18	S	88.6	Confident	72.4	Confident	10 Å²	10	74.8 Å²	74.8	7%	0.07	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-64.2	154.2	171	75.6	0	0	0	0	110.4	E20 L21 I22 L51	S18-E20 PolarHBondContact O-N 3.02Å; S18-L21 WeakPolarHBondContact O-CB 3.35Å; S18-L21 PolarHBondContact O-N 2.84Å; S18-L21 WeakPolarHBondContact OG-CB 3.49Å; S18-L21 PolarHBondContact OG-N 2.88Å; S18-L21 VanDerWaalsContact OG-N 3.14Å; S18-I22 WeakPolarHBondContact O-CG1 3.47Å; S18-I22 PolarHBondContact O-N 3.38Å; S18-L51 PolarHBondContact N-O 2.79Å; S18-L51 PolarHBondContact OG-O 3.28Å
19	A	87.8	Confident	75	Confident	85 Å²	85	73 Å²	73	70%	0.702	40%	0.403	S	S	*	.	H	α-helix	trans	-58.1	-34.9	177.8	0	0	0	0	0	112.3	I22 H23	A19-I22 PolarHBondContact O-N 3.32Å; A19-H23 PolarHBondContact O-N 3.2Å; A19-H23 VanDerWaalsContact O-N 3.11Å
20	E	90.4	Very high	77.6	Confident	146 Å²	146	73.1 Å²	73.1	68%	0.682	40%	0.403	S	S	*	.	H	α-helix	trans	-63.6	-44.4	173.7	-64.2	177	172.6	0	0	111.5	S18 I22 H23 T24	S18-E20 PolarHBondContact O-N 3.02Å; E20-I22 VanDerWaalsContact C-N 3.34Å; E20-I22 PolarHBondContact O-N 2.96Å; E20-H23 WeakPolarHBondContact O-CB 3.45Å; E20-H23 PolarHBondContact O-N 3.11Å; E20-H23 VanDerWaalsContact O-N 3.17Å; E20-T24 PolarHBondContact O-N 2.82Å; E20-T24 PolarHBondContact O-OG1 3.21Å; E20-T24 VanDerWaalsContact O-OG1 3.12Å
21	L	92	Very high	80.3	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-63.9	-39.5	177.8	-178.8	60.1	0	0	0	111.8	A17 S18 H23 T24 F25 L36 I38 L51	A17-L21 HydrophobicContact CB-CB 4.45Å; A17-L21 HydrophobicContact CB-CD2 3.96Å; A17-L21 HydrophobicContact CB-CG 4.34Å; S18-L21 WeakPolarHBondContact O-CB 3.35Å; S18-L21 PolarHBondContact O-N 2.84Å; S18-L21 WeakPolarHBondContact OG-CB 3.49Å; S18-L21 PolarHBondContact OG-N 2.88Å; S18-L21 VanDerWaalsContact OG-N 3.14Å; L21-H23 VanDerWaalsContact C-N 3.29Å; L21-H23 PolarHBondContact O-N 3.08Å; L21-T24 PolarHBondContact O-N 3.16Å; L21-F25 HydrophobicContact CD1-CD1 3.97Å; L21-F25 HydrophobicContact CD1-CE1 3.41Å; L21-F25 VanDerWaalsContact CD1-CE1 3.41Å; L21-F25 HydrophobicContact CD1-CZ 3.77Å; L21-F25 HydrophobicContact CD2-CE1 4.23Å; L21-F25 HydrophobicContact CD2-CE2 4.28Å; L21-F25 HydrophobicContact CD2-CZ 3.7Å; L21-F25 HydrophobicContact CG-CD1 4.26Å; L21-F25 HydrophobicContact CG-CE1 3.69Å; L21-F25 HydrophobicContact CG-CE2 3.97Å; L21-F25 HydrophobicContact CG-CZ 3.52Å; L21-F25 WeakPolarHBondContact O-CD1 3.28Å; L21-F25 VanDerWaalsContact O-CG 3.29Å; L21-F25 WeakPolarHBondContact O-CG 3.47Å; L21-F25 PolarHBondContact O-N 2.79Å; L21-L36 HydrophobicContact CD1-CD2 4.05Å; L21-I38 HydrophobicContact CD1-CD1 4.2Å; L21-I38 HydrophobicContact CD1-CG1 4.16Å; L21-I38 HydrophobicContact CD2-CG2 3.94Å; L21-L51 HydrophobicContact CD2-CB 3.54Å; L21-L51 VanDerWaalsContact CD2-O 3.27Å; L21-L51 WeakPolarHBondContact CD2-O 3.32Å
22	I	91.3	Very high	82.9	Confident	73 Å²	73	65.7 Å²	65.7	37%	0.374	36%	0.36	S	S	.	.	H	α-helix	trans	-61.7	-39.8	175	-64.7	169.6	0	0	0	110.7	A17 S18 A19 E20 F25 N26	A17-I22 HydrophobicContact CB-CD1 4.37Å; A17-I22 HydrophobicContact CB-CG1 3.86Å; S18-I22 WeakPolarHBondContact O-CG1 3.47Å; S18-I22 PolarHBondContact O-N 3.38Å; A19-I22 PolarHBondContact O-N 3.32Å; E20-I22 VanDerWaalsContact C-N 3.34Å; E20-I22 PolarHBondContact O-N 2.96Å; I22-F25 WeakPolarHBondContact O-CB 3.35Å; I22-F25 PolarHBondContact O-N 3.33Å; I22-N26 PolarHBondContact O-N 2.95Å; I22-N26 PolarHBondContact O-ND2 2.87Å
23	H	91.7	Very high	85.3	Confident	112 Å²	112	58.5 Å²	58.5	52%	0.519	33%	0.327	S	S	.	.	H	α-helix	trans	-62.5	-47.3	173.7	-174.3	-84.9	0	0	0	111.4	A19 E20 L21 F25 N26 E27	A19-H23 PolarHBondContact O-N 3.2Å; A19-H23 VanDerWaalsContact O-N 3.11Å; E20-H23 WeakPolarHBondContact O-CB 3.45Å; E20-H23 PolarHBondContact O-N 3.11Å; E20-H23 VanDerWaalsContact O-N 3.17Å; L21-H23 VanDerWaalsContact C-N 3.29Å; L21-H23 PolarHBondContact O-N 3.08Å; H23-F25 VanDerWaalsContact C-N 3.26Å; H23-F25 PolarHBondContact O-N 2.9Å; H23-N26 WeakPolarHBondContact O-CB 3.19Å; H23-N26 PolarHBondContact O-N 2.91Å; H23-E27 IonicContact CE1-OE1 3.24Å; H23-E27 PolarHBondContact CE1-OE1 2.87Å; H23-E27 VanDerWaalsContact CE1-OE1 3.24Å; H23-E27 IonicContact ND1-OE1 3.57Å; H23-E27 PolarHBondContact O-N 3.16Å
24	T	92.4	Very high	87.5	Confident	24 Å²	24	55.7 Å²	55.7	15%	0.147	30%	0.303	C	S	.	.	H	α-helix	trans	-61.8	-32.8	176.5	-51.4	0	0	0	0	112.5	E20 L21 N26 E27 C28 L36 T56	E20-T24 PolarHBondContact O-N 2.82Å; E20-T24 PolarHBondContact O-OG1 3.21Å; E20-T24 VanDerWaalsContact O-OG1 3.12Å; L21-T24 PolarHBondContact O-N 3.16Å; T24-N26 VanDerWaalsContact C-N 3.31Å; T24-N26 PolarHBondContact O-N 3.45Å; T24-E27 PolarHBondContact O-N 3.35Å; T24-C28 PolarHBondContact O-N 3.12Å; T24-C28 PolarHBondContact O-SG 2.84Å; T24-L36 HydrophobicContact CG2-CD1 3.92Å; T24-L36 HydrophobicContact CG2-CD2 4.12Å; T24-T56 HydrophobicContact CG2-CG2 3.73Å
25	F	93.5	Very high	89.1	Confident	4 Å²	4	50.8 Å²	50.8	2%	0.018	28%	0.278	C	S	.	.	H	α-helix	trans	-62.6	-37.1	173.2	-69.8	-15.5	0	0	0	112.7	A17 L21 I22 H23 C28 K29 L36 I38 L84 L122 E125 F126	A17-F25 HydrophobicContact CB-CE2 4.34Å; L21-F25 HydrophobicContact CD1-CD1 3.97Å; L21-F25 HydrophobicContact CD1-CE1 3.41Å; L21-F25 VanDerWaalsContact CD1-CE1 3.41Å; L21-F25 HydrophobicContact CD1-CZ 3.77Å; L21-F25 HydrophobicContact CD2-CE1 4.23Å; L21-F25 HydrophobicContact CD2-CE2 4.28Å; L21-F25 HydrophobicContact CD2-CZ 3.7Å; L21-F25 HydrophobicContact CG-CD1 4.26Å; L21-F25 HydrophobicContact CG-CE1 3.69Å; L21-F25 HydrophobicContact CG-CE2 3.97Å; L21-F25 HydrophobicContact CG-CZ 3.52Å; L21-F25 WeakPolarHBondContact O-CD1 3.28Å; L21-F25 VanDerWaalsContact O-CG 3.29Å; L21-F25 WeakPolarHBondContact O-CG 3.47Å; L21-F25 PolarHBondContact O-N 2.79Å; I22-F25 WeakPolarHBondContact O-CB 3.35Å; I22-F25 PolarHBondContact O-N 3.33Å; H23-F25 VanDerWaalsContact C-N 3.26Å; H23-F25 PolarHBondContact O-N 2.9Å; F25-C28 WeakPolarHBondContact O-CB 3.41Å; F25-C28 PolarHBondContact O-N 3.01Å; F25-K29 WeakPolarHBondContact O-CG 3.38Å; F25-K29 PolarHBondContact O-N 2.84Å; F25-L36 HydrophobicContact CD1-CD2 3.77Å; F25-L36 HydrophobicContact CE1-CD2 3.68Å; F25-I38 HydrophobicContact CE1-CD1 3.75Å; F25-I38 HydrophobicContact CZ-CD1 4.04Å; F25-L84 HydrophobicContact CE1-CD1 4.14Å; F25-L122 HydrophobicContact CZ-CD1 3.7Å; F25-E125 HydrophobicContact CE2-CB 3.99Å; F25-F126 HydrophobicContact CB-CD2 4.25Å; F25-F126 AromaticContact CD1-CD2 3.55Å; F25-F126 HydrophobicContact CD1-CD2 3.55Å; F25-F126 HydrophobicContact CD1-CE2 4.04Å; F25-F126 HydrophobicContact CD2-CD2 4.3Å; F25-F126 AromaticContact CE1-CD2 3.82Å; F25-F126 HydrophobicContact CE1-CD2 3.82Å; F25-F126 HydrophobicContact CE2-CB 4.38Å; F25-F126 AromaticContact CG-CD2 3.8Å; F25-F126 HydrophobicContact CG-CD2 3.8Å; F25-F126 HydrophobicContact CG-CE2 4.43Å; F25-F126 HydrophobicContact CZ-CB 4.4Å; F25-F126 HydrophobicContact CZ-CD2 4.32Å
26	N	90.5	Very high	90.1	Very high	83 Å²	83	49.6 Å²	49.6	44%	0.444	27%	0.272	S	S	.	.	H	α-helix	trans	-67.8	-39.5	174.8	-64.8	-34.5	0	0	0	111.3	I22 H23 T24 K29 N30	I22-N26 PolarHBondContact O-N 2.95Å; I22-N26 PolarHBondContact O-ND2 2.87Å; H23-N26 WeakPolarHBondContact O-CB 3.19Å; H23-N26 PolarHBondContact O-N 2.91Å; T24-N26 VanDerWaalsContact C-N 3.31Å; T24-N26 PolarHBondContact O-N 3.45Å; N26-K29 PolarHBondContact O-N 3.36Å; N26-N30 PolarHBondContact O-N 3.17Å; N26-N30 VanDerWaalsContact O-N 3.08Å
27	E	90.6	Very high	90.6	Very high	77 Å²	77	45 Å²	45	36%	0.36	25%	0.248	S	C	.	.	H	α-helix	trans	-63.2	-40.8	173.4	-64.1	178.6	151.6	0	0	112.2	H23 T24 K29 N30 G31 S32 V33	H23-E27 IonicContact CE1-OE1 3.24Å; H23-E27 PolarHBondContact CE1-OE1 2.87Å; H23-E27 VanDerWaalsContact CE1-OE1 3.24Å; H23-E27 IonicContact ND1-OE1 3.57Å; H23-E27 PolarHBondContact O-N 3.16Å; T24-E27 PolarHBondContact O-N 3.35Å; E27-K29 VanDerWaalsContact C-N 3.35Å; E27-K29 PolarHBondContact O-N 3Å; E27-N30 PolarHBondContact O-N 3.47Å; E27-G31 PolarHBondContact O-N 3.39Å; E27-S32 PolarHBondContact O-OG 2.74Å; E27-V33 HydrophobicContact CB-CG2 4.49Å
28	C	90.8	Very high	91	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-57.8	-48.2	173.2	-68.3	0	0	0	0	110.8	T24 F25 N30 G31 W97 F126	T24-C28 PolarHBondContact O-N 3.12Å; T24-C28 PolarHBondContact O-SG 2.84Å; F25-C28 WeakPolarHBondContact O-CB 3.41Å; F25-C28 PolarHBondContact O-N 3.01Å; C28-N30 VanDerWaalsContact C-N 3.26Å; C28-N30 PolarHBondContact O-N 3.45Å; C28-G31 WeakPolarHBondContact O-CA 3.31Å; C28-G31 PolarHBondContact O-N 3.28Å; C28-W97 HydrophobicContact CB-CH2 3.6Å; C28-W97 HydrophobicContact CB-CZ2 3.71Å; C28-W97 HydrophobicContact CB-CZ3 4.46Å; C28-W97 VanDerWaalsContact O-CZ2 3.29Å; C28-W97 WeakPolarHBondContact O-CZ2 3.25Å; C28-F126 HydrophobicContact CB-CE2 4.04Å; C28-F126 HydrophobicContact CB-CZ 4.43Å
29	K	87.6	Confident	91.2	Very high	83 Å²	83	44.5 Å²	44.5	36%	0.361	24%	0.243	S	C	.	.	H	α-helix	trans	-62.6	-31.1	179.5	-72.1	170.4	-176.9	173.3	0	113.3	F25 N26 E27 G31 F126	F25-K29 WeakPolarHBondContact O-CG 3.38Å; F25-K29 PolarHBondContact O-N 2.84Å; N26-K29 PolarHBondContact O-N 3.36Å; E27-K29 VanDerWaalsContact C-N 3.35Å; E27-K29 PolarHBondContact O-N 3Å; K29-G31 PolarHBondContact O-N 2.98Å; K29-F126 WeakPolarHBondContact CE-O 3.11Å; K29-F126 PolarHBondContact NZ-O 2.83Å
30	N	87.2	Confident	91.4	Very high	137 Å²	137	41.5 Å²	41.5	73%	0.733	22%	0.215	S	C	*	.	H	α-helix	trans	-71.6	-13.2	173.2	-67.7	-15.8	0	0	0	113.4	N26 E27 C28	N26-N30 PolarHBondContact O-N 3.17Å; N26-N30 VanDerWaalsContact O-N 3.08Å; E27-N30 PolarHBondContact O-N 3.47Å; C28-N30 VanDerWaalsContact C-N 3.26Å; C28-N30 PolarHBondContact O-N 3.45Å
31	G	86.9	Confident	91.1	Very high	13 Å²	13	38.9 Å²	38.9	13%	0.134	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.7	16.4	172.3	0	0	0	0	0	116.2	E27 C28 K29 R86	E27-G31 PolarHBondContact O-N 3.39Å; C28-G31 WeakPolarHBondContact O-CA 3.31Å; C28-G31 PolarHBondContact O-N 3.28Å; K29-G31 PolarHBondContact O-N 2.98Å; G31-R86 PolarHBondContact O-NH1 3.17Å; G31-R86 PolarHBondContact O-NH2 2.75Å; G31-R86 VanDerWaalsContact O-NH2 3.16Å
32	S	88.3	Confident	90.3	Very high	67 Å²	67	44 Å²	44	47%	0.469	23%	0.225	S	C	.	.			trans	-80.1	-25.9	174.7	55.6	0	0	0	0	113	E27 P58 S59	E27-S32 PolarHBondContact O-OG 2.74Å; S32-P58 WeakPolarHBondContact O-CA 3.28Å; S32-S59 PolarHBondContact O-N 3.22Å
33	V	92.4	Very high	89	Confident	9 Å²	9	41.5 Å²	41.5	6%	0.055	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	133.5	-173.8	-175.2	0	0	0	0	110.6	E27 L35 L36 T56 W97	E27-V33 HydrophobicContact CB-CG2 4.49Å; V33-L35 WeakPolarHBondContact CG1-O 3.47Å; V33-L36 HydrophobicContact CG1-CB 4.39Å; V33-T56 HydrophobicContact CG1-CG2 4.28Å; V33-W97 WeakPolarHBondContact O-CH2 3.38Å
34	R	93.5	Very high	87.4	Confident	1 Å²	1	44.2 Å²	44.2	0%	0.004	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	-43.4	173.8	176.3	66.7	71.6	-170.8	5.3	112.4	Y57 S59 L61 D66 Y70 F85 R86 D88	R34-Y57 PolarHBondContact N-O 2.94Å; R34-S59 PolarHBondContact NE-OG 3.44Å; R34-S59 PolarHBondContact NH2-OG 3.38Å; R34-L61 PolarHBondContact NH2-O 3.25Å; R34-D66 HydrophobicContact CG-CB 3.71Å; R34-D66 IonicContact CZ-OD2 3.66Å; R34-D66 IonicContact NE-OD2 3.68Å; R34-D66 PolarHBondContact NE-OD2 2.88Å; R34-D66 IonicContact NH2-OD2 2.77Å; R34-Y70 HydrophobicContact CB-CD2 4.46Å; R34-Y70 HydrophobicContact CB-CE2 4.4Å; R34-Y70 HydrophobicContact CG-CD2 4.1Å; R34-Y70 HydrophobicContact CG-CE2 4.32Å; R34-F85 HydrophobicContact CG-CD2 4.37Å; R34-F85 HydrophobicContact CG-CE2 3.73Å; R34-F85 HydrophobicContact CG-CZ 4.15Å; R34-F85 CarbonylContact O-C 3.6Å; R34-F85 WeakPolarHBondContact O-CA 3.41Å; R34-R86 WeakPolarHBondContact CD-O 3.49Å; R34-R86 PolarHBondContact NH1-O 3.24Å; R34-R86 PolarHBondContact O-N 3.25Å; R34-D88 IonicContact CZ-OD1 3.77Å; R34-D88 IonicContact NH1-OD1 2.94Å; R34-D88 PolarHBondContact NH1-OD1 2.59Å; R34-D88 IonicContact NH2-OD1 3.63Å; R34-D88 PolarHBondContact NH2-OD1 3.48Å; R34-D88 IonicContact NH2-OD2 3.96Å
35	L	93.6	Very high	85.6	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	130.8	-178.6	-172.6	155.4	0	0	0	109.4	V33 K37 T56 Y57 L71 V83 L84 F85	V33-L35 WeakPolarHBondContact CG1-O 3.47Å; L35-K37 HydrophobicContact CD2-CB 4.4Å; L35-T56 CarbonylContact O-C 3.55Å; L35-T56 WeakPolarHBondContact O-CA 3.36Å; L35-Y57 HydrophobicContact CB-CD2 4.06Å; L35-Y57 HydrophobicContact CD2-CD2 3.72Å; L35-Y57 HydrophobicContact CD2-CE2 4.09Å; L35-Y57 HydrophobicContact CG-CD2 4.34Å; L35-Y57 PolarHBondContact N-O 2.8Å; L35-Y57 PolarHBondContact O-N 2.86Å; L35-L71 HydrophobicContact CD1-CD2 3.81Å; L35-L71 HydrophobicContact CD1-CG 4.45Å; L35-V83 HydrophobicContact CD1-CG1 3.71Å; L35-V83 HydrophobicContact CD2-CG1 3.87Å; L35-V83 HydrophobicContact CG-CG1 3.61Å; L35-L84 CarbonylContact C-O 3.58Å; L35-L84 WeakPolarHBondContact CA-O 3.47Å; L35-F85 HydrophobicContact CB-CD2 4.2Å; L35-F85 HydrophobicContact CD1-CD2 4.12Å; L35-F85 HydrophobicContact CG-CD2 4.41Å
36	L	94.3	Very high	83.8	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	118.5	171.6	168.9	62.6	0	0	0	108.9	L21 T24 F25 V33 I38 T56 V83 L84	L21-L36 HydrophobicContact CD1-CD2 4.05Å; T24-L36 HydrophobicContact CG2-CD1 3.92Å; T24-L36 HydrophobicContact CG2-CD2 4.12Å; F25-L36 HydrophobicContact CD1-CD2 3.77Å; F25-L36 HydrophobicContact CE1-CD2 3.68Å; V33-L36 HydrophobicContact CG1-CB 4.39Å; L36-I38 HydrophobicContact CD1-CG1 4.37Å; L36-I38 HydrophobicContact CD2-CD1 4.03Å; L36-I38 HydrophobicContact CD2-CG1 4.12Å; L36-I38 HydrophobicContact CG-CD1 4.21Å; L36-I38 HydrophobicContact CG-CG1 3.82Å; L36-T56 HydrophobicContact CD1-CG2 3.52Å; L36-V83 WeakPolarHBondContact O-CA 3.21Å; L36-L84 HydrophobicContact CB-CB 4.35Å; L36-L84 HydrophobicContact CD2-CD1 4.35Å; L36-L84 PolarHBondContact N-O 2.85Å; L36-L84 PolarHBondContact O-N 2.93Å
37	K	94.3	Very high	82.1	Confident	10 Å²	10	59.6 Å²	59.6	4%	0.043	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	127	172.5	-174.3	-173.5	-177.3	-168.5	0	109.6	L35 G53 E54 I55 S74 C81 Y82	L35-K37 HydrophobicContact CD2-CB 4.4Å; K37-G53 CarbonylContact O-C 3.45Å; K37-E54 HydrophobicContact CD-CB 4.38Å; K37-E54 WeakPolarHBondContact CD-OE2 3.39Å; K37-E54 WeakPolarHBondContact CE-OE2 3.45Å; K37-E54 IonicContact NZ-OE2 2.78Å; K37-E54 PolarHBondContact NZ-OE2 3.44Å; K37-E54 PolarHBondContact O-N 3.32Å; K37-I55 HydrophobicContact CB-CB 4.23Å; K37-I55 HydrophobicContact CD-CD1 4.36Å; K37-I55 PolarHBondContact N-O 3.27Å; K37-S74 WeakPolarHBondContact CD-O 3.47Å; K37-S74 WeakPolarHBondContact CE-O 3.29Å; K37-S74 PolarHBondContact NZ-O 3.12Å; K37-S74 VanDerWaalsContact NZ-O 3.13Å; K37-C81 HydrophobicContact CG-CB 4.31Å; K37-Y82 WeakPolarHBondContact CA-O 3.33Å
38	I	93.9	Very high	81.2	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	134.3	-177.9	-52.4	172	0	0	0	108.8	L21 F25 L36 L51 I52 Y82 L84 L122	L21-I38 HydrophobicContact CD1-CD1 4.2Å; L21-I38 HydrophobicContact CD1-CG1 4.16Å; L21-I38 HydrophobicContact CD2-CG2 3.94Å; F25-I38 HydrophobicContact CE1-CD1 3.75Å; F25-I38 HydrophobicContact CZ-CD1 4.04Å; L36-I38 HydrophobicContact CD1-CG1 4.37Å; L36-I38 HydrophobicContact CD2-CD1 4.03Å; L36-I38 HydrophobicContact CD2-CG1 4.12Å; L36-I38 HydrophobicContact CG-CD1 4.21Å; L36-I38 HydrophobicContact CG-CG1 3.82Å; I38-L51 HydrophobicContact CG2-CB 4.1Å; I38-L51 HydrophobicContact CG2-CD2 3.97Å; I38-I52 WeakPolarHBondContact CA-O 3.42Å; I38-Y82 PolarHBondContact N-O 3.29Å; I38-Y82 PolarHBondContact O-N 3.43Å; I38-L84 HydrophobicContact CD1-CD1 3.82Å; I38-L84 HydrophobicContact CD1-CG 4.37Å; I38-L122 HydrophobicContact CD1-CD1 3.51Å; I38-L122 HydrophobicContact CD1-CD2 4.15Å; I38-L122 HydrophobicContact CD1-CG 4.46Å
39	V	93	Very high	80.5	Confident	10 Å²	10	59.9 Å²	59.9	6%	0.061	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	150.6	179.6	-65.3	0	0	0	0	109.9	K41 I52 E54 C81 Y115	V39-K41 HydrophobicContact CG2-CD 4.06Å; V39-K41 HydrophobicContact CG2-CG 4.05Å; V39-I52 PolarHBondContact N-O 2.93Å; V39-I52 PolarHBondContact O-N 3.14Å; V39-E54 HydrophobicContact CG1-CB 4.33Å; V39-E54 HydrophobicContact CG2-CB 3.88Å; V39-E54 HydrophobicContact CG2-CG 4.41Å; V39-C81 HydrophobicContact CG1-CB 4Å; V39-Y115 VanDerWaalsContact CA-OH 3.32Å; V39-Y115 WeakPolarHBondContact CA-OH 3.27Å
40	I	91.3	Very high	80.5	Confident	22 Å²	22	59 Å²	59	11%	0.113	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	116.2	171.6	-59.9	171.3	0	0	0	106.9	E49 L51 Y82 L114 Y115 T118	I40-E49 HydrophobicContact CG2-CB 3.58Å; I40-E49 HydrophobicContact CG2-CG 4.49Å; I40-L51 HydrophobicContact CD1-CD2 4.42Å; I40-L51 HydrophobicContact CG1-CD2 3.7Å; I40-Y82 HydrophobicContact CD1-CE2 4.4Å; I40-L114 HydrophobicContact CD1-CB 4.36Å; I40-Y115 HydrophobicContact CB-CE2 4.21Å; I40-Y115 HydrophobicContact CD1-CD1 4.12Å; I40-Y115 HydrophobicContact CD1-CD2 4.03Å; I40-Y115 HydrophobicContact CD1-CE1 4.14Å; I40-Y115 HydrophobicContact CD1-CE2 4.09Å; I40-Y115 HydrophobicContact CD1-CG 4.07Å; I40-Y115 HydrophobicContact CG1-CE1 4.07Å; I40-Y115 HydrophobicContact CG1-CE2 4.29Å; I40-Y115 PolarHBondContact N-OH 2.85Å; I40-T118 HydrophobicContact CD1-CG2 4.21Å
41	K	85	Confident	80.6	Confident	91 Å²	91	52.5 Å²	52.5	40%	0.396	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	150.4	173.7	-71.2	176.5	177.7	166.4	0	110	V39 A43 E49 Q50 I52 E54	V39-K41 HydrophobicContact CG2-CD 4.06Å; V39-K41 HydrophobicContact CG2-CG 4.05Å; K41-A43 PolarHBondContact O-N 3.43Å; K41-E49 WeakPolarHBondContact O-CA 3.48Å; K41-Q50 PolarHBondContact N-O 3.38Å; K41-Q50 VanDerWaalsContact N-O 3.16Å; K41-Q50 PolarHBondContact O-N 3.23Å; K41-I52 HydrophobicContact CB-CD1 3.85Å; K41-E54 IonicContact NZ-OE1 2.91Å; K41-E54 PolarHBondContact NZ-OE1 3.38Å
42	H	73.7	Confident	80.8	Confident	108 Å²	108	53.8 Å²	53.8	50%	0.5	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	122.1	171.6	-103	-73.2	0	0	0	109.8	E49	H42-E49 IonicContact NE2-OE1 3.61Å
43	A	64.9	Low	80.9	Confident	20 Å²	20	51.9 Å²	51.9	17%	0.165	27%	0.273	C	S	.	.			trans	-71.5	139.5	169.4	0	0	0	0	0	109.8	K41 F45 T48 Q50	K41-A43 PolarHBondContact O-N 3.43Å; A43-F45 PolarHBondContact O-N 2.96Å; A43-T48 WeakPolarHBondContact CB-O 3.45Å; A43-T48 PolarHBondContact N-O 2.88Å; A43-Q50 HydrophobicContact CB-CG 4.17Å
44	L	58.6	Low	80.7	Confident	169 Å²	169	55.2 Å²	55.2	89%	0.885	29%	0.288	S	S	*	.	S	Bend	trans	-59	-29.8	-173.5	-82.3	156.8	0	0	0	113.3
45	F	54.5	Low	80.5	Confident	192 Å²	192	58.1 Å²	58.1	84%	0.842	30%	0.303	S	S	*	.	S	Bend	trans	-159.3	132.4	173.3	-94.3	-90.5	0	0	0	108.6	A43	A43-F45 PolarHBondContact O-N 2.96Å
46	P	55	Low	80.4	Confident	93 Å²	93	61.6 Å²	61.6	60%	0.604	33%	0.325	S	S	*	.	S	Bend	cis	-107.9	111.9	-2.7	33.1	-18	0	0	0	111	T48	P46-T48 WeakPolarHBondContact O-CG2 3.4Å; P46-T48 PolarHBondContact O-N 3.37Å; P46-T48 PolarHBondContact O-OG1 3.47Å; P46-T48 VanDerWaalsContact O-OG1 3.12Å
47	N	55.3	Low	80.3	Confident	150 Å²	150	63.9 Å²	63.9	80%	0.802	33%	0.334	S	S	*	.	S	Bend	trans	33.8	32.9	168.4	-73.4	-10.9	0	0	0	117.6
48	T	70.2	Confident	80.2	Confident	63 Å²	63	66.2 Å²	66.2	39%	0.387	35%	0.35	S	S	.	.			trans	-109.7	124.2	-179.3	38.5	0	0	0	0	105.9	A43 P46	A43-T48 WeakPolarHBondContact CB-O 3.45Å; A43-T48 PolarHBondContact N-O 2.88Å; P46-T48 WeakPolarHBondContact O-CG2 3.4Å; P46-T48 PolarHBondContact O-N 3.37Å; P46-T48 PolarHBondContact O-OG1 3.47Å; P46-T48 VanDerWaalsContact O-OG1 3.12Å
49	E	77.7	Confident	80	Confident	20 Å²	20	67.9 Å²	67.9	9%	0.093	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	140.7	168	-43.3	174	167.8	0	0	106.8	F15 I40 K41 H42 R110 L114	F15-E49 HydrophobicContact CD1-CB 3.57Å; F15-E49 HydrophobicContact CD1-CG 4.39Å; F15-E49 VanDerWaalsContact CD1-O 3.24Å; F15-E49 WeakPolarHBondContact CD1-O 3.15Å; F15-E49 HydrophobicContact CE1-CB 3.45Å; F15-E49 VanDerWaalsContact CE1-CB 3.45Å; F15-E49 HydrophobicContact CE1-CG 3.76Å; F15-E49 WeakPolarHBondContact CE1-OE2 3.17Å; F15-E49 HydrophobicContact CZ-CB 4.35Å; F15-E49 HydrophobicContact CZ-CG 4.45Å; F15-E49 VanDerWaalsContact CZ-OE2 3.24Å; F15-E49 WeakPolarHBondContact CZ-OE2 3.42Å; I40-E49 HydrophobicContact CG2-CB 3.58Å; I40-E49 HydrophobicContact CG2-CG 4.49Å; K41-E49 WeakPolarHBondContact O-CA 3.48Å; H42-E49 IonicContact NE2-OE1 3.61Å; E49-R110 IonicContact OE1-CZ 2.59Å; E49-R110 IonicContact OE1-NH2 3.96Å; E49-R110 PolarHBondContact OE1-NH2 3.4Å; E49-L114 VanDerWaalsContact OE2-CD1 3.26Å; E49-L114 WeakPolarHBondContact OE2-CD1 3.38Å; E49-L114 VanDerWaalsContact OE2-CD2 3.24Å; E49-L114 WeakPolarHBondContact OE2-CD2 3.37Å
50	Q	86.2	Confident	79.7	Confident	65 Å²	65	76.4 Å²	76.4	30%	0.304	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	148.8	-179.6	-68	-175.8	0.9	0	0	109.1	K41 A43 I52	K41-Q50 PolarHBondContact N-O 3.38Å; K41-Q50 VanDerWaalsContact N-O 3.16Å; K41-Q50 PolarHBondContact O-N 3.23Å; A43-Q50 HydrophobicContact CB-CG 4.17Å; Q50-I52 HydrophobicContact CB-CD1 4.46Å; Q50-I52 HydrophobicContact CB-CG1 4.45Å; Q50-I52 PolarHBondContact O-N 3.35Å
51	L	89.8	Confident	79.5	Confident	0 Å²	0	80.2 Å²	80.2	0%	0	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	122.7	169.5	-66.4	163.9	0	0	0	108.3	L16 S18 L21 I38 I40 Y82 T118 L122	L16-L51 PolarHBondContact O-N 3.35Å; L16-L51 VanDerWaalsContact O-N 3.14Å; S18-L51 PolarHBondContact N-O 2.79Å; S18-L51 PolarHBondContact OG-O 3.28Å; L21-L51 HydrophobicContact CD2-CB 3.54Å; L21-L51 VanDerWaalsContact CD2-O 3.27Å; L21-L51 WeakPolarHBondContact CD2-O 3.32Å; I38-L51 HydrophobicContact CG2-CB 4.1Å; I38-L51 HydrophobicContact CG2-CD2 3.97Å; I40-L51 HydrophobicContact CD1-CD2 4.42Å; I40-L51 HydrophobicContact CG1-CD2 3.7Å; L51-Y82 HydrophobicContact CD2-CD2 4.29Å; L51-Y82 HydrophobicContact CD2-CE2 3.95Å; L51-T118 HydrophobicContact CD1-CG2 3.9Å; L51-T118 HydrophobicContact CD2-CG2 3.81Å; L51-T118 HydrophobicContact CG-CG2 3.99Å; L51-L122 HydrophobicContact CD1-CB 4.06Å; L51-L122 HydrophobicContact CD1-CD1 4.32Å
52	I	91.2	Very high	79.7	Confident	39 Å²	39	79 Å²	79	20%	0.2	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	139.9	-178.2	-67.4	155.2	0	0	0	108.8	I38 V39 K41 Q50	I38-I52 WeakPolarHBondContact CA-O 3.42Å; V39-I52 PolarHBondContact N-O 2.93Å; V39-I52 PolarHBondContact O-N 3.14Å; K41-I52 HydrophobicContact CB-CD1 3.85Å; Q50-I52 HydrophobicContact CB-CD1 4.46Å; Q50-I52 HydrophobicContact CB-CG1 4.45Å; Q50-I52 PolarHBondContact O-N 3.35Å
53	G	90.2	Very high	80.4	Confident	28 Å²	28	76.5 Å²	76.5	29%	0.289	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	120.8	171	0	0	0	0	0	110	K37	K37-G53 CarbonylContact O-C 3.45Å
54	E	89	Confident	81.5	Confident	79 Å²	79	76.8 Å²	76.8	37%	0.369	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	-45.1	-179.4	-167.4	169.7	-125	0	0	112.3	K37 V39 K41	K37-E54 HydrophobicContact CD-CB 4.38Å; K37-E54 WeakPolarHBondContact CD-OE2 3.39Å; K37-E54 WeakPolarHBondContact CE-OE2 3.45Å; K37-E54 IonicContact NZ-OE2 2.78Å; K37-E54 PolarHBondContact NZ-OE2 3.44Å; K37-E54 PolarHBondContact O-N 3.32Å; V39-E54 HydrophobicContact CG1-CB 4.33Å; V39-E54 HydrophobicContact CG2-CB 3.88Å; V39-E54 HydrophobicContact CG2-CG 4.41Å; K41-E54 IonicContact NZ-OE1 2.91Å; K41-E54 PolarHBondContact NZ-OE1 3.38Å
55	I	89.3	Confident	82.9	Confident	62 Å²	62	73.1 Å²	73.1	32%	0.318	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	135.7	-175.1	-56	177.8	0	0	0	108.6	K37 Y57	K37-I55 HydrophobicContact CB-CB 4.23Å; K37-I55 HydrophobicContact CD-CD1 4.36Å; K37-I55 PolarHBondContact N-O 3.27Å; I55-Y57 HydrophobicContact CG2-CD2 4.01Å; I55-Y57 HydrophobicContact CG2-CE1 4.5Å; I55-Y57 HydrophobicContact CG2-CE2 3.48Å; I55-Y57 VanDerWaalsContact CG2-CE2 3.48Å
56	T	91.7	Very high	84.6	Confident	73 Å²	73	64 Å²	64	45%	0.448	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	139.1	168.4	50	0	0	0	0	110.2	T24 V33 L35 L36	T24-T56 HydrophobicContact CG2-CG2 3.73Å; V33-T56 HydrophobicContact CG1-CG2 4.28Å; L35-T56 CarbonylContact O-C 3.55Å; L35-T56 WeakPolarHBondContact O-CA 3.36Å; L36-T56 HydrophobicContact CD1-CG2 3.52Å
57	Y	92.5	Very high	86.1	Confident	48 Å²	48	59.6 Å²	59.6	19%	0.188	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	131.9	169.8	-65.6	-86.4	0	0	0	109.7	R34 L35 I55 Y70 S73	R34-Y57 PolarHBondContact N-O 2.94Å; L35-Y57 HydrophobicContact CB-CD2 4.06Å; L35-Y57 HydrophobicContact CD2-CD2 3.72Å; L35-Y57 HydrophobicContact CD2-CE2 4.09Å; L35-Y57 HydrophobicContact CG-CD2 4.34Å; L35-Y57 PolarHBondContact N-O 2.8Å; L35-Y57 PolarHBondContact O-N 2.86Å; I55-Y57 HydrophobicContact CG2-CD2 4.01Å; I55-Y57 HydrophobicContact CG2-CE1 4.5Å; I55-Y57 HydrophobicContact CG2-CE2 3.48Å; I55-Y57 VanDerWaalsContact CG2-CE2 3.48Å; Y57-Y70 AromaticContact CD1-CD1 3.43Å; Y57-Y70 HydrophobicContact CD1-CD1 3.43Å; Y57-Y70 VanDerWaalsContact CD1-CD1 3.43Å; Y57-Y70 HydrophobicContact CD1-CD2 4.47Å; Y57-Y70 AromaticContact CD1-CE1 3.68Å; Y57-Y70 HydrophobicContact CD1-CE1 3.68Å; Y57-Y70 AromaticContact CD1-CG 3.89Å; Y57-Y70 HydrophobicContact CD1-CG 3.89Å; Y57-Y70 HydrophobicContact CD2-CG 4.26Å; Y57-Y70 AromaticContact CE1-CD1 3.91Å; Y57-Y70 HydrophobicContact CE1-CD1 3.91Å; Y57-Y70 HydrophobicContact CE1-CE1 4.38Å; Y57-Y70 AromaticContact CG-CD1 3.78Å; Y57-Y70 HydrophobicContact CG-CD1 3.78Å; Y57-Y70 HydrophobicContact CG-CD2 4.07Å; Y57-Y70 HydrophobicContact CG-CE1 4.23Å; Y57-Y70 HydrophobicContact CG-CE2 4.46Å; Y57-Y70 AromaticContact CG-CG 3.72Å; Y57-Y70 HydrophobicContact CG-CG 3.72Å; Y57-S73 PolarHBondContact OH-OG 3.18Å
58	P	91.8	Very high	87.6	Confident	59 Å²	59	58.7 Å²	58.7	38%	0.383	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	153	178.5	31	-35.2	0	0	0	110.9	S32 R60 Y70	S32-P58 WeakPolarHBondContact O-CA 3.28Å; P58-R60 HydrophobicContact CG-CG 4.42Å; P58-Y70 WeakPolarHBondContact O-CE2 3.38Å
59	S	88.9	Confident	88.2	Confident	34 Å²	34	61.7 Å²	61.7	24%	0.238	31%	0.308	C	S	.	.			trans	-77	125.3	169.1	-169.9	0	0	0	0	110.7	S32 R34 R86	S32-S59 PolarHBondContact O-N 3.22Å; R34-S59 PolarHBondContact NE-OG 3.44Å; R34-S59 PolarHBondContact NH2-OG 3.38Å; S59-R86 PolarHBondContact OG-NH2 2.92Å
60	R	87	Confident	88.7	Confident	190 Å²	190	61.3 Å²	61.3	72%	0.717	31%	0.306	S	S	*	.			trans	-124.2	-48	-179.1	-65.4	-173.8	179.5	-156.6	-0.4	112.4	P58 D66	P58-R60 HydrophobicContact CG-CG 4.42Å; R60-D66 PolarHBondContact N-OD2 3.31Å
61	L	86.9	Confident	88.4	Confident	102 Å²	102	58.3 Å²	58.3	53%	0.534	29%	0.292	S	S	.	.	S	Bend	trans	-118.1	-159.4	-175.8	-61.8	176.2	0	0	0	110.1	R34 E65 D66	R34-L61 PolarHBondContact NH2-O 3.25Å; L61-E65 HydrophobicContact CB-CB 4.01Å; L61-E65 WeakPolarHBondContact CB-OE2 3.44Å; L61-E65 HydrophobicContact CD1-CB 4.13Å; L61-D66 WeakPolarHBondContact CB-OD1 3.35Å; L61-D66 PolarHBondContact N-OD1 3.37Å; L61-D66 VanDerWaalsContact N-OD1 3.11Å; L61-D66 PolarHBondContact N-OD2 3.02Å
62	T	89.1	Confident	87.8	Confident	64 Å²	64	62.8 Å²	62.8	39%	0.393	32%	0.316	S	S	.	.			trans	-65	154.1	171.1	61.7	0	0	0	0	110.8	S64 E65 D66 D88	T62-S64 PolarHBondContact O-N 2.85Å; T62-E65 PolarHBondContact N-OE2 2.76Å; T62-E65 PolarHBondContact O-N 3.07Å; T62-E65 VanDerWaalsContact O-N 3.17Å; T62-E65 VanDerWaalsContact OG1-CD 3.31Å; T62-E65 VanDerWaalsContact OG1-CG 3.31Å; T62-E65 WeakPolarHBondContact OG1-CG 3.44Å; T62-E65 PolarHBondContact OG1-N 2.87Å; T62-E65 PolarHBondContact OG1-OE2 3.04Å; T62-D66 PolarHBondContact O-N 3.2Å; T62-D88 WeakPolarHBondContact CA-OD2 3.48Å
63	W	89.5	Confident	87.2	Confident	56 Å²	56	64 Å²	64	21%	0.212	33%	0.328	C	S	.	.	H	α-helix	trans	-56.4	-35.4	178.3	78	-91.6	0	0	0	111.9	A67 F85 L87 D88 L145 M148 E149 L152	W63-A67 WeakPolarHBondContact O-CB 3.37Å; W63-A67 PolarHBondContact O-N 2.81Å; W63-F85 HydrophobicContact CB-CE1 4.12Å; W63-F85 HydrophobicContact CB-CZ 4.32Å; W63-F85 AromaticContact CE3-CE1 3.87Å; W63-F85 HydrophobicContact CE3-CE1 3.87Å; W63-F85 HydrophobicContact CE3-CZ 4.43Å; W63-F85 WeakPolarHBondContact O-CZ 3.39Å; W63-L87 HydrophobicContact CD2-CD2 3.88Å; W63-L87 HydrophobicContact CE3-CD2 3.94Å; W63-L87 HydrophobicContact CG-CD2 4.21Å; W63-L87 HydrophobicContact CZ3-CD2 4.43Å; W63-D88 PolarHBondContact N-OD2 3.32Å; W63-L145 HydrophobicContact CE3-CD1 4.37Å; W63-L145 HydrophobicContact CH2-CD1 3.98Å; W63-L145 HydrophobicContact CZ3-CD1 3.61Å; W63-M148 HydrophobicContact CE3-CE 4.48Å; W63-M148 HydrophobicContact CZ3-CE 4.1Å; W63-E149 HydrophobicContact CH2-CG 3.91Å; W63-L152 HydrophobicContact CH2-CD1 4.12Å
64	S	87.7	Confident	86.6	Confident	26 Å²	26	62.8 Å²	62.8	18%	0.182	32%	0.315	C	S	.	.	H	α-helix	trans	-68	-40.4	-180	-177.9	0	0	0	0	112.2	T62 K68 L145	T62-S64 PolarHBondContact O-N 2.85Å; S64-K68 WeakPolarHBondContact O-CG 3.45Å; S64-K68 PolarHBondContact O-N 3.26Å; S64-L145 VanDerWaalsContact OG-CD2 3.22Å; S64-L145 WeakPolarHBondContact OG-CD2 3.48Å
65	E	88.2	Confident	86.2	Confident	92 Å²	92	60.2 Å²	60.2	43%	0.43	30%	0.303	S	S	.	.	H	α-helix	trans	-72.4	-46.5	178.1	-70.4	167.7	142.2	0	0	111.7	L61 T62 A67 K68 Q69	L61-E65 HydrophobicContact CB-CB 4.01Å; L61-E65 WeakPolarHBondContact CB-OE2 3.44Å; L61-E65 HydrophobicContact CD1-CB 4.13Å; T62-E65 PolarHBondContact N-OE2 2.76Å; T62-E65 PolarHBondContact O-N 3.07Å; T62-E65 VanDerWaalsContact O-N 3.17Å; T62-E65 VanDerWaalsContact OG1-CD 3.31Å; T62-E65 VanDerWaalsContact OG1-CG 3.31Å; T62-E65 WeakPolarHBondContact OG1-CG 3.44Å; T62-E65 PolarHBondContact OG1-N 2.87Å; T62-E65 PolarHBondContact OG1-OE2 3.04Å; E65-A67 PolarHBondContact O-N 2.99Å; E65-K68 PolarHBondContact O-N 3.34Å; E65-Q69 PolarHBondContact O-N 3.22Å
66	D	89.3	Confident	85.9	Confident	1 Å²	1	60.7 Å²	60.7	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-62.2	-35.5	176.7	-73.2	-11.9	0	0	0	111	R34 R60 L61 T62 Q69 Y70	R34-D66 HydrophobicContact CG-CB 3.71Å; R34-D66 IonicContact CZ-OD2 3.66Å; R34-D66 IonicContact NE-OD2 3.68Å; R34-D66 PolarHBondContact NE-OD2 2.88Å; R34-D66 IonicContact NH2-OD2 2.77Å; R60-D66 PolarHBondContact N-OD2 3.31Å; L61-D66 WeakPolarHBondContact CB-OD1 3.35Å; L61-D66 PolarHBondContact N-OD1 3.37Å; L61-D66 VanDerWaalsContact N-OD1 3.11Å; L61-D66 PolarHBondContact N-OD2 3.02Å; T62-D66 PolarHBondContact O-N 3.2Å; D66-Q69 PolarHBondContact O-N 3.19Å; D66-Y70 HydrophobicContact CB-CD2 3.89Å; D66-Y70 HydrophobicContact CB-CE2 3.8Å; D66-Y70 WeakPolarHBondContact O-CB 3.23Å; D66-Y70 WeakPolarHBondContact O-CD2 3.28Å; D66-Y70 PolarHBondContact O-N 3.01Å
67	A	87.1	Confident	85.2	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.008	31%	0.31	C	S	.	.	H	α-helix	trans	-60.2	-45.4	176	0	0	0	0	0	112.4	W63 E65 Q69 L71 F85 L145	W63-A67 WeakPolarHBondContact O-CB 3.37Å; W63-A67 PolarHBondContact O-N 2.81Å; E65-A67 PolarHBondContact O-N 2.99Å; A67-Q69 PolarHBondContact O-N 3.23Å; A67-L71 HydrophobicContact CB-CD1 3.6Å; A67-L71 HydrophobicContact CB-CG 4.35Å; A67-L71 VanDerWaalsContact O-CB 3.32Å; A67-L71 WeakPolarHBondContact O-CB 3.5Å; A67-L71 WeakPolarHBondContact O-CD1 3.49Å; A67-L71 VanDerWaalsContact O-CG 3.3Å; A67-L71 WeakPolarHBondContact O-CG 3.13Å; A67-L71 PolarHBondContact O-N 3.25Å; A67-F85 HydrophobicContact CB-CE1 4.44Å; A67-F85 HydrophobicContact CB-CE2 4.14Å; A67-F85 HydrophobicContact CB-CZ 3.71Å; A67-L145 HydrophobicContact CB-CD1 3.96Å
68	K	85.8	Confident	84.7	Confident	131 Å²	131	62.3 Å²	62.3	57%	0.57	33%	0.326	S	S	*	.	H	α-helix	trans	-58.2	-37.1	178.5	-70.2	174.8	-173.5	176.1	0	112.1	S64 E65 L145	S64-K68 WeakPolarHBondContact O-CG 3.45Å; S64-K68 PolarHBondContact O-N 3.26Å; E65-K68 PolarHBondContact O-N 3.34Å; K68-L145 HydrophobicContact CD-CD2 4.13Å; K68-L145 HydrophobicContact CG-CB 4.29Å; K68-L145 HydrophobicContact CG-CD2 3.8Å
69	Q	84	Confident	84.6	Confident	126 Å²	126	66.1 Å²	66.1	59%	0.589	34%	0.337	S	S	*	.	H	α-helix	trans	-82.7	-47.9	-177.6	-169.3	177.1	14	0	0	112.5	E65 D66 A67 S73	E65-Q69 PolarHBondContact O-N 3.22Å; D66-Q69 PolarHBondContact O-N 3.19Å; A67-Q69 PolarHBondContact O-N 3.23Å; Q69-S73 PolarHBondContact O-OG 2.95Å
70	Y	86.7	Confident	84.8	Confident	12 Å²	12	64.7 Å²	64.7	5%	0.047	33%	0.327	C	S	.	.	H	α-helix	trans	-89.1	-31.1	-165.9	-58.1	-29.7	0	0	0	114.5	R34 Y57 P58 D66 S73 S74	R34-Y70 HydrophobicContact CB-CD2 4.46Å; R34-Y70 HydrophobicContact CB-CE2 4.4Å; R34-Y70 HydrophobicContact CG-CD2 4.1Å; R34-Y70 HydrophobicContact CG-CE2 4.32Å; Y57-Y70 AromaticContact CD1-CD1 3.43Å; Y57-Y70 HydrophobicContact CD1-CD1 3.43Å; Y57-Y70 VanDerWaalsContact CD1-CD1 3.43Å; Y57-Y70 HydrophobicContact CD1-CD2 4.47Å; Y57-Y70 AromaticContact CD1-CE1 3.68Å; Y57-Y70 HydrophobicContact CD1-CE1 3.68Å; Y57-Y70 AromaticContact CD1-CG 3.89Å; Y57-Y70 HydrophobicContact CD1-CG 3.89Å; Y57-Y70 HydrophobicContact CD2-CG 4.26Å; Y57-Y70 AromaticContact CE1-CD1 3.91Å; Y57-Y70 HydrophobicContact CE1-CD1 3.91Å; Y57-Y70 HydrophobicContact CE1-CE1 4.38Å; Y57-Y70 AromaticContact CG-CD1 3.78Å; Y57-Y70 HydrophobicContact CG-CD1 3.78Å; Y57-Y70 HydrophobicContact CG-CD2 4.07Å; Y57-Y70 HydrophobicContact CG-CE1 4.23Å; Y57-Y70 HydrophobicContact CG-CE2 4.46Å; Y57-Y70 AromaticContact CG-CG 3.72Å; Y57-Y70 HydrophobicContact CG-CG 3.72Å; P58-Y70 WeakPolarHBondContact O-CE2 3.38Å; D66-Y70 HydrophobicContact CB-CD2 3.89Å; D66-Y70 HydrophobicContact CB-CE2 3.8Å; D66-Y70 WeakPolarHBondContact O-CB 3.23Å; D66-Y70 WeakPolarHBondContact O-CD2 3.28Å; D66-Y70 PolarHBondContact O-N 3.01Å; Y70-S73 PolarHBondContact O-N 3.06Å; Y70-S73 PolarHBondContact O-OG 3Å; Y70-S73 VanDerWaalsContact O-OG 3.08Å; Y70-S74 WeakPolarHBondContact O-CB 3.41Å; Y70-S74 PolarHBondContact O-N 3.12Å; Y70-S74 PolarHBondContact O-OG 3.43Å
71	L	81	Confident	85.1	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-66.1	-51.4	-174.3	-68.2	167.7	0	0	0	111.2	L35 A67 S73 S74 F85 M143 M148	L35-L71 HydrophobicContact CD1-CD2 3.81Å; L35-L71 HydrophobicContact CD1-CG 4.45Å; A67-L71 HydrophobicContact CB-CD1 3.6Å; A67-L71 HydrophobicContact CB-CG 4.35Å; A67-L71 VanDerWaalsContact O-CB 3.32Å; A67-L71 WeakPolarHBondContact O-CB 3.5Å; A67-L71 WeakPolarHBondContact O-CD1 3.49Å; A67-L71 VanDerWaalsContact O-CG 3.3Å; A67-L71 WeakPolarHBondContact O-CG 3.13Å; A67-L71 PolarHBondContact O-N 3.25Å; L71-S73 VanDerWaalsContact C-N 3.3Å; L71-S73 PolarHBondContact O-N 3.46Å; L71-S74 PolarHBondContact O-N 3.43Å; L71-S74 VanDerWaalsContact O-N 3.16Å; L71-S74 PolarHBondContact O-OG 3.1Å; L71-F85 HydrophobicContact CD2-CD2 4.12Å; L71-M143 HydrophobicContact CB-CE 3.92Å; L71-M143 HydrophobicContact CD2-CE 3.98Å; L71-M143 HydrophobicContact CD2-CG 4.34Å; L71-M143 HydrophobicContact CD2-SD 4.48Å; L71-M143 WeakPolarHBondContact O-CE 3.34Å; L71-M148 HydrophobicContact CD1-CE 4.35Å; L71-M148 HydrophobicContact CD1-SD 3.18Å; L71-M148 WeakPolarHBondContact CD1-SD 3.48Å; L71-M148 HydrophobicContact CD2-SD 4.41Å; L71-M148 HydrophobicContact CG-SD 4.42Å
72	N	76.3	Confident	85.4	Confident	94 Å²	94	50.9 Å²	50.9	50%	0.503	27%	0.268	S	S	.	.	H	α-helix	trans	-61.6	-36.4	-179.5	-71.2	-22.6	0	0	0	112.5	S74	N72-S74 VanDerWaalsContact C-N 3.32Å
73	S	79.7	Confident	85.7	Confident	66 Å²	66	47.9 Å²	47.9	46%	0.462	25%	0.249	S	C	.	.	H	α-helix	trans	-77.5	-17.3	-179.4	61.7	0	0	0	0	113.9	Y57 Q69 Y70 L71	Y57-S73 PolarHBondContact OH-OG 3.18Å; Q69-S73 PolarHBondContact O-OG 2.95Å; Y70-S73 PolarHBondContact O-N 3.06Å; Y70-S73 PolarHBondContact O-OG 3Å; Y70-S73 VanDerWaalsContact O-OG 3.08Å; L71-S73 VanDerWaalsContact C-N 3.3Å; L71-S73 PolarHBondContact O-N 3.46Å
74	S	77	Confident	85.9	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.007	24%	0.239	C	C	.	.	H	α-helix	trans	-84.7	-20.9	-172.9	69.3	0	0	0	0	114.1	K37 Y70 L71 N72 M143	K37-S74 WeakPolarHBondContact CD-O 3.47Å; K37-S74 WeakPolarHBondContact CE-O 3.29Å; K37-S74 PolarHBondContact NZ-O 3.12Å; K37-S74 VanDerWaalsContact NZ-O 3.13Å; Y70-S74 WeakPolarHBondContact O-CB 3.41Å; Y70-S74 PolarHBondContact O-N 3.12Å; Y70-S74 PolarHBondContact O-OG 3.43Å; L71-S74 PolarHBondContact O-N 3.43Å; L71-S74 VanDerWaalsContact O-N 3.16Å; L71-S74 PolarHBondContact O-OG 3.1Å; N72-S74 VanDerWaalsContact C-N 3.32Å; S74-M143 WeakPolarHBondContact OG-CE 3.43Å
75	L	81.3	Confident	86.2	Confident	25 Å²	25	44 Å²	44	13%	0.131	23%	0.23	C	C	.	.			trans	-90.2	144.2	-176.3	-62.6	-177.4	0	0	0	113	V83 F102 P140 M143	L75-V83 HydrophobicContact CD2-CG2 4.47Å; L75-F102 HydrophobicContact CD1-CD2 4.15Å; L75-F102 HydrophobicContact CD1-CE2 4.2Å; L75-F102 HydrophobicContact CD1-CG 4.41Å; L75-F102 HydrophobicContact CD1-CZ 4.49Å; L75-F102 HydrophobicContact CD2-CB 3.97Å; L75-F102 HydrophobicContact CD2-CD1 3.73Å; L75-F102 HydrophobicContact CD2-CD2 4.28Å; L75-F102 HydrophobicContact CD2-CE1 4.29Å; L75-F102 HydrophobicContact CD2-CG 3.72Å; L75-P140 HydrophobicContact CD1-CB 4.05Å; L75-M143 HydrophobicContact CD1-CB 3.7Å; L75-M143 HydrophobicContact CD1-CE 3.41Å; L75-M143 VanDerWaalsContact CD1-CE 3.41Å; L75-M143 HydrophobicContact CD1-CG 4.25Å; L75-M143 HydrophobicContact CD1-SD 3.69Å; L75-M143 HydrophobicContact CD2-CE 3.47Å; L75-M143 VanDerWaalsContact CD2-CE 3.47Å; L75-M143 HydrophobicContact CD2-SD 3.75Å; L75-M143 HydrophobicContact CG-CE 3.2Å; L75-M143 HydrophobicContact CG-SD 3.92Å
76	V	81.4	Confident	86.5	Confident	72 Å²	72	40.3 Å²	40.3	44%	0.436	21%	0.213	S	C	.	.			trans	-117.7	121.3	167.3	178.5	0	0	0	0	106.4	D78 K79 F102	V76-D78 PolarHBondContact O-N 3.16Å; V76-K79 HydrophobicContact CB-CB 4.36Å; V76-K79 HydrophobicContact CG1-CB 4.42Å; V76-K79 HydrophobicContact CG1-CD 4.49Å; V76-K79 HydrophobicContact CG1-CG 4.36Å; V76-K79 PolarHBondContact O-N 3.46Å; V76-K79 VanDerWaalsContact O-N 3.1Å; V76-F102 WeakPolarHBondContact O-CE1 3.48Å
77	A	77.6	Confident	86.6	Confident	56 Å²	56	40.6 Å²	40.6	46%	0.463	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-35	-166.3	0	0	0	0	0	114.7	P104	A77-P104 VanDerWaalsContact O-CB 3.25Å; A77-P104 WeakPolarHBondContact O-CB 3.45Å; A77-P104 VanDerWaalsContact O-CG 3.3Å; A77-P104 WeakPolarHBondContact O-CG 3.18Å
78	D	83.2	Confident	86.8	Confident	100 Å²	100	43.9 Å²	43.9	54%	0.535	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	8.7	-174.2	-64.5	-40.4	0	0	0	114.8	V76 T106	V76-D78 PolarHBondContact O-N 3.16Å; D78-T106 WeakPolarHBondContact OD1-CB 3.25Å; D78-T106 PolarHBondContact OD1-OG1 2.91Å
79	K	88.4	Confident	87	Confident	139 Å²	139	40.7 Å²	40.7	60%	0.604	22%	0.223	S	C	*	.	S	Bend	trans	-125.3	123	-178	-68.1	-171.7	177.5	-178.1	0	111.7	V76 F102	V76-K79 HydrophobicContact CB-CB 4.36Å; V76-K79 HydrophobicContact CG1-CB 4.42Å; V76-K79 HydrophobicContact CG1-CD 4.49Å; V76-K79 HydrophobicContact CG1-CG 4.36Å; V76-K79 PolarHBondContact O-N 3.46Å; V76-K79 VanDerWaalsContact O-N 3.1Å; K79-F102 WeakPolarHBondContact O-CE1 3.17Å
80	P	92.5	Very high	87.2	Confident	4 Å²	4	38.5 Å²	38.5	3%	0.026	22%	0.218	C	C	.	.			trans	-66.2	146.2	174.8	25	-28.6	0	0	0	111.1	F102 V103 A107 E111 Y115	P80-F102 CarbonylContact C-O 3.57Å; P80-F102 WeakPolarHBondContact CA-O 3.31Å; P80-F102 WeakPolarHBondContact CB-O 3.39Å; P80-V103 HydrophobicContact CB-CG2 4.48Å; P80-A107 HydrophobicContact CG-CB 4.27Å; P80-E111 VanDerWaalsContact CD-OE2 3.25Å; P80-E111 WeakPolarHBondContact CD-OE2 3.35Å; P80-E111 HydrophobicContact CG-CB 3.85Å; P80-Y115 HydrophobicContact CB-CD1 4.25Å; P80-Y115 HydrophobicContact CB-CD2 3.57Å; P80-Y115 HydrophobicContact CB-CE1 4.47Å; P80-Y115 HydrophobicContact CB-CE2 3.8Å; P80-Y115 HydrophobicContact CB-CG 3.8Å; P80-Y115 HydrophobicContact CG-CD2 3.46Å; P80-Y115 VanDerWaalsContact CG-CD2 3.46Å; P80-Y115 HydrophobicContact CG-CE2 3.47Å; P80-Y115 VanDerWaalsContact CG-CE2 3.47Å; P80-Y115 HydrophobicContact CG-CG 4.22Å; P80-Y115 PolarHBondContact O-OH 2.8Å
81	C	93.4	Very high	87.2	Confident	2 Å²	2	39.5 Å²	39.5	1%	0.014	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	163.4	174.9	65.1	0	0	0	0	111.2	K37 V39 F102	K37-C81 HydrophobicContact CG-CB 4.31Å; V39-C81 HydrophobicContact CG1-CB 4Å; C81-F102 PolarHBondContact N-O 3.38Å; C81-F102 PolarHBondContact O-N 3.24Å
82	Y	94.5	Very high	87.3	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	144.3	163	-51.8	-75.6	0	0	0	109.9	K37 I38 I40 L51 F100 Y115 T118 K119 L122	K37-Y82 WeakPolarHBondContact CA-O 3.33Å; I38-Y82 PolarHBondContact N-O 3.29Å; I38-Y82 PolarHBondContact O-N 3.43Å; I40-Y82 HydrophobicContact CD1-CE2 4.4Å; L51-Y82 HydrophobicContact CD2-CD2 4.29Å; L51-Y82 HydrophobicContact CD2-CE2 3.95Å; Y82-F100 CarbonylContact C-O 3.06Å; Y82-F100 WeakPolarHBondContact CA-O 3.22Å; Y82-Y115 HydrophobicContact CD1-CD1 4.45Å; Y82-Y115 AromaticContact CD2-CD1 3.83Å; Y82-Y115 HydrophobicContact CD2-CD1 3.83Å; Y82-Y115 AromaticContact CD2-CE1 3.87Å; Y82-Y115 HydrophobicContact CD2-CE1 3.87Å; Y82-Y115 HydrophobicContact CE1-CD1 4.09Å; Y82-Y115 AromaticContact CE2-CD1 3.42Å; Y82-Y115 HydrophobicContact CE2-CD1 3.42Å; Y82-Y115 VanDerWaalsContact CE2-CD1 3.42Å; Y82-Y115 AromaticContact CE2-CE1 3.78Å; Y82-Y115 HydrophobicContact CE2-CE1 3.78Å; Y82-Y115 HydrophobicContact CE2-CG 4.44Å; Y82-Y115 HydrophobicContact CG-CD1 4.36Å; Y82-Y115 AromaticContact CZ-CD1 3.58Å; Y82-Y115 WeakPolarHBondContact OH-CA 3.35Å; Y82-Y115 PolarHBondContact OH-O 2.95Å; Y82-T118 WeakPolarHBondContact OH-CB 3.27Å; Y82-K119 HydrophobicContact CE1-CB 4Å; Y82-K119 HydrophobicContact CE1-CG 4.28Å; Y82-K119 WeakPolarHBondContact OH-CA 3.48Å; Y82-K119 PolarHBondContact OH-N 3.39Å; Y82-L122 HydrophobicContact CD1-CD2 3.93Å; Y82-L122 HydrophobicContact CD2-CD2 3.47Å; Y82-L122 VanDerWaalsContact CD2-CD2 3.47Å; Y82-L122 HydrophobicContact CE1-CD2 4.44Å; Y82-L122 HydrophobicContact CE2-CD2 4.03Å; Y82-L122 HydrophobicContact CG-CD2 3.38Å
83	V	94.1	Very high	87.8	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	117.9	174.9	176.6	0	0	0	0	108.2	L35 L36 L75 F100	L35-V83 HydrophobicContact CD1-CG1 3.71Å; L35-V83 HydrophobicContact CD2-CG1 3.87Å; L35-V83 HydrophobicContact CG-CG1 3.61Å; L36-V83 WeakPolarHBondContact O-CA 3.21Å; L75-V83 HydrophobicContact CD2-CG2 4.47Å; V83-F100 HydrophobicContact CB-CB 4.19Å; V83-F100 PolarHBondContact N-O 2.97Å; V83-F100 PolarHBondContact O-N 3.02Å
84	L	94.5	Very high	88.2	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	124.5	168.5	-75.9	171.9	0	0	0	108.5	F25 L35 L36 I38 W97 L98 L99 F126 I131	F25-L84 HydrophobicContact CE1-CD1 4.14Å; L35-L84 CarbonylContact C-O 3.58Å; L35-L84 WeakPolarHBondContact CA-O 3.47Å; L36-L84 HydrophobicContact CB-CB 4.35Å; L36-L84 HydrophobicContact CD2-CD1 4.35Å; L36-L84 PolarHBondContact N-O 2.85Å; L36-L84 PolarHBondContact O-N 2.93Å; I38-L84 HydrophobicContact CD1-CD1 3.82Å; I38-L84 HydrophobicContact CD1-CG 4.37Å; L84-W97 HydrophobicContact CB-CE3 4.02Å; L84-W97 HydrophobicContact CB-CZ3 4.28Å; L84-L98 WeakPolarHBondContact CA-O 3.28Å; L84-L99 HydrophobicContact CD2-CB 4.04Å; L84-L99 HydrophobicContact CD2-CD1 3.75Å; L84-L99 HydrophobicContact CD2-CG 4.45Å; L84-L99 HydrophobicContact CG-CD1 4.22Å; L84-F126 HydrophobicContact CD1-CB 4.39Å; L84-F126 HydrophobicContact CD1-CD1 4.23Å; L84-F126 HydrophobicContact CD1-CD2 3.48Å; L84-F126 VanDerWaalsContact CD1-CD2 3.48Å; L84-F126 HydrophobicContact CD1-CE1 4.39Å; L84-F126 HydrophobicContact CD1-CE2 3.69Å; L84-F126 HydrophobicContact CD1-CG 3.77Å; L84-F126 HydrophobicContact CD1-CZ 4.13Å; L84-F126 HydrophobicContact CD2-CD1 4.29Å; L84-F126 HydrophobicContact CD2-CE1 4.37Å; L84-I131 HydrophobicContact CD2-CD1 4.38Å
85	F	93.7	Very high	88.9	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	127.3	-177.8	-175.5	-92.9	0	0	0	110.9	R34 L35 W63 A67 L71 L87 W97 L98 F100 M148	R34-F85 HydrophobicContact CG-CD2 4.37Å; R34-F85 HydrophobicContact CG-CE2 3.73Å; R34-F85 HydrophobicContact CG-CZ 4.15Å; R34-F85 CarbonylContact O-C 3.6Å; R34-F85 WeakPolarHBondContact O-CA 3.41Å; L35-F85 HydrophobicContact CB-CD2 4.2Å; L35-F85 HydrophobicContact CD1-CD2 4.12Å; L35-F85 HydrophobicContact CG-CD2 4.41Å; W63-F85 HydrophobicContact CB-CE1 4.12Å; W63-F85 HydrophobicContact CB-CZ 4.32Å; W63-F85 AromaticContact CE3-CE1 3.87Å; W63-F85 HydrophobicContact CE3-CE1 3.87Å; W63-F85 HydrophobicContact CE3-CZ 4.43Å; W63-F85 WeakPolarHBondContact O-CZ 3.39Å; A67-F85 HydrophobicContact CB-CE1 4.44Å; A67-F85 HydrophobicContact CB-CE2 4.14Å; A67-F85 HydrophobicContact CB-CZ 3.71Å; L71-F85 HydrophobicContact CD2-CD2 4.12Å; F85-L87 HydrophobicContact CD1-CD2 4.48Å; F85-L87 HydrophobicContact CE1-CD2 4.38Å; F85-W97 VanDerWaalsContact C-CE3 3.49Å; F85-W97 CarbonylContact O-C 3.57Å; F85-W97 WeakPolarHBondContact O-CA 3.19Å; F85-L98 HydrophobicContact CB-CB 4.47Å; F85-L98 PolarHBondContact N-O 3.37Å; F85-L98 PolarHBondContact O-N 3.38Å; F85-F100 HydrophobicContact CB-CD2 4.33Å; F85-F100 HydrophobicContact CB-CE2 3.96Å; F85-M148 HydrophobicContact CD1-CE 3.73Å; F85-M148 HydrophobicContact CE1-CE 3.94Å; F85-M148 HydrophobicContact CG-CE 4.35Å
86	R	93.9	Very high	89.4	Confident	16 Å²	16	47.3 Å²	47.3	6%	0.06	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	130.1	-177.1	-162.5	-176.8	68.7	152.8	-12.1	111.5	G31 R34 S59 F95 W97	G31-R86 PolarHBondContact O-NH1 3.17Å; G31-R86 PolarHBondContact O-NH2 2.75Å; G31-R86 VanDerWaalsContact O-NH2 3.16Å; R34-R86 WeakPolarHBondContact CD-O 3.49Å; R34-R86 PolarHBondContact NH1-O 3.24Å; R34-R86 PolarHBondContact O-N 3.25Å; S59-R86 PolarHBondContact OG-NH2 2.92Å; R86-F95 HydrophobicContact CG-CB 3.86Å; R86-F95 HydrophobicContact CG-CG 4.36Å; R86-W97 HydrophobicContact CB-CD2 4.01Å; R86-W97 HydrophobicContact CB-CE3 3.85Å; R86-W97 HydrophobicContact CB-CH2 3.6Å; R86-W97 HydrophobicContact CB-CZ2 3.72Å; R86-W97 HydrophobicContact CB-CZ3 3.66Å; R86-W97 HydrophobicContact CG-CD2 4.1Å; R86-W97 HydrophobicContact CG-CE3 4.43Å; R86-W97 HydrophobicContact CG-CH2 3.99Å; R86-W97 HydrophobicContact CG-CZ2 3.55Å; R86-W97 HydrophobicContact CG-CZ3 4.4Å
87	L	92.1	Very high	90	Very high	7 Å²	7	44 Å²	44	4%	0.037	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	162.3	167.5	-63	176.9	0	0	0	111	W63 F85 T89 E96 L98	W63-L87 HydrophobicContact CD2-CD2 3.88Å; W63-L87 HydrophobicContact CE3-CD2 3.94Å; W63-L87 HydrophobicContact CG-CD2 4.21Å; W63-L87 HydrophobicContact CZ3-CD2 4.43Å; F85-L87 HydrophobicContact CD1-CD2 4.48Å; F85-L87 HydrophobicContact CE1-CD2 4.38Å; L87-T89 WeakPolarHBondContact CB-OG1 3.46Å; L87-T89 PolarHBondContact O-N 3.26Å; L87-E96 HydrophobicContact CB-CB 4.34Å; L87-E96 HydrophobicContact CD1-CB 4.33Å; L87-E96 PolarHBondContact N-O 3.25Å; L87-L98 HydrophobicContact CD1-CD1 4.3Å; L87-L98 HydrophobicContact CD1-CD2 4.03Å; L87-L98 HydrophobicContact CD1-CG 4.02Å; L87-L98 HydrophobicContact CD2-CD1 3.86Å; L87-L98 HydrophobicContact CD2-CG 4.23Å; L87-L98 HydrophobicContact CG-CD1 4.23Å; L87-L98 HydrophobicContact CG-CG 4.04Å
88	D	91	Very high	90.8	Very high	69 Å²	69	41.3 Å²	41.3	37%	0.369	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	-6.9	173.8	-63.6	-25.5	0	0	0	112.6	R34 T62 W63	R34-D88 IonicContact CZ-OD1 3.77Å; R34-D88 IonicContact NH1-OD1 2.94Å; R34-D88 PolarHBondContact NH1-OD1 2.59Å; R34-D88 IonicContact NH2-OD1 3.63Å; R34-D88 PolarHBondContact NH2-OD1 3.48Å; R34-D88 IonicContact NH2-OD2 3.96Å; T62-D88 WeakPolarHBondContact CA-OD2 3.48Å; W63-D88 PolarHBondContact N-OD2 3.32Å
89	T	89.7	Confident	91.3	Very high	64 Å²	64	36.6 Å²	36.6	39%	0.393	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	152.6	176.6	47	0	0	0	0	111.9	L87 E96	L87-T89 WeakPolarHBondContact CB-OG1 3.46Å; L87-T89 PolarHBondContact O-N 3.26Å; T89-E96 WeakPolarHBondContact CB-OE2 3.3Å; T89-E96 PolarHBondContact O-N 2.78Å; T89-E96 PolarHBondContact OG1-OE2 2.9Å
90	T	89.7	Confident	91.6	Very high	81 Å²	81	30 Å²	30	50%	0.497	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	154	178.4	58.3	0	0	0	0	111.7	G94 F95	T90-G94 CarbonylContact C-O 3.5Å; T90-G94 WeakPolarHBondContact CA-O 3.38Å; T90-F95 HydrophobicContact CG2-CD1 3.74Å; T90-F95 HydrophobicContact CG2-CE1 3.89Å; T90-F95 HydrophobicContact CG2-CG 4.38Å
91	C	85.7	Confident	91.6	Very high	32 Å²	32	29.9 Å²	29.9	22%	0.216	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	-179	173.4	70.1	0	0	0	0	109.4	V93 G94 E96	C91-V93 PolarHBondContact O-N 3.17Å; C91-G94 PolarHBondContact N-O 2.76Å; C91-G94 PolarHBondContact O-N 2.94Å; C91-G94 VanDerWaalsContact O-N 3.14Å; C91-G94 PolarHBondContact SG-O 3.33Å; C91-E96 HydrophobicContact CB-CG 3.95Å
92	T	84.1	Confident	91.6	Very high	141 Å²	141	29.8 Å²	29.8	87%	0.865	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-16.1	-178.6	53.7	0	0	0	0	114.8
93	V	85.4	Confident	91.5	Very high	98 Å²	98	30.3 Å²	30.3	59%	0.594	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.3	-11.8	-177.1	-167.1	0	0	0	0	112.2	C91	C91-V93 PolarHBondContact O-N 3.17Å
94	G	87.9	Confident	91.5	Very high	20 Å²	20	30.5 Å²	30.5	21%	0.206	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	138.1	-152.9	-176.1	0	0	0	0	0	112.3	T90 C91	T90-G94 CarbonylContact C-O 3.5Å; T90-G94 WeakPolarHBondContact CA-O 3.38Å; C91-G94 PolarHBondContact N-O 2.76Å; C91-G94 PolarHBondContact O-N 2.94Å; C91-G94 VanDerWaalsContact O-N 3.14Å; C91-G94 PolarHBondContact SG-O 3.33Å
95	F	91.9	Very high	91.2	Very high	64 Å²	64	35.8 Å²	35.8	28%	0.281	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61	146.4	177.7	-67	-78.1	0	0	0	112.8	R86 T90 W97	R86-F95 HydrophobicContact CG-CB 3.86Å; R86-F95 HydrophobicContact CG-CG 4.36Å; T90-F95 HydrophobicContact CG2-CD1 3.74Å; T90-F95 HydrophobicContact CG2-CE1 3.89Å; T90-F95 HydrophobicContact CG2-CG 4.38Å; F95-W97 PolarHBondContact O-NE1 3.49Å
96	E	92.6	Very high	91.1	Very high	29 Å²	29	40.5 Å²	40.5	14%	0.136	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	140.4	172.7	-67.4	-171.7	140.6	0	0	111.3	L87 T89 C91 C130 R132	L87-E96 HydrophobicContact CB-CB 4.34Å; L87-E96 HydrophobicContact CD1-CB 4.33Å; L87-E96 PolarHBondContact N-O 3.25Å; T89-E96 WeakPolarHBondContact CB-OE2 3.3Å; T89-E96 PolarHBondContact O-N 2.78Å; T89-E96 PolarHBondContact OG1-OE2 2.9Å; C91-E96 HydrophobicContact CB-CG 3.95Å; E96-C130 CarbonylContact C-O 3.54Å; E96-R132 HydrophobicContact CB-CB 4.33Å; E96-R132 IonicContact OE1-NH1 2.59Å; E96-R132 PolarHBondContact OE1-NH1 2.93Å; E96-R132 WeakPolarHBondContact OE2-CD 3.42Å; E96-R132 IonicContact OE2-CZ 2.75Å; E96-R132 IonicContact OE2-NE 3.17Å; E96-R132 IonicContact OE2-NH1 2.96Å; E96-R132 PolarHBondContact OE2-NH1 3.43Å
97	W	94.4	Very high	90.9	Very high	2 Å²	2	40 Å²	40	1%	0.008	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	148.3	-178.7	-67.5	78.6	0	0	0	111.8	C28 V33 L84 F85 R86 F95 F126 C130 I131 R132	C28-W97 HydrophobicContact CB-CH2 3.6Å; C28-W97 HydrophobicContact CB-CZ2 3.71Å; C28-W97 HydrophobicContact CB-CZ3 4.46Å; C28-W97 VanDerWaalsContact O-CZ2 3.29Å; C28-W97 WeakPolarHBondContact O-CZ2 3.25Å; V33-W97 WeakPolarHBondContact O-CH2 3.38Å; L84-W97 HydrophobicContact CB-CE3 4.02Å; L84-W97 HydrophobicContact CB-CZ3 4.28Å; F85-W97 VanDerWaalsContact C-CE3 3.49Å; F85-W97 CarbonylContact O-C 3.57Å; F85-W97 WeakPolarHBondContact O-CA 3.19Å; R86-W97 HydrophobicContact CB-CD2 4.01Å; R86-W97 HydrophobicContact CB-CE3 3.85Å; R86-W97 HydrophobicContact CB-CH2 3.6Å; R86-W97 HydrophobicContact CB-CZ2 3.72Å; R86-W97 HydrophobicContact CB-CZ3 3.66Å; R86-W97 HydrophobicContact CG-CD2 4.1Å; R86-W97 HydrophobicContact CG-CE3 4.43Å; R86-W97 HydrophobicContact CG-CH2 3.99Å; R86-W97 HydrophobicContact CG-CZ2 3.55Å; R86-W97 HydrophobicContact CG-CZ3 4.4Å; F95-W97 PolarHBondContact O-NE1 3.49Å; W97-F126 HydrophobicContact CB-CE1 3.99Å; W97-F126 AromaticContact CD1-CE1 3.83Å; W97-F126 AromaticContact CD1-CZ 3.95Å; W97-F126 AromaticContact CD2-CE1 3.98Å; W97-F126 HydrophobicContact CD2-CE1 3.98Å; W97-F126 AromaticContact CD2-CZ 3.6Å; W97-F126 HydrophobicContact CD2-CZ 3.6Å; W97-F126 AromaticContact CE2-CZ 3.74Å; W97-F126 HydrophobicContact CE3-CZ 4.06Å; W97-F126 AromaticContact CG-CE1 3.64Å; W97-F126 HydrophobicContact CG-CE1 3.64Å; W97-F126 AromaticContact CG-CZ 3.78Å; W97-F126 HydrophobicContact CG-CZ 3.78Å; W97-F126 HydrophobicContact CZ2-CZ 4.32Å; W97-F126 AromaticContact NE1-CZ 3.93Å; W97-C130 PolarHBondContact N-O 2.59Å; W97-I131 HydrophobicContact CB-CG1 4.38Å; W97-I131 CarbonylContact O-C 3.54Å; W97-I131 WeakPolarHBondContact O-CA 3.02Å; W97-R132 PolarHBondContact O-N 2.93Å
98	L	93.5	Very high	90.8	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	134.2	168.9	-58.9	-178.2	0	0	0	109.3	L84 F85 L87 F100 H133 F135 M148 L152	L84-L98 WeakPolarHBondContact CA-O 3.28Å; F85-L98 HydrophobicContact CB-CB 4.47Å; F85-L98 PolarHBondContact N-O 3.37Å; F85-L98 PolarHBondContact O-N 3.38Å; L87-L98 HydrophobicContact CD1-CD1 4.3Å; L87-L98 HydrophobicContact CD1-CD2 4.03Å; L87-L98 HydrophobicContact CD1-CG 4.02Å; L87-L98 HydrophobicContact CD2-CD1 3.86Å; L87-L98 HydrophobicContact CD2-CG 4.23Å; L87-L98 HydrophobicContact CG-CD1 4.23Å; L87-L98 HydrophobicContact CG-CG 4.04Å; L98-F100 HydrophobicContact CB-CD2 4.45Å; L98-F100 HydrophobicContact CB-CE2 3.71Å; L98-F100 HydrophobicContact CB-CZ 4.01Å; L98-F100 HydrophobicContact CD1-CE2 4.28Å; L98-F100 HydrophobicContact CD1-CZ 3.99Å; L98-H133 WeakPolarHBondContact CA-O 3.34Å; L98-H133 HydrophobicContact CD2-CB 3.93Å; L98-F135 HydrophobicContact CD1-CE2 4.4Å; L98-F135 HydrophobicContact CD2-CE2 4.09Å; L98-M148 HydrophobicContact CD1-CE 3.58Å; L98-L152 HydrophobicContact CD1-CD1 4.41Å; L98-L152 HydrophobicContact CD1-CD2 4.22Å; L98-L152 HydrophobicContact CD2-CD2 3.97Å
99	L	94.9	Very high	90.8	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	110.8	175.3	173.4	62.2	0	0	0	109.5	L84 K119 L122 I131 H133 D134 F135	L84-L99 HydrophobicContact CD2-CB 4.04Å; L84-L99 HydrophobicContact CD2-CD1 3.75Å; L84-L99 HydrophobicContact CD2-CG 4.45Å; L84-L99 HydrophobicContact CG-CD1 4.22Å; L99-K119 HydrophobicContact CD2-CG 4.38Å; L99-L122 HydrophobicContact CD1-CD2 4.01Å; L99-I131 HydrophobicContact CB-CG2 3.97Å; L99-I131 HydrophobicContact CD2-CD1 4.48Å; L99-H133 PolarHBondContact N-O 3.19Å; L99-H133 VanDerWaalsContact N-O 3.08Å; L99-D134 HydrophobicContact CB-CB 4.3Å; L99-D134 HydrophobicContact CD2-CB 4.5Å; L99-D134 CarbonylContact O-C 3.59Å; L99-D134 VanDerWaalsContact O-CA 3.3Å; L99-D134 WeakPolarHBondContact O-CA 3.37Å; L99-F135 PolarHBondContact O-N 2.79Å
100	F	93.1	Very high	90.7	Very high	1 Å²	1	49.3 Å²	49.3	0%	0.004	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	124.7	171.2	-59.8	-78.6	0	0	0	109.7	Y82 V83 F85 L98 F135 I137 M143 M148	Y82-F100 CarbonylContact C-O 3.06Å; Y82-F100 WeakPolarHBondContact CA-O 3.22Å; V83-F100 HydrophobicContact CB-CB 4.19Å; V83-F100 PolarHBondContact N-O 2.97Å; V83-F100 PolarHBondContact O-N 3.02Å; F85-F100 HydrophobicContact CB-CD2 4.33Å; F85-F100 HydrophobicContact CB-CE2 3.96Å; L98-F100 HydrophobicContact CB-CD2 4.45Å; L98-F100 HydrophobicContact CB-CE2 3.71Å; L98-F100 HydrophobicContact CB-CZ 4.01Å; L98-F100 HydrophobicContact CD1-CE2 4.28Å; L98-F100 HydrophobicContact CD1-CZ 3.99Å; F100-F135 WeakPolarHBondContact CA-O 3.31Å; F100-F135 HydrophobicContact CD1-CB 3.73Å; F100-F135 HydrophobicContact CD1-CD2 4.01Å; F100-F135 HydrophobicContact CD1-CG 4.33Å; F100-F135 HydrophobicContact CE1-CB 3.91Å; F100-F135 AromaticContact CE1-CD2 3.41Å; F100-F135 HydrophobicContact CE1-CD2 3.41Å; F100-F135 VanDerWaalsContact CE1-CD2 3.41Å; F100-F135 HydrophobicContact CE1-CE2 4.28Å; F100-F135 HydrophobicContact CE1-CG 4.01Å; F100-F135 AromaticContact CZ-CD2 3.95Å; F100-F135 HydrophobicContact CZ-CD2 3.95Å; F100-F135 HydrophobicContact CZ-CE2 4.49Å; F100-I137 HydrophobicContact CB-CD1 4.34Å; F100-I137 HydrophobicContact CD1-CD1 3.39Å; F100-I137 HydrophobicContact CD1-CG1 4.21Å; F100-I137 HydrophobicContact CE1-CD1 4.04Å; F100-I137 HydrophobicContact CG-CD1 4.19Å; F100-M143 HydrophobicContact CB-SD 4.43Å; F100-M148 HydrophobicContact CE1-CG 4.05Å; F100-M148 HydrophobicContact CE2-CE 3.85Å; F100-M148 HydrophobicContact CE2-SD 4.16Å; F100-M148 HydrophobicContact CZ-CE 3.59Å; F100-M148 HydrophobicContact CZ-CG 3.65Å; F100-M148 HydrophobicContact CZ-SD 3.72Å
101	S	93.5	Very high	90.7	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.014	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	96.6	171.5	-52.7	0	0	0	0	107.9	K119 F135 H136 I137	S101-K119 WeakPolarHBondContact OG-CD 3.44Å; S101-K119 WeakPolarHBondContact OG-CE 3.38Å; S101-F135 PolarHBondContact N-O 3.45Å; S101-H136 PolarHBondContact O-ND1 2.93Å; S101-I137 PolarHBondContact O-N 2.85Å
102	F	93.6	Very high	91	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	112.7	178.5	178	-111.4	0	0	0	109.5	L75 V76 K79 P80 C81 P104 I137 P140	L75-F102 HydrophobicContact CD1-CD2 4.15Å; L75-F102 HydrophobicContact CD1-CE2 4.2Å; L75-F102 HydrophobicContact CD1-CG 4.41Å; L75-F102 HydrophobicContact CD1-CZ 4.49Å; L75-F102 HydrophobicContact CD2-CB 3.97Å; L75-F102 HydrophobicContact CD2-CD1 3.73Å; L75-F102 HydrophobicContact CD2-CD2 4.28Å; L75-F102 HydrophobicContact CD2-CE1 4.29Å; L75-F102 HydrophobicContact CD2-CG 3.72Å; V76-F102 WeakPolarHBondContact O-CE1 3.48Å; K79-F102 WeakPolarHBondContact O-CE1 3.17Å; P80-F102 CarbonylContact C-O 3.57Å; P80-F102 WeakPolarHBondContact CA-O 3.31Å; P80-F102 WeakPolarHBondContact CB-O 3.39Å; C81-F102 PolarHBondContact N-O 3.38Å; C81-F102 PolarHBondContact O-N 3.24Å; F102-P104 HydrophobicContact CE1-CB 4.22Å; F102-P104 HydrophobicContact CE1-CG 3.78Å; F102-P104 HydrophobicContact CE2-CB 4.41Å; F102-P104 HydrophobicContact CZ-CB 3.82Å; F102-P104 HydrophobicContact CZ-CG 3.91Å; F102-I137 CarbonylContact C-O 3.53Å; F102-I137 VanDerWaalsContact CA-O 3.31Å; F102-I137 WeakPolarHBondContact CA-O 3.19Å; F102-I137 HydrophobicContact CD2-CB 4.39Å; F102-I137 HydrophobicContact CD2-CG2 3.93Å; F102-P140 HydrophobicContact CE2-CB 4.47Å
103	V	92.9	Very high	91.3	Very high	11 Å²	11	51.1 Å²	51.1	7%	0.067	27%	0.267	C	S	.	.			trans	-134.1	92	-179.7	-174.5	0	0	0	0	108.1	P80 R112 I137	P80-V103 HydrophobicContact CB-CG2 4.48Å; V103-R112 HydrophobicContact CG1-CB 3.81Å; V103-R112 HydrophobicContact CG1-CG 3.58Å; V103-I137 PolarHBondContact N-O 2.96Å
104	P	92.4	Very high	91.5	Very high	4 Å²	4	47.9 Å²	47.9	3%	0.026	25%	0.246	C	C	.	.			trans	-71.4	145.7	-177.4	28	-31.2	0	0	0	111.2	A77 F102 T106 A107 T138	A77-P104 VanDerWaalsContact O-CB 3.25Å; A77-P104 WeakPolarHBondContact O-CB 3.45Å; A77-P104 VanDerWaalsContact O-CG 3.3Å; A77-P104 WeakPolarHBondContact O-CG 3.18Å; F102-P104 HydrophobicContact CE1-CB 4.22Å; F102-P104 HydrophobicContact CE1-CG 3.78Å; F102-P104 HydrophobicContact CE2-CB 4.41Å; F102-P104 HydrophobicContact CZ-CB 3.82Å; F102-P104 HydrophobicContact CZ-CG 3.91Å; P104-T106 PolarHBondContact O-N 2.65Å; P104-A107 HydrophobicContact CG-CB 4.08Å; P104-A107 WeakPolarHBondContact O-CB 3.34Å; P104-A107 PolarHBondContact O-N 3.2Å; P104-A107 VanDerWaalsContact O-N 3.12Å; P104-T138 WeakPolarHBondContact CA-O 3.26Å
105	D	89.9	Confident	91.7	Very high	111 Å²	111	47.7 Å²	47.7	59%	0.594	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-21	178.9	-77.3	-34.4	0	0	0	113.2	A107 R112 T138	D105-A107 VanDerWaalsContact C-N 3.28Å; D105-A107 PolarHBondContact O-N 2.78Å; D105-R112 IonicContact OD1-NH1 3.32Å; D105-R112 PolarHBondContact OD1-NH1 3.13Å; D105-T138 HydrophobicContact CB-CG2 4.24Å; D105-T138 VanDerWaalsContact OD2-CG2 3.24Å; D105-T138 WeakPolarHBondContact OD2-CG2 3.08Å
106	T	90.5	Very high	91.7	Very high	98 Å²	98	48 Å²	48	60%	0.601	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-16.7	175.9	56.8	0	0	0	0	113.1	D78 P104	D78-T106 WeakPolarHBondContact OD1-CB 3.25Å; D78-T106 PolarHBondContact OD1-OG1 2.91Å; P104-T106 PolarHBondContact O-N 2.65Å
107	A	89.2	Confident	91.5	Very high	5 Å²	5	50.4 Å²	50.4	4%	0.041	27%	0.274	C	S	.	.	S	Bend	trans	-70.9	145.4	-179.2	0	0	0	0	0	112.5	P80 P104 D105 R112	P80-A107 HydrophobicContact CG-CB 4.27Å; P104-A107 HydrophobicContact CG-CB 4.08Å; P104-A107 WeakPolarHBondContact O-CB 3.34Å; P104-A107 PolarHBondContact O-N 3.2Å; P104-A107 VanDerWaalsContact O-N 3.12Å; D105-A107 VanDerWaalsContact C-N 3.28Å; D105-A107 PolarHBondContact O-N 2.78Å; A107-R112 HydrophobicContact CB-CG 3.93Å; A107-R112 PolarHBondContact O-NE 3.41Å
108	P	90.3	Very high	91.4	Very high	76 Å²	76	50.3 Å²	50.3	49%	0.494	27%	0.273	S	S	.	.			trans	-53.6	142.1	176.1	-24.8	33.4	0	0	0	112.5	R110 E111 R112	P108-R110 PolarHBondContact O-N 3.41Å; P108-R110 VanDerWaalsContact O-N 3.12Å; P108-E111 HydrophobicContact CB-CG 4.5Å; P108-E111 PolarHBondContact O-N 3Å; P108-R112 PolarHBondContact O-N 3.1Å; P108-R112 VanDerWaalsContact O-N 3.07Å
109	V	90.5	Very high	91.3	Very high	103 Å²	103	52.5 Å²	52.5	62%	0.624	28%	0.283	S	S	*	.	H	α-helix	trans	-52.2	-39.7	-178.9	176.7	0	0	0	0	112	E111 R112 M113	V109-E111 PolarHBondContact O-N 2.81Å; V109-R112 PolarHBondContact O-N 3.27Å; V109-M113 WeakPolarHBondContact O-CB 3.35Å; V109-M113 PolarHBondContact O-N 3.31Å
110	R	89.3	Confident	91.1	Very high	157 Å²	157	56 Å²	56	59%	0.592	31%	0.312	S	S	*	.	H	α-helix	trans	-56.8	-49.1	176.4	-179.9	178.8	167.9	-172.5	-8	111.5	E49 P108 M113 L114	E49-R110 IonicContact OE1-CZ 2.59Å; E49-R110 IonicContact OE1-NH2 3.96Å; E49-R110 PolarHBondContact OE1-NH2 3.4Å; P108-R110 PolarHBondContact O-N 3.41Å; P108-R110 VanDerWaalsContact O-N 3.12Å; R110-M113 PolarHBondContact O-N 2.77Å; R110-L114 HydrophobicContact CG-CD1 4.05Å; R110-L114 VanDerWaalsContact O-CG 3.24Å; R110-L114 WeakPolarHBondContact O-CG 3.41Å; R110-L114 PolarHBondContact O-N 3.43Å
111	E	89.5	Confident	91	Very high	77 Å²	77	57 Å²	57	36%	0.36	32%	0.318	S	S	.	.	H	α-helix	trans	-66.5	-43.5	179.9	-63.8	-172.8	-178.8	0	0	111.5	P80 P108 V109 M113 L114 Y115	P80-E111 VanDerWaalsContact CD-OE2 3.25Å; P80-E111 WeakPolarHBondContact CD-OE2 3.35Å; P80-E111 HydrophobicContact CG-CB 3.85Å; P108-E111 HydrophobicContact CB-CG 4.5Å; P108-E111 PolarHBondContact O-N 3Å; V109-E111 PolarHBondContact O-N 2.81Å; E111-M113 VanDerWaalsContact C-N 3.27Å; E111-M113 PolarHBondContact O-N 2.99Å; E111-L114 WeakPolarHBondContact O-CB 3.15Å; E111-L114 PolarHBondContact O-N 3.08Å; E111-L114 VanDerWaalsContact O-N 3.15Å; E111-Y115 WeakPolarHBondContact O-CD2 3.28Å; E111-Y115 PolarHBondContact O-N 3.48Å
112	R	90.9	Very high	91	Very high	83 Å²	83	57 Å²	57	31%	0.313	32%	0.318	S	S	.	.	H	α-helix	trans	-57.6	-42.1	176.6	-63.2	-165.3	-72.3	166.4	-1.9	112	V103 D105 A107 P108 V109 A116	V103-R112 HydrophobicContact CG1-CB 3.81Å; V103-R112 HydrophobicContact CG1-CG 3.58Å; D105-R112 IonicContact OD1-NH1 3.32Å; D105-R112 PolarHBondContact OD1-NH1 3.13Å; A107-R112 HydrophobicContact CB-CG 3.93Å; A107-R112 PolarHBondContact O-NE 3.41Å; P108-R112 PolarHBondContact O-N 3.1Å; P108-R112 VanDerWaalsContact O-N 3.07Å; V109-R112 PolarHBondContact O-N 3.27Å; R112-A116 WeakPolarHBondContact O-CB 3.4Å; R112-A116 PolarHBondContact O-N 2.95Å
113	M	90.6	Very high	91	Very high	132 Å²	132	61.4 Å²	61.4	65%	0.65	34%	0.335	S	S	*	.	H	α-helix	trans	-64.7	-44.8	176.4	-167.2	179.1	-148.9	0	0	111.8	V109 R110 E111 Y115 A116 S117	V109-M113 WeakPolarHBondContact O-CB 3.35Å; V109-M113 PolarHBondContact O-N 3.31Å; R110-M113 PolarHBondContact O-N 2.77Å; E111-M113 VanDerWaalsContact C-N 3.27Å; E111-M113 PolarHBondContact O-N 2.99Å; M113-Y115 PolarHBondContact O-N 2.71Å; M113-A116 PolarHBondContact O-N 2.77Å; M113-S117 WeakPolarHBondContact O-CB 3.48Å; M113-S117 PolarHBondContact O-N 2.86Å; M113-S117 PolarHBondContact O-OG 3.44Å
114	L	90.2	Very high	90.9	Very high	31 Å²	31	67.1 Å²	67.1	16%	0.162	36%	0.361	C	S	.	.	H	α-helix	trans	-58.7	-47.9	177.5	-71.3	168.3	0	0	0	111.8	F15 I40 E49 R110 E111 A116 S117 T118	F15-L114 HydrophobicContact CE1-CD2 4.49Å; F15-L114 HydrophobicContact CE2-CD2 3.44Å; F15-L114 VanDerWaalsContact CE2-CD2 3.44Å; F15-L114 HydrophobicContact CZ-CD2 3.32Å; I40-L114 HydrophobicContact CD1-CB 4.36Å; E49-L114 VanDerWaalsContact OE2-CD1 3.26Å; E49-L114 WeakPolarHBondContact OE2-CD1 3.38Å; E49-L114 VanDerWaalsContact OE2-CD2 3.24Å; E49-L114 WeakPolarHBondContact OE2-CD2 3.37Å; R110-L114 HydrophobicContact CG-CD1 4.05Å; R110-L114 VanDerWaalsContact O-CG 3.24Å; R110-L114 WeakPolarHBondContact O-CG 3.41Å; R110-L114 PolarHBondContact O-N 3.43Å; E111-L114 WeakPolarHBondContact O-CB 3.15Å; E111-L114 PolarHBondContact O-N 3.08Å; E111-L114 VanDerWaalsContact O-N 3.15Å; L114-A116 VanDerWaalsContact C-N 3.34Å; L114-A116 PolarHBondContact O-N 2.89Å; L114-S117 PolarHBondContact O-N 2.83Å; L114-T118 WeakPolarHBondContact O-CB 3.29Å; L114-T118 PolarHBondContact O-N 2.52Å; L114-T118 PolarHBondContact O-OG1 2.87Å
115	Y	92.1	Very high	90.8	Very high	15 Å²	15	70.4 Å²	70.4	6%	0.059	38%	0.376	C	S	.	.	H	α-helix	trans	-71.1	-24.9	176.9	-79.4	-93.2	0	0	0	113.4	V39 I40 P80 Y82 E111 M113	V39-Y115 VanDerWaalsContact CA-OH 3.32Å; V39-Y115 WeakPolarHBondContact CA-OH 3.27Å; I40-Y115 HydrophobicContact CB-CE2 4.21Å; I40-Y115 HydrophobicContact CD1-CD1 4.12Å; I40-Y115 HydrophobicContact CD1-CD2 4.03Å; I40-Y115 HydrophobicContact CD1-CE1 4.14Å; I40-Y115 HydrophobicContact CD1-CE2 4.09Å; I40-Y115 HydrophobicContact CD1-CG 4.07Å; I40-Y115 HydrophobicContact CG1-CE1 4.07Å; I40-Y115 HydrophobicContact CG1-CE2 4.29Å; I40-Y115 PolarHBondContact N-OH 2.85Å; P80-Y115 HydrophobicContact CB-CD1 4.25Å; P80-Y115 HydrophobicContact CB-CD2 3.57Å; P80-Y115 HydrophobicContact CB-CE1 4.47Å; P80-Y115 HydrophobicContact CB-CE2 3.8Å; P80-Y115 HydrophobicContact CB-CG 3.8Å; P80-Y115 HydrophobicContact CG-CD2 3.46Å; P80-Y115 VanDerWaalsContact CG-CD2 3.46Å; P80-Y115 HydrophobicContact CG-CE2 3.47Å; P80-Y115 VanDerWaalsContact CG-CE2 3.47Å; P80-Y115 HydrophobicContact CG-CG 4.22Å; P80-Y115 PolarHBondContact O-OH 2.8Å; Y82-Y115 HydrophobicContact CD1-CD1 4.45Å; Y82-Y115 AromaticContact CD2-CD1 3.83Å; Y82-Y115 HydrophobicContact CD2-CD1 3.83Å; Y82-Y115 AromaticContact CD2-CE1 3.87Å; Y82-Y115 HydrophobicContact CD2-CE1 3.87Å; Y82-Y115 HydrophobicContact CE1-CD1 4.09Å; Y82-Y115 AromaticContact CE2-CD1 3.42Å; Y82-Y115 HydrophobicContact CE2-CD1 3.42Å; Y82-Y115 VanDerWaalsContact CE2-CD1 3.42Å; Y82-Y115 AromaticContact CE2-CE1 3.78Å; Y82-Y115 HydrophobicContact CE2-CE1 3.78Å; Y82-Y115 HydrophobicContact CE2-CG 4.44Å; Y82-Y115 HydrophobicContact CG-CD1 4.36Å; Y82-Y115 AromaticContact CZ-CD1 3.58Å; Y82-Y115 WeakPolarHBondContact OH-CA 3.35Å; Y82-Y115 PolarHBondContact OH-O 2.95Å; E111-Y115 WeakPolarHBondContact O-CD2 3.28Å; E111-Y115 PolarHBondContact O-N 3.48Å; M113-Y115 PolarHBondContact O-N 2.71Å
116	A	91.1	Very high	90.9	Very high	72 Å²	72	65.1 Å²	65.1	60%	0.595	35%	0.347	S	S	*	.	H	α-helix	trans	-71.5	-45.5	171.8	0	0	0	0	0	111.3	R112 M113 L114	R112-A116 WeakPolarHBondContact O-CB 3.4Å; R112-A116 PolarHBondContact O-N 2.95Å; M113-A116 PolarHBondContact O-N 2.77Å; L114-A116 VanDerWaalsContact C-N 3.34Å; L114-A116 PolarHBondContact O-N 2.89Å
117	S	89.6	Confident	91	Very high	78 Å²	78	61.2 Å²	61.2	55%	0.545	33%	0.327	S	S	.	.	H	α-helix	trans	-73.1	-27.1	-176.2	-62.9	0	0	0	0	113.9	M113 L114	M113-S117 WeakPolarHBondContact O-CB 3.48Å; M113-S117 PolarHBondContact O-N 2.86Å; M113-S117 PolarHBondContact O-OG 3.44Å; L114-S117 PolarHBondContact O-N 2.83Å
118	T	91.1	Very high	91	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-88.9	-15.1	-174.2	-46.2	0	0	0	0	113.7	F15 I40 L51 Y82 L114 A120 T121 L122	F15-T118 HydrophobicContact CB-CG2 3.85Å; F15-T118 HydrophobicContact CD2-CG2 4.14Å; F15-T118 WeakPolarHBondContact CD2-OG1 3.34Å; F15-T118 HydrophobicContact CG-CG2 4.47Å; I40-T118 HydrophobicContact CD1-CG2 4.21Å; L51-T118 HydrophobicContact CD1-CG2 3.9Å; L51-T118 HydrophobicContact CD2-CG2 3.81Å; L51-T118 HydrophobicContact CG-CG2 3.99Å; Y82-T118 WeakPolarHBondContact OH-CB 3.27Å; L114-T118 WeakPolarHBondContact O-CB 3.29Å; L114-T118 PolarHBondContact O-N 2.52Å; L114-T118 PolarHBondContact O-OG1 2.87Å; T118-A120 VanDerWaalsContact C-N 3.28Å; T118-A120 PolarHBondContact O-N 2.8Å; T118-T121 PolarHBondContact O-N 2.8Å; T118-T121 VanDerWaalsContact O-N 3.12Å; T118-L122 PolarHBondContact O-N 3.23Å
119	K	92.3	Very high	91	Very high	47 Å²	47	62.4 Å²	62.4	20%	0.204	34%	0.343	C	S	.	.	H	α-helix	trans	-55.8	-41.5	-174	-178.1	-175.3	171.7	-173.6	0	112.7	Y82 L99 S101 L122 R123 D134	Y82-K119 HydrophobicContact CE1-CB 4Å; Y82-K119 HydrophobicContact CE1-CG 4.28Å; Y82-K119 WeakPolarHBondContact OH-CA 3.48Å; Y82-K119 PolarHBondContact OH-N 3.39Å; L99-K119 HydrophobicContact CD2-CG 4.38Å; S101-K119 WeakPolarHBondContact OG-CD 3.44Å; S101-K119 WeakPolarHBondContact OG-CE 3.38Å; K119-L122 PolarHBondContact O-N 3.35Å; K119-R123 WeakPolarHBondContact O-CB 3.33Å; K119-R123 PolarHBondContact O-N 2.78Å; K119-D134 WeakPolarHBondContact CE-OD2 3.02Å; K119-D134 IonicContact NZ-OD2 2.73Å; K119-D134 PolarHBondContact NZ-OD2 3.15Å
120	A	91.3	Very high	91	Very high	74 Å²	74	57.9 Å²	57.9	61%	0.612	32%	0.316	S	S	*	.	H	α-helix	trans	-64.6	-43.5	-180	0	0	0	0	0	111.8	T118 R123 Q124	T118-A120 VanDerWaalsContact C-N 3.28Å; T118-A120 PolarHBondContact O-N 2.8Å; A120-R123 PolarHBondContact O-N 3.09Å; A120-Q124 PolarHBondContact O-N 3.42Å
121	T	90.7	Very high	91.2	Very high	21 Å²	21	50.9 Å²	50.9	13%	0.129	29%	0.29	C	S	.	.	H	α-helix	trans	-62.3	-46.9	176.1	-48.3	0	0	0	0	111.1	F15 T118 R123 Q124 E125	F15-T121 WeakPolarHBondContact O-CG2 3.29Å; T118-T121 PolarHBondContact O-N 2.8Å; T118-T121 VanDerWaalsContact O-N 3.12Å; T121-R123 VanDerWaalsContact C-N 3.3Å; T121-R123 PolarHBondContact O-N 2.86Å; T121-Q124 WeakPolarHBondContact O-CB 3.3Å; T121-Q124 PolarHBondContact O-N 2.67Å; T121-Q124 VanDerWaalsContact O-N 3.09Å; T121-E125 HydrophobicContact CG2-CG 4.35Å; T121-E125 WeakPolarHBondContact O-CG 3.35Å; T121-E125 PolarHBondContact O-N 3.27Å
122	L	92.5	Very high	91.2	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-56.7	-45	175.7	171.9	62	0	0	0	111.9	F25 I38 L51 Y82 L99 T118 K119 Q124 E125 F126	F25-L122 HydrophobicContact CZ-CD1 3.7Å; I38-L122 HydrophobicContact CD1-CD1 3.51Å; I38-L122 HydrophobicContact CD1-CD2 4.15Å; I38-L122 HydrophobicContact CD1-CG 4.46Å; L51-L122 HydrophobicContact CD1-CB 4.06Å; L51-L122 HydrophobicContact CD1-CD1 4.32Å; Y82-L122 HydrophobicContact CD1-CD2 3.93Å; Y82-L122 HydrophobicContact CD2-CD2 3.47Å; Y82-L122 VanDerWaalsContact CD2-CD2 3.47Å; Y82-L122 HydrophobicContact CE1-CD2 4.44Å; Y82-L122 HydrophobicContact CE2-CD2 4.03Å; Y82-L122 HydrophobicContact CG-CD2 3.38Å; L99-L122 HydrophobicContact CD1-CD2 4.01Å; T118-L122 PolarHBondContact O-N 3.23Å; K119-L122 PolarHBondContact O-N 3.35Å; L122-Q124 VanDerWaalsContact C-N 3.27Å; L122-Q124 PolarHBondContact O-N 2.88Å; L122-E125 PolarHBondContact O-N 3.33Å; L122-F126 WeakPolarHBondContact O-CB 3.5Å; L122-F126 PolarHBondContact O-N 3.11Å
123	R	93.3	Very high	91.3	Very high	93 Å²	93	50 Å²	50	35%	0.351	29%	0.285	S	S	.	.	H	α-helix	trans	-60.7	-39.3	178.1	-171.7	-178.1	179.8	166.3	0.9	111.5	K119 A120 T121 G127 P128 I131	K119-R123 WeakPolarHBondContact O-CB 3.33Å; K119-R123 PolarHBondContact O-N 2.78Å; A120-R123 PolarHBondContact O-N 3.09Å; T121-R123 VanDerWaalsContact C-N 3.3Å; T121-R123 PolarHBondContact O-N 2.86Å; R123-G127 CarbonylContact O-C 3.6Å; R123-G127 PolarHBondContact O-N 3.48Å; R123-G127 VanDerWaalsContact O-N 3.12Å; R123-P128 HydrophobicContact CG-CB 4.25Å; R123-I131 HydrophobicContact CB-CD1 4.47Å; R123-I131 HydrophobicContact CG-CD1 3.81Å
124	Q	92	Very high	91.3	Very high	132 Å²	132	45.8 Å²	45.8	62%	0.617	27%	0.265	S	S	*	.	H	α-helix	trans	-69.5	-44.4	178.4	-171.8	62.7	23.2	0	0	112.2	A120 T121 L122 G127	A120-Q124 PolarHBondContact O-N 3.42Å; T121-Q124 WeakPolarHBondContact O-CB 3.3Å; T121-Q124 PolarHBondContact O-N 2.67Å; T121-Q124 VanDerWaalsContact O-N 3.09Å; L122-Q124 VanDerWaalsContact C-N 3.27Å; L122-Q124 PolarHBondContact O-N 2.88Å; Q124-G127 PolarHBondContact O-N 3.05Å
125	E	90.9	Very high	91.4	Very high	73 Å²	73	44.8 Å²	44.8	34%	0.341	26%	0.26	S	S	.	.	H	α-helix	trans	-65.9	-40.2	179.4	-69.6	-62.4	150	0	0	112.3	A17 F25 T121 L122	A17-E125 HydrophobicContact CB-CB 4.36Å; A17-E125 HydrophobicContact CB-CG 4.21Å; F25-E125 HydrophobicContact CE2-CB 3.99Å; T121-E125 HydrophobicContact CG2-CG 4.35Å; T121-E125 WeakPolarHBondContact O-CG 3.35Å; T121-E125 PolarHBondContact O-N 3.27Å; L122-E125 PolarHBondContact O-N 3.33Å
126	F	92.1	Very high	91.4	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-69.7	-42.5	176.7	-172.6	-107.4	0	0	0	111.8	F25 C28 K29 L84 W97 L122 C130 I131	F25-F126 HydrophobicContact CB-CD2 4.25Å; F25-F126 AromaticContact CD1-CD2 3.55Å; F25-F126 HydrophobicContact CD1-CD2 3.55Å; F25-F126 HydrophobicContact CD1-CE2 4.04Å; F25-F126 HydrophobicContact CD2-CD2 4.3Å; F25-F126 AromaticContact CE1-CD2 3.82Å; F25-F126 HydrophobicContact CE1-CD2 3.82Å; F25-F126 HydrophobicContact CE2-CB 4.38Å; F25-F126 AromaticContact CG-CD2 3.8Å; F25-F126 HydrophobicContact CG-CD2 3.8Å; F25-F126 HydrophobicContact CG-CE2 4.43Å; F25-F126 HydrophobicContact CZ-CB 4.4Å; F25-F126 HydrophobicContact CZ-CD2 4.32Å; C28-F126 HydrophobicContact CB-CE2 4.04Å; C28-F126 HydrophobicContact CB-CZ 4.43Å; K29-F126 WeakPolarHBondContact CE-O 3.11Å; K29-F126 PolarHBondContact NZ-O 2.83Å; L84-F126 HydrophobicContact CD1-CB 4.39Å; L84-F126 HydrophobicContact CD1-CD1 4.23Å; L84-F126 HydrophobicContact CD1-CD2 3.48Å; L84-F126 VanDerWaalsContact CD1-CD2 3.48Å; L84-F126 HydrophobicContact CD1-CE1 4.39Å; L84-F126 HydrophobicContact CD1-CE2 3.69Å; L84-F126 HydrophobicContact CD1-CG 3.77Å; L84-F126 HydrophobicContact CD1-CZ 4.13Å; L84-F126 HydrophobicContact CD2-CD1 4.29Å; L84-F126 HydrophobicContact CD2-CE1 4.37Å; W97-F126 HydrophobicContact CB-CE1 3.99Å; W97-F126 AromaticContact CD1-CE1 3.83Å; W97-F126 AromaticContact CD1-CZ 3.95Å; W97-F126 AromaticContact CD2-CE1 3.98Å; W97-F126 HydrophobicContact CD2-CE1 3.98Å; W97-F126 AromaticContact CD2-CZ 3.6Å; W97-F126 HydrophobicContact CD2-CZ 3.6Å; W97-F126 AromaticContact CE2-CZ 3.74Å; W97-F126 HydrophobicContact CE3-CZ 4.06Å; W97-F126 AromaticContact CG-CE1 3.64Å; W97-F126 HydrophobicContact CG-CE1 3.64Å; W97-F126 AromaticContact CG-CZ 3.78Å; W97-F126 HydrophobicContact CG-CZ 3.78Å; W97-F126 HydrophobicContact CZ2-CZ 4.32Å; W97-F126 AromaticContact NE1-CZ 3.93Å; L122-F126 WeakPolarHBondContact O-CB 3.5Å; L122-F126 PolarHBondContact O-N 3.11Å; F126-C130 HydrophobicContact CE1-CB 4.2Å; F126-I131 HydrophobicContact CD1-CD1 3.82Å; F126-I131 HydrophobicContact CD1-CG1 3.82Å; F126-I131 HydrophobicContact CE1-CG1 4.2Å
127	G	91	Very high	91.4	Very high	16 Å²	16	46.6 Å²	46.6	17%	0.165	26%	0.256	C	S	.	.			trans	119.8	105.7	-176.7	0	0	0	0	0	110.8	R123 Q124 G129 C130	R123-G127 CarbonylContact O-C 3.6Å; R123-G127 PolarHBondContact O-N 3.48Å; R123-G127 VanDerWaalsContact O-N 3.12Å; Q124-G127 PolarHBondContact O-N 3.05Å; G127-G129 PolarHBondContact O-N 3.11Å; G127-G129 VanDerWaalsContact O-N 3.16Å; G127-C130 PolarHBondContact O-N 2.88Å
128	P	90.6	Very high	91.5	Very high	55 Å²	55	44.8 Å²	44.8	36%	0.357	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-65.1	-24.4	-172.5	24.3	-33.8	0	0	0	113.4	R123 C130 I131	R123-P128 HydrophobicContact CG-CB 4.25Å; P128-C130 VanDerWaalsContact C-N 3.3Å; P128-C130 PolarHBondContact O-N 3.09Å; P128-I131 PolarHBondContact O-N 3.37Å
129	G	90	Very high	91.3	Very high	51 Å²	51	50.6 Å²	50.6	53%	0.526	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-69.9	-21.5	179.2	0	0	0	0	0	114.6	G127	G127-G129 PolarHBondContact O-N 3.11Å; G127-G129 VanDerWaalsContact O-N 3.16Å
130	C	91	Very high	90.9	Very high	8 Å²	8	51.1 Å²	51.1	5%	0.054	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-87.3	-18	177.4	-52.2	0	0	0	0	112.4	E96 W97 F126 G127 P128 R132	E96-C130 CarbonylContact C-O 3.54Å; W97-C130 PolarHBondContact N-O 2.59Å; F126-C130 HydrophobicContact CE1-CB 4.2Å; G127-C130 PolarHBondContact O-N 2.88Å; P128-C130 VanDerWaalsContact C-N 3.3Å; P128-C130 PolarHBondContact O-N 3.09Å; C130-R132 PolarHBondContact O-N 2.86Å
131	I	92.6	Very high	90.5	Very high	9 Å²	9	54.1 Å²	54.1	5%	0.046	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	106.9	-175.4	-62.5	165.4	0	0	0	109.1	L84 W97 L99 R123 F126 P128	L84-I131 HydrophobicContact CD2-CD1 4.38Å; W97-I131 HydrophobicContact CB-CG1 4.38Å; W97-I131 CarbonylContact O-C 3.54Å; W97-I131 WeakPolarHBondContact O-CA 3.02Å; L99-I131 HydrophobicContact CB-CG2 3.97Å; L99-I131 HydrophobicContact CD2-CD1 4.48Å; R123-I131 HydrophobicContact CB-CD1 4.47Å; R123-I131 HydrophobicContact CG-CD1 3.81Å; F126-I131 HydrophobicContact CD1-CD1 3.82Å; F126-I131 HydrophobicContact CD1-CG1 3.82Å; F126-I131 HydrophobicContact CE1-CG1 4.2Å; P128-I131 PolarHBondContact O-N 3.37Å
132	R	90.5	Very high	90.2	Very high	109 Å²	109	56.4 Å²	56.4	41%	0.411	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	-49.7	-179.5	-173	-169.7	177	130.8	-3.2	111.4	E96 W97 C130	E96-R132 HydrophobicContact CB-CB 4.33Å; E96-R132 IonicContact OE1-NH1 2.59Å; E96-R132 PolarHBondContact OE1-NH1 2.93Å; E96-R132 WeakPolarHBondContact OE2-CD 3.42Å; E96-R132 IonicContact OE2-CZ 2.75Å; E96-R132 IonicContact OE2-NE 3.17Å; E96-R132 IonicContact OE2-NH1 2.96Å; E96-R132 PolarHBondContact OE2-NH1 3.43Å; W97-R132 PolarHBondContact O-N 2.93Å; C130-R132 PolarHBondContact O-N 2.86Å
133	H	91.2	Very high	89.7	Confident	32 Å²	32	56.4 Å²	56.4	15%	0.148	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	143.1	-179.7	-59.2	-54	0	0	0	111.1	L98 L99 F135 K155	L98-H133 WeakPolarHBondContact CA-O 3.34Å; L98-H133 HydrophobicContact CD2-CB 3.93Å; L99-H133 PolarHBondContact N-O 3.19Å; L99-H133 VanDerWaalsContact N-O 3.08Å; H133-F135 HydrophobicContact CB-CE1 4.32Å; H133-F135 HydrophobicContact CB-CE2 3.75Å; H133-F135 HydrophobicContact CB-CZ 3.63Å; H133-K155 HydrophobicContact CB-CD 3.91Å; H133-K155 VanDerWaalsContact ND1-CD 3.31Å; H133-K155 WeakPolarHBondContact ND1-CD 3.38Å
134	D	92.1	Very high	89.2	Confident	45 Å²	45	56.3 Å²	56.3	24%	0.241	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	139	168.9	67.9	-41.7	0	0	0	110.4	L99 K119 K155	L99-D134 HydrophobicContact CB-CB 4.3Å; L99-D134 HydrophobicContact CD2-CB 4.5Å; L99-D134 CarbonylContact O-C 3.59Å; L99-D134 VanDerWaalsContact O-CA 3.3Å; L99-D134 WeakPolarHBondContact O-CA 3.37Å; K119-D134 WeakPolarHBondContact CE-OD2 3.02Å; K119-D134 IonicContact NZ-OD2 2.73Å; K119-D134 PolarHBondContact NZ-OD2 3.15Å; D134-K155 PolarHBondContact O-NZ 3.36Å; D134-K155 IonicContact OD1-NZ 2.76Å
135	F	92	Very high	88.8	Confident	10 Å²	10	51 Å²	51	4%	0.044	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	137.5	-179.9	-59.8	-67.4	0	0	0	109.4	L98 L99 F100 S101 H133 L151 L152 K155	L98-F135 HydrophobicContact CD1-CE2 4.4Å; L98-F135 HydrophobicContact CD2-CE2 4.09Å; L99-F135 PolarHBondContact O-N 2.79Å; F100-F135 WeakPolarHBondContact CA-O 3.31Å; F100-F135 HydrophobicContact CD1-CB 3.73Å; F100-F135 HydrophobicContact CD1-CD2 4.01Å; F100-F135 HydrophobicContact CD1-CG 4.33Å; F100-F135 HydrophobicContact CE1-CB 3.91Å; F100-F135 AromaticContact CE1-CD2 3.41Å; F100-F135 HydrophobicContact CE1-CD2 3.41Å; F100-F135 VanDerWaalsContact CE1-CD2 3.41Å; F100-F135 HydrophobicContact CE1-CE2 4.28Å; F100-F135 HydrophobicContact CE1-CG 4.01Å; F100-F135 AromaticContact CZ-CD2 3.95Å; F100-F135 HydrophobicContact CZ-CD2 3.95Å; F100-F135 HydrophobicContact CZ-CE2 4.49Å; S101-F135 PolarHBondContact N-O 3.45Å; H133-F135 HydrophobicContact CB-CE1 4.32Å; H133-F135 HydrophobicContact CB-CE2 3.75Å; H133-F135 HydrophobicContact CB-CZ 3.63Å; F135-L151 HydrophobicContact CD1-CB 4.18Å; F135-L151 HydrophobicContact CD1-CD1 3.79Å; F135-L151 HydrophobicContact CD1-CD2 4.29Å; F135-L151 HydrophobicContact CD1-CG 4.33Å; F135-L151 HydrophobicContact CE1-CB 3.57Å; F135-L151 HydrophobicContact CE1-CD1 4.07Å; F135-L151 HydrophobicContact CE1-CD2 4.22Å; F135-L151 HydrophobicContact CE1-CG 4.17Å; F135-L151 HydrophobicContact CG-CD1 4.1Å; F135-L151 HydrophobicContact CZ-CB 3.75Å; F135-L152 HydrophobicContact CZ-CD2 4.45Å; F135-K155 HydrophobicContact CE1-CD 3.78Å; F135-K155 HydrophobicContact CE1-CG 4.37Å; F135-K155 HydrophobicContact CZ-CD 4.13Å
136	H	92.5	Very high	88.6	Confident	119 Å²	119	50.7 Å²	50.7	55%	0.551	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.8	126.9	172.1	-176.5	70.9	0	0	0	108.2	S101	S101-H136 PolarHBondContact O-ND1 2.93Å
137	I	90.6	Very high	88.1	Confident	6 Å²	6	52.6 Å²	52.6	3%	0.031	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	130.1	-175.3	-63.2	-174.8	0	0	0	108.5	F100 S101 F102 V103 K139 D142 M143	F100-I137 HydrophobicContact CB-CD1 4.34Å; F100-I137 HydrophobicContact CD1-CD1 3.39Å; F100-I137 HydrophobicContact CD1-CG1 4.21Å; F100-I137 HydrophobicContact CE1-CD1 4.04Å; F100-I137 HydrophobicContact CG-CD1 4.19Å; S101-I137 PolarHBondContact O-N 2.85Å; F102-I137 CarbonylContact C-O 3.53Å; F102-I137 VanDerWaalsContact CA-O 3.31Å; F102-I137 WeakPolarHBondContact CA-O 3.19Å; F102-I137 HydrophobicContact CD2-CB 4.39Å; F102-I137 HydrophobicContact CD2-CG2 3.93Å; V103-I137 PolarHBondContact N-O 2.96Å; I137-K139 WeakPolarHBondContact CG2-O 3.49Å; I137-D142 HydrophobicContact CG2-CB 3.93Å; I137-M143 HydrophobicContact CD1-CB 3.91Å; I137-M143 HydrophobicContact CD1-CG 3.74Å; I137-M143 HydrophobicContact CD1-SD 4.34Å; I137-M143 HydrophobicContact CG2-CB 4.45Å
138	T	90.7	Very high	87.8	Confident	39 Å²	39	51.9 Å²	51.9	24%	0.239	28%	0.281	C	S	.	.			trans	-108.2	-35.6	179.6	-49.8	0	0	0	0	111.7	P104 D105	P104-T138 WeakPolarHBondContact CA-O 3.26Å; D105-T138 HydrophobicContact CB-CG2 4.24Å; D105-T138 VanDerWaalsContact OD2-CG2 3.24Å; D105-T138 WeakPolarHBondContact OD2-CG2 3.08Å
139	K	86.8	Confident	87.6	Confident	122 Å²	122	53.5 Å²	53.5	53%	0.53	28%	0.284	S	S	.	.	S	Bend	trans	-104.2	140.6	178.8	-60.3	179.2	-179.7	179.4	0	110.6	I137 E141 D142	I137-K139 WeakPolarHBondContact CG2-O 3.49Å; K139-E141 PolarHBondContact O-N 3.32Å; K139-D142 PolarHBondContact O-N 2.98Å; K139-D142 VanDerWaalsContact O-N 3.16Å
140	P	84.5	Confident	87.4	Confident	58 Å²	58	57.1 Å²	57.1	38%	0.377	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-63.3	-28.9	177.6	25.9	-33.8	0	0	0	112.4	L75 F102 D142 M143	L75-P140 HydrophobicContact CD1-CB 4.05Å; F102-P140 HydrophobicContact CE2-CB 4.47Å; P140-D142 PolarHBondContact O-N 3.39Å; P140-M143 PolarHBondContact O-N 3.21Å; P140-M143 VanDerWaalsContact O-N 3.1Å
141	E	83.9	Confident	87.1	Confident	138 Å²	138	58.8 Å²	58.8	65%	0.645	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-61.8	-29.4	176.5	-62.8	172.8	-165.8	0	0	113	K139 M143 Q144	K139-E141 PolarHBondContact O-N 3.32Å; E141-M143 PolarHBondContact O-N 3.44Å; E141-Q144 VanDerWaalsContact O-CG 3.29Å; E141-Q144 WeakPolarHBondContact O-CG 3.32Å
142	D	83.6	Confident	86.7	Confident	69 Å²	69	59.7 Å²	59.7	37%	0.369	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-76	-11.9	178.9	-63.4	-31.7	0	0	0	111.8	I137 K139 P140 Q144 T147	I137-D142 HydrophobicContact CG2-CB 3.93Å; K139-D142 PolarHBondContact O-N 2.98Å; K139-D142 VanDerWaalsContact O-N 3.16Å; P140-D142 PolarHBondContact O-N 3.39Å; D142-Q144 VanDerWaalsContact C-N 3.27Å; D142-Q144 PolarHBondContact O-N 2.8Å; D142-T147 WeakPolarHBondContact O-CB 3.36Å; D142-T147 WeakPolarHBondContact O-CG2 3.13Å; D142-T147 PolarHBondContact O-OG1 2.87Å
143	M	82.9	Confident	86.4	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.005	31%	0.309	C	S	.	.	S	Bend	trans	-92.9	49.6	177.2	-152.4	171.8	86.2	0	0	112.6	L71 S74 L75 F100 I137 P140 E141	L71-M143 HydrophobicContact CB-CE 3.92Å; L71-M143 HydrophobicContact CD2-CE 3.98Å; L71-M143 HydrophobicContact CD2-CG 4.34Å; L71-M143 HydrophobicContact CD2-SD 4.48Å; L71-M143 WeakPolarHBondContact O-CE 3.34Å; S74-M143 WeakPolarHBondContact OG-CE 3.43Å; L75-M143 HydrophobicContact CD1-CB 3.7Å; L75-M143 HydrophobicContact CD1-CE 3.41Å; L75-M143 VanDerWaalsContact CD1-CE 3.41Å; L75-M143 HydrophobicContact CD1-CG 4.25Å; L75-M143 HydrophobicContact CD1-SD 3.69Å; L75-M143 HydrophobicContact CD2-CE 3.47Å; L75-M143 VanDerWaalsContact CD2-CE 3.47Å; L75-M143 HydrophobicContact CD2-SD 3.75Å; L75-M143 HydrophobicContact CG-CE 3.2Å; L75-M143 HydrophobicContact CG-SD 3.92Å; F100-M143 HydrophobicContact CB-SD 4.43Å; I137-M143 HydrophobicContact CD1-CB 3.91Å; I137-M143 HydrophobicContact CD1-CG 3.74Å; I137-M143 HydrophobicContact CD1-SD 4.34Å; I137-M143 HydrophobicContact CG2-CB 4.45Å; P140-M143 PolarHBondContact O-N 3.21Å; P140-M143 VanDerWaalsContact O-N 3.1Å; E141-M143 PolarHBondContact O-N 3.44Å
144	Q	82.7	Confident	86	Confident	90 Å²	90	63 Å²	63	42%	0.421	32%	0.319	S	S	.	.	S	Bend	trans	-112.7	158.5	176.5	-68.7	-178.8	-5.3	0	0	111.3	E141 D142 A146 T147 M148	E141-Q144 VanDerWaalsContact O-CG 3.29Å; E141-Q144 WeakPolarHBondContact O-CG 3.32Å; D142-Q144 VanDerWaalsContact C-N 3.27Å; D142-Q144 PolarHBondContact O-N 2.8Å; Q144-A146 VanDerWaalsContact C-N 3.3Å; Q144-A146 PolarHBondContact O-N 3.33Å; Q144-T147 PolarHBondContact O-N 3.22Å; Q144-T147 VanDerWaalsContact O-N 3.16Å; Q144-M148 PolarHBondContact O-N 3.32Å
145	L	83.8	Confident	85.4	Confident	21 Å²	21	64 Å²	64	11%	0.11	32%	0.321	C	S	.	.	H	α-helix	trans	-54.1	-45.4	178.9	177.2	70.5	0	0	0	112.3	W63 S64 A67 K68 T147 M148 E149	W63-L145 HydrophobicContact CE3-CD1 4.37Å; W63-L145 HydrophobicContact CH2-CD1 3.98Å; W63-L145 HydrophobicContact CZ3-CD1 3.61Å; S64-L145 VanDerWaalsContact OG-CD2 3.22Å; S64-L145 WeakPolarHBondContact OG-CD2 3.48Å; A67-L145 HydrophobicContact CB-CD1 3.96Å; K68-L145 HydrophobicContact CD-CD2 4.13Å; K68-L145 HydrophobicContact CG-CB 4.29Å; K68-L145 HydrophobicContact CG-CD2 3.8Å; L145-T147 VanDerWaalsContact C-N 3.27Å; L145-T147 PolarHBondContact O-N 3.17Å; L145-M148 WeakPolarHBondContact O-CB 3.1Å; L145-M148 PolarHBondContact O-N 2.99Å; L145-M148 VanDerWaalsContact O-N 3.11Å; L145-E149 HydrophobicContact CD1-CG 4.25Å; L145-E149 HydrophobicContact CG-CG 4.37Å; L145-E149 PolarHBondContact O-N 3.03Å
146	A	85	Confident	84.6	Confident	67 Å²	67	67.1 Å²	67.1	55%	0.554	34%	0.344	S	S	*	.	H	α-helix	trans	-59.4	-40.1	-178.5	0	0	0	0	0	111.9	Q144 K150	Q144-A146 VanDerWaalsContact C-N 3.3Å; Q144-A146 PolarHBondContact O-N 3.33Å; A146-K150 WeakPolarHBondContact O-CB 3.48Å; A146-K150 PolarHBondContact O-N 3.18Å; A146-K150 VanDerWaalsContact O-N 3.13Å
147	T	83.2	Confident	83.5	Confident	40 Å²	40	65 Å²	65	25%	0.245	34%	0.343	C	S	.	.	H	α-helix	trans	-68.2	-41.3	176.5	-47.8	0	0	0	0	111.1	D142 Q144 L145 K150 L151	D142-T147 WeakPolarHBondContact O-CB 3.36Å; D142-T147 WeakPolarHBondContact O-CG2 3.13Å; D142-T147 PolarHBondContact O-OG1 2.87Å; Q144-T147 PolarHBondContact O-N 3.22Å; Q144-T147 VanDerWaalsContact O-N 3.16Å; L145-T147 VanDerWaalsContact C-N 3.27Å; L145-T147 PolarHBondContact O-N 3.17Å; T147-K150 PolarHBondContact O-N 3.22Å; T147-L151 HydrophobicContact CG2-CD1 4Å; T147-L151 HydrophobicContact CG2-CG 4.36Å; T147-L151 WeakPolarHBondContact O-CB 3.33Å; T147-L151 WeakPolarHBondContact O-CG 3.22Å; T147-L151 PolarHBondContact O-N 2.75Å
148	M	83.7	Confident	81.9	Confident	1 Å²	1	70.3 Å²	70.3	1%	0.005	37%	0.367	C	S	.	.	H	α-helix	trans	-61.2	-46.9	175.7	-72.1	177.4	63.6	0	0	112.6	W63 L71 F85 L98 F100 Q144 L145 K150 L151 L152	W63-M148 HydrophobicContact CE3-CE 4.48Å; W63-M148 HydrophobicContact CZ3-CE 4.1Å; L71-M148 HydrophobicContact CD1-CE 4.35Å; L71-M148 HydrophobicContact CD1-SD 3.18Å; L71-M148 WeakPolarHBondContact CD1-SD 3.48Å; L71-M148 HydrophobicContact CD2-SD 4.41Å; L71-M148 HydrophobicContact CG-SD 4.42Å; F85-M148 HydrophobicContact CD1-CE 3.73Å; F85-M148 HydrophobicContact CE1-CE 3.94Å; F85-M148 HydrophobicContact CG-CE 4.35Å; L98-M148 HydrophobicContact CD1-CE 3.58Å; F100-M148 HydrophobicContact CE1-CG 4.05Å; F100-M148 HydrophobicContact CE2-CE 3.85Å; F100-M148 HydrophobicContact CE2-SD 4.16Å; F100-M148 HydrophobicContact CZ-CE 3.59Å; F100-M148 HydrophobicContact CZ-CG 3.65Å; F100-M148 HydrophobicContact CZ-SD 3.72Å; Q144-M148 PolarHBondContact O-N 3.32Å; L145-M148 WeakPolarHBondContact O-CB 3.1Å; L145-M148 PolarHBondContact O-N 2.99Å; L145-M148 VanDerWaalsContact O-N 3.11Å; M148-K150 VanDerWaalsContact C-N 3.34Å; M148-K150 PolarHBondContact O-N 3.23Å; M148-L151 PolarHBondContact O-N 3.37Å; M148-L152 WeakPolarHBondContact O-CB 3.31Å; M148-L152 VanDerWaalsContact O-CG 3.27Å; M148-L152 WeakPolarHBondContact O-CG 3.24Å; M148-L152 PolarHBondContact O-N 2.98Å
149	E	86.2	Confident	80.1	Confident	89 Å²	89	74.6 Å²	74.6	42%	0.416	39%	0.393	S	S	.	.	H	α-helix	trans	-59.8	-45.5	178.5	-73.8	175.8	167.5	0	0	111.1	W63 L145 L151 L152 Q153	W63-E149 HydrophobicContact CH2-CG 3.91Å; L145-E149 HydrophobicContact CD1-CG 4.25Å; L145-E149 HydrophobicContact CG-CG 4.37Å; L145-E149 PolarHBondContact O-N 3.03Å; E149-L151 PolarHBondContact O-N 2.53Å; E149-L152 PolarHBondContact O-N 3.29Å; E149-Q153 WeakPolarHBondContact O-CB 3.24Å; E149-Q153 PolarHBondContact O-N 3.08Å
150	K	86.4	Confident	78.5	Confident	126 Å²	126	74.8 Å²	74.8	55%	0.548	40%	0.399	S	S	.	.	H	α-helix	trans	-59.7	-47.2	175.3	-173.8	-177.6	177.9	-168.5	0	112.1	A146 T147 M148 L152 Q153 E154	A146-K150 WeakPolarHBondContact O-CB 3.48Å; A146-K150 PolarHBondContact O-N 3.18Å; A146-K150 VanDerWaalsContact O-N 3.13Å; T147-K150 PolarHBondContact O-N 3.22Å; M148-K150 VanDerWaalsContact C-N 3.34Å; M148-K150 PolarHBondContact O-N 3.23Å; K150-L152 PolarHBondContact O-N 3.33Å; K150-Q153 PolarHBondContact O-N 3.25Å; K150-E154 WeakPolarHBondContact CE-OE1 3.39Å; K150-E154 IonicContact NZ-OE1 2.81Å; K150-E154 WeakPolarHBondContact O-CG 3.17Å; K150-E154 PolarHBondContact O-N 3.47Å
151	L	83.8	Confident	77	Confident	43 Å²	43	75.1 Å²	75.1	23%	0.225	40%	0.4	C	S	.	.	H	α-helix	trans	-65.4	-37.1	-179.6	-75.7	173.1	0	0	0	112.9	F135 T147 M148 E149 K155	F135-L151 HydrophobicContact CD1-CB 4.18Å; F135-L151 HydrophobicContact CD1-CD1 3.79Å; F135-L151 HydrophobicContact CD1-CD2 4.29Å; F135-L151 HydrophobicContact CD1-CG 4.33Å; F135-L151 HydrophobicContact CE1-CB 3.57Å; F135-L151 HydrophobicContact CE1-CD1 4.07Å; F135-L151 HydrophobicContact CE1-CD2 4.22Å; F135-L151 HydrophobicContact CE1-CG 4.17Å; F135-L151 HydrophobicContact CG-CD1 4.1Å; F135-L151 HydrophobicContact CZ-CB 3.75Å; T147-L151 HydrophobicContact CG2-CD1 4Å; T147-L151 HydrophobicContact CG2-CG 4.36Å; T147-L151 WeakPolarHBondContact O-CB 3.33Å; T147-L151 WeakPolarHBondContact O-CG 3.22Å; T147-L151 PolarHBondContact O-N 2.75Å; M148-L151 PolarHBondContact O-N 3.37Å; E149-L151 PolarHBondContact O-N 2.53Å; L151-K155 PolarHBondContact O-N 3.24Å
152	L	84.9	Confident	75.5	Confident	29 Å²	29	72.4 Å²	72.4	15%	0.152	39%	0.394	C	S	.	.	H	α-helix	trans	-65.1	-41.9	173.3	-72.3	175.3	0	0	0	111.3	W63 L98 F135 M148 E149 K150 S156	W63-L152 HydrophobicContact CH2-CD1 4.12Å; L98-L152 HydrophobicContact CD1-CD1 4.41Å; L98-L152 HydrophobicContact CD1-CD2 4.22Å; L98-L152 HydrophobicContact CD2-CD2 3.97Å; F135-L152 HydrophobicContact CZ-CD2 4.45Å; M148-L152 WeakPolarHBondContact O-CB 3.31Å; M148-L152 VanDerWaalsContact O-CG 3.27Å; M148-L152 WeakPolarHBondContact O-CG 3.24Å; M148-L152 PolarHBondContact O-N 2.98Å; E149-L152 PolarHBondContact O-N 3.29Å; K150-L152 PolarHBondContact O-N 3.33Å; L152-S156 WeakPolarHBondContact O-CB 3.33Å; L152-S156 PolarHBondContact O-N 3.21Å; L152-S156 PolarHBondContact O-OG 3.11Å
153	Q	84.3	Confident	74.2	Confident	134 Å²	134	73.1 Å²	73.1	63%	0.626	41%	0.405	S	S	*	.	H	α-helix	trans	-64.3	-48.5	176.6	-169.3	174.3	6.1	0	0	111.1	E149 K150 K155 S156 S157	E149-Q153 WeakPolarHBondContact O-CB 3.24Å; E149-Q153 PolarHBondContact O-N 3.08Å; K150-Q153 PolarHBondContact O-N 3.25Å; Q153-K155 PolarHBondContact O-N 3.16Å; Q153-S156 WeakPolarHBondContact CA-OG 3.15Å; Q153-S156 PolarHBondContact O-N 3.2Å; Q153-S156 VanDerWaalsContact O-N 3.15Å; Q153-S156 PolarHBondContact O-OG 3.37Å; Q153-S157 PolarHBondContact O-N 2.84Å; Q153-S157 PolarHBondContact O-OG 2.86Å
154	E	81.9	Confident	73	Confident	77 Å²	77	76.6 Å²	76.6	36%	0.36	43%	0.433	S	S	.	.	H	α-helix	trans	-56.9	-49.2	177	-75	176.2	-179	0	0	111.9	K150 S156 S157 Q158	K150-E154 WeakPolarHBondContact CE-OE1 3.39Å; K150-E154 IonicContact NZ-OE1 2.81Å; K150-E154 WeakPolarHBondContact O-CG 3.17Å; K150-E154 PolarHBondContact O-N 3.47Å; E154-S156 VanDerWaalsContact C-N 3.3Å; E154-S156 PolarHBondContact O-N 3.34Å; E154-S157 PolarHBondContact O-N 3.32Å; E154-S157 VanDerWaalsContact O-N 3.16Å; E154-Q158 WeakPolarHBondContact O-CB 3.37Å; E154-Q158 WeakPolarHBondContact O-CG 3.41Å; E154-Q158 PolarHBondContact O-N 3.48Å
155	K	80.4	Confident	71.8	Confident	65 Å²	65	76.6 Å²	76.6	28%	0.283	44%	0.436	S	S	.	.	H	α-helix	trans	-67.4	-28.8	178.4	-77.1	-163.4	174.5	-177.8	0	113.3	H133 D134 F135 L151 Q153	H133-K155 HydrophobicContact CB-CD 3.91Å; H133-K155 VanDerWaalsContact ND1-CD 3.31Å; H133-K155 WeakPolarHBondContact ND1-CD 3.38Å; D134-K155 PolarHBondContact O-NZ 3.36Å; D134-K155 IonicContact OD1-NZ 2.76Å; F135-K155 HydrophobicContact CE1-CD 3.78Å; F135-K155 HydrophobicContact CE1-CG 4.37Å; F135-K155 HydrophobicContact CZ-CD 4.13Å; L151-K155 PolarHBondContact O-N 3.24Å; Q153-K155 PolarHBondContact O-N 3.16Å
156	S	75.1	Confident	70.2	Confident	75 Å²	75	78.9 Å²	78.9	52%	0.524	45%	0.447	S	S	.	.	H	α-helix	trans	-72.9	-28.8	173.4	74.3	0	0	0	0	113	L152 Q153 E154	L152-S156 WeakPolarHBondContact O-CB 3.33Å; L152-S156 PolarHBondContact O-N 3.21Å; L152-S156 PolarHBondContact O-OG 3.11Å; Q153-S156 WeakPolarHBondContact CA-OG 3.15Å; Q153-S156 PolarHBondContact O-N 3.2Å; Q153-S156 VanDerWaalsContact O-N 3.15Å; Q153-S156 PolarHBondContact O-OG 3.37Å; E154-S156 VanDerWaalsContact C-N 3.3Å; E154-S156 PolarHBondContact O-N 3.34Å
157	S	68.8	Low	68.9	Low	76 Å²	76	80.8 Å²	80.8	53%	0.531	45%	0.448	S	S	.	.	H	α-helix	trans	-92.9	-10.7	179.1	-58.7	0	0	0	0	114	Q153 E154 T159	Q153-S157 PolarHBondContact O-N 2.84Å; Q153-S157 PolarHBondContact O-OG 2.86Å; E154-S157 PolarHBondContact O-N 3.32Å; E154-S157 VanDerWaalsContact O-N 3.16Å; S157-T159 PolarHBondContact O-N 3.44Å
158	Q	57.9	Low	67.7	Low	117 Å²	117	85 Å²	85	55%	0.547	47%	0.469	S	S	.	.			trans	-72.8	54	-179.8	-84.9	170.8	16.4	0	0	113.4	E154 I160	E154-Q158 WeakPolarHBondContact O-CB 3.37Å; E154-Q158 WeakPolarHBondContact O-CG 3.41Å; E154-Q158 PolarHBondContact O-N 3.48Å; Q158-I160 HydrophobicContact CG-CD1 4.26Å
159	T	52.4	Low	66.5	Low	128 Å²	128	89.6 Å²	89.6	79%	0.785	49%	0.493	S	S	*	.			trans	-90.3	53.9	140.6	-48	0	0	0	0	107.2	S157 V161	S157-T159 PolarHBondContact O-N 3.44Å; T159-V161 PolarHBondContact O-N 2.73Å
160	I	53.2	Low	65.3	Low	126 Å²	126	89.6 Å²	89.6	65%	0.646	49%	0.493	S	S	*	.			trans	-91.8	87.4	174.6	-58.9	171.6	0	0	0	106.1	Q158	Q158-I160 HydrophobicContact CG-CD1 4.26Å
161	V	53.6	Low	64.4	Low	65 Å²	65	88.3 Å²	88.3	39%	0.394	49%	0.492	S	S	.	.			trans	-59.8	126.6	156.8	-155	0	0	0	0	105.4	T159 S163 N165 M166	T159-V161 PolarHBondContact O-N 2.73Å; V161-S163 PolarHBondContact O-N 2.91Å; V161-S163 VanDerWaalsContact O-N 3.09Å; V161-N165 HydrophobicContact CG1-CB 4.13Å; V161-M166 HydrophobicContact CB-CG 3.92Å; V161-M166 HydrophobicContact CB-SD 4.19Å; V161-M166 HydrophobicContact CG1-CG 4.36Å; V161-M166 HydrophobicContact CG2-CG 4.35Å; V161-M166 HydrophobicContact CG2-SD 3.99Å
162	P	52.6	Low	63.6	Low	82 Å²	82	89.8 Å²	89.8	53%	0.532	50%	0.504	S	S	.	.			trans	-50.5	124.2	174.8	-24.8	33	0	0	0	108.7	A164 N165	P162-A164 PolarHBondContact O-N 3.49Å; P162-N165 PolarHBondContact O-N 3.43Å
163	S	55.8	Low	62.7	Low	84 Å²	84	93.8 Å²	93.8	59%	0.587	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-49.7	-28.9	-171.6	160.2	0	0	0	0	113.5	V161 N165 M166	V161-S163 PolarHBondContact O-N 2.91Å; V161-S163 VanDerWaalsContact O-N 3.09Å; S163-N165 PolarHBondContact O-N 3.14Å; S163-N165 VanDerWaalsContact O-N 3.12Å; S163-M166 PolarHBondContact O-N 3.09Å; S163-M166 VanDerWaalsContact O-N 3.16Å
164	A	57.6	Low	62.1	Low	73 Å²	73	90.8 Å²	90.8	60%	0.603	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-57.9	-23.8	174.2	0	0	0	0	0	115	P162	P162-A164 PolarHBondContact O-N 3.49Å
165	N	56.3	Low	61.5	Low	90 Å²	90	91.3 Å²	91.3	48%	0.481	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-96.6	-15.3	179.7	-69	-12.6	0	0	0	113.7	V161 P162 S163	V161-N165 HydrophobicContact CG1-CB 4.13Å; P162-N165 PolarHBondContact O-N 3.43Å; S163-N165 PolarHBondContact O-N 3.14Å; S163-N165 VanDerWaalsContact O-N 3.12Å
166	M	52.3	Low	61	Low	69 Å²	69	94.6 Å²	94.6	34%	0.34	53%	0.531	S	S	.	.	H	α-helix	trans	-79.4	-45.1	-179	-78.1	-73.2	-74.8	0	0	111.3	V161 S163 N168 L169 H170	V161-M166 HydrophobicContact CB-CG 3.92Å; V161-M166 HydrophobicContact CB-SD 4.19Å; V161-M166 HydrophobicContact CG1-CG 4.36Å; V161-M166 HydrophobicContact CG2-CG 4.35Å; V161-M166 HydrophobicContact CG2-SD 3.99Å; S163-M166 PolarHBondContact O-N 3.09Å; S163-M166 VanDerWaalsContact O-N 3.16Å; M166-N168 PolarHBondContact O-N 2.85Å; M166-L169 PolarHBondContact O-N 3.31Å; M166-H170 WeakPolarHBondContact O-CB 3.38Å; M166-H170 PolarHBondContact O-N 3.4Å
167	D	56	Low	60.6	Low	108 Å²	108	97.2 Å²	97.2	58%	0.578	54%	0.535	S	S	*	.	H	α-helix	trans	-66.3	-24.7	-171.9	-61.3	-16	0	0	0	113.1
168	N	58.1	Low	60.6	Low	127 Å²	127	99.5 Å²	99.5	68%	0.679	54%	0.537	S	S	*	.	H	α-helix	trans	-97.2	-18.6	-179.3	-68	-51.1	0	0	0	114.5	M166 P172	M166-N168 PolarHBondContact O-N 2.85Å; N168-P172 WeakPolarHBondContact O-CD 3.2Å; N168-P172 WeakPolarHBondContact O-CG 3.38Å
169	L	59.7	Low	60.9	Low	99 Å²	99	97.1 Å²	97.1	52%	0.518	53%	0.533	S	S	.	.	H	α-helix	trans	-109.4	-32.8	-173.8	-72.2	168.1	0	0	0	113.3	M166 P172 E173	M166-L169 PolarHBondContact O-N 3.31Å; L169-P172 WeakPolarHBondContact O-CD 3.3Å; L169-P172 WeakPolarHBondContact O-CG 3.39Å; L169-E173 WeakPolarHBondContact O-CG 3.36Å; L169-E173 PolarHBondContact O-N 3.38Å
170	H	60.8	Low	61.5	Low	88 Å²	88	94.8 Å²	94.8	41%	0.407	52%	0.522	S	S	.	.	H	α-helix	trans	-69.9	-40.2	-179.1	-114.8	52.2	0	0	0	112.4	M166 E173 I174	M166-H170 WeakPolarHBondContact O-CB 3.38Å; M166-H170 PolarHBondContact O-N 3.4Å; H170-E173 PolarHBondContact O-N 3.33Å; H170-I174 HydrophobicContact CB-CD1 4.33Å; H170-I174 VanDerWaalsContact O-CB 3.3Å; H170-I174 WeakPolarHBondContact O-CB 3.34Å; H170-I174 WeakPolarHBondContact O-CG1 3.36Å; H170-I174 PolarHBondContact O-N 3.45Å
171	D	66.8	Low	62.1	Low	100 Å²	100	94.3 Å²	94.3	54%	0.535	53%	0.525	S	S	.	.	H	α-helix	trans	-62.1	-48.8	-178.6	-72.7	-10.9	0	0	0	113.8	N175	D171-N175 WeakPolarHBondContact O-CB 3.19Å; D171-N175 PolarHBondContact O-N 3.2Å; D171-N175 PolarHBondContact O-ND2 3.24Å; D171-N175 VanDerWaalsContact O-ND2 3.11Å
172	P	66.6	Low	62.4	Low	73 Å²	73	93.4 Å²	93.4	47%	0.474	52%	0.524	S	S	.	.	H	α-helix	trans	-67.7	-37.2	178.2	25.4	-34.2	0	0	0	112.7	N168 L169 H176	N168-P172 WeakPolarHBondContact O-CD 3.2Å; N168-P172 WeakPolarHBondContact O-CG 3.38Å; L169-P172 WeakPolarHBondContact O-CD 3.3Å; L169-P172 WeakPolarHBondContact O-CG 3.39Å; P172-H176 WeakPolarHBondContact O-CB 3.39Å; P172-H176 PolarHBondContact O-N 2.81Å
173	E	67.5	Low	62.6	Low	113 Å²	113	99.6 Å²	99.6	53%	0.528	54%	0.538	S	S	.	.	H	α-helix	trans	-67.2	-45.3	178.6	-71.6	-177.1	172.1	0	0	111.4	L169 H170 H176 H177	L169-E173 WeakPolarHBondContact O-CG 3.36Å; L169-E173 PolarHBondContact O-N 3.38Å; H170-E173 PolarHBondContact O-N 3.33Å; E173-H176 PolarHBondContact O-N 3.22Å; E173-H177 PolarHBondContact O-CD2 3.36Å; E173-H177 PolarHBondContact O-N 2.87Å
174	I	70.2	Confident	62.5	Low	72 Å²	72	99.2 Å²	99.2	37%	0.369	54%	0.54	S	S	.	.	H	α-helix	trans	-64.6	-45.2	176.3	-67.8	170.3	0	0	0	110.6	H170 H176 H177 Q178	H170-I174 HydrophobicContact CB-CD1 4.33Å; H170-I174 VanDerWaalsContact O-CB 3.3Å; H170-I174 WeakPolarHBondContact O-CB 3.34Å; H170-I174 WeakPolarHBondContact O-CG1 3.36Å; H170-I174 PolarHBondContact O-N 3.45Å; I174-H176 VanDerWaalsContact C-N 3.32Å; I174-H176 PolarHBondContact O-N 3.18Å; I174-H177 PolarHBondContact O-N 3.41Å; I174-Q178 HydrophobicContact CG2-CG 4.43Å; I174-Q178 WeakPolarHBondContact O-CG 3.46Å; I174-Q178 PolarHBondContact O-N 3.2Å
175	N	69.9	Low	62.2	Low	88 Å²	88	97.7 Å²	97.7	47%	0.471	53%	0.527	S	S	.	.	H	α-helix	trans	-65	-35.8	178	-76.2	-29.3	0	0	0	112.2	D171 Q178 S179	D171-N175 WeakPolarHBondContact O-CB 3.19Å; D171-N175 PolarHBondContact O-N 3.2Å; D171-N175 PolarHBondContact O-ND2 3.24Å; D171-N175 VanDerWaalsContact O-ND2 3.11Å; N175-Q178 PolarHBondContact O-N 3.48Å; N175-S179 VanDerWaalsContact O-CB 3.24Å; N175-S179 WeakPolarHBondContact O-CB 3.36Å; N175-S179 PolarHBondContact O-N 3.23Å; N175-S179 PolarHBondContact O-OG 3.27Å
176	H	70.3	Confident	62	Low	134 Å²	134	102 Å²	102	62%	0.62	54%	0.538	S	S	*	.	H	α-helix	trans	-66	-43.9	174.3	-170.8	67.2	0	0	0	111	P172 E173 I174 S179 S180	P172-H176 WeakPolarHBondContact O-CB 3.39Å; P172-H176 PolarHBondContact O-N 2.81Å; E173-H176 PolarHBondContact O-N 3.22Å; I174-H176 VanDerWaalsContact C-N 3.32Å; I174-H176 PolarHBondContact O-N 3.18Å; H176-S179 PolarHBondContact O-N 2.91Å; H176-S180 WeakPolarHBondContact O-CB 3.34Å; H176-S180 PolarHBondContact O-N 3.13Å; H176-S180 PolarHBondContact O-OG 3.45Å
177	H	66.8	Low	62	Low	129 Å²	129	105.2 Å²	105.2	60%	0.597	56%	0.557	S	S	*	*	H	α-helix	trans	-60.1	-47.3	173.5	-78.9	-56	0	0	0	112	E173 I174 S179 S180 V181	E173-H177 PolarHBondContact O-CD2 3.36Å; E173-H177 PolarHBondContact O-N 2.87Å; I174-H177 PolarHBondContact O-N 3.41Å; H177-S179 PolarHBondContact O-N 3.46Å; H177-S180 PolarHBondContact O-N 2.95Å; H177-S180 PolarHBondContact O-OG 2.82Å; H177-V181 WeakPolarHBondContact O-CG2 3.42Å; H177-V181 PolarHBondContact O-N 3.45Å
178	Q	68.9	Low	61.9	Low	124 Å²	124	109.3 Å²	109.3	58%	0.579	57%	0.57	S	S	*	*	H	α-helix	trans	-61.6	-42.5	176.5	-70.8	-178.4	14.9	0	0	112.3	I174 N175 V181 A182	I174-Q178 HydrophobicContact CG2-CG 4.43Å; I174-Q178 WeakPolarHBondContact O-CG 3.46Å; I174-Q178 PolarHBondContact O-N 3.2Å; N175-Q178 PolarHBondContact O-N 3.48Å; Q178-V181 PolarHBondContact O-N 3.09Å; Q178-A182 PolarHBondContact O-N 2.91Å
179	S	64	Low	61.9	Low	68 Å²	68	107.2 Å²	107.2	48%	0.476	57%	0.57	S	S	.	*	H	α-helix	trans	-67.2	-35.8	178.6	-58.9	0	0	0	0	112.2	N175 H176 H177 V181 A182 A185	N175-S179 VanDerWaalsContact O-CB 3.24Å; N175-S179 WeakPolarHBondContact O-CB 3.36Å; N175-S179 PolarHBondContact O-N 3.23Å; N175-S179 PolarHBondContact O-OG 3.27Å; H176-S179 PolarHBondContact O-N 2.91Å; H177-S179 PolarHBondContact O-N 3.46Å; S179-V181 VanDerWaalsContact C-N 3.32Å; S179-V181 PolarHBondContact O-N 3.22Å; S179-A182 PolarHBondContact O-N 3.01Å; S179-A185 WeakPolarHBondContact O-CB 3.43Å
180	S	64.9	Low	61.8	Low	78 Å²	78	107.8 Å²	107.8	55%	0.545	58%	0.577	S	S	.	*	H	α-helix	trans	-69.6	-28.1	178.6	72.6	0	0	0	0	113.2	H176 H177	H176-S180 WeakPolarHBondContact O-CB 3.34Å; H176-S180 PolarHBondContact O-N 3.13Å; H176-S180 PolarHBondContact O-OG 3.45Å; H177-S180 PolarHBondContact O-N 2.95Å; H177-S180 PolarHBondContact O-OG 2.82Å
181	V	65.6	Low	61.7	Low	116 Å²	116	108.8 Å²	108.8	70%	0.703	59%	0.594	S	S	*	*	H	α-helix	trans	-84.7	-22.8	177.8	178.5	0	0	0	0	111.9	H177 Q178 S179 Y183	H177-V181 WeakPolarHBondContact O-CG2 3.42Å; H177-V181 PolarHBondContact O-N 3.45Å; Q178-V181 PolarHBondContact O-N 3.09Å; S179-V181 VanDerWaalsContact C-N 3.32Å; S179-V181 PolarHBondContact O-N 3.22Å; V181-Y183 PolarHBondContact O-N 3.3Å
182	A	59.8	Low	61.7	Low	46 Å²	46	114.9 Å²	114.9	38%	0.38	61%	0.61	S	S	.	*			trans	-71.1	113.9	179.5	0	0	0	0	0	111.7	Q178 S179 A184 A185	Q178-A182 PolarHBondContact O-N 2.91Å; S179-A182 PolarHBondContact O-N 3.01Å; A182-A184 PolarHBondContact O-N 3.27Å; A182-A185 WeakPolarHBondContact O-CB 3.14Å; A182-A185 PolarHBondContact O-N 2.92Å
183	Y	57.3	Low	62.2	Low	213 Å²	213	113 Å²	113	84%	0.835	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.1	-27.2	172.6	-97.8	-91.5	0	0	0	113.7	V181 A185	V181-Y183 PolarHBondContact O-N 3.3Å; Y183-A185 PolarHBondContact O-N 3.16Å
184	A	53.7	Low	63	Low	76 Å²	76	111.3 Å²	111.3	63%	0.628	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	-9.6	179	0	0	0	0	0	114.3	A182 Y186	A182-A184 PolarHBondContact O-N 3.27Å; A184-Y186 VanDerWaalsContact C-N 3.29Å; A184-Y186 PolarHBondContact O-N 2.77Å
185	A	51.1	Low	63.8	Low	40 Å²	40	114.8 Å²	114.8	33%	0.331	61%	0.606	S	S	.	*	H	α-helix	trans	-67.1	-29.2	-179.6	0	0	0	0	0	112.7	S179 A182 Y183 D187 K188 A189	S179-A185 WeakPolarHBondContact O-CB 3.43Å; A182-A185 WeakPolarHBondContact O-CB 3.14Å; A182-A185 PolarHBondContact O-N 2.92Å; Y183-A185 PolarHBondContact O-N 3.16Å; A185-D187 VanDerWaalsContact C-N 3.32Å; A185-D187 PolarHBondContact O-N 3.12Å; A185-K188 PolarHBondContact O-N 2.84Å; A185-A189 WeakPolarHBondContact O-CB 3.39Å; A185-A189 PolarHBondContact O-N 3.05Å
186	Y	51.2	Low	64.6	Low	181 Å²	181	111.4 Å²	111.4	71%	0.71	59%	0.587	S	S	*	*	H	α-helix	trans	-60.8	-40.1	-179	-71.5	-75	0	0	0	112.7	A184 K188 A189	A184-Y186 VanDerWaalsContact C-N 3.29Å; A184-Y186 PolarHBondContact O-N 2.77Å; Y186-K188 VanDerWaalsContact C-N 3.28Å; Y186-K188 PolarHBondContact O-N 3.31Å; Y186-A189 PolarHBondContact O-N 3.41Å
187	D	52.9	Low	65.5	Low	136 Å²	136	109.2 Å²	109.2	73%	0.727	58%	0.584	S	S	*	*	H	α-helix	trans	-74.8	-19.9	-176.8	-149.1	35.6	0	0	0	112.7	A185	A185-D187 VanDerWaalsContact C-N 3.32Å; A185-D187 PolarHBondContact O-N 3.12Å
188	K	54.6	Low	66.6	Low	195 Å²	195	104.4 Å²	104.4	85%	0.848	56%	0.562	S	S	*	*	H	α-helix	trans	-93.5	-21.2	173	-70.3	-173.1	179.9	-178.7	0	113.5	A185 Y186	A185-K188 PolarHBondContact O-N 2.84Å; Y186-K188 VanDerWaalsContact C-N 3.28Å; Y186-K188 PolarHBondContact O-N 3.31Å
189	A	56.7	Low	67.7	Low	83 Å²	83	101.6 Å²	101.6	69%	0.686	55%	0.552	S	S	*	*	H	α-helix	trans	-75.8	-26.6	-176.4	0	0	0	0	0	113	A185 Y186	A185-A189 WeakPolarHBondContact O-CB 3.39Å; A185-A189 PolarHBondContact O-N 3.05Å; Y186-A189 PolarHBondContact O-N 3.41Å
190	V	57.3	Low	69	Low	111 Å²	111	107 Å²	107	67%	0.673	56%	0.561	S	S	*	*	S	Bend	trans	-98.9	120.4	177.6	-174.1	0	0	0	0	108.7	R192	V190-R192 PolarHBondContact O-N 3.09Å
191	S	60.3	Low	70.3	Confident	108 Å²	108	107.9 Å²	107.9	76%	0.755	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-56.1	124	172.4	-70.1	0	0	0	0	108.9	G193	S191-G193 PolarHBondContact O-N 3.26Å
192	R	67.2	Low	71.6	Confident	229 Å²	229	102.3 Å²	102.3	86%	0.864	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-50.8	116.1	175.3	-69.5	-176.1	178.5	-178	-1.7	108.3	V190	V190-R192 PolarHBondContact O-N 3.09Å
193	G	76	Confident	73.2	Confident	33 Å²	33	102.7 Å²	102.7	34%	0.34	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-64.8	167.3	-174.3	0	0	0	0	0	113.1	S191 T311	S191-G193 PolarHBondContact O-N 3.26Å; G193-T311 VanDerWaalsContact CA-O 3.23Å; G193-T311 WeakPolarHBondContact CA-O 3.34Å
194	I	84.3	Confident	75	Confident	78 Å²	78	96.5 Å²	96.5	40%	0.4	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-93.6	122.6	178.4	-64.9	166	0	0	0	108.3	F196 T311 C312	I194-F196 HydrophobicContact CG2-CD1 3.73Å; I194-F196 HydrophobicContact CG2-CE1 3.47Å; I194-F196 VanDerWaalsContact CG2-CE1 3.47Å; I194-F196 HydrophobicContact CG2-CZ 4.28Å; I194-F196 PolarHBondContact O-N 3.29Å; I194-T311 HydrophobicContact CB-CG2 4.12Å; I194-T311 HydrophobicContact CD1-CG2 3.68Å; I194-T311 HydrophobicContact CG1-CG2 3.62Å; I194-T311 PolarHBondContact N-O 3.4Å; I194-C312 WeakPolarHBondContact O-CA 3.18Å; I194-C312 PolarHBondContact O-SG 3.05Å; I194-C312 VanDerWaalsContact O-SG 3.37Å
195	R	86.7	Confident	77	Confident	145 Å²	145	93 Å²	93	55%	0.547	47%	0.474	S	S	.	.			trans	-91.7	102.2	-178.6	-162.9	175.1	-140.6	107.6	1.9	110.5	P315 E318 T319	R195-P315 HydrophobicContact CB-CB 4.03Å; R195-P315 HydrophobicContact CG-CB 4.04Å; R195-E318 IonicContact NH1-OE2 3.64Å; R195-E318 IonicContact NH2-OE2 3.12Å; R195-T319 PolarHBondContact NE-OG1 3.22Å; R195-T319 PolarHBondContact NH2-OG1 2.74Å
196	F	87.3	Confident	79.1	Confident	17 Å²	17	91.1 Å²	91.1	8%	0.075	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-83.4	140.2	171.1	-72.9	-14.3	0	0	0	111.4	I194 E246 V248 L308 C312	I194-F196 HydrophobicContact CG2-CD1 3.73Å; I194-F196 HydrophobicContact CG2-CE1 3.47Å; I194-F196 VanDerWaalsContact CG2-CE1 3.47Å; I194-F196 HydrophobicContact CG2-CZ 4.28Å; I194-F196 PolarHBondContact O-N 3.29Å; F196-E246 HydrophobicContact CD1-CB 3.99Å; F196-E246 HydrophobicContact CE1-CB 3.66Å; F196-E246 HydrophobicContact CE1-CG 4.16Å; F196-E246 HydrophobicContact CZ-CB 3.95Å; F196-E246 HydrophobicContact CZ-CG 4.22Å; F196-V248 HydrophobicContact CB-CG2 4.1Å; F196-L308 HydrophobicContact CE2-CD2 4.15Å; F196-L308 HydrophobicContact CZ-CD2 3.66Å; F196-C312 HydrophobicContact CD2-CB 4.32Å; F196-C312 WeakPolarHBondContact CD2-SG 3.41Å; F196-C312 WeakPolarHBondContact CE2-SG 3.45Å
197	P	89.4	Confident	81.2	Confident	87 Å²	87	83 Å²	83	57%	0.565	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-55.7	138.2	166.3	24.1	-35.2	0	0	0	110.5	E246 A247 V248	P197-E246 WeakPolarHBondContact CD-O 3.36Å; P197-E246 WeakPolarHBondContact CG-O 3.31Å; P197-A247 HydrophobicContact CG-CB 4.13Å; P197-A247 CarbonylContact O-C 3.54Å; P197-A247 VanDerWaalsContact O-CA 3.28Å; P197-A247 WeakPolarHBondContact O-CA 3.38Å; P197-V248 PolarHBondContact O-N 2.79Å
198	I	90.5	Very high	83.2	Confident	28 Å²	28	82.5 Å²	82.5	14%	0.144	42%	0.418	C	S	.	.	B	Isolated β-bridge	trans	-98.4	127.6	175.2	-52.7	172.7	0	0	0	107	A202 L203 V248 F316 T319	I198-A202 HydrophobicContact CG2-CB 3.81Å; I198-L203 HydrophobicContact CB-CD2 4.17Å; I198-L203 HydrophobicContact CB-CG 4.19Å; I198-L203 HydrophobicContact CD1-CD2 4.27Å; I198-L203 HydrophobicContact CG2-CD2 3.87Å; I198-L203 HydrophobicContact CG2-CG 3.81Å; I198-V248 HydrophobicContact CG1-CB 4.38Å; I198-V248 HydrophobicContact CG2-CB 4.46Å; I198-F316 HydrophobicContact CD1-CD2 3.6Å; I198-F316 HydrophobicContact CD1-CE2 3.73Å; I198-F316 HydrophobicContact CG1-CD2 3.96Å; I198-F316 HydrophobicContact CG1-CE2 4.17Å; I198-T319 HydrophobicContact CD1-CG2 3.69Å
199	D	90.5	Very high	85	Confident	66 Å²	66	73.2 Å²	73.2	35%	0.353	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-64.8	152.5	179.6	-163.6	18.3	0	0	0	111.6	D201 A202 L203 V248 K249	D199-D201 VanDerWaalsContact C-N 3.32Å; D199-D201 PolarHBondContact O-N 3.16Å; D199-A202 WeakPolarHBondContact O-CB 3.5Å; D199-A202 PolarHBondContact O-N 2.94Å; D199-A202 VanDerWaalsContact O-N 3.16Å; D199-L203 PolarHBondContact O-N 2.78Å; D199-L203 VanDerWaalsContact O-N 3.08Å; D199-V248 WeakPolarHBondContact CB-O 3.48Å; D199-V248 PolarHBondContact N-O 3.21Å; D199-K249 HydrophobicContact CB-CG 4.21Å
200	R	91.8	Very high	86.7	Confident	180 Å²	180	74.9 Å²	74.9	68%	0.679	37%	0.367	S	S	*	.	H	α-helix	trans	-62.4	-41.8	-175.2	-177.3	-179.7	170.8	178.2	0	111.7	A202 L203 D204	R200-A202 PolarHBondContact O-N 3.03Å; R200-L203 PolarHBondContact O-N 3.2Å; R200-L203 VanDerWaalsContact O-N 3.16Å; R200-D204 IonicContact NE-OD2 2.84Å; R200-D204 WeakPolarHBondContact O-CB 3.35Å; R200-D204 PolarHBondContact O-N 3.03Å
201	D	93	Very high	88.3	Confident	97 Å²	97	74 Å²	74	52%	0.519	36%	0.358	S	S	.	.	H	α-helix	trans	-62.2	-35	179.1	-66.5	-15	0	0	0	111.6	D199 A205 L250	D199-D201 VanDerWaalsContact C-N 3.32Å; D199-D201 PolarHBondContact O-N 3.16Å; D201-A205 WeakPolarHBondContact O-CB 3.21Å; D201-A205 PolarHBondContact O-N 3.44Å; D201-L250 HydrophobicContact CB-CB 4.33Å; D201-L250 HydrophobicContact CB-CD2 4.31Å
202	A	92.8	Very high	89.6	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-68.5	-43.2	175	0	0	0	0	0	112	I198 D199 R200 A205 L206 L219 L250	I198-A202 HydrophobicContact CG2-CB 3.81Å; D199-A202 WeakPolarHBondContact O-CB 3.5Å; D199-A202 PolarHBondContact O-N 2.94Å; D199-A202 VanDerWaalsContact O-N 3.16Å; R200-A202 PolarHBondContact O-N 3.03Å; A202-A205 PolarHBondContact O-N 3.38Å; A202-L206 VanDerWaalsContact O-CG 3.29Å; A202-L206 WeakPolarHBondContact O-CG 3.46Å; A202-L206 PolarHBondContact O-N 2.99Å; A202-L219 HydrophobicContact CB-CD2 3.6Å; A202-L250 HydrophobicContact CB-CB 4.18Å
203	L	93.6	Very high	90.7	Very high	53 Å²	53	64.4 Å²	64.4	28%	0.277	32%	0.321	S	S	.	.	H	α-helix	trans	-63.1	-42.8	174.6	-70.1	173.1	0	0	0	111.7	I198 D199 R200 L206 G207 V324	I198-L203 HydrophobicContact CB-CD2 4.17Å; I198-L203 HydrophobicContact CB-CG 4.19Å; I198-L203 HydrophobicContact CD1-CD2 4.27Å; I198-L203 HydrophobicContact CG2-CD2 3.87Å; I198-L203 HydrophobicContact CG2-CG 3.81Å; D199-L203 PolarHBondContact O-N 2.78Å; D199-L203 VanDerWaalsContact O-N 3.08Å; R200-L203 PolarHBondContact O-N 3.2Å; R200-L203 VanDerWaalsContact O-N 3.16Å; L203-L206 PolarHBondContact O-N 3.48Å; L203-G207 PolarHBondContact O-N 2.7Å; L203-V324 HydrophobicContact CD2-CG2 3.78Å
204	D	94.8	Very high	91.5	Very high	83 Å²	83	63.1 Å²	63.1	44%	0.444	31%	0.306	S	S	.	.	H	α-helix	trans	-65.8	-40.4	179.2	-72.5	-15.1	0	0	0	111.1	R200 G207 R208	R200-D204 IonicContact NE-OD2 2.84Å; R200-D204 WeakPolarHBondContact O-CB 3.35Å; R200-D204 PolarHBondContact O-N 3.03Å; D204-G207 PolarHBondContact O-N 3.35Å; D204-R208 WeakPolarHBondContact O-CG 3.22Å; D204-R208 PolarHBondContact O-N 3.16Å
205	A	95.3	Very high	91.9	Very high	3 Å²	3	59.7 Å²	59.7	3%	0.025	29%	0.289	C	S	.	.	H	α-helix	trans	-63.8	-44	173.7	0	0	0	0	0	112.6	D201 A202 G207 R208 L209 I214 V217 L250 A253	D201-A205 WeakPolarHBondContact O-CB 3.21Å; D201-A205 PolarHBondContact O-N 3.44Å; A202-A205 PolarHBondContact O-N 3.38Å; A205-G207 VanDerWaalsContact C-N 3.3Å; A205-G207 PolarHBondContact O-N 3.15Å; A205-R208 WeakPolarHBondContact O-CB 3.31Å; A205-R208 PolarHBondContact O-N 2.87Å; A205-L209 PolarHBondContact O-N 3.23Å; A205-I214 WeakPolarHBondContact O-CD1 3.35Å; A205-V217 HydrophobicContact CB-CG1 4.1Å; A205-V217 HydrophobicContact CB-CG2 4.3Å; A205-L250 HydrophobicContact CB-CD1 3.7Å; A205-L250 HydrophobicContact CB-CD2 3.85Å; A205-L250 HydrophobicContact CB-CG 4.41Å; A205-A253 HydrophobicContact CB-CB 3.89Å
206	L	95.6	Very high	92.2	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.7	-38.5	173.5	-70.4	170	0	0	0	111.3	A202 L203 R208 L209 R210 V217 L219 F274 F316 V320 V324 I326	A202-L206 VanDerWaalsContact O-CG 3.29Å; A202-L206 WeakPolarHBondContact O-CG 3.46Å; A202-L206 PolarHBondContact O-N 2.99Å; L203-L206 PolarHBondContact O-N 3.48Å; L206-R208 VanDerWaalsContact C-N 3.33Å; L206-R208 PolarHBondContact O-N 2.78Å; L206-L209 WeakPolarHBondContact O-CB 3.38Å; L206-L209 PolarHBondContact O-N 3.47Å; L206-L209 VanDerWaalsContact O-N 3.16Å; L206-R210 PolarHBondContact O-N 2.97Å; L206-V217 HydrophobicContact CD2-CB 4.35Å; L206-V217 HydrophobicContact CD2-CG1 4.19Å; L206-V217 HydrophobicContact CD2-CG2 4.49Å; L206-V217 HydrophobicContact CG-CG1 4.46Å; L206-L219 HydrophobicContact CD1-CD1 4.26Å; L206-F274 HydrophobicContact CD2-CB 4.41Å; L206-F274 HydrophobicContact CD2-CD1 4.26Å; L206-F274 HydrophobicContact CD2-CD2 3.65Å; L206-F274 HydrophobicContact CD2-CE1 4.44Å; L206-F274 HydrophobicContact CD2-CE2 3.88Å; L206-F274 HydrophobicContact CD2-CG 3.85Å; L206-F274 HydrophobicContact CD2-CZ 4.27Å; L206-F316 HydrophobicContact CD1-CZ 4.45Å; L206-V320 HydrophobicContact CD1-CG1 4.34Å; L206-V320 HydrophobicContact CD1-CG2 3.73Å; L206-V324 HydrophobicContact CB-CG1 4Å; L206-V324 HydrophobicContact CB-CG2 4.32Å; L206-I326 HydrophobicContact CB-CD1 3.85Å; L206-I326 HydrophobicContact CD2-CD1 3.97Å; L206-I326 HydrophobicContact CG-CD1 4.48Å; L206-I326 WeakPolarHBondContact O-CD1 3.27Å
207	G	94.5	Very high	92.7	Very high	12 Å²	12	52 Å²	52	12%	0.124	26%	0.259	C	S	.	.	H	α-helix	trans	-57.8	-43.8	171.4	0	0	0	0	0	112.5	L203 D204 A205 L209 R210 D211	L203-G207 PolarHBondContact O-N 2.7Å; D204-G207 PolarHBondContact O-N 3.35Å; A205-G207 VanDerWaalsContact C-N 3.3Å; A205-G207 PolarHBondContact O-N 3.15Å; G207-L209 VanDerWaalsContact C-N 3.33Å; G207-L209 PolarHBondContact O-N 3.05Å; G207-R210 WeakPolarHBondContact O-CB 3.11Å; G207-R210 PolarHBondContact O-N 2.99Å; G207-D211 VanDerWaalsContact O-CG 3.3Å; G207-D211 PolarHBondContact O-N 3.11Å
208	R	94.2	Very high	92.9	Very high	124 Å²	124	48.1 Å²	48.1	47%	0.468	23%	0.234	S	C	.	.	H	α-helix	trans	-64.1	-34.5	174.6	-70	171.2	63.3	-166.5	-2	113	D204 A205 L206 D212 C213 I214	D204-R208 WeakPolarHBondContact O-CG 3.22Å; D204-R208 PolarHBondContact O-N 3.16Å; A205-R208 WeakPolarHBondContact O-CB 3.31Å; A205-R208 PolarHBondContact O-N 2.87Å; L206-R208 VanDerWaalsContact C-N 3.33Å; L206-R208 PolarHBondContact O-N 2.78Å; R208-D212 PolarHBondContact O-N 3.43Å; R208-C213 HydrophobicContact CB-CB 4.15Å; R208-C213 WeakPolarHBondContact O-CB 3.24Å; R208-C213 PolarHBondContact O-N 3.13Å; R208-I214 HydrophobicContact CB-CD1 3.96Å; R208-I214 HydrophobicContact CB-CG1 3.93Å; R208-I214 PolarHBondContact O-N 2.93Å
209	L	93.7	Very high	93.1	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-66.6	-43.4	173.8	-175	85.3	0	0	0	110.9	A205 L206 G207 D211 D212 I214 N215 V217 F274 A276 V290 I326	A205-L209 PolarHBondContact O-N 3.23Å; L206-L209 WeakPolarHBondContact O-CB 3.38Å; L206-L209 PolarHBondContact O-N 3.47Å; L206-L209 VanDerWaalsContact O-N 3.16Å; G207-L209 VanDerWaalsContact C-N 3.33Å; G207-L209 PolarHBondContact O-N 3.05Å; L209-D211 VanDerWaalsContact C-N 3.32Å; L209-D211 PolarHBondContact O-N 2.92Å; L209-D212 PolarHBondContact O-N 3.39Å; L209-I214 HydrophobicContact CB-CG1 4.12Å; L209-I214 HydrophobicContact CD1-CG1 4.4Å; L209-I214 WeakPolarHBondContact CD1-O 3.29Å; L209-N215 WeakPolarHBondContact CD1-O 3.19Å; L209-V217 HydrophobicContact CB-CG2 4.02Å; L209-V217 HydrophobicContact CD1-CG2 4.31Å; L209-V217 HydrophobicContact CD2-CG2 4.48Å; L209-F274 HydrophobicContact CD2-CB 3.53Å; L209-F274 HydrophobicContact CD2-CD1 4.35Å; L209-F274 HydrophobicContact CD2-CG 4.26Å; L209-A276 HydrophobicContact CD1-CB 3.91Å; L209-A276 HydrophobicContact CG-CB 4.44Å; L209-V290 HydrophobicContact CD2-CG1 4.35Å; L209-I326 HydrophobicContact CD2-CD1 4.23Å
210	R	91.9	Very high	93	Very high	118 Å²	118	44 Å²	44	45%	0.445	21%	0.212	S	C	.	.	H	α-helix	trans	-59.8	-43.4	175.6	-176.3	-163.3	68.9	-159	-6.6	111.7	L206 G207 D212 V324 I326	L206-R210 PolarHBondContact O-N 2.97Å; G207-R210 WeakPolarHBondContact O-CB 3.11Å; G207-R210 PolarHBondContact O-N 2.99Å; R210-D212 PolarHBondContact O-N 2.91Å; R210-V324 WeakPolarHBondContact CD-O 3.17Å; R210-V324 PolarHBondContact NH1-O 2.76Å; R210-I326 HydrophobicContact CB-CG1 3.83Å; R210-I326 HydrophobicContact CG-CG1 4.3Å
211	D	90.8	Very high	92.6	Very high	92 Å²	92	35.9 Å²	35.9	49%	0.492	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	16.2	-177.4	-59.3	-19.1	0	0	0	112.5	G207 L209 C213	G207-D211 VanDerWaalsContact O-CG 3.3Å; G207-D211 PolarHBondContact O-N 3.11Å; L209-D211 VanDerWaalsContact C-N 3.32Å; L209-D211 PolarHBondContact O-N 2.92Å; D211-C213 PolarHBondContact O-N 3.16Å; D211-C213 VanDerWaalsContact O-N 3.14Å; D211-C213 PolarHBondContact O-SG 3.32Å
212	D	88.1	Confident	91.5	Very high	53 Å²	53	34.1 Å²	34.1	28%	0.283	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	24.3	175.6	-160.6	33.8	0	0	0	115.4	R208 L209 R210 R278 I287	R208-D212 PolarHBondContact O-N 3.43Å; L209-D212 PolarHBondContact O-N 3.39Å; R210-D212 PolarHBondContact O-N 2.91Å; D212-R278 VanDerWaalsContact CG-CZ 3.48Å; D212-R278 PolarHBondContact O-NH2 3.5Å; D212-R278 IonicContact OD1-CZ 3.48Å; D212-R278 IonicContact OD1-NE 3.5Å; D212-R278 IonicContact OD1-NH1 3.19Å; D212-R278 PolarHBondContact OD1-NH1 3.28Å; D212-R278 IonicContact OD1-NH2 3.56Å; D212-R278 PolarHBondContact OD1-NH2 2.91Å; D212-R278 IonicContact OD2-CZ 2.72Å; D212-R278 VanDerWaalsContact OD2-CZ 3.26Å; D212-R278 IonicContact OD2-NH1 3.97Å; D212-R278 PolarHBondContact OD2-NH1 2.74Å; D212-R278 IonicContact OD2-NH2 3.62Å; D212-R278 PolarHBondContact OD2-NH2 3.47Å; D212-R278 VanDerWaalsContact OD2-NH2 3.17Å; D212-I287 HydrophobicContact CB-CD1 3.9Å; D212-I287 HydrophobicContact CB-CG1 4.32Å; D212-I287 WeakPolarHBondContact OD1-CD1 3.45Å; D212-I287 WeakPolarHBondContact OD1-CG1 3.3Å
213	C	89.5	Confident	89.7	Confident	83 Å²	83	34.9 Å²	34.9	56%	0.561	18%	0.177	S	C	*	.	S	Bend	trans	-86.2	-26.5	-180	-64.4	0	0	0	0	113.3	R208 D211	R208-C213 HydrophobicContact CB-CB 4.15Å; R208-C213 WeakPolarHBondContact O-CB 3.24Å; R208-C213 PolarHBondContact O-N 3.13Å; D211-C213 PolarHBondContact O-N 3.16Å; D211-C213 VanDerWaalsContact O-N 3.14Å; D211-C213 PolarHBondContact O-SG 3.32Å
214	I	92.5	Very high	87.6	Confident	5 Å²	5	36.2 Å²	36.2	3%	0.026	18%	0.184	C	C	.	.			trans	-135.5	162.9	172.7	60.2	178.2	0	0	0	108.5	A205 R208 L209 V217 A253 Q255	A205-I214 WeakPolarHBondContact O-CD1 3.35Å; R208-I214 HydrophobicContact CB-CD1 3.96Å; R208-I214 HydrophobicContact CB-CG1 3.93Å; R208-I214 PolarHBondContact O-N 2.93Å; L209-I214 HydrophobicContact CB-CG1 4.12Å; L209-I214 HydrophobicContact CD1-CG1 4.4Å; L209-I214 WeakPolarHBondContact CD1-O 3.29Å; I214-V217 HydrophobicContact CD1-CG2 3.58Å; I214-V217 HydrophobicContact CG1-CG2 4.42Å; I214-A253 HydrophobicContact CD1-CB 3.79Å; I214-Q255 VanDerWaalsContact C-OE1 3.25Å
215	N	92.8	Very high	85.2	Confident	7 Å²	7	39.8 Å²	39.8	4%	0.037	20%	0.198	C	C	.	.	S	Bend	trans	-117.3	-7.5	178.3	72.6	-6.6	0	0	0	114	L209 S254 Q255 I256 Y275 A276	L209-N215 WeakPolarHBondContact CD1-O 3.19Å; N215-S254 PolarHBondContact OD1-O 2.85Å; N215-Q255 VanDerWaalsContact CG-CD 3.47Å; N215-Q255 VanDerWaalsContact OD1-CA 3.27Å; N215-Q255 WeakPolarHBondContact OD1-CA 3.37Å; N215-Q255 PolarHBondContact OD1-OE1 3.38Å; N215-I256 PolarHBondContact ND2-O 3.2Å; N215-I256 PolarHBondContact OD1-N 3.44Å; N215-I256 PolarHBondContact OD1-O 3.16Å; N215-Y275 CarbonylContact O-C 3.51Å; N215-Y275 VanDerWaalsContact O-CA 3.27Å; N215-Y275 WeakPolarHBondContact O-CA 3.42Å; N215-Y275 WeakPolarHBondContact O-CD2 3.18Å; N215-A276 HydrophobicContact CB-CB 4.32Å; N215-A276 PolarHBondContact O-N 3.18Å
216	Y	94.6	Very high	82.5	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	135.3	179.3	-179.7	-102.4	0	0	0	112.2	Q218 S254 I256 V261 H264 H273 F274 Y275 F293	Y216-Q218 HydrophobicContact CE1-CB 3.74Å; Y216-Q218 PolarHBondContact OH-OE1 3.27Å; Y216-S254 PolarHBondContact N-O 2.87Å; Y216-S254 PolarHBondContact O-N 2.9Å; Y216-I256 HydrophobicContact CD1-CD1 3.3Å; Y216-I256 HydrophobicContact CD1-CG1 4.48Å; Y216-I256 HydrophobicContact CE1-CD1 3.73Å; Y216-I256 HydrophobicContact CG-CD1 3.72Å; Y216-V261 HydrophobicContact CD2-CG1 4.25Å; Y216-V261 HydrophobicContact CE2-CG1 3.84Å; Y216-H264 HydrophobicContact CE1-CB 4.17Å; Y216-H273 HydrophobicContact CE2-CB 4.14Å; Y216-H273 AromaticContact CE2-ND1 3.76Å; Y216-H273 AromaticContact CZ-ND1 3.56Å; Y216-H273 PolarHBondContact OH-CE1 2.73Å; Y216-H273 VanDerWaalsContact OH-CE1 3.31Å; Y216-H273 PolarHBondContact OH-ND1 3.42Å; Y216-F274 WeakPolarHBondContact CA-O 3.43Å; Y216-Y275 HydrophobicContact CD2-CD2 4.14Å; Y216-F293 HydrophobicContact CE2-CZ 4.24Å
217	V	96.2	Very high	79.6	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	127.7	172.2	-176.7	0	0	0	0	108.8	A205 L206 L209 I214 L219 L250 E252 H273 F274	A205-V217 HydrophobicContact CB-CG1 4.1Å; A205-V217 HydrophobicContact CB-CG2 4.3Å; L206-V217 HydrophobicContact CD2-CB 4.35Å; L206-V217 HydrophobicContact CD2-CG1 4.19Å; L206-V217 HydrophobicContact CD2-CG2 4.49Å; L206-V217 HydrophobicContact CG-CG1 4.46Å; L209-V217 HydrophobicContact CB-CG2 4.02Å; L209-V217 HydrophobicContact CD1-CG2 4.31Å; L209-V217 HydrophobicContact CD2-CG2 4.48Å; I214-V217 HydrophobicContact CD1-CG2 3.58Å; I214-V217 HydrophobicContact CG1-CG2 4.42Å; V217-L219 HydrophobicContact CG1-CD2 3.88Å; V217-L219 HydrophobicContact CG1-CG 4.09Å; V217-L250 HydrophobicContact CG1-CD1 3.73Å; V217-E252 WeakPolarHBondContact CA-O 3.47Å; V217-H273 CarbonylContact O-C 3.52Å; V217-H273 WeakPolarHBondContact O-CA 3.34Å; V217-F274 HydrophobicContact CB-CB 4.35Å; V217-F274 PolarHBondContact N-O 2.72Å; V217-F274 PolarHBondContact O-N 3.25Å
218	Q	94.5	Very high	76.7	Confident	6 Å²	6	57 Å²	57	3%	0.028	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	130.7	175.1	-178.5	172.4	-36	0	0	110.3	Y216 E251 E252 H264 R271 Y272	Y216-Q218 HydrophobicContact CE1-CB 3.74Å; Y216-Q218 PolarHBondContact OH-OE1 3.27Å; Q218-E251 HydrophobicContact CB-CB 4.43Å; Q218-E251 HydrophobicContact CG-CB 4.07Å; Q218-E251 PolarHBondContact O-N 3.31Å; Q218-E252 HydrophobicContact CB-CB 4.11Å; Q218-E252 PolarHBondContact N-O 3.49Å; Q218-E252 PolarHBondContact O-N 3.23Å; Q218-H264 PolarHBondContact OE1-O 3.19Å; Q218-R271 HydrophobicContact CG-CB 4.22Å; Q218-R271 HydrophobicContact CG-CG 4.23Å; Q218-Y272 WeakPolarHBondContact CA-O 3.4Å
219	L	93.6	Very high	73.7	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	146.1	-176.5	-54.9	168.8	0	0	0	110.8	A202 L206 V217 V248 K249 L250 R271 Y272 F274 F316	A202-L219 HydrophobicContact CB-CD2 3.6Å; L206-L219 HydrophobicContact CD1-CD1 4.26Å; V217-L219 HydrophobicContact CG1-CD2 3.88Å; V217-L219 HydrophobicContact CG1-CG 4.09Å; L219-V248 HydrophobicContact CB-CG1 3.95Å; L219-V248 HydrophobicContact CD1-CG1 4.21Å; L219-K249 VanDerWaalsContact CA-O 3.31Å; L219-K249 WeakPolarHBondContact CA-O 3.25Å; L219-L250 HydrophobicContact CD2-CB 4.45Å; L219-L250 HydrophobicContact CD2-CD1 3.94Å; L219-R271 WeakPolarHBondContact O-CD 3.38Å; L219-Y272 PolarHBondContact N-O 3.1Å; L219-Y272 PolarHBondContact O-N 3.36Å; L219-F274 HydrophobicContact CD1-CD2 4.34Å; L219-F274 HydrophobicContact CD1-CE2 4.06Å; L219-F316 HydrophobicContact CD1-CE1 4.2Å; L219-F316 HydrophobicContact CD1-CE2 3.93Å; L219-F316 HydrophobicContact CD1-CZ 3.3Å
220	V	90.1	Very high	70.8	Confident	6 Å²	6	69.2 Å²	69.2	4%	0.036	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	134.3	177.6	57	0	0	0	0	109.3	F222 V248 K249 E251 Y309	V220-F222 HydrophobicContact CB-CE2 4.23Å; V220-F222 HydrophobicContact CG1-CD2 3.8Å; V220-F222 HydrophobicContact CG1-CE2 3.29Å; V220-F222 HydrophobicContact CG1-CZ 4.08Å; V220-F222 HydrophobicContact CG2-CD2 4.09Å; V220-F222 HydrophobicContact CG2-CE1 4.5Å; V220-F222 HydrophobicContact CG2-CE2 3.87Å; V220-F222 HydrophobicContact CG2-CZ 4.07Å; V220-V248 WeakPolarHBondContact O-CA 3.38Å; V220-K249 HydrophobicContact CG1-CB 4.09Å; V220-K249 PolarHBondContact N-O 3.48Å; V220-K249 PolarHBondContact O-N 3.24Å; V220-E251 HydrophobicContact CG1-CB 4.38Å; V220-E251 WeakPolarHBondContact CG1-OE2 3.45Å; V220-Y309 WeakPolarHBondContact CA-OH 3.41Å; V220-Y309 WeakPolarHBondContact CG2-OH 3.22Å
221	C	81.9	Confident	68	Low	10 Å²	10	73.8 Å²	73.8	7%	0.068	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	106.6	171.8	-60.9	0	0	0	0	107.3	Y272 Y309	C221-Y272 WeakPolarHBondContact SG-CE2 3.49Å; C221-Y309 HydrophobicContact CB-CD1 4.48Å; C221-Y309 HydrophobicContact CB-CD2 3.99Å; C221-Y309 HydrophobicContact CB-CE1 4.14Å; C221-Y309 HydrophobicContact CB-CE2 3.6Å; C221-Y309 HydrophobicContact CB-CG 4.43Å; C221-Y309 VanDerWaalsContact N-CZ 3.34Å; C221-Y309 PolarHBondContact N-OH 3.32Å
222	F	70.4	Confident	65.3	Low	61 Å²	61	79.7 Å²	79.7	27%	0.268	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	139.1	174.1	-78.4	-80	0	0	0	110	V220 E246 A247 K249	V220-F222 HydrophobicContact CB-CE2 4.23Å; V220-F222 HydrophobicContact CG1-CD2 3.8Å; V220-F222 HydrophobicContact CG1-CE2 3.29Å; V220-F222 HydrophobicContact CG1-CZ 4.08Å; V220-F222 HydrophobicContact CG2-CD2 4.09Å; V220-F222 HydrophobicContact CG2-CE1 4.5Å; V220-F222 HydrophobicContact CG2-CE2 3.87Å; V220-F222 HydrophobicContact CG2-CZ 4.07Å; F222-E246 WeakPolarHBondContact O-CA 3.22Å; F222-A247 PolarHBondContact N-O 2.8Å; F222-A247 PolarHBondContact O-N 3.5Å; F222-K249 HydrophobicContact CD2-CB 4.2Å; F222-K249 HydrophobicContact CD2-CD 3.79Å; F222-K249 HydrophobicContact CD2-CG 4.08Å; F222-K249 HydrophobicContact CE2-CB 4.33Å; F222-K249 HydrophobicContact CE2-CD 4.11Å
223	A	54.3	Low	62.7	Low	15 Å²	15	83.5 Å²	83.5	12%	0.124	40%	0.4	C	S	.	.			trans	-132.5	151.5	160.5	0	0	0	0	0	109.2	E225 L308	A223-E225 PolarHBondContact O-N 3.33Å; A223-L308 HydrophobicContact CB-CD1 3.23Å
224	L	50	Low	60.3	Low	81 Å²	81	87.9 Å²	87.9	42%	0.424	41%	0.412	S	S	.	.	S	Bend	trans	-42.7	123.5	174.1	-85.8	152.6	0	0	0	110.5	L244 K304	L224-L244 HydrophobicContact CD2-CD2 3.93Å; L224-K304 PolarHBondContact O-NZ 3.16Å
225	E	44.3	Very low	57.5	Low	159 Å²	159	94 Å²	94	74%	0.743	45%	0.45	S	S	*	.			trans	89.2	62.9	-177.7	-53.2	169.6	148.3	0	0	116.8	A223 K304	A223-E225 PolarHBondContact O-N 3.33Å; E225-K304 IonicContact OE2-NZ 3.73Å; E225-K304 PolarHBondContact OE2-NZ 2.83Å; E225-K304 VanDerWaalsContact OE2-NZ 3.12Å
226	C	39.7	Very low	54.8	Low	67 Å²	67	100 Å²	100	45%	0.453	49%	0.489	S	S	.	.			trans	-126.3	74.6	154	-75.8	0	0	0	0	108.8	E305	C226-E305 PolarHBondContact SG-OE1 3.08Å; C226-E305 VanDerWaalsContact SG-OE1 3.35Å
227	L	34.3	Very low	51.9	Low	104 Å²	104	111 Å²	111	55%	0.545	53%	0.532	S	S	.	.			trans	-150.4	61.4	174.9	-132	161	0	0	0	110.9	I243	L227-I243 HydrophobicContact CD1-CD1 3.33Å; L227-I243 HydrophobicContact CD1-CG1 3.91Å; L227-I243 HydrophobicContact CD1-CG2 3.84Å
228	F	33.1	Very low	48.7	Very low	206 Å²	206	118.7 Å²	118.7	90%	0.904	57%	0.573	S	S	*	*			trans	-152.9	129.8	153.5	-95.6	-76.7	0	0	0	109
229	F	31.1	Very low	45.7	Very low	203 Å²	203	127.1 Å²	127.1	89%	0.89	61%	0.612	S	S	*	*	S	Bend	trans	97.4	78.5	-176.4	-73.8	-86.5	0	0	0	116.3
230	Q	33.7	Very low	42.7	Very low	177 Å²	177	132.7 Å²	132.7	83%	0.827	65%	0.651	S	S	*	*				-175.6	70.7	111.7	-159	138.6	-28	0	0	110	R232	Q230-R232 PolarHBondContact O-N 3.31Å
231	F	32.5	Very low	39.9	Very low	215 Å²	215	137.4 Å²	137.4	94%	0.943	68%	0.68	S	S	*	*			trans	-84.2	95.1	161.8	-99.5	-83.3	0	0	0	108.2
232	R	33.9	Very low	38	Very low	216 Å²	216	140.7 Å²	140.7	82%	0.815	70%	0.697	S	S	*	*			trans	-150.2	109.2	156.1	-133.2	179.9	-177.3	173.1	1.1	110.2	Q230	Q230-R232 PolarHBondContact O-N 3.31Å
233	N	33.4	Very low	36.8	Very low	133 Å²	133	141.3 Å²	141.3	71%	0.711	70%	0.702	S	S	*	*	S	Bend	trans	80.6	108.8	157.7	-56.7	-8.2	0	0	0	119
234	E	38.5	Very low	36.8	Very low	174 Å²	174	146.1 Å²	146.1	81%	0.813	73%	0.725	S	S	*	*			trans	62.5	77.9	131.9	-63	174.8	179.4	0	0	118.2
235	T	35	Very low	37.5	Very low	134 Å²	134	145.9 Å²	145.9	82%	0.822	72%	0.724	S	S	*	*				167.6	118.8	116.2	32.5	0	0	0	0	108.7	Y237	T235-Y237 PolarHBondContact O-N 3.5Å
236	P	35.9	Very low	39	Very low	132 Å²	132	143.3 Å²	143.3	86%	0.857	71%	0.712	S	S	*	*			trans	-88.9	100.5	175.1	32.4	-24.8	0	0	0	108.6
237	Y	33.2	Very low	41.3	Very low	231 Å²	231	140.5 Å²	140.5	91%	0.906	69%	0.694	S	S	*	*			trans	-104.8	115.9	157.3	-141.2	-93.4	0	0	0	108.5	T235 Q239	T235-Y237 PolarHBondContact O-N 3.5Å; Y237-Q239 PolarHBondContact O-N 2.86Å
238	L	29.2	Very low	43.9	Very low	163 Å²	163	135.6 Å²	135.6	85%	0.853	67%	0.668	S	S	*	*			trans	-62.4	122.4	-178.4	-77.4	144.6	0	0	0	111.2
239	Q	31	Very low	46.6	Very low	182 Å²	182	127 Å²	127	85%	0.85	63%	0.63	S	S	*	*			trans	-143.3	125.3	139.8	-108.8	172.7	-8.4	0	0	107.6	Y237 V241	Y237-Q239 PolarHBondContact O-N 2.86Å; Q239-V241 PolarHBondContact O-N 2.57Å; Q239-V241 VanDerWaalsContact O-N 3.11Å
240	S	30.2	Very low	49.5	Very low	118 Å²	118	119.8 Å²	119.8	83%	0.825	60%	0.601	S	S	*	*			trans	-47.3	106.9	-171	45.7	0	0	0	0	113.7	D242	S240-D242 PolarHBondContact O-N 2.85Å
241	V	33.3	Very low	52.2	Low	105 Å²	105	115.7 Å²	115.7	64%	0.636	58%	0.582	S	S	*	*			trans	-75.8	103.9	168.2	-167.8	0	0	0	0	107.2	Q239 I243	Q239-V241 PolarHBondContact O-N 2.57Å; Q239-V241 VanDerWaalsContact O-N 3.11Å; V241-I243 VanDerWaalsContact C-N 3.34Å; V241-I243 HydrophobicContact CB-CD1 3.89Å; V241-I243 HydrophobicContact CB-CG1 3.9Å; V241-I243 HydrophobicContact CG1-CD1 4Å; V241-I243 HydrophobicContact CG1-CG1 3.5Å; V241-I243 WeakPolarHBondContact O-CD1 3.35Å; V241-I243 VanDerWaalsContact O-CG1 3.29Å; V241-I243 WeakPolarHBondContact O-CG1 3.44Å; V241-I243 PolarHBondContact O-N 3.44Å
242	D	41.4	Very low	55	Low	78 Å²	78	108 Å²	108	42%	0.417	55%	0.549	S	S	.	.			trans	-75.7	87.5	175	-178.2	43.9	0	0	0	108.8	S240 L244 N245 K249	S240-D242 PolarHBondContact O-N 2.85Å; D242-L244 VanDerWaalsContact C-N 3.34Å; D242-N245 PolarHBondContact OD1-ND2 3.18Å; D242-N245 PolarHBondContact OD2-ND2 3.46Å; D242-K249 VanDerWaalsContact CB-NZ 3.33Å; D242-K249 PolarHBondContact O-NZ 2.72Å; D242-K249 IonicContact OD2-NZ 3.97Å; D242-K249 PolarHBondContact OD2-NZ 3.17Å
243	I	45.4	Very low	57.9	Low	74 Å²	74	99.2 Å²	99.2	38%	0.379	52%	0.522	S	S	.	.			trans	-84.9	4	-169.3	-66.7	149.2	0	0	0	113	L227 V241	L227-I243 HydrophobicContact CD1-CD1 3.33Å; L227-I243 HydrophobicContact CD1-CG1 3.91Å; L227-I243 HydrophobicContact CD1-CG2 3.84Å; V241-I243 VanDerWaalsContact C-N 3.34Å; V241-I243 HydrophobicContact CB-CD1 3.89Å; V241-I243 HydrophobicContact CB-CG1 3.9Å; V241-I243 HydrophobicContact CG1-CD1 4Å; V241-I243 HydrophobicContact CG1-CG1 3.5Å; V241-I243 WeakPolarHBondContact O-CD1 3.35Å; V241-I243 VanDerWaalsContact O-CG1 3.29Å; V241-I243 WeakPolarHBondContact O-CG1 3.44Å; V241-I243 PolarHBondContact O-N 3.44Å
244	L	54.1	Low	60.7	Low	117 Å²	117	94.2 Å²	94.2	61%	0.613	50%	0.498	S	S	*	.	S	Bend	trans	-106.2	-8.8	-166.9	-78	164.8	0	0	0	116.2	L224 D242	L224-L244 HydrophobicContact CD2-CD2 3.93Å; D242-L244 VanDerWaalsContact C-N 3.34Å
245	N	63.2	Low	63.2	Low	75 Å²	75	89.1 Å²	89.1	40%	0.401	47%	0.474	S	S	.	.			trans	-114.5	119.7	-163.1	-64.5	-38.7	0	0	0	112.3	D242 A247	D242-N245 PolarHBondContact OD1-ND2 3.18Å; D242-N245 PolarHBondContact OD2-ND2 3.46Å; N245-A247 HydrophobicContact CB-CB 4.14Å; N245-A247 PolarHBondContact O-N 3.34Å
246	E	77.4	Confident	65.8	Low	105 Å²	105	83 Å²	83	49%	0.491	44%	0.436	S	S	.	.			trans	-57.9	81.5	161.7	-71.1	-178.5	171.2	0	0	109.1	F196 P197 F222	F196-E246 HydrophobicContact CD1-CB 3.99Å; F196-E246 HydrophobicContact CE1-CB 3.66Å; F196-E246 HydrophobicContact CE1-CG 4.16Å; F196-E246 HydrophobicContact CZ-CB 3.95Å; F196-E246 HydrophobicContact CZ-CG 4.22Å; P197-E246 WeakPolarHBondContact CD-O 3.36Å; P197-E246 WeakPolarHBondContact CG-O 3.31Å; F222-E246 WeakPolarHBondContact O-CA 3.22Å
247	A	86.5	Confident	68.3	Low	8 Å²	8	79.4 Å²	79.4	7%	0.066	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	151.3	-168.5	0	0	0	0	0	111.3	P197 F222 N245	P197-A247 HydrophobicContact CG-CB 4.13Å; P197-A247 CarbonylContact O-C 3.54Å; P197-A247 VanDerWaalsContact O-CA 3.28Å; P197-A247 WeakPolarHBondContact O-CA 3.38Å; F222-A247 PolarHBondContact N-O 2.8Å; F222-A247 PolarHBondContact O-N 3.5Å; N245-A247 HydrophobicContact CB-CB 4.14Å; N245-A247 PolarHBondContact O-N 3.34Å
248	V	88.9	Confident	70.8	Confident	1 Å²	1	69.5 Å²	69.5	1%	0.006	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	115.9	171	-173.4	0	0	0	0	108.4	F196 P197 I198 D199 L219 V220 F316	F196-V248 HydrophobicContact CB-CG2 4.1Å; P197-V248 PolarHBondContact O-N 2.79Å; I198-V248 HydrophobicContact CG1-CB 4.38Å; I198-V248 HydrophobicContact CG2-CB 4.46Å; D199-V248 WeakPolarHBondContact CB-O 3.48Å; D199-V248 PolarHBondContact N-O 3.21Å; L219-V248 HydrophobicContact CB-CG1 3.95Å; L219-V248 HydrophobicContact CD1-CG1 4.21Å; V220-V248 WeakPolarHBondContact O-CA 3.38Å; V248-F316 HydrophobicContact CB-CD2 4.45Å; V248-F316 HydrophobicContact CB-CE2 4.47Å; V248-F316 HydrophobicContact CG1-CD2 4.19Å; V248-F316 HydrophobicContact CG1-CE2 3.86Å; V248-F316 HydrophobicContact CG1-CZ 4.47Å; V248-F316 HydrophobicContact CG2-CD2 4.08Å
249	K	90.1	Very high	73.5	Confident	25 Å²	25	66.5 Å²	66.5	11%	0.109	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	157.6	-177.5	-60.3	-168.7	176.3	-173.8	0	111.6	D199 L219 V220 F222 D242	D199-K249 HydrophobicContact CB-CG 4.21Å; L219-K249 VanDerWaalsContact CA-O 3.31Å; L219-K249 WeakPolarHBondContact CA-O 3.25Å; V220-K249 HydrophobicContact CG1-CB 4.09Å; V220-K249 PolarHBondContact N-O 3.48Å; V220-K249 PolarHBondContact O-N 3.24Å; F222-K249 HydrophobicContact CD2-CB 4.2Å; F222-K249 HydrophobicContact CD2-CD 3.79Å; F222-K249 HydrophobicContact CD2-CG 4.08Å; F222-K249 HydrophobicContact CE2-CB 4.33Å; F222-K249 HydrophobicContact CE2-CD 4.11Å; D242-K249 VanDerWaalsContact CB-NZ 3.33Å; D242-K249 PolarHBondContact O-NZ 2.72Å; D242-K249 IonicContact OD2-NZ 3.97Å; D242-K249 PolarHBondContact OD2-NZ 3.17Å
250	L	92.6	Very high	76.3	Confident	53 Å²	53	61.8 Å²	61.8	28%	0.277	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	129.2	173.3	-177.1	65.1	0	0	0	110	D201 A202 A205 V217 L219 E252 A253	D201-L250 HydrophobicContact CB-CB 4.33Å; D201-L250 HydrophobicContact CB-CD2 4.31Å; A202-L250 HydrophobicContact CB-CB 4.18Å; A205-L250 HydrophobicContact CB-CD1 3.7Å; A205-L250 HydrophobicContact CB-CD2 3.85Å; A205-L250 HydrophobicContact CB-CG 4.41Å; V217-L250 HydrophobicContact CG1-CD1 3.73Å; L219-L250 HydrophobicContact CD2-CB 4.45Å; L219-L250 HydrophobicContact CD2-CD1 3.94Å; L250-E252 WeakPolarHBondContact CD1-O 3.31Å; L250-A253 HydrophobicContact CD1-CB 4.1Å; L250-A253 HydrophobicContact CD2-CB 4.26Å
251	E	90.6	Very high	79.3	Confident	90 Å²	90	56.1 Å²	56.1	42%	0.421	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	-48.9	170.7	-169.2	95.1	138.5	0	0	110.3	Q218 V220 R271	Q218-E251 HydrophobicContact CB-CB 4.43Å; Q218-E251 HydrophobicContact CG-CB 4.07Å; Q218-E251 PolarHBondContact O-N 3.31Å; V220-E251 HydrophobicContact CG1-CB 4.38Å; V220-E251 WeakPolarHBondContact CG1-OE2 3.45Å; E251-R271 IonicContact OE1-CZ 3.72Å; E251-R271 IonicContact OE1-NE 3.47Å; E251-R271 PolarHBondContact OE1-NE 2.98Å; E251-R271 IonicContact OE1-NH2 3.98Å; E251-R271 PolarHBondContact OE1-NH2 3.04Å
252	E	91.7	Very high	82.1	Confident	55 Å²	55	54.7 Å²	54.7	26%	0.257	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	141.1	-178.4	-170.2	-179	169.2	0	0	111.1	V217 Q218 L250 S254 H264	V217-E252 WeakPolarHBondContact CA-O 3.47Å; Q218-E252 HydrophobicContact CB-CB 4.11Å; Q218-E252 PolarHBondContact N-O 3.49Å; Q218-E252 PolarHBondContact O-N 3.23Å; L250-E252 WeakPolarHBondContact CD1-O 3.31Å; E252-S254 PolarHBondContact OE1-OG 3.12Å; E252-H264 IonicContact OE1-CE1 2.74Å; E252-H264 PolarHBondContact OE1-CE1 3.49Å; E252-H264 IonicContact OE1-ND1 3.47Å; E252-H264 PolarHBondContact OE1-ND1 2.9Å; E252-H264 IonicContact OE2-CE1 2.79Å; E252-H264 IonicContact OE2-CG 3.07Å; E252-H264 IonicContact OE2-ND1 3.28Å; E252-H264 PolarHBondContact OE2-ND1 3Å
253	A	94	Very high	84.4	Confident	30 Å²	30	58.4 Å²	58.4	25%	0.248	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	114.2	168.8	0	0	0	0	0	108.9	A205 I214 L250	A205-A253 HydrophobicContact CB-CB 3.89Å; I214-A253 HydrophobicContact CD1-CB 3.79Å; L250-A253 HydrophobicContact CD1-CB 4.1Å; L250-A253 HydrophobicContact CD2-CB 4.26Å
254	S	92.2	Very high	86.6	Confident	29 Å²	29	57.6 Å²	57.6	20%	0.203	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	170.9	-171	54	0	0	0	0	111.4	N215 Y216 E252 I256	N215-S254 PolarHBondContact OD1-O 2.85Å; Y216-S254 PolarHBondContact N-O 2.87Å; Y216-S254 PolarHBondContact O-N 2.9Å; E252-S254 PolarHBondContact OE1-OG 3.12Å; S254-I256 WeakPolarHBondContact OG-CD1 3.49Å; S254-I256 WeakPolarHBondContact OG-CG1 3.43Å
255	Q	90.9	Very high	88.3	Confident	67 Å²	67	52.4 Å²	52.4	31%	0.313	27%	0.269	S	S	.	.			trans	-99	107.2	172	-167.4	74.5	2	0	0	108.3	I214 N215 N283	I214-Q255 VanDerWaalsContact C-OE1 3.25Å; N215-Q255 VanDerWaalsContact CG-CD 3.47Å; N215-Q255 VanDerWaalsContact OD1-CA 3.27Å; N215-Q255 WeakPolarHBondContact OD1-CA 3.37Å; N215-Q255 PolarHBondContact OD1-OE1 3.38Å; Q255-N283 PolarHBondContact NE2-OD1 2.83Å
256	I	90.6	Very high	89.4	Confident	5 Å²	5	50.2 Å²	50.2	3%	0.026	26%	0.259	C	S	.	.			trans	-121.5	126.1	-174.4	-60.2	166	0	0	0	109.9	N215 Y216 S254 Q260 V261 H264 Y275	N215-I256 PolarHBondContact ND2-O 3.2Å; N215-I256 PolarHBondContact OD1-N 3.44Å; N215-I256 PolarHBondContact OD1-O 3.16Å; Y216-I256 HydrophobicContact CD1-CD1 3.3Å; Y216-I256 HydrophobicContact CD1-CG1 4.48Å; Y216-I256 HydrophobicContact CE1-CD1 3.73Å; Y216-I256 HydrophobicContact CG-CD1 3.72Å; S254-I256 WeakPolarHBondContact OG-CD1 3.49Å; S254-I256 WeakPolarHBondContact OG-CG1 3.43Å; I256-Q260 HydrophobicContact CG2-CB 3.64Å; I256-V261 HydrophobicContact CG2-CG2 3.95Å; I256-H264 HydrophobicContact CD1-CB 4.27Å; I256-H264 VanDerWaalsContact CD1-CD2 3.48Å; I256-H264 WeakPolarHBondContact CD1-CD2 3.43Å; I256-Y275 WeakPolarHBondContact O-CE2 3.38Å
257	P	88.2	Confident	89.7	Confident	56 Å²	56	49.2 Å²	49.2	36%	0.364	26%	0.26	S	S	.	.			trans	-60.7	152	168.5	-27.1	38.4	0	0	0	113.3	D259 Q260 V261	P257-D259 VanDerWaalsContact C-N 3.26Å; P257-D259 WeakPolarHBondContact CB-OD1 3.05Å; P257-D259 PolarHBondContact O-N 3.37Å; P257-D259 VanDerWaalsContact O-N 3.15Å; P257-Q260 PolarHBondContact O-N 2.78Å; P257-V261 PolarHBondContact O-N 3.18Å
258	C	85.9	Confident	89.5	Confident	23 Å²	23	52.5 Å²	52.5	16%	0.155	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-40.3	-174.7	-165.2	0	0	0	0	114	Q260 Y275 F345	C258-Q260 VanDerWaalsContact C-N 3.29Å; C258-Q260 PolarHBondContact O-N 2.8Å; C258-Y275 VanDerWaalsContact CA-OH 3.26Å; C258-Y275 WeakPolarHBondContact CA-OH 3.32Å; C258-Y275 PolarHBondContact N-OH 2.88Å; C258-F345 WeakPolarHBondContact SG-CD2 3.27Å; C258-F345 VanDerWaalsContact SG-CG 3.58Å
259	D	85.9	Confident	89.3	Confident	100 Å²	100	53.9 Å²	53.9	54%	0.535	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-20.8	179.7	61.2	-41.8	0	0	0	113.8	P257	P257-D259 VanDerWaalsContact C-N 3.26Å; P257-D259 WeakPolarHBondContact CB-OD1 3.05Å; P257-D259 PolarHBondContact O-N 3.37Å; P257-D259 VanDerWaalsContact O-N 3.15Å
260	Q	89.9	Confident	89.2	Confident	83 Å²	83	52.7 Å²	52.7	39%	0.388	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-16.3	-175.6	-68.5	176.7	31.1	0	0	113.4	I256 P257 C258 K262 M263 H264	I256-Q260 HydrophobicContact CG2-CB 3.64Å; P257-Q260 PolarHBondContact O-N 2.78Å; C258-Q260 VanDerWaalsContact C-N 3.29Å; C258-Q260 PolarHBondContact O-N 2.8Å; Q260-K262 PolarHBondContact O-N 3.28Å; Q260-K262 VanDerWaalsContact O-N 3.09Å; Q260-M263 WeakPolarHBondContact O-CB 3.42Å; Q260-M263 PolarHBondContact O-N 2.85Å; Q260-H264 PolarHBondContact O-CD2 3.14Å
261	V	91.5	Very high	89.1	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-51.8	-39.8	-179.1	179.3	0	0	0	0	111.8	Y216 I256 P257 M263 H264 I265 Y275 F293 I340 F345	Y216-V261 HydrophobicContact CD2-CG1 4.25Å; Y216-V261 HydrophobicContact CE2-CG1 3.84Å; I256-V261 HydrophobicContact CG2-CG2 3.95Å; P257-V261 PolarHBondContact O-N 3.18Å; V261-M263 PolarHBondContact O-N 2.8Å; V261-M263 VanDerWaalsContact O-N 3.11Å; V261-H264 PolarHBondContact O-N 2.83Å; V261-I265 HydrophobicContact CG1-CD1 4.44Å; V261-Y275 HydrophobicContact CG2-CD2 3.86Å; V261-Y275 HydrophobicContact CG2-CE2 3.54Å; V261-F293 HydrophobicContact CG1-CZ 3.89Å; V261-I340 HydrophobicContact CG1-CG2 4.45Å; V261-F345 HydrophobicContact CB-CE2 4.36Å; V261-F345 HydrophobicContact CB-CZ 4.19Å; V261-F345 HydrophobicContact CG1-CZ 4.08Å; V261-F345 HydrophobicContact CG2-CE2 4.45Å; V261-F345 HydrophobicContact CG2-CZ 4.23Å
262	K	92.1	Very high	89.3	Confident	74 Å²	74	47.1 Å²	47.1	32%	0.322	25%	0.253	S	S	.	.	H	α-helix	trans	-52.6	-32.9	176.4	-177.4	171.2	-179.9	165.4	0	114.2	Q260 H264 E338 I340	Q260-K262 PolarHBondContact O-N 3.28Å; Q260-K262 VanDerWaalsContact O-N 3.09Å; K262-H264 VanDerWaalsContact C-N 3.29Å; K262-H264 PolarHBondContact O-N 3.48Å; K262-E338 PolarHBondContact NZ-O 2.86Å; K262-I340 WeakPolarHBondContact CB-O 3.4Å; K262-I340 WeakPolarHBondContact CD-O 3.44Å
263	M	91.5	Very high	89.5	Confident	157 Å²	157	44.5 Å²	44.5	77%	0.773	24%	0.24	S	C	*	.	H	α-helix	trans	-73	-23.3	-177.6	-59.2	-169.6	-176.5	0	0	112.8	Q260 V261	Q260-M263 WeakPolarHBondContact O-CB 3.42Å; Q260-M263 PolarHBondContact O-N 2.85Å; V261-M263 PolarHBondContact O-N 2.8Å; V261-M263 VanDerWaalsContact O-N 3.11Å
264	H	90	Very high	89.6	Confident	57 Å²	57	43.1 Å²	43.1	26%	0.264	23%	0.229	S	C	.	.	H	α-helix	trans	-88.7	-9.5	-178.1	-67.4	-98.3	0	0	0	113	Y216 Q218 E252 I256 Q260 V261 K262 P266	Y216-H264 HydrophobicContact CE1-CB 4.17Å; Q218-H264 PolarHBondContact OE1-O 3.19Å; E252-H264 IonicContact OE1-CE1 2.74Å; E252-H264 PolarHBondContact OE1-CE1 3.49Å; E252-H264 IonicContact OE1-ND1 3.47Å; E252-H264 PolarHBondContact OE1-ND1 2.9Å; E252-H264 IonicContact OE2-CE1 2.79Å; E252-H264 IonicContact OE2-CG 3.07Å; E252-H264 IonicContact OE2-ND1 3.28Å; E252-H264 PolarHBondContact OE2-ND1 3Å; I256-H264 HydrophobicContact CD1-CB 4.27Å; I256-H264 VanDerWaalsContact CD1-CD2 3.48Å; I256-H264 WeakPolarHBondContact CD1-CD2 3.43Å; Q260-H264 PolarHBondContact O-CD2 3.14Å; V261-H264 PolarHBondContact O-N 2.83Å; K262-H264 VanDerWaalsContact C-N 3.29Å; K262-H264 PolarHBondContact O-N 3.48Å; H264-P266 WeakPolarHBondContact O-CD 3.34Å
265	I	90.3	Very high	89.7	Confident	7 Å²	7	42.2 Å²	42.2	4%	0.036	22%	0.221	C	C	.	.	S	Bend	trans	-84.9	118.9	-176.7	-60.2	175.6	0	0	0	110.2	V261 F293 T295 K337 I340	V261-I265 HydrophobicContact CG1-CD1 4.44Å; I265-F293 HydrophobicContact CD1-CE2 3.83Å; I265-F293 HydrophobicContact CD1-CZ 4.42Å; I265-T295 HydrophobicContact CD1-CG2 4.2Å; I265-T295 HydrophobicContact CG2-CG2 3.7Å; I265-K337 HydrophobicContact CB-CB 4.15Å; I265-K337 HydrophobicContact CG2-CB 3.83Å; I265-I340 HydrophobicContact CD1-CB 4.22Å; I265-I340 HydrophobicContact CD1-CD1 3.22Å; I265-I340 HydrophobicContact CD1-CG1 4.28Å; I265-I340 HydrophobicContact CD1-CG2 4.09Å
266	P	86.6	Confident	89.8	Confident	29 Å²	29	39 Å²	39	19%	0.188	21%	0.206	C	C	.	.			trans	-62.3	148.6	175.5	-22.4	35.5	0	0	0	112.1	H264 R271	H264-P266 WeakPolarHBondContact O-CD 3.34Å; P266-R271 HydrophobicContact CG-CG 3.73Å
267	T	84.2	Confident	89.7	Confident	84 Å²	84	39.7 Å²	39.7	52%	0.515	21%	0.209	S	C	.	.	S	Bend	trans	-92.8	-15	179.8	45.3	0	0	0	0	113.9	P297 K337	T267-P297 WeakPolarHBondContact O-CB 3.38Å; T267-K337 HydrophobicContact CG2-CD 3.52Å; T267-K337 HydrophobicContact CG2-CG 4.41Å
268	N	82.3	Confident	89.6	Confident	78 Å²	78	38 Å²	38	42%	0.417	20%	0.196	S	C	.	.	S	Bend	trans	-123	-14.3	-168	59.8	-24.1	0	0	0	113.5	G300 S301	N268-G300 CarbonylContact O-C 3.58Å; N268-S301 PolarHBondContact O-N 2.63Å
269	C	83.5	Confident	88.9	Confident	30 Å²	30	45.8 Å²	45.8	20%	0.203	22%	0.222	C	C	.	.	S	Bend	trans	-129	140.4	-178.5	-60.1	0	0	0	0	111.1
270	P	88.2	Confident	88	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.228	C	C	.	.			trans	-66.2	147.8	175.2	25.2	-31.5	0	0	0	112	Y294 T295 L296 E305 Y309	P270-Y294 HydrophobicContact CB-CE2 3.85Å; P270-T295 WeakPolarHBondContact CA-O 3.38Å; P270-T295 WeakPolarHBondContact CB-O 3.3Å; P270-L296 HydrophobicContact CB-CD1 3.99Å; P270-E305 HydrophobicContact CG-CB 4.21Å; P270-Y309 HydrophobicContact CB-CD1 3.96Å; P270-Y309 HydrophobicContact CB-CD2 3.99Å; P270-Y309 HydrophobicContact CB-CE1 4.03Å; P270-Y309 HydrophobicContact CB-CE2 4.06Å; P270-Y309 HydrophobicContact CB-CG 3.92Å; P270-Y309 HydrophobicContact CG-CD1 4.45Å; P270-Y309 HydrophobicContact CG-CD2 3.61Å; P270-Y309 HydrophobicContact CG-CE1 4.38Å; P270-Y309 HydrophobicContact CG-CE2 3.53Å; P270-Y309 HydrophobicContact CG-CG 4.07Å; P270-Y309 WeakPolarHBondContact O-CE1 3.07Å; P270-Y309 PolarHBondContact O-OH 3.31Å
271	R	91.4	Very high	86.6	Confident	26 Å²	26	46 Å²	46	10%	0.098	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	148.5	176.8	-69.2	-64.5	-178	-88.8	4.3	111.1	Q218 L219 E251 P266 H273 T295	Q218-R271 HydrophobicContact CG-CB 4.22Å; Q218-R271 HydrophobicContact CG-CG 4.23Å; L219-R271 WeakPolarHBondContact O-CD 3.38Å; E251-R271 IonicContact OE1-CZ 3.72Å; E251-R271 IonicContact OE1-NE 3.47Å; E251-R271 PolarHBondContact OE1-NE 2.98Å; E251-R271 IonicContact OE1-NH2 3.98Å; E251-R271 PolarHBondContact OE1-NH2 3.04Å; P266-R271 HydrophobicContact CG-CG 3.73Å; R271-H273 VanDerWaalsContact CB-NE2 3.28Å; R271-H273 WeakPolarHBondContact CB-NE2 3.38Å; R271-H273 PolarHBondContact O-CD2 2.72Å; R271-T295 PolarHBondContact N-O 3.47Å; R271-T295 VanDerWaalsContact N-O 3.13Å; R271-T295 PolarHBondContact N-OG1 3.25Å; R271-T295 PolarHBondContact O-N 3.35Å; R271-T295 PolarHBondContact O-OG1 2.91Å
272	Y	95.1	Very high	85.1	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	141.6	165.3	-69.2	-28.7	0	0	0	109.3	Q218 L219 C221 F292 Y294 Y309 K313 F316	Q218-Y272 WeakPolarHBondContact CA-O 3.4Å; L219-Y272 PolarHBondContact N-O 3.1Å; L219-Y272 PolarHBondContact O-N 3.36Å; C221-Y272 WeakPolarHBondContact SG-CE2 3.49Å; Y272-F292 AromaticContact CD1-CE2 3.84Å; Y272-F292 HydrophobicContact CD1-CE2 3.84Å; Y272-F292 AromaticContact CD1-CZ 3.52Å; Y272-F292 HydrophobicContact CD1-CZ 3.52Å; Y272-F292 AromaticContact CE1-CZ 3.94Å; Y272-F292 HydrophobicContact CE1-CZ 3.94Å; Y272-F292 AromaticContact CG-CE2 3.83Å; Y272-F292 HydrophobicContact CG-CE2 3.83Å; Y272-F292 HydrophobicContact CG-CZ 4.01Å; Y272-Y294 AromaticContact CD1-CD2 3.89Å; Y272-Y294 HydrophobicContact CD1-CD2 3.89Å; Y272-Y294 HydrophobicContact CD1-CG 4.11Å; Y272-Y294 AromaticContact CE1-CD2 3.93Å; Y272-Y294 HydrophobicContact CE1-CD2 3.93Å; Y272-Y294 HydrophobicContact CE1-CE2 4.46Å; Y272-Y294 HydrophobicContact CE1-CG 4.01Å; Y272-Y309 AromaticContact CD1-CD1 3.96Å; Y272-Y309 HydrophobicContact CD1-CD1 3.96Å; Y272-Y309 HydrophobicContact CD1-CE1 4.43Å; Y272-Y309 AromaticContact CE1-CD1 3.67Å; Y272-Y309 HydrophobicContact CE1-CD1 3.67Å; Y272-Y309 HydrophobicContact CE1-CG 4.49Å; Y272-Y309 HydrophobicContact CE2-CD1 4.38Å; Y272-Y309 HydrophobicContact CG-CD1 4.42Å; Y272-Y309 AromaticContact CZ-CD1 3.89Å; Y272-Y309 PolarHBondContact OH-O 3.2Å; Y272-K313 HydrophobicContact CE1-CB 4.38Å; Y272-K313 HydrophobicContact CE1-CG 4.49Å; Y272-K313 VanDerWaalsContact OH-CA 3.29Å; Y272-K313 WeakPolarHBondContact OH-CA 3.5Å; Y272-K313 PolarHBondContact OH-N 3.29Å; Y272-K313 VanDerWaalsContact OH-N 3.08Å; Y272-F316 AromaticContact CD2-CD1 3.88Å; Y272-F316 HydrophobicContact CD2-CD1 3.88Å; Y272-F316 AromaticContact CD2-CE1 3.86Å; Y272-F316 HydrophobicContact CD2-CE1 3.86Å; Y272-F316 AromaticContact CE2-CD1 3.85Å; Y272-F316 HydrophobicContact CE2-CD1 3.85Å; Y272-F316 HydrophobicContact CE2-CE1 4.31Å; Y272-F316 HydrophobicContact CE2-CG 4.25Å
273	H	95.5	Very high	83.7	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	137.9	-178.3	-52.7	-91.8	0	0	0	109.8	Y216 V217 R271 F292 F293 T295	Y216-H273 HydrophobicContact CE2-CB 4.14Å; Y216-H273 AromaticContact CE2-ND1 3.76Å; Y216-H273 AromaticContact CZ-ND1 3.56Å; Y216-H273 PolarHBondContact OH-CE1 2.73Å; Y216-H273 VanDerWaalsContact OH-CE1 3.31Å; Y216-H273 PolarHBondContact OH-ND1 3.42Å; V217-H273 CarbonylContact O-C 3.52Å; V217-H273 WeakPolarHBondContact O-CA 3.34Å; R271-H273 VanDerWaalsContact CB-NE2 3.28Å; R271-H273 WeakPolarHBondContact CB-NE2 3.38Å; R271-H273 PolarHBondContact O-CD2 2.72Å; H273-F292 WeakPolarHBondContact O-CA 3.34Å; H273-F293 HydrophobicContact CB-CD1 3.82Å; H273-F293 HydrophobicContact CB-CD2 3.72Å; H273-F293 HydrophobicContact CB-CE1 3.45Å; H273-F293 VanDerWaalsContact CB-CE1 3.45Å; H273-F293 HydrophobicContact CB-CE2 3.32Å; H273-F293 HydrophobicContact CB-CG 3.95Å; H273-F293 HydrophobicContact CB-CZ 3.19Å; H273-F293 AromaticContact CD2-CD2 3.59Å; H273-F293 AromaticContact CD2-CE2 3.35Å; H273-F293 WeakPolarHBondContact CD2-CE2 3.36Å; H273-F293 PolarHBondContact CD2-O 2.81Å; H273-F293 AromaticContact CG-CD2 3.83Å; H273-F293 AromaticContact CG-CE2 3.28Å; H273-F293 AromaticContact CG-CZ 3.57Å; H273-F293 PolarHBondContact N-O 3.18Å; H273-F293 AromaticContact ND1-CE2 3.98Å; H273-F293 PolarHBondContact O-N 2.82Å; H273-T295 WeakPolarHBondContact NE2-CG2 3.39Å; H273-T295 PolarHBondContact NE2-OG1 3.1Å
274	F	96.2	Very high	82.3	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	132.3	165.5	-71.6	-100.8	0	0	0	108.5	L206 L209 Y216 V217 L219 V290 I291 F292 F316 L317 V320 I328	L206-F274 HydrophobicContact CD2-CB 4.41Å; L206-F274 HydrophobicContact CD2-CD1 4.26Å; L206-F274 HydrophobicContact CD2-CD2 3.65Å; L206-F274 HydrophobicContact CD2-CE1 4.44Å; L206-F274 HydrophobicContact CD2-CE2 3.88Å; L206-F274 HydrophobicContact CD2-CG 3.85Å; L206-F274 HydrophobicContact CD2-CZ 4.27Å; L209-F274 HydrophobicContact CD2-CB 3.53Å; L209-F274 HydrophobicContact CD2-CD1 4.35Å; L209-F274 HydrophobicContact CD2-CG 4.26Å; Y216-F274 WeakPolarHBondContact CA-O 3.43Å; V217-F274 HydrophobicContact CB-CB 4.35Å; V217-F274 PolarHBondContact N-O 2.72Å; V217-F274 PolarHBondContact O-N 3.25Å; L219-F274 HydrophobicContact CD1-CD2 4.34Å; L219-F274 HydrophobicContact CD1-CE2 4.06Å; F274-V290 HydrophobicContact CD1-CG1 4.35Å; F274-I291 WeakPolarHBondContact CA-O 3.34Å; F274-F292 HydrophobicContact CD2-CD2 4.24Å; F274-F292 HydrophobicContact CE1-CB 4.29Å; F274-F292 HydrophobicContact CE1-CD2 4.12Å; F274-F292 AromaticContact CE2-CD2 3.75Å; F274-F292 HydrophobicContact CE2-CD2 3.75Å; F274-F292 HydrophobicContact CE2-CE2 4.18Å; F274-F292 AromaticContact CZ-CD2 3.69Å; F274-F292 HydrophobicContact CZ-CD2 3.69Å; F274-F292 HydrophobicContact CZ-CE2 4.34Å; F274-F316 AromaticContact CE2-CE1 3.63Å; F274-F316 HydrophobicContact CE2-CE1 3.63Å; F274-F316 AromaticContact CE2-CZ 3.75Å; F274-F316 HydrophobicContact CE2-CZ 3.75Å; F274-F316 AromaticContact CZ-CE1 3.8Å; F274-F316 HydrophobicContact CZ-CE1 3.8Å; F274-F316 HydrophobicContact CZ-CZ 4.08Å; F274-L317 HydrophobicContact CE1-CD2 4.46Å; F274-L317 HydrophobicContact CZ-CD2 3.88Å; F274-V320 HydrophobicContact CE1-CG1 3.93Å; F274-V320 HydrophobicContact CZ-CB 4.45Å; F274-V320 HydrophobicContact CZ-CG1 3.96Å; F274-V320 HydrophobicContact CZ-CG2 4.22Å; F274-I328 HydrophobicContact CE1-CD1 3.6Å; F274-I328 HydrophobicContact CE1-CG1 4.06Å; F274-I328 HydrophobicContact CZ-CD1 4.21Å
275	Y	94.6	Very high	81.3	Confident	10 Å²	10	44.9 Å²	44.9	4%	0.039	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	125.8	176.3	-172.9	-106.2	0	0	0	110.7	N215 Y216 I256 C258 V261 L277 I291 F345	N215-Y275 CarbonylContact O-C 3.51Å; N215-Y275 VanDerWaalsContact O-CA 3.27Å; N215-Y275 WeakPolarHBondContact O-CA 3.42Å; N215-Y275 WeakPolarHBondContact O-CD2 3.18Å; Y216-Y275 HydrophobicContact CD2-CD2 4.14Å; I256-Y275 WeakPolarHBondContact O-CE2 3.38Å; C258-Y275 VanDerWaalsContact CA-OH 3.26Å; C258-Y275 WeakPolarHBondContact CA-OH 3.32Å; C258-Y275 PolarHBondContact N-OH 2.88Å; V261-Y275 HydrophobicContact CG2-CD2 3.86Å; V261-Y275 HydrophobicContact CG2-CE2 3.54Å; Y275-L277 HydrophobicContact CD1-CB 4.34Å; Y275-L277 HydrophobicContact CE1-CB 4.2Å; Y275-L277 HydrophobicContact CE1-CD1 3.91Å; Y275-I291 PolarHBondContact N-O 3.18Å; Y275-I291 PolarHBondContact O-N 2.98Å; Y275-F345 AromaticContact CD1-CD1 3.71Å; Y275-F345 HydrophobicContact CD1-CD1 3.71Å; Y275-F345 AromaticContact CD1-CE1 3.46Å; Y275-F345 HydrophobicContact CD1-CE1 3.46Å; Y275-F345 VanDerWaalsContact CD1-CE1 3.46Å; Y275-F345 HydrophobicContact CD1-CZ 4.16Å; Y275-F345 HydrophobicContact CE1-CD1 4Å; Y275-F345 AromaticContact CE1-CE1 4Å; Y275-F345 HydrophobicContact CE1-CE1 4Å; Y275-F345 HydrophobicContact CE1-CG 4.46Å; Y275-F345 HydrophobicContact CE1-CZ 4.44Å; Y275-F345 AromaticContact CG-CE1 3.98Å; Y275-F345 HydrophobicContact CG-CE1 3.98Å; Y275-F345 HydrophobicContact CG-CZ 4.47Å
276	A	92.9	Very high	80.6	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	100.4	175.9	0	0	0	0	0	109.6	L209 N215 I287	L209-A276 HydrophobicContact CD1-CB 3.91Å; L209-A276 HydrophobicContact CG-CB 4.44Å; N215-A276 HydrophobicContact CB-CB 4.32Å; N215-A276 PolarHBondContact O-N 3.18Å; A276-I287 HydrophobicContact CB-CD1 3.81Å; A276-I287 HydrophobicContact CB-CG1 4.01Å; A276-I287 HydrophobicContact CB-CG2 3.95Å
277	L	88.7	Confident	80.1	Confident	19 Å²	19	50.1 Å²	50.1	10%	0.099	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	130	178.7	-175.9	68.4	0	0	0	110.5	Y275 V288 L289 I291 F345 L349	Y275-L277 HydrophobicContact CD1-CB 4.34Å; Y275-L277 HydrophobicContact CE1-CB 4.2Å; Y275-L277 HydrophobicContact CE1-CD1 3.91Å; L277-V288 PolarHBondContact O-N 3.41Å; L277-L289 HydrophobicContact CB-CB 4.22Å; L277-L289 HydrophobicContact CD2-CD2 4.47Å; L277-L289 PolarHBondContact N-O 3.15Å; L277-L289 PolarHBondContact O-N 2.95Å; L277-I291 HydrophobicContact CB-CD1 4.33Å; L277-I291 HydrophobicContact CD2-CD1 4.5Å; L277-F345 HydrophobicContact CD1-CB 4.22Å; L277-F345 HydrophobicContact CD2-CB 4.37Å; L277-L349 HydrophobicContact CD2-CB 4.14Å; L277-L349 HydrophobicContact CD2-CD1 4.37Å; L277-L349 HydrophobicContact CD2-CD2 4.36Å
278	R	85.2	Confident	79.8	Confident	20 Å²	20	48.1 Å²	48.1	8%	0.075	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	147.9	176.5	-61.5	-179.3	-176.2	-113.4	11.9	110	D212 D280 G281 N283 S285	D212-R278 VanDerWaalsContact CG-CZ 3.48Å; D212-R278 PolarHBondContact O-NH2 3.5Å; D212-R278 IonicContact OD1-CZ 3.48Å; D212-R278 IonicContact OD1-NE 3.5Å; D212-R278 IonicContact OD1-NH1 3.19Å; D212-R278 PolarHBondContact OD1-NH1 3.28Å; D212-R278 IonicContact OD1-NH2 3.56Å; D212-R278 PolarHBondContact OD1-NH2 2.91Å; D212-R278 IonicContact OD2-CZ 2.72Å; D212-R278 VanDerWaalsContact OD2-CZ 3.26Å; D212-R278 IonicContact OD2-NH1 3.97Å; D212-R278 PolarHBondContact OD2-NH1 2.74Å; D212-R278 IonicContact OD2-NH2 3.62Å; D212-R278 PolarHBondContact OD2-NH2 3.47Å; D212-R278 VanDerWaalsContact OD2-NH2 3.17Å; R278-D280 VanDerWaalsContact C-N 3.34Å; R278-D280 PolarHBondContact O-N 3.12Å; R278-G281 PolarHBondContact O-N 3.31Å; R278-N283 PolarHBondContact NH1-O 3.07Å; R278-N283 VanDerWaalsContact NH1-O 3.09Å; R278-S285 WeakPolarHBondContact CB-OG 3.47Å; R278-S285 WeakPolarHBondContact CD-O 3.41Å; R278-S285 PolarHBondContact NH1-O 2.94Å
279	R	71.3	Confident	80.1	Confident	187 Å²	187	45 Å²	45	71%	0.706	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-42.1	-171	-172.2	168.9	-87	152.7	-5.2	113.2	V288	R279-V288 HydrophobicContact CB-CG2 3.73Å
280	D	66.6	Low	80.6	Confident	125 Å²	125	44.3 Å²	44.3	67%	0.668	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	10.3	-170.7	-60.8	-32.9	0	0	0	112.7	R278 A282 S285	R278-D280 VanDerWaalsContact C-N 3.34Å; R278-D280 PolarHBondContact O-N 3.12Å; D280-A282 PolarHBondContact O-N 3.35Å; D280-S285 PolarHBondContact N-OG 3.4Å
281	G	60.3	Low	80.9	Confident	63 Å²	63	44.3 Å²	44.3	65%	0.649	26%	0.263	S	S	*	.	S	Bend	trans	64.3	-20.3	-172.9	0	0	0	0	0	114.8	R278	R278-G281 PolarHBondContact O-N 3.31Å
282	A	60.6	Low	81.1	Confident	53 Å²	53	43.1 Å²	43.1	44%	0.438	26%	0.258	S	S	.	.	S	Bend	trans	-82.3	139.9	175.9	0	0	0	0	0	111.5	D280 A284 S285	D280-A282 PolarHBondContact O-N 3.35Å; A282-A284 PolarHBondContact O-N 3.41Å; A282-S285 PolarHBondContact O-N 3.46Å; A282-S285 PolarHBondContact O-OG 2.92Å
283	N	62.1	Low	81	Confident	99 Å²	99	43.1 Å²	43.1	53%	0.529	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-2.4	-179.8	-64.2	-15.4	0	0	0	115.1	Q255 R278	Q255-N283 PolarHBondContact NE2-OD1 2.83Å; R278-N283 PolarHBondContact NH1-O 3.07Å; R278-N283 VanDerWaalsContact NH1-O 3.09Å
284	A	63.3	Low	80.9	Confident	102 Å²	102	43.2 Å²	43.2	84%	0.843	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-18	179.7	0	0	0	0	0	113.6	A282	A282-A284 PolarHBondContact O-N 3.41Å
285	S	67.5	Low	80.7	Confident	11 Å²	11	43.5 Å²	43.5	8%	0.077	26%	0.26	C	S	.	.	S	Bend	trans	-90.6	145	-179.1	57.3	0	0	0	0	111.3	R278 D280 A282	R278-S285 WeakPolarHBondContact CB-OG 3.47Å; R278-S285 WeakPolarHBondContact CD-O 3.41Å; R278-S285 PolarHBondContact NH1-O 2.94Å; D280-S285 PolarHBondContact N-OG 3.4Å; A282-S285 PolarHBondContact O-N 3.46Å; A282-S285 PolarHBondContact O-OG 2.92Å
286	P	76.7	Confident	80.4	Confident	99 Å²	99	45.1 Å²	45.1	64%	0.643	27%	0.269	S	S	*	.	P	Polyproline II helix	trans	-63.5	153.3	179	27.2	-34.8	0	0	0	111	V288	P286-V288 PolarHBondContact O-N 3.02Å
287	I	75.1	Confident	80	Confident	47 Å²	47	45.7 Å²	45.7	24%	0.241	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	125	171.2	-57.8	174.2	0	0	0	108.6	D212 A276 V290	D212-I287 HydrophobicContact CB-CD1 3.9Å; D212-I287 HydrophobicContact CB-CG1 4.32Å; D212-I287 WeakPolarHBondContact OD1-CD1 3.45Å; D212-I287 WeakPolarHBondContact OD1-CG1 3.3Å; A276-I287 HydrophobicContact CB-CD1 3.81Å; A276-I287 HydrophobicContact CB-CG1 4.01Å; A276-I287 HydrophobicContact CB-CG2 3.95Å; I287-V290 HydrophobicContact CG2-CG2 3.89Å
288	V	79.5	Confident	79.6	Confident	42 Å²	42	49.6 Å²	49.6	26%	0.255	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	-41	176.1	-175.5	0	0	0	0	110.1	L277 R279 P286 Q329 L349	L277-V288 PolarHBondContact O-N 3.41Å; R279-V288 HydrophobicContact CB-CG2 3.73Å; P286-V288 PolarHBondContact O-N 3.02Å; V288-Q329 PolarHBondContact O-NE2 3.06Å; V288-L349 HydrophobicContact CG1-CD1 3.73Å
289	L	88.2	Confident	79.4	Confident	12 Å²	12	56.1 Å²	56.1	6%	0.063	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	121.9	-170.3	-166.9	76.6	0	0	0	111.7	L277 I291 Q329 R330 L349	L277-L289 HydrophobicContact CB-CB 4.22Å; L277-L289 HydrophobicContact CD2-CD2 4.47Å; L277-L289 PolarHBondContact N-O 3.15Å; L277-L289 PolarHBondContact O-N 2.95Å; L289-I291 HydrophobicContact CD2-CD1 3.85Å; L289-I291 HydrophobicContact CD2-CG1 3.64Å; L289-I291 HydrophobicContact CG-CD1 4.49Å; L289-I291 HydrophobicContact CG-CG1 3.87Å; L289-Q329 HydrophobicContact CD1-CB 3.3Å; L289-Q329 HydrophobicContact CD1-CG 4.04Å; L289-Q329 HydrophobicContact CG-CB 4.26Å; L289-R330 HydrophobicContact CD1-CG 4.25Å; L289-R330 HydrophobicContact CD2-CG 3.99Å; L289-R330 HydrophobicContact CG-CG 4.45Å; L289-L349 HydrophobicContact CB-CD1 4.18Å; L289-L349 HydrophobicContact CD2-CD1 4.22Å
290	V	92.7	Very high	79.6	Confident	15 Å²	15	50.1 Å²	50.1	9%	0.091	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	118.8	166	-175.8	0	0	0	0	109.4	L209 F274 I287 I326 Q329	L209-V290 HydrophobicContact CD2-CG1 4.35Å; F274-V290 HydrophobicContact CD1-CG1 4.35Å; I287-V290 HydrophobicContact CG2-CG2 3.89Å; V290-I326 HydrophobicContact CB-CG2 4.34Å; V290-I326 HydrophobicContact CG1-CG2 3.73Å; V290-I326 HydrophobicContact CG2-CG2 4.45Å; V290-Q329 PolarHBondContact O-N 3.02Å
291	I	94.2	Very high	80.2	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	125.3	-177.7	-55.5	165.7	0	0	0	108	F274 Y275 L277 L289 F293 R330 F345 L348	F274-I291 WeakPolarHBondContact CA-O 3.34Å; Y275-I291 PolarHBondContact N-O 3.18Å; Y275-I291 PolarHBondContact O-N 2.98Å; L277-I291 HydrophobicContact CB-CD1 4.33Å; L277-I291 HydrophobicContact CD2-CD1 4.5Å; L289-I291 HydrophobicContact CD2-CD1 3.85Å; L289-I291 HydrophobicContact CD2-CG1 3.64Å; L289-I291 HydrophobicContact CG-CD1 4.49Å; L289-I291 HydrophobicContact CG-CG1 3.87Å; I291-F293 HydrophobicContact CG2-CD1 4.21Å; I291-R330 HydrophobicContact CG1-CB 4.32Å; I291-R330 HydrophobicContact CG2-CB 4.22Å; I291-F345 HydrophobicContact CD1-CD1 3.63Å; I291-F345 HydrophobicContact CD1-CE1 4.27Å; I291-L348 HydrophobicContact CD1-CB 4.46Å; I291-L348 HydrophobicContact CD1-CD1 4.17Å; I291-L348 HydrophobicContact CG2-CD1 3.97Å
292	F	96	Very high	81.2	Confident	1 Å²	1	44.2 Å²	44.2	0%	0.004	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	129.3	162	169.8	-97.4	0	0	0	108.7	Y272 H273 F274 K313 F316 L317 I328 R330 K331 V332	Y272-F292 AromaticContact CD1-CE2 3.84Å; Y272-F292 HydrophobicContact CD1-CE2 3.84Å; Y272-F292 AromaticContact CD1-CZ 3.52Å; Y272-F292 HydrophobicContact CD1-CZ 3.52Å; Y272-F292 AromaticContact CE1-CZ 3.94Å; Y272-F292 HydrophobicContact CE1-CZ 3.94Å; Y272-F292 AromaticContact CG-CE2 3.83Å; Y272-F292 HydrophobicContact CG-CE2 3.83Å; Y272-F292 HydrophobicContact CG-CZ 4.01Å; H273-F292 WeakPolarHBondContact O-CA 3.34Å; F274-F292 HydrophobicContact CD2-CD2 4.24Å; F274-F292 HydrophobicContact CE1-CB 4.29Å; F274-F292 HydrophobicContact CE1-CD2 4.12Å; F274-F292 AromaticContact CE2-CD2 3.75Å; F274-F292 HydrophobicContact CE2-CD2 3.75Å; F274-F292 HydrophobicContact CE2-CE2 4.18Å; F274-F292 AromaticContact CZ-CD2 3.69Å; F274-F292 HydrophobicContact CZ-CD2 3.69Å; F274-F292 HydrophobicContact CZ-CE2 4.34Å; F292-K313 HydrophobicContact CE1-CD 3.89Å; F292-K313 HydrophobicContact CE1-CG 3.93Å; F292-K313 HydrophobicContact CZ-CD 4.34Å; F292-K313 HydrophobicContact CZ-CG 3.97Å; F292-F316 HydrophobicContact CE2-CE1 4.27Å; F292-L317 HydrophobicContact CB-CD2 4.38Å; F292-L317 HydrophobicContact CD1-CD1 3.91Å; F292-L317 HydrophobicContact CD1-CD2 4.05Å; F292-L317 HydrophobicContact CD2-CD2 3.55Å; F292-L317 HydrophobicContact CE1-CD1 3.92Å; F292-L317 HydrophobicContact CE1-CD2 4.2Å; F292-L317 HydrophobicContact CE2-CD2 3.68Å; F292-L317 HydrophobicContact CG-CD1 4.37Å; F292-L317 HydrophobicContact CG-CD2 3.71Å; F292-L317 HydrophobicContact CZ-CD1 4.36Å; F292-L317 HydrophobicContact CZ-CD2 4.01Å; F292-L317 HydrophobicContact CZ-CG 4.48Å; F292-I328 HydrophobicContact CB-CD1 4.45Å; F292-I328 HydrophobicContact CB-CG2 3.66Å; F292-R330 PolarHBondContact N-O 3.47Å; F292-K331 HydrophobicContact CB-CG 4.45Å; F292-K331 HydrophobicContact CD1-CB 4.3Å; F292-K331 HydrophobicContact CD1-CG 4.34Å; F292-K331 CarbonylContact O-C 3.55Å; F292-K331 WeakPolarHBondContact O-CA 3.47Å; F292-V332 PolarHBondContact O-N 3.01Å
293	F	94.3	Very high	82.3	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	141.2	168.1	62.4	-83	0	0	0	111.9	Y216 V261 I265 H273 I291 T295 V332 I340 F345	Y216-F293 HydrophobicContact CE2-CZ 4.24Å; V261-F293 HydrophobicContact CG1-CZ 3.89Å; I265-F293 HydrophobicContact CD1-CE2 3.83Å; I265-F293 HydrophobicContact CD1-CZ 4.42Å; H273-F293 HydrophobicContact CB-CD1 3.82Å; H273-F293 HydrophobicContact CB-CD2 3.72Å; H273-F293 HydrophobicContact CB-CE1 3.45Å; H273-F293 VanDerWaalsContact CB-CE1 3.45Å; H273-F293 HydrophobicContact CB-CE2 3.32Å; H273-F293 HydrophobicContact CB-CG 3.95Å; H273-F293 HydrophobicContact CB-CZ 3.19Å; H273-F293 AromaticContact CD2-CD2 3.59Å; H273-F293 AromaticContact CD2-CE2 3.35Å; H273-F293 WeakPolarHBondContact CD2-CE2 3.36Å; H273-F293 PolarHBondContact CD2-O 2.81Å; H273-F293 AromaticContact CG-CD2 3.83Å; H273-F293 AromaticContact CG-CE2 3.28Å; H273-F293 AromaticContact CG-CZ 3.57Å; H273-F293 PolarHBondContact N-O 3.18Å; H273-F293 AromaticContact ND1-CE2 3.98Å; H273-F293 PolarHBondContact O-N 2.82Å; I291-F293 HydrophobicContact CG2-CD1 4.21Å; F293-T295 HydrophobicContact CD2-CG2 3.86Å; F293-T295 HydrophobicContact CE2-CG2 4.01Å; F293-V332 CarbonylContact C-O 3.58Å; F293-V332 WeakPolarHBondContact CA-O 3.33Å; F293-V332 HydrophobicContact CB-CB 4.23Å; F293-I340 HydrophobicContact CD2-CD1 3.92Å; F293-I340 HydrophobicContact CE2-CD1 3.78Å; F293-F345 HydrophobicContact CE1-CE1 4.35Å
294	Y	92.3	Very high	83.3	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.008	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	117.6	178	166	-148	0	0	0	108.1	P270 Y272 L296 Y309 V332 E333 V334	P270-Y294 HydrophobicContact CB-CE2 3.85Å; Y272-Y294 AromaticContact CD1-CD2 3.89Å; Y272-Y294 HydrophobicContact CD1-CD2 3.89Å; Y272-Y294 HydrophobicContact CD1-CG 4.11Å; Y272-Y294 AromaticContact CE1-CD2 3.93Å; Y272-Y294 HydrophobicContact CE1-CD2 3.93Å; Y272-Y294 HydrophobicContact CE1-CE2 4.46Å; Y272-Y294 HydrophobicContact CE1-CG 4.01Å; Y294-L296 HydrophobicContact CE1-CB 4.38Å; Y294-L296 HydrophobicContact CE1-CD2 4.42Å; Y294-L296 HydrophobicContact CE2-CB 4.06Å; Y294-L296 HydrophobicContact CE2-CD1 4.18Å; Y294-L296 WeakPolarHBondContact OH-CD1 3.5Å; Y294-Y309 HydrophobicContact CD2-CD1 4.19Å; Y294-Y309 AromaticContact CE2-CD1 3.74Å; Y294-Y309 HydrophobicContact CE2-CD1 3.74Å; Y294-Y309 HydrophobicContact CE2-CG 4.01Å; Y294-Y309 VanDerWaalsContact CZ-CB 3.49Å; Y294-Y309 WeakPolarHBondContact OH-CB 2.97Å; Y294-V332 PolarHBondContact N-O 3.41Å; Y294-E333 HydrophobicContact CD1-CG 4.16Å; Y294-V334 PolarHBondContact O-N 2.77Å
295	T	92.1	Very high	84.1	Confident	6 Å²	6	44.7 Å²	44.7	4%	0.037	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	125.7	175.9	57.4	0	0	0	0	109.9	I265 P270 R271 H273 F293 V334 I340	I265-T295 HydrophobicContact CD1-CG2 4.2Å; I265-T295 HydrophobicContact CG2-CG2 3.7Å; P270-T295 WeakPolarHBondContact CA-O 3.38Å; P270-T295 WeakPolarHBondContact CB-O 3.3Å; R271-T295 PolarHBondContact N-O 3.47Å; R271-T295 VanDerWaalsContact N-O 3.13Å; R271-T295 PolarHBondContact N-OG1 3.25Å; R271-T295 PolarHBondContact O-N 3.35Å; R271-T295 PolarHBondContact O-OG1 2.91Å; H273-T295 WeakPolarHBondContact NE2-CG2 3.39Å; H273-T295 PolarHBondContact NE2-OG1 3.1Å; F293-T295 HydrophobicContact CD2-CG2 3.86Å; F293-T295 HydrophobicContact CE2-CG2 4.01Å; T295-V334 CarbonylContact C-O 3.59Å; T295-V334 VanDerWaalsContact CA-O 3.31Å; T295-V334 WeakPolarHBondContact CA-O 3.38Å; T295-I340 HydrophobicContact CG2-CD1 3.96Å
296	L	89.1	Confident	85	Confident	44 Å²	44	47.7 Å²	47.7	23%	0.23	27%	0.272	C	S	.	.			trans	-128.5	89.7	-178.9	-174.1	60.7	0	0	0	109.9	P270 Y294 S298 R306 V334 D335	P270-L296 HydrophobicContact CB-CD1 3.99Å; Y294-L296 HydrophobicContact CE1-CB 4.38Å; Y294-L296 HydrophobicContact CE1-CD2 4.42Å; Y294-L296 HydrophobicContact CE2-CB 4.06Å; Y294-L296 HydrophobicContact CE2-CD1 4.18Å; Y294-L296 WeakPolarHBondContact OH-CD1 3.5Å; L296-S298 PolarHBondContact O-N 2.96Å; L296-R306 HydrophobicContact CD1-CB 4.01Å; L296-R306 HydrophobicContact CD1-CG 3.45Å; L296-R306 VanDerWaalsContact CD1-CG 3.45Å; L296-R306 HydrophobicContact CD2-CG 4.48Å; L296-R306 HydrophobicContact CG-CG 4.34Å; L296-V334 PolarHBondContact N-O 2.94Å; L296-D335 CarbonylContact O-C 3.58Å; L296-D335 WeakPolarHBondContact O-CA 3.34Å; L296-D335 VanDerWaalsContact O-O 3.12Å
297	P	85	Confident	85.4	Confident	12 Å²	12	48.4 Å²	48.4	8%	0.078	27%	0.268	C	S	.	.			trans	-62.7	134.8	-179	25.8	-32.3	0	0	0	110.5	T267 E299 S301	T267-P297 WeakPolarHBondContact O-CB 3.38Å; P297-E299 WeakPolarHBondContact CB-O 3.3Å; P297-E299 PolarHBondContact O-N 3.47Å; P297-S301 PolarHBondContact O-OG 3.04Å; P297-S301 VanDerWaalsContact O-OG 3.11Å
298	S	79.5	Confident	86	Confident	102 Å²	102	47.4 Å²	47.4	71%	0.713	26%	0.263	S	S	*	.	S	Bend	trans	-61.3	-30.5	179.9	54.4	0	0	0	0	112.7	L296	L296-S298 PolarHBondContact O-N 2.96Å
299	E	81.4	Confident	86.4	Confident	156 Å²	156	45.6 Å²	45.6	73%	0.729	25%	0.252	S	S	*	.	S	Bend	trans	-119.7	157.7	177.5	-61.5	-174	177.6	0	0	110.9	P297 S301	P297-E299 WeakPolarHBondContact CB-O 3.3Å; P297-E299 PolarHBondContact O-N 3.47Å; E299-S301 VanDerWaalsContact C-N 3.3Å; E299-S301 PolarHBondContact O-N 2.64Å
300	G	75	Confident	86.5	Confident	62 Å²	62	47.7 Å²	47.7	64%	0.639	27%	0.268	S	S	*	.	S	Bend	trans	87.8	-26.4	175.9	0	0	0	0	0	115.8	N268	N268-G300 CarbonylContact O-C 3.58Å
301	S	78.6	Confident	86.2	Confident	12 Å²	12	48.8 Å²	48.8	8%	0.084	27%	0.274	C	S	.	.			trans	-86.9	142.7	176.1	62.2	0	0	0	0	112.5	N268 P297 E299 R306	N268-S301 PolarHBondContact O-N 2.63Å; P297-S301 PolarHBondContact O-OG 3.04Å; P297-S301 VanDerWaalsContact O-OG 3.11Å; E299-S301 VanDerWaalsContact C-N 3.3Å; E299-S301 PolarHBondContact O-N 2.64Å; S301-R306 PolarHBondContact O-NH1 3.3Å; S301-R306 WeakPolarHBondContact OG-CD 3.48Å; S301-R306 WeakPolarHBondContact OG-CG 3.47Å; S301-R306 PolarHBondContact OG-NH1 2.8Å
302	S	82.5	Confident	86	Confident	52 Å²	52	48.9 Å²	48.9	36%	0.364	28%	0.275	S	S	.	.			trans	-80.2	155.3	171.8	68.3	0	0	0	0	111.4	K304 E305 R306	S302-K304 PolarHBondContact O-N 3.12Å; S302-E305 WeakPolarHBondContact CB-OE2 3.46Å; S302-E305 PolarHBondContact N-OE2 3.09Å; S302-E305 PolarHBondContact O-N 3.02Å; S302-E305 VanDerWaalsContact OG-CG 3.25Å; S302-E305 WeakPolarHBondContact OG-CG 3.49Å; S302-E305 PolarHBondContact OG-N 3.22Å; S302-E305 PolarHBondContact OG-OE2 3.02Å; S302-R306 WeakPolarHBondContact O-CG 3.48Å; S302-R306 PolarHBondContact O-N 3.39Å
303	I	83.6	Confident	85.8	Confident	123 Å²	123	51.4 Å²	51.4	63%	0.631	29%	0.286	S	S	*	.	H	α-helix	trans	-56.2	-39.1	175.3	-62.9	170	0	0	0	110.6	R306 M307	I303-R306 PolarHBondContact O-N 3.04Å; I303-M307 HydrophobicContact CG2-CG 4.16Å; I303-M307 WeakPolarHBondContact O-CB 3.45Å; I303-M307 VanDerWaalsContact O-CG 3.28Å; I303-M307 WeakPolarHBondContact O-CG 3.32Å; I303-M307 PolarHBondContact O-N 3.02Å
304	K	82	Confident	85.6	Confident	102 Å²	102	52.9 Å²	52.9	44%	0.443	30%	0.301	S	S	.	.	H	α-helix	trans	-59.3	-50.9	178	-169.9	-175.9	-175.6	-173.1	0	110.8	L224 E225 S302 R306 M307 L308	L224-K304 PolarHBondContact O-NZ 3.16Å; E225-K304 IonicContact OE2-NZ 3.73Å; E225-K304 PolarHBondContact OE2-NZ 2.83Å; E225-K304 VanDerWaalsContact OE2-NZ 3.12Å; S302-K304 PolarHBondContact O-N 3.12Å; K304-R306 PolarHBondContact O-N 3.02Å; K304-M307 PolarHBondContact O-N 3.1Å; K304-L308 HydrophobicContact CG-CD1 4.12Å; K304-L308 WeakPolarHBondContact O-CB 3.19Å; K304-L308 VanDerWaalsContact O-CG 3.22Å; K304-L308 WeakPolarHBondContact O-CG 3.49Å; K304-L308 PolarHBondContact O-N 2.94Å
305	E	81.4	Confident	85.5	Confident	38 Å²	38	53.3 Å²	53.3	18%	0.178	30%	0.304	C	S	.	.	H	α-helix	trans	-60.4	-46.8	177	-72.2	165.2	123.9	0	0	111.8	C226 P270 S302 M307 L308 Y309	C226-E305 PolarHBondContact SG-OE1 3.08Å; C226-E305 VanDerWaalsContact SG-OE1 3.35Å; P270-E305 HydrophobicContact CG-CB 4.21Å; S302-E305 WeakPolarHBondContact CB-OE2 3.46Å; S302-E305 PolarHBondContact N-OE2 3.09Å; S302-E305 PolarHBondContact O-N 3.02Å; S302-E305 VanDerWaalsContact OG-CG 3.25Å; S302-E305 WeakPolarHBondContact OG-CG 3.49Å; S302-E305 PolarHBondContact OG-N 3.22Å; S302-E305 PolarHBondContact OG-OE2 3.02Å; E305-M307 VanDerWaalsContact C-N 3.32Å; E305-M307 PolarHBondContact O-N 3.45Å; E305-L308 PolarHBondContact O-N 2.89Å; E305-Y309 VanDerWaalsContact O-CD2 3.31Å; E305-Y309 WeakPolarHBondContact O-CD2 3.37Å; E305-Y309 PolarHBondContact O-N 3.37Å
306	R	85.3	Confident	85.6	Confident	74 Å²	74	53.4 Å²	53.4	28%	0.279	30%	0.304	S	S	.	.	H	α-helix	trans	-59.4	-44.2	178.3	-62.3	-158	-79.6	-83.5	-4.6	112	L296 S301 S302 I303 K304 S310	L296-R306 HydrophobicContact CD1-CB 4.01Å; L296-R306 HydrophobicContact CD1-CG 3.45Å; L296-R306 VanDerWaalsContact CD1-CG 3.45Å; L296-R306 HydrophobicContact CD2-CG 4.48Å; L296-R306 HydrophobicContact CG-CG 4.34Å; S301-R306 PolarHBondContact O-NH1 3.3Å; S301-R306 WeakPolarHBondContact OG-CD 3.48Å; S301-R306 WeakPolarHBondContact OG-CG 3.47Å; S301-R306 PolarHBondContact OG-NH1 2.8Å; S302-R306 WeakPolarHBondContact O-CG 3.48Å; S302-R306 PolarHBondContact O-N 3.39Å; I303-R306 PolarHBondContact O-N 3.04Å; K304-R306 PolarHBondContact O-N 3.02Å; R306-S310 WeakPolarHBondContact O-CB 3.29Å; R306-S310 PolarHBondContact O-N 2.77Å; R306-S310 PolarHBondContact O-OG 3.34Å; R306-S310 VanDerWaalsContact O-OG 3.1Å
307	M	86.6	Confident	85.8	Confident	114 Å²	114	51.7 Å²	51.7	56%	0.562	30%	0.295	S	S	*	.	H	α-helix	trans	-64.4	-41.8	178.1	-75.4	-59.8	-60.7	0	0	111.9	I303 K304 E305 S310 T311	I303-M307 HydrophobicContact CG2-CG 4.16Å; I303-M307 WeakPolarHBondContact O-CB 3.45Å; I303-M307 VanDerWaalsContact O-CG 3.28Å; I303-M307 WeakPolarHBondContact O-CG 3.32Å; I303-M307 PolarHBondContact O-N 3.02Å; K304-M307 PolarHBondContact O-N 3.1Å; E305-M307 VanDerWaalsContact C-N 3.32Å; E305-M307 PolarHBondContact O-N 3.45Å; M307-S310 PolarHBondContact O-N 2.88Å; M307-T311 VanDerWaalsContact O-CB 3.25Å; M307-T311 WeakPolarHBondContact O-CB 3.47Å; M307-T311 PolarHBondContact O-N 3.12Å; M307-T311 PolarHBondContact O-OG1 2.87Å
308	L	86.5	Confident	86.2	Confident	27 Å²	27	55.7 Å²	55.7	14%	0.141	31%	0.313	C	S	.	.	H	α-helix	trans	-63.1	-50.4	178.2	-74.3	170	0	0	0	111.8	F196 A223 K304 E305 S310 T311 C312	F196-L308 HydrophobicContact CE2-CD2 4.15Å; F196-L308 HydrophobicContact CZ-CD2 3.66Å; A223-L308 HydrophobicContact CB-CD1 3.23Å; K304-L308 HydrophobicContact CG-CD1 4.12Å; K304-L308 WeakPolarHBondContact O-CB 3.19Å; K304-L308 VanDerWaalsContact O-CG 3.22Å; K304-L308 WeakPolarHBondContact O-CG 3.49Å; K304-L308 PolarHBondContact O-N 2.94Å; E305-L308 PolarHBondContact O-N 2.89Å; L308-S310 VanDerWaalsContact C-N 3.32Å; L308-S310 PolarHBondContact O-N 3.46Å; L308-T311 PolarHBondContact O-N 2.98Å; L308-C312 VanDerWaalsContact O-CB 3.28Å; L308-C312 WeakPolarHBondContact O-CB 3.32Å; L308-C312 PolarHBondContact O-N 3.39Å; L308-C312 PolarHBondContact O-SG 3.16Å
309	Y	88.9	Confident	86.7	Confident	4 Å²	4	51.9 Å²	51.9	2%	0.016	29%	0.285	C	S	.	.	H	α-helix	trans	-62.4	-37.5	176.8	-85.4	-104.4	0	0	0	112.4	V220 C221 P270 Y272 Y294 E305 K313	V220-Y309 WeakPolarHBondContact CA-OH 3.41Å; V220-Y309 WeakPolarHBondContact CG2-OH 3.22Å; C221-Y309 HydrophobicContact CB-CD1 4.48Å; C221-Y309 HydrophobicContact CB-CD2 3.99Å; C221-Y309 HydrophobicContact CB-CE1 4.14Å; C221-Y309 HydrophobicContact CB-CE2 3.6Å; C221-Y309 HydrophobicContact CB-CG 4.43Å; C221-Y309 VanDerWaalsContact N-CZ 3.34Å; C221-Y309 PolarHBondContact N-OH 3.32Å; P270-Y309 HydrophobicContact CB-CD1 3.96Å; P270-Y309 HydrophobicContact CB-CD2 3.99Å; P270-Y309 HydrophobicContact CB-CE1 4.03Å; P270-Y309 HydrophobicContact CB-CE2 4.06Å; P270-Y309 HydrophobicContact CB-CG 3.92Å; P270-Y309 HydrophobicContact CG-CD1 4.45Å; P270-Y309 HydrophobicContact CG-CD2 3.61Å; P270-Y309 HydrophobicContact CG-CE1 4.38Å; P270-Y309 HydrophobicContact CG-CE2 3.53Å; P270-Y309 HydrophobicContact CG-CG 4.07Å; P270-Y309 WeakPolarHBondContact O-CE1 3.07Å; P270-Y309 PolarHBondContact O-OH 3.31Å; Y272-Y309 AromaticContact CD1-CD1 3.96Å; Y272-Y309 HydrophobicContact CD1-CD1 3.96Å; Y272-Y309 HydrophobicContact CD1-CE1 4.43Å; Y272-Y309 AromaticContact CE1-CD1 3.67Å; Y272-Y309 HydrophobicContact CE1-CD1 3.67Å; Y272-Y309 HydrophobicContact CE1-CG 4.49Å; Y272-Y309 HydrophobicContact CE2-CD1 4.38Å; Y272-Y309 HydrophobicContact CG-CD1 4.42Å; Y272-Y309 AromaticContact CZ-CD1 3.89Å; Y272-Y309 PolarHBondContact OH-O 3.2Å; Y294-Y309 HydrophobicContact CD2-CD1 4.19Å; Y294-Y309 AromaticContact CE2-CD1 3.74Å; Y294-Y309 HydrophobicContact CE2-CD1 3.74Å; Y294-Y309 HydrophobicContact CE2-CG 4.01Å; Y294-Y309 VanDerWaalsContact CZ-CB 3.49Å; Y294-Y309 WeakPolarHBondContact OH-CB 2.97Å; E305-Y309 VanDerWaalsContact O-CD2 3.31Å; E305-Y309 WeakPolarHBondContact O-CD2 3.37Å; E305-Y309 PolarHBondContact O-N 3.37Å; Y309-K313 PolarHBondContact O-N 3.24Å
310	S	89.1	Confident	87.3	Confident	56 Å²	56	44.5 Å²	44.5	39%	0.392	25%	0.251	S	S	.	.	H	α-helix	trans	-68.5	-38.3	175.9	-67.1	0	0	0	0	112.6	R306 M307 L308	R306-S310 WeakPolarHBondContact O-CB 3.29Å; R306-S310 PolarHBondContact O-N 2.77Å; R306-S310 PolarHBondContact O-OG 3.34Å; R306-S310 VanDerWaalsContact O-OG 3.1Å; M307-S310 PolarHBondContact O-N 2.88Å; L308-S310 VanDerWaalsContact C-N 3.32Å; L308-S310 PolarHBondContact O-N 3.46Å
311	T	87.5	Confident	88.2	Confident	38 Å²	38	44.6 Å²	44.6	23%	0.233	24%	0.235	C	C	.	.	H	α-helix	trans	-81.4	-32	-174.5	-49.2	0	0	0	0	112.7	G193 I194 M307 L308	G193-T311 VanDerWaalsContact CA-O 3.23Å; G193-T311 WeakPolarHBondContact CA-O 3.34Å; I194-T311 HydrophobicContact CB-CG2 4.12Å; I194-T311 HydrophobicContact CD1-CG2 3.68Å; I194-T311 HydrophobicContact CG1-CG2 3.62Å; I194-T311 PolarHBondContact N-O 3.4Å; M307-T311 VanDerWaalsContact O-CB 3.25Å; M307-T311 WeakPolarHBondContact O-CB 3.47Å; M307-T311 PolarHBondContact O-N 3.12Å; M307-T311 PolarHBondContact O-OG1 2.87Å; L308-T311 PolarHBondContact O-N 2.98Å
312	C	89	Confident	88.9	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.007	27%	0.265	C	S	.	.	H	α-helix	trans	-80.3	-20.8	179.6	-66.5	0	0	0	0	113.6	I194 F196 L308 G314 P315 F316	I194-C312 WeakPolarHBondContact O-CA 3.18Å; I194-C312 PolarHBondContact O-SG 3.05Å; I194-C312 VanDerWaalsContact O-SG 3.37Å; F196-C312 HydrophobicContact CD2-CB 4.32Å; F196-C312 WeakPolarHBondContact CD2-SG 3.41Å; F196-C312 WeakPolarHBondContact CE2-SG 3.45Å; L308-C312 VanDerWaalsContact O-CB 3.28Å; L308-C312 WeakPolarHBondContact O-CB 3.32Å; L308-C312 PolarHBondContact O-N 3.39Å; L308-C312 PolarHBondContact O-SG 3.16Å; C312-G314 PolarHBondContact O-N 2.88Å; C312-P315 WeakPolarHBondContact O-CD 3.45Å; C312-F316 WeakPolarHBondContact O-CB 3.42Å; C312-F316 PolarHBondContact O-N 2.81Å
313	K	91.8	Very high	89.4	Confident	54 Å²	54	52.8 Å²	52.8	24%	0.235	28%	0.277	C	S	.	.	H	α-helix	trans	-53.2	-50	-174.6	-174.8	-170.8	69.6	174.8	0	112.7	Y272 F292 Y309 F316 L317 E333	Y272-K313 HydrophobicContact CE1-CB 4.38Å; Y272-K313 HydrophobicContact CE1-CG 4.49Å; Y272-K313 VanDerWaalsContact OH-CA 3.29Å; Y272-K313 WeakPolarHBondContact OH-CA 3.5Å; Y272-K313 PolarHBondContact OH-N 3.29Å; Y272-K313 VanDerWaalsContact OH-N 3.08Å; F292-K313 HydrophobicContact CE1-CD 3.89Å; F292-K313 HydrophobicContact CE1-CG 3.93Å; F292-K313 HydrophobicContact CZ-CD 4.34Å; F292-K313 HydrophobicContact CZ-CG 3.97Å; Y309-K313 PolarHBondContact O-N 3.24Å; K313-F316 PolarHBondContact O-N 2.81Å; K313-L317 HydrophobicContact CD-CD1 4.44Å; K313-L317 HydrophobicContact CG-CD1 3.85Å; K313-L317 HydrophobicContact CG-CG 4.28Å; K313-L317 WeakPolarHBondContact O-CB 3.26Å; K313-L317 WeakPolarHBondContact O-CG 3.24Å; K313-L317 PolarHBondContact O-N 3.08Å; K313-E333 IonicContact NZ-OE1 2.72Å; K313-E333 PolarHBondContact NZ-OE1 3.32Å
314	G	91	Very high	89.8	Confident	32 Å²	32	47.4 Å²	47.4	33%	0.33	25%	0.25	S	C	.	.	H	α-helix	trans	-57.4	-64.8	-176.8	0	0	0	0	0	112.7	C312 F316 L317 E318	C312-G314 PolarHBondContact O-N 2.88Å; G314-F316 PolarHBondContact O-N 3.36Å; G314-L317 PolarHBondContact O-N 3.5Å; G314-E318 WeakPolarHBondContact O-CG 3.24Å; G314-E318 PolarHBondContact O-N 2.9Å
315	P	90.6	Very high	90.3	Very high	11 Å²	11	44.8 Å²	44.8	7%	0.071	25%	0.252	C	S	.	.	H	α-helix	trans	-59.8	-31.9	179	-25.4	34.2	0	0	0	114.2	R195 C312 T319	R195-P315 HydrophobicContact CB-CB 4.03Å; R195-P315 HydrophobicContact CG-CB 4.04Å; C312-P315 WeakPolarHBondContact O-CD 3.45Å; P315-T319 PolarHBondContact O-N 3.32Å; P315-T319 VanDerWaalsContact O-N 3.1Å; P315-T319 PolarHBondContact O-OG1 3Å
316	F	92.6	Very high	90.8	Very high	8 Å²	8	43.3 Å²	43.3	4%	0.035	25%	0.245	C	C	.	.	H	α-helix	trans	-63.9	-51.8	175	169.1	-106.3	0	0	0	111	I198 L206 L219 V248 Y272 F274 F292 C312 K313 G314 E318 T319 V320	I198-F316 HydrophobicContact CD1-CD2 3.6Å; I198-F316 HydrophobicContact CD1-CE2 3.73Å; I198-F316 HydrophobicContact CG1-CD2 3.96Å; I198-F316 HydrophobicContact CG1-CE2 4.17Å; L206-F316 HydrophobicContact CD1-CZ 4.45Å; L219-F316 HydrophobicContact CD1-CE1 4.2Å; L219-F316 HydrophobicContact CD1-CE2 3.93Å; L219-F316 HydrophobicContact CD1-CZ 3.3Å; V248-F316 HydrophobicContact CB-CD2 4.45Å; V248-F316 HydrophobicContact CB-CE2 4.47Å; V248-F316 HydrophobicContact CG1-CD2 4.19Å; V248-F316 HydrophobicContact CG1-CE2 3.86Å; V248-F316 HydrophobicContact CG1-CZ 4.47Å; V248-F316 HydrophobicContact CG2-CD2 4.08Å; Y272-F316 AromaticContact CD2-CD1 3.88Å; Y272-F316 HydrophobicContact CD2-CD1 3.88Å; Y272-F316 AromaticContact CD2-CE1 3.86Å; Y272-F316 HydrophobicContact CD2-CE1 3.86Å; Y272-F316 AromaticContact CE2-CD1 3.85Å; Y272-F316 HydrophobicContact CE2-CD1 3.85Å; Y272-F316 HydrophobicContact CE2-CE1 4.31Å; Y272-F316 HydrophobicContact CE2-CG 4.25Å; F274-F316 AromaticContact CE2-CE1 3.63Å; F274-F316 HydrophobicContact CE2-CE1 3.63Å; F274-F316 AromaticContact CE2-CZ 3.75Å; F274-F316 HydrophobicContact CE2-CZ 3.75Å; F274-F316 AromaticContact CZ-CE1 3.8Å; F274-F316 HydrophobicContact CZ-CE1 3.8Å; F274-F316 HydrophobicContact CZ-CZ 4.08Å; F292-F316 HydrophobicContact CE2-CE1 4.27Å; C312-F316 WeakPolarHBondContact O-CB 3.42Å; C312-F316 PolarHBondContact O-N 2.81Å; K313-F316 PolarHBondContact O-N 2.81Å; G314-F316 PolarHBondContact O-N 3.36Å; F316-E318 VanDerWaalsContact C-N 3.35Å; F316-E318 PolarHBondContact O-N 3.3Å; F316-T319 WeakPolarHBondContact O-CB 3.15Å; F316-T319 PolarHBondContact O-N 2.92Å; F316-T319 VanDerWaalsContact O-N 3.12Å; F316-V320 HydrophobicContact CD2-CG2 4.28Å; F316-V320 HydrophobicContact CE1-CG2 4.12Å; F316-V320 HydrophobicContact CE2-CG2 3.71Å; F316-V320 HydrophobicContact CZ-CG2 3.59Å; F316-V320 WeakPolarHBondContact O-CG2 3.25Å; F316-V320 PolarHBondContact O-N 3.19Å
317	L	94.6	Very high	91.1	Very high	7 Å²	7	49.7 Å²	49.7	4%	0.037	27%	0.269	C	S	.	.	H	α-helix	trans	-63.6	-38.4	179.7	-65.9	-179.6	0	0	0	112.6	F274 F292 K313 G314 T319 V320 E321 I328 K331	F274-L317 HydrophobicContact CE1-CD2 4.46Å; F274-L317 HydrophobicContact CZ-CD2 3.88Å; F292-L317 HydrophobicContact CB-CD2 4.38Å; F292-L317 HydrophobicContact CD1-CD1 3.91Å; F292-L317 HydrophobicContact CD1-CD2 4.05Å; F292-L317 HydrophobicContact CD2-CD2 3.55Å; F292-L317 HydrophobicContact CE1-CD1 3.92Å; F292-L317 HydrophobicContact CE1-CD2 4.2Å; F292-L317 HydrophobicContact CE2-CD2 3.68Å; F292-L317 HydrophobicContact CG-CD1 4.37Å; F292-L317 HydrophobicContact CG-CD2 3.71Å; F292-L317 HydrophobicContact CZ-CD1 4.36Å; F292-L317 HydrophobicContact CZ-CD2 4.01Å; F292-L317 HydrophobicContact CZ-CG 4.48Å; K313-L317 HydrophobicContact CD-CD1 4.44Å; K313-L317 HydrophobicContact CG-CD1 3.85Å; K313-L317 HydrophobicContact CG-CG 4.28Å; K313-L317 WeakPolarHBondContact O-CB 3.26Å; K313-L317 WeakPolarHBondContact O-CG 3.24Å; K313-L317 PolarHBondContact O-N 3.08Å; G314-L317 PolarHBondContact O-N 3.5Å; L317-T319 VanDerWaalsContact C-N 3.32Å; L317-T319 PolarHBondContact O-N 3.47Å; L317-V320 PolarHBondContact O-N 3.16Å; L317-E321 WeakPolarHBondContact O-CG 3.14Å; L317-E321 PolarHBondContact O-N 2.88Å; L317-I328 HydrophobicContact CB-CD1 4.45Å; L317-I328 HydrophobicContact CD2-CD1 3.65Å; L317-K331 HydrophobicContact CD1-CD 3.82Å; L317-K331 HydrophobicContact CD1-CG 4.3Å
318	E	92.1	Very high	91.5	Very high	96 Å²	96	45 Å²	45	45%	0.449	25%	0.246	S	C	.	.	H	α-helix	trans	-56.7	-47.2	171.5	-72	169	-168.1	0	0	111.1	R195 G314 F316 V320 E321 D322	R195-E318 IonicContact NH1-OE2 3.64Å; R195-E318 IonicContact NH2-OE2 3.12Å; G314-E318 WeakPolarHBondContact O-CG 3.24Å; G314-E318 PolarHBondContact O-N 2.9Å; F316-E318 VanDerWaalsContact C-N 3.35Å; F316-E318 PolarHBondContact O-N 3.3Å; E318-V320 VanDerWaalsContact C-N 3.3Å; E318-V320 PolarHBondContact O-N 2.77Å; E318-E321 PolarHBondContact O-N 2.98Å; E318-D322 VanDerWaalsContact O-CB 3.3Å; E318-D322 WeakPolarHBondContact O-CB 3.48Å; E318-D322 PolarHBondContact O-N 3.11Å
319	T	91.7	Very high	91.7	Very high	23 Å²	23	48.1 Å²	48.1	14%	0.141	26%	0.26	C	S	.	.	H	α-helix	trans	-63.7	-37.2	179.3	-52	0	0	0	0	111.6	R195 I198 P315 F316 L317 V323	R195-T319 PolarHBondContact NE-OG1 3.22Å; R195-T319 PolarHBondContact NH2-OG1 2.74Å; I198-T319 HydrophobicContact CD1-CG2 3.69Å; P315-T319 PolarHBondContact O-N 3.32Å; P315-T319 VanDerWaalsContact O-N 3.1Å; P315-T319 PolarHBondContact O-OG1 3Å; F316-T319 WeakPolarHBondContact O-CB 3.15Å; F316-T319 PolarHBondContact O-N 2.92Å; F316-T319 VanDerWaalsContact O-N 3.12Å; L317-T319 VanDerWaalsContact C-N 3.32Å; L317-T319 PolarHBondContact O-N 3.47Å; T319-V323 HydrophobicContact CG2-CB 4.31Å; T319-V323 HydrophobicContact CG2-CG2 3.82Å; T319-V323 WeakPolarHBondContact O-CA 3.39Å; T319-V323 WeakPolarHBondContact O-CB 3.32Å; T319-V323 WeakPolarHBondContact O-CG2 3.17Å; T319-V323 PolarHBondContact O-N 2.94Å
320	V	93.5	Very high	91.9	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.276	C	S	.	.	I	π-helix	trans	-67.9	-42.5	176.4	174.4	0	0	0	0	111.9	L206 F274 F316 L317 E318 V324 G325 I326	L206-V320 HydrophobicContact CD1-CG1 4.34Å; L206-V320 HydrophobicContact CD1-CG2 3.73Å; F274-V320 HydrophobicContact CE1-CG1 3.93Å; F274-V320 HydrophobicContact CZ-CB 4.45Å; F274-V320 HydrophobicContact CZ-CG1 3.96Å; F274-V320 HydrophobicContact CZ-CG2 4.22Å; F316-V320 HydrophobicContact CD2-CG2 4.28Å; F316-V320 HydrophobicContact CE1-CG2 4.12Å; F316-V320 HydrophobicContact CE2-CG2 3.71Å; F316-V320 HydrophobicContact CZ-CG2 3.59Å; F316-V320 WeakPolarHBondContact O-CG2 3.25Å; F316-V320 PolarHBondContact O-N 3.19Å; L317-V320 PolarHBondContact O-N 3.16Å; E318-V320 VanDerWaalsContact C-N 3.3Å; E318-V320 PolarHBondContact O-N 2.77Å; V320-V324 WeakPolarHBondContact O-CB 3.49Å; V320-V324 PolarHBondContact O-N 3.13Å; V320-G325 PolarHBondContact O-N 3.34Å; V320-G325 VanDerWaalsContact O-N 3.12Å; V320-I326 HydrophobicContact CG1-CB 4.01Å; V320-I326 HydrophobicContact CG1-CD1 3.85Å; V320-I326 HydrophobicContact CG1-CG1 4.39Å; V320-I326 PolarHBondContact O-N 2.93Å
321	E	94.3	Very high	92.2	Very high	65 Å²	65	54.8 Å²	54.8	30%	0.304	28%	0.28	S	S	.	.	I	π-helix	trans	-67.9	-43.5	177.4	-73.5	172.6	179.4	0	0	111.5	L317 E318 G325 I326 I328 K331	L317-E321 WeakPolarHBondContact O-CG 3.14Å; L317-E321 PolarHBondContact O-N 2.88Å; E318-E321 PolarHBondContact O-N 2.98Å; E321-G325 VanDerWaalsContact O-CA 3.28Å; E321-G325 WeakPolarHBondContact O-CA 3.36Å; E321-G325 PolarHBondContact O-N 2.93Å; E321-I326 WeakPolarHBondContact CG-O 3.41Å; E321-I328 HydrophobicContact CG-CD1 4.06Å; E321-I328 HydrophobicContact CG-CG1 4.12Å; E321-K331 VanDerWaalsContact OE1-CE 3.3Å; E321-K331 WeakPolarHBondContact OE1-CE 3.29Å; E321-K331 IonicContact OE1-NZ 3.26Å; E321-K331 PolarHBondContact OE1-NZ 3.45Å; E321-K331 IonicContact OE2-NZ 2.87Å
322	D	93	Very high	92.5	Very high	133 Å²	133	54.5 Å²	54.5	71%	0.711	28%	0.277	S	S	*	.	I	π-helix	trans	-82.2	-43.1	-174.4	-69.8	-20.3	0	0	0	114.1	E318	E318-D322 VanDerWaalsContact O-CB 3.3Å; E318-D322 WeakPolarHBondContact O-CB 3.48Å; E318-D322 PolarHBondContact O-N 3.11Å
323	V	91.6	Very high	92.7	Very high	103 Å²	103	60.1 Å²	60.1	62%	0.624	30%	0.304	S	S	*	.	I	π-helix	trans	-92.9	-45.7	-172.7	-176.5	0	0	0	0	111.5	T319	T319-V323 HydrophobicContact CG2-CB 4.31Å; T319-V323 HydrophobicContact CG2-CG2 3.82Å; T319-V323 WeakPolarHBondContact O-CA 3.39Å; T319-V323 WeakPolarHBondContact O-CB 3.32Å; T319-V323 WeakPolarHBondContact O-CG2 3.17Å; T319-V323 PolarHBondContact O-N 2.94Å
324	V	92.1	Very high	92.7	Very high	10 Å²	10	57.9 Å²	57.9	6%	0.061	30%	0.295	C	S	.	.	I	π-helix	trans	-81.3	-33.9	179.2	-170.8	0	0	0	0	110.3	L203 L206 R210 V320 I326	L203-V324 HydrophobicContact CD2-CG2 3.78Å; L206-V324 HydrophobicContact CB-CG1 4Å; L206-V324 HydrophobicContact CB-CG2 4.32Å; R210-V324 WeakPolarHBondContact CD-O 3.17Å; R210-V324 PolarHBondContact NH1-O 2.76Å; V320-V324 WeakPolarHBondContact O-CB 3.49Å; V320-V324 PolarHBondContact O-N 3.13Å; V324-I326 HydrophobicContact CB-CD1 4.49Å; V324-I326 HydrophobicContact CB-CG1 4.46Å; V324-I326 HydrophobicContact CG1-CD1 3.92Å; V324-I326 HydrophobicContact CG1-CG1 3.96Å
325	G	92.3	Very high	92.6	Very high	47 Å²	47	61.5 Å²	61.5	49%	0.485	31%	0.306	S	S	.	.			trans	85.5	23.6	-179.1	0	0	0	0	0	113.6	V320 E321	V320-G325 PolarHBondContact O-N 3.34Å; V320-G325 VanDerWaalsContact O-N 3.12Å; E321-G325 VanDerWaalsContact O-CA 3.28Å; E321-G325 WeakPolarHBondContact O-CA 3.36Å; E321-G325 PolarHBondContact O-N 2.93Å
326	I	92.9	Very high	92.4	Very high	6 Å²	6	62.6 Å²	62.6	3%	0.031	31%	0.314	C	S	.	.			trans	-81.2	126	175	-67.2	168.9	0	0	0	109.3	L206 L209 R210 V290 V320 E321 V324 I328	L206-I326 HydrophobicContact CB-CD1 3.85Å; L206-I326 HydrophobicContact CD2-CD1 3.97Å; L206-I326 HydrophobicContact CG-CD1 4.48Å; L206-I326 WeakPolarHBondContact O-CD1 3.27Å; L209-I326 HydrophobicContact CD2-CD1 4.23Å; R210-I326 HydrophobicContact CB-CG1 3.83Å; R210-I326 HydrophobicContact CG-CG1 4.3Å; V290-I326 HydrophobicContact CB-CG2 4.34Å; V290-I326 HydrophobicContact CG1-CG2 3.73Å; V290-I326 HydrophobicContact CG2-CG2 4.45Å; V320-I326 HydrophobicContact CG1-CB 4.01Å; V320-I326 HydrophobicContact CG1-CD1 3.85Å; V320-I326 HydrophobicContact CG1-CG1 4.39Å; V320-I326 PolarHBondContact O-N 2.93Å; E321-I326 WeakPolarHBondContact CG-O 3.41Å; V324-I326 HydrophobicContact CB-CD1 4.49Å; V324-I326 HydrophobicContact CB-CG1 4.46Å; V324-I326 HydrophobicContact CG1-CD1 3.92Å; V324-I326 HydrophobicContact CG1-CG1 3.96Å; I326-I328 HydrophobicContact CG2-CG1 4.05Å; I326-I328 PolarHBondContact O-N 2.82Å
327	R	92.3	Very high	92.1	Very high	208 Å²	208	65.4 Å²	65.4	79%	0.785	33%	0.326	S	S	*	.			trans	-89	96.6	174	-171.3	178.3	-178.8	-175.5	0.6	111.2	Q329	R327-Q329 PolarHBondContact O-N 2.85Å
328	I	93.5	Very high	91.8	Very high	17 Å²	17	70 Å²	70	9%	0.087	35%	0.348	C	S	.	.			trans	-77.2	116.7	-179.8	-50	174.8	0	0	0	109.8	F274 F292 L317 E321 I326 R330 K331	F274-I328 HydrophobicContact CE1-CD1 3.6Å; F274-I328 HydrophobicContact CE1-CG1 4.06Å; F274-I328 HydrophobicContact CZ-CD1 4.21Å; F292-I328 HydrophobicContact CB-CD1 4.45Å; F292-I328 HydrophobicContact CB-CG2 3.66Å; L317-I328 HydrophobicContact CB-CD1 4.45Å; L317-I328 HydrophobicContact CD2-CD1 3.65Å; E321-I328 HydrophobicContact CG-CD1 4.06Å; E321-I328 HydrophobicContact CG-CG1 4.12Å; I326-I328 HydrophobicContact CG2-CG1 4.05Å; I326-I328 PolarHBondContact O-N 2.82Å; I328-R330 WeakPolarHBondContact CG2-O 3.4Å; I328-K331 HydrophobicContact CG2-CG 3.82Å
329	Q	91.6	Very high	91.6	Very high	91 Å²	91	68.5 Å²	68.5	43%	0.425	35%	0.345	S	S	.	.			trans	-94.9	-27.1	-176.2	-72.5	150.5	-61.9	0	0	112.9	V288 L289 V290 R327	V288-Q329 PolarHBondContact O-NE2 3.06Å; L289-Q329 HydrophobicContact CD1-CB 3.3Å; L289-Q329 HydrophobicContact CD1-CG 4.04Å; L289-Q329 HydrophobicContact CG-CB 4.26Å; V290-Q329 PolarHBondContact O-N 3.02Å; R327-Q329 PolarHBondContact O-N 2.85Å
330	R	92.9	Very high	91.5	Very high	93 Å²	93	67.5 Å²	67.5	35%	0.351	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	135.2	176	-65.6	-63.9	-171.1	-166	-3	110.4	L289 I291 F292 I328 L348	L289-R330 HydrophobicContact CD1-CG 4.25Å; L289-R330 HydrophobicContact CD2-CG 3.99Å; L289-R330 HydrophobicContact CG-CG 4.45Å; I291-R330 HydrophobicContact CG1-CB 4.32Å; I291-R330 HydrophobicContact CG2-CB 4.22Å; F292-R330 PolarHBondContact N-O 3.47Å; I328-R330 WeakPolarHBondContact CG2-O 3.4Å; R330-L348 HydrophobicContact CG-CB 4.43Å; R330-L348 PolarHBondContact NE-O 3.29Å; R330-L348 PolarHBondContact NH2-O 3.14Å
331	K	94.7	Very high	91.2	Very high	108 Å²	108	71.1 Å²	71.1	47%	0.47	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	115.2	175.6	-64.3	173.8	-177.2	-179.3	0	106.8	F292 L317 E321 I328	F292-K331 HydrophobicContact CB-CG 4.45Å; F292-K331 HydrophobicContact CD1-CB 4.3Å; F292-K331 HydrophobicContact CD1-CG 4.34Å; F292-K331 CarbonylContact O-C 3.55Å; F292-K331 WeakPolarHBondContact O-CA 3.47Å; L317-K331 HydrophobicContact CD1-CD 3.82Å; L317-K331 HydrophobicContact CD1-CG 4.3Å; E321-K331 VanDerWaalsContact OE1-CE 3.3Å; E321-K331 WeakPolarHBondContact OE1-CE 3.29Å; E321-K331 IonicContact OE1-NZ 3.26Å; E321-K331 PolarHBondContact OE1-NZ 3.45Å; E321-K331 IonicContact OE2-NZ 2.87Å; I328-K331 HydrophobicContact CG2-CG 3.82Å
332	V	93.8	Very high	90.7	Very high	31 Å²	31	74.1 Å²	74.1	19%	0.188	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	143.7	-173	-169.7	0	0	0	0	110.1	F292 F293 Y294 V334 F344 L348	F292-V332 PolarHBondContact O-N 3.01Å; F293-V332 CarbonylContact C-O 3.58Å; F293-V332 WeakPolarHBondContact CA-O 3.33Å; F293-V332 HydrophobicContact CB-CB 4.23Å; Y294-V332 PolarHBondContact N-O 3.41Å; V332-V334 HydrophobicContact CG1-CG2 3.98Å; V332-F344 HydrophobicContact CB-CZ 4.31Å; V332-F344 HydrophobicContact CG1-CE2 3.94Å; V332-F344 HydrophobicContact CG1-CZ 3.94Å; V332-L348 HydrophobicContact CG2-CD1 3.88Å; V332-L348 HydrophobicContact CG2-CD2 3.5Å; V332-L348 HydrophobicContact CG2-CG 4.36Å
333	E	93.2	Very high	90.5	Very high	120 Å²	120	74 Å²	74	56%	0.561	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.4	131.1	172.4	-62.6	-176.9	170.9	0	0	108.1	Y294 K313	Y294-E333 HydrophobicContact CD1-CG 4.16Å; K313-E333 IonicContact NZ-OE1 2.72Å; K313-E333 PolarHBondContact NZ-OE1 3.32Å
334	V	92.4	Very high	90.4	Very high	7 Å²	7	70.5 Å²	70.5	4%	0.042	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	126.8	-173.4	-178.7	0	0	0	0	109	Y294 T295 L296 V332 S336 T339 I340 F344	Y294-V334 PolarHBondContact O-N 2.77Å; T295-V334 CarbonylContact C-O 3.59Å; T295-V334 VanDerWaalsContact CA-O 3.31Å; T295-V334 WeakPolarHBondContact CA-O 3.38Å; L296-V334 PolarHBondContact N-O 2.94Å; V332-V334 HydrophobicContact CG1-CG2 3.98Å; V334-S336 WeakPolarHBondContact CG1-O 3.49Å; V334-T339 WeakPolarHBondContact CG1-OG1 3.46Å; V334-I340 HydrophobicContact CB-CD1 4.28Å; V334-I340 HydrophobicContact CG1-CD1 3.92Å; V334-I340 HydrophobicContact CG1-CG1 4.04Å; V334-I340 HydrophobicContact CG2-CD1 4.29Å; V334-I340 HydrophobicContact CG2-CG1 4.42Å; V334-F344 HydrophobicContact CG2-CE2 3.88Å; V334-F344 HydrophobicContact CG2-CZ 3.87Å
335	D	88.6	Confident	90.3	Very high	108 Å²	108	70 Å²	70	58%	0.578	34%	0.339	S	S	*	.	S	Bend	trans	-89.2	-22.3	-178.3	59	-14.6	0	0	0	113.5	L296	L296-D335 CarbonylContact O-C 3.58Å; L296-D335 WeakPolarHBondContact O-CA 3.34Å; L296-D335 VanDerWaalsContact O-O 3.12Å
336	S	85.9	Confident	90	Very high	34 Å²	34	71.5 Å²	71.5	24%	0.238	34%	0.338	C	S	.	.			trans	-137.4	128.4	-173.3	157.1	0	0	0	0	110.5	V334 E338 T339	V334-S336 WeakPolarHBondContact CG1-O 3.49Å; S336-E338 PolarHBondContact O-N 3.34Å; S336-E338 VanDerWaalsContact O-N 3.08Å; S336-E338 WeakPolarHBondContact OG-CB 3.34Å; S336-E338 PolarHBondContact OG-N 2.85Å; S336-E338 PolarHBondContact OG-OE2 3.25Å; S336-T339 PolarHBondContact O-N 2.85Å; S336-T339 PolarHBondContact O-OG1 3.07Å
337	K	87.6	Confident	89.7	Confident	66 Å²	66	74.8 Å²	74.8	29%	0.287	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-61.1	-20.5	175.9	69	170.3	-176.1	179.6	0	112.1	I265 T267 T339 I340	I265-K337 HydrophobicContact CB-CB 4.15Å; I265-K337 HydrophobicContact CG2-CB 3.83Å; T267-K337 HydrophobicContact CG2-CD 3.52Å; T267-K337 HydrophobicContact CG2-CG 4.41Å; K337-T339 PolarHBondContact O-N 3.13Å; K337-I340 PolarHBondContact O-N 3.26Å
338	E	88.1	Confident	89.5	Confident	104 Å²	104	66.2 Å²	66.2	49%	0.486	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-65	-28.7	-176.8	-67.8	63.9	-146.1	0	0	112.3	K262 S336 I340	K262-E338 PolarHBondContact NZ-O 2.86Å; S336-E338 PolarHBondContact O-N 3.34Å; S336-E338 VanDerWaalsContact O-N 3.08Å; S336-E338 WeakPolarHBondContact OG-CB 3.34Å; S336-E338 PolarHBondContact OG-N 2.85Å; S336-E338 PolarHBondContact OG-OE2 3.25Å; E338-I340 VanDerWaalsContact C-N 3.28Å; E338-I340 PolarHBondContact O-N 3.08Å
339	T	87.9	Confident	89.1	Confident	65 Å²	65	68 Å²	68	40%	0.399	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-78	-10.6	179.7	68	0	0	0	0	113.6	V334 S336 K337 D341 F344	V334-T339 WeakPolarHBondContact CG1-OG1 3.46Å; S336-T339 PolarHBondContact O-N 2.85Å; S336-T339 PolarHBondContact O-OG1 3.07Å; K337-T339 PolarHBondContact O-N 3.13Å; T339-D341 PolarHBondContact O-N 3.48Å; T339-F344 WeakPolarHBondContact O-CB 3.24Å
340	I	89.6	Confident	88.7	Confident	2 Å²	2	69.4 Å²	69.4	1%	0.01	35%	0.346	C	S	.	.			trans	-91.7	90.9	-179.2	-62.8	170	0	0	0	107.7	V261 K262 I265 F293 T295 V334 K337 E338 F344 F345	V261-I340 HydrophobicContact CG1-CG2 4.45Å; K262-I340 WeakPolarHBondContact CB-O 3.4Å; K262-I340 WeakPolarHBondContact CD-O 3.44Å; I265-I340 HydrophobicContact CD1-CB 4.22Å; I265-I340 HydrophobicContact CD1-CD1 3.22Å; I265-I340 HydrophobicContact CD1-CG1 4.28Å; I265-I340 HydrophobicContact CD1-CG2 4.09Å; F293-I340 HydrophobicContact CD2-CD1 3.92Å; F293-I340 HydrophobicContact CE2-CD1 3.78Å; T295-I340 HydrophobicContact CG2-CD1 3.96Å; V334-I340 HydrophobicContact CB-CD1 4.28Å; V334-I340 HydrophobicContact CG1-CD1 3.92Å; V334-I340 HydrophobicContact CG1-CG1 4.04Å; V334-I340 HydrophobicContact CG2-CD1 4.29Å; V334-I340 HydrophobicContact CG2-CG1 4.42Å; K337-I340 PolarHBondContact O-N 3.26Å; E338-I340 VanDerWaalsContact C-N 3.28Å; E338-I340 PolarHBondContact O-N 3.08Å; I340-F344 HydrophobicContact CG1-CD1 4.42Å; I340-F344 HydrophobicContact CG1-CE1 4.35Å; I340-F344 HydrophobicContact CG1-CZ 4.47Å; I340-F344 HydrophobicContact CG2-CD1 4.32Å; I340-F345 HydrophobicContact CG2-CE2 3.76Å; I340-F345 HydrophobicContact CG2-CZ 3.84Å
341	D	86.2	Confident	88.1	Confident	76 Å²	76	69 Å²	69	41%	0.406	36%	0.355	S	S	.	.	S	Bend	trans	-122.5	-179.8	172.7	63.8	4.7	0	0	0	110.5	T339 K343 F344 F345	T339-D341 PolarHBondContact O-N 3.48Å; D341-K343 PolarHBondContact O-N 3.27Å; D341-K343 WeakPolarHBondContact OD1-CB 3.43Å; D341-K343 PolarHBondContact OD1-N 3.16Å; D341-F344 VanDerWaalsContact O-CB 3.31Å; D341-F344 WeakPolarHBondContact O-CB 3.24Å; D341-F344 PolarHBondContact O-N 3.36Å; D341-F344 VanDerWaalsContact O-N 3.16Å; D341-F344 PolarHBondContact OD1-N 3.22Å; D341-F345 WeakPolarHBondContact O-CD2 3.34Å
342	E	85.6	Confident	87.3	Confident	127 Å²	127	68.5 Å²	68.5	59%	0.593	37%	0.365	S	S	*	.	H	α-helix	trans	-57.9	-35.9	177.5	-174.3	179.2	-175.5	0	0	111.9	F344 F345 V346	E342-F344 VanDerWaalsContact C-N 3.34Å; E342-F344 PolarHBondContact O-N 3.36Å; E342-F345 PolarHBondContact O-N 3.16Å; E342-V346 WeakPolarHBondContact O-CG2 3.44Å; E342-V346 PolarHBondContact O-N 2.99Å; E342-V346 VanDerWaalsContact O-N 3.09Å
343	K	87.7	Confident	86.5	Confident	132 Å²	132	71.6 Å²	71.6	57%	0.574	39%	0.388	S	S	*	.	H	α-helix	trans	-64.4	-37.9	179	-174.3	-174.7	172.6	-169.4	0	111.9	D341 F345 V346 D347	D341-K343 PolarHBondContact O-N 3.27Å; D341-K343 WeakPolarHBondContact OD1-CB 3.43Å; D341-K343 PolarHBondContact OD1-N 3.16Å; K343-F345 VanDerWaalsContact C-N 3.28Å; K343-F345 PolarHBondContact O-N 3.46Å; K343-V346 PolarHBondContact O-N 2.94Å; K343-D347 WeakPolarHBondContact CE-OD2 3.47Å; K343-D347 WeakPolarHBondContact O-CB 3.47Å; K343-D347 PolarHBondContact O-N 2.96Å
344	F	90	Very high	85.7	Confident	29 Å²	29	71.6 Å²	71.6	13%	0.127	40%	0.399	C	S	.	.	H	α-helix	trans	-53.7	-45.9	173.4	170.2	-95.6	0	0	0	111.8	V332 V334 T339 I340 D341 E342 L348	V332-F344 HydrophobicContact CB-CZ 4.31Å; V332-F344 HydrophobicContact CG1-CE2 3.94Å; V332-F344 HydrophobicContact CG1-CZ 3.94Å; V334-F344 HydrophobicContact CG2-CE2 3.88Å; V334-F344 HydrophobicContact CG2-CZ 3.87Å; T339-F344 WeakPolarHBondContact O-CB 3.24Å; I340-F344 HydrophobicContact CG1-CD1 4.42Å; I340-F344 HydrophobicContact CG1-CE1 4.35Å; I340-F344 HydrophobicContact CG1-CZ 4.47Å; I340-F344 HydrophobicContact CG2-CD1 4.32Å; D341-F344 VanDerWaalsContact O-CB 3.31Å; D341-F344 WeakPolarHBondContact O-CB 3.24Å; D341-F344 PolarHBondContact O-N 3.36Å; D341-F344 VanDerWaalsContact O-N 3.16Å; D341-F344 PolarHBondContact OD1-N 3.22Å; E342-F344 VanDerWaalsContact C-N 3.34Å; E342-F344 PolarHBondContact O-N 3.36Å; F344-L348 HydrophobicContact CD1-CD1 3.97Å; F344-L348 HydrophobicContact CE1-CD1 3.51Å; F344-L348 HydrophobicContact CE2-CD1 4.12Å; F344-L348 HydrophobicContact CG-CD1 4.45Å; F344-L348 HydrophobicContact CZ-CD1 3.6Å; F344-L348 VanDerWaalsContact O-CG 3.24Å; F344-L348 WeakPolarHBondContact O-CG 3.39Å; F344-L348 PolarHBondContact O-N 3.3Å
345	F	88.7	Confident	85	Confident	0 Å²	0	80.4 Å²	80.4	0%	0	44%	0.436	C	S	.	.	H	α-helix	trans	-71.5	-36	179.1	-64.3	-76.5	0	0	0	112.8	C258 V261 Y275 L277 I291 F293 I340 D341 E342 K343 L348 L349	C258-F345 WeakPolarHBondContact SG-CD2 3.27Å; C258-F345 VanDerWaalsContact SG-CG 3.58Å; V261-F345 HydrophobicContact CB-CE2 4.36Å; V261-F345 HydrophobicContact CB-CZ 4.19Å; V261-F345 HydrophobicContact CG1-CZ 4.08Å; V261-F345 HydrophobicContact CG2-CE2 4.45Å; V261-F345 HydrophobicContact CG2-CZ 4.23Å; Y275-F345 AromaticContact CD1-CD1 3.71Å; Y275-F345 HydrophobicContact CD1-CD1 3.71Å; Y275-F345 AromaticContact CD1-CE1 3.46Å; Y275-F345 HydrophobicContact CD1-CE1 3.46Å; Y275-F345 VanDerWaalsContact CD1-CE1 3.46Å; Y275-F345 HydrophobicContact CD1-CZ 4.16Å; Y275-F345 HydrophobicContact CE1-CD1 4Å; Y275-F345 AromaticContact CE1-CE1 4Å; Y275-F345 HydrophobicContact CE1-CE1 4Å; Y275-F345 HydrophobicContact CE1-CG 4.46Å; Y275-F345 HydrophobicContact CE1-CZ 4.44Å; Y275-F345 AromaticContact CG-CE1 3.98Å; Y275-F345 HydrophobicContact CG-CE1 3.98Å; Y275-F345 HydrophobicContact CG-CZ 4.47Å; L277-F345 HydrophobicContact CD1-CB 4.22Å; L277-F345 HydrophobicContact CD2-CB 4.37Å; I291-F345 HydrophobicContact CD1-CD1 3.63Å; I291-F345 HydrophobicContact CD1-CE1 4.27Å; F293-F345 HydrophobicContact CE1-CE1 4.35Å; I340-F345 HydrophobicContact CG2-CE2 3.76Å; I340-F345 HydrophobicContact CG2-CZ 3.84Å; D341-F345 WeakPolarHBondContact O-CD2 3.34Å; E342-F345 PolarHBondContact O-N 3.16Å; K343-F345 VanDerWaalsContact C-N 3.28Å; K343-F345 PolarHBondContact O-N 3.46Å; F345-L348 PolarHBondContact O-N 2.93Å; F345-L349 PolarHBondContact O-N 2.91Å; F345-L349 VanDerWaalsContact O-N 3.14Å
346	V	86	Confident	84.5	Confident	77 Å²	77	83 Å²	83	47%	0.467	45%	0.45	S	S	.	.	H	α-helix	trans	-65.6	-45.9	175.1	174.1	0	0	0	0	111.5	E342 K343 L348 L349 D350	E342-V346 WeakPolarHBondContact O-CG2 3.44Å; E342-V346 PolarHBondContact O-N 2.99Å; E342-V346 VanDerWaalsContact O-N 3.09Å; K343-V346 PolarHBondContact O-N 2.94Å; V346-L348 PolarHBondContact O-N 3.4Å; V346-L349 WeakPolarHBondContact O-CB 3.43Å; V346-L349 PolarHBondContact O-N 3.14Å; V346-L349 VanDerWaalsContact O-N 3.09Å; V346-D350 PolarHBondContact O-N 3.02Å
347	D	87.6	Confident	84.1	Confident	76 Å²	76	85.8 Å²	85.8	41%	0.406	47%	0.47	S	S	.	.	H	α-helix	trans	-64.3	-28.9	179	-73.7	-13	0	0	0	111.6	K343 D350 P351	K343-D347 WeakPolarHBondContact CE-OD2 3.47Å; K343-D347 WeakPolarHBondContact O-CB 3.47Å; K343-D347 PolarHBondContact O-N 2.96Å; D347-D350 CarbonylContact O-C 3.58Å; D347-P351 WeakPolarHBondContact O-CA 3.35Å
348	L	87.8	Confident	83.8	Confident	28 Å²	28	87.7 Å²	87.7	15%	0.147	50%	0.498	C	S	.	.	H	α-helix	trans	-76	-29.5	173.9	-72.9	173.9	0	0	0	113.7	I291 R330 V332 F344 F345 V346	I291-L348 HydrophobicContact CD1-CB 4.46Å; I291-L348 HydrophobicContact CD1-CD1 4.17Å; I291-L348 HydrophobicContact CG2-CD1 3.97Å; R330-L348 HydrophobicContact CG-CB 4.43Å; R330-L348 PolarHBondContact NE-O 3.29Å; R330-L348 PolarHBondContact NH2-O 3.14Å; V332-L348 HydrophobicContact CG2-CD1 3.88Å; V332-L348 HydrophobicContact CG2-CD2 3.5Å; V332-L348 HydrophobicContact CG2-CG 4.36Å; F344-L348 HydrophobicContact CD1-CD1 3.97Å; F344-L348 HydrophobicContact CE1-CD1 3.51Å; F344-L348 HydrophobicContact CE2-CD1 4.12Å; F344-L348 HydrophobicContact CG-CD1 4.45Å; F344-L348 HydrophobicContact CZ-CD1 3.6Å; F344-L348 VanDerWaalsContact O-CG 3.24Å; F344-L348 WeakPolarHBondContact O-CG 3.39Å; F344-L348 PolarHBondContact O-N 3.3Å; F345-L348 PolarHBondContact O-N 2.93Å; V346-L348 PolarHBondContact O-N 3.4Å
349	L	85.3	Confident	83.6	Confident	54 Å²	54	91.7 Å²	91.7	28%	0.283	51%	0.514	S	S	.	.	H	α-helix	trans	-69.6	-53.6	173.6	-174.1	66.2	0	0	0	110	L277 V288 L289 F345 V346	L277-L349 HydrophobicContact CD2-CB 4.14Å; L277-L349 HydrophobicContact CD2-CD1 4.37Å; L277-L349 HydrophobicContact CD2-CD2 4.36Å; V288-L349 HydrophobicContact CG1-CD1 3.73Å; L289-L349 HydrophobicContact CB-CD1 4.18Å; L289-L349 HydrophobicContact CD2-CD1 4.22Å; F345-L349 PolarHBondContact O-N 2.91Å; F345-L349 VanDerWaalsContact O-N 3.14Å; V346-L349 WeakPolarHBondContact O-CB 3.43Å; V346-L349 PolarHBondContact O-N 3.14Å; V346-L349 VanDerWaalsContact O-N 3.09Å
350	D	82.8	Confident	83.6	Confident	121 Å²	121	98 Å²	98	65%	0.647	54%	0.536	S	S	*	.	S	Bend	trans	-125.9	88.7	-177.5	-71.9	-38.4	0	0	0	111.3	V346 D347 S352	V346-D350 PolarHBondContact O-N 3.02Å; D347-D350 CarbonylContact O-C 3.58Å; D350-S352 PolarHBondContact O-N 3Å
351	P	80.3	Confident	83.5	Confident	85 Å²	85	104.9 Å²	104.9	55%	0.552	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-64.1	124	-178.8	25.4	-33.5	0	0	0	110.5	D347 S353	D347-P351 WeakPolarHBondContact O-CA 3.35Å; P351-S353 PolarHBondContact O-N 3.44Å
352	S	78	Confident	83.7	Confident	96 Å²	96	110.6 Å²	110.6	67%	0.671	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-58.2	135.5	177.2	67.4	0	0	0	0	110.8	D350	D350-S352 PolarHBondContact O-N 3Å
353	S	77.6	Confident	83.9	Confident	96 Å²	96	110.1 Å²	110.1	67%	0.671	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-59	146.2	174.5	54.4	0	0	0	0	111	P351 K355	P351-S353 PolarHBondContact O-N 3.44Å; S353-K355 PolarHBondContact O-N 3.23Å
354	P	76.8	Confident	83.6	Confident	121 Å²	121	113.9 Å²	113.9	79%	0.786	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-57.3	118.9	177.5	22.9	-32	0	0	0	109	D356	P354-D356 PolarHBondContact O-N 3.45Å
355	K	77.5	Confident	83.2	Confident	191 Å²	191	115.1 Å²	115.1	83%	0.83	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-66.4	122.7	177	-66.4	179.5	-178.3	175.4	0	108.3	S353 S357	S353-K355 PolarHBondContact O-N 3.23Å; K355-S357 PolarHBondContact O-N 3.22Å
356	D	77.1	Confident	83.1	Confident	162 Å²	162	119.5 Å²	119.5	87%	0.866	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-52.6	125.4	173.7	-81.7	-32.4	0	0	0	109.7	P354 A358	P354-D356 PolarHBondContact O-N 3.45Å; D356-A358 PolarHBondContact O-N 3.12Å; D356-A358 VanDerWaalsContact O-N 3.16Å
357	S	77.9	Confident	82.6	Confident	94 Å²	94	124.1 Å²	124.1	66%	0.657	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-57.8	123.6	177.5	63.4	0	0	0	0	109.1	K355 K359	K355-S357 PolarHBondContact O-N 3.22Å; S357-K359 PolarHBondContact O-N 3.44Å
358	A	80.6	Confident	82	Confident	106 Å²	106	131.6 Å²	131.6	88%	0.876	71%	0.71	S	S	*	*			trans	-59	112.9	178.2	0	0	0	0	0	110	D356	D356-A358 PolarHBondContact O-N 3.12Å; D356-A358 VanDerWaalsContact O-N 3.16Å
359	K	84.3	Confident	80.9	Confident	188 Å²	188	136.1 Å²	136.1	82%	0.817	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-82.4	123.8	177.9	-69	177.1	-177.2	170.9	0	109.5	S357	S357-K359 PolarHBondContact O-N 3.44Å
360	F	88.3	Confident	79.8	Confident	196 Å²	196	145.9 Å²	145.9	86%	0.86	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-63.4	137.6	171.6	-176.7	-103.3	0	0	0	110.6
361	L	87	Confident	79.5	Confident	148 Å²	148	142.7 Å²	142.7	78%	0.775	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-68.9	135	179.4	-68.6	173.1	0	0	0	110.7
362	K	90.8	Very high	79.6	Confident	195 Å²	195	147.1 Å²	147.1	85%	0.848	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-61.3	147.8	172.6	-69.1	-178.2	-179.8	-179.7	0	110.2
363	P	88.9	Confident	79.7	Confident	118 Å²	118	153.8 Å²	153.8	77%	0.766	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-58.7	153.2	178	25	-34.3	0	0	0	111.5	G365	P363-G365 PolarHBondContact O-N 2.96Å
364	K	82.7	Confident	79.9	Confident	210 Å²	210	159.6 Å²	159.6	91%	0.913	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-60.8	131.1	173.3	-66.8	-175.9	-179.9	-179.8	0	109
365	G	82.3	Confident	80.3	Confident	56 Å²	56	160.8 Å²	160.8	58%	0.577	79%	0.79	S	S	*	*			trans	-66.6	-175.7	178	0	0	0	0	0	113.4	P363 I367	P363-G365 PolarHBondContact O-N 2.96Å; G365-I367 PolarHBondContact O-N 3.17Å
366	P	85.8	Confident	80.3	Confident	91 Å²	91	158.5 Å²	158.5	59%	0.591	79%	0.786	S	S	*	*			trans	-55.4	132	-179.6	-18.9	28.5	0	0	0	112.5	R368 Q369	P366-R368 PolarHBondContact O-N 3.17Å; P366-Q369 HydrophobicContact CB-CG 4.32Å; P366-Q369 HydrophobicContact CG-CG 4.44Å
367	I	75.3	Confident	80.2	Confident	175 Å²	175	157 Å²	157	90%	0.897	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	-22.6	-170.5	-64	168.4	0	0	0	113.7	G365	G365-I367 PolarHBondContact O-N 3.17Å
368	R	75.1	Confident	79.3	Confident	232 Å²	232	159.9 Å²	159.9	88%	0.875	79%	0.786	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.4	52.8	-175.1	-64.7	-174.2	175.8	-170.4	-0.5	113	P366 R370	P366-R368 PolarHBondContact O-N 3.17Å; R368-R370 PolarHBondContact O-N 3.37Å; R368-R370 VanDerWaalsContact O-N 3.07Å
369	Q	63.9	Low	77.9	Confident	124 Å²	124	160.5 Å²	160.5	58%	0.579	78%	0.779	S	S	*	*			trans	-72.9	98.6	166.6	-77.3	-171.6	-11.1	0	0	109.7	P366 G371	P366-Q369 HydrophobicContact CB-CG 4.32Å; P366-Q369 HydrophobicContact CG-CG 4.44Å; Q369-G371 PolarHBondContact O-N 3.24Å
370	R	62.9	Low	76.3	Confident	258 Å²	258	157.2 Å²	157.2	97%	0.974	78%	0.776	S	S	*	*			trans	-77.7	95.3	165	-83.3	-175.6	172.4	-176	-2.4	108.2	R368	R368-R370 PolarHBondContact O-N 3.37Å; R368-R370 VanDerWaalsContact O-N 3.07Å
371	G	76	Confident	74.1	Confident	55 Å²	55	156.4 Å²	156.4	57%	0.567	79%	0.788	S	S	*	*	S	Bend	trans	131.7	150.9	170.2	0	0	0	0	0	113.9	Q369	Q369-G371 PolarHBondContact O-N 3.24Å
372	E	82	Confident	73.5	Confident	178 Å²	178	156.8 Å²	156.8	83%	0.832	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-64.4	151.6	171.8	-66.2	179.5	162.1	0	0	111.1	R374	E372-R374 PolarHBondContact O-N 2.66Å
373	R	80.4	Confident	72.6	Confident	236 Å²	236	154.8 Å²	154.8	89%	0.891	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-64.2	120	174.5	-62.7	179.3	81.7	174.5	4.7	108.3
374	R	82.4	Confident	71.6	Confident	217 Å²	217	156.8 Å²	156.8	82%	0.819	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-102.3	149.5	175.7	-63.2	179.1	178.5	-171.3	-2.9	109.5	E372	E372-R374 PolarHBondContact O-N 2.66Å
375	L	85.4	Confident	71	Confident	147 Å²	147	153.7 Å²	153.7	77%	0.77	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-69.2	129.1	165.2	-110.4	82.8	0	0	0	108.4	N377	L375-N377 VanDerWaalsContact C-N 3.33Å; L375-N377 WeakPolarHBondContact CD2-OD1 3.21Å; L375-N377 PolarHBondContact O-N 2.92Å
376	N	77.5	Confident	70.3	Confident	142 Å²	142	159.8 Å²	159.8	76%	0.759	79%	0.791	S	S	*	*			trans	-86.6	79	169.7	-70.8	-1.1	0	0	0	108.5	L378	N376-L378 PolarHBondContact O-N 3.11Å
377	N	74.4	Confident	69.3	Low	132 Å²	132	164.4 Å²	164.4	71%	0.706	81%	0.805	S	S	*	*			trans	-78	72.3	168.8	-72	1.3	0	0	0	108.8	L375 T379	L375-N377 VanDerWaalsContact C-N 3.33Å; L375-N377 WeakPolarHBondContact CD2-OD1 3.21Å; L375-N377 PolarHBondContact O-N 2.92Å; N377-T379 PolarHBondContact O-N 3.12Å
378	L	59.1	Low	68.8	Low	154 Å²	154	163.6 Å²	163.6	81%	0.806	80%	0.798	S	S	*	*			trans	-77.4	101	163.1	-69	170	0	0	0	106.4	N376	N376-L378 PolarHBondContact O-N 3.11Å
379	T	50.6	Low	68.4	Low	119 Å²	119	158.4 Å²	158.4	73%	0.73	79%	0.792	S	S	*	*			trans	-54.3	127.3	162.1	24.4	0	0	0	0	108	N377 T381	N377-T379 PolarHBondContact O-N 3.12Å; T379-T381 PolarHBondContact O-N 3.17Å; T379-T381 VanDerWaalsContact O-N 3.1Å
380	P	52.1	Low	68.7	Low	118 Å²	118	161.3 Å²	161.3	77%	0.766	81%	0.81	S	S	*	*			trans	-63.2	115.4	170.7	25.8	-29.6	0	0	0	107.5
381	T	41.9	Very low	69.3	Low	179 Å²	179	152.5 Å²	152.5	100%	1.098	80%	0.795	S	S	*	*			trans	-75.8	0	167.9	45.6	0	0	0	0	111	T379	T379-T381 PolarHBondContact O-N 3.17Å; T379-T381 VanDerWaalsContact O-N 3.1Å

Retrieved 381 of 381 residues in 156 ms (Link to these results)

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