A0A024R7W9_HUMAN Loading...

COP9 signalosome complex subunit 5

AlphaFold DB (Q92905), UniProt , Accession A0A024R7W9, Species HUMAN (Homo sapiens, Human), Gene COPS5, Length 334 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	45.7	Very low	76.1	Confident	234 Å²	234	101.4 Å²	101.4	100%	1.153	64%	0.637	S	S	*	*				0	6.7	0	-74.1	-158.4	-86.4	0	0	114.7
2	A	52.7	Low	77.4	Confident	95 Å²	95	99.8 Å²	99.8	79%	0.785	63%	0.626	S	S	*	*			trans	-85.4	-14	-175	0	0	0	0	0	116
3	A	54.8	Low	78.6	Confident	92 Å²	92	102.7 Å²	102.7	76%	0.76	62%	0.618	S	S	*	*	H	α-helix	trans	-78	-20	-173.6	0	0	0	0	0	114.9
4	S	68.6	Low	79.6	Confident	91 Å²	91	100.4 Å²	100.4	64%	0.636	60%	0.598	S	S	*	*	H	α-helix	trans	-79.2	-30.7	-174.6	67.6	0	0	0	0	113.9	M8	S4-M8 PolarHBondContact O-N 3.31Å
5	G	79	Confident	80.2	Confident	45 Å²	45	103.3 Å²	103.3	46%	0.464	61%	0.608	S	S	.	*	H	α-helix	trans	-69.1	-43.3	-178.2	0	0	0	0	0	113.1	G7 M8 A9	G5-G7 PolarHBondContact O-N 3.4Å; G5-M8 PolarHBondContact O-N 3Å; G5-A9 WeakPolarHBondContact O-CB 3.45Å; G5-A9 PolarHBondContact O-N 3.49Å
6	S	85.8	Confident	81	Confident	88 Å²	88	101.4 Å²	101.4	62%	0.615	61%	0.607	S	S	*	*	H	α-helix	trans	-63.3	-43.4	-179.6	-171.6	0	0	0	0	112.2	A9 Q10	S6-A9 PolarHBondContact O-N 3.47Å; S6-Q10 PolarHBondContact O-N 3.01Å
7	G	88.3	Confident	81.7	Confident	33 Å²	33	100.6 Å²	100.6	34%	0.34	60%	0.6	S	S	.	*	H	α-helix	trans	-67.3	-36.8	179.9	0	0	0	0	0	113	G5 K11	G5-G7 PolarHBondContact O-N 3.4Å; G7-K11 WeakPolarHBondContact O-CG 3.49Å; G7-K11 PolarHBondContact O-N 3.38Å
8	M	90.4	Very high	82	Confident	120 Å²	120	102.7 Å²	102.7	59%	0.591	61%	0.607	S	S	*	*	H	α-helix	trans	-68.3	-45.2	174.7	-76.9	-61.8	-58.5	0	0	112	S4 G5 Q10 K11 T12	S4-M8 PolarHBondContact O-N 3.31Å; G5-M8 PolarHBondContact O-N 3Å; M8-Q10 VanDerWaalsContact C-N 3.32Å; M8-Q10 PolarHBondContact O-N 2.95Å; M8-K11 PolarHBondContact O-N 3.07Å; M8-T12 PolarHBondContact O-N 3.4Å; M8-T12 PolarHBondContact O-OG1 3.12Å; M8-T12 VanDerWaalsContact O-OG1 3.1Å
9	A	91.5	Very high	82.1	Confident	63 Å²	63	102.6 Å²	102.6	52%	0.521	60%	0.601	S	S	.	*	H	α-helix	trans	-59.5	-42	178	0	0	0	0	0	112.1	G5 S6 W13	G5-A9 WeakPolarHBondContact O-CB 3.45Å; G5-A9 PolarHBondContact O-N 3.49Å; S6-A9 PolarHBondContact O-N 3.47Å; A9-W13 WeakPolarHBondContact O-CB 3.4Å; A9-W13 PolarHBondContact O-N 3.1Å
10	Q	90	Very high	81.9	Confident	112 Å²	112	106.4 Å²	106.4	52%	0.523	61%	0.613	S	S	.	*	H	α-helix	trans	-60.7	-51.6	175.3	-178	-177.9	-9.9	0	0	111.7	S6 M8 T12 W13 E14	S6-Q10 PolarHBondContact O-N 3.01Å; M8-Q10 VanDerWaalsContact C-N 3.32Å; M8-Q10 PolarHBondContact O-N 2.95Å; Q10-T12 VanDerWaalsContact C-N 3.33Å; Q10-T12 PolarHBondContact O-N 3.29Å; Q10-W13 WeakPolarHBondContact O-CB 3.39Å; Q10-W13 PolarHBondContact O-N 3.19Å; Q10-W13 VanDerWaalsContact O-N 3.12Å; Q10-E14 HydrophobicContact CG-CG 4.5Å; Q10-E14 WeakPolarHBondContact CG-OE1 3.46Å; Q10-E14 PolarHBondContact NE2-OE1 2.87Å; Q10-E14 WeakPolarHBondContact O-CG 3.41Å; Q10-E14 PolarHBondContact O-N 3.21Å
11	K	90	Very high	81.4	Confident	142 Å²	142	110.4 Å²	110.4	62%	0.617	63%	0.626	S	S	*	*	H	α-helix	trans	-60.1	-41.7	179.6	-73.8	-179.7	179.3	-173.8	0	112.6	G7 M8 W13 E14 L15	G7-K11 WeakPolarHBondContact O-CG 3.49Å; G7-K11 PolarHBondContact O-N 3.38Å; M8-K11 PolarHBondContact O-N 3.07Å; K11-W13 VanDerWaalsContact C-N 3.31Å; K11-E14 PolarHBondContact O-N 3.36Å; K11-L15 WeakPolarHBondContact O-CB 3.37Å; K11-L15 PolarHBondContact O-N 3.04Å
12	T	92.6	Very high	82.7	Confident	83 Å²	83	103.5 Å²	103.5	51%	0.509	61%	0.606	S	S	.	*	H	α-helix	trans	-63	-40.5	176.2	-61.1	0	0	0	0	111.3	M8 Q10 A16	M8-T12 PolarHBondContact O-N 3.4Å; M8-T12 PolarHBondContact O-OG1 3.12Å; M8-T12 VanDerWaalsContact O-OG1 3.1Å; Q10-T12 VanDerWaalsContact C-N 3.33Å; Q10-T12 PolarHBondContact O-N 3.29Å; T12-A16 VanDerWaalsContact O-CB 3.25Å; T12-A16 WeakPolarHBondContact O-CB 3.46Å; T12-A16 PolarHBondContact O-N 2.91Å
13	W	92.7	Very high	83.4	Confident	137 Å²	137	106.9 Å²	106.9	52%	0.519	61%	0.606	S	S	.	*	H	α-helix	trans	-67.1	-44.4	177.4	-179.2	88.2	0	0	0	112.4	A9 Q10 K11 L15 A16 N17 M19	A9-W13 WeakPolarHBondContact O-CB 3.4Å; A9-W13 PolarHBondContact O-N 3.1Å; Q10-W13 WeakPolarHBondContact O-CB 3.39Å; Q10-W13 PolarHBondContact O-N 3.19Å; Q10-W13 VanDerWaalsContact O-N 3.12Å; K11-W13 VanDerWaalsContact C-N 3.31Å; W13-L15 VanDerWaalsContact C-N 3.33Å; W13-L15 PolarHBondContact O-N 2.8Å; W13-A16 PolarHBondContact O-N 3.48Å; W13-N17 VanDerWaalsContact CD1-ND2 3.28Å; W13-N17 PolarHBondContact NE1-ND2 3.04Å; W13-N17 WeakPolarHBondContact O-CB 3.25Å; W13-N17 PolarHBondContact O-N 3.44Å; W13-N17 PolarHBondContact O-ND2 3.42Å; W13-M19 HydrophobicContact CE3-CE 4.24Å; W13-M19 HydrophobicContact CE3-SD 4.29Å; W13-M19 HydrophobicContact CH2-CE 3.08Å; W13-M19 HydrophobicContact CH2-SD 3.84Å; W13-M19 HydrophobicContact CZ2-CE 3.99Å; W13-M19 HydrophobicContact CZ3-CE 3.23Å; W13-M19 HydrophobicContact CZ3-SD 3.35Å; W13-M19 WeakPolarHBondContact CZ3-SD 3.38Å
14	E	92.5	Very high	84.4	Confident	71 Å²	71	105 Å²	105	33%	0.332	59%	0.587	S	S	.	*	H	α-helix	trans	-58.5	-46	176	-73.1	168.3	-180	0	0	111.2	Q10 K11 N17 N18 M19	Q10-E14 HydrophobicContact CG-CG 4.5Å; Q10-E14 WeakPolarHBondContact CG-OE1 3.46Å; Q10-E14 PolarHBondContact NE2-OE1 2.87Å; Q10-E14 WeakPolarHBondContact O-CG 3.41Å; Q10-E14 PolarHBondContact O-N 3.21Å; K11-E14 PolarHBondContact O-N 3.36Å; E14-N17 PolarHBondContact O-N 3.45Å; E14-N18 PolarHBondContact O-N 2.92Å; E14-M19 HydrophobicContact CB-CB 4.35Å; E14-M19 HydrophobicContact CG-SD 4.45Å; E14-M19 PolarHBondContact O-N 3.02Å
15	L	89.2	Confident	85.1	Confident	143 Å²	143	106 Å²	106	75%	0.749	58%	0.584	S	S	*	*	H	α-helix	trans	-62.8	-49.3	177.1	-168.6	92.9	0	0	0	111.8	K11 W13 N17 N18	K11-L15 WeakPolarHBondContact O-CB 3.37Å; K11-L15 PolarHBondContact O-N 3.04Å; W13-L15 VanDerWaalsContact C-N 3.33Å; W13-L15 PolarHBondContact O-N 2.8Å; L15-N17 PolarHBondContact O-N 3.21Å; L15-N18 PolarHBondContact O-N 3.22Å
16	A	92.8	Very high	85.5	Confident	73 Å²	73	105.8 Å²	105.8	60%	0.603	57%	0.573	S	S	*	*	H	α-helix	trans	-64.8	-28.7	-177	0	0	0	0	0	113	T12 W13	T12-A16 VanDerWaalsContact O-CB 3.25Å; T12-A16 WeakPolarHBondContact O-CB 3.46Å; T12-A16 PolarHBondContact O-N 2.91Å; W13-A16 PolarHBondContact O-N 3.48Å
17	N	92.9	Very high	85.7	Confident	89 Å²	89	105.1 Å²	105.1	48%	0.476	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.7	6.8	179.9	-68	-82.7	0	0	0	113.5	W13 E14 L15 M19	W13-N17 VanDerWaalsContact CD1-ND2 3.28Å; W13-N17 PolarHBondContact NE1-ND2 3.04Å; W13-N17 WeakPolarHBondContact O-CB 3.25Å; W13-N17 PolarHBondContact O-N 3.44Å; W13-N17 PolarHBondContact O-ND2 3.42Å; E14-N17 PolarHBondContact O-N 3.45Å; L15-N17 PolarHBondContact O-N 3.21Å; N17-M19 PolarHBondContact O-N 3.27Å; N17-M19 VanDerWaalsContact O-N 3.17Å
18	N	87.4	Confident	85.9	Confident	137 Å²	137	105.4 Å²	105.4	73%	0.733	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	48.9	40.7	-175.5	-58.8	-63.2	0	0	0	112.2	E14 L15 Q20	E14-N18 PolarHBondContact O-N 2.92Å; L15-N18 PolarHBondContact O-N 3.22Å; N18-Q20 PolarHBondContact O-N 3.19Å
19	M	83.7	Confident	85.9	Confident	101 Å²	101	102.8 Å²	102.8	50%	0.498	54%	0.537	S	S	.	.	P	Polyproline II helix	trans	-64.8	121	-173.9	-172.4	153.4	-72.6	0	0	109.7	W13 E14 N17	W13-M19 HydrophobicContact CE3-CE 4.24Å; W13-M19 HydrophobicContact CE3-SD 4.29Å; W13-M19 HydrophobicContact CH2-CE 3.08Å; W13-M19 HydrophobicContact CH2-SD 3.84Å; W13-M19 HydrophobicContact CZ2-CE 3.99Å; W13-M19 HydrophobicContact CZ3-CE 3.23Å; W13-M19 HydrophobicContact CZ3-SD 3.35Å; W13-M19 WeakPolarHBondContact CZ3-SD 3.38Å; E14-M19 HydrophobicContact CB-CB 4.35Å; E14-M19 HydrophobicContact CG-SD 4.45Å; E14-M19 PolarHBondContact O-N 3.02Å; N17-M19 PolarHBondContact O-N 3.27Å; N17-M19 VanDerWaalsContact O-N 3.17Å
20	Q	77.8	Confident	85.9	Confident	178 Å²	178	106.8 Å²	106.8	83%	0.832	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-94.6	130.8	177	-63.7	-176.7	0.9	0	0	109.3	N18 A22	N18-Q20 PolarHBondContact O-N 3.19Å; Q20-A22 PolarHBondContact O-N 3.44Å
21	E	71.9	Confident	86	Confident	191 Å²	191	104 Å²	104	89%	0.893	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-67.4	128.4	168.5	-70.5	-174.5	170.3	0	0	109
22	A	71.7	Confident	86.1	Confident	89 Å²	89	101.1 Å²	101.1	74%	0.736	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-61.7	152.1	168.5	0	0	0	0	0	109.9	Q20 S24	Q20-A22 PolarHBondContact O-N 3.44Å; A22-S24 PolarHBondContact O-N 3.4Å
23	Q	67.9	Low	86.1	Confident	166 Å²	166	103.5 Å²	103.5	78%	0.776	52%	0.522	S	S	*	.			trans	-48.8	114.8	177.6	-77	-176.9	-33.1	0	0	110.3
24	S	76.7	Confident	86.1	Confident	53 Å²	53	103.4 Å²	103.4	37%	0.371	53%	0.526	S	S	.	.			trans	-73.8	142.6	-177.1	177.9	0	0	0	0	109.6	A22 D26 E27	A22-S24 PolarHBondContact O-N 3.4Å; S24-D26 PolarHBondContact O-N 3.37Å; S24-D26 PolarHBondContact OG-N 3.17Å; S24-D26 VanDerWaalsContact OG-N 3.15Å; S24-E27 WeakPolarHBondContact O-CB 3.14Å; S24-E27 WeakPolarHBondContact O-CG 3.45Å; S24-E27 PolarHBondContact O-N 3.23Å
25	I	81.8	Confident	86.1	Confident	111 Å²	111	103.9 Å²	103.9	57%	0.569	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-52.8	-21.3	167.4	56.8	166.2	0	0	0	112.6	E27 I28	I25-E27 VanDerWaalsContact C-N 3.34Å; I25-I28 WeakPolarHBondContact O-CG2 3.37Å
26	D	88.9	Confident	86.3	Confident	42 Å²	42	97.6 Å²	97.6	23%	0.225	50%	0.495	C	S	.	.	G	3₁₀ helix	trans	-82.6	-6.5	-179.2	-62.4	-23.9	0	0	0	113.3	S24 I28 Y29 S231 S232	S24-D26 PolarHBondContact O-N 3.37Å; S24-D26 PolarHBondContact OG-N 3.17Å; S24-D26 VanDerWaalsContact OG-N 3.15Å; D26-I28 PolarHBondContact O-N 3.31Å; D26-Y29 WeakPolarHBondContact O-CB 3.38Å; D26-Y29 PolarHBondContact O-N 3.5Å; D26-S231 WeakPolarHBondContact OD1-CA 3.42Å; D26-S231 WeakPolarHBondContact OD1-CB 3.46Å; D26-S232 PolarHBondContact OD1-N 3.26Å; D26-S232 VanDerWaalsContact OD2-CB 3.3Å; D26-S232 WeakPolarHBondContact OD2-CB 3.33Å; D26-S232 PolarHBondContact OD2-OG 2.98Å
27	E	89.5	Confident	86.3	Confident	74 Å²	74	99.5 Å²	99.5	35%	0.346	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-59.5	-32.5	178	-75.2	-175.2	174.3	0	0	112.9	S24 I25 Y29 K30	S24-E27 WeakPolarHBondContact O-CB 3.14Å; S24-E27 WeakPolarHBondContact O-CG 3.45Å; S24-E27 PolarHBondContact O-N 3.23Å; I25-E27 VanDerWaalsContact C-N 3.34Å; E27-Y29 PolarHBondContact O-N 3.07Å; E27-K30 WeakPolarHBondContact O-CB 3.45Å; E27-K30 PolarHBondContact O-N 2.99Å
28	I	92.3	Very high	86.4	Confident	38 Å²	38	100.4 Å²	100.4	20%	0.195	49%	0.492	C	S	.	.	G	3₁₀ helix	trans	-58.4	-19.7	174.9	-166.1	168.9	0	0	0	112.7	I25 D26 K56 K84 I91 F229	I25-I28 WeakPolarHBondContact O-CG2 3.37Å; D26-I28 PolarHBondContact O-N 3.31Å; I28-K56 HydrophobicContact CD1-CD 3.99Å; I28-K84 VanDerWaalsContact O-CE 3.26Å; I28-K84 WeakPolarHBondContact O-CE 3.35Å; I28-K84 PolarHBondContact O-NZ 2.88Å; I28-I91 HydrophobicContact CD1-CD1 4.21Å; I28-I91 HydrophobicContact CD1-CG2 4.1Å; I28-I91 HydrophobicContact CG1-CD1 4.1Å; I28-I91 HydrophobicContact CG1-CG2 4.17Å; I28-F229 HydrophobicContact CD1-CD1 3.96Å; I28-F229 HydrophobicContact CD1-CD2 3.99Å; I28-F229 HydrophobicContact CD1-CE1 3.99Å; I28-F229 HydrophobicContact CD1-CE2 4.02Å; I28-F229 HydrophobicContact CD1-CG 3.95Å; I28-F229 HydrophobicContact CD1-CZ 4.02Å; I28-F229 HydrophobicContact CG1-CE2 4.23Å; I28-F229 HydrophobicContact CG1-CZ 4.39Å; I28-F229 HydrophobicContact CG2-CD2 3.6Å; I28-F229 HydrophobicContact CG2-CE2 3.7Å; I28-F229 HydrophobicContact CG2-CG 4.46Å
29	Y	91.4	Very high	86.6	Confident	65 Å²	65	95.4 Å²	95.4	26%	0.255	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-87.3	-9.9	177.2	-65	-101.1	0	0	0	113.8	D26 E27 M93 F229 K230 S231 D234	D26-Y29 WeakPolarHBondContact O-CB 3.38Å; D26-Y29 PolarHBondContact O-N 3.5Å; E27-Y29 PolarHBondContact O-N 3.07Å; Y29-M93 HydrophobicContact CD1-CE 3.14Å; Y29-M93 HydrophobicContact CD2-CE 4.47Å; Y29-M93 HydrophobicContact CE1-CE 3.67Å; Y29-M93 HydrophobicContact CG-CE 3.61Å; Y29-F229 HydrophobicContact CD2-CE2 4.43Å; Y29-F229 HydrophobicContact CE1-CE2 4.07Å; Y29-F229 AromaticContact CE2-CD2 3.76Å; Y29-F229 HydrophobicContact CE2-CD2 3.76Å; Y29-F229 AromaticContact CE2-CE2 3.73Å; Y29-F229 HydrophobicContact CE2-CE2 3.73Å; Y29-F229 AromaticContact CZ-CD2 3.78Å; Y29-F229 AromaticContact CZ-CE2 3.52Å; Y29-K230 WeakPolarHBondContact OH-CA 3.47Å; Y29-S231 PolarHBondContact OH-N 3.27Å; Y29-D234 PolarHBondContact OH-OD2 3.14Å; Y29-D234 VanDerWaalsContact OH-OD2 3.08Å
30	K	91	Very high	87	Confident	147 Å²	147	93.8 Å²	93.8	64%	0.639	46%	0.458	S	S	*	.			trans	-74.9	129.9	178.1	-67.2	178.9	179.4	170.5	0	111.1	E27 K84	E27-K30 WeakPolarHBondContact O-CB 3.45Å; E27-K30 PolarHBondContact O-N 2.99Å; K30-K84 PolarHBondContact O-NZ 3.44Å
31	Y	91.7	Very high	87.7	Confident	55 Å²	55	89.3 Å²	89.3	22%	0.216	45%	0.451	C	S	.	.			trans	-101.4	116.9	178.5	-174.9	-91.9	0	0	0	111.4	K33 Q36 K84 L130 E131	Y31-K33 HydrophobicContact CD1-CB 4.34Å; Y31-K33 HydrophobicContact CE1-CB 3.77Å; Y31-K33 HydrophobicContact CE1-CG 4.26Å; Y31-Q36 HydrophobicContact CE2-CG 3.85Å; Y31-K84 HydrophobicContact CD2-CD 4.36Å; Y31-L130 HydrophobicContact CD1-CB 3.51Å; Y31-L130 HydrophobicContact CD1-CD1 3.97Å; Y31-L130 HydrophobicContact CD1-CG 4.39Å; Y31-L130 HydrophobicContact CD2-CB 4.49Å; Y31-L130 HydrophobicContact CE1-CB 3.76Å; Y31-L130 HydrophobicContact CG-CB 3.91Å; Y31-E131 HydrophobicContact CD2-CG 3.98Å; Y31-E131 HydrophobicContact CE2-CG 4.36Å
32	D	92.2	Very high	88.7	Confident	81 Å²	81	83.5 Å²	83.5	43%	0.433	44%	0.436	S	S	.	.			trans	-101.9	103.9	170.7	-174.1	-24.3	0	0	0	110.3	K34 Q35 Q36	D32-K34 VanDerWaalsContact C-N 3.3Å; D32-K34 PolarHBondContact O-N 3.28Å; D32-K34 WeakPolarHBondContact OD1-CA 3.33Å; D32-K34 WeakPolarHBondContact OD1-CB 3.46Å; D32-K34 PolarHBondContact OD1-N 3.19Å; D32-Q35 HydrophobicContact CB-CB 3.79Å; D32-Q35 PolarHBondContact O-N 2.9Å; D32-Q35 PolarHBondContact OD1-N 3.1Å; D32-Q36 VanDerWaalsContact O-CG 3.29Å; D32-Q36 WeakPolarHBondContact O-CG 3.28Å; D32-Q36 PolarHBondContact O-N 3.16Å
33	K	91.6	Very high	89.7	Confident	132 Å²	132	84.7 Å²	84.7	57%	0.574	43%	0.425	S	S	*	.	H	α-helix	trans	-60.6	-38.2	179.9	-172.4	176.4	179.4	179.1	0	112.7	Y31 Q37	Y31-K33 HydrophobicContact CD1-CB 4.34Å; Y31-K33 HydrophobicContact CE1-CB 3.77Å; Y31-K33 HydrophobicContact CE1-CG 4.26Å; K33-Q37 WeakPolarHBondContact O-CB 3.49Å; K33-Q37 VanDerWaalsContact O-CG 3.26Å; K33-Q37 WeakPolarHBondContact O-CG 3.3Å; K33-Q37 PolarHBondContact O-N 3.22Å
34	K	93.5	Very high	90.8	Very high	136 Å²	136	78.4 Å²	78.4	59%	0.591	40%	0.398	S	S	*	.	H	α-helix	trans	-69.8	-47.3	-176.9	-177.9	-176.6	171.3	-170.9	0	109.7	D32 Q36 Q37 E38	D32-K34 VanDerWaalsContact C-N 3.3Å; D32-K34 PolarHBondContact O-N 3.28Å; D32-K34 WeakPolarHBondContact OD1-CA 3.33Å; D32-K34 WeakPolarHBondContact OD1-CB 3.46Å; D32-K34 PolarHBondContact OD1-N 3.19Å; K34-Q36 VanDerWaalsContact C-N 3.31Å; K34-Q36 PolarHBondContact O-N 3.43Å; K34-Q37 PolarHBondContact O-N 3.1Å; K34-E38 WeakPolarHBondContact CE-OE1 3.3Å; K34-E38 IonicContact NZ-OE1 2.92Å; K34-E38 WeakPolarHBondContact O-CG 3.37Å; K34-E38 PolarHBondContact O-N 3.29Å
35	Q	92.4	Very high	91.5	Very high	80 Å²	80	76.7 Å²	76.7	37%	0.374	38%	0.384	S	S	.	.	H	α-helix	trans	-56.7	-45.8	175.6	-172	-166.5	33.8	0	0	111.4	D32 Q37 E38 I39	D32-Q35 HydrophobicContact CB-CB 3.79Å; D32-Q35 PolarHBondContact O-N 2.9Å; D32-Q35 PolarHBondContact OD1-N 3.1Å; Q35-Q37 PolarHBondContact O-N 3.35Å; Q35-E38 PolarHBondContact O-N 3.01Å; Q35-I39 HydrophobicContact CG-CD1 4.11Å; Q35-I39 WeakPolarHBondContact O-CG1 3.47Å; Q35-I39 PolarHBondContact O-N 2.87Å
36	Q	93.8	Very high	91.9	Very high	12 Å²	12	75.5 Å²	75.5	6%	0.056	38%	0.382	C	S	.	.	H	α-helix	trans	-63.3	-40.6	178.5	-67	-57.7	-60.3	0	0	112.1	Y31 D32 K34 I39 L40 V85	Y31-Q36 HydrophobicContact CE2-CG 3.85Å; D32-Q36 VanDerWaalsContact O-CG 3.29Å; D32-Q36 WeakPolarHBondContact O-CG 3.28Å; D32-Q36 PolarHBondContact O-N 3.16Å; K34-Q36 VanDerWaalsContact C-N 3.31Å; K34-Q36 PolarHBondContact O-N 3.43Å; Q36-I39 PolarHBondContact O-N 3.02Å; Q36-L40 WeakPolarHBondContact O-CB 3.39Å; Q36-L40 VanDerWaalsContact O-CG 3.23Å; Q36-L40 WeakPolarHBondContact O-CG 3.27Å; Q36-L40 PolarHBondContact O-N 3.4Å; Q36-V85 PolarHBondContact NE2-O 3.48Å
37	Q	92.8	Very high	91.9	Very high	112 Å²	112	82.7 Å²	82.7	52%	0.523	41%	0.411	S	S	.	.	H	α-helix	trans	-64	-39.9	175.7	-74.8	175.6	-22.8	0	0	112.5	K33 K34 Q35 L40 A41	K33-Q37 WeakPolarHBondContact O-CB 3.49Å; K33-Q37 VanDerWaalsContact O-CG 3.26Å; K33-Q37 WeakPolarHBondContact O-CG 3.3Å; K33-Q37 PolarHBondContact O-N 3.22Å; K34-Q37 PolarHBondContact O-N 3.1Å; Q35-Q37 PolarHBondContact O-N 3.35Å; Q37-L40 PolarHBondContact O-N 3.09Å; Q37-A41 WeakPolarHBondContact O-CB 3.39Å; Q37-A41 PolarHBondContact O-N 2.82Å
38	E	94.3	Very high	91.9	Very high	109 Å²	109	82.5 Å²	82.5	51%	0.509	41%	0.412	S	S	.	.	H	α-helix	trans	-64.7	-43.2	177.1	-72.8	173.3	177.1	0	0	111.9	K34 Q35 A41 A42	K34-E38 WeakPolarHBondContact CE-OE1 3.3Å; K34-E38 IonicContact NZ-OE1 2.92Å; K34-E38 WeakPolarHBondContact O-CG 3.37Å; K34-E38 PolarHBondContact O-N 3.29Å; Q35-E38 PolarHBondContact O-N 3.01Å; E38-A41 PolarHBondContact O-N 3.19Å; E38-A42 WeakPolarHBondContact O-CB 3.5Å; E38-A42 PolarHBondContact O-N 3.25Å
39	I	92.9	Very high	91.7	Very high	32 Å²	32	84.1 Å²	84.1	16%	0.164	42%	0.419	C	S	.	.	H	α-helix	trans	-62.4	-45.5	176	-65.6	164.6	0	0	0	110.8	Q35 Q36 A41 A42 K43 W45 V85	Q35-I39 HydrophobicContact CG-CD1 4.11Å; Q35-I39 WeakPolarHBondContact O-CG1 3.47Å; Q35-I39 PolarHBondContact O-N 2.87Å; Q36-I39 PolarHBondContact O-N 3.02Å; I39-A41 VanDerWaalsContact C-N 3.28Å; I39-A41 PolarHBondContact O-N 2.93Å; I39-A42 PolarHBondContact O-N 3.38Å; I39-K43 PolarHBondContact O-N 3.41Å; I39-W45 HydrophobicContact CG2-CH2 4.15Å; I39-W45 HydrophobicContact CG2-CZ3 3.72Å; I39-V85 HydrophobicContact CB-CG2 4.31Å; I39-V85 HydrophobicContact CD1-CG2 4.26Å; I39-V85 HydrophobicContact CG2-CG2 3.56Å
40	L	90.7	Very high	91.7	Very high	67 Å²	67	83.7 Å²	83.7	35%	0.351	42%	0.419	S	S	.	.	H	α-helix	trans	-64.8	-30.8	177.3	-70.6	170.9	0	0	0	113	Q36 Q37 K43 W45 P164	Q36-L40 WeakPolarHBondContact O-CB 3.39Å; Q36-L40 VanDerWaalsContact O-CG 3.23Å; Q36-L40 WeakPolarHBondContact O-CG 3.27Å; Q36-L40 PolarHBondContact O-N 3.4Å; Q37-L40 PolarHBondContact O-N 3.09Å; L40-K43 WeakPolarHBondContact O-CE 3.44Å; L40-K43 WeakPolarHBondContact O-CG 2.84Å; L40-W45 HydrophobicContact CD2-CH2 4.11Å; L40-W45 HydrophobicContact CD2-CZ2 4.45Å; L40-P164 HydrophobicContact CD2-CG 4.31Å
41	A	92.7	Very high	91.9	Very high	83 Å²	83	78.9 Å²	78.9	69%	0.686	40%	0.397	S	S	*	.	H	α-helix	trans	-73.8	-40.1	173.9	0	0	0	0	0	111.7	Q37 E38 I39	Q37-A41 WeakPolarHBondContact O-CB 3.39Å; Q37-A41 PolarHBondContact O-N 2.82Å; E38-A41 PolarHBondContact O-N 3.19Å; I39-A41 VanDerWaalsContact C-N 3.28Å; I39-A41 PolarHBondContact O-N 2.93Å
42	A	93.2	Very high	92.1	Very high	70 Å²	70	76.3 Å²	76.3	58%	0.579	39%	0.387	S	S	*	.	H	α-helix	trans	-71.9	-30.7	-179.1	0	0	0	0	0	113.6	E38 I39	E38-A42 WeakPolarHBondContact O-CB 3.5Å; E38-A42 PolarHBondContact O-N 3.25Å; I39-A42 PolarHBondContact O-N 3.38Å
43	K	92.5	Very high	92.3	Very high	113 Å²	113	75.6 Å²	75.6	49%	0.491	38%	0.381	S	S	.	.			trans	43.9	53.8	179.7	-56.7	-171.1	176.9	-176.5	0	113.8	I39 L40 W45 T46	I39-K43 PolarHBondContact O-N 3.41Å; L40-K43 WeakPolarHBondContact O-CE 3.44Å; L40-K43 WeakPolarHBondContact O-CG 2.84Å; K43-W45 HydrophobicContact CB-CZ2 4.11Å; K43-W45 HydrophobicContact CG-CZ2 4.01Å; K43-W45 PolarHBondContact O-N 3.44Å; K43-W45 VanDerWaalsContact O-N 3.14Å; K43-T46 HydrophobicContact CB-CG2 3.8Å; K43-T46 HydrophobicContact CD-CG2 4.46Å; K43-T46 WeakPolarHBondContact O-CB 3.23Å; K43-T46 PolarHBondContact O-N 2.99Å; K43-T46 PolarHBondContact O-OG1 3.49Å
44	P	92	Very high	92.7	Very high	34 Å²	34	73.5 Å²	73.5	22%	0.221	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-57.3	-32.6	-173.9	23.2	-34.6	0	0	0	113.7	T46 K47 Y51	P44-T46 PolarHBondContact O-N 3.27Å; P44-T46 VanDerWaalsContact O-N 3.1Å; P44-K47 PolarHBondContact O-N 2.94Å; P44-K47 VanDerWaalsContact O-N 3.08Å; P44-Y51 HydrophobicContact CB-CD2 4.28Å; P44-Y51 HydrophobicContact CB-CE1 4.19Å; P44-Y51 HydrophobicContact CB-CE2 3.8Å; P44-Y51 HydrophobicContact CG-CD1 4.4Å; P44-Y51 HydrophobicContact CG-CE1 3.69Å; P44-Y51 HydrophobicContact CG-CE2 4.16Å
45	W	91.4	Very high	92.9	Very high	17 Å²	17	67 Å²	67	6%	0.064	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-62.1	-11.6	175.3	54	83.3	0	0	0	115.2	I39 L40 K43 K47 D48 Y51 F52 E163 P164	I39-W45 HydrophobicContact CG2-CH2 4.15Å; I39-W45 HydrophobicContact CG2-CZ3 3.72Å; L40-W45 HydrophobicContact CD2-CH2 4.11Å; L40-W45 HydrophobicContact CD2-CZ2 4.45Å; K43-W45 HydrophobicContact CB-CZ2 4.11Å; K43-W45 HydrophobicContact CG-CZ2 4.01Å; K43-W45 PolarHBondContact O-N 3.44Å; K43-W45 VanDerWaalsContact O-N 3.14Å; W45-K47 VanDerWaalsContact C-N 3.27Å; W45-D48 CarbonylContact O-C 3.6Å; W45-Y51 HydrophobicContact CB-CD1 3.95Å; W45-Y51 HydrophobicContact CB-CG 4.19Å; W45-Y51 HydrophobicContact CE3-CD1 4.38Å; W45-Y51 HydrophobicContact CE3-CE1 4.36Å; W45-F52 HydrophobicContact CB-CD2 4.26Å; W45-F52 HydrophobicContact CB-CE2 3.81Å; W45-F52 AromaticContact CD2-CE2 3.85Å; W45-F52 HydrophobicContact CD2-CE2 3.85Å; W45-F52 HydrophobicContact CD2-CZ 4.07Å; W45-F52 HydrophobicContact CE3-CE1 4.46Å; W45-F52 AromaticContact CE3-CE2 3.63Å; W45-F52 HydrophobicContact CE3-CE2 3.63Å; W45-F52 AromaticContact CE3-CZ 3.37Å; W45-F52 HydrophobicContact CE3-CZ 3.37Å; W45-F52 AromaticContact CG-CE2 3.94Å; W45-F52 HydrophobicContact CG-CE2 3.94Å; W45-F52 HydrophobicContact CZ3-CE2 4.43Å; W45-F52 AromaticContact CZ3-CZ 3.83Å; W45-F52 HydrophobicContact CZ3-CZ 3.83Å; W45-E163 HydrophobicContact CZ2-CG 4.44Å; W45-P164 HydrophobicContact CH2-CB 4.42Å; W45-P164 HydrophobicContact CH2-CG 3.98Å; W45-P164 HydrophobicContact CZ2-CB 4.44Å; W45-P164 HydrophobicContact CZ2-CG 4.3Å; W45-P164 HydrophobicContact CZ3-CG 4.29Å
46	T	88.9	Confident	93.2	Very high	86 Å²	86	66.7 Å²	66.7	53%	0.528	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-74.4	-20.7	173.3	58.6	0	0	0	0	112.7	K43 P44	K43-T46 HydrophobicContact CB-CG2 3.8Å; K43-T46 HydrophobicContact CD-CG2 4.46Å; K43-T46 WeakPolarHBondContact O-CB 3.23Å; K43-T46 PolarHBondContact O-N 2.99Å; K43-T46 PolarHBondContact O-OG1 3.49Å; P44-T46 PolarHBondContact O-N 3.27Å; P44-T46 VanDerWaalsContact O-N 3.1Å
47	K	89.4	Confident	93.4	Very high	194 Å²	194	66.1 Å²	66.1	84%	0.843	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-27.9	178.4	-61.6	179.7	-178.7	176.9	0	112.7	P44 W45	P44-K47 PolarHBondContact O-N 2.94Å; P44-K47 VanDerWaalsContact O-N 3.08Å; W45-K47 VanDerWaalsContact C-N 3.27Å
48	D	90.1	Very high	93.6	Very high	69 Å²	69	60.8 Å²	60.8	37%	0.369	31%	0.311	S	S	.	.			trans	-134.2	111.6	-179.3	178.5	7.2	0	0	0	109.7	W45 H50 Y51	W45-D48 CarbonylContact O-C 3.6Å; D48-H50 PolarHBondContact O-N 3.24Å; D48-H50 VanDerWaalsContact O-N 3.16Å; D48-H50 WeakPolarHBondContact OD1-CA 3.35Å; D48-H50 PolarHBondContact OD1-N 3.33Å; D48-Y51 VanDerWaalsContact O-CB 3.22Å; D48-Y51 WeakPolarHBondContact O-CB 3.45Å; D48-Y51 PolarHBondContact O-N 2.62Å
49	H	88.1	Confident	93.6	Very high	72 Å²	72	56.6 Å²	56.6	33%	0.333	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-15.3	179	-58.6	145.4	0	0	0	113.2	Y189 Y193 Y222	H49-Y189 HydrophobicContact CB-CD1 4.41Å; H49-Y193 AromaticContact CE1-CD2 3.73Å; H49-Y193 AromaticContact ND1-CD2 3.19Å; H49-Y193 WeakPolarHBondContact ND1-CD2 3.16Å; H49-Y193 AromaticContact ND1-CE2 3.29Å; H49-Y193 VanDerWaalsContact ND1-CE2 3.29Å; H49-Y193 WeakPolarHBondContact ND1-CE2 3.25Å; H49-Y193 AromaticContact ND1-CG 3.79Å; H49-Y193 AromaticContact ND1-CZ 3.95Å; H49-Y222 VanDerWaalsContact O-CE1 3.32Å; H49-Y222 WeakPolarHBondContact O-CE1 3.34Å; H49-Y222 PolarHBondContact O-OH 2.88Å
50	H	90.6	Very high	93.7	Very high	56 Å²	56	57.8 Å²	57.8	26%	0.259	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	24.3	175.6	-156	78.1	0	0	0	112.4	D48 F52 Y222	D48-H50 PolarHBondContact O-N 3.24Å; D48-H50 VanDerWaalsContact O-N 3.16Å; D48-H50 WeakPolarHBondContact OD1-CA 3.35Å; D48-H50 PolarHBondContact OD1-N 3.33Å; H50-F52 VanDerWaalsContact C-N 3.35Å; H50-F52 PolarHBondContact O-N 2.96Å; H50-Y222 AromaticContact CE1-CD2 3.24Å; H50-Y222 WeakPolarHBondContact CE1-CD2 3.35Å; H50-Y222 AromaticContact CE1-CE2 3.75Å; H50-Y222 AromaticContact CE1-CG 3.62Å; H50-Y222 AromaticContact ND1-CD1 3.8Å; H50-Y222 AromaticContact ND1-CD2 3.31Å; H50-Y222 VanDerWaalsContact ND1-CD2 3.31Å; H50-Y222 WeakPolarHBondContact ND1-CD2 3.41Å; H50-Y222 AromaticContact ND1-CE1 3.97Å; H50-Y222 AromaticContact ND1-CE2 3.53Å; H50-Y222 AromaticContact ND1-CG 3.44Å; H50-Y222 AromaticContact ND1-CZ 3.84Å
51	Y	94.8	Very high	94	Very high	46 Å²	46	54.6 Å²	54.6	18%	0.18	29%	0.285	C	S	.	.			trans	-57.4	-43.6	179.7	178	-102.8	0	0	0	113.4	P44 W45 D48 K53 G87 E88	P44-Y51 HydrophobicContact CB-CD2 4.28Å; P44-Y51 HydrophobicContact CB-CE1 4.19Å; P44-Y51 HydrophobicContact CB-CE2 3.8Å; P44-Y51 HydrophobicContact CG-CD1 4.4Å; P44-Y51 HydrophobicContact CG-CE1 3.69Å; P44-Y51 HydrophobicContact CG-CE2 4.16Å; W45-Y51 HydrophobicContact CB-CD1 3.95Å; W45-Y51 HydrophobicContact CB-CG 4.19Å; W45-Y51 HydrophobicContact CE3-CD1 4.38Å; W45-Y51 HydrophobicContact CE3-CE1 4.36Å; D48-Y51 VanDerWaalsContact O-CB 3.22Å; D48-Y51 WeakPolarHBondContact O-CB 3.45Å; D48-Y51 PolarHBondContact O-N 2.62Å; Y51-K53 PolarHBondContact O-N 2.6Å; Y51-G87 WeakPolarHBondContact CE1-O 3.44Å; Y51-G87 PolarHBondContact OH-O 3.04Å; Y51-E88 HydrophobicContact CE2-CG 4.23Å; Y51-E88 VanDerWaalsContact O-CB 3.25Å; Y51-E88 WeakPolarHBondContact O-CB 3.48Å; Y51-E88 WeakPolarHBondContact O-CG 3.48Å
52	F	97.2	Very high	94.3	Very high	1 Å²	1	52 Å²	52	0%	0.004	26%	0.259	C	S	.	.			trans	-85.1	114.5	177.9	-68	-67.7	0	0	0	109.9	W45 H50 V85 E88 M90 P164 Y222 L224	W45-F52 HydrophobicContact CB-CD2 4.26Å; W45-F52 HydrophobicContact CB-CE2 3.81Å; W45-F52 AromaticContact CD2-CE2 3.85Å; W45-F52 HydrophobicContact CD2-CE2 3.85Å; W45-F52 HydrophobicContact CD2-CZ 4.07Å; W45-F52 HydrophobicContact CE3-CE1 4.46Å; W45-F52 AromaticContact CE3-CE2 3.63Å; W45-F52 HydrophobicContact CE3-CE2 3.63Å; W45-F52 AromaticContact CE3-CZ 3.37Å; W45-F52 HydrophobicContact CE3-CZ 3.37Å; W45-F52 AromaticContact CG-CE2 3.94Å; W45-F52 HydrophobicContact CG-CE2 3.94Å; W45-F52 HydrophobicContact CZ3-CE2 4.43Å; W45-F52 AromaticContact CZ3-CZ 3.83Å; W45-F52 HydrophobicContact CZ3-CZ 3.83Å; H50-F52 VanDerWaalsContact C-N 3.35Å; H50-F52 PolarHBondContact O-N 2.96Å; F52-V85 HydrophobicContact CE1-CB 4.25Å; F52-V85 HydrophobicContact CE1-CG1 3.87Å; F52-V85 HydrophobicContact CZ-CG1 3.99Å; F52-E88 WeakPolarHBondContact CA-O 3.45Å; F52-M90 HydrophobicContact CB-CG 4.28Å; F52-M90 HydrophobicContact CB-SD 4.31Å; F52-M90 HydrophobicContact CD1-CG 3.51Å; F52-M90 HydrophobicContact CD1-SD 4.21Å; F52-M90 HydrophobicContact CD2-SD 4.15Å; F52-M90 HydrophobicContact CE1-CG 3.88Å; F52-M90 HydrophobicContact CG-CG 3.86Å; F52-M90 HydrophobicContact CG-SD 3.97Å; F52-P164 HydrophobicContact CE2-CB 3.67Å; F52-P164 HydrophobicContact CZ-CB 3.65Å; F52-P164 HydrophobicContact CZ-CG 4.26Å; F52-Y222 VanDerWaalsContact O-CE2 3.31Å; F52-Y222 WeakPolarHBondContact O-CE2 3.42Å; F52-L224 HydrophobicContact CB-CD2 4.18Å
53	K	96.6	Very high	94.3	Very high	67 Å²	67	52.5 Å²	52.5	29%	0.291	25%	0.252	S	S	.	.			trans	-110.1	-24	-178.5	-60.9	176.5	-166.4	142.2	0	112.5	Y51 E88 L224 E225	Y51-K53 PolarHBondContact O-N 2.6Å; K53-E88 WeakPolarHBondContact CD-OE2 3.27Å; K53-E88 PolarHBondContact N-O 2.95Å; K53-E88 IonicContact NZ-OE1 3.14Å; K53-E88 PolarHBondContact NZ-OE1 2.67Å; K53-E88 IonicContact NZ-OE2 3.77Å; K53-E88 PolarHBondContact NZ-OE2 3.33Å; K53-L224 CarbonylContact O-C 3.52Å; K53-L224 WeakPolarHBondContact O-CA 3.21Å; K53-E225 PolarHBondContact O-N 2.96Å
54	Y	98.2	Very high	94.5	Very high	87 Å²	87	50.3 Å²	50.3	34%	0.341	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	142.9	-170.5	-50.2	-74.9	0	0	0	111.7	E88 T89 M90 E225	Y54-E88 HydrophobicContact CD2-CB 4.22Å; Y54-E88 HydrophobicContact CE2-CB 4.42Å; Y54-E88 PolarHBondContact N-O 2.95Å; Y54-T89 WeakPolarHBondContact O-CA 3.46Å; Y54-M90 PolarHBondContact O-N 3.46Å; Y54-E225 WeakPolarHBondContact CA-O 3.48Å; Y54-E225 HydrophobicContact CD1-CB 3.93Å; Y54-E225 HydrophobicContact CD1-CG 4.46Å; Y54-E225 HydrophobicContact CE1-CB 4.4Å
55	C	98.4	Very high	94.8	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	116	172	-171.7	0	0	0	0	109.4	M90 A185 L224 E225 V226 S227	C55-M90 CarbonylContact C-O 3.46Å; C55-M90 WeakPolarHBondContact CA-O 3.42Å; C55-A185 HydrophobicContact CB-CB 3.73Å; C55-L224 HydrophobicContact CB-CB 4.01Å; C55-L224 HydrophobicContact CB-CD2 4.18Å; C55-E225 PolarHBondContact N-O 3.25Å; C55-V226 HydrophobicContact CB-CG2 4.4Å; C55-V226 CarbonylContact O-C 3.55Å; C55-V226 VanDerWaalsContact O-CA 3.32Å; C55-V226 WeakPolarHBondContact O-CA 3.04Å; C55-S227 PolarHBondContact O-N 2.83Å
56	K	98.2	Very high	95	Very high	74 Å²	74	49.1 Å²	49.1	32%	0.322	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	125	176.6	-79.6	-178.7	-174.7	176	0	109.5	I28 T89 M90 I91 I92 S227 F229	I28-K56 HydrophobicContact CD1-CD 3.99Å; K56-T89 HydrophobicContact CB-CG2 4.1Å; K56-T89 HydrophobicContact CD-CG2 3.86Å; K56-T89 HydrophobicContact CG-CG2 3.75Å; K56-M90 PolarHBondContact N-O 3.29Å; K56-I91 HydrophobicContact CB-CG1 4.27Å; K56-I91 HydrophobicContact CB-CG2 4.31Å; K56-I91 CarbonylContact O-C 3.48Å; K56-I91 WeakPolarHBondContact O-CA 3.41Å; K56-I92 PolarHBondContact O-N 3.25Å; K56-S227 CarbonylContact C-O 3.57Å; K56-S227 WeakPolarHBondContact CA-O 3.19Å; K56-S227 VanDerWaalsContact CG-OG 3.28Å; K56-S227 WeakPolarHBondContact CG-OG 3.4Å; K56-F229 HydrophobicContact CB-CD1 3.92Å; K56-F229 HydrophobicContact CB-CE1 3.87Å
57	I	98.4	Very high	95.3	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	126.2	-178.2	-51.6	-178	0	0	0	109.8	A61 L62 M65 I92 L183 V226 S227 Y228 F229	I57-A61 HydrophobicContact CG2-CB 4.04Å; I57-L62 HydrophobicContact CG2-CB 4.1Å; I57-M65 HydrophobicContact CD1-CE 4.4Å; I57-M65 HydrophobicContact CG2-CE 3.73Å; I57-I92 HydrophobicContact CD1-CD1 4.24Å; I57-I92 HydrophobicContact CG1-CB 4.44Å; I57-I92 HydrophobicContact CG1-CD1 3.92Å; I57-I92 HydrophobicContact CG2-CB 4.48Å; I57-I92 HydrophobicContact CG2-CG2 4.36Å; I57-L183 HydrophobicContact CD1-CD1 3.78Å; I57-L183 HydrophobicContact CD1-CD2 3.55Å; I57-L183 HydrophobicContact CD1-CG 4.38Å; I57-V226 HydrophobicContact CD1-CG1 3.85Å; I57-V226 HydrophobicContact CG1-CG1 4.27Å; I57-S227 PolarHBondContact N-O 2.78Å; I57-Y228 HydrophobicContact CB-CD1 3.97Å; I57-Y228 HydrophobicContact CB-CE1 4.21Å; I57-Y228 HydrophobicContact CD1-CE1 4.33Å; I57-Y228 WeakPolarHBondContact O-CA 3.11Å; I57-F229 VanDerWaalsContact C-CE1 3.41Å; I57-F229 WeakPolarHBondContact O-CD1 3.31Å; I57-F229 PolarHBondContact O-N 3.38Å; I57-F229 VanDerWaalsContact O-N 3.11Å
58	S	96.9	Very high	95.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	146.2	174.2	82.8	0	0	0	0	110.5	L60 A61 L62 I92 M93 F229	S58-L60 PolarHBondContact O-N 3.39Å; S58-A61 PolarHBondContact O-N 3.41Å; S58-A61 VanDerWaalsContact O-N 3.14Å; S58-A61 WeakPolarHBondContact OG-CB 3.29Å; S58-A61 PolarHBondContact OG-N 3.35Å; S58-L62 WeakPolarHBondContact O-CB 3.31Å; S58-L62 PolarHBondContact O-N 2.97Å; S58-I92 PolarHBondContact N-O 3.45Å; S58-M93 WeakPolarHBondContact CB-O 3.42Å; S58-M93 PolarHBondContact OG-O 3.43Å; S58-F229 CarbonylContact C-O 3.35Å; S58-F229 WeakPolarHBondContact CA-O 3.42Å; S58-F229 VanDerWaalsContact N-CE1 3.28Å
59	A	95.6	Very high	95.8	Very high	21 Å²	21	39.9 Å²	39.9	17%	0.174	19%	0.189	C	C	.	.	H	α-helix	trans	-57.9	-31.8	176.8	0	0	0	0	0	112.3	L63 F229 K230 L238	A59-L63 VanDerWaalsContact O-CB 3.3Å; A59-L63 WeakPolarHBondContact O-CB 3.38Å; A59-L63 PolarHBondContact O-N 2.84Å; A59-F229 PolarHBondContact N-O 3.43Å; A59-K230 HydrophobicContact CB-CB 3.82Å; A59-L238 HydrophobicContact CB-CD1 4.32Å
60	L	94.3	Very high	96	Very high	57 Å²	57	41.9 Å²	41.9	30%	0.298	19%	0.194	S	C	.	.	H	α-helix	trans	-65.4	-51.2	174.7	179.9	64.1	0	0	0	111.7	S58 L62 L63 K64	S58-L60 PolarHBondContact O-N 3.39Å; L60-L62 VanDerWaalsContact C-N 3.33Å; L60-L62 PolarHBondContact O-N 2.85Å; L60-L63 PolarHBondContact O-N 2.95Å; L60-K64 HydrophobicContact CD1-CG 4.46Å; L60-K64 HydrophobicContact CG-CD 4.44Å; L60-K64 WeakPolarHBondContact O-CG 3.2Å; L60-K64 PolarHBondContact O-N 2.92Å
61	A	97.2	Very high	96.1	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61	-45.1	178.3	0	0	0	0	0	110.6	I57 S58 L63 K64 M65 I92 S95	I57-A61 HydrophobicContact CG2-CB 4.04Å; S58-A61 PolarHBondContact O-N 3.41Å; S58-A61 VanDerWaalsContact O-N 3.14Å; S58-A61 WeakPolarHBondContact OG-CB 3.29Å; S58-A61 PolarHBondContact OG-N 3.35Å; A61-L63 PolarHBondContact O-N 3.44Å; A61-K64 PolarHBondContact O-N 2.88Å; A61-M65 HydrophobicContact CB-CE 4.4Å; A61-M65 WeakPolarHBondContact O-CB 3.33Å; A61-M65 VanDerWaalsContact O-CG 3.22Å; A61-M65 WeakPolarHBondContact O-CG 3.2Å; A61-M65 PolarHBondContact O-N 3.41Å; A61-I92 HydrophobicContact CB-CG2 3.7Å; A61-S95 PolarHBondContact O-OG 3.06Å
62	L	97.6	Very high	95.9	Very high	28 Å²	28	42.2 Å²	42.2	15%	0.147	21%	0.211	C	C	.	.	H	α-helix	trans	-54.8	-51.7	176.2	-175.7	65.2	0	0	0	111.4	I57 S58 L60 K64 M65 V66 V181 L183 Y228	I57-L62 HydrophobicContact CG2-CB 4.1Å; S58-L62 WeakPolarHBondContact O-CB 3.31Å; S58-L62 PolarHBondContact O-N 2.97Å; L60-L62 VanDerWaalsContact C-N 3.33Å; L60-L62 PolarHBondContact O-N 2.85Å; L62-K64 PolarHBondContact O-N 2.8Å; L62-M65 PolarHBondContact O-N 3.34Å; L62-V66 HydrophobicContact CD1-CG2 4.27Å; L62-V66 WeakPolarHBondContact O-CB 3.41Å; L62-V66 VanDerWaalsContact O-CG2 3.25Å; L62-V66 WeakPolarHBondContact O-CG2 3.19Å; L62-V66 PolarHBondContact O-N 2.98Å; L62-V181 HydrophobicContact CD1-CB 4.37Å; L62-V181 HydrophobicContact CD1-CG1 3.79Å; L62-V181 HydrophobicContact CD1-CG2 4.38Å; L62-V181 HydrophobicContact CD2-CG2 4.35Å; L62-V181 HydrophobicContact CG-CG2 4.45Å; L62-L183 HydrophobicContact CD1-CD1 3.74Å; L62-Y228 HydrophobicContact CD1-CD1 4.21Å; L62-Y228 HydrophobicContact CD1-CE1 3.55Å; L62-Y228 HydrophobicContact CD2-CD1 3.66Å; L62-Y228 HydrophobicContact CD2-CE1 3.71Å; L62-Y228 HydrophobicContact CD2-CG 4.31Å; L62-Y228 HydrophobicContact CG-CD1 4.37Å; L62-Y228 HydrophobicContact CG-CE1 4.17Å
63	L	94.8	Very high	95.5	Very high	80 Å²	80	43.6 Å²	43.6	42%	0.419	23%	0.226	S	C	.	.	H	α-helix	trans	-61.3	-47	-179.1	-177.5	63.8	0	0	0	111.4	A59 L60 A61 M65 V66 M67	A59-L63 VanDerWaalsContact O-CB 3.3Å; A59-L63 WeakPolarHBondContact O-CB 3.38Å; A59-L63 PolarHBondContact O-N 2.84Å; L60-L63 PolarHBondContact O-N 2.95Å; A61-L63 PolarHBondContact O-N 3.44Å; L63-M65 PolarHBondContact O-N 3.23Å; L63-V66 PolarHBondContact O-N 3.17Å; L63-M67 HydrophobicContact CD1-CG 4.15Å; L63-M67 HydrophobicContact CD1-SD 3.96Å; L63-M67 HydrophobicContact CD2-SD 4.41Å; L63-M67 HydrophobicContact CG-CG 4.38Å; L63-M67 HydrophobicContact CG-SD 3.8Å; L63-M67 VanDerWaalsContact O-CB 3.31Å; L63-M67 WeakPolarHBondContact O-CB 3.31Å; L63-M67 WeakPolarHBondContact O-CG 3.39Å; L63-M67 PolarHBondContact O-N 3.26Å
64	K	96.8	Very high	95.1	Very high	68 Å²	68	46.7 Å²	46.7	30%	0.296	25%	0.246	S	C	.	.	H	α-helix	trans	-60	-46.8	178.2	-75.8	-177.3	176.4	-172.6	0	112.4	L60 A61 L62 M67 H68 D94 S95	L60-K64 HydrophobicContact CD1-CG 4.46Å; L60-K64 HydrophobicContact CG-CD 4.44Å; L60-K64 WeakPolarHBondContact O-CG 3.2Å; L60-K64 PolarHBondContact O-N 2.92Å; A61-K64 PolarHBondContact O-N 2.88Å; L62-K64 PolarHBondContact O-N 2.8Å; K64-M67 PolarHBondContact O-N 2.86Å; K64-H68 WeakPolarHBondContact O-CB 3.41Å; K64-H68 PolarHBondContact O-N 3.24Å; K64-D94 WeakPolarHBondContact CD-OD1 3.08Å; K64-D94 VanDerWaalsContact CE-OD1 3.29Å; K64-D94 WeakPolarHBondContact CE-OD1 3.35Å; K64-D94 IonicContact NZ-OD1 2.68Å; K64-D94 PolarHBondContact NZ-OD1 2.71Å; K64-D94 IonicContact NZ-OD2 3.32Å; K64-D94 PolarHBondContact NZ-OD2 3.11Å; K64-S95 WeakPolarHBondContact CB-OG 3.48Å; K64-S95 VanDerWaalsContact CD-O 3.26Å; K64-S95 WeakPolarHBondContact CD-O 3.45Å; K64-S95 PolarHBondContact NZ-O 2.96Å
65	M	97.6	Very high	94.7	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-67.1	-41.8	-178.9	-62.7	-176.2	-70.6	0	0	111.5	I57 A61 L62 L63 H68 A69 M81 S95 Y137 V168 I170 L183	I57-M65 HydrophobicContact CD1-CE 4.4Å; I57-M65 HydrophobicContact CG2-CE 3.73Å; A61-M65 HydrophobicContact CB-CE 4.4Å; A61-M65 WeakPolarHBondContact O-CB 3.33Å; A61-M65 VanDerWaalsContact O-CG 3.22Å; A61-M65 WeakPolarHBondContact O-CG 3.2Å; A61-M65 PolarHBondContact O-N 3.41Å; L62-M65 PolarHBondContact O-N 3.34Å; L63-M65 PolarHBondContact O-N 3.23Å; M65-H68 PolarHBondContact O-N 3.43Å; M65-A69 VanDerWaalsContact O-CB 3.29Å; M65-A69 WeakPolarHBondContact O-CB 3.47Å; M65-A69 PolarHBondContact O-N 3.33Å; M65-M81 HydrophobicContact CE-SD 4.38Å; M65-M81 HydrophobicContact SD-CG 3.99Å; M65-M81 HydrophobicContact SD-SD 3.61Å; M65-M81 VanDerWaalsContact SD-SD 3.61Å; M65-S95 VanDerWaalsContact CG-OG 3.24Å; M65-S95 WeakPolarHBondContact CG-OG 3.4Å; M65-Y137 HydrophobicContact CB-CD2 4Å; M65-Y137 HydrophobicContact CB-CE2 3.94Å; M65-Y137 HydrophobicContact CB-CG 4.36Å; M65-Y137 HydrophobicContact CG-CD1 3.73Å; M65-Y137 HydrophobicContact CG-CD2 3.94Å; M65-Y137 HydrophobicContact CG-CE1 3.74Å; M65-Y137 HydrophobicContact CG-CE2 3.95Å; M65-Y137 HydrophobicContact CG-CG 3.83Å; M65-Y137 HydrophobicContact SD-CD1 3.66Å; M65-Y137 HydrophobicContact SD-CD2 4.2Å; M65-Y137 HydrophobicContact SD-CE1 4.28Å; M65-Y137 HydrophobicContact SD-CG 3.61Å; M65-V168 HydrophobicContact SD-CG1 4.35Å; M65-I170 HydrophobicContact CB-CD1 3.25Å; M65-I170 HydrophobicContact CE-CD1 4.43Å; M65-I170 HydrophobicContact CG-CD1 4.21Å; M65-I170 HydrophobicContact SD-CD1 4.12Å; M65-L183 HydrophobicContact CE-CD1 4.2Å
66	V	96.2	Very high	94.4	Very high	26 Å²	26	47.6 Å²	47.6	16%	0.158	26%	0.256	C	S	.	.	H	α-helix	trans	-66.4	-42.1	177.5	172.1	0	0	0	0	111.4	L62 L63 H68 A69 R70 I170 T175 V181	L62-V66 HydrophobicContact CD1-CG2 4.27Å; L62-V66 WeakPolarHBondContact O-CB 3.41Å; L62-V66 VanDerWaalsContact O-CG2 3.25Å; L62-V66 WeakPolarHBondContact O-CG2 3.19Å; L62-V66 PolarHBondContact O-N 2.98Å; L63-V66 PolarHBondContact O-N 3.17Å; V66-H68 VanDerWaalsContact C-N 3.33Å; V66-H68 PolarHBondContact O-N 3.32Å; V66-A69 PolarHBondContact O-N 3.23Å; V66-R70 WeakPolarHBondContact O-CB 3.43Å; V66-R70 PolarHBondContact O-N 3.49Å; V66-I170 HydrophobicContact CG2-CG2 4.3Å; V66-T175 HydrophobicContact CG1-CG2 4.24Å; V66-V181 HydrophobicContact CG2-CB 4.47Å; V66-V181 HydrophobicContact CG2-CG1 3.6Å; V66-V181 HydrophobicContact CG2-CG2 3.99Å
67	M	94.7	Very high	94.1	Very high	122 Å²	122	44.7 Å²	44.7	60%	0.601	24%	0.244	S	C	*	.	H	α-helix	trans	-61.9	-42.6	175.2	-74.3	178	67.9	0	0	111.5	L63 K64 R70 S71	L63-M67 HydrophobicContact CD1-CG 4.15Å; L63-M67 HydrophobicContact CD1-SD 3.96Å; L63-M67 HydrophobicContact CD2-SD 4.41Å; L63-M67 HydrophobicContact CG-CG 4.38Å; L63-M67 HydrophobicContact CG-SD 3.8Å; L63-M67 VanDerWaalsContact O-CB 3.31Å; L63-M67 WeakPolarHBondContact O-CB 3.31Å; L63-M67 WeakPolarHBondContact O-CG 3.39Å; L63-M67 PolarHBondContact O-N 3.26Å; K64-M67 PolarHBondContact O-N 2.86Å; M67-R70 PolarHBondContact O-N 2.74Å; M67-S71 PolarHBondContact O-N 3.16Å
68	H	95.2	Very high	93.8	Very high	32 Å²	32	45.1 Å²	45.1	15%	0.148	25%	0.246	C	C	.	.	H	α-helix	trans	-65.2	-50.2	176.6	-177.5	-145.8	0	0	0	111.7	K64 M65 V66 R70 S71 G72 M78 A97 Y137	K64-H68 WeakPolarHBondContact O-CB 3.41Å; K64-H68 PolarHBondContact O-N 3.24Å; M65-H68 PolarHBondContact O-N 3.43Å; V66-H68 VanDerWaalsContact C-N 3.33Å; V66-H68 PolarHBondContact O-N 3.32Å; H68-R70 PolarHBondContact O-N 2.91Å; H68-S71 PolarHBondContact O-N 3.43Å; H68-S71 PolarHBondContact O-OG 2.92Å; H68-G72 PolarHBondContact O-N 2.78Å; H68-M78 PolarHBondContact CE1-O 3.24Å; H68-M78 VanDerWaalsContact CE1-O 3.28Å; H68-A97 WeakPolarHBondContact CE1-CB 3.33Å; H68-Y137 AromaticContact ND1-CE2 3.6Å; H68-Y137 AromaticContact ND1-CZ 3.6Å; H68-Y137 PolarHBondContact ND1-OH 3.09Å
69	A	94.7	Very high	93.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-54.5	-40.4	175.6	0	0	0	0	0	111.8	M65 V66 G72 I170 P172	M65-A69 VanDerWaalsContact O-CB 3.29Å; M65-A69 WeakPolarHBondContact O-CB 3.47Å; M65-A69 PolarHBondContact O-N 3.33Å; V66-A69 PolarHBondContact O-N 3.23Å; A69-G72 PolarHBondContact O-N 3.3Å; A69-I170 HydrophobicContact CB-CB 4.37Å; A69-I170 HydrophobicContact CB-CG2 3.98Å; A69-P172 HydrophobicContact CB-CB 4.02Å; A69-P172 HydrophobicContact CB-CG 4.11Å
70	R	92.5	Very high	93.5	Very high	115 Å²	115	44.6 Å²	44.6	43%	0.434	24%	0.241	S	C	.	.	H	α-helix	trans	-68.4	-38	175.5	-179.1	52	174.2	179.7	-0.7	112.8	V66 M67 H68 G72 G73 P172 I176	V66-R70 WeakPolarHBondContact O-CB 3.43Å; V66-R70 PolarHBondContact O-N 3.49Å; M67-R70 PolarHBondContact O-N 2.74Å; H68-R70 PolarHBondContact O-N 2.91Å; R70-G72 PolarHBondContact O-N 3.15Å; R70-G73 PolarHBondContact O-N 2.77Å; R70-G73 VanDerWaalsContact O-N 3.14Å; R70-P172 HydrophobicContact CB-CB 4.48Å; R70-I176 VanDerWaalsContact CD-CD1 3.5Å; R70-I176 HydrophobicContact CG-CD1 4.37Å
71	S	92.7	Very high	93.6	Very high	92 Å²	92	41.9 Å²	41.9	64%	0.643	23%	0.227	S	C	*	.	H	α-helix	trans	-65	-24.8	178.9	69.2	0	0	0	0	113.5	M67 H68 G73	M67-S71 PolarHBondContact O-N 3.16Å; H68-S71 PolarHBondContact O-N 3.43Å; H68-S71 PolarHBondContact O-OG 2.92Å; S71-G73 PolarHBondContact O-N 3.49Å
72	G	90.6	Very high	93.5	Very high	16 Å²	16	42 Å²	42	17%	0.165	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-14	173.5	0	0	0	0	0	114.8	H68 A69 R70 N74 L75	H68-G72 PolarHBondContact O-N 2.78Å; A69-G72 PolarHBondContact O-N 3.3Å; R70-G72 PolarHBondContact O-N 3.15Å; G72-N74 PolarHBondContact O-N 3.14Å; G72-N74 VanDerWaalsContact O-N 3.13Å; G72-L75 WeakPolarHBondContact O-CB 3.26Å; G72-L75 PolarHBondContact O-N 2.98Å
73	G	89.2	Confident	93.4	Very high	30 Å²	30	41 Å²	41	31%	0.309	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	-114.6	-175.1	0	0	0	0	0	111.2	R70 S71	R70-G73 PolarHBondContact O-N 2.77Å; R70-G73 VanDerWaalsContact O-N 3.14Å; S71-G73 PolarHBondContact O-N 3.49Å
74	N	88.3	Confident	93.5	Very high	132 Å²	132	38 Å²	38	71%	0.706	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-1.4	177	-64.4	-21.9	0	0	0	113.1	G72	G72-N74 PolarHBondContact O-N 3.14Å; G72-N74 VanDerWaalsContact O-N 3.13Å
75	L	89.8	Confident	93.4	Very high	92 Å²	92	34.8 Å²	34.8	48%	0.482	19%	0.193	S	C	.	.	S	Bend	trans	-85.7	146.6	176.4	-59.4	176.9	0	0	0	110.6	G72 V77	G72-L75 WeakPolarHBondContact O-CB 3.26Å; G72-L75 PolarHBondContact O-N 2.98Å; L75-V77 PolarHBondContact O-N 2.94Å
76	E	90.2	Very high	93.2	Very high	14 Å²	14	39 Å²	39	7%	0.065	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	121	171.4	-58.3	-173.9	165.6	0	0	109.1	G102 S139 H140	E76-G102 VanDerWaalsContact O-CA 3.25Å; E76-G102 WeakPolarHBondContact O-CA 3.33Å; E76-G102 PolarHBondContact O-N 3.08Å; E76-G102 VanDerWaalsContact O-N 3.15Å; E76-S139 WeakPolarHBondContact CA-OG 3.26Å; E76-S139 WeakPolarHBondContact CB-O 3.4Å; E76-S139 VanDerWaalsContact CG-O 3.31Å; E76-S139 WeakPolarHBondContact CG-O 3.34Å; E76-H140 IonicContact OE1-CD2 2.67Å
77	V	91.8	Very high	93.1	Very high	14 Å²	14	39.2 Å²	39.2	9%	0.085	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	158.2	173.3	-59.3	0	0	0	0	109.5	L75 H138 S139	L75-V77 PolarHBondContact O-N 2.94Å; V77-H138 CarbonylContact O-C 3.55Å; V77-H138 WeakPolarHBondContact O-CA 3.03Å; V77-H138 WeakPolarHBondContact O-CB 3.43Å; V77-S139 PolarHBondContact N-OG 2.83Å; V77-S139 PolarHBondContact O-N 3.24Å
78	M	92.1	Very high	93.2	Very high	8 Å²	8	36.5 Å²	36.5	4%	0.039	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	159	177.1	80.2	-170.7	80.5	0	0	112.3	H68 L98 V100 V107 Y137 H138	H68-M78 PolarHBondContact CE1-O 3.24Å; H68-M78 VanDerWaalsContact CE1-O 3.28Å; M78-L98 HydrophobicContact CG-CB 4.28Å; M78-L98 HydrophobicContact CG-CD1 4.23Å; M78-L98 PolarHBondContact O-N 3.47Å; M78-L98 VanDerWaalsContact O-N 3.11Å; M78-L98 HydrophobicContact SD-CD1 4.37Å; M78-V100 HydrophobicContact CE-CB 3.94Å; M78-V100 HydrophobicContact CE-CG2 3.42Å; M78-V100 VanDerWaalsContact CE-CG2 3.42Å; M78-V100 HydrophobicContact CG-CG2 3.36Å; M78-V100 HydrophobicContact SD-CB 4.4Å; M78-V100 HydrophobicContact SD-CG2 3.43Å; M78-V100 WeakPolarHBondContact SD-CG2 3.45Å; M78-V107 HydrophobicContact CE-CB 3.63Å; M78-V107 HydrophobicContact CE-CG1 3.1Å; M78-V107 HydrophobicContact CE-CG2 3.64Å; M78-V107 HydrophobicContact SD-CB 4.33Å; M78-V107 HydrophobicContact SD-CG1 3.16Å; M78-V107 WeakPolarHBondContact SD-CG1 3.37Å; M78-Y137 CarbonylContact C-O 3.59Å; M78-Y137 WeakPolarHBondContact CA-O 3.29Å; M78-Y137 WeakPolarHBondContact CB-O 3.32Å; M78-H138 HydrophobicContact CB-CB 4.04Å
79	G	93.5	Very high	93.3	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.01	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	-175.9	170.7	0	0	0	0	0	112.5	F96 W136 Y137	G79-F96 CarbonylContact C-O 3.5Å; G79-F96 WeakPolarHBondContact CA-O 3.3Å; G79-W136 CarbonylContact O-C 3.59Å; G79-W136 VanDerWaalsContact O-CA 3.31Å; G79-W136 WeakPolarHBondContact O-CA 3.41Å; G79-Y137 VanDerWaalsContact C-CE1 3.42Å; G79-Y137 PolarHBondContact N-O 2.97Å; G79-Y137 PolarHBondContact O-N 3.49Å
80	L	93.8	Very high	93.4	Very high	10 Å²	10	35.8 Å²	35.8	5%	0.052	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	156.4	175.6	-72.2	178.9	0	0	0	111.9	S95 F96 L98 M117 G135 W136 F165	L80-S95 CarbonylContact O-C 3.58Å; L80-S95 VanDerWaalsContact O-CA 3.24Å; L80-S95 WeakPolarHBondContact O-CA 3.45Å; L80-S95 WeakPolarHBondContact O-CB 3.38Å; L80-F96 HydrophobicContact CB-CD1 4.32Å; L80-F96 HydrophobicContact CB-CE1 3.7Å; L80-F96 HydrophobicContact CB-CE2 4.13Å; L80-F96 HydrophobicContact CB-CZ 3.63Å; L80-F96 HydrophobicContact CD1-CE2 4.31Å; L80-F96 HydrophobicContact CD1-CZ 3.79Å; L80-F96 HydrophobicContact CG-CZ 4.27Å; L80-F96 PolarHBondContact N-O 3.02Å; L80-F96 PolarHBondContact O-N 2.83Å; L80-L98 HydrophobicContact CD1-CD2 4.38Å; L80-L98 HydrophobicContact CG-CD1 4.16Å; L80-L98 HydrophobicContact CG-CD2 4.44Å; L80-L98 HydrophobicContact CG-CG 4.42Å; L80-M117 HydrophobicContact CD1-CB 4.27Å; L80-M117 HydrophobicContact CD1-CE 3.41Å; L80-M117 VanDerWaalsContact CD1-CE 3.41Å; L80-M117 HydrophobicContact CD1-CG 3.47Å; L80-M117 VanDerWaalsContact CD1-CG 3.47Å; L80-M117 HydrophobicContact CD1-SD 3.68Å; L80-G135 WeakPolarHBondContact CD2-O 3.49Å; L80-W136 HydrophobicContact CD2-CB 3.83Å; L80-F165 HydrophobicContact CD2-CZ 4.24Å
81	M	96.2	Very high	93.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	132.2	178.6	-60.1	179.9	-60	0	0	108.9	M65 I92 D94 A133 I134 G135 W136 Y137 V166 V168	M65-M81 HydrophobicContact CE-SD 4.38Å; M65-M81 HydrophobicContact SD-CG 3.99Å; M65-M81 HydrophobicContact SD-SD 3.61Å; M65-M81 VanDerWaalsContact SD-SD 3.61Å; M81-I92 HydrophobicContact CB-CG1 4.21Å; M81-I92 HydrophobicContact CB-CG2 3.93Å; M81-I92 HydrophobicContact CE-CD1 3.77Å; M81-I92 HydrophobicContact CE-CG1 4.35Å; M81-I92 HydrophobicContact CG-CG2 4.19Å; M81-I92 HydrophobicContact SD-CD1 3.38Å; M81-I92 WeakPolarHBondContact SD-CD1 3.34Å; M81-I92 HydrophobicContact SD-CG1 4Å; M81-I92 HydrophobicContact SD-CG2 4.17Å; M81-D94 CarbonylContact C-O 3.58Å; M81-D94 WeakPolarHBondContact CA-O 3.22Å; M81-A133 WeakPolarHBondContact O-CA 3.48Å; M81-I134 HydrophobicContact CB-CG2 4.27Å; M81-I134 PolarHBondContact O-N 2.97Å; M81-G135 PolarHBondContact N-O 3.34Å; M81-W136 WeakPolarHBondContact CE-O 3.33Å; M81-Y137 HydrophobicContact CG-CD1 3.83Å; M81-Y137 HydrophobicContact SD-CD1 4.44Å; M81-V166 HydrophobicContact CE-CG1 3.82Å; M81-V168 HydrophobicContact CE-CB 3.89Å; M81-V168 HydrophobicContact CE-CG2 3.62Å; M81-V168 HydrophobicContact SD-CB 3.85Å; M81-V168 HydrophobicContact SD-CG1 4.45Å; M81-V168 HydrophobicContact SD-CG2 3.73Å
82	L	95.2	Very high	94	Very high	3 Å²	3	26.1 Å²	26.1	2%	0.016	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	137.8	173.3	-59.2	-177.7	0	0	0	108.9	M93 D94 F96 Y120 I121 A124 E131 N132 A133	L82-M93 PolarHBondContact O-N 2.97Å; L82-D94 HydrophobicContact CB-CB 4.48Å; L82-D94 PolarHBondContact N-O 2.92Å; L82-D94 PolarHBondContact O-N 3.33Å; L82-D94 VanDerWaalsContact O-N 3.13Å; L82-F96 HydrophobicContact CD1-CE1 4.43Å; L82-F96 HydrophobicContact CD2-CE1 3.97Å; L82-F96 HydrophobicContact CG-CD1 4.34Å; L82-F96 HydrophobicContact CG-CE1 4.07Å; L82-Y120 HydrophobicContact CD1-CD1 4.42Å; L82-Y120 HydrophobicContact CD1-CE1 3.94Å; L82-I121 HydrophobicContact CD2-CG1 4.22Å; L82-A124 HydrophobicContact CD1-CB 4.36Å; L82-E131 HydrophobicContact CB-CB 4.22Å; L82-N132 WeakPolarHBondContact CA-O 3.31Å; L82-A133 HydrophobicContact CD2-CB 4.49Å
83	G	96	Very high	94.2	Very high	5 Å²	5	26.1 Å²	26.1	5%	0.052	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.9	-159.3	-178.7	0	0	0	0	0	114.8	I91 E131 N132	G83-I91 CarbonylContact C-O 3.59Å; G83-I91 WeakPolarHBondContact CA-O 3.31Å; G83-E131 WeakPolarHBondContact O-CB 3.2Å; G83-N132 PolarHBondContact N-O 2.68Å
84	K	95.8	Very high	94.5	Very high	17 Å²	17	25 Å²	25	7%	0.074	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	170.9	-175.3	66	-175.8	179.8	-162.4	0	110.7	I28 K30 Y31 I91	I28-K84 VanDerWaalsContact O-CE 3.26Å; I28-K84 WeakPolarHBondContact O-CE 3.35Å; I28-K84 PolarHBondContact O-NZ 2.88Å; K30-K84 PolarHBondContact O-NZ 3.44Å; Y31-K84 HydrophobicContact CD2-CD 4.36Å; K84-I91 HydrophobicContact CG-CB 4.22Å; K84-I91 PolarHBondContact N-O 3.49Å; K84-I91 PolarHBondContact O-N 2.94Å
85	V	95.7	Very high	94.8	Very high	2 Å²	2	18.7 Å²	18.7	1%	0.012	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	144.8	176	-66.9	0	0	0	0	111.1	Q36 I39 F52 M90 I134 P164	Q36-V85 PolarHBondContact NE2-O 3.48Å; I39-V85 HydrophobicContact CB-CG2 4.31Å; I39-V85 HydrophobicContact CD1-CG2 4.26Å; I39-V85 HydrophobicContact CG2-CG2 3.56Å; F52-V85 HydrophobicContact CE1-CB 4.25Å; F52-V85 HydrophobicContact CE1-CG1 3.87Å; F52-V85 HydrophobicContact CZ-CG1 3.99Å; V85-M90 HydrophobicContact CG1-CG 4.41Å; V85-I134 HydrophobicContact CG1-CD1 3.79Å; V85-P164 HydrophobicContact CG1-CB 4.16Å; V85-P164 HydrophobicContact CG1-CG 3.53Å; V85-P164 HydrophobicContact CG2-CG 4.45Å
86	D	93.9	Very high	95	Very high	87 Å²	87	14.8 Å²	14.8	47%	0.465	9%	0.085	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	102.3	173.1	-175.4	24.4	0	0	0	109.2	E88 T89 I91	D86-E88 PolarHBondContact O-N 3.18Å; D86-T89 PolarHBondContact N-O 3.33Å; D86-T89 WeakPolarHBondContact O-CB 3.32Å; D86-T89 PolarHBondContact O-N 2.68Å; D86-I91 HydrophobicContact CB-CD1 3.76Å
87	G	93.3	Very high	95.1	Very high	32 Å²	32	15.9 Å²	15.9	33%	0.33	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	-126.2	-171.6	0	0	0	0	0	112.4	Y51 T89	Y51-G87 WeakPolarHBondContact CE1-O 3.44Å; Y51-G87 PolarHBondContact OH-O 3.04Å; G87-T89 PolarHBondContact O-N 3.37Å
88	E	96.3	Very high	95	Very high	65 Å²	65	15.8 Å²	15.8	30%	0.304	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	6.2	178.7	-56.7	-172.1	156	0	0	113.6	Y51 F52 K53 Y54 D86	Y51-E88 HydrophobicContact CE2-CG 4.23Å; Y51-E88 VanDerWaalsContact O-CB 3.25Å; Y51-E88 WeakPolarHBondContact O-CB 3.48Å; Y51-E88 WeakPolarHBondContact O-CG 3.48Å; F52-E88 WeakPolarHBondContact CA-O 3.45Å; K53-E88 WeakPolarHBondContact CD-OE2 3.27Å; K53-E88 PolarHBondContact N-O 2.95Å; K53-E88 IonicContact NZ-OE1 3.14Å; K53-E88 PolarHBondContact NZ-OE1 2.67Å; K53-E88 IonicContact NZ-OE2 3.77Å; K53-E88 PolarHBondContact NZ-OE2 3.33Å; Y54-E88 HydrophobicContact CD2-CB 4.22Å; Y54-E88 HydrophobicContact CE2-CB 4.42Å; Y54-E88 PolarHBondContact N-O 2.95Å; D86-E88 PolarHBondContact O-N 3.18Å
89	T	97.5	Very high	94.2	Very high	17 Å²	17	19.5 Å²	19.5	10%	0.104	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	128.8	-175.1	-51.6	0	0	0	0	112.2	Y54 K56 D86 G87 I91	Y54-T89 WeakPolarHBondContact O-CA 3.46Å; K56-T89 HydrophobicContact CB-CG2 4.1Å; K56-T89 HydrophobicContact CD-CG2 3.86Å; K56-T89 HydrophobicContact CG-CG2 3.75Å; D86-T89 PolarHBondContact N-O 3.33Å; D86-T89 WeakPolarHBondContact O-CB 3.32Å; D86-T89 PolarHBondContact O-N 2.68Å; G87-T89 PolarHBondContact O-N 3.37Å; T89-I91 HydrophobicContact CG2-CG1 3.93Å
90	M	98	Very high	93.1	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	120.3	167	-59.1	-169.5	67.4	0	0	109.3	F52 Y54 C55 K56 V85 I134 P164 V166 L224	F52-M90 HydrophobicContact CB-CG 4.28Å; F52-M90 HydrophobicContact CB-SD 4.31Å; F52-M90 HydrophobicContact CD1-CG 3.51Å; F52-M90 HydrophobicContact CD1-SD 4.21Å; F52-M90 HydrophobicContact CD2-SD 4.15Å; F52-M90 HydrophobicContact CE1-CG 3.88Å; F52-M90 HydrophobicContact CG-CG 3.86Å; F52-M90 HydrophobicContact CG-SD 3.97Å; Y54-M90 PolarHBondContact O-N 3.46Å; C55-M90 CarbonylContact C-O 3.46Å; C55-M90 WeakPolarHBondContact CA-O 3.42Å; K56-M90 PolarHBondContact N-O 3.29Å; V85-M90 HydrophobicContact CG1-CG 4.41Å; M90-I134 HydrophobicContact CE-CD1 3.85Å; M90-I134 HydrophobicContact CE-CG1 3.69Å; M90-I134 WeakPolarHBondContact CE-O 3.37Å; M90-P164 HydrophobicContact CE-CB 4.17Å; M90-V166 HydrophobicContact CE-CB 3.77Å; M90-V166 HydrophobicContact CE-CG1 3.95Å; M90-V166 HydrophobicContact SD-CB 3.79Å; M90-V166 HydrophobicContact SD-CG1 4.39Å; M90-V166 HydrophobicContact SD-CG2 4.49Å; M90-L224 HydrophobicContact CG-CD2 4.49Å; M90-L224 HydrophobicContact SD-CD2 4.34Å
91	I	97.8	Very high	91.4	Very high	4 Å²	4	28.5 Å²	28.5	2%	0.021	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	112.5	-174.2	-52.8	175.5	0	0	0	109.2	I28 K56 G83 K84 D86 T89 M93 F229	I28-I91 HydrophobicContact CD1-CD1 4.21Å; I28-I91 HydrophobicContact CD1-CG2 4.1Å; I28-I91 HydrophobicContact CG1-CD1 4.1Å; I28-I91 HydrophobicContact CG1-CG2 4.17Å; K56-I91 HydrophobicContact CB-CG1 4.27Å; K56-I91 HydrophobicContact CB-CG2 4.31Å; K56-I91 CarbonylContact O-C 3.48Å; K56-I91 WeakPolarHBondContact O-CA 3.41Å; G83-I91 CarbonylContact C-O 3.59Å; G83-I91 WeakPolarHBondContact CA-O 3.31Å; K84-I91 HydrophobicContact CG-CB 4.22Å; K84-I91 PolarHBondContact N-O 3.49Å; K84-I91 PolarHBondContact O-N 2.94Å; D86-I91 HydrophobicContact CB-CD1 3.76Å; T89-I91 HydrophobicContact CG2-CG1 3.93Å; I91-M93 HydrophobicContact CG2-CG 4.46Å; I91-M93 HydrophobicContact CG2-SD 3.57Å; I91-M93 VanDerWaalsContact CG2-SD 3.57Å; I91-F229 HydrophobicContact CG2-CE1 3.78Å; I91-F229 HydrophobicContact CG2-CZ 3.72Å
92	I	98.1	Very high	89.7	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	114.7	174	-65.6	157.2	0	0	0	108.7	K56 I57 S58 A61 M81 I134 V166 V168	K56-I92 PolarHBondContact O-N 3.25Å; I57-I92 HydrophobicContact CD1-CD1 4.24Å; I57-I92 HydrophobicContact CG1-CB 4.44Å; I57-I92 HydrophobicContact CG1-CD1 3.92Å; I57-I92 HydrophobicContact CG2-CB 4.48Å; I57-I92 HydrophobicContact CG2-CG2 4.36Å; S58-I92 PolarHBondContact N-O 3.45Å; A61-I92 HydrophobicContact CB-CG2 3.7Å; M81-I92 HydrophobicContact CB-CG1 4.21Å; M81-I92 HydrophobicContact CB-CG2 3.93Å; M81-I92 HydrophobicContact CE-CD1 3.77Å; M81-I92 HydrophobicContact CE-CG1 4.35Å; M81-I92 HydrophobicContact CG-CG2 4.19Å; M81-I92 HydrophobicContact SD-CD1 3.38Å; M81-I92 WeakPolarHBondContact SD-CD1 3.34Å; M81-I92 HydrophobicContact SD-CG1 4Å; M81-I92 HydrophobicContact SD-CG2 4.17Å; I92-I134 HydrophobicContact CG1-CG2 4.06Å; I92-V166 HydrophobicContact CD1-CG1 4.35Å; I92-V168 HydrophobicContact CD1-CG2 3.97Å
93	M	95.7	Very high	87.6	Confident	16 Å²	16	32.9 Å²	32.9	8%	0.079	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	-38.4	-177.5	-63.6	-55.3	-59.4	0	0	112	Y29 S58 L82 I91 E131 F229	Y29-M93 HydrophobicContact CD1-CE 3.14Å; Y29-M93 HydrophobicContact CD2-CE 4.47Å; Y29-M93 HydrophobicContact CE1-CE 3.67Å; Y29-M93 HydrophobicContact CG-CE 3.61Å; S58-M93 WeakPolarHBondContact CB-O 3.42Å; S58-M93 PolarHBondContact OG-O 3.43Å; L82-M93 PolarHBondContact O-N 2.97Å; I91-M93 HydrophobicContact CG2-CG 4.46Å; I91-M93 HydrophobicContact CG2-SD 3.57Å; I91-M93 VanDerWaalsContact CG2-SD 3.57Å; M93-E131 HydrophobicContact CB-CG 4.22Å; M93-E131 HydrophobicContact CG-CG 3.89Å; M93-F229 HydrophobicContact CE-CE2 4.23Å; M93-F229 HydrophobicContact CE-CZ 4.33Å; M93-F229 HydrophobicContact SD-CE2 4.14Å; M93-F229 HydrophobicContact SD-CZ 3.69Å
94	D	95.3	Very high	85.4	Confident	5 Å²	5	37.5 Å²	37.5	3%	0.027	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	168.3	179.4	-163.4	31.2	0	0	0	111.9	K64 M81 L82 R129	K64-D94 WeakPolarHBondContact CD-OD1 3.08Å; K64-D94 VanDerWaalsContact CE-OD1 3.29Å; K64-D94 WeakPolarHBondContact CE-OD1 3.35Å; K64-D94 IonicContact NZ-OD1 2.68Å; K64-D94 PolarHBondContact NZ-OD1 2.71Å; K64-D94 IonicContact NZ-OD2 3.32Å; K64-D94 PolarHBondContact NZ-OD2 3.11Å; M81-D94 CarbonylContact C-O 3.58Å; M81-D94 WeakPolarHBondContact CA-O 3.22Å; L82-D94 HydrophobicContact CB-CB 4.48Å; L82-D94 PolarHBondContact N-O 2.92Å; L82-D94 PolarHBondContact O-N 3.33Å; L82-D94 VanDerWaalsContact O-N 3.13Å; D94-R129 IonicContact OD1-NH1 2.6Å; D94-R129 IonicContact OD2-CZ 3.88Å; D94-R129 IonicContact OD2-NH1 3.89Å; D94-R129 PolarHBondContact OD2-NH1 2.94Å
95	S	95.5	Very high	82.9	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	160	172.8	65.9	0	0	0	0	111.6	A61 K64 M65 L80	A61-S95 PolarHBondContact O-OG 3.06Å; K64-S95 WeakPolarHBondContact CB-OG 3.48Å; K64-S95 VanDerWaalsContact CD-O 3.26Å; K64-S95 WeakPolarHBondContact CD-O 3.45Å; K64-S95 PolarHBondContact NZ-O 2.96Å; M65-S95 VanDerWaalsContact CG-OG 3.24Å; M65-S95 WeakPolarHBondContact CG-OG 3.4Å; L80-S95 CarbonylContact O-C 3.58Å; L80-S95 VanDerWaalsContact O-CA 3.24Å; L80-S95 WeakPolarHBondContact O-CA 3.45Å; L80-S95 WeakPolarHBondContact O-CB 3.38Å
96	F	93.5	Very high	80.5	Confident	11 Å²	11	50 Å²	50	5%	0.048	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	146.5	171.8	62.9	-86	0	0	0	111.3	G79 L80 L82 L98 Y116 Y120 Y137	G79-F96 CarbonylContact C-O 3.5Å; G79-F96 WeakPolarHBondContact CA-O 3.3Å; L80-F96 HydrophobicContact CB-CD1 4.32Å; L80-F96 HydrophobicContact CB-CE1 3.7Å; L80-F96 HydrophobicContact CB-CE2 4.13Å; L80-F96 HydrophobicContact CB-CZ 3.63Å; L80-F96 HydrophobicContact CD1-CE2 4.31Å; L80-F96 HydrophobicContact CD1-CZ 3.79Å; L80-F96 HydrophobicContact CG-CZ 4.27Å; L80-F96 PolarHBondContact N-O 3.02Å; L80-F96 PolarHBondContact O-N 2.83Å; L82-F96 HydrophobicContact CD1-CE1 4.43Å; L82-F96 HydrophobicContact CD2-CE1 3.97Å; L82-F96 HydrophobicContact CG-CD1 4.34Å; L82-F96 HydrophobicContact CG-CE1 4.07Å; F96-L98 HydrophobicContact CD2-CD2 4.42Å; F96-L98 HydrophobicContact CE2-CD2 3.85Å; F96-Y116 AromaticContact CD2-CE1 3.89Å; F96-Y116 HydrophobicContact CD2-CE1 3.89Å; F96-Y116 HydrophobicContact CE2-CD1 4.33Å; F96-Y116 HydrophobicContact CE2-CE1 4.1Å; F96-Y120 HydrophobicContact CB-CD2 4.3Å; F96-Y120 HydrophobicContact CB-CE1 3.98Å; F96-Y120 HydrophobicContact CB-CE2 3.7Å; F96-Y120 AromaticContact CD1-CD1 3.47Å; F96-Y120 HydrophobicContact CD1-CD1 3.47Å; F96-Y120 VanDerWaalsContact CD1-CD1 3.47Å; F96-Y120 AromaticContact CD1-CE1 3.26Å; F96-Y120 HydrophobicContact CD1-CE1 3.26Å; F96-Y120 HydrophobicContact CD1-CE2 4.4Å; F96-Y120 HydrophobicContact CD1-CG 4.14Å; F96-Y120 AromaticContact CD1-CZ 3.78Å; F96-Y120 HydrophobicContact CD2-CD1 4.14Å; F96-Y120 HydrophobicContact CD2-CD2 4.05Å; F96-Y120 HydrophobicContact CD2-CE1 4.4Å; F96-Y120 HydrophobicContact CD2-CE2 4.31Å; F96-Y120 AromaticContact CD2-CG 3.96Å; F96-Y120 HydrophobicContact CD2-CG 3.96Å; F96-Y120 AromaticContact CE1-CD1 3.43Å; F96-Y120 HydrophobicContact CE1-CD1 3.43Å; F96-Y120 VanDerWaalsContact CE1-CD1 3.43Å; F96-Y120 AromaticContact CE1-CE1 3.7Å; F96-Y120 HydrophobicContact CE1-CE1 3.7Å; F96-Y120 HydrophobicContact CE1-CG 4.14Å; F96-Y120 HydrophobicContact CE2-CD1 4.1Å; F96-Y120 HydrophobicContact CE2-CD2 4.45Å; F96-Y120 AromaticContact CE2-CG 3.94Å; F96-Y120 HydrophobicContact CE2-CG 3.94Å; F96-Y120 AromaticContact CG-CD1 3.81Å; F96-Y120 HydrophobicContact CG-CD1 3.81Å; F96-Y120 HydrophobicContact CG-CD2 4.08Å; F96-Y120 AromaticContact CG-CE1 3.64Å; F96-Y120 HydrophobicContact CG-CE1 3.64Å; F96-Y120 AromaticContact CG-CE2 3.92Å; F96-Y120 HydrophobicContact CG-CE2 3.92Å; F96-Y120 HydrophobicContact CG-CG 4.03Å; F96-Y120 AromaticContact CG-CZ 3.7Å; F96-Y120 AromaticContact CZ-CD1 3.73Å; F96-Y120 HydrophobicContact CZ-CD1 3.73Å; F96-Y120 HydrophobicContact CZ-CE1 4.4Å; F96-Y120 HydrophobicContact CZ-CG 4.01Å; F96-Y137 PolarHBondContact O-OH 3.21Å
97	A	92.5	Very high	78.3	Confident	37 Å²	37	47 Å²	47	31%	0.306	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	139	176.3	0	0	0	0	0	110.3	H68 Y116	H68-A97 WeakPolarHBondContact CE1-CB 3.33Å; A97-Y116 WeakPolarHBondContact O-CE1 3.49Å
98	L	88.5	Confident	76.3	Confident	12 Å²	12	51.4 Å²	51.4	6%	0.063	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	145.3	166.4	-70	178.6	0	0	0	109.1	M78 L80 F96 V100 Y116 M117	M78-L98 HydrophobicContact CG-CB 4.28Å; M78-L98 HydrophobicContact CG-CD1 4.23Å; M78-L98 PolarHBondContact O-N 3.47Å; M78-L98 VanDerWaalsContact O-N 3.11Å; M78-L98 HydrophobicContact SD-CD1 4.37Å; L80-L98 HydrophobicContact CD1-CD2 4.38Å; L80-L98 HydrophobicContact CG-CD1 4.16Å; L80-L98 HydrophobicContact CG-CD2 4.44Å; L80-L98 HydrophobicContact CG-CG 4.42Å; F96-L98 HydrophobicContact CD2-CD2 4.42Å; F96-L98 HydrophobicContact CE2-CD2 3.85Å; L98-V100 HydrophobicContact CB-CG2 3.53Å; L98-V100 PolarHBondContact O-N 3.49Å; L98-Y116 HydrophobicContact CD2-CD1 4.07Å; L98-M117 HydrophobicContact CD1-SD 4.31Å; L98-M117 HydrophobicContact CD2-CG 3.49Å; L98-M117 VanDerWaalsContact CD2-CG 3.49Å; L98-M117 HydrophobicContact CD2-SD 4.19Å
99	P	76.3	Confident	74.2	Confident	85 Å²	85	49.1 Å²	49.1	55%	0.552	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78	62.4	179.8	34.2	-36.9	0	0	0	110.8	Y116	P99-Y116 HydrophobicContact CG-CD1 4.32Å; P99-Y116 HydrophobicContact CG-CG 4.13Å
100	V	69.5	Low	72.1	Confident	21 Å²	21	55 Å²	55	13%	0.127	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	118.9	-175.3	-73.1	0	0	0	0	108.3	M78 L98 A113	M78-V100 HydrophobicContact CE-CB 3.94Å; M78-V100 HydrophobicContact CE-CG2 3.42Å; M78-V100 VanDerWaalsContact CE-CG2 3.42Å; M78-V100 HydrophobicContact CG-CG2 3.36Å; M78-V100 HydrophobicContact SD-CB 4.4Å; M78-V100 HydrophobicContact SD-CG2 3.43Å; M78-V100 WeakPolarHBondContact SD-CG2 3.45Å; L98-V100 HydrophobicContact CB-CG2 3.53Å; L98-V100 PolarHBondContact O-N 3.49Å; V100-A113 HydrophobicContact CG1-CB 3.99Å
101	E	59.9	Low	70.2	Confident	180 Å²	180	58.6 Å²	58.6	84%	0.841	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87	111.1	169.1	-68.1	179.9	175.5	0	0	107.3
102	G	58.8	Low	68.6	Low	3 Å²	3	61.2 Å²	61.2	3%	0.031	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	131.6	177.6	0	0	0	0	0	110.6	E76	E76-G102 VanDerWaalsContact O-CA 3.25Å; E76-G102 WeakPolarHBondContact O-CA 3.33Å; E76-G102 PolarHBondContact O-N 3.08Å; E76-G102 VanDerWaalsContact O-N 3.15Å
103	T	51.1	Low	67.2	Low	91 Å²	91	61.2 Å²	61.2	56%	0.558	34%	0.338	S	S	*	.	B	Isolated β-bridge	trans	-96.4	145	150.1	51.6	0	0	0	0	107.1	T105 R106	T103-T105 PolarHBondContact O-N 2.92Å; T103-R106 PolarHBondContact O-N 3.31Å
104	E	49.8	Very low	66.1	Low	102 Å²	102	66.4 Å²	66.4	48%	0.477	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-41.2	-23.7	-175.8	-172.8	-174.7	166.1	0	0	115.7	K210	E104-K210 VanDerWaalsContact CG-NZ 3.33Å; E104-K210 WeakPolarHBondContact OE1-CE 3.32Å; E104-K210 IonicContact OE1-NZ 3.61Å; E104-K210 PolarHBondContact OE1-NZ 2.69Å
105	T	43.9	Very low	65.4	Low	91 Å²	91	73 Å²	73	56%	0.558	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-10.8	-176.1	59.4	0	0	0	0	114.9	T103 I150	T103-T105 PolarHBondContact O-N 2.92Å; T105-I150 WeakPolarHBondContact O-CD1 3.46Å
106	R	46.1	Very low	64.8	Low	191 Å²	191	77.6 Å²	77.6	72%	0.721	41%	0.407	S	S	*	.	B	Isolated β-bridge	trans	-151	98.2	-173.2	-64.5	-172.6	-174.8	-179.6	2.1	112.5	T103 N108	T103-R106 PolarHBondContact O-N 3.31Å; R106-N108 PolarHBondContact O-N 3Å
107	V	47.1	Very low	64.3	Low	24 Å²	24	78.2 Å²	78.2	15%	0.145	41%	0.41	C	S	.	.			trans	-94.7	72.7	159.9	168.5	0	0	0	0	107.5	M78 W136	M78-V107 HydrophobicContact CE-CB 3.63Å; M78-V107 HydrophobicContact CE-CG1 3.1Å; M78-V107 HydrophobicContact CE-CG2 3.64Å; M78-V107 HydrophobicContact SD-CB 4.33Å; M78-V107 HydrophobicContact SD-CG1 3.16Å; M78-V107 WeakPolarHBondContact SD-CG1 3.37Å; V107-W136 HydrophobicContact CG1-CZ3 4.43Å
108	N	50.8	Low	63.9	Low	124 Å²	124	79.5 Å²	79.5	66%	0.663	42%	0.421	S	S	*	.			trans	-98.1	106.5	169.7	-145.5	-1.9	0	0	0	106.7	R106 Q110	R106-N108 PolarHBondContact O-N 3Å; N108-Q110 PolarHBondContact O-N 3.13Å
109	A	52.3	Low	63.9	Low	17 Å²	17	81.2 Å²	81.2	14%	0.14	44%	0.437	C	S	.	.			trans	-56.9	96.3	164.6	0	0	0	0	0	106.6	A113 Y114	A109-A113 HydrophobicContact CB-CB 3.72Å; A109-Y114 HydrophobicContact CB-CE2 4.3Å; A109-Y114 VanDerWaalsContact O-CE2 3.24Å; A109-Y114 WeakPolarHBondContact O-CE2 3.25Å
110	Q	54.5	Low	64.5	Low	142 Å²	142	79.9 Å²	79.9	66%	0.664	42%	0.421	S	S	*	.			trans	-58.5	165.6	177	-65.7	-178.5	-10.3	0	0	109	N108 A112 A113 Y114	N108-Q110 PolarHBondContact O-N 3.13Å; Q110-A112 PolarHBondContact O-N 3.49Å; Q110-A113 WeakPolarHBondContact O-CA 3.42Å; Q110-A113 WeakPolarHBondContact O-CB 3.44Å; Q110-A113 PolarHBondContact O-N 3.17Å; Q110-Y114 PolarHBondContact O-N 3.33Å
111	A	58.2	Low	65.4	Low	74 Å²	74	80.4 Å²	80.4	61%	0.612	42%	0.423	S	S	*	.	H	α-helix	trans	-47.8	-37.8	179.9	0	0	0	0	0	113.5	A113 Y114 E115	A111-A113 VanDerWaalsContact C-N 3.3Å; A111-A113 PolarHBondContact O-N 2.84Å; A111-Y114 PolarHBondContact O-N 3.01Å; A111-E115 PolarHBondContact O-N 3.33Å; A111-E115 VanDerWaalsContact O-N 3.13Å
112	A	63.2	Low	66.8	Low	59 Å²	59	76.4 Å²	76.4	49%	0.488	40%	0.404	S	S	.	.	H	α-helix	trans	-59.9	-34.2	175.5	0	0	0	0	0	113.9	Q110 Y116	Q110-A112 PolarHBondContact O-N 3.49Å; A112-Y116 VanDerWaalsContact O-CB 3.31Å; A112-Y116 WeakPolarHBondContact O-CB 3.5Å; A112-Y116 PolarHBondContact O-N 3Å
113	A	69.4	Low	68.4	Low	1 Å²	1	80.5 Å²	80.5	1%	0.008	43%	0.425	C	S	.	.	H	α-helix	trans	-68.5	-41.3	176.1	0	0	0	0	0	111.1	V100 A109 Q110 A111 Y116 M117	V100-A113 HydrophobicContact CG1-CB 3.99Å; A109-A113 HydrophobicContact CB-CB 3.72Å; Q110-A113 WeakPolarHBondContact O-CA 3.42Å; Q110-A113 WeakPolarHBondContact O-CB 3.44Å; Q110-A113 PolarHBondContact O-N 3.17Å; A111-A113 VanDerWaalsContact C-N 3.3Å; A111-A113 PolarHBondContact O-N 2.84Å; A113-Y116 PolarHBondContact O-N 3.36Å; A113-M117 WeakPolarHBondContact O-CB 3.22Å; A113-M117 WeakPolarHBondContact O-CG 3.29Å; A113-M117 PolarHBondContact O-N 2.79Å
114	Y	72.3	Confident	70.2	Confident	124 Å²	124	76.5 Å²	76.5	49%	0.486	40%	0.402	S	S	.	.	H	α-helix	trans	-64.6	-41	176.2	-71.6	-68.1	0	0	0	112.9	A109 Q110 A111 M117 A118	A109-Y114 HydrophobicContact CB-CE2 4.3Å; A109-Y114 VanDerWaalsContact O-CE2 3.24Å; A109-Y114 WeakPolarHBondContact O-CE2 3.25Å; Q110-Y114 PolarHBondContact O-N 3.33Å; A111-Y114 PolarHBondContact O-N 3.01Å; Y114-M117 HydrophobicContact CD1-CE 4.16Å; Y114-M117 HydrophobicContact CD1-SD 4.06Å; Y114-M117 HydrophobicContact CE1-CE 4.46Å; Y114-M117 WeakPolarHBondContact O-CB 3.35Å; Y114-M117 PolarHBondContact O-N 3.35Å; Y114-A118 PolarHBondContact O-N 3.5Å
115	E	79.7	Confident	72.1	Confident	144 Å²	144	75.6 Å²	75.6	67%	0.673	40%	0.396	S	S	*	.	H	α-helix	trans	-61.8	-45.4	174.1	-70.9	179.3	-178.5	0	0	111.2	A111 M117 A118 A119	A111-E115 PolarHBondContact O-N 3.33Å; A111-E115 VanDerWaalsContact O-N 3.13Å; E115-M117 VanDerWaalsContact C-N 3.34Å; E115-M117 PolarHBondContact O-N 2.72Å; E115-A118 PolarHBondContact O-N 3.48Å; E115-A119 WeakPolarHBondContact O-CB 3.24Å; E115-A119 PolarHBondContact O-N 2.91Å
116	Y	84.1	Confident	74.3	Confident	96 Å²	96	78.2 Å²	78.2	38%	0.376	40%	0.402	S	S	.	.	H	α-helix	trans	-60.9	-41.7	175.8	-176.5	-96.9	0	0	0	112.1	F96 A97 L98 P99 A112 A113 A119 Y120	F96-Y116 AromaticContact CD2-CE1 3.89Å; F96-Y116 HydrophobicContact CD2-CE1 3.89Å; F96-Y116 HydrophobicContact CE2-CD1 4.33Å; F96-Y116 HydrophobicContact CE2-CE1 4.1Å; A97-Y116 WeakPolarHBondContact O-CE1 3.49Å; L98-Y116 HydrophobicContact CD2-CD1 4.07Å; P99-Y116 HydrophobicContact CG-CD1 4.32Å; P99-Y116 HydrophobicContact CG-CG 4.13Å; A112-Y116 VanDerWaalsContact O-CB 3.31Å; A112-Y116 WeakPolarHBondContact O-CB 3.5Å; A112-Y116 PolarHBondContact O-N 3Å; A113-Y116 PolarHBondContact O-N 3.36Å; Y116-A119 PolarHBondContact O-N 3.47Å; Y116-Y120 HydrophobicContact CE1-CD2 4.49Å; Y116-Y120 VanDerWaalsContact O-CB 3.27Å; Y116-Y120 WeakPolarHBondContact O-CB 3.49Å; Y116-Y120 PolarHBondContact O-N 3.05Å
117	M	83.3	Confident	76.4	Confident	24 Å²	24	74.4 Å²	74.4	12%	0.118	40%	0.399	C	S	.	.	H	α-helix	trans	-59.7	-49.2	176	-71.8	167.2	50.8	0	0	112	L80 L98 A113 Y114 E115 Y120 I121	L80-M117 HydrophobicContact CD1-CB 4.27Å; L80-M117 HydrophobicContact CD1-CE 3.41Å; L80-M117 VanDerWaalsContact CD1-CE 3.41Å; L80-M117 HydrophobicContact CD1-CG 3.47Å; L80-M117 VanDerWaalsContact CD1-CG 3.47Å; L80-M117 HydrophobicContact CD1-SD 3.68Å; L98-M117 HydrophobicContact CD1-SD 4.31Å; L98-M117 HydrophobicContact CD2-CG 3.49Å; L98-M117 VanDerWaalsContact CD2-CG 3.49Å; L98-M117 HydrophobicContact CD2-SD 4.19Å; A113-M117 WeakPolarHBondContact O-CB 3.22Å; A113-M117 WeakPolarHBondContact O-CG 3.29Å; A113-M117 PolarHBondContact O-N 2.79Å; Y114-M117 HydrophobicContact CD1-CE 4.16Å; Y114-M117 HydrophobicContact CD1-SD 4.06Å; Y114-M117 HydrophobicContact CE1-CE 4.46Å; Y114-M117 WeakPolarHBondContact O-CB 3.35Å; Y114-M117 PolarHBondContact O-N 3.35Å; E115-M117 VanDerWaalsContact C-N 3.34Å; E115-M117 PolarHBondContact O-N 2.72Å; M117-Y120 PolarHBondContact O-N 3.11Å; M117-I121 WeakPolarHBondContact O-CG1 3.26Å; M117-I121 PolarHBondContact O-N 2.89Å
118	A	84	Confident	78.3	Confident	65 Å²	65	75.8 Å²	75.8	54%	0.537	42%	0.419	S	S	.	.	H	α-helix	trans	-62.9	-45.9	179.9	0	0	0	0	0	111.3	Y114 E115 I121 E122	Y114-A118 PolarHBondContact O-N 3.5Å; E115-A118 PolarHBondContact O-N 3.48Å; A118-I121 PolarHBondContact O-N 2.7Å; A118-E122 WeakPolarHBondContact O-CB 3.39Å; A118-E122 PolarHBondContact O-N 2.79Å
119	A	87.9	Confident	80.1	Confident	48 Å²	48	74.4 Å²	74.4	40%	0.397	41%	0.405	S	S	.	.	H	α-helix	trans	-62.9	-42.2	177.3	0	0	0	0	0	112.2	E115 Y116 E122 N123	E115-A119 WeakPolarHBondContact O-CB 3.24Å; E115-A119 PolarHBondContact O-N 2.91Å; Y116-A119 PolarHBondContact O-N 3.47Å; A119-E122 PolarHBondContact O-N 3.46Å; A119-N123 WeakPolarHBondContact O-CB 3.12Å; A119-N123 PolarHBondContact O-N 3.26Å; A119-N123 PolarHBondContact O-ND2 2.98Å
120	Y	89.4	Confident	81.9	Confident	57 Å²	57	77.4 Å²	77.4	22%	0.224	42%	0.418	C	S	.	.	H	α-helix	trans	-63.8	-47.3	179.1	-170	-81	0	0	0	111.7	L82 F96 Y116 M117 E122 N123 A124	L82-Y120 HydrophobicContact CD1-CD1 4.42Å; L82-Y120 HydrophobicContact CD1-CE1 3.94Å; F96-Y120 HydrophobicContact CB-CD2 4.3Å; F96-Y120 HydrophobicContact CB-CE1 3.98Å; F96-Y120 HydrophobicContact CB-CE2 3.7Å; F96-Y120 AromaticContact CD1-CD1 3.47Å; F96-Y120 HydrophobicContact CD1-CD1 3.47Å; F96-Y120 VanDerWaalsContact CD1-CD1 3.47Å; F96-Y120 AromaticContact CD1-CE1 3.26Å; F96-Y120 HydrophobicContact CD1-CE1 3.26Å; F96-Y120 HydrophobicContact CD1-CE2 4.4Å; F96-Y120 HydrophobicContact CD1-CG 4.14Å; F96-Y120 AromaticContact CD1-CZ 3.78Å; F96-Y120 HydrophobicContact CD2-CD1 4.14Å; F96-Y120 HydrophobicContact CD2-CD2 4.05Å; F96-Y120 HydrophobicContact CD2-CE1 4.4Å; F96-Y120 HydrophobicContact CD2-CE2 4.31Å; F96-Y120 AromaticContact CD2-CG 3.96Å; F96-Y120 HydrophobicContact CD2-CG 3.96Å; F96-Y120 AromaticContact CE1-CD1 3.43Å; F96-Y120 HydrophobicContact CE1-CD1 3.43Å; F96-Y120 VanDerWaalsContact CE1-CD1 3.43Å; F96-Y120 AromaticContact CE1-CE1 3.7Å; F96-Y120 HydrophobicContact CE1-CE1 3.7Å; F96-Y120 HydrophobicContact CE1-CG 4.14Å; F96-Y120 HydrophobicContact CE2-CD1 4.1Å; F96-Y120 HydrophobicContact CE2-CD2 4.45Å; F96-Y120 AromaticContact CE2-CG 3.94Å; F96-Y120 HydrophobicContact CE2-CG 3.94Å; F96-Y120 AromaticContact CG-CD1 3.81Å; F96-Y120 HydrophobicContact CG-CD1 3.81Å; F96-Y120 HydrophobicContact CG-CD2 4.08Å; F96-Y120 AromaticContact CG-CE1 3.64Å; F96-Y120 HydrophobicContact CG-CE1 3.64Å; F96-Y120 AromaticContact CG-CE2 3.92Å; F96-Y120 HydrophobicContact CG-CE2 3.92Å; F96-Y120 HydrophobicContact CG-CG 4.03Å; F96-Y120 AromaticContact CG-CZ 3.7Å; F96-Y120 AromaticContact CZ-CD1 3.73Å; F96-Y120 HydrophobicContact CZ-CD1 3.73Å; F96-Y120 HydrophobicContact CZ-CE1 4.4Å; F96-Y120 HydrophobicContact CZ-CG 4.01Å; Y116-Y120 HydrophobicContact CE1-CD2 4.49Å; Y116-Y120 VanDerWaalsContact O-CB 3.27Å; Y116-Y120 WeakPolarHBondContact O-CB 3.49Å; Y116-Y120 PolarHBondContact O-N 3.05Å; M117-Y120 PolarHBondContact O-N 3.11Å; Y120-E122 VanDerWaalsContact C-N 3.29Å; Y120-E122 PolarHBondContact O-N 2.8Å; Y120-N123 PolarHBondContact O-N 3.24Å; Y120-A124 VanDerWaalsContact O-CB 3.3Å; Y120-A124 WeakPolarHBondContact O-CB 3.29Å; Y120-A124 PolarHBondContact O-N 2.98Å
121	I	87.4	Confident	83.7	Confident	31 Å²	31	71.8 Å²	71.8	16%	0.159	39%	0.391	C	S	.	.	H	α-helix	trans	-62.4	-39.5	179.1	-68.8	168.6	0	0	0	110.6	L82 M117 A118 A124 K125 A133	L82-I121 HydrophobicContact CD2-CG1 4.22Å; M117-I121 WeakPolarHBondContact O-CG1 3.26Å; M117-I121 PolarHBondContact O-N 2.89Å; A118-I121 PolarHBondContact O-N 2.7Å; I121-A124 PolarHBondContact O-N 2.98Å; I121-K125 WeakPolarHBondContact O-CG 3.24Å; I121-K125 PolarHBondContact O-N 3.11Å; I121-A133 HydrophobicContact CD1-CB 4.33Å
122	E	89.3	Confident	85.2	Confident	96 Å²	96	71.8 Å²	71.8	45%	0.449	38%	0.381	S	S	.	.	H	α-helix	trans	-69.2	-42.2	178.6	-165	56.8	-155.9	0	0	112.3	A118 A119 Y120 A124 K125 Q126	A118-E122 WeakPolarHBondContact O-CB 3.39Å; A118-E122 PolarHBondContact O-N 2.79Å; A119-E122 PolarHBondContact O-N 3.46Å; Y120-E122 VanDerWaalsContact C-N 3.29Å; Y120-E122 PolarHBondContact O-N 2.8Å; E122-A124 VanDerWaalsContact C-N 3.32Å; E122-A124 PolarHBondContact O-N 2.8Å; E122-K125 PolarHBondContact O-N 3.48Å; E122-K125 IonicContact OE2-NZ 3.81Å; E122-K125 PolarHBondContact OE2-NZ 3.49Å; E122-Q126 PolarHBondContact O-N 2.91Å
123	N	91.9	Very high	86.6	Confident	90 Å²	90	70.1 Å²	70.1	48%	0.481	37%	0.367	S	S	.	.	H	α-helix	trans	-65	-35.7	174.3	-70.2	-23.6	0	0	0	112.3	A119 Y120 K125 Q126 V127	A119-N123 WeakPolarHBondContact O-CB 3.12Å; A119-N123 PolarHBondContact O-N 3.26Å; A119-N123 PolarHBondContact O-ND2 2.98Å; Y120-N123 PolarHBondContact O-N 3.24Å; N123-K125 VanDerWaalsContact C-N 3.31Å; N123-K125 PolarHBondContact O-N 3.39Å; N123-Q126 WeakPolarHBondContact O-CB 3.42Å; N123-Q126 PolarHBondContact O-N 2.95Å; N123-V127 PolarHBondContact O-N 3.44Å
124	A	90.2	Very high	87.8	Confident	7 Å²	7	70.5 Å²	70.5	6%	0.058	37%	0.369	C	S	.	.	H	α-helix	trans	-60.5	-40.9	176.4	0	0	0	0	0	111.5	L82 Y120 I121 E122 Q126 V127 G128 R129	L82-A124 HydrophobicContact CD1-CB 4.36Å; Y120-A124 VanDerWaalsContact O-CB 3.3Å; Y120-A124 WeakPolarHBondContact O-CB 3.29Å; Y120-A124 PolarHBondContact O-N 2.98Å; I121-A124 PolarHBondContact O-N 2.98Å; E122-A124 VanDerWaalsContact C-N 3.32Å; E122-A124 PolarHBondContact O-N 2.8Å; A124-Q126 VanDerWaalsContact C-N 3.31Å; A124-Q126 PolarHBondContact O-N 2.96Å; A124-V127 WeakPolarHBondContact O-CG2 3.48Å; A124-V127 PolarHBondContact O-N 3.4Å; A124-G128 PolarHBondContact O-N 2.91Å; A124-R129 CarbonylContact C-O 3.53Å; A124-R129 HydrophobicContact CB-CB 4.1Å; A124-R129 WeakPolarHBondContact O-CB 3.39Å; A124-R129 PolarHBondContact O-N 3.14Å
125	K	89.6	Confident	89	Confident	82 Å²	82	64.6 Å²	64.6	36%	0.357	35%	0.346	S	S	.	.	H	α-helix	trans	-63.3	-36.4	176.1	-66.8	170.5	-164.9	159.6	0	112.6	I121 E122 N123 V127 G128 R129	I121-K125 WeakPolarHBondContact O-CG 3.24Å; I121-K125 PolarHBondContact O-N 3.11Å; E122-K125 PolarHBondContact O-N 3.48Å; E122-K125 IonicContact OE2-NZ 3.81Å; E122-K125 PolarHBondContact OE2-NZ 3.49Å; N123-K125 VanDerWaalsContact C-N 3.31Å; N123-K125 PolarHBondContact O-N 3.39Å; K125-V127 PolarHBondContact O-N 3.29Å; K125-G128 PolarHBondContact O-N 2.9Å; K125-R129 WeakPolarHBondContact CA-O 3.16Å; K125-R129 PolarHBondContact N-O 3.47Å
126	Q	90.2	Very high	89.7	Confident	147 Å²	147	58.2 Å²	58.2	69%	0.687	32%	0.316	S	S	*	.	H	α-helix	trans	-63	-27.6	178.4	-64.9	-179.1	5	0	0	112.7	E122 N123 A124	E122-Q126 PolarHBondContact O-N 2.91Å; N123-Q126 WeakPolarHBondContact O-CB 3.42Å; N123-Q126 PolarHBondContact O-N 2.95Å; A124-Q126 VanDerWaalsContact C-N 3.31Å; A124-Q126 PolarHBondContact O-N 2.96Å
127	V	89.4	Confident	90.3	Very high	110 Å²	110	53.7 Å²	53.7	67%	0.667	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	16.1	175.6	-59.3	0	0	0	0	113.1	N123 A124 K125 R129	N123-V127 PolarHBondContact O-N 3.44Å; A124-V127 WeakPolarHBondContact O-CG2 3.48Å; A124-V127 PolarHBondContact O-N 3.4Å; K125-V127 PolarHBondContact O-N 3.29Å; V127-R129 HydrophobicContact CG2-CG 4.25Å
128	G	86.5	Confident	90.9	Very high	54 Å²	54	52.7 Å²	52.7	56%	0.557	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.6	13.2	175.6	0	0	0	0	0	115.3	A124 K125 L130	A124-G128 PolarHBondContact O-N 2.91Å; K125-G128 PolarHBondContact O-N 2.9Å; G128-L130 PolarHBondContact O-N 3.02Å
129	R	89.2	Confident	91.4	Very high	95 Å²	95	49.6 Å²	49.6	36%	0.358	27%	0.267	S	S	.	.			trans	-89.9	100.6	171.2	-63.2	-179.4	178.4	-144.9	-5	108.8	D94 A124 K125 V127	D94-R129 IonicContact OD1-NH1 2.6Å; D94-R129 IonicContact OD2-CZ 3.88Å; D94-R129 IonicContact OD2-NH1 3.89Å; D94-R129 PolarHBondContact OD2-NH1 2.94Å; A124-R129 CarbonylContact C-O 3.53Å; A124-R129 HydrophobicContact CB-CB 4.1Å; A124-R129 WeakPolarHBondContact O-CB 3.39Å; A124-R129 PolarHBondContact O-N 3.14Å; K125-R129 WeakPolarHBondContact CA-O 3.16Å; K125-R129 PolarHBondContact N-O 3.47Å; V127-R129 HydrophobicContact CG2-CG 4.25Å
130	L	90.1	Very high	91.7	Very high	80 Å²	80	47.4 Å²	47.4	42%	0.419	25%	0.249	S	C	.	.			trans	-94.9	-6.5	-170.3	-58.2	-179.2	0	0	0	112.8	Y31 G128	Y31-L130 HydrophobicContact CD1-CB 3.51Å; Y31-L130 HydrophobicContact CD1-CD1 3.97Å; Y31-L130 HydrophobicContact CD1-CG 4.39Å; Y31-L130 HydrophobicContact CD2-CB 4.49Å; Y31-L130 HydrophobicContact CE1-CB 3.76Å; Y31-L130 HydrophobicContact CG-CB 3.91Å; G128-L130 PolarHBondContact O-N 3.02Å
131	E	92.1	Very high	91.9	Very high	23 Å²	23	45.1 Å²	45.1	11%	0.107	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-63.2	137	174.8	-67.4	81.1	-176.8	0	0	111.8	Y31 L82 G83 M93	Y31-E131 HydrophobicContact CD2-CG 3.98Å; Y31-E131 HydrophobicContact CE2-CG 4.36Å; L82-E131 HydrophobicContact CB-CB 4.22Å; G83-E131 WeakPolarHBondContact O-CB 3.2Å; M93-E131 HydrophobicContact CB-CG 4.22Å; M93-E131 HydrophobicContact CG-CG 3.89Å
132	N	90.5	Very high	92.1	Very high	75 Å²	75	44 Å²	44	40%	0.401	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	172.4	174.2	-65.7	-50.5	0	0	0	110.5	L82 G83 I134	L82-N132 WeakPolarHBondContact CA-O 3.31Å; G83-N132 PolarHBondContact N-O 2.68Å; N132-I134 PolarHBondContact O-N 2.63Å
133	A	92.4	Very high	92.1	Very high	23 Å²	23	41.7 Å²	41.7	19%	0.19	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	126.3	170	0	0	0	0	0	110.1	M81 L82 I121 F165	M81-A133 WeakPolarHBondContact O-CA 3.48Å; L82-A133 HydrophobicContact CD2-CB 4.49Å; I121-A133 HydrophobicContact CD1-CB 4.33Å; A133-F165 HydrophobicContact CB-CE2 4.39Å
134	I	95.2	Very high	92.1	Very high	10 Å²	10	37.4 Å²	37.4	5%	0.051	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	-7.6	-179.5	-162.9	62.3	0	0	0	112	M81 V85 M90 I92 N132 P164 F165 V166	M81-I134 HydrophobicContact CB-CG2 4.27Å; M81-I134 PolarHBondContact O-N 2.97Å; V85-I134 HydrophobicContact CG1-CD1 3.79Å; M90-I134 HydrophobicContact CE-CD1 3.85Å; M90-I134 HydrophobicContact CE-CG1 3.69Å; M90-I134 WeakPolarHBondContact CE-O 3.37Å; I92-I134 HydrophobicContact CG1-CG2 4.06Å; N132-I134 PolarHBondContact O-N 2.63Å; I134-P164 HydrophobicContact CD1-CG 4.03Å; I134-P164 WeakPolarHBondContact CD1-O 3.5Å; I134-F165 CarbonylContact O-C 3.56Å; I134-F165 WeakPolarHBondContact O-CA 3.35Å; I134-V166 PolarHBondContact O-N 3.14Å
135	G	96	Very high	92.3	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174.8	178	-175.7	0	0	0	0	0	112.8	L80 M81 F165 V166	L80-G135 WeakPolarHBondContact CD2-O 3.49Å; M81-G135 PolarHBondContact N-O 3.34Å; G135-F165 VanDerWaalsContact C-CZ 3.46Å; G135-F165 VanDerWaalsContact CA-CZ 3.49Å; G135-V166 CarbonylContact C-O 3.55Å; G135-V166 WeakPolarHBondContact CA-O 3.26Å
136	W	95.6	Very high	92.6	Very high	9 Å²	9	33.5 Å²	33.5	3%	0.034	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	154.6	172.9	68.8	-63.3	0	0	0	109.7	G79 L80 M81 V107 H138 D151 T154 Q155 F165 V166 A167 V168	G79-W136 CarbonylContact O-C 3.59Å; G79-W136 VanDerWaalsContact O-CA 3.31Å; G79-W136 WeakPolarHBondContact O-CA 3.41Å; L80-W136 HydrophobicContact CD2-CB 3.83Å; M81-W136 WeakPolarHBondContact CE-O 3.33Å; V107-W136 HydrophobicContact CG1-CZ3 4.43Å; W136-H138 HydrophobicContact CE3-CB 4.26Å; W136-H138 AromaticContact CE3-ND1 3.7Å; W136-H138 AromaticContact CH2-CE1 3.48Å; W136-H138 VanDerWaalsContact CH2-CE1 3.48Å; W136-H138 WeakPolarHBondContact CH2-CE1 3.28Å; W136-H138 AromaticContact CH2-ND1 3.19Å; W136-H138 WeakPolarHBondContact CH2-ND1 3.33Å; W136-H138 AromaticContact CZ2-ND1 3.96Å; W136-H138 HydrophobicContact CZ3-CB 3.81Å; W136-H138 AromaticContact CZ3-CE1 3.82Å; W136-H138 AromaticContact CZ3-CG 3.58Å; W136-H138 AromaticContact CZ3-ND1 3.04Å; W136-H138 WeakPolarHBondContact CZ3-ND1 3.24Å; W136-D151 HydrophobicContact CH2-CB 4.07Å; W136-D151 HydrophobicContact CZ2-CB 4.29Å; W136-T154 HydrophobicContact CH2-CG2 4.31Å; W136-T154 HydrophobicContact CZ2-CG2 4.12Å; W136-Q155 VanDerWaalsContact CD1-OE1 3.32Å; W136-F165 HydrophobicContact CB-CE1 4.1Å; W136-F165 AromaticContact CD1-CD1 3.87Å; W136-F165 AromaticContact CD1-CE1 3.5Å; W136-F165 HydrophobicContact CG-CE1 4.12Å; W136-V166 PolarHBondContact N-O 3.31Å; W136-A167 HydrophobicContact CZ2-CB 4.12Å; W136-A167 CarbonylContact O-C 3.56Å; W136-A167 WeakPolarHBondContact O-CA 3.39Å; W136-V168 PolarHBondContact O-N 3.46Å
137	Y	96.5	Very high	92.7	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.008	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	152.4	170.4	72.6	-84.6	0	0	0	110.5	M65 H68 M78 G79 M81 F96 V168 I170	M65-Y137 HydrophobicContact CB-CD2 4Å; M65-Y137 HydrophobicContact CB-CE2 3.94Å; M65-Y137 HydrophobicContact CB-CG 4.36Å; M65-Y137 HydrophobicContact CG-CD1 3.73Å; M65-Y137 HydrophobicContact CG-CD2 3.94Å; M65-Y137 HydrophobicContact CG-CE1 3.74Å; M65-Y137 HydrophobicContact CG-CE2 3.95Å; M65-Y137 HydrophobicContact CG-CG 3.83Å; M65-Y137 HydrophobicContact SD-CD1 3.66Å; M65-Y137 HydrophobicContact SD-CD2 4.2Å; M65-Y137 HydrophobicContact SD-CE1 4.28Å; M65-Y137 HydrophobicContact SD-CG 3.61Å; H68-Y137 AromaticContact ND1-CE2 3.6Å; H68-Y137 AromaticContact ND1-CZ 3.6Å; H68-Y137 PolarHBondContact ND1-OH 3.09Å; M78-Y137 CarbonylContact C-O 3.59Å; M78-Y137 WeakPolarHBondContact CA-O 3.29Å; M78-Y137 WeakPolarHBondContact CB-O 3.32Å; G79-Y137 VanDerWaalsContact C-CE1 3.42Å; G79-Y137 PolarHBondContact N-O 2.97Å; G79-Y137 PolarHBondContact O-N 3.49Å; M81-Y137 HydrophobicContact CG-CD1 3.83Å; M81-Y137 HydrophobicContact SD-CD1 4.44Å; F96-Y137 PolarHBondContact O-OH 3.21Å; Y137-V168 CarbonylContact C-O 3.59Å; Y137-V168 WeakPolarHBondContact CA-O 3.42Å; Y137-V168 WeakPolarHBondContact CB-O 3.48Å; Y137-I170 HydrophobicContact CD2-CD1 4.26Å
138	H	95	Very high	92.9	Very high	2 Å²	2	21.9 Å²	21.9	1%	0.009	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	168.1	167.7	65.3	-78	0	0	0	111	V77 M78 W136 H140 D151 V168 V169 I170	V77-H138 CarbonylContact O-C 3.55Å; V77-H138 WeakPolarHBondContact O-CA 3.03Å; V77-H138 WeakPolarHBondContact O-CB 3.43Å; M78-H138 HydrophobicContact CB-CB 4.04Å; W136-H138 HydrophobicContact CE3-CB 4.26Å; W136-H138 AromaticContact CE3-ND1 3.7Å; W136-H138 AromaticContact CH2-CE1 3.48Å; W136-H138 VanDerWaalsContact CH2-CE1 3.48Å; W136-H138 WeakPolarHBondContact CH2-CE1 3.28Å; W136-H138 AromaticContact CH2-ND1 3.19Å; W136-H138 WeakPolarHBondContact CH2-ND1 3.33Å; W136-H138 AromaticContact CZ2-ND1 3.96Å; W136-H138 HydrophobicContact CZ3-CB 3.81Å; W136-H138 AromaticContact CZ3-CE1 3.82Å; W136-H138 AromaticContact CZ3-CG 3.58Å; W136-H138 AromaticContact CZ3-ND1 3.04Å; W136-H138 WeakPolarHBondContact CZ3-ND1 3.24Å; H138-H140 AromaticContact CD2-CD2 3.62Å; H138-H140 AromaticContact CD2-NE2 3.62Å; H138-H140 AromaticContact NE2-CD2 3.69Å; H138-H140 AromaticContact NE2-CE1 3.91Å; H138-H140 AromaticContact NE2-NE2 3.26Å; H138-H140 PolarHBondContact NE2-NE2 2.84Å; H138-D151 IonicContact CE1-OD1 3.04Å; H138-D151 IonicContact NE2-OD1 3.95Å; H138-D151 IonicContact NE2-OD2 2.92Å; H138-V168 PolarHBondContact N-O 3.41Å; H138-V169 WeakPolarHBondContact O-CA 3.08Å; H138-I170 PolarHBondContact O-N 2.98Å
139	S	94.9	Very high	93.1	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	140.1	-179	64.5	0	0	0	0	113	E76 V77 I170	E76-S139 WeakPolarHBondContact CA-OG 3.26Å; E76-S139 WeakPolarHBondContact CB-O 3.4Å; E76-S139 VanDerWaalsContact CG-O 3.31Å; E76-S139 WeakPolarHBondContact CG-O 3.34Å; V77-S139 PolarHBondContact N-OG 2.83Å; V77-S139 PolarHBondContact O-N 3.24Å; S139-I170 CarbonylContact C-O 3.56Å; S139-I170 WeakPolarHBondContact CA-O 3.41Å
140	H	94.2	Very high	93.1	Very high	3 Å²	3	18.6 Å²	18.6	1%	0.014	10%	0.102	C	C	.	.			trans	-115.6	91.7	167.5	-81.2	-172.9	0	0	0	109.9	E76 H138 G142 Y143 G144 W146 D151 V169 I170 D171	E76-H140 IonicContact OE1-CD2 2.67Å; H138-H140 AromaticContact CD2-CD2 3.62Å; H138-H140 AromaticContact CD2-NE2 3.62Å; H138-H140 AromaticContact NE2-CD2 3.69Å; H138-H140 AromaticContact NE2-CE1 3.91Å; H138-H140 AromaticContact NE2-NE2 3.26Å; H138-H140 PolarHBondContact NE2-NE2 2.84Å; H140-G142 PolarHBondContact O-N 2.97Å; H140-Y143 HydrophobicContact CB-CD2 3.93Å; H140-Y143 HydrophobicContact CB-CG 4.42Å; H140-G144 WeakPolarHBondContact CB-O 3.43Å; H140-G144 PolarHBondContact ND1-O 2.84Å; H140-W146 PolarHBondContact CE1-O 3.37Å; H140-W146 AromaticContact ND1-NE1 3.92Å; H140-W146 PolarHBondContact ND1-O 3.13Å; H140-D151 IonicContact CE1-OD2 2.7Å; H140-D151 IonicContact NE2-OD2 2.71Å; H140-V169 HydrophobicContact CB-CG1 3.94Å; H140-I170 PolarHBondContact N-O 3.05Å; H140-D171 WeakPolarHBondContact O-CA 3Å; H140-D171 WeakPolarHBondContact O-CB 3.47Å
141	P	93.2	Very high	93.2	Very high	9 Å²	9	15 Å²	15	6%	0.058	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	97.5	-175.7	-20	34.4	0	0	0	112.7	Y143 P172	P141-Y143 WeakPolarHBondContact O-CD1 3.48Å; P141-Y143 WeakPolarHBondContact O-CE1 3.49Å; P141-P172 HydrophobicContact CB-CG 4.33Å; P141-P172 HydrophobicContact CG-CG 4.38Å
142	G	91.7	Very high	93.3	Very high	7 Å²	7	13.9 Å²	13.9	7%	0.072	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	91	-3.8	175.5	0	0	0	0	0	115.4	H140 D171 R174	H140-G142 PolarHBondContact O-N 2.97Å; G142-D171 VanDerWaalsContact CA-OD2 3.25Å; G142-D171 WeakPolarHBondContact CA-OD2 3.35Å; G142-D171 VanDerWaalsContact N-CG 3.27Å; G142-D171 PolarHBondContact N-OD1 3.36Å; G142-D171 PolarHBondContact N-OD2 3.31Å; G142-R174 PolarHBondContact O-NE 2.87Å; G142-R174 PolarHBondContact O-NH2 3.44Å
143	Y	89.4	Confident	93.4	Very high	47 Å²	47	14 Å²	14	18%	0.184	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-11.3	-173.2	-39.5	-35.6	0	0	0	113.9	H140 P141 W146 D171 R174 P207	H140-Y143 HydrophobicContact CB-CD2 3.93Å; H140-Y143 HydrophobicContact CB-CG 4.42Å; P141-Y143 WeakPolarHBondContact O-CD1 3.48Å; P141-Y143 WeakPolarHBondContact O-CE1 3.49Å; Y143-W146 PolarHBondContact O-NE1 3.07Å; Y143-W146 VanDerWaalsContact O-NE1 3.14Å; Y143-D171 PolarHBondContact N-OD2 3.47Å; Y143-D171 VanDerWaalsContact N-OD2 3.11Å; Y143-R174 VanDerWaalsContact C-NH2 3.25Å; Y143-R174 PolarHBondContact O-NH2 2.68Å; Y143-P207 HydrophobicContact CD1-CG 4.01Å
144	G	92.3	Very high	93.3	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	9%	0.085	C	C	.	.			trans	83.8	173.5	-169	0	0	0	0	0	112.6	H140 D171	H140-G144 WeakPolarHBondContact CB-O 3.43Å; H140-G144 PolarHBondContact ND1-O 2.84Å; G144-D171 WeakPolarHBondContact CA-OD2 3.49Å; G144-D171 PolarHBondContact N-OD2 3.16Å
145	C	94.8	Very high	93.3	Very high	7 Å²	7	14 Å²	14	5%	0.047	8%	0.083	C	C	.	.	S	Bend	trans	-97.5	107.6	-176.1	-63.1	0	0	0	0	110.4	V169 N182 F186	C145-V169 HydrophobicContact CB-CB 4.03Å; C145-V169 HydrophobicContact CB-CG1 4.2Å; C145-V169 PolarHBondContact SG-O 3.45Å; C145-N182 PolarHBondContact SG-O 3.03Å; C145-N182 VanDerWaalsContact SG-O 3.41Å; C145-N182 PolarHBondContact SG-OD1 3.45Å; C145-F186 HydrophobicContact CB-CE2 4.25Å; C145-F186 HydrophobicContact CB-CZ 4.23Å; C145-F186 VanDerWaalsContact O-CZ 3.28Å; C145-F186 WeakPolarHBondContact O-CZ 3.45Å
146	W	94.4	Very high	93.1	Very high	1 Å²	1	16.5 Å²	16.5	0%	0.004	10%	0.095	C	C	.	.			trans	-160.5	166.9	178.7	57.2	-84.2	0	0	0	108.3	H140 Y143 K210 D213 F214 Y221	H140-W146 PolarHBondContact CE1-O 3.37Å; H140-W146 AromaticContact ND1-NE1 3.92Å; H140-W146 PolarHBondContact ND1-O 3.13Å; Y143-W146 PolarHBondContact O-NE1 3.07Å; Y143-W146 VanDerWaalsContact O-NE1 3.14Å; W146-K210 HydrophobicContact CH2-CB 4.14Å; W146-K210 HydrophobicContact CH2-CD 4.41Å; W146-K210 HydrophobicContact CZ2-CB 3.76Å; W146-K210 HydrophobicContact CZ2-CD 4.32Å; W146-K210 HydrophobicContact CZ2-CG 4.17Å; W146-D213 HydrophobicContact CH2-CB 4.23Å; W146-D213 HydrophobicContact CZ3-CB 4.29Å; W146-F214 HydrophobicContact CB-CD2 3.66Å; W146-F214 HydrophobicContact CB-CE2 3.76Å; W146-F214 HydrophobicContact CD2-CB 4.17Å; W146-F214 AromaticContact CD2-CD2 3.77Å; W146-F214 HydrophobicContact CD2-CD2 3.77Å; W146-F214 HydrophobicContact CD2-CG 4.42Å; W146-F214 HydrophobicContact CE3-CB 3.82Å; W146-F214 AromaticContact CE3-CD2 3.77Å; W146-F214 HydrophobicContact CE3-CD2 3.77Å; W146-F214 HydrophobicContact CE3-CG 4.31Å; W146-F214 AromaticContact CG-CD2 3.71Å; W146-F214 HydrophobicContact CG-CD2 3.71Å; W146-F214 HydrophobicContact CG-CE2 4.24Å; W146-F214 HydrophobicContact CH2-CB 4.38Å; W146-F214 HydrophobicContact CZ3-CB 3.91Å; W146-Y221 WeakPolarHBondContact CB-OH 3.49Å
147	L	93.7	Very high	92.9	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.116	C	C	.	.			trans	-103.5	126.7	177.6	-58.8	-177.9	0	0	0	110.8	D151 V152 A167 V169 F186 T188 Y221	L147-D151 HydrophobicContact CB-CB 3.9Å; L147-D151 HydrophobicContact CD2-CB 3.89Å; L147-D151 HydrophobicContact CG-CB 4.42Å; L147-V152 HydrophobicContact CB-CG2 3.77Å; L147-V152 HydrophobicContact CD1-CG2 4.35Å; L147-A167 HydrophobicContact CD1-CB 4.42Å; L147-A167 HydrophobicContact CD2-CB 4.01Å; L147-V169 HydrophobicContact CD2-CG2 3.64Å; L147-F186 HydrophobicContact CD1-CB 3.7Å; L147-F186 HydrophobicContact CD1-CG 4.37Å; L147-F186 HydrophobicContact CD2-CB 4.36Å; L147-F186 HydrophobicContact CD2-CD2 4.05Å; L147-F186 HydrophobicContact CD2-CG 4.46Å; L147-F186 HydrophobicContact CG-CB 3.98Å; L147-F186 HydrophobicContact CG-CD2 4.14Å; L147-F186 HydrophobicContact CG-CG 4.11Å; L147-T188 HydrophobicContact CD1-CG2 4.31Å; L147-Y221 HydrophobicContact CB-CD1 3.91Å; L147-Y221 HydrophobicContact CB-CE1 3.69Å; L147-Y221 HydrophobicContact CB-CG 4.4Å; L147-Y221 HydrophobicContact CD1-CD1 4.12Å; L147-Y221 HydrophobicContact CD1-CD2 4.32Å; L147-Y221 HydrophobicContact CD1-CG 3.92Å; L147-Y221 HydrophobicContact CG-CD1 4.35Å; L147-Y221 HydrophobicContact CG-CD2 4.41Å; L147-Y221 HydrophobicContact CG-CE1 4.41Å; L147-Y221 HydrophobicContact CG-CE2 4.49Å; L147-Y221 HydrophobicContact CG-CG 4.34Å; L147-Y221 PolarHBondContact N-OH 3.03Å; L147-Y221 WeakPolarHBondContact O-CE1 3.21Å
148	S	92.2	Very high	92.7	Very high	12 Å²	12	21.6 Å²	21.6	8%	0.084	12%	0.123	C	C	.	.			trans	-67.5	169.5	167.8	70.9	0	0	0	0	112.1	I150 D151 V152 D213	S148-I150 PolarHBondContact O-N 3.5Å; S148-I150 PolarHBondContact OG-N 2.98Å; S148-D151 VanDerWaalsContact CB-OD2 3.23Å; S148-D151 WeakPolarHBondContact CB-OD2 3.38Å; S148-D151 PolarHBondContact N-OD2 3.28Å; S148-D151 PolarHBondContact O-N 2.9Å; S148-D151 VanDerWaalsContact O-N 3.14Å; S148-D151 PolarHBondContact OG-N 2.91Å; S148-D151 VanDerWaalsContact OG-N 3.11Å; S148-D151 PolarHBondContact OG-OD2 3.03Å; S148-V152 WeakPolarHBondContact O-CG2 3.29Å; S148-V152 PolarHBondContact O-N 2.86Å; S148-D213 WeakPolarHBondContact CA-OD2 3.44Å; S148-D213 WeakPolarHBondContact CB-OD2 3.27Å
149	G	91.1	Very high	92.6	Very high	10 Å²	10	22.5 Å²	22.5	10%	0.103	13%	0.127	C	C	.	.	H	α-helix	trans	-56.9	-32.7	172.3	0	0	0	0	0	113.9	S153 D213 H217	G149-S153 WeakPolarHBondContact O-CB 3.24Å; G149-S153 PolarHBondContact O-N 3.28Å; G149-S153 VanDerWaalsContact O-N 3.1Å; G149-S153 PolarHBondContact O-OG 2.84Å; G149-D213 PolarHBondContact N-OD1 2.96Å; G149-D213 VanDerWaalsContact N-OD1 3.07Å; G149-H217 VanDerWaalsContact CA-CD2 3.49Å; G149-H217 WeakPolarHBondContact CA-CD2 3.33Å
150	I	89.6	Confident	92.4	Very high	71 Å²	71	29.3 Å²	29.3	36%	0.364	16%	0.159	S	C	.	.	H	α-helix	trans	-72.5	-42.8	176.3	-63.3	169.5	0	0	0	110.2	T105 S148 S153 T154	T105-I150 WeakPolarHBondContact O-CD1 3.46Å; S148-I150 PolarHBondContact O-N 3.5Å; S148-I150 PolarHBondContact OG-N 2.98Å; I150-S153 PolarHBondContact O-N 3.38Å; I150-T154 WeakPolarHBondContact O-CB 3.46Å; I150-T154 PolarHBondContact O-N 2.89Å; I150-T154 PolarHBondContact O-OG1 2.85Å
151	D	93.1	Very high	92.1	Very high	3 Å²	3	36.1 Å²	36.1	2%	0.016	19%	0.189	C	C	.	.	H	α-helix	trans	-66.5	-41	179.2	-55	-41.6	0	0	0	111.4	W136 H138 H140 L147 S148 S153 T154 Q155	W136-D151 HydrophobicContact CH2-CB 4.07Å; W136-D151 HydrophobicContact CZ2-CB 4.29Å; H138-D151 IonicContact CE1-OD1 3.04Å; H138-D151 IonicContact NE2-OD1 3.95Å; H138-D151 IonicContact NE2-OD2 2.92Å; H140-D151 IonicContact CE1-OD2 2.7Å; H140-D151 IonicContact NE2-OD2 2.71Å; L147-D151 HydrophobicContact CB-CB 3.9Å; L147-D151 HydrophobicContact CD2-CB 3.89Å; L147-D151 HydrophobicContact CG-CB 4.42Å; S148-D151 VanDerWaalsContact CB-OD2 3.23Å; S148-D151 WeakPolarHBondContact CB-OD2 3.38Å; S148-D151 PolarHBondContact N-OD2 3.28Å; S148-D151 PolarHBondContact O-N 2.9Å; S148-D151 VanDerWaalsContact O-N 3.14Å; S148-D151 PolarHBondContact OG-N 2.91Å; S148-D151 VanDerWaalsContact OG-N 3.11Å; S148-D151 PolarHBondContact OG-OD2 3.03Å; D151-S153 VanDerWaalsContact C-N 3.33Å; D151-S153 PolarHBondContact O-N 2.94Å; D151-T154 PolarHBondContact O-N 2.93Å; D151-Q155 VanDerWaalsContact O-CB 3.24Å; D151-Q155 WeakPolarHBondContact O-CB 3.37Å; D151-Q155 PolarHBondContact O-N 2.95Å
152	V	93.1	Very high	91.8	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.006	21%	0.205	C	C	.	.	H	α-helix	trans	-58.7	-47.9	173	170.7	0	0	0	0	110	L147 S148 T154 Q155 M156 T188 H217 Q220 Y221	L147-V152 HydrophobicContact CB-CG2 3.77Å; L147-V152 HydrophobicContact CD1-CG2 4.35Å; S148-V152 WeakPolarHBondContact O-CG2 3.29Å; S148-V152 PolarHBondContact O-N 2.86Å; V152-T154 VanDerWaalsContact C-N 3.33Å; V152-T154 PolarHBondContact O-N 3.45Å; V152-Q155 PolarHBondContact O-N 3.31Å; V152-M156 HydrophobicContact CG1-CG 4.27Å; V152-M156 HydrophobicContact CG1-SD 3.94Å; V152-M156 WeakPolarHBondContact O-CB 3.24Å; V152-M156 WeakPolarHBondContact O-CG 3.33Å; V152-M156 PolarHBondContact O-N 3.17Å; V152-T188 HydrophobicContact CB-CG2 4.38Å; V152-T188 HydrophobicContact CG1-CG2 3.94Å; V152-T188 HydrophobicContact CG2-CG2 4.47Å; V152-H217 HydrophobicContact CG2-CB 4.34Å; V152-Q220 HydrophobicContact CG1-CB 4.03Å; V152-Y221 HydrophobicContact CG2-CD1 3.62Å; V152-Y221 HydrophobicContact CG2-CE1 4.04Å
153	S	92.3	Very high	91.7	Very high	77 Å²	77	42.3 Å²	42.3	54%	0.538	22%	0.215	S	C	.	.	H	α-helix	trans	-61.2	-42.4	178.8	-60.8	0	0	0	0	112	G149 I150 D151 L157	G149-S153 WeakPolarHBondContact O-CB 3.24Å; G149-S153 PolarHBondContact O-N 3.28Å; G149-S153 VanDerWaalsContact O-N 3.1Å; G149-S153 PolarHBondContact O-OG 2.84Å; I150-S153 PolarHBondContact O-N 3.38Å; D151-S153 VanDerWaalsContact C-N 3.33Å; D151-S153 PolarHBondContact O-N 2.94Å; S153-L157 WeakPolarHBondContact O-CB 3.15Å; S153-L157 PolarHBondContact O-N 2.77Å
154	T	91.2	Very high	92	Very high	32 Å²	32	40.4 Å²	40.4	20%	0.196	21%	0.209	C	C	.	.	H	α-helix	trans	-65.7	-46.1	178	-58.6	0	0	0	0	111.4	W136 I150 D151 V152 L157 N158	W136-T154 HydrophobicContact CH2-CG2 4.31Å; W136-T154 HydrophobicContact CZ2-CG2 4.12Å; I150-T154 WeakPolarHBondContact O-CB 3.46Å; I150-T154 PolarHBondContact O-N 2.89Å; I150-T154 PolarHBondContact O-OG1 2.85Å; D151-T154 PolarHBondContact O-N 2.93Å; V152-T154 VanDerWaalsContact C-N 3.33Å; V152-T154 PolarHBondContact O-N 3.45Å; T154-L157 WeakPolarHBondContact O-CB 3.43Å; T154-L157 PolarHBondContact O-N 3Å; T154-N158 PolarHBondContact O-N 3.39Å; T154-N158 PolarHBondContact O-ND2 3.42Å
155	Q	94.4	Very high	92.1	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-66.3	-39.4	178.3	177.5	57.9	14.9	0	0	111.9	W136 D151 V152 N158 Q159 F165 A167 T188	W136-Q155 VanDerWaalsContact CD1-OE1 3.32Å; D151-Q155 VanDerWaalsContact O-CB 3.24Å; D151-Q155 WeakPolarHBondContact O-CB 3.37Å; D151-Q155 PolarHBondContact O-N 2.95Å; V152-Q155 PolarHBondContact O-N 3.31Å; Q155-N158 PolarHBondContact O-N 3.09Å; Q155-Q159 WeakPolarHBondContact O-CB 3.22Å; Q155-Q159 PolarHBondContact O-N 3.22Å; Q155-F165 PolarHBondContact NE2-O 3.39Å; Q155-A167 HydrophobicContact CB-CB 4.33Å; Q155-A167 HydrophobicContact CG-CB 4.05Å; Q155-T188 HydrophobicContact CB-CG2 3.87Å; Q155-T188 HydrophobicContact CG-CG2 3.68Å
156	M	92.7	Very high	92.3	Very high	53 Å²	53	40.2 Å²	40.2	26%	0.261	21%	0.207	S	C	.	.	H	α-helix	trans	-61.3	-44	173.6	-76.1	-178.2	73.4	0	0	111.6	V152 Q159 Q160 T188 K191	V152-M156 HydrophobicContact CG1-CG 4.27Å; V152-M156 HydrophobicContact CG1-SD 3.94Å; V152-M156 WeakPolarHBondContact O-CB 3.24Å; V152-M156 WeakPolarHBondContact O-CG 3.33Å; V152-M156 PolarHBondContact O-N 3.17Å; M156-Q159 PolarHBondContact O-N 3.19Å; M156-Q160 WeakPolarHBondContact O-CB 3.45Å; M156-Q160 PolarHBondContact O-N 3.43Å; M156-T188 HydrophobicContact CG-CG2 3.98Å; M156-T188 WeakPolarHBondContact CG-OG1 3.28Å; M156-K191 HydrophobicContact CE-CB 3.86Å; M156-K191 HydrophobicContact CE-CG 4.49Å
157	L	91.4	Very high	92.4	Very high	89 Å²	89	40.1 Å²	40.1	47%	0.466	21%	0.207	S	C	.	.	H	α-helix	trans	-60.9	-46.5	176.1	-169.8	76.8	0	0	0	111	S153 T154 Q160 F161	S153-L157 WeakPolarHBondContact O-CB 3.15Å; S153-L157 PolarHBondContact O-N 2.77Å; T154-L157 WeakPolarHBondContact O-CB 3.43Å; T154-L157 PolarHBondContact O-N 3Å; L157-Q160 WeakPolarHBondContact O-CB 3.44Å; L157-Q160 PolarHBondContact O-N 3.36Å; L157-F161 HydrophobicContact CD1-CD2 4.03Å; L157-F161 HydrophobicContact CD1-CE2 3.57Å; L157-F161 HydrophobicContact CG-CD2 4.09Å; L157-F161 HydrophobicContact CG-CE2 4.14Å; L157-F161 VanDerWaalsContact O-CD2 3.27Å; L157-F161 WeakPolarHBondContact O-CD2 3.44Å; L157-F161 PolarHBondContact O-N 2.93Å; L157-F161 VanDerWaalsContact O-N 3.16Å
158	N	91.8	Very high	92.6	Very high	30 Å²	30	40.1 Å²	40.1	16%	0.16	21%	0.207	C	C	.	.	H	α-helix	trans	-64.2	-43.8	178.1	-72.2	-30.2	0	0	0	112	T154 Q155 Q160 F161 Q162 F165	T154-N158 PolarHBondContact O-N 3.39Å; T154-N158 PolarHBondContact O-ND2 3.42Å; Q155-N158 PolarHBondContact O-N 3.09Å; N158-Q160 PolarHBondContact O-N 3Å; N158-F161 PolarHBondContact O-N 3.39Å; N158-Q162 CarbonylContact O-C 3.54Å; N158-Q162 WeakPolarHBondContact O-CA 3.08Å; N158-Q162 WeakPolarHBondContact O-CB 3.38Å; N158-Q162 PolarHBondContact O-N 3.39Å; N158-F165 HydrophobicContact CB-CD1 3.44Å; N158-F165 VanDerWaalsContact CB-CD1 3.44Å; N158-F165 HydrophobicContact CB-CE1 3.69Å; N158-F165 HydrophobicContact CB-CG 4.08Å
159	Q	92.8	Very high	92.9	Very high	21 Å²	21	39.6 Å²	39.6	10%	0.098	20%	0.203	C	C	.	.	H	α-helix	trans	-61.7	-32	173.6	-80.7	-178.5	-141.1	0	0	112.3	Q155 M156 E163 F165 T188	Q155-Q159 WeakPolarHBondContact O-CB 3.22Å; Q155-Q159 PolarHBondContact O-N 3.22Å; M156-Q159 PolarHBondContact O-N 3.19Å; Q159-E163 WeakPolarHBondContact CB-OE2 3.25Å; Q159-E163 WeakPolarHBondContact O-CB 3.31Å; Q159-F165 HydrophobicContact CG-CB 4.21Å; Q159-T188 PolarHBondContact NE2-O 2.92Å; Q159-T188 PolarHBondContact OE1-OG1 2.98Å
160	Q	90.2	Very high	93.1	Very high	143 Å²	143	39.1 Å²	39.1	67%	0.668	20%	0.198	S	C	*	.	H	α-helix	trans	-68.6	-40.1	177.5	-176.8	177	-3.7	0	0	112.8	M156 L157 N158	M156-Q160 WeakPolarHBondContact O-CB 3.45Å; M156-Q160 PolarHBondContact O-N 3.43Å; L157-Q160 WeakPolarHBondContact O-CB 3.44Å; L157-Q160 PolarHBondContact O-N 3.36Å; N158-Q160 PolarHBondContact O-N 3Å
161	F	87.9	Confident	93.4	Very high	146 Å²	146	35.7 Å²	35.7	64%	0.64	18%	0.18	S	C	*	.	H	α-helix	trans	-102.2	-23	-173.7	-67	-70	0	0	0	114.5	L157 N158	L157-F161 HydrophobicContact CD1-CD2 4.03Å; L157-F161 HydrophobicContact CD1-CE2 3.57Å; L157-F161 HydrophobicContact CG-CD2 4.09Å; L157-F161 HydrophobicContact CG-CE2 4.14Å; L157-F161 VanDerWaalsContact O-CD2 3.27Å; L157-F161 WeakPolarHBondContact O-CD2 3.44Å; L157-F161 PolarHBondContact O-N 2.93Å; L157-F161 VanDerWaalsContact O-N 3.16Å; N158-F161 PolarHBondContact O-N 3.39Å
162	Q	87.2	Confident	93.5	Very high	83 Å²	83	35.7 Å²	35.7	39%	0.388	18%	0.18	S	C	.	.	S	Bend	trans	-137.8	58.9	-170.7	-60.8	-174.7	45.8	0	0	111.8	N158 P164 F165	N158-Q162 CarbonylContact O-C 3.54Å; N158-Q162 WeakPolarHBondContact O-CA 3.08Å; N158-Q162 WeakPolarHBondContact O-CB 3.38Å; N158-Q162 PolarHBondContact O-N 3.39Å; Q162-P164 CarbonylContact O-C 3.56Å; Q162-F165 HydrophobicContact CB-CD2 4.13Å; Q162-F165 HydrophobicContact CB-CE2 4.38Å; Q162-F165 WeakPolarHBondContact O-CB 3.16Å; Q162-F165 WeakPolarHBondContact O-CD2 3.32Å
163	E	90.9	Very high	93.5	Very high	62 Å²	62	36.5 Å²	36.5	29%	0.29	19%	0.185	S	C	.	.	S	Bend	trans	-86.4	135	177.5	-161.3	70.3	-100.7	0	0	111.6	W45 Q159 F165 R187	W45-E163 HydrophobicContact CZ2-CG 4.44Å; Q159-E163 WeakPolarHBondContact CB-OE2 3.25Å; Q159-E163 WeakPolarHBondContact O-CB 3.31Å; E163-F165 PolarHBondContact OE1-N 3.04Å; E163-F165 VanDerWaalsContact OE1-N 3.14Å; E163-R187 VanDerWaalsContact CD-NH2 3.33Å; E163-R187 IonicContact OE1-CZ 3.56Å; E163-R187 IonicContact OE1-NH1 3.71Å; E163-R187 PolarHBondContact OE1-NH1 2.91Å; E163-R187 IonicContact OE1-NH2 3.81Å; E163-R187 PolarHBondContact OE1-NH2 3.44Å; E163-R187 IonicContact OE2-NH2 3.69Å; E163-R187 PolarHBondContact OE2-NH2 2.82Å
164	P	94.4	Very high	93.5	Very high	8 Å²	8	33.4 Å²	33.4	5%	0.052	16%	0.162	C	C	.	.	S	Bend	cis	-83.9	134.9	5.2	31.3	-31.7	0	0	0	115.5	L40 W45 F52 V85 M90 I134 Q162	L40-P164 HydrophobicContact CD2-CG 4.31Å; W45-P164 HydrophobicContact CH2-CB 4.42Å; W45-P164 HydrophobicContact CH2-CG 3.98Å; W45-P164 HydrophobicContact CZ2-CB 4.44Å; W45-P164 HydrophobicContact CZ2-CG 4.3Å; W45-P164 HydrophobicContact CZ3-CG 4.29Å; F52-P164 HydrophobicContact CE2-CB 3.67Å; F52-P164 HydrophobicContact CZ-CB 3.65Å; F52-P164 HydrophobicContact CZ-CG 4.26Å; V85-P164 HydrophobicContact CG1-CB 4.16Å; V85-P164 HydrophobicContact CG1-CG 3.53Å; V85-P164 HydrophobicContact CG2-CG 4.45Å; M90-P164 HydrophobicContact CE-CB 4.17Å; I134-P164 HydrophobicContact CD1-CG 4.03Å; I134-P164 WeakPolarHBondContact CD1-O 3.5Å; Q162-P164 CarbonylContact O-C 3.56Å
165	F	95.6	Very high	93.6	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.009	16%	0.157	C	C	.	.			trans	-132.1	141.4	179.8	-137.1	-112.3	0	0	0	114.9	L80 A133 I134 G135 W136 Q155 N158 Q159 Q162 E163 R187	L80-F165 HydrophobicContact CD2-CZ 4.24Å; A133-F165 HydrophobicContact CB-CE2 4.39Å; I134-F165 CarbonylContact O-C 3.56Å; I134-F165 WeakPolarHBondContact O-CA 3.35Å; G135-F165 VanDerWaalsContact C-CZ 3.46Å; G135-F165 VanDerWaalsContact CA-CZ 3.49Å; W136-F165 HydrophobicContact CB-CE1 4.1Å; W136-F165 AromaticContact CD1-CD1 3.87Å; W136-F165 AromaticContact CD1-CE1 3.5Å; W136-F165 HydrophobicContact CG-CE1 4.12Å; Q155-F165 PolarHBondContact NE2-O 3.39Å; N158-F165 HydrophobicContact CB-CD1 3.44Å; N158-F165 VanDerWaalsContact CB-CD1 3.44Å; N158-F165 HydrophobicContact CB-CE1 3.69Å; N158-F165 HydrophobicContact CB-CG 4.08Å; Q159-F165 HydrophobicContact CG-CB 4.21Å; Q162-F165 HydrophobicContact CB-CD2 4.13Å; Q162-F165 HydrophobicContact CB-CE2 4.38Å; Q162-F165 WeakPolarHBondContact O-CB 3.16Å; Q162-F165 WeakPolarHBondContact O-CD2 3.32Å; E163-F165 PolarHBondContact OE1-N 3.04Å; E163-F165 VanDerWaalsContact OE1-N 3.14Å; F165-R187 PolarHBondContact O-NH1 2.92Å
166	V	97.5	Very high	93.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	143.4	176	66.8	0	0	0	0	112.1	M81 M90 I92 I134 G135 W136 A185 F186 R187 L224	M81-V166 HydrophobicContact CE-CG1 3.82Å; M90-V166 HydrophobicContact CE-CB 3.77Å; M90-V166 HydrophobicContact CE-CG1 3.95Å; M90-V166 HydrophobicContact SD-CB 3.79Å; M90-V166 HydrophobicContact SD-CG1 4.39Å; M90-V166 HydrophobicContact SD-CG2 4.49Å; I92-V166 HydrophobicContact CD1-CG1 4.35Å; I134-V166 PolarHBondContact O-N 3.14Å; G135-V166 CarbonylContact C-O 3.55Å; G135-V166 WeakPolarHBondContact CA-O 3.26Å; W136-V166 PolarHBondContact N-O 3.31Å; V166-A185 HydrophobicContact CG2-CB 4.18Å; V166-F186 WeakPolarHBondContact CG2-O 3.07Å; V166-R187 HydrophobicContact CG2-CG 4.31Å; V166-L224 HydrophobicContact CG2-CD2 4.32Å
167	A	97.5	Very high	92.9	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	129.6	169.2	0	0	0	0	0	109.7	W136 L147 Q155 A185 F186	W136-A167 HydrophobicContact CZ2-CB 4.12Å; W136-A167 CarbonylContact O-C 3.56Å; W136-A167 WeakPolarHBondContact O-CA 3.39Å; L147-A167 HydrophobicContact CD1-CB 4.42Å; L147-A167 HydrophobicContact CD2-CB 4.01Å; Q155-A167 HydrophobicContact CB-CB 4.33Å; Q155-A167 HydrophobicContact CG-CB 4.05Å; A167-A185 CarbonylContact O-C 3.49Å; A167-A185 WeakPolarHBondContact O-CA 3.32Å; A167-F186 PolarHBondContact N-O 3.21Å; A167-F186 PolarHBondContact O-N 3.44Å
168	V	98.2	Very high	92.5	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	128.3	173.5	165.6	0	0	0	0	109.9	M65 M81 I92 W136 Y137 H138 I170 L183 G184 A185	M65-V168 HydrophobicContact SD-CG1 4.35Å; M81-V168 HydrophobicContact CE-CB 3.89Å; M81-V168 HydrophobicContact CE-CG2 3.62Å; M81-V168 HydrophobicContact SD-CB 3.85Å; M81-V168 HydrophobicContact SD-CG1 4.45Å; M81-V168 HydrophobicContact SD-CG2 3.73Å; I92-V168 HydrophobicContact CD1-CG2 3.97Å; W136-V168 PolarHBondContact O-N 3.46Å; Y137-V168 CarbonylContact C-O 3.59Å; Y137-V168 WeakPolarHBondContact CA-O 3.42Å; Y137-V168 WeakPolarHBondContact CB-O 3.48Å; H138-V168 PolarHBondContact N-O 3.41Å; V168-I170 HydrophobicContact CG1-CD1 4.34Å; V168-I170 HydrophobicContact CG1-CG1 4.03Å; V168-L183 HydrophobicContact CG1-CD1 3.82Å; V168-L183 HydrophobicContact CG1-CD2 3.81Å; V168-L183 HydrophobicContact CG1-CG 3.69Å; V168-G184 CarbonylContact C-O 3.48Å; V168-G184 WeakPolarHBondContact CA-O 3.44Å; V168-A185 HydrophobicContact CG2-CB 4.04Å
169	V	97.4	Very high	92.1	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	135.4	176.4	-170.8	0	0	0	0	108.1	H138 H140 C145 L147 L183 G184 F186	H138-V169 WeakPolarHBondContact O-CA 3.08Å; H140-V169 HydrophobicContact CB-CG1 3.94Å; C145-V169 HydrophobicContact CB-CB 4.03Å; C145-V169 HydrophobicContact CB-CG1 4.2Å; C145-V169 PolarHBondContact SG-O 3.45Å; L147-V169 HydrophobicContact CD2-CG2 3.64Å; V169-L183 CarbonylContact O-C 3.51Å; V169-L183 VanDerWaalsContact O-CA 3.27Å; V169-L183 WeakPolarHBondContact O-CA 3.44Å; V169-G184 PolarHBondContact N-O 3.28Å; V169-G184 PolarHBondContact O-N 3.02Å; V169-F186 HydrophobicContact CB-CE2 4Å; V169-F186 HydrophobicContact CG2-CD2 3.75Å; V169-F186 HydrophobicContact CG2-CE2 3.62Å
170	I	97.1	Very high	92	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	129.2	178.8	-59.4	173.4	0	0	0	109.2	M65 V66 A69 Y137 H138 S139 H140 V168 P172 L183	M65-I170 HydrophobicContact CB-CD1 3.25Å; M65-I170 HydrophobicContact CE-CD1 4.43Å; M65-I170 HydrophobicContact CG-CD1 4.21Å; M65-I170 HydrophobicContact SD-CD1 4.12Å; V66-I170 HydrophobicContact CG2-CG2 4.3Å; A69-I170 HydrophobicContact CB-CB 4.37Å; A69-I170 HydrophobicContact CB-CG2 3.98Å; Y137-I170 HydrophobicContact CD2-CD1 4.26Å; H138-I170 PolarHBondContact O-N 2.98Å; S139-I170 CarbonylContact C-O 3.56Å; S139-I170 WeakPolarHBondContact CA-O 3.41Å; H140-I170 PolarHBondContact N-O 3.05Å; V168-I170 HydrophobicContact CG1-CD1 4.34Å; V168-I170 HydrophobicContact CG1-CG1 4.03Å; I170-P172 WeakPolarHBondContact O-CD 3.23Å; I170-L183 HydrophobicContact CD1-CD1 4.03Å; I170-L183 HydrophobicContact CG1-CB 4.39Å; I170-L183 HydrophobicContact CG1-CD1 3.82Å; I170-L183 HydrophobicContact CG1-CG 3.92Å
171	D	95.8	Very high	92.2	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	98.7	171.5	-172	-31.5	0	0	0	109.7	H140 G142 Y143 G144 T173 R174 T175 N182	H140-D171 WeakPolarHBondContact O-CA 3Å; H140-D171 WeakPolarHBondContact O-CB 3.47Å; G142-D171 VanDerWaalsContact CA-OD2 3.25Å; G142-D171 WeakPolarHBondContact CA-OD2 3.35Å; G142-D171 VanDerWaalsContact N-CG 3.27Å; G142-D171 PolarHBondContact N-OD1 3.36Å; G142-D171 PolarHBondContact N-OD2 3.31Å; Y143-D171 PolarHBondContact N-OD2 3.47Å; Y143-D171 VanDerWaalsContact N-OD2 3.11Å; G144-D171 WeakPolarHBondContact CA-OD2 3.49Å; G144-D171 PolarHBondContact N-OD2 3.16Å; D171-T173 VanDerWaalsContact C-N 3.29Å; D171-T173 PolarHBondContact O-N 3.46Å; D171-T173 WeakPolarHBondContact OD1-CB 3.45Å; D171-T173 PolarHBondContact OD1-N 2.96Å; D171-R174 HydrophobicContact CB-CB 4.1Å; D171-R174 HydrophobicContact CB-CG 4.44Å; D171-R174 PolarHBondContact OD1-N 3.09Å; D171-R174 WeakPolarHBondContact OD2-CD 3.34Å; D171-R174 WeakPolarHBondContact OD2-CG 3.16Å; D171-R174 IonicContact OD2-NE 2.74Å; D171-R174 PolarHBondContact OD2-NE 3.43Å; D171-T175 VanDerWaalsContact O-CB 3.24Å; D171-T175 WeakPolarHBondContact O-CB 3.36Å; D171-T175 PolarHBondContact O-N 2.86Å; D171-T175 PolarHBondContact O-OG1 2.86Å; D171-N182 HydrophobicContact CB-CB 4.16Å; D171-N182 PolarHBondContact N-O 3.43Å
172	P	95.2	Very high	92.6	Very high	2 Å²	2	32 Å²	32	1%	0.013	19%	0.189	C	C	.	.	H	α-helix	trans	-66.9	-31.8	-179	27.5	-35.2	0	0	0	112.2	A69 R70 P141 I170 T175 I176	A69-P172 HydrophobicContact CB-CB 4.02Å; A69-P172 HydrophobicContact CB-CG 4.11Å; R70-P172 HydrophobicContact CB-CB 4.48Å; P141-P172 HydrophobicContact CB-CG 4.33Å; P141-P172 HydrophobicContact CG-CG 4.38Å; I170-P172 WeakPolarHBondContact O-CD 3.23Å; P172-T175 PolarHBondContact O-N 3.13Å; P172-I176 WeakPolarHBondContact O-CG1 3.35Å; P172-I176 PolarHBondContact O-N 2.97Å; P172-I176 VanDerWaalsContact O-N 3.16Å
173	T	93.2	Very high	93	Very high	18 Å²	18	29 Å²	29	11%	0.11	18%	0.175	C	C	.	.	H	α-helix	trans	-70.2	-49.4	-178.4	-54.6	0	0	0	0	110.6	D171 T175 I176 S177 Y261	D171-T173 VanDerWaalsContact C-N 3.29Å; D171-T173 PolarHBondContact O-N 3.46Å; D171-T173 WeakPolarHBondContact OD1-CB 3.45Å; D171-T173 PolarHBondContact OD1-N 2.96Å; T173-T175 VanDerWaalsContact C-N 3.29Å; T173-T175 PolarHBondContact O-N 2.95Å; T173-I176 PolarHBondContact O-N 2.94Å; T173-S177 PolarHBondContact O-N 2.96Å; T173-Y261 HydrophobicContact CG2-CD1 4.11Å; T173-Y261 HydrophobicContact CG2-CD2 3.38Å; T173-Y261 HydrophobicContact CG2-CE2 4.05Å; T173-Y261 HydrophobicContact CG2-CG 3.41Å; T173-Y261 VanDerWaalsContact CG2-CG 3.41Å
174	R	92.1	Very high	93.3	Very high	13 Å²	13	26.6 Å²	26.6	5%	0.049	17%	0.167	C	C	.	.	H	α-helix	trans	-67.3	-31.1	174.2	-69.3	-179.2	-164.3	-153.6	-5.5	112.5	G142 Y143 D171 I176 S177 A178 N182 T205	G142-R174 PolarHBondContact O-NE 2.87Å; G142-R174 PolarHBondContact O-NH2 3.44Å; Y143-R174 VanDerWaalsContact C-NH2 3.25Å; Y143-R174 PolarHBondContact O-NH2 2.68Å; D171-R174 HydrophobicContact CB-CB 4.1Å; D171-R174 HydrophobicContact CB-CG 4.44Å; D171-R174 PolarHBondContact OD1-N 3.09Å; D171-R174 WeakPolarHBondContact OD2-CD 3.34Å; D171-R174 WeakPolarHBondContact OD2-CG 3.16Å; D171-R174 IonicContact OD2-NE 2.74Å; D171-R174 PolarHBondContact OD2-NE 3.43Å; R174-I176 VanDerWaalsContact C-N 3.3Å; R174-I176 PolarHBondContact O-N 2.84Å; R174-S177 PolarHBondContact O-N 2.86Å; R174-A178 VanDerWaalsContact O-CB 3.3Å; R174-A178 WeakPolarHBondContact O-CB 3.46Å; R174-A178 PolarHBondContact O-N 3.45Å; R174-N182 HydrophobicContact CB-CB 4.02Å; R174-T205 PolarHBondContact NH1-O 3.02Å; R174-T205 PolarHBondContact NH2-O 2.77Å
175	T	92.7	Very high	93.5	Very high	14 Å²	14	26.2 Å²	26.2	9%	0.086	17%	0.165	C	C	.	.	H	α-helix	trans	-59.3	-43.6	174.9	-68	0	0	0	0	111.5	V66 D171 P172 T173 G179 K180 V181 N182	V66-T175 HydrophobicContact CG1-CG2 4.24Å; D171-T175 VanDerWaalsContact O-CB 3.24Å; D171-T175 WeakPolarHBondContact O-CB 3.36Å; D171-T175 PolarHBondContact O-N 2.86Å; D171-T175 PolarHBondContact O-OG1 2.86Å; P172-T175 PolarHBondContact O-N 3.13Å; T173-T175 VanDerWaalsContact C-N 3.29Å; T173-T175 PolarHBondContact O-N 2.95Å; T175-G179 WeakPolarHBondContact O-CA 3.37Å; T175-G179 PolarHBondContact O-N 3.15Å; T175-K180 WeakPolarHBondContact CA-O 3.3Å; T175-K180 PolarHBondContact O-N 2.97Å; T175-V181 HydrophobicContact CG2-CB 4.39Å; T175-V181 HydrophobicContact CG2-CG2 4.15Å; T175-N182 PolarHBondContact OG1-N 3.01Å
176	I	88.1	Confident	93.6	Very high	56 Å²	56	26.8 Å²	26.8	29%	0.287	17%	0.167	S	C	.	.	H	α-helix	trans	-73.3	-39.4	178.5	-65.2	169	0	0	0	111	R70 P172 T173 R174 T257 N258	R70-I176 VanDerWaalsContact CD-CD1 3.5Å; R70-I176 HydrophobicContact CG-CD1 4.37Å; P172-I176 WeakPolarHBondContact O-CG1 3.35Å; P172-I176 PolarHBondContact O-N 2.97Å; P172-I176 VanDerWaalsContact O-N 3.16Å; T173-I176 PolarHBondContact O-N 2.94Å; R174-I176 VanDerWaalsContact C-N 3.3Å; R174-I176 PolarHBondContact O-N 2.84Å; I176-T257 HydrophobicContact CG2-CG2 3.76Å; I176-N258 VanDerWaalsContact CG2-OD1 3.29Å; I176-N258 WeakPolarHBondContact CG2-OD1 3.31Å
177	S	84	Confident	93.6	Very high	22 Å²	22	27.2 Å²	27.2	15%	0.154	17%	0.169	C	C	.	.	H	α-helix	trans	-64	-46	177.7	-158.8	0	0	0	0	113.4	T173 R174 N258 E313	T173-S177 PolarHBondContact O-N 2.96Å; R174-S177 PolarHBondContact O-N 2.86Å; S177-N258 WeakPolarHBondContact CA-ND2 3.31Å; S177-E313 PolarHBondContact OG-OE2 2.92Å
178	A	83.7	Confident	93.4	Very high	68 Å²	68	27.3 Å²	27.3	56%	0.562	17%	0.17	S	C	*	.	H	α-helix	trans	-82.9	-16	-178	0	0	0	0	0	113.7	R174 K180	R174-A178 VanDerWaalsContact O-CB 3.3Å; R174-A178 WeakPolarHBondContact O-CB 3.46Å; R174-A178 PolarHBondContact O-N 3.45Å; A178-K180 PolarHBondContact O-N 2.87Å
179	G	82.9	Confident	93.2	Very high	74 Å²	74	28.2 Å²	28.2	76%	0.763	17%	0.173	S	C	*	.	S	Bend	trans	65.6	12.8	-170.1	0	0	0	0	0	113.9	T175	T175-G179 WeakPolarHBondContact O-CA 3.37Å; T175-G179 PolarHBondContact O-N 3.15Å
180	K	90.7	Very high	92.8	Very high	160 Å²	160	31 Å²	31	70%	0.696	19%	0.191	S	C	*	.	S	Bend	trans	-132.1	133.7	179.3	178.3	-176.9	176.4	-174.9	0	107.9	T175 A178 N182	T175-K180 WeakPolarHBondContact CA-O 3.3Å; T175-K180 PolarHBondContact O-N 2.97Å; A178-K180 PolarHBondContact O-N 2.87Å; K180-N182 PolarHBondContact O-N 3.02Å; K180-N182 VanDerWaalsContact O-N 3.09Å
181	V	94.9	Very high	92.3	Very high	39 Å²	39	40.4 Å²	40.4	24%	0.236	23%	0.232	C	C	.	.			trans	-57.6	118.8	178.1	-176.8	0	0	0	0	110.1	L62 V66 T175 L183	L62-V181 HydrophobicContact CD1-CB 4.37Å; L62-V181 HydrophobicContact CD1-CG1 3.79Å; L62-V181 HydrophobicContact CD1-CG2 4.38Å; L62-V181 HydrophobicContact CD2-CG2 4.35Å; L62-V181 HydrophobicContact CG-CG2 4.45Å; V66-V181 HydrophobicContact CG2-CB 4.47Å; V66-V181 HydrophobicContact CG2-CG1 3.6Å; V66-V181 HydrophobicContact CG2-CG2 3.99Å; T175-V181 HydrophobicContact CG2-CB 4.39Å; T175-V181 HydrophobicContact CG2-CG2 4.15Å; V181-L183 HydrophobicContact CG1-CB 3.93Å
182	N	95.1	Very high	91.7	Very high	50 Å²	50	44.1 Å²	44.1	27%	0.267	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	102.2	173.3	-165.2	-38.3	0	0	0	107.6	C145 D171 R174 T175 K180	C145-N182 PolarHBondContact SG-O 3.03Å; C145-N182 VanDerWaalsContact SG-O 3.41Å; C145-N182 PolarHBondContact SG-OD1 3.45Å; D171-N182 HydrophobicContact CB-CB 4.16Å; D171-N182 PolarHBondContact N-O 3.43Å; R174-N182 HydrophobicContact CB-CB 4.02Å; T175-N182 PolarHBondContact OG1-N 3.01Å; K180-N182 PolarHBondContact O-N 3.02Å; K180-N182 VanDerWaalsContact O-N 3.09Å
183	L	97.1	Very high	91.2	Very high	21 Å²	21	48.2 Å²	48.2	11%	0.11	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	133.6	-174.7	-177	159.7	0	0	0	109	I57 L62 M65 V168 V169 I170 V181 V226	I57-L183 HydrophobicContact CD1-CD1 3.78Å; I57-L183 HydrophobicContact CD1-CD2 3.55Å; I57-L183 HydrophobicContact CD1-CG 4.38Å; L62-L183 HydrophobicContact CD1-CD1 3.74Å; M65-L183 HydrophobicContact CE-CD1 4.2Å; V168-L183 HydrophobicContact CG1-CD1 3.82Å; V168-L183 HydrophobicContact CG1-CD2 3.81Å; V168-L183 HydrophobicContact CG1-CG 3.69Å; V169-L183 CarbonylContact O-C 3.51Å; V169-L183 VanDerWaalsContact O-CA 3.27Å; V169-L183 WeakPolarHBondContact O-CA 3.44Å; I170-L183 HydrophobicContact CD1-CD1 4.03Å; I170-L183 HydrophobicContact CG1-CB 4.39Å; I170-L183 HydrophobicContact CG1-CD1 3.82Å; I170-L183 HydrophobicContact CG1-CG 3.92Å; V181-L183 HydrophobicContact CG1-CB 3.93Å; L183-V226 HydrophobicContact CD2-CG1 4.03Å; L183-V226 HydrophobicContact CD2-CG2 3.96Å
184	G	96.9	Very high	90.7	Very high	11 Å²	11	56.3 Å²	56.3	11%	0.113	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	143	170.3	0	0	0	0	0	110.9	V168 V169 F186	V168-G184 CarbonylContact C-O 3.48Å; V168-G184 WeakPolarHBondContact CA-O 3.44Å; V169-G184 PolarHBondContact N-O 3.28Å; V169-G184 PolarHBondContact O-N 3.02Å; G184-F186 VanDerWaalsContact C-CE2 3.43Å
185	A	98.1	Very high	90.2	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	133.6	171.9	0	0	0	0	0	108.8	C55 V166 A167 V168 A223 L224 V226	C55-A185 HydrophobicContact CB-CB 3.73Å; V166-A185 HydrophobicContact CG2-CB 4.18Å; A167-A185 CarbonylContact O-C 3.49Å; A167-A185 WeakPolarHBondContact O-CA 3.32Å; V168-A185 HydrophobicContact CG2-CB 4.04Å; A185-A223 CarbonylContact O-C 3.51Å; A185-A223 WeakPolarHBondContact O-CA 3.47Å; A185-L224 HydrophobicContact CB-CB 4.19Å; A185-L224 PolarHBondContact O-N 3.3Å; A185-V226 HydrophobicContact CB-CG2 3.7Å
186	F	97.6	Very high	89.6	Confident	15 Å²	15	60.8 Å²	60.8	7%	0.066	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	150.1	-169.3	-54	-79.2	0	0	0	112	C145 L147 V166 A167 V169 G184 Y221 Y222 A223	C145-F186 HydrophobicContact CB-CE2 4.25Å; C145-F186 HydrophobicContact CB-CZ 4.23Å; C145-F186 VanDerWaalsContact O-CZ 3.28Å; C145-F186 WeakPolarHBondContact O-CZ 3.45Å; L147-F186 HydrophobicContact CD1-CB 3.7Å; L147-F186 HydrophobicContact CD1-CG 4.37Å; L147-F186 HydrophobicContact CD2-CB 4.36Å; L147-F186 HydrophobicContact CD2-CD2 4.05Å; L147-F186 HydrophobicContact CD2-CG 4.46Å; L147-F186 HydrophobicContact CG-CB 3.98Å; L147-F186 HydrophobicContact CG-CD2 4.14Å; L147-F186 HydrophobicContact CG-CG 4.11Å; V166-F186 WeakPolarHBondContact CG2-O 3.07Å; A167-F186 PolarHBondContact N-O 3.21Å; A167-F186 PolarHBondContact O-N 3.44Å; V169-F186 HydrophobicContact CB-CE2 4Å; V169-F186 HydrophobicContact CG2-CD2 3.75Å; V169-F186 HydrophobicContact CG2-CE2 3.62Å; G184-F186 VanDerWaalsContact C-CE2 3.43Å; F186-Y221 HydrophobicContact CB-CD2 4.29Å; F186-Y221 AromaticContact CD1-CD2 3.7Å; F186-Y221 HydrophobicContact CD1-CD2 3.7Å; F186-Y221 AromaticContact CD1-CE2 3.83Å; F186-Y221 HydrophobicContact CD1-CE2 3.83Å; F186-Y221 HydrophobicContact CE1-CD2 4.41Å; F186-Y221 HydrophobicContact CE1-CE2 4.11Å; F186-Y221 HydrophobicContact CG-CD2 4.22Å; F186-Y221 HydrophobicContact CG-CE2 4.48Å; F186-Y222 VanDerWaalsContact CA-O 3.31Å; F186-Y222 WeakPolarHBondContact CA-O 3.13Å; F186-A223 HydrophobicContact CD1-CB 3.96Å; F186-A223 HydrophobicContact CE1-CB 3.85Å
187	R	96.5	Very high	88.7	Confident	8 Å²	8	65.3 Å²	65.3	3%	0.03	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	145.2	169.7	-73.4	-177	57.1	94.1	15.3	110.2	E163 F165 V166 Y221 Y222 L224	E163-R187 VanDerWaalsContact CD-NH2 3.33Å; E163-R187 IonicContact OE1-CZ 3.56Å; E163-R187 IonicContact OE1-NH1 3.71Å; E163-R187 PolarHBondContact OE1-NH1 2.91Å; E163-R187 IonicContact OE1-NH2 3.81Å; E163-R187 PolarHBondContact OE1-NH2 3.44Å; E163-R187 IonicContact OE2-NH2 3.69Å; E163-R187 PolarHBondContact OE2-NH2 2.82Å; F165-R187 PolarHBondContact O-NH1 2.92Å; V166-R187 HydrophobicContact CG2-CG 4.31Å; R187-Y221 CarbonylContact O-C 3.47Å; R187-Y221 WeakPolarHBondContact O-CA 3.44Å; R187-Y221 WeakPolarHBondContact O-CB 3.3Å; R187-Y222 HydrophobicContact CB-CE1 3.89Å; R187-Y222 HydrophobicContact CB-CE2 4.06Å; R187-Y222 PolarHBondContact N-O 2.83Å; R187-Y222 PolarHBondContact NE-OH 2.97Å; R187-Y222 WeakPolarHBondContact O-CD1 3.44Å; R187-Y222 PolarHBondContact O-N 2.76Å; R187-L224 HydrophobicContact CB-CD1 4.05Å; R187-L224 HydrophobicContact CG-CD1 3.77Å
188	T	94.9	Very high	87.6	Confident	3 Å²	3	71 Å²	71	2%	0.018	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	143.9	-179.2	54	0	0	0	0	111	L147 V152 Q155 M156 Q159 Q220	L147-T188 HydrophobicContact CD1-CG2 4.31Å; V152-T188 HydrophobicContact CB-CG2 4.38Å; V152-T188 HydrophobicContact CG1-CG2 3.94Å; V152-T188 HydrophobicContact CG2-CG2 4.47Å; Q155-T188 HydrophobicContact CB-CG2 3.87Å; Q155-T188 HydrophobicContact CG-CG2 3.68Å; M156-T188 HydrophobicContact CG-CG2 3.98Å; M156-T188 WeakPolarHBondContact CG-OG1 3.28Å; Q159-T188 PolarHBondContact NE2-O 2.92Å; Q159-T188 PolarHBondContact OE1-OG1 2.98Å; T188-Q220 WeakPolarHBondContact CA-O 3.46Å
189	Y	93	Very high	86.2	Confident	19 Å²	19	70.7 Å²	70.7	8%	0.075	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-71.4	152.6	168.9	-65.4	-67.4	0	0	0	111	H49 Y193 P195 Q220 Y222	H49-Y189 HydrophobicContact CB-CD1 4.41Å; Y189-Y193 AromaticContact CD1-CD1 3.43Å; Y189-Y193 HydrophobicContact CD1-CD1 3.43Å; Y189-Y193 VanDerWaalsContact CD1-CD1 3.43Å; Y189-Y193 AromaticContact CD1-CE1 3.48Å; Y189-Y193 HydrophobicContact CD1-CE1 3.48Å; Y189-Y193 VanDerWaalsContact CD1-CE1 3.48Å; Y189-Y193 HydrophobicContact CD2-CD1 4.48Å; Y189-Y193 HydrophobicContact CE1-CD1 4.08Å; Y189-Y193 AromaticContact CE1-CE1 3.66Å; Y189-Y193 HydrophobicContact CE1-CE1 3.66Å; Y189-Y193 AromaticContact CG-CD1 3.66Å; Y189-Y193 HydrophobicContact CG-CD1 3.66Å; Y189-Y193 HydrophobicContact CG-CE1 4.12Å; Y189-P195 HydrophobicContact CD2-CB 4.24Å; Y189-P195 HydrophobicContact CD2-CG 4.4Å; Y189-P195 HydrophobicContact CE1-CB 4.5Å; Y189-P195 HydrophobicContact CE2-CB 3.68Å; Y189-P195 HydrophobicContact CE2-CG 4.12Å; Y189-Q220 PolarHBondContact N-O 3.22Å; Y189-Y222 AromaticContact CD1-CD1 4Å; Y189-Y222 HydrophobicContact CD1-CD1 4Å; Y189-Y222 HydrophobicContact CD1-CE1 4.2Å; Y189-Y222 AromaticContact CE1-CD1 3.49Å; Y189-Y222 HydrophobicContact CE1-CD1 3.49Å; Y189-Y222 VanDerWaalsContact CE1-CD1 3.49Å; Y189-Y222 AromaticContact CE1-CE1 3.94Å; Y189-Y222 HydrophobicContact CE1-CE1 3.94Å; Y189-Y222 HydrophobicContact CE1-CG 4.42Å; Y189-Y222 HydrophobicContact CE2-CD1 4.05Å; Y189-Y222 HydrophobicContact CG-CD1 4.49Å; Y189-Y222 AromaticContact CZ-CD1 3.53Å
190	P	89.4	Confident	84.9	Confident	58 Å²	58	73.7 Å²	73.7	38%	0.377	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-61	151.6	172.6	-23.5	35.1	0	0	0	112.3	G192 Y193	P190-G192 PolarHBondContact O-N 3.17Å; P190-Y193 VanDerWaalsContact O-CB 3.3Å; P190-Y193 WeakPolarHBondContact O-CB 3.43Å; P190-Y193 PolarHBondContact O-N 3.27Å
191	K	85.8	Confident	83.5	Confident	197 Å²	197	70.1 Å²	70.1	86%	0.857	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	124.2	-179.9	-167.1	175	-177.5	175.7	0	110.9	M156	M156-K191 HydrophobicContact CE-CB 3.86Å; M156-K191 HydrophobicContact CE-CG 4.49Å
192	G	83.8	Confident	82.2	Confident	78 Å²	78	76.4 Å²	76.4	80%	0.804	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.6	-5.7	178.9	0	0	0	0	0	115.1	P190 K194	P190-G192 PolarHBondContact O-N 3.17Å; G192-K194 PolarHBondContact O-N 3.37Å
193	Y	85.3	Confident	81.3	Confident	88 Å²	88	77 Å²	77	35%	0.345	43%	0.43	S	S	.	.			trans	-68.3	131.2	170.6	-177	-102.2	0	0	0	110.2	H49 Y189 P190 P195	H49-Y193 AromaticContact CE1-CD2 3.73Å; H49-Y193 AromaticContact ND1-CD2 3.19Å; H49-Y193 WeakPolarHBondContact ND1-CD2 3.16Å; H49-Y193 AromaticContact ND1-CE2 3.29Å; H49-Y193 VanDerWaalsContact ND1-CE2 3.29Å; H49-Y193 WeakPolarHBondContact ND1-CE2 3.25Å; H49-Y193 AromaticContact ND1-CG 3.79Å; H49-Y193 AromaticContact ND1-CZ 3.95Å; Y189-Y193 AromaticContact CD1-CD1 3.43Å; Y189-Y193 HydrophobicContact CD1-CD1 3.43Å; Y189-Y193 VanDerWaalsContact CD1-CD1 3.43Å; Y189-Y193 AromaticContact CD1-CE1 3.48Å; Y189-Y193 HydrophobicContact CD1-CE1 3.48Å; Y189-Y193 VanDerWaalsContact CD1-CE1 3.48Å; Y189-Y193 HydrophobicContact CD2-CD1 4.48Å; Y189-Y193 HydrophobicContact CE1-CD1 4.08Å; Y189-Y193 AromaticContact CE1-CE1 3.66Å; Y189-Y193 HydrophobicContact CE1-CE1 3.66Å; Y189-Y193 AromaticContact CG-CD1 3.66Å; Y189-Y193 HydrophobicContact CG-CD1 3.66Å; Y189-Y193 HydrophobicContact CG-CE1 4.12Å; P190-Y193 VanDerWaalsContact O-CB 3.3Å; P190-Y193 WeakPolarHBondContact O-CB 3.43Å; P190-Y193 PolarHBondContact O-N 3.27Å; Y193-P195 HydrophobicContact CE1-CB 4.24Å
194	K	82.2	Confident	80.4	Confident	188 Å²	188	79 Å²	79	82%	0.817	44%	0.439	S	S	*	.			trans	-98.1	110.3	171.2	-70.5	-175.4	179.3	-178.4	0	107.6	G192	G192-K194 PolarHBondContact O-N 3.37Å
195	P	81.9	Confident	79.7	Confident	38 Å²	38	79.2 Å²	79.2	25%	0.247	44%	0.438	C	S	.	.			trans	-61.8	154.5	174.5	28	-34.6	0	0	0	110.3	Y189 Y193	Y189-P195 HydrophobicContact CD2-CB 4.24Å; Y189-P195 HydrophobicContact CD2-CG 4.4Å; Y189-P195 HydrophobicContact CE1-CB 4.5Å; Y189-P195 HydrophobicContact CE2-CB 3.68Å; Y189-P195 HydrophobicContact CE2-CG 4.12Å; Y193-P195 HydrophobicContact CE1-CB 4.24Å
196	P	79.4	Confident	79.2	Confident	84 Å²	84	79.4 Å²	79.4	55%	0.545	44%	0.439	S	S	.	.			trans	-51.4	144.5	166.3	-20.3	31.7	0	0	0	109.6	E198	P196-E198 PolarHBondContact O-N 3.06Å
197	D	69.7	Low	78.7	Confident	151 Å²	151	79.8 Å²	79.8	81%	0.807	44%	0.443	S	S	*	.			trans	-67.6	83.8	168.9	-86.4	-37.4	0	0	0	108.1	K219	D197-K219 IonicContact OD1-NZ 3.9Å
198	E	61.2	Low	78.2	Confident	142 Å²	142	80.5 Å²	80.5	66%	0.664	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-66.9	149.6	162.6	-69.8	-174.1	-178.2	0	0	108.6	P196	P196-E198 PolarHBondContact O-N 3.06Å
199	G	54.8	Low	77.8	Confident	61 Å²	61	86.2 Å²	86.2	63%	0.629	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-55.1	172.7	-178.6	0	0	0	0	0	113	S201	G199-S201 PolarHBondContact O-N 2.88Å
200	P	54.3	Low	77.5	Confident	137 Å²	137	86 Å²	86	89%	0.89	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-53.9	122.8	179.4	22.4	-31.6	0	0	0	109.8
201	S	62	Low	77.3	Confident	85 Å²	85	86.5 Å²	86.5	59%	0.594	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-50.2	143.5	174.1	-171.7	0	0	0	0	109.7	G199 Y203	G199-S201 PolarHBondContact O-N 2.88Å; S201-Y203 PolarHBondContact O-N 3.45Å
202	E	68	Low	77.3	Confident	171 Å²	171	84.8 Å²	84.8	80%	0.799	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-51.2	130.8	176.3	-172.6	177.9	-178.5	0	0	109.4	Q204	E202-Q204 PolarHBondContact O-N 3.16Å
203	Y	76.1	Confident	77.4	Confident	62 Å²	62	83.4 Å²	83.4	24%	0.243	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-64.5	116.1	-178.2	177.7	-107.7	0	0	0	109.8	S201 K302 R305 D306	S201-Y203 PolarHBondContact O-N 3.45Å; Y203-K302 HydrophobicContact CD2-CD 4.01Å; Y203-K302 HydrophobicContact CD2-CG 3.77Å; Y203-K302 HydrophobicContact CE1-CB 4.18Å; Y203-K302 HydrophobicContact CE1-CG 4.24Å; Y203-K302 HydrophobicContact CE2-CB 3.83Å; Y203-K302 HydrophobicContact CE2-CD 3.6Å; Y203-K302 HydrophobicContact CE2-CG 3.42Å; Y203-K302 VanDerWaalsContact CE2-CG 3.42Å; Y203-K302 HydrophobicContact CG-CG 4.33Å; Y203-K302 WeakPolarHBondContact OH-CB 3.24Å; Y203-R305 HydrophobicContact CD1-CB 4.35Å; Y203-R305 HydrophobicContact CE1-CB 4.18Å; Y203-D306 WeakPolarHBondContact CE1-OD1 3.33Å; Y203-D306 PolarHBondContact OH-OD1 3.38Å; Y203-D306 PolarHBondContact OH-OD2 3.48Å; Y203-D306 VanDerWaalsContact OH-OD2 3.05Å
204	Q	77.9	Confident	77.5	Confident	64 Å²	64	80.9 Å²	80.9	30%	0.299	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-103	134.3	172.9	-61.6	-174.9	53.7	0	0	109.2	E202 I206	E202-Q204 PolarHBondContact O-N 3.16Å; Q204-I206 HydrophobicContact CB-CD1 4.34Å; Q204-I206 HydrophobicContact CB-CG1 4.1Å; Q204-I206 PolarHBondContact O-N 2.91Å
205	T	82.1	Confident	77.6	Confident	15 Å²	15	74.2 Å²	74.2	9%	0.092	42%	0.421	C	S	.	.			trans	-62.2	105.7	165.6	-52.4	0	0	0	0	107.5	R174 D306	R174-T205 PolarHBondContact NH1-O 3.02Å; R174-T205 PolarHBondContact NH2-O 2.77Å; T205-D306 VanDerWaalsContact CB-OD1 3.25Å; T205-D306 WeakPolarHBondContact CB-OD1 3.32Å; T205-D306 HydrophobicContact CG2-CB 4.44Å; T205-D306 VanDerWaalsContact CG2-OD1 3.25Å; T205-D306 WeakPolarHBondContact CG2-OD1 3.49Å; T205-D306 PolarHBondContact OG1-OD1 2.88Å
206	I	87.9	Confident	77.8	Confident	4 Å²	4	77 Å²	77	2%	0.021	44%	0.437	C	S	.	.			trans	-116.5	135.9	174	-62.4	174.8	0	0	0	106.7	Q204 K210 F214 K272	Q204-I206 HydrophobicContact CB-CD1 4.34Å; Q204-I206 HydrophobicContact CB-CG1 4.1Å; Q204-I206 PolarHBondContact O-N 2.91Å; I206-K210 HydrophobicContact CG2-CB 3.8Å; I206-F214 HydrophobicContact CD1-CB 3.83Å; I206-F214 HydrophobicContact CD1-CD1 3.32Å; I206-F214 HydrophobicContact CD1-CD2 3.55Å; I206-F214 HydrophobicContact CD1-CE1 3.65Å; I206-F214 HydrophobicContact CD1-CE2 3.87Å; I206-F214 HydrophobicContact CD1-CG 3.25Å; I206-F214 HydrophobicContact CD1-CZ 3.91Å; I206-K272 PolarHBondContact O-NZ 3.15Å
207	P	87.1	Confident	78.2	Confident	23 Å²	23	74.9 Å²	74.9	15%	0.149	42%	0.42	C	S	.	.			trans	-56.8	146.4	175	-27.2	37	0	0	0	112.4	Y143 N209 K210 I211 D268	Y143-P207 HydrophobicContact CD1-CG 4.01Å; P207-N209 VanDerWaalsContact C-N 3.3Å; P207-N209 WeakPolarHBondContact CB-OD1 3.02Å; P207-N209 PolarHBondContact O-N 3.45Å; P207-K210 PolarHBondContact O-N 3.23Å; P207-I211 PolarHBondContact O-N 3.3Å; P207-I211 VanDerWaalsContact O-N 3.09Å; P207-D268 WeakPolarHBondContact CA-OD1 3.19Å
208	L	85.5	Confident	79	Confident	22 Å²	22	69.5 Å²	69.5	12%	0.115	39%	0.393	C	S	.	.	H	α-helix	trans	-56.5	-41.2	-177.6	-83.9	175.8	0	0	0	113.3	K210 I211 D268 E271 K272	L208-K210 PolarHBondContact O-N 3.35Å; L208-K210 VanDerWaalsContact O-N 3.07Å; L208-I211 VanDerWaalsContact O-CG2 3.28Å; L208-I211 WeakPolarHBondContact O-CG2 3.46Å; L208-I211 PolarHBondContact O-N 2.87Å; L208-D268 PolarHBondContact N-OD1 2.81Å; L208-E271 HydrophobicContact CD1-CB 3.36Å; L208-K272 HydrophobicContact CD1-CB 4.43Å; L208-K272 HydrophobicContact CD1-CG 3.69Å; L208-K272 HydrophobicContact CD2-CD 4.48Å; L208-K272 HydrophobicContact CD2-CG 3.58Å; L208-K272 HydrophobicContact CG-CD 4.33Å; L208-K272 HydrophobicContact CG-CG 3.55Å
209	N	86.3	Confident	80.3	Confident	123 Å²	123	69.3 Å²	69.3	66%	0.658	39%	0.39	S	S	*	.	H	α-helix	trans	-65.5	-10.1	178.6	66.6	-32.9	0	0	0	113.6	P207	P207-N209 VanDerWaalsContact C-N 3.3Å; P207-N209 WeakPolarHBondContact CB-OD1 3.02Å; P207-N209 PolarHBondContact O-N 3.45Å
210	K	87.5	Confident	82	Confident	14 Å²	14	70 Å²	70	6%	0.061	38%	0.377	C	S	.	.	H	α-helix	trans	-115.8	-12.6	-179.4	-65.3	-56.2	-156.3	161.8	0	114	E104 W146 I206 P207 L208 E212 D213 F214	E104-K210 VanDerWaalsContact CG-NZ 3.33Å; E104-K210 WeakPolarHBondContact OE1-CE 3.32Å; E104-K210 IonicContact OE1-NZ 3.61Å; E104-K210 PolarHBondContact OE1-NZ 2.69Å; W146-K210 HydrophobicContact CH2-CB 4.14Å; W146-K210 HydrophobicContact CH2-CD 4.41Å; W146-K210 HydrophobicContact CZ2-CB 3.76Å; W146-K210 HydrophobicContact CZ2-CD 4.32Å; W146-K210 HydrophobicContact CZ2-CG 4.17Å; I206-K210 HydrophobicContact CG2-CB 3.8Å; P207-K210 PolarHBondContact O-N 3.23Å; L208-K210 PolarHBondContact O-N 3.35Å; L208-K210 VanDerWaalsContact O-N 3.07Å; K210-E212 VanDerWaalsContact C-N 3.28Å; K210-E212 PolarHBondContact O-N 3.06Å; K210-D213 PolarHBondContact O-N 3.15Å; K210-F214 PolarHBondContact O-N 3.31Å; K210-F214 VanDerWaalsContact O-N 3.1Å
211	I	84.4	Confident	83.9	Confident	69 Å²	69	64.4 Å²	64.4	35%	0.354	34%	0.338	S	S	.	.	H	α-helix	trans	-65	-32.3	-170.5	-158	170.4	0	0	0	113	P207 L208 G215	P207-I211 PolarHBondContact O-N 3.3Å; P207-I211 VanDerWaalsContact O-N 3.09Å; L208-I211 VanDerWaalsContact O-CG2 3.28Å; L208-I211 WeakPolarHBondContact O-CG2 3.46Å; L208-I211 PolarHBondContact O-N 2.87Å; I211-G215 PolarHBondContact O-N 2.88Å
212	E	85.9	Confident	85.5	Confident	161 Å²	161	61 Å²	61	75%	0.752	31%	0.312	S	S	*	.	H	α-helix	trans	-68.6	-48.8	178.6	-64.3	-171.7	168.3	0	0	111.4	K210 F214 G215 V216	K210-E212 VanDerWaalsContact C-N 3.28Å; K210-E212 PolarHBondContact O-N 3.06Å; E212-F214 PolarHBondContact O-N 2.81Å; E212-G215 PolarHBondContact O-N 2.92Å; E212-G215 VanDerWaalsContact O-N 3.15Å; E212-V216 WeakPolarHBondContact O-CG2 3.34Å; E212-V216 PolarHBondContact O-N 2.89Å
213	D	86.1	Confident	86.7	Confident	50 Å²	50	55.9 Å²	55.9	27%	0.267	30%	0.299	S	S	.	.	H	α-helix	trans	-60	-46.9	178	-175.1	29	0	0	0	111	W146 S148 G149 K210 G215 V216 H217	W146-D213 HydrophobicContact CH2-CB 4.23Å; W146-D213 HydrophobicContact CZ3-CB 4.29Å; S148-D213 WeakPolarHBondContact CA-OD2 3.44Å; S148-D213 WeakPolarHBondContact CB-OD2 3.27Å; G149-D213 PolarHBondContact N-OD1 2.96Å; G149-D213 VanDerWaalsContact N-OD1 3.07Å; K210-D213 PolarHBondContact O-N 3.15Å; D213-G215 PolarHBondContact O-N 2.9Å; D213-V216 PolarHBondContact O-N 2.88Å; D213-H217 PolarHBondContact O-CD2 3.04Å; D213-H217 VanDerWaalsContact O-CD2 3.29Å; D213-H217 PolarHBondContact O-N 2.82Å; D213-H217 IonicContact OD1-CD2 2.81Å; D213-H217 PolarHBondContact OD1-CD2 3.41Å; D213-H217 IonicContact OD1-NE2 2.96Å
214	F	87	Confident	87.7	Confident	34 Å²	34	53.3 Å²	53.3	15%	0.149	29%	0.29	C	S	.	.	H	α-helix	trans	-56.3	-49.1	172.2	174.9	-103.2	0	0	0	112.2	W146 I206 K210 E212 V216 H217 C218	W146-F214 HydrophobicContact CB-CD2 3.66Å; W146-F214 HydrophobicContact CB-CE2 3.76Å; W146-F214 HydrophobicContact CD2-CB 4.17Å; W146-F214 AromaticContact CD2-CD2 3.77Å; W146-F214 HydrophobicContact CD2-CD2 3.77Å; W146-F214 HydrophobicContact CD2-CG 4.42Å; W146-F214 HydrophobicContact CE3-CB 3.82Å; W146-F214 AromaticContact CE3-CD2 3.77Å; W146-F214 HydrophobicContact CE3-CD2 3.77Å; W146-F214 HydrophobicContact CE3-CG 4.31Å; W146-F214 AromaticContact CG-CD2 3.71Å; W146-F214 HydrophobicContact CG-CD2 3.71Å; W146-F214 HydrophobicContact CG-CE2 4.24Å; W146-F214 HydrophobicContact CH2-CB 4.38Å; W146-F214 HydrophobicContact CZ3-CB 3.91Å; I206-F214 HydrophobicContact CD1-CB 3.83Å; I206-F214 HydrophobicContact CD1-CD1 3.32Å; I206-F214 HydrophobicContact CD1-CD2 3.55Å; I206-F214 HydrophobicContact CD1-CE1 3.65Å; I206-F214 HydrophobicContact CD1-CE2 3.87Å; I206-F214 HydrophobicContact CD1-CG 3.25Å; I206-F214 HydrophobicContact CD1-CZ 3.91Å; K210-F214 PolarHBondContact O-N 3.31Å; K210-F214 VanDerWaalsContact O-N 3.1Å; E212-F214 PolarHBondContact O-N 2.81Å; F214-V216 VanDerWaalsContact C-N 3.29Å; F214-V216 PolarHBondContact O-N 3.19Å; F214-H217 PolarHBondContact O-N 2.88Å; F214-C218 HydrophobicContact CD2-CB 4.19Å; F214-C218 HydrophobicContact CE1-CB 4.25Å; F214-C218 HydrophobicContact CE2-CB 3.84Å; F214-C218 HydrophobicContact CZ-CB 3.88Å; F214-C218 WeakPolarHBondContact O-CB 3.32Å; F214-C218 PolarHBondContact O-N 3.11Å
215	G	85.1	Confident	88.7	Confident	48 Å²	48	56.3 Å²	56.3	50%	0.495	30%	0.304	S	S	.	.	H	α-helix	trans	-62.7	-31.5	-176.4	0	0	0	0	0	114.2	I211 E212 D213	I211-G215 PolarHBondContact O-N 2.88Å; E212-G215 PolarHBondContact O-N 2.92Å; E212-G215 VanDerWaalsContact O-N 3.15Å; D213-G215 PolarHBondContact O-N 2.9Å
216	V	86	Confident	89.4	Confident	98 Å²	98	57.4 Å²	57.4	59%	0.594	31%	0.31	S	S	*	.	H	α-helix	trans	-78.4	-36	178.7	174.3	0	0	0	0	111.8	E212 D213 F214	E212-V216 WeakPolarHBondContact O-CG2 3.34Å; E212-V216 PolarHBondContact O-N 2.89Å; D213-V216 PolarHBondContact O-N 2.88Å; F214-V216 VanDerWaalsContact C-N 3.29Å; F214-V216 PolarHBondContact O-N 3.19Å
217	H	88	Confident	89.9	Confident	39 Å²	39	59.2 Å²	59.2	18%	0.181	32%	0.324	C	S	.	.	H	α-helix	trans	-104.7	-15.1	-168.9	-67.5	-73.8	0	0	0	114.9	G149 V152 D213 F214 K219 Q220 Y221	G149-H217 VanDerWaalsContact CA-CD2 3.49Å; G149-H217 WeakPolarHBondContact CA-CD2 3.33Å; V152-H217 HydrophobicContact CG2-CB 4.34Å; D213-H217 PolarHBondContact O-CD2 3.04Å; D213-H217 VanDerWaalsContact O-CD2 3.29Å; D213-H217 PolarHBondContact O-N 2.82Å; D213-H217 IonicContact OD1-CD2 2.81Å; D213-H217 PolarHBondContact OD1-CD2 3.41Å; D213-H217 IonicContact OD1-NE2 2.96Å; F214-H217 PolarHBondContact O-N 2.88Å; H217-K219 PolarHBondContact O-N 3.1Å; H217-Q220 PolarHBondContact ND1-NE2 3.3Å; H217-Q220 VanDerWaalsContact ND1-NE2 3.17Å; H217-Q220 PolarHBondContact ND1-OE1 2.94Å; H217-Q220 WeakPolarHBondContact O-CB 3.45Å; H217-Q220 PolarHBondContact O-N 2.94Å; H217-Y221 WeakPolarHBondContact O-CD1 3.36Å; H217-Y221 VanDerWaalsContact O-CE1 3.27Å; H217-Y221 WeakPolarHBondContact O-CE1 3.35Å
218	C	86.1	Confident	90.3	Very high	37 Å²	37	63.1 Å²	63.1	25%	0.25	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-58.1	-24	-175.1	65.3	0	0	0	0	115.1	F214 Q220	F214-C218 HydrophobicContact CD2-CB 4.19Å; F214-C218 HydrophobicContact CE1-CB 4.25Å; F214-C218 HydrophobicContact CE2-CB 3.84Å; F214-C218 HydrophobicContact CZ-CB 3.88Å; F214-C218 WeakPolarHBondContact O-CB 3.32Å; F214-C218 PolarHBondContact O-N 3.11Å; C218-Q220 VanDerWaalsContact C-N 3.34Å
219	K	88.9	Confident	90.8	Very high	139 Å²	139	63.5 Å²	63.5	60%	0.604	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-84.4	-2.3	176.2	-62.9	-167.1	174.7	-161.2	0	114.2	D197 H217	D197-K219 IonicContact OD1-NZ 3.9Å; H217-K219 PolarHBondContact O-N 3.1Å
220	Q	91	Very high	91.2	Very high	75 Å²	75	62.4 Å²	62.4	35%	0.35	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-93.3	-7.1	-175.9	-57.9	-178	20.9	0	0	112.8	V152 T188 Y189 H217 C218	V152-Q220 HydrophobicContact CG1-CB 4.03Å; T188-Q220 WeakPolarHBondContact CA-O 3.46Å; Y189-Q220 PolarHBondContact N-O 3.22Å; H217-Q220 PolarHBondContact ND1-NE2 3.3Å; H217-Q220 VanDerWaalsContact ND1-NE2 3.17Å; H217-Q220 PolarHBondContact ND1-OE1 2.94Å; H217-Q220 WeakPolarHBondContact O-CB 3.45Å; H217-Q220 PolarHBondContact O-N 2.94Å; C218-Q220 VanDerWaalsContact C-N 3.34Å
221	Y	93.8	Very high	91.5	Very high	19 Å²	19	62.4 Å²	62.4	8%	0.075	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	166.7	179.9	58.8	-92.1	0	0	0	110.9	W146 L147 V152 F186 R187 H217	W146-Y221 WeakPolarHBondContact CB-OH 3.49Å; L147-Y221 HydrophobicContact CB-CD1 3.91Å; L147-Y221 HydrophobicContact CB-CE1 3.69Å; L147-Y221 HydrophobicContact CB-CG 4.4Å; L147-Y221 HydrophobicContact CD1-CD1 4.12Å; L147-Y221 HydrophobicContact CD1-CD2 4.32Å; L147-Y221 HydrophobicContact CD1-CG 3.92Å; L147-Y221 HydrophobicContact CG-CD1 4.35Å; L147-Y221 HydrophobicContact CG-CD2 4.41Å; L147-Y221 HydrophobicContact CG-CE1 4.41Å; L147-Y221 HydrophobicContact CG-CE2 4.49Å; L147-Y221 HydrophobicContact CG-CG 4.34Å; L147-Y221 PolarHBondContact N-OH 3.03Å; L147-Y221 WeakPolarHBondContact O-CE1 3.21Å; V152-Y221 HydrophobicContact CG2-CD1 3.62Å; V152-Y221 HydrophobicContact CG2-CE1 4.04Å; F186-Y221 HydrophobicContact CB-CD2 4.29Å; F186-Y221 AromaticContact CD1-CD2 3.7Å; F186-Y221 HydrophobicContact CD1-CD2 3.7Å; F186-Y221 AromaticContact CD1-CE2 3.83Å; F186-Y221 HydrophobicContact CD1-CE2 3.83Å; F186-Y221 HydrophobicContact CE1-CD2 4.41Å; F186-Y221 HydrophobicContact CE1-CE2 4.11Å; F186-Y221 HydrophobicContact CG-CD2 4.22Å; F186-Y221 HydrophobicContact CG-CE2 4.48Å; R187-Y221 CarbonylContact O-C 3.47Å; R187-Y221 WeakPolarHBondContact O-CA 3.44Å; R187-Y221 WeakPolarHBondContact O-CB 3.3Å; H217-Y221 WeakPolarHBondContact O-CD1 3.36Å; H217-Y221 VanDerWaalsContact O-CE1 3.27Å; H217-Y221 WeakPolarHBondContact O-CE1 3.35Å
222	Y	94.1	Very high	91.9	Very high	13 Å²	13	61.2 Å²	61.2	5%	0.051	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	153.5	172.2	61.9	-88.5	0	0	0	110.3	H49 H50 F52 F186 R187 Y189 L224	H49-Y222 VanDerWaalsContact O-CE1 3.32Å; H49-Y222 WeakPolarHBondContact O-CE1 3.34Å; H49-Y222 PolarHBondContact O-OH 2.88Å; H50-Y222 AromaticContact CE1-CD2 3.24Å; H50-Y222 WeakPolarHBondContact CE1-CD2 3.35Å; H50-Y222 AromaticContact CE1-CE2 3.75Å; H50-Y222 AromaticContact CE1-CG 3.62Å; H50-Y222 AromaticContact ND1-CD1 3.8Å; H50-Y222 AromaticContact ND1-CD2 3.31Å; H50-Y222 VanDerWaalsContact ND1-CD2 3.31Å; H50-Y222 WeakPolarHBondContact ND1-CD2 3.41Å; H50-Y222 AromaticContact ND1-CE1 3.97Å; H50-Y222 AromaticContact ND1-CE2 3.53Å; H50-Y222 AromaticContact ND1-CG 3.44Å; H50-Y222 AromaticContact ND1-CZ 3.84Å; F52-Y222 VanDerWaalsContact O-CE2 3.31Å; F52-Y222 WeakPolarHBondContact O-CE2 3.42Å; F186-Y222 VanDerWaalsContact CA-O 3.31Å; F186-Y222 WeakPolarHBondContact CA-O 3.13Å; R187-Y222 HydrophobicContact CB-CE1 3.89Å; R187-Y222 HydrophobicContact CB-CE2 4.06Å; R187-Y222 PolarHBondContact N-O 2.83Å; R187-Y222 PolarHBondContact NE-OH 2.97Å; R187-Y222 WeakPolarHBondContact O-CD1 3.44Å; R187-Y222 PolarHBondContact O-N 2.76Å; Y189-Y222 AromaticContact CD1-CD1 4Å; Y189-Y222 HydrophobicContact CD1-CD1 4Å; Y189-Y222 HydrophobicContact CD1-CE1 4.2Å; Y189-Y222 AromaticContact CE1-CD1 3.49Å; Y189-Y222 HydrophobicContact CE1-CD1 3.49Å; Y189-Y222 VanDerWaalsContact CE1-CD1 3.49Å; Y189-Y222 AromaticContact CE1-CE1 3.94Å; Y189-Y222 HydrophobicContact CE1-CE1 3.94Å; Y189-Y222 HydrophobicContact CE1-CG 4.42Å; Y189-Y222 HydrophobicContact CE2-CD1 4.05Å; Y189-Y222 HydrophobicContact CG-CD1 4.49Å; Y189-Y222 AromaticContact CZ-CD1 3.53Å; Y222-L224 HydrophobicContact CD2-CD1 3.9Å; Y222-L224 HydrophobicContact CE2-CD1 3.58Å; Y222-L224 HydrophobicContact CE2-CG 4.4Å
223	A	94.9	Very high	92.1	Very high	64 Å²	64	58.6 Å²	58.6	53%	0.529	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	144.2	176.2	0	0	0	0	0	110.8	A185 F186	A185-A223 CarbonylContact O-C 3.51Å; A185-A223 WeakPolarHBondContact O-CA 3.47Å; F186-A223 HydrophobicContact CD1-CB 3.96Å; F186-A223 HydrophobicContact CE1-CB 3.85Å
224	L	96.8	Very high	92.5	Very high	8 Å²	8	57.4 Å²	57.4	4%	0.042	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	144.2	169.2	-76.8	67.6	0	0	0	108.5	F52 K53 C55 M90 V166 A185 R187 Y222 V226	F52-L224 HydrophobicContact CB-CD2 4.18Å; K53-L224 CarbonylContact O-C 3.52Å; K53-L224 WeakPolarHBondContact O-CA 3.21Å; C55-L224 HydrophobicContact CB-CB 4.01Å; C55-L224 HydrophobicContact CB-CD2 4.18Å; M90-L224 HydrophobicContact CG-CD2 4.49Å; M90-L224 HydrophobicContact SD-CD2 4.34Å; V166-L224 HydrophobicContact CG2-CD2 4.32Å; A185-L224 HydrophobicContact CB-CB 4.19Å; A185-L224 PolarHBondContact O-N 3.3Å; R187-L224 HydrophobicContact CB-CD1 4.05Å; R187-L224 HydrophobicContact CG-CD1 3.77Å; Y222-L224 HydrophobicContact CD2-CD1 3.9Å; Y222-L224 HydrophobicContact CE2-CD1 3.58Å; Y222-L224 HydrophobicContact CE2-CG 4.4Å; L224-V226 PolarHBondContact O-N 3.4Å
225	E	97.5	Very high	92.7	Very high	128 Å²	128	61 Å²	61	60%	0.598	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.5	116.6	173.3	-176.8	-176.7	154.3	0	0	109.7	K53 Y54 C55	K53-E225 PolarHBondContact O-N 2.96Å; Y54-E225 WeakPolarHBondContact CA-O 3.48Å; Y54-E225 HydrophobicContact CD1-CB 3.93Å; Y54-E225 HydrophobicContact CD1-CG 4.46Å; Y54-E225 HydrophobicContact CE1-CB 4.4Å; C55-E225 PolarHBondContact N-O 3.25Å
226	V	97.8	Very high	93.1	Very high	37 Å²	37	64.5 Å²	64.5	22%	0.224	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	127.6	-177.8	-179.7	0	0	0	0	110.6	C55 I57 L183 A185 L224 Y228	C55-V226 HydrophobicContact CB-CG2 4.4Å; C55-V226 CarbonylContact O-C 3.55Å; C55-V226 VanDerWaalsContact O-CA 3.32Å; C55-V226 WeakPolarHBondContact O-CA 3.04Å; I57-V226 HydrophobicContact CD1-CG1 3.85Å; I57-V226 HydrophobicContact CG1-CG1 4.27Å; L183-V226 HydrophobicContact CD2-CG1 4.03Å; L183-V226 HydrophobicContact CD2-CG2 3.96Å; A185-V226 HydrophobicContact CB-CG2 3.7Å; L224-V226 PolarHBondContact O-N 3.4Å; V226-Y228 HydrophobicContact CG1-CE1 3.83Å; V226-Y228 HydrophobicContact CG1-CE2 4.31Å
227	S	97.9	Very high	93.5	Very high	43 Å²	43	63.9 Å²	63.9	30%	0.301	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	158.5	169.1	55.7	0	0	0	0	111.2	C55 K56 I57	C55-S227 PolarHBondContact O-N 2.83Å; K56-S227 CarbonylContact C-O 3.57Å; K56-S227 WeakPolarHBondContact CA-O 3.19Å; K56-S227 VanDerWaalsContact CG-OG 3.28Å; K56-S227 WeakPolarHBondContact CG-OG 3.4Å; I57-S227 PolarHBondContact N-O 2.78Å
228	Y	96.6	Very high	93.6	Very high	104 Å²	104	65 Å²	65	41%	0.408	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	145.6	-174.4	-53.9	-74.7	0	0	0	111.2	I57 L62 V226	I57-Y228 HydrophobicContact CB-CD1 3.97Å; I57-Y228 HydrophobicContact CB-CE1 4.21Å; I57-Y228 HydrophobicContact CD1-CE1 4.33Å; I57-Y228 WeakPolarHBondContact O-CA 3.11Å; L62-Y228 HydrophobicContact CD1-CD1 4.21Å; L62-Y228 HydrophobicContact CD1-CE1 3.55Å; L62-Y228 HydrophobicContact CD2-CD1 3.66Å; L62-Y228 HydrophobicContact CD2-CE1 3.71Å; L62-Y228 HydrophobicContact CD2-CG 4.31Å; L62-Y228 HydrophobicContact CG-CD1 4.37Å; L62-Y228 HydrophobicContact CG-CE1 4.17Å; V226-Y228 HydrophobicContact CG1-CE1 3.83Å; V226-Y228 HydrophobicContact CG1-CE2 4.31Å
229	F	95.9	Very high	94	Very high	30 Å²	30	68.2 Å²	68.2	13%	0.132	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	158.9	175.4	67.1	-83.3	0	0	0	111.1	I28 Y29 K56 I57 S58 A59 I91 M93	I28-F229 HydrophobicContact CD1-CD1 3.96Å; I28-F229 HydrophobicContact CD1-CD2 3.99Å; I28-F229 HydrophobicContact CD1-CE1 3.99Å; I28-F229 HydrophobicContact CD1-CE2 4.02Å; I28-F229 HydrophobicContact CD1-CG 3.95Å; I28-F229 HydrophobicContact CD1-CZ 4.02Å; I28-F229 HydrophobicContact CG1-CE2 4.23Å; I28-F229 HydrophobicContact CG1-CZ 4.39Å; I28-F229 HydrophobicContact CG2-CD2 3.6Å; I28-F229 HydrophobicContact CG2-CE2 3.7Å; I28-F229 HydrophobicContact CG2-CG 4.46Å; Y29-F229 HydrophobicContact CD2-CE2 4.43Å; Y29-F229 HydrophobicContact CE1-CE2 4.07Å; Y29-F229 AromaticContact CE2-CD2 3.76Å; Y29-F229 HydrophobicContact CE2-CD2 3.76Å; Y29-F229 AromaticContact CE2-CE2 3.73Å; Y29-F229 HydrophobicContact CE2-CE2 3.73Å; Y29-F229 AromaticContact CZ-CD2 3.78Å; Y29-F229 AromaticContact CZ-CE2 3.52Å; K56-F229 HydrophobicContact CB-CD1 3.92Å; K56-F229 HydrophobicContact CB-CE1 3.87Å; I57-F229 VanDerWaalsContact C-CE1 3.41Å; I57-F229 WeakPolarHBondContact O-CD1 3.31Å; I57-F229 PolarHBondContact O-N 3.38Å; I57-F229 VanDerWaalsContact O-N 3.11Å; S58-F229 CarbonylContact C-O 3.35Å; S58-F229 WeakPolarHBondContact CA-O 3.42Å; S58-F229 VanDerWaalsContact N-CE1 3.28Å; A59-F229 PolarHBondContact N-O 3.43Å; I91-F229 HydrophobicContact CG2-CE1 3.78Å; I91-F229 HydrophobicContact CG2-CZ 3.72Å; M93-F229 HydrophobicContact CE-CE2 4.23Å; M93-F229 HydrophobicContact CE-CZ 4.33Å; M93-F229 HydrophobicContact SD-CE2 4.14Å; M93-F229 HydrophobicContact SD-CZ 3.69Å
230	K	94.5	Very high	94.2	Very high	101 Å²	101	67.1 Å²	67.1	44%	0.439	34%	0.335	S	S	.	.			trans	-145.6	146	178	64.1	-177.9	176.4	-176	0	109.8	Y29 A59 D234 R235 L238	Y29-K230 WeakPolarHBondContact OH-CA 3.47Å; A59-K230 HydrophobicContact CB-CB 3.82Å; K230-D234 HydrophobicContact CB-CB 3.97Å; K230-R235 HydrophobicContact CD-CB 4.44Å; K230-L238 HydrophobicContact CD-CD1 3.86Å
231	S	93.2	Very high	94.1	Very high	14 Å²	14	67 Å²	67	10%	0.098	34%	0.337	C	S	.	.			trans	-74.2	167.5	176.3	63.6	0	0	0	0	111.8	D26 Y29 L233 D234 R235	D26-S231 WeakPolarHBondContact OD1-CA 3.42Å; D26-S231 WeakPolarHBondContact OD1-CB 3.46Å; Y29-S231 PolarHBondContact OH-N 3.27Å; S231-L233 PolarHBondContact O-N 2.99Å; S231-D234 PolarHBondContact N-OD2 2.99Å; S231-D234 VanDerWaalsContact N-OD2 3.14Å; S231-D234 PolarHBondContact O-N 3.43Å; S231-D234 WeakPolarHBondContact OG-CB 3.02Å; S231-D234 PolarHBondContact OG-N 2.82Å; S231-D234 PolarHBondContact OG-OD2 3.4Å; S231-R235 WeakPolarHBondContact O-CB 3.38Å; S231-R235 PolarHBondContact O-N 3.25Å
232	S	92.4	Very high	93.9	Very high	43 Å²	43	74.1 Å²	74.1	30%	0.301	36%	0.364	S	S	.	.	H	α-helix	trans	-58.2	-33.3	170.3	69.1	0	0	0	0	112.5	D26 K236	D26-S232 PolarHBondContact OD1-N 3.26Å; D26-S232 VanDerWaalsContact OD2-CB 3.3Å; D26-S232 WeakPolarHBondContact OD2-CB 3.33Å; D26-S232 PolarHBondContact OD2-OG 2.98Å; S232-K236 PolarHBondContact O-N 2.92Å
233	L	91.6	Very high	93.6	Very high	106 Å²	106	78.2 Å²	78.2	56%	0.555	39%	0.387	S	S	*	.	H	α-helix	trans	-73.6	-48.8	174.6	179.8	61.8	0	0	0	111.5	S231 R235 K236 L237	S231-L233 PolarHBondContact O-N 2.99Å; L233-R235 PolarHBondContact O-N 2.83Å; L233-K236 WeakPolarHBondContact O-CB 3.41Å; L233-K236 PolarHBondContact O-N 3.26Å; L233-L237 HydrophobicContact CD1-CG 4.44Å; L233-L237 HydrophobicContact CG-CD1 4.13Å; L233-L237 HydrophobicContact CG-CG 4.43Å; L233-L237 WeakPolarHBondContact O-CG 3.49Å; L233-L237 PolarHBondContact O-N 2.78Å
234	D	92.8	Very high	93.4	Very high	25 Å²	25	82 Å²	82	13%	0.134	39%	0.391	C	S	.	.	H	α-helix	trans	-56.8	-37.9	177	-66.9	-36.1	0	0	0	110.8	Y29 K230 S231 K236 L237 L238	Y29-D234 PolarHBondContact OH-OD2 3.14Å; Y29-D234 VanDerWaalsContact OH-OD2 3.08Å; K230-D234 HydrophobicContact CB-CB 3.97Å; S231-D234 PolarHBondContact N-OD2 2.99Å; S231-D234 VanDerWaalsContact N-OD2 3.14Å; S231-D234 PolarHBondContact O-N 3.43Å; S231-D234 WeakPolarHBondContact OG-CB 3.02Å; S231-D234 PolarHBondContact OG-N 2.82Å; S231-D234 PolarHBondContact OG-OD2 3.4Å; D234-K236 PolarHBondContact O-N 3.36Å; D234-L237 PolarHBondContact O-N 3.32Å; D234-L238 VanDerWaalsContact O-CB 3.31Å; D234-L238 WeakPolarHBondContact O-CB 3.42Å; D234-L238 WeakPolarHBondContact O-CG 3.27Å; D234-L238 PolarHBondContact O-N 2.84Å
235	R	92.7	Very high	93.1	Very high	111 Å²	111	86.5 Å²	86.5	42%	0.419	41%	0.408	S	S	.	.	H	α-helix	trans	-56.4	-48	173.9	-176.4	-176.8	62.7	76.2	-6.2	111.9	K230 S231 L233 E239	K230-R235 HydrophobicContact CD-CB 4.44Å; S231-R235 WeakPolarHBondContact O-CB 3.38Å; S231-R235 PolarHBondContact O-N 3.25Å; L233-R235 PolarHBondContact O-N 2.83Å; R235-E239 IonicContact NH1-OE2 3.2Å; R235-E239 WeakPolarHBondContact O-CB 3.44Å; R235-E239 PolarHBondContact O-N 3.31Å; R235-E239 VanDerWaalsContact O-N 3.09Å
236	K	93.5	Very high	92.5	Very high	120 Å²	120	86.4 Å²	86.4	52%	0.522	40%	0.402	S	S	.	.	H	α-helix	trans	-65.5	-41	177.9	-66.7	175.4	-178	176	0	111.4	S232 L233 D234 E239 L240	S232-K236 PolarHBondContact O-N 2.92Å; L233-K236 WeakPolarHBondContact O-CB 3.41Å; L233-K236 PolarHBondContact O-N 3.26Å; D234-K236 PolarHBondContact O-N 3.36Å; K236-E239 PolarHBondContact O-N 2.94Å; K236-L240 WeakPolarHBondContact O-CG 3.46Å; K236-L240 PolarHBondContact O-N 2.75Å; K236-L240 VanDerWaalsContact O-N 3.1Å
237	L	92.9	Very high	92.1	Very high	85 Å²	85	88.1 Å²	88.1	45%	0.445	41%	0.413	S	S	.	.	H	α-helix	trans	-64.3	-45.9	178.3	-68.5	174.7	0	0	0	111.8	L233 D234 E239 L240 L241	L233-L237 HydrophobicContact CD1-CG 4.44Å; L233-L237 HydrophobicContact CG-CD1 4.13Å; L233-L237 HydrophobicContact CG-CG 4.43Å; L233-L237 WeakPolarHBondContact O-CG 3.49Å; L233-L237 PolarHBondContact O-N 2.78Å; D234-L237 PolarHBondContact O-N 3.32Å; L237-E239 VanDerWaalsContact C-N 3.29Å; L237-E239 PolarHBondContact O-N 3.34Å; L237-L240 PolarHBondContact O-N 3.31Å; L237-L241 WeakPolarHBondContact O-CG 3.47Å; L237-L241 PolarHBondContact O-N 3.34Å
238	L	91.7	Very high	91.5	Very high	63 Å²	63	90.5 Å²	90.5	33%	0.33	42%	0.422	S	S	.	.	H	α-helix	trans	-63.1	-36.4	177.8	-71.2	168.9	0	0	0	111.9	A59 K230 D234 L241 W242	A59-L238 HydrophobicContact CB-CD1 4.32Å; K230-L238 HydrophobicContact CD-CD1 3.86Å; D234-L238 VanDerWaalsContact O-CB 3.31Å; D234-L238 WeakPolarHBondContact O-CB 3.42Å; D234-L238 WeakPolarHBondContact O-CG 3.27Å; D234-L238 PolarHBondContact O-N 2.84Å; L238-L241 HydrophobicContact CD2-CD1 4.4Å; L238-L241 PolarHBondContact O-N 3.16Å; L238-W242 WeakPolarHBondContact O-CB 3.47Å; L238-W242 PolarHBondContact O-N 3.17Å
239	E	92.6	Very high	90.9	Very high	104 Å²	104	89.4 Å²	89.4	49%	0.486	43%	0.427	S	S	.	.	H	α-helix	trans	-63.7	-43.5	174.4	-173.1	175.9	178.7	0	0	111.9	R235 K236 L237 W242 N243	R235-E239 IonicContact NH1-OE2 3.2Å; R235-E239 WeakPolarHBondContact O-CB 3.44Å; R235-E239 PolarHBondContact O-N 3.31Å; R235-E239 VanDerWaalsContact O-N 3.09Å; K236-E239 PolarHBondContact O-N 2.94Å; L237-E239 VanDerWaalsContact C-N 3.29Å; L237-E239 PolarHBondContact O-N 3.34Å; E239-W242 PolarHBondContact O-N 3.43Å; E239-N243 VanDerWaalsContact O-CG 3.29Å; E239-N243 PolarHBondContact O-N 2.94Å; E239-N243 PolarHBondContact O-ND2 2.92Å
240	L	93.6	Very high	90.3	Very high	116 Å²	116	91.3 Å²	91.3	61%	0.607	44%	0.438	S	S	*	.	H	α-helix	trans	-64	-41.6	174.4	-67.9	173.4	0	0	0	112.2	K236 L237 W242 N243 K244	K236-L240 WeakPolarHBondContact O-CG 3.46Å; K236-L240 PolarHBondContact O-N 2.75Å; K236-L240 VanDerWaalsContact O-N 3.1Å; L237-L240 PolarHBondContact O-N 3.31Å; L240-W242 VanDerWaalsContact C-N 3.34Å; L240-N243 PolarHBondContact O-N 3.35Å; L240-K244 WeakPolarHBondContact O-CB 3.27Å; L240-K244 PolarHBondContact O-N 3.49Å; L240-K244 VanDerWaalsContact O-N 3.1Å
241	L	90.3	Very high	89.9	Confident	74 Å²	74	90.8 Å²	90.8	39%	0.387	45%	0.447	S	S	.	.	H	α-helix	trans	-63.5	-41.8	176.3	-69.9	171.6	0	0	0	111.3	L237 L238 K244 Y245	L237-L241 WeakPolarHBondContact O-CG 3.47Å; L237-L241 PolarHBondContact O-N 3.34Å; L238-L241 HydrophobicContact CD2-CD1 4.4Å; L238-L241 PolarHBondContact O-N 3.16Å; L241-K244 PolarHBondContact O-N 3.36Å; L241-Y245 HydrophobicContact CB-CD2 4.38Å; L241-Y245 HydrophobicContact CD2-CD2 4.11Å; L241-Y245 HydrophobicContact CD2-CE2 3.67Å; L241-Y245 VanDerWaalsContact O-CD2 3.28Å; L241-Y245 WeakPolarHBondContact O-CD2 3.18Å; L241-Y245 PolarHBondContact O-N 3.07Å
242	W	88.2	Confident	89.5	Confident	168 Å²	168	92.9 Å²	92.9	64%	0.636	46%	0.461	S	S	*	.	H	α-helix	trans	-59.9	-49.4	176.3	-171.4	-98.3	0	0	0	111.4	L238 E239 L240 K244 Y245 W246	L238-W242 WeakPolarHBondContact O-CB 3.47Å; L238-W242 PolarHBondContact O-N 3.17Å; E239-W242 PolarHBondContact O-N 3.43Å; L240-W242 VanDerWaalsContact C-N 3.34Å; W242-K244 PolarHBondContact O-N 3.49Å; W242-K244 VanDerWaalsContact O-N 3.16Å; W242-Y245 PolarHBondContact O-N 3.44Å; W242-W246 WeakPolarHBondContact O-CB 3.39Å; W242-W246 PolarHBondContact O-N 3.04Å
243	N	88.9	Confident	89.3	Confident	99 Å²	99	91.4 Å²	91.4	53%	0.529	45%	0.451	S	S	.	.	H	α-helix	trans	-60.9	-27.2	177.9	-69.8	-23.4	0	0	0	113.1	E239 L240 W246	E239-N243 VanDerWaalsContact O-CG 3.29Å; E239-N243 PolarHBondContact O-N 2.94Å; E239-N243 PolarHBondContact O-ND2 2.92Å; L240-N243 PolarHBondContact O-N 3.35Å; N243-W246 VanDerWaalsContact O-CD1 3.29Å
244	K	91	Very high	89	Confident	142 Å²	142	88.3 Å²	88.3	62%	0.617	44%	0.439	S	S	*	.	H	α-helix	trans	-84.5	-39.2	178.1	-172.8	173.8	179.3	-175.6	0	113.5	L240 L241 W242	L240-K244 WeakPolarHBondContact O-CB 3.27Å; L240-K244 PolarHBondContact O-N 3.49Å; L240-K244 VanDerWaalsContact O-N 3.1Å; L241-K244 PolarHBondContact O-N 3.36Å; W242-K244 PolarHBondContact O-N 3.49Å; W242-K244 VanDerWaalsContact O-N 3.16Å
245	Y	88.6	Confident	88.7	Confident	104 Å²	104	89.8 Å²	89.8	41%	0.408	45%	0.446	S	S	.	.	H	α-helix	trans	-113.3	-0.7	-165.9	-62.9	-65.1	0	0	0	115.2	L241 W242 V247 N248	L241-Y245 HydrophobicContact CB-CD2 4.38Å; L241-Y245 HydrophobicContact CD2-CD2 4.11Å; L241-Y245 HydrophobicContact CD2-CE2 3.67Å; L241-Y245 VanDerWaalsContact O-CD2 3.28Å; L241-Y245 WeakPolarHBondContact O-CD2 3.18Å; L241-Y245 PolarHBondContact O-N 3.07Å; W242-Y245 PolarHBondContact O-N 3.44Å; Y245-V247 PolarHBondContact O-N 3.23Å; Y245-V247 VanDerWaalsContact O-N 3.07Å; Y245-N248 WeakPolarHBondContact O-CB 3.23Å; Y245-N248 PolarHBondContact O-N 2.92Å
246	W	86.8	Confident	88.5	Confident	125 Å²	125	91.1 Å²	91.1	47%	0.473	46%	0.461	S	S	.	.	H	α-helix	trans	-53.3	-32.5	179.6	69	-85.9	0	0	0	113.6	W242 N243 N248 T249 L250	W242-W246 WeakPolarHBondContact O-CB 3.39Å; W242-W246 PolarHBondContact O-N 3.04Å; N243-W246 VanDerWaalsContact O-CD1 3.29Å; W246-N248 PolarHBondContact O-N 3.35Å; W246-T249 VanDerWaalsContact O-CB 3.31Å; W246-T249 WeakPolarHBondContact O-CB 3.39Å; W246-T249 PolarHBondContact O-N 2.95Å; W246-T249 VanDerWaalsContact O-N 3.09Å; W246-L250 HydrophobicContact CE3-CD1 3.59Å; W246-L250 HydrophobicContact CE3-CG 4.23Å; W246-L250 HydrophobicContact CH2-CD1 4.46Å; W246-L250 HydrophobicContact CZ3-CD1 3.28Å; W246-L250 HydrophobicContact CZ3-CG 4.37Å; W246-L250 PolarHBondContact O-N 3.05Å
247	V	88	Confident	88.1	Confident	73 Å²	73	88.6 Å²	88.6	44%	0.442	46%	0.455	S	S	.	.	H	α-helix	trans	-61.3	-35.1	177.3	-175.7	0	0	0	0	111.4	Y245 T249 L250 S251	Y245-V247 PolarHBondContact O-N 3.23Å; Y245-V247 VanDerWaalsContact O-N 3.07Å; V247-T249 VanDerWaalsContact C-N 3.29Å; V247-T249 PolarHBondContact O-N 3.42Å; V247-L250 PolarHBondContact O-N 3.26Å; V247-L250 VanDerWaalsContact O-N 3.16Å; V247-S251 PolarHBondContact O-N 3.08Å; V247-S251 PolarHBondContact O-OG 3.34Å
248	N	86.3	Confident	87.8	Confident	93 Å²	93	84.9 Å²	84.9	50%	0.497	44%	0.436	S	S	.	.	H	α-helix	trans	-66.1	-34.3	176.8	-66.1	-17.1	0	0	0	111.7	Y245 W246 L250 S251 S252	Y245-N248 WeakPolarHBondContact O-CB 3.23Å; Y245-N248 PolarHBondContact O-N 2.92Å; W246-N248 PolarHBondContact O-N 3.35Å; N248-L250 VanDerWaalsContact C-N 3.31Å; N248-S251 WeakPolarHBondContact CA-OG 3.25Å; N248-S251 PolarHBondContact O-N 3.25Å; N248-S251 PolarHBondContact O-OG 3.03Å; N248-S252 VanDerWaalsContact O-CB 3.29Å; N248-S252 WeakPolarHBondContact O-CB 3.38Å; N248-S252 PolarHBondContact O-N 3.46Å; N248-S252 PolarHBondContact O-OG 3.38Å
249	T	82.7	Confident	87.7	Confident	82 Å²	82	83.7 Å²	83.7	50%	0.503	44%	0.436	S	S	.	.	H	α-helix	trans	-63.6	-41.9	173.7	-52.6	0	0	0	0	110.3	W246 V247 S252	W246-T249 VanDerWaalsContact O-CB 3.31Å; W246-T249 WeakPolarHBondContact O-CB 3.39Å; W246-T249 PolarHBondContact O-N 2.95Å; W246-T249 VanDerWaalsContact O-N 3.09Å; V247-T249 VanDerWaalsContact C-N 3.29Å; V247-T249 PolarHBondContact O-N 3.42Å; T249-S252 PolarHBondContact O-OG 3.01Å
250	L	83.6	Confident	87.5	Confident	69 Å²	69	85.6 Å²	85.6	36%	0.361	45%	0.449	S	S	.	.	H	α-helix	trans	-70.6	-38.8	177.1	-68.2	-176.7	0	0	0	113.6	W246 V247 N248 S252 K324 F328	W246-L250 HydrophobicContact CE3-CD1 3.59Å; W246-L250 HydrophobicContact CE3-CG 4.23Å; W246-L250 HydrophobicContact CH2-CD1 4.46Å; W246-L250 HydrophobicContact CZ3-CD1 3.28Å; W246-L250 HydrophobicContact CZ3-CG 4.37Å; W246-L250 PolarHBondContact O-N 3.05Å; V247-L250 PolarHBondContact O-N 3.26Å; V247-L250 VanDerWaalsContact O-N 3.16Å; N248-L250 VanDerWaalsContact C-N 3.31Å; L250-S252 VanDerWaalsContact C-N 3.34Å; L250-K324 WeakPolarHBondContact O-CD 3.37Å; L250-K324 WeakPolarHBondContact O-CE 3.44Å; L250-K324 PolarHBondContact O-NZ 3.49Å; L250-F328 HydrophobicContact CD1-CZ 4.2Å
251	S	85.6	Confident	87.3	Confident	90 Å²	90	81.5 Å²	81.5	63%	0.629	43%	0.426	S	S	*	.	H	α-helix	trans	-77.9	-18	-179.9	65.3	0	0	0	0	113.6	V247 N248	V247-S251 PolarHBondContact O-N 3.08Å; V247-S251 PolarHBondContact O-OG 3.34Å; N248-S251 WeakPolarHBondContact CA-OG 3.25Å; N248-S251 PolarHBondContact O-N 3.25Å; N248-S251 PolarHBondContact O-OG 3.03Å
252	S	86.3	Confident	87.3	Confident	58 Å²	58	79.6 Å²	79.6	41%	0.406	42%	0.417	S	S	.	.			trans	-67.5	147.9	177.1	69.4	0	0	0	0	112.5	N248 T249 L250 K324	N248-S252 VanDerWaalsContact O-CB 3.29Å; N248-S252 WeakPolarHBondContact O-CB 3.38Å; N248-S252 PolarHBondContact O-N 3.46Å; N248-S252 PolarHBondContact O-OG 3.38Å; T249-S252 PolarHBondContact O-OG 3.01Å; L250-S252 VanDerWaalsContact C-N 3.34Å; S252-K324 PolarHBondContact O-NZ 3.14Å
253	S	87.7	Confident	87.5	Confident	13 Å²	13	75.2 Å²	75.2	9%	0.091	41%	0.409	C	S	.	.			trans	-124.8	116.2	172.4	-179.1	0	0	0	0	109.2	L255 L256 T257 Q321	S253-L255 PolarHBondContact O-N 3.18Å; S253-L256 PolarHBondContact O-N 3.45Å; S253-T257 WeakPolarHBondContact O-CB 3.21Å; S253-T257 PolarHBondContact O-N 2.91Å; S253-T257 PolarHBondContact O-OG1 2.81Å; S253-Q321 VanDerWaalsContact CB-NE2 3.3Å; S253-Q321 PolarHBondContact OG-NE2 3.3Å; S253-Q321 VanDerWaalsContact OG-NE2 3.11Å
254	S	85.5	Confident	87.6	Confident	41 Å²	41	72.2 Å²	72.2	29%	0.287	40%	0.401	S	S	.	.	H	α-helix	trans	-62.2	-33.6	175.7	54.4	0	0	0	0	111.6	L256 T257 N258 G317	S254-L256 VanDerWaalsContact C-N 3.31Å; S254-L256 PolarHBondContact O-N 2.82Å; S254-T257 PolarHBondContact O-N 2.66Å; S254-N258 WeakPolarHBondContact O-CB 3.44Å; S254-N258 VanDerWaalsContact O-CG 3.31Å; S254-N258 PolarHBondContact O-N 3.41Å; S254-N258 PolarHBondContact O-ND2 2.88Å; S254-G317 VanDerWaalsContact OG-CA 3.32Å; S254-G317 WeakPolarHBondContact OG-CA 3.34Å
255	L	86.6	Confident	87.6	Confident	55 Å²	55	66.1 Å²	66.1	29%	0.288	38%	0.375	S	S	.	.	H	α-helix	trans	-61.2	-38.4	176.3	-64.2	176.8	0	0	0	112.8	S253 A259 L318 Q321	S253-L255 PolarHBondContact O-N 3.18Å; L255-A259 WeakPolarHBondContact O-CB 3.28Å; L255-A259 PolarHBondContact O-N 3.22Å; L255-L318 HydrophobicContact CD1-CD2 3.63Å; L255-L318 HydrophobicContact CD1-CG 3.94Å; L255-L318 HydrophobicContact CD2-CG 4.41Å; L255-Q321 HydrophobicContact CD1-CG 4.24Å
256	L	87.4	Confident	87.8	Confident	140 Å²	140	65.1 Å²	65.1	73%	0.733	38%	0.38	S	S	*	.	H	α-helix	trans	-80.7	-43.1	178.4	-64.3	177.9	0	0	0	111.2	S253 S254 N258	S253-L256 PolarHBondContact O-N 3.45Å; S254-L256 VanDerWaalsContact C-N 3.31Å; S254-L256 PolarHBondContact O-N 2.82Å; L256-N258 VanDerWaalsContact C-N 3.29Å; L256-N258 PolarHBondContact O-N 3.23Å
257	T	85.6	Confident	88.1	Confident	66 Å²	66	65.8 Å²	65.8	41%	0.405	39%	0.386	S	S	.	.	H	α-helix	trans	-70.8	-29	-174.1	-47.3	0	0	0	0	112	I176 S253 S254	I176-T257 HydrophobicContact CG2-CG2 3.76Å; S253-T257 WeakPolarHBondContact O-CB 3.21Å; S253-T257 PolarHBondContact O-N 2.91Å; S253-T257 PolarHBondContact O-OG1 2.81Å; S254-T257 PolarHBondContact O-N 2.66Å
258	N	86	Confident	88.3	Confident	7 Å²	7	63.3 Å²	63.3	4%	0.037	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	11	-176.8	-51.6	-32.9	0	0	0	113	I176 S177 S254 L256 D260 Y261 T262	I176-N258 VanDerWaalsContact CG2-OD1 3.29Å; I176-N258 WeakPolarHBondContact CG2-OD1 3.31Å; S177-N258 WeakPolarHBondContact CA-ND2 3.31Å; S254-N258 WeakPolarHBondContact O-CB 3.44Å; S254-N258 VanDerWaalsContact O-CG 3.31Å; S254-N258 PolarHBondContact O-N 3.41Å; S254-N258 PolarHBondContact O-ND2 2.88Å; L256-N258 VanDerWaalsContact C-N 3.29Å; L256-N258 PolarHBondContact O-N 3.23Å; N258-D260 VanDerWaalsContact C-N 3.34Å; N258-D260 PolarHBondContact O-N 2.96Å; N258-Y261 WeakPolarHBondContact O-CB 3.33Å; N258-Y261 PolarHBondContact O-N 2.81Å; N258-T262 PolarHBondContact O-N 3.04Å; N258-T262 PolarHBondContact O-OG1 2.85Å
259	A	89.4	Confident	88.6	Confident	39 Å²	39	60 Å²	60	32%	0.322	35%	0.352	S	S	.	.	H	α-helix	trans	-51.4	-52.4	-175.3	0	0	0	0	0	111.9	L255 Y261 T262 T263	L255-A259 WeakPolarHBondContact O-CB 3.28Å; L255-A259 PolarHBondContact O-N 3.22Å; A259-Y261 VanDerWaalsContact C-N 3.3Å; A259-Y261 PolarHBondContact O-N 3.14Å; A259-T262 PolarHBondContact O-N 2.99Å; A259-T263 WeakPolarHBondContact O-CB 3.33Å; A259-T263 PolarHBondContact O-N 2.6Å; A259-T263 PolarHBondContact O-OG1 2.97Å
260	D	89.1	Confident	89.1	Confident	144 Å²	144	58.6 Å²	58.6	77%	0.77	35%	0.346	S	S	*	.	H	α-helix	trans	-60.8	-39.4	179.6	-62.6	-23.5	0	0	0	112.3	N258 G264	N258-D260 VanDerWaalsContact C-N 3.34Å; N258-D260 PolarHBondContact O-N 2.96Å; D260-G264 PolarHBondContact O-N 2.9Å
261	Y	89.5	Confident	89.5	Confident	29 Å²	29	60.2 Å²	60.2	11%	0.114	35%	0.352	C	S	.	.	H	α-helix	trans	-66.3	-48.7	177.7	175	-114.8	0	0	0	111.7	T173 N258 A259 T263 G264 Q265	T173-Y261 HydrophobicContact CG2-CD1 4.11Å; T173-Y261 HydrophobicContact CG2-CD2 3.38Å; T173-Y261 HydrophobicContact CG2-CE2 4.05Å; T173-Y261 HydrophobicContact CG2-CG 3.41Å; T173-Y261 VanDerWaalsContact CG2-CG 3.41Å; N258-Y261 WeakPolarHBondContact O-CB 3.33Å; N258-Y261 PolarHBondContact O-N 2.81Å; A259-Y261 VanDerWaalsContact C-N 3.3Å; A259-Y261 PolarHBondContact O-N 3.14Å; Y261-T263 VanDerWaalsContact C-N 3.33Å; Y261-T263 PolarHBondContact O-N 3.24Å; Y261-G264 PolarHBondContact O-N 3.41Å; Y261-G264 VanDerWaalsContact O-N 3.15Å; Y261-Q265 HydrophobicContact CD2-CG 4.4Å; Y261-Q265 HydrophobicContact CE1-CG 4.15Å; Y261-Q265 HydrophobicContact CE2-CG 3.98Å; Y261-Q265 VanDerWaalsContact CZ-CD 3.41Å; Y261-Q265 WeakPolarHBondContact O-CG 3.42Å; Y261-Q265 PolarHBondContact O-N 2.82Å; Y261-Q265 PolarHBondContact OH-NE2 2.68Å
262	T	90.2	Very high	89.7	Confident	35 Å²	35	56.7 Å²	56.7	22%	0.215	33%	0.325	C	S	.	.	H	α-helix	trans	-61.2	-43	178	-59.2	0	0	0	0	110.9	N258 A259 G264 Q265 V266 T310	N258-T262 PolarHBondContact O-N 3.04Å; N258-T262 PolarHBondContact O-OG1 2.85Å; A259-T262 PolarHBondContact O-N 2.99Å; T262-G264 VanDerWaalsContact C-N 3.35Å; T262-G264 PolarHBondContact O-N 3.48Å; T262-Q265 PolarHBondContact O-N 3.39Å; T262-V266 WeakPolarHBondContact O-CG2 3.23Å; T262-V266 PolarHBondContact O-N 2.57Å; T262-T310 HydrophobicContact CG2-CG2 4.09Å
263	T	92.2	Very high	89.9	Confident	75 Å²	75	57.8 Å²	57.8	46%	0.46	33%	0.326	S	S	.	.	H	α-helix	trans	-60.2	-44.2	173.6	-67	0	0	0	0	111.6	A259 Y261 Q265 V266 F267	A259-T263 WeakPolarHBondContact O-CB 3.33Å; A259-T263 PolarHBondContact O-N 2.6Å; A259-T263 PolarHBondContact O-OG1 2.97Å; Y261-T263 VanDerWaalsContact C-N 3.33Å; Y261-T263 PolarHBondContact O-N 3.24Å; T263-Q265 PolarHBondContact O-N 3.32Å; T263-V266 PolarHBondContact O-N 3.14Å; T263-F267 HydrophobicContact CG2-CD2 3.74Å; T263-F267 HydrophobicContact CG2-CE2 3.38Å; T263-F267 HydrophobicContact CG2-CZ 4.43Å; T263-F267 VanDerWaalsContact O-CD2 3.23Å; T263-F267 WeakPolarHBondContact O-CD2 3.49Å; T263-F267 PolarHBondContact O-N 3.1Å
264	G	91.1	Very high	90	Very high	36 Å²	36	62.6 Å²	62.6	37%	0.371	35%	0.347	S	S	.	.	H	α-helix	trans	-59.9	-40.9	174.6	0	0	0	0	0	113.4	D260 Y261 T262 V266 F267 D268	D260-G264 PolarHBondContact O-N 2.9Å; Y261-G264 PolarHBondContact O-N 3.41Å; Y261-G264 VanDerWaalsContact O-N 3.15Å; T262-G264 VanDerWaalsContact C-N 3.35Å; T262-G264 PolarHBondContact O-N 3.48Å; G264-V266 VanDerWaalsContact C-N 3.32Å; G264-V266 PolarHBondContact O-N 3.08Å; G264-F267 PolarHBondContact O-N 3.11Å; G264-D268 WeakPolarHBondContact O-CB 3.2Å; G264-D268 PolarHBondContact O-N 2.92Å
265	Q	91	Very high	90.1	Very high	14 Å²	14	65.2 Å²	65.2	7%	0.065	36%	0.355	C	S	.	.	H	α-helix	trans	-64.3	-35.6	175	-70.2	-179.1	-71.1	0	0	112.7	Y261 T262 T263 L269 T310	Y261-Q265 HydrophobicContact CD2-CG 4.4Å; Y261-Q265 HydrophobicContact CE1-CG 4.15Å; Y261-Q265 HydrophobicContact CE2-CG 3.98Å; Y261-Q265 VanDerWaalsContact CZ-CD 3.41Å; Y261-Q265 WeakPolarHBondContact O-CG 3.42Å; Y261-Q265 PolarHBondContact O-N 2.82Å; Y261-Q265 PolarHBondContact OH-NE2 2.68Å; T262-Q265 PolarHBondContact O-N 3.39Å; T263-Q265 PolarHBondContact O-N 3.32Å; Q265-L269 VanDerWaalsContact O-CB 3.24Å; Q265-L269 WeakPolarHBondContact O-CB 3.16Å; Q265-L269 PolarHBondContact O-N 3.1Å; Q265-T310 HydrophobicContact CB-CG2 4.13Å
266	V	92.6	Very high	90	Very high	83 Å²	83	63 Å²	63	50%	0.503	34%	0.344	S	S	.	.	H	α-helix	trans	-68.6	-41.9	176.3	173	0	0	0	0	110.8	T262 T263 G264 L269 S270 T310	T262-V266 WeakPolarHBondContact O-CG2 3.23Å; T262-V266 PolarHBondContact O-N 2.57Å; T263-V266 PolarHBondContact O-N 3.14Å; G264-V266 VanDerWaalsContact C-N 3.32Å; G264-V266 PolarHBondContact O-N 3.08Å; V266-L269 PolarHBondContact O-N 3.07Å; V266-S270 PolarHBondContact O-N 3.49Å; V266-T310 HydrophobicContact CG2-CG2 4.25Å
267	F	94.1	Very high	90	Very high	140 Å²	140	63 Å²	63	61%	0.614	34%	0.34	S	S	*	.	H	α-helix	trans	-62.7	-48.3	173.9	-76.3	-59.8	0	0	0	112	T263 G264 L269 S270 E271	T263-F267 HydrophobicContact CG2-CD2 3.74Å; T263-F267 HydrophobicContact CG2-CE2 3.38Å; T263-F267 HydrophobicContact CG2-CZ 4.43Å; T263-F267 VanDerWaalsContact O-CD2 3.23Å; T263-F267 WeakPolarHBondContact O-CD2 3.49Å; T263-F267 PolarHBondContact O-N 3.1Å; G264-F267 PolarHBondContact O-N 3.11Å; F267-L269 VanDerWaalsContact C-N 3.29Å; F267-L269 PolarHBondContact O-N 2.87Å; F267-S270 WeakPolarHBondContact O-CB 3.22Å; F267-S270 PolarHBondContact O-N 3.25Å; F267-S270 VanDerWaalsContact O-N 3.09Å; F267-E271 PolarHBondContact O-N 3.14Å
268	D	92.3	Very high	89.9	Confident	20 Å²	20	62.6 Å²	62.6	11%	0.107	34%	0.343	C	S	.	.	H	α-helix	trans	-58.8	-40.1	176.5	178	75.1	0	0	0	112.1	P207 L208 G264 E271 K272	P207-D268 WeakPolarHBondContact CA-OD1 3.19Å; L208-D268 PolarHBondContact N-OD1 2.81Å; G264-D268 WeakPolarHBondContact O-CB 3.2Å; G264-D268 PolarHBondContact O-N 2.92Å; D268-E271 PolarHBondContact O-N 3.37Å; D268-K272 WeakPolarHBondContact O-CB 3.45Å; D268-K272 VanDerWaalsContact O-CG 3.3Å; D268-K272 WeakPolarHBondContact O-CG 3.45Å; D268-K272 PolarHBondContact O-N 3.23Å; D268-K272 WeakPolarHBondContact OD2-CE 3.45Å; D268-K272 IonicContact OD2-NZ 2.82Å; D268-K272 PolarHBondContact OD2-NZ 2.98Å
269	L	92	Very high	89.5	Confident	23 Å²	23	65.5 Å²	65.5	12%	0.12	36%	0.357	C	S	.	.	H	α-helix	trans	-64.3	-42.4	174.2	178.2	64.1	0	0	0	112	Q265 V266 F267 K272 L273 A303 D306	Q265-L269 VanDerWaalsContact O-CB 3.24Å; Q265-L269 WeakPolarHBondContact O-CB 3.16Å; Q265-L269 PolarHBondContact O-N 3.1Å; V266-L269 PolarHBondContact O-N 3.07Å; F267-L269 VanDerWaalsContact C-N 3.29Å; F267-L269 PolarHBondContact O-N 2.87Å; L269-K272 PolarHBondContact O-N 2.87Å; L269-L273 HydrophobicContact CD1-CD1 4.41Å; L269-L273 HydrophobicContact CD1-CG 4.39Å; L269-L273 HydrophobicContact CG-CD1 4.2Å; L269-L273 VanDerWaalsContact O-CG 3.31Å; L269-L273 WeakPolarHBondContact O-CG 3.35Å; L269-L273 PolarHBondContact O-N 2.7Å; L269-A303 HydrophobicContact CD1-CB 4.02Å; L269-A303 VanDerWaalsContact CD1-O 3.26Å; L269-A303 WeakPolarHBondContact CD1-O 3.43Å; L269-D306 HydrophobicContact CD1-CB 4.36Å
270	S	92.9	Very high	88.8	Confident	53 Å²	53	67.4 Å²	67.4	37%	0.371	36%	0.361	S	S	.	.	H	α-helix	trans	-58.6	-49.3	176.5	-165.9	0	0	0	0	110.8	V266 F267 K272 L273 E274	V266-S270 PolarHBondContact O-N 3.49Å; F267-S270 WeakPolarHBondContact O-CB 3.22Å; F267-S270 PolarHBondContact O-N 3.25Å; F267-S270 VanDerWaalsContact O-N 3.09Å; S270-K272 VanDerWaalsContact C-N 3.33Å; S270-K272 PolarHBondContact O-N 3.41Å; S270-L273 PolarHBondContact O-N 2.84Å; S270-E274 WeakPolarHBondContact O-CG 3.33Å; S270-E274 PolarHBondContact O-N 3.43Å
271	E	91.8	Very high	87.7	Confident	104 Å²	104	63.5 Å²	63.5	49%	0.486	36%	0.355	S	S	.	.	H	α-helix	trans	-62.1	-39.1	177.3	-70.3	-175.3	166.3	0	0	112.1	L208 F267 D268 L273 E274 Q275	L208-E271 HydrophobicContact CD1-CB 3.36Å; F267-E271 PolarHBondContact O-N 3.14Å; D268-E271 PolarHBondContact O-N 3.37Å; E271-L273 VanDerWaalsContact C-N 3.31Å; E271-L273 PolarHBondContact O-N 2.98Å; E271-E274 PolarHBondContact O-N 3.3Å; E271-Q275 WeakPolarHBondContact O-CB 3.11Å; E271-Q275 WeakPolarHBondContact O-CG 3.24Å; E271-Q275 PolarHBondContact O-N 3.31Å
272	K	90.6	Very high	86.3	Confident	16 Å²	16	72.2 Å²	72.2	7%	0.07	39%	0.388	C	S	.	.	H	α-helix	trans	-61.9	-39.5	175.5	-79.7	169.5	176.4	166.3	0	111.9	I206 L208 D268 L269 S270 S276 D306	I206-K272 PolarHBondContact O-NZ 3.15Å; L208-K272 HydrophobicContact CD1-CB 4.43Å; L208-K272 HydrophobicContact CD1-CG 3.69Å; L208-K272 HydrophobicContact CD2-CD 4.48Å; L208-K272 HydrophobicContact CD2-CG 3.58Å; L208-K272 HydrophobicContact CG-CD 4.33Å; L208-K272 HydrophobicContact CG-CG 3.55Å; D268-K272 WeakPolarHBondContact O-CB 3.45Å; D268-K272 VanDerWaalsContact O-CG 3.3Å; D268-K272 WeakPolarHBondContact O-CG 3.45Å; D268-K272 PolarHBondContact O-N 3.23Å; D268-K272 WeakPolarHBondContact OD2-CE 3.45Å; D268-K272 IonicContact OD2-NZ 2.82Å; D268-K272 PolarHBondContact OD2-NZ 2.98Å; L269-K272 PolarHBondContact O-N 2.87Å; S270-K272 VanDerWaalsContact C-N 3.33Å; S270-K272 PolarHBondContact O-N 3.41Å; K272-S276 WeakPolarHBondContact O-CB 3.36Å; K272-S276 PolarHBondContact O-N 2.86Å; K272-S276 VanDerWaalsContact O-N 3.13Å; K272-S276 PolarHBondContact O-OG 3.36Å; K272-D306 IonicContact NZ-OD2 3.77Å; K272-D306 PolarHBondContact NZ-OD2 2.93Å
273	L	90.5	Very high	84.4	Confident	80 Å²	80	72.5 Å²	72.5	42%	0.419	40%	0.397	S	S	.	.	H	α-helix	trans	-69	-46.1	177.4	-70.7	171.2	0	0	0	111	L269 S270 E271 Q275 S276 E277 L300 A303	L269-L273 HydrophobicContact CD1-CD1 4.41Å; L269-L273 HydrophobicContact CD1-CG 4.39Å; L269-L273 HydrophobicContact CG-CD1 4.2Å; L269-L273 VanDerWaalsContact O-CG 3.31Å; L269-L273 WeakPolarHBondContact O-CG 3.35Å; L269-L273 PolarHBondContact O-N 2.7Å; S270-L273 PolarHBondContact O-N 2.84Å; E271-L273 VanDerWaalsContact C-N 3.31Å; E271-L273 PolarHBondContact O-N 2.98Å; L273-Q275 VanDerWaalsContact C-N 3.35Å; L273-Q275 PolarHBondContact O-N 3.02Å; L273-S276 WeakPolarHBondContact O-CB 3.48Å; L273-S276 PolarHBondContact O-N 2.8Å; L273-E277 PolarHBondContact O-N 3.09Å; L273-L300 HydrophobicContact CD2-CD2 4.4Å; L273-A303 HydrophobicContact CD2-CB 3.9Å; L273-A303 HydrophobicContact CG-CB 4.49Å
274	E	90.4	Very high	82.5	Confident	114 Å²	114	74.5 Å²	74.5	53%	0.533	41%	0.414	S	S	.	.	H	α-helix	trans	-58.9	-43.6	176.1	-73	174	-159.6	0	0	112.1	S270 E271 S276 E277 A278	S270-E274 WeakPolarHBondContact O-CG 3.33Å; S270-E274 PolarHBondContact O-N 3.43Å; E271-E274 PolarHBondContact O-N 3.3Å; E274-S276 VanDerWaalsContact C-N 3.29Å; E274-S276 PolarHBondContact O-N 3Å; E274-E277 PolarHBondContact O-N 2.96Å; E274-A278 WeakPolarHBondContact O-CB 3.44Å; E274-A278 PolarHBondContact O-N 2.91Å
275	Q	86.2	Confident	80.7	Confident	96 Å²	96	82.2 Å²	82.2	45%	0.449	44%	0.438	S	S	.	.	H	α-helix	trans	-63.3	-34.7	174.7	-73.7	-175.1	15.3	0	0	112.7	E271 L273 Q279	E271-Q275 WeakPolarHBondContact O-CB 3.11Å; E271-Q275 WeakPolarHBondContact O-CG 3.24Å; E271-Q275 PolarHBondContact O-N 3.31Å; L273-Q275 VanDerWaalsContact C-N 3.35Å; L273-Q275 PolarHBondContact O-N 3.02Å; Q275-Q279 WeakPolarHBondContact O-CG 3.22Å; Q275-Q279 PolarHBondContact O-N 3.46Å
276	S	85.8	Confident	78.5	Confident	8 Å²	8	89.3 Å²	89.3	6%	0.056	47%	0.473	C	S	.	.	H	α-helix	trans	-72.4	-41.7	177.9	-59.5	0	0	0	0	111.1	K272 L273 E274 Q279 L280	K272-S276 WeakPolarHBondContact O-CB 3.36Å; K272-S276 PolarHBondContact O-N 2.86Å; K272-S276 VanDerWaalsContact O-N 3.13Å; K272-S276 PolarHBondContact O-OG 3.36Å; L273-S276 WeakPolarHBondContact O-CB 3.48Å; L273-S276 PolarHBondContact O-N 2.8Å; E274-S276 VanDerWaalsContact C-N 3.29Å; E274-S276 PolarHBondContact O-N 3Å; S276-Q279 PolarHBondContact O-N 2.88Å; S276-L280 WeakPolarHBondContact O-CG 3.22Å; S276-L280 PolarHBondContact O-N 2.65Å; S276-L280 VanDerWaalsContact O-N 3.15Å
277	E	86.3	Confident	76.2	Confident	141 Å²	141	94.3 Å²	94.3	66%	0.659	50%	0.496	S	S	*	.	H	α-helix	trans	-62	-47.7	175.5	-175.9	179.8	-173.3	0	0	111.8	L273 E274 Q279 L280 G281	L273-E277 PolarHBondContact O-N 3.09Å; E274-E277 PolarHBondContact O-N 2.96Å; E277-Q279 PolarHBondContact O-N 3.36Å; E277-Q279 VanDerWaalsContact O-N 3.14Å; E277-L280 PolarHBondContact O-N 3.42Å; E277-L280 VanDerWaalsContact O-N 3.07Å; E277-G281 PolarHBondContact O-N 2.93Å
278	A	84.1	Confident	73.9	Confident	57 Å²	57	90.8 Å²	90.8	47%	0.471	50%	0.499	S	S	.	.	H	α-helix	trans	-59.1	-28.4	178.6	0	0	0	0	0	113	E274 R282	E274-A278 WeakPolarHBondContact O-CB 3.44Å; E274-A278 PolarHBondContact O-N 2.91Å; A278-R282 WeakPolarHBondContact O-CG 3.41Å
279	Q	76.6	Confident	71.6	Confident	69 Å²	69	95.1 Å²	95.1	32%	0.322	52%	0.522	S	S	.	.	H	α-helix	trans	-79.3	-38	175.9	-71.2	-175	-3.5	0	0	112.5	Q275 S276 E277 R282 G283 K299	Q275-Q279 WeakPolarHBondContact O-CG 3.22Å; Q275-Q279 PolarHBondContact O-N 3.46Å; S276-Q279 PolarHBondContact O-N 2.88Å; E277-Q279 PolarHBondContact O-N 3.36Å; E277-Q279 VanDerWaalsContact O-N 3.14Å; Q279-R282 PolarHBondContact O-N 3.49Å; Q279-G283 PolarHBondContact O-N 2.74Å; Q279-K299 VanDerWaalsContact CD-NZ 3.28Å
280	L	76.5	Confident	69.4	Low	78 Å²	78	102.2 Å²	102.2	41%	0.408	55%	0.554	S	S	.	*	H	α-helix	trans	-64.3	-42.3	174	-70.3	169.2	0	0	0	111.5	S276 E277 R282 G283 L300	S276-L280 WeakPolarHBondContact O-CG 3.22Å; S276-L280 PolarHBondContact O-N 2.65Å; S276-L280 VanDerWaalsContact O-N 3.15Å; E277-L280 PolarHBondContact O-N 3.42Å; E277-L280 VanDerWaalsContact O-N 3.07Å; L280-R282 PolarHBondContact O-N 3Å; L280-G283 PolarHBondContact O-N 2.96Å; L280-L300 HydrophobicContact CD1-CD1 4.18Å
281	G	65.7	Low	67.3	Low	62 Å²	62	103.4 Å²	103.4	64%	0.639	56%	0.56	S	S	*	*	H	α-helix	trans	-62.3	-25.1	178.1	0	0	0	0	0	114.5	E277	E277-G281 PolarHBondContact O-N 2.93Å
282	R	59.2	Low	65.1	Low	213 Å²	213	103.1 Å²	103.1	80%	0.804	56%	0.558	S	S	*	*	H	α-helix	trans	-84.3	-19.8	174.3	-68.7	-177.4	-174	-169.7	3.2	113.4	A278 Q279 L280	A278-R282 WeakPolarHBondContact O-CG 3.41Å; Q279-R282 PolarHBondContact O-N 3.49Å; L280-R282 PolarHBondContact O-N 3Å
283	G	50.9	Low	63.2	Low	40 Å²	40	107.3 Å²	107.3	41%	0.412	58%	0.581	S	S	.	*	H	α-helix	trans	-73.3	-27.4	-177.2	0	0	0	0	0	114.3	Q279 L280 F285 M286	Q279-G283 PolarHBondContact O-N 2.74Å; L280-G283 PolarHBondContact O-N 2.96Å; G283-F285 PolarHBondContact O-N 3.05Å; G283-M286 PolarHBondContact O-N 2.67Å
284	S	51.8	Low	61.4	Low	117 Å²	117	112.7 Å²	112.7	82%	0.818	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-12.2	-177.1	-67.1	0	0	0	0	115.2
285	F	53.1	Low	59.9	Low	199 Å²	199	114 Å²	114	87%	0.873	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.5	-9	179.3	-159	-101.6	0	0	0	114.9	G283	G283-F285 PolarHBondContact O-N 3.05Å
286	M	45	Very low	58.5	Low	163 Å²	163	109.9 Å²	109.9	80%	0.803	58%	0.582	S	S	*	*			trans	-117.5	87.8	-178.8	-149.6	176.9	-81.4	0	0	110.8	G283 G288	G283-M286 PolarHBondContact O-N 2.67Å; M286-G288 PolarHBondContact O-N 3Å
287	L	43.6	Very low	57.3	Low	187 Å²	187	116 Å²	116	98%	0.979	61%	0.61	S	S	*	*			trans	-62.8	92.6	173.2	-165	111.2	0	0	0	109.8
288	G	46	Very low	57	Low	67 Å²	67	112.5 Å²	112.5	69%	0.691	60%	0.595	S	S	*	*			trans	127.1	80	166.3	0	0	0	0	0	115	M286	M286-G288 PolarHBondContact O-N 3Å
289	L	44.7	Very low	56.9	Low	110 Å²	110	113 Å²	113	58%	0.576	59%	0.587	S	S	*	*			trans	-161.8	99.6	146.2	-160.6	66.7	0	0	0	110.6	T291 H292	L289-T291 WeakPolarHBondContact CD2-OG1 3.34Å; L289-T291 HydrophobicContact CG-CG2 4.28Å; L289-T291 WeakPolarHBondContact CG-OG1 3.46Å; L289-T291 PolarHBondContact O-N 3Å; L289-H292 PolarHBondContact O-N 3.07Å
290	E	46.2	Very low	57.3	Low	172 Å²	172	113 Å²	113	80%	0.804	59%	0.589	S	S	*	*	H	α-helix	trans	-51.8	-14.8	174.4	-61.1	-179.1	153	0	0	114.1
291	T	48.1	Very low	57.8	Low	79 Å²	79	111.3 Å²	111.3	49%	0.485	59%	0.586	S	S	.	*	H	α-helix	trans	-79.8	-19.5	177.7	74.2	0	0	0	0	114.1	L289	L289-T291 WeakPolarHBondContact CD2-OG1 3.34Å; L289-T291 HydrophobicContact CG-CG2 4.28Å; L289-T291 WeakPolarHBondContact CG-OG1 3.46Å; L289-T291 PolarHBondContact O-N 3Å
292	H	46.1	Very low	58.8	Low	98 Å²	98	111.5 Å²	111.5	45%	0.454	57%	0.569	S	S	.	*	H	α-helix	trans	-83.4	-37.8	-178.2	-143.7	-76.7	0	0	0	111.8	L289 K295 S296	L289-H292 PolarHBondContact O-N 3.07Å; H292-K295 PolarHBondContact O-N 2.97Å; H292-S296 PolarHBondContact O-N 3.3Å; H292-S296 VanDerWaalsContact O-N 3.15Å; H292-S296 PolarHBondContact O-OG 3.07Å
293	D	50.4	Low	60.2	Low	103 Å²	103	101.5 Å²	101.5	55%	0.551	53%	0.532	S	S	*	.	H	α-helix	trans	-64.7	-40.2	178.4	-69.1	-33.3	0	0	0	112.5	K295 S296 E297	D293-K295 VanDerWaalsContact C-N 3.28Å; D293-K295 PolarHBondContact O-N 2.75Å; D293-S296 WeakPolarHBondContact CA-OG 3.44Å; D293-S296 PolarHBondContact O-N 3.09Å; D293-S296 PolarHBondContact O-OG 3.32Å; D293-E297 WeakPolarHBondContact O-CB 3.44Å; D293-E297 WeakPolarHBondContact O-CG 3.43Å; D293-E297 PolarHBondContact O-N 3.36Å
294	R	53.8	Low	62	Low	193 Å²	193	103.6 Å²	103.6	73%	0.728	54%	0.537	S	S	*	.	H	α-helix	trans	-63.7	-33.1	175.9	-70.9	-174.7	177.3	-179.3	1.7	113.1	D298	R294-D298 WeakPolarHBondContact O-CB 3.25Å; R294-D298 PolarHBondContact O-N 3.48Å
295	K	57.9	Low	63.8	Low	142 Å²	142	104 Å²	104	62%	0.617	52%	0.521	S	S	*	.	H	α-helix	trans	-75.3	-36.1	179	-75.6	-177.6	179.4	178.5	0	112.1	H292 D293 K299	H292-K295 PolarHBondContact O-N 2.97Å; D293-K295 VanDerWaalsContact C-N 3.28Å; D293-K295 PolarHBondContact O-N 2.75Å; K295-K299 WeakPolarHBondContact O-CG 3.25Å; K295-K299 PolarHBondContact O-N 3.18Å
296	S	57	Low	65.6	Low	10 Å²	10	94.7 Å²	94.7	7%	0.07	48%	0.48	C	S	.	.	H	α-helix	trans	-73	-41.1	176	51.8	0	0	0	0	111.8	H292 D293 D298 K299 L300	H292-S296 PolarHBondContact O-N 3.3Å; H292-S296 VanDerWaalsContact O-N 3.15Å; H292-S296 PolarHBondContact O-OG 3.07Å; D293-S296 WeakPolarHBondContact CA-OG 3.44Å; D293-S296 PolarHBondContact O-N 3.09Å; D293-S296 PolarHBondContact O-OG 3.32Å; S296-D298 VanDerWaalsContact C-N 3.3Å; S296-D298 PolarHBondContact O-N 3.07Å; S296-K299 PolarHBondContact O-N 3.36Å; S296-K299 VanDerWaalsContact O-N 3.17Å; S296-L300 PolarHBondContact O-N 3.41Å
297	E	60.1	Low	67.8	Low	136 Å²	136	89.1 Å²	89.1	64%	0.636	46%	0.457	S	S	*	.	H	α-helix	trans	-58	-42.2	172.2	-76.6	-176.2	164.5	0	0	111.7	D293 K299 L300 A301	D293-E297 WeakPolarHBondContact O-CB 3.44Å; D293-E297 WeakPolarHBondContact O-CG 3.43Å; D293-E297 PolarHBondContact O-N 3.36Å; E297-K299 VanDerWaalsContact C-N 3.34Å; E297-K299 PolarHBondContact O-N 3.3Å; E297-L300 PolarHBondContact O-N 3.1Å; E297-A301 VanDerWaalsContact O-CB 3.29Å; E297-A301 WeakPolarHBondContact O-CB 3.34Å; E297-A301 PolarHBondContact O-N 3.29Å
298	D	80.3	Confident	70.1	Confident	67 Å²	67	83.3 Å²	83.3	36%	0.358	43%	0.431	S	S	.	.	H	α-helix	trans	-64.4	-36.7	176.9	-174.8	38.3	0	0	0	112.2	R294 S296 K302	R294-D298 WeakPolarHBondContact O-CB 3.25Å; R294-D298 PolarHBondContact O-N 3.48Å; S296-D298 VanDerWaalsContact C-N 3.3Å; S296-D298 PolarHBondContact O-N 3.07Å; D298-K302 WeakPolarHBondContact O-CB 3.47Å; D298-K302 WeakPolarHBondContact O-CD 3.24Å; D298-K302 WeakPolarHBondContact O-CG 3.36Å; D298-K302 PolarHBondContact O-N 3.03Å; D298-K302 WeakPolarHBondContact OD1-CE 3.31Å; D298-K302 IonicContact OD1-NZ 3.93Å; D298-K302 VanDerWaalsContact OD2-CE 3.25Å; D298-K302 WeakPolarHBondContact OD2-CE 3.47Å; D298-K302 IonicContact OD2-NZ 2.57Å; D298-K302 PolarHBondContact OD2-NZ 3.16Å
299	K	81.4	Confident	72.2	Confident	69 Å²	69	83.1 Å²	83.1	30%	0.3	41%	0.411	S	S	.	.	H	α-helix	trans	-67.9	-45.6	175.7	-76	-175.6	174.7	-167	0	113	Q279 K295 S296 E297 A301 K302 A303	Q279-K299 VanDerWaalsContact CD-NZ 3.28Å; K295-K299 WeakPolarHBondContact O-CG 3.25Å; K295-K299 PolarHBondContact O-N 3.18Å; S296-K299 PolarHBondContact O-N 3.36Å; S296-K299 VanDerWaalsContact O-N 3.17Å; E297-K299 VanDerWaalsContact C-N 3.34Å; E297-K299 PolarHBondContact O-N 3.3Å; K299-A301 VanDerWaalsContact C-N 3.31Å; K299-A301 PolarHBondContact O-N 2.89Å; K299-K302 WeakPolarHBondContact O-CB 3.3Å; K299-K302 PolarHBondContact O-N 2.91Å; K299-A303 PolarHBondContact O-N 3.17Å
300	L	85.2	Confident	74.3	Confident	68 Å²	68	78.4 Å²	78.4	36%	0.356	39%	0.387	S	S	.	.	H	α-helix	trans	-64.2	-38.2	175.8	-72.2	177.4	0	0	0	111.5	L273 L280 S296 E297 K302 A303 T304	L273-L300 HydrophobicContact CD2-CD2 4.4Å; L280-L300 HydrophobicContact CD1-CD1 4.18Å; S296-L300 PolarHBondContact O-N 3.41Å; E297-L300 PolarHBondContact O-N 3.1Å; L300-K302 VanDerWaalsContact C-N 3.31Å; L300-K302 PolarHBondContact O-N 2.86Å; L300-A303 PolarHBondContact O-N 3.4Å; L300-T304 WeakPolarHBondContact O-CB 3.28Å; L300-T304 PolarHBondContact O-N 3.14Å; L300-T304 PolarHBondContact O-OG1 3.34Å
301	A	86.9	Confident	76.5	Confident	43 Å²	43	73.6 Å²	73.6	36%	0.355	37%	0.37	S	S	.	.	H	α-helix	trans	-64	-35.8	174.2	0	0	0	0	0	112.4	E297 K299 R305	E297-A301 VanDerWaalsContact O-CB 3.29Å; E297-A301 WeakPolarHBondContact O-CB 3.34Å; E297-A301 PolarHBondContact O-N 3.29Å; K299-A301 VanDerWaalsContact C-N 3.31Å; K299-A301 PolarHBondContact O-N 2.89Å; A301-R305 WeakPolarHBondContact O-CG 3.39Å; A301-R305 PolarHBondContact O-N 2.97Å; A301-R305 VanDerWaalsContact O-N 3.1Å; A301-R305 PolarHBondContact O-NE 3.1Å
302	K	87.2	Confident	78.5	Confident	66 Å²	66	74 Å²	74	29%	0.287	37%	0.368	S	S	.	.	H	α-helix	trans	-68	-47.2	173.2	-76.4	169.5	179.6	166.8	0	112	Y203 D298 K299 L300 T304 R305 D306	Y203-K302 HydrophobicContact CD2-CD 4.01Å; Y203-K302 HydrophobicContact CD2-CG 3.77Å; Y203-K302 HydrophobicContact CE1-CB 4.18Å; Y203-K302 HydrophobicContact CE1-CG 4.24Å; Y203-K302 HydrophobicContact CE2-CB 3.83Å; Y203-K302 HydrophobicContact CE2-CD 3.6Å; Y203-K302 HydrophobicContact CE2-CG 3.42Å; Y203-K302 VanDerWaalsContact CE2-CG 3.42Å; Y203-K302 HydrophobicContact CG-CG 4.33Å; Y203-K302 WeakPolarHBondContact OH-CB 3.24Å; D298-K302 WeakPolarHBondContact O-CB 3.47Å; D298-K302 WeakPolarHBondContact O-CD 3.24Å; D298-K302 WeakPolarHBondContact O-CG 3.36Å; D298-K302 PolarHBondContact O-N 3.03Å; D298-K302 WeakPolarHBondContact OD1-CE 3.31Å; D298-K302 IonicContact OD1-NZ 3.93Å; D298-K302 VanDerWaalsContact OD2-CE 3.25Å; D298-K302 WeakPolarHBondContact OD2-CE 3.47Å; D298-K302 IonicContact OD2-NZ 2.57Å; D298-K302 PolarHBondContact OD2-NZ 3.16Å; K299-K302 WeakPolarHBondContact O-CB 3.3Å; K299-K302 PolarHBondContact O-N 2.91Å; L300-K302 VanDerWaalsContact C-N 3.31Å; L300-K302 PolarHBondContact O-N 2.86Å; K302-T304 VanDerWaalsContact C-N 3.28Å; K302-T304 PolarHBondContact O-N 3.3Å; K302-R305 WeakPolarHBondContact O-CB 3.13Å; K302-R305 PolarHBondContact O-N 3.11Å; K302-R305 VanDerWaalsContact O-N 3.11Å; K302-D306 PolarHBondContact O-N 3.36Å
303	A	88	Confident	80.5	Confident	3 Å²	3	71.1 Å²	71.1	3%	0.025	36%	0.355	C	S	.	.	H	α-helix	trans	-60	-38.8	174.8	0	0	0	0	0	112	L269 L273 K299 L300 D306 S307	L269-A303 HydrophobicContact CD1-CB 4.02Å; L269-A303 VanDerWaalsContact CD1-O 3.26Å; L269-A303 WeakPolarHBondContact CD1-O 3.43Å; L273-A303 HydrophobicContact CD2-CB 3.9Å; L273-A303 HydrophobicContact CG-CB 4.49Å; K299-A303 PolarHBondContact O-N 3.17Å; L300-A303 PolarHBondContact O-N 3.4Å; A303-D306 PolarHBondContact O-N 2.86Å; A303-S307 WeakPolarHBondContact O-CB 3.37Å; A303-S307 PolarHBondContact O-N 3.39Å
304	T	89.8	Confident	82.4	Confident	83 Å²	83	67.6 Å²	67.6	51%	0.509	34%	0.34	S	S	.	.	H	α-helix	trans	-62.7	-42.9	174.5	-56.9	0	0	0	0	111.4	L300 K302 S307 C308	L300-T304 WeakPolarHBondContact O-CB 3.28Å; L300-T304 PolarHBondContact O-N 3.14Å; L300-T304 PolarHBondContact O-OG1 3.34Å; K302-T304 VanDerWaalsContact C-N 3.28Å; K302-T304 PolarHBondContact O-N 3.3Å; T304-S307 PolarHBondContact O-N 3.36Å; T304-C308 WeakPolarHBondContact O-CB 3.31Å; T304-C308 PolarHBondContact O-N 3.17Å; T304-C308 PolarHBondContact O-SG 2.98Å
305	R	89.1	Confident	84.2	Confident	126 Å²	126	62.3 Å²	62.3	48%	0.475	33%	0.325	S	S	.	.	H	α-helix	trans	-61.6	-44.2	175.4	-78.8	-176.3	-98.5	-172.7	-5.9	112.1	Y203 A301 K302 C308 K309	Y203-R305 HydrophobicContact CD1-CB 4.35Å; Y203-R305 HydrophobicContact CE1-CB 4.18Å; A301-R305 WeakPolarHBondContact O-CG 3.39Å; A301-R305 PolarHBondContact O-N 2.97Å; A301-R305 VanDerWaalsContact O-N 3.1Å; A301-R305 PolarHBondContact O-NE 3.1Å; K302-R305 WeakPolarHBondContact O-CB 3.13Å; K302-R305 PolarHBondContact O-N 3.11Å; K302-R305 VanDerWaalsContact O-N 3.11Å; R305-C308 PolarHBondContact O-N 3.4Å; R305-K309 WeakPolarHBondContact O-CB 3.27Å; R305-K309 PolarHBondContact O-N 3.44Å
306	D	90	Very high	85.6	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.021	32%	0.322	C	S	.	.	H	α-helix	trans	-62.7	-44.3	176.3	-75	-10.6	0	0	0	111.6	Y203 T205 L269 K272 K302 A303 K309 T310	Y203-D306 WeakPolarHBondContact CE1-OD1 3.33Å; Y203-D306 PolarHBondContact OH-OD1 3.38Å; Y203-D306 PolarHBondContact OH-OD2 3.48Å; Y203-D306 VanDerWaalsContact OH-OD2 3.05Å; T205-D306 VanDerWaalsContact CB-OD1 3.25Å; T205-D306 WeakPolarHBondContact CB-OD1 3.32Å; T205-D306 HydrophobicContact CG2-CB 4.44Å; T205-D306 VanDerWaalsContact CG2-OD1 3.25Å; T205-D306 WeakPolarHBondContact CG2-OD1 3.49Å; T205-D306 PolarHBondContact OG1-OD1 2.88Å; L269-D306 HydrophobicContact CD1-CB 4.36Å; K272-D306 IonicContact NZ-OD2 3.77Å; K272-D306 PolarHBondContact NZ-OD2 2.93Å; K302-D306 PolarHBondContact O-N 3.36Å; A303-D306 PolarHBondContact O-N 2.86Å; D306-K309 PolarHBondContact O-N 3.28Å; D306-T310 PolarHBondContact O-N 3.06Å; D306-T310 PolarHBondContact O-OG1 3.02Å; D306-T310 VanDerWaalsContact O-OG1 3.08Å
307	S	92.5	Very high	87.2	Confident	46 Å²	46	60.8 Å²	60.8	32%	0.322	32%	0.319	S	S	.	.	H	α-helix	trans	-60.1	-47.8	175.8	-175.8	0	0	0	0	112.8	A303 T304 K309 T310 T311	A303-S307 WeakPolarHBondContact O-CB 3.37Å; A303-S307 PolarHBondContact O-N 3.39Å; T304-S307 PolarHBondContact O-N 3.36Å; S307-K309 VanDerWaalsContact C-N 3.32Å; S307-K309 PolarHBondContact O-N 3.27Å; S307-T310 PolarHBondContact O-N 2.94Å; S307-T311 WeakPolarHBondContact O-CB 3.26Å; S307-T311 PolarHBondContact O-N 3.15Å; S307-T311 PolarHBondContact O-OG1 3.05Å
308	C	92.5	Very high	88.7	Confident	65 Å²	65	59.2 Å²	59.2	44%	0.439	31%	0.314	S	S	.	.	H	α-helix	trans	-59.5	-44.2	176.4	-74.4	0	0	0	0	111.3	T304 R305 T311 I312	T304-C308 WeakPolarHBondContact O-CB 3.31Å; T304-C308 PolarHBondContact O-N 3.17Å; T304-C308 PolarHBondContact O-SG 2.98Å; R305-C308 PolarHBondContact O-N 3.4Å; C308-T311 PolarHBondContact O-N 2.96Å; C308-I312 WeakPolarHBondContact O-CB 3.43Å; C308-I312 WeakPolarHBondContact O-CD1 3.44Å; C308-I312 WeakPolarHBondContact O-CG1 3.43Å; C308-I312 PolarHBondContact O-N 3.2Å
309	K	89.1	Confident	89.3	Confident	62 Å²	62	60.9 Å²	60.9	27%	0.27	32%	0.321	S	S	.	.	H	α-helix	trans	-60.1	-52.8	178.5	-177	-174.4	174.6	-170.7	0	111.6	R305 D306 S307 T311 I312 E313	R305-K309 WeakPolarHBondContact O-CB 3.27Å; R305-K309 PolarHBondContact O-N 3.44Å; D306-K309 PolarHBondContact O-N 3.28Å; S307-K309 VanDerWaalsContact C-N 3.32Å; S307-K309 PolarHBondContact O-N 3.27Å; K309-T311 VanDerWaalsContact C-N 3.27Å; K309-T311 PolarHBondContact O-N 3.29Å; K309-I312 PolarHBondContact O-N 2.78Å; K309-E313 WeakPolarHBondContact CE-OE1 3.5Å; K309-E313 PolarHBondContact O-N 3.2Å
310	T	89.2	Confident	89.7	Confident	12 Å²	12	59.8 Å²	59.8	7%	0.074	32%	0.322	C	S	.	.	H	α-helix	trans	-58.9	-40.9	178.9	-55.4	0	0	0	0	111.5	T262 Q265 V266 D306 S307 E313 A314	T262-T310 HydrophobicContact CG2-CG2 4.09Å; Q265-T310 HydrophobicContact CB-CG2 4.13Å; V266-T310 HydrophobicContact CG2-CG2 4.25Å; D306-T310 PolarHBondContact O-N 3.06Å; D306-T310 PolarHBondContact O-OG1 3.02Å; D306-T310 VanDerWaalsContact O-OG1 3.08Å; S307-T310 PolarHBondContact O-N 2.94Å; T310-E313 PolarHBondContact O-N 2.97Å; T310-A314 PolarHBondContact O-N 3.48Å; T310-A314 VanDerWaalsContact O-N 3.07Å
311	T	91.6	Very high	90	Very high	70 Å²	70	59.7 Å²	59.7	43%	0.429	32%	0.32	S	S	.	.	H	α-helix	trans	-64.5	-44.7	177.9	-58.2	0	0	0	0	112	S307 C308 K309 E313 A314 I315	S307-T311 WeakPolarHBondContact O-CB 3.26Å; S307-T311 PolarHBondContact O-N 3.15Å; S307-T311 PolarHBondContact O-OG1 3.05Å; C308-T311 PolarHBondContact O-N 2.96Å; K309-T311 VanDerWaalsContact C-N 3.27Å; K309-T311 PolarHBondContact O-N 3.29Å; T311-E313 PolarHBondContact O-N 3.31Å; T311-A314 PolarHBondContact O-N 2.89Å; T311-I315 HydrophobicContact CG2-CD1 3.74Å; T311-I315 HydrophobicContact CG2-CG1 4.38Å; T311-I315 WeakPolarHBondContact O-CB 3.39Å; T311-I315 VanDerWaalsContact O-CG1 3.27Å; T311-I315 WeakPolarHBondContact O-CG1 3.42Å; T311-I315 PolarHBondContact O-N 3.37Å
312	I	90.3	Very high	90.3	Very high	88 Å²	88	61.9 Å²	61.9	45%	0.451	33%	0.329	S	S	.	.	H	α-helix	trans	-62.1	-43.8	177.9	-71.1	164.5	0	0	0	110.8	C308 K309 A314 I315 H316	C308-I312 WeakPolarHBondContact O-CB 3.43Å; C308-I312 WeakPolarHBondContact O-CD1 3.44Å; C308-I312 WeakPolarHBondContact O-CG1 3.43Å; C308-I312 PolarHBondContact O-N 3.2Å; K309-I312 PolarHBondContact O-N 2.78Å; I312-A314 PolarHBondContact O-N 3.45Å; I312-I315 PolarHBondContact O-N 2.79Å; I312-H316 VanDerWaalsContact CG2-CE1 3.47Å; I312-H316 WeakPolarHBondContact CG2-CE1 3.5Å; I312-H316 WeakPolarHBondContact O-CB 3.36Å; I312-H316 VanDerWaalsContact O-CG 3.3Å; I312-H316 PolarHBondContact O-N 3.06Å
313	E	88	Confident	90.5	Very high	38 Å²	38	63.1 Å²	63.1	18%	0.178	34%	0.337	C	S	.	.	H	α-helix	trans	-61.4	-44.1	177.9	-71.2	-179	-160.6	0	0	111.7	S177 K309 T310 T311 H316 G317	S177-E313 PolarHBondContact OG-OE2 2.92Å; K309-E313 WeakPolarHBondContact CE-OE1 3.5Å; K309-E313 PolarHBondContact O-N 3.2Å; T310-E313 PolarHBondContact O-N 2.97Å; T311-E313 PolarHBondContact O-N 3.31Å; E313-H316 PolarHBondContact O-N 3.42Å; E313-G317 PolarHBondContact O-N 3.13Å
314	A	89.6	Confident	90.6	Very high	29 Å²	29	64.5 Å²	64.5	24%	0.24	34%	0.343	C	S	.	.	H	α-helix	trans	-64.3	-43.9	176.1	0	0	0	0	0	112.5	T310 T311 I312 G317 L318	T310-A314 PolarHBondContact O-N 3.48Å; T310-A314 VanDerWaalsContact O-N 3.07Å; T311-A314 PolarHBondContact O-N 2.89Å; I312-A314 PolarHBondContact O-N 3.45Å; A314-G317 PolarHBondContact O-N 2.85Å; A314-L318 WeakPolarHBondContact O-CG 3.18Å; A314-L318 PolarHBondContact O-N 3.17Å
315	I	91.6	Very high	90.7	Very high	81 Å²	81	63.5 Å²	63.5	42%	0.415	33%	0.334	S	S	.	.	H	α-helix	trans	-62.7	-45.1	177.1	-70.8	171	0	0	0	110.7	T311 I312 G317 L318 M319	T311-I315 HydrophobicContact CG2-CD1 3.74Å; T311-I315 HydrophobicContact CG2-CG1 4.38Å; T311-I315 WeakPolarHBondContact O-CB 3.39Å; T311-I315 VanDerWaalsContact O-CG1 3.27Å; T311-I315 WeakPolarHBondContact O-CG1 3.42Å; T311-I315 PolarHBondContact O-N 3.37Å; I312-I315 PolarHBondContact O-N 2.79Å; I315-G317 VanDerWaalsContact C-N 3.28Å; I315-G317 PolarHBondContact O-N 3.03Å; I315-L318 PolarHBondContact O-N 3.23Å; I315-M319 HydrophobicContact CG2-CG 4.1Å; I315-M319 HydrophobicContact CG2-SD 3.76Å; I315-M319 WeakPolarHBondContact O-CB 3.29Å; I315-M319 VanDerWaalsContact O-CG 3.3Å; I315-M319 WeakPolarHBondContact O-CG 3.19Å; I315-M319 PolarHBondContact O-N 2.94Å
316	H	89.1	Confident	90.8	Very high	121 Å²	121	63 Å²	63	56%	0.56	34%	0.336	S	S	*	.	H	α-helix	trans	-58.5	-41.7	176	-75.1	171.2	0	0	0	112	I312 E313 S320	I312-H316 VanDerWaalsContact CG2-CE1 3.47Å; I312-H316 WeakPolarHBondContact CG2-CE1 3.5Å; I312-H316 WeakPolarHBondContact O-CB 3.36Å; I312-H316 VanDerWaalsContact O-CG 3.3Å; I312-H316 PolarHBondContact O-N 3.06Å; E313-H316 PolarHBondContact O-N 3.42Å; H316-S320 WeakPolarHBondContact O-CB 3.3Å; H316-S320 PolarHBondContact O-N 3.4Å
317	G	89.6	Confident	90.8	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-60.2	-46.7	174.1	0	0	0	0	0	112.7	S254 E313 A314 I315 S320 Q321	S254-G317 VanDerWaalsContact OG-CA 3.32Å; S254-G317 WeakPolarHBondContact OG-CA 3.34Å; E313-G317 PolarHBondContact O-N 3.13Å; A314-G317 PolarHBondContact O-N 2.85Å; I315-G317 VanDerWaalsContact C-N 3.28Å; I315-G317 PolarHBondContact O-N 3.03Å; G317-S320 WeakPolarHBondContact O-CB 3.4Å; G317-S320 PolarHBondContact O-N 3.44Å; G317-Q321 PolarHBondContact O-N 2.76Å
318	L	91.9	Very high	90.6	Very high	102 Å²	102	71.1 Å²	71.1	53%	0.534	37%	0.369	S	S	.	.	H	α-helix	trans	-63.6	-47.1	177.8	-72.5	168.1	0	0	0	111.9	L255 A314 I315 S320 Q321 V322	L255-L318 HydrophobicContact CD1-CD2 3.63Å; L255-L318 HydrophobicContact CD1-CG 3.94Å; L255-L318 HydrophobicContact CD2-CG 4.41Å; A314-L318 WeakPolarHBondContact O-CG 3.18Å; A314-L318 PolarHBondContact O-N 3.17Å; I315-L318 PolarHBondContact O-N 3.23Å; L318-S320 VanDerWaalsContact C-N 3.29Å; L318-S320 PolarHBondContact O-N 2.7Å; L318-Q321 PolarHBondContact O-N 3.5Å; L318-Q321 VanDerWaalsContact O-N 3.09Å; L318-V322 WeakPolarHBondContact O-CG2 3.29Å; L318-V322 PolarHBondContact O-N 2.96Å
319	M	92.2	Very high	90.4	Very high	103 Å²	103	73.1 Å²	73.1	51%	0.507	38%	0.375	S	S	.	.	H	α-helix	trans	-57.1	-43.5	177	-73.4	177.6	68.7	0	0	111.4	I315 Q321 V322 I323	I315-M319 HydrophobicContact CG2-CG 4.1Å; I315-M319 HydrophobicContact CG2-SD 3.76Å; I315-M319 WeakPolarHBondContact O-CB 3.29Å; I315-M319 VanDerWaalsContact O-CG 3.3Å; I315-M319 WeakPolarHBondContact O-CG 3.19Å; I315-M319 PolarHBondContact O-N 2.94Å; M319-Q321 VanDerWaalsContact C-N 3.31Å; M319-Q321 PolarHBondContact O-N 3.44Å; M319-V322 PolarHBondContact O-N 3.41Å; M319-I323 WeakPolarHBondContact O-CB 3.44Å; M319-I323 VanDerWaalsContact O-CG1 3.26Å; M319-I323 WeakPolarHBondContact O-CG1 3.46Å; M319-I323 PolarHBondContact O-N 3.15Å
320	S	90.8	Very high	90.3	Very high	45 Å²	45	73.5 Å²	73.5	32%	0.315	38%	0.378	S	S	.	.	H	α-helix	trans	-58.1	-42.6	176.3	-170.2	0	0	0	0	111.9	H316 G317 L318 K324	H316-S320 WeakPolarHBondContact O-CB 3.3Å; H316-S320 PolarHBondContact O-N 3.4Å; G317-S320 WeakPolarHBondContact O-CB 3.4Å; G317-S320 PolarHBondContact O-N 3.44Å; L318-S320 VanDerWaalsContact C-N 3.29Å; L318-S320 PolarHBondContact O-N 2.7Å; S320-K324 VanDerWaalsContact O-CG 3.22Å; S320-K324 WeakPolarHBondContact O-CG 3.25Å; S320-K324 PolarHBondContact O-N 2.94Å; S320-K324 WeakPolarHBondContact OG-CE 3.44Å
321	Q	91	Very high	89.5	Confident	66 Å²	66	78.2 Å²	78.2	31%	0.308	40%	0.402	S	S	.	.	H	α-helix	trans	-68.8	-41.8	177.9	-64.8	-54.3	-42	0	0	112.7	S253 L255 G317 L318 M319 I323 K324 D325	S253-Q321 VanDerWaalsContact CB-NE2 3.3Å; S253-Q321 PolarHBondContact OG-NE2 3.3Å; S253-Q321 VanDerWaalsContact OG-NE2 3.11Å; L255-Q321 HydrophobicContact CD1-CG 4.24Å; G317-Q321 PolarHBondContact O-N 2.76Å; L318-Q321 PolarHBondContact O-N 3.5Å; L318-Q321 VanDerWaalsContact O-N 3.09Å; M319-Q321 VanDerWaalsContact C-N 3.31Å; M319-Q321 PolarHBondContact O-N 3.44Å; Q321-I323 VanDerWaalsContact C-N 3.34Å; Q321-I323 PolarHBondContact O-N 3.44Å; Q321-K324 PolarHBondContact O-N 3.15Å; Q321-D325 PolarHBondContact O-N 2.92Å
322	V	92.6	Very high	88.5	Confident	89 Å²	89	82 Å²	82	54%	0.539	42%	0.419	S	S	.	.	H	α-helix	trans	-61.7	-43.2	176.4	173.6	0	0	0	0	111	L318 M319 D325 K326	L318-V322 WeakPolarHBondContact O-CG2 3.29Å; L318-V322 PolarHBondContact O-N 2.96Å; M319-V322 PolarHBondContact O-N 3.41Å; V322-D325 PolarHBondContact O-N 3.34Å; V322-K326 HydrophobicContact CG1-CG 4.47Å; V322-K326 WeakPolarHBondContact O-CB 3.16Å; V322-K326 VanDerWaalsContact O-CG 3.28Å; V322-K326 WeakPolarHBondContact O-CG 3.4Å; V322-K326 PolarHBondContact O-N 3.32Å
323	I	91.5	Very high	87.1	Confident	92 Å²	92	84.4 Å²	84.4	47%	0.472	43%	0.432	S	S	.	.	H	α-helix	trans	-62	-45.1	176.7	-69.9	165.9	0	0	0	110.5	M319 Q321 D325 K326 L327	M319-I323 WeakPolarHBondContact O-CB 3.44Å; M319-I323 VanDerWaalsContact O-CG1 3.26Å; M319-I323 WeakPolarHBondContact O-CG1 3.46Å; M319-I323 PolarHBondContact O-N 3.15Å; Q321-I323 VanDerWaalsContact C-N 3.34Å; Q321-I323 PolarHBondContact O-N 3.44Å; I323-D325 PolarHBondContact O-N 3.18Å; I323-K326 PolarHBondContact O-N 3.24Å; I323-L327 HydrophobicContact CG2-CD1 3.59Å; I323-L327 HydrophobicContact CG2-CG 4.21Å; I323-L327 WeakPolarHBondContact O-CB 3.34Å; I323-L327 WeakPolarHBondContact O-CG 3.46Å; I323-L327 PolarHBondContact O-N 3.38Å
324	K	91.1	Very high	85.5	Confident	32 Å²	32	90.5 Å²	90.5	14%	0.139	48%	0.479	C	S	.	.	H	α-helix	trans	-61.2	-44.8	177.6	-72.1	169.1	-168.6	-173.2	0	111.8	L250 S252 S320 Q321 K326 L327 F328	L250-K324 WeakPolarHBondContact O-CD 3.37Å; L250-K324 WeakPolarHBondContact O-CE 3.44Å; L250-K324 PolarHBondContact O-NZ 3.49Å; S252-K324 PolarHBondContact O-NZ 3.14Å; S320-K324 VanDerWaalsContact O-CG 3.22Å; S320-K324 WeakPolarHBondContact O-CG 3.25Å; S320-K324 PolarHBondContact O-N 2.94Å; S320-K324 WeakPolarHBondContact OG-CE 3.44Å; Q321-K324 PolarHBondContact O-N 3.15Å; K324-K326 PolarHBondContact O-N 3.22Å; K324-L327 PolarHBondContact O-N 3.07Å; K324-F328 HydrophobicContact CB-CD2 4.27Å; K324-F328 WeakPolarHBondContact O-CB 3.49Å; K324-F328 VanDerWaalsContact O-CD2 3.27Å; K324-F328 WeakPolarHBondContact O-CD2 3.48Å; K324-F328 PolarHBondContact O-N 3.03Å
325	D	90.7	Very high	85.3	Confident	62 Å²	62	93.6 Å²	93.6	33%	0.332	49%	0.491	S	S	.	.	I	π-helix	trans	-60.8	-46.2	177.8	-174.7	64.6	0	0	0	111.5	Q321 V322 I323 L327 N329 Q330	Q321-D325 PolarHBondContact O-N 2.92Å; V322-D325 PolarHBondContact O-N 3.34Å; I323-D325 PolarHBondContact O-N 3.18Å; D325-L327 PolarHBondContact O-N 3.34Å; D325-N329 WeakPolarHBondContact O-CA 3.38Å; D325-N329 WeakPolarHBondContact O-CB 3.47Å; D325-N329 PolarHBondContact O-N 3.39Å; D325-N329 WeakPolarHBondContact OD1-CB 3.42Å; D325-N329 PolarHBondContact OD1-ND2 2.98Å; D325-Q330 PolarHBondContact O-N 3.04Å; D325-Q330 PolarHBondContact OD2-NE2 2.95Å
326	K	91.6	Very high	85	Confident	116 Å²	116	94.3 Å²	94.3	50%	0.504	50%	0.495	S	S	.	.	I	π-helix	trans	-62.6	-42.3	177.1	-69.8	-73.7	169.8	-175.3	0	112.9	V322 I323 K324	V322-K326 HydrophobicContact CG1-CG 4.47Å; V322-K326 WeakPolarHBondContact O-CB 3.16Å; V322-K326 VanDerWaalsContact O-CG 3.28Å; V322-K326 WeakPolarHBondContact O-CG 3.4Å; V322-K326 PolarHBondContact O-N 3.32Å; I323-K326 PolarHBondContact O-N 3.24Å; K324-K326 PolarHBondContact O-N 3.22Å
327	L	90.1	Very high	84.8	Confident	92 Å²	92	92.8 Å²	92.8	48%	0.482	49%	0.491	S	S	.	.	I	π-helix	trans	-78.6	-28.7	-177.4	-73	176.5	0	0	0	114	I323 K324 D325 I331	I323-L327 HydrophobicContact CG2-CD1 3.59Å; I323-L327 HydrophobicContact CG2-CG 4.21Å; I323-L327 WeakPolarHBondContact O-CB 3.34Å; I323-L327 WeakPolarHBondContact O-CG 3.46Å; I323-L327 PolarHBondContact O-N 3.38Å; K324-L327 PolarHBondContact O-N 3.07Å; D325-L327 PolarHBondContact O-N 3.34Å; L327-I331 WeakPolarHBondContact O-CD1 3.19Å; L327-I331 VanDerWaalsContact O-CG1 3.23Å; L327-I331 WeakPolarHBondContact O-CG1 3.47Å
328	F	89.2	Confident	84.5	Confident	129 Å²	129	98.2 Å²	98.2	57%	0.566	52%	0.52	S	S	*	.	I	π-helix	trans	-115.2	-30.9	-171.8	-62.4	-67	0	0	0	113.7	L250 K324	L250-F328 HydrophobicContact CD1-CZ 4.2Å; K324-F328 HydrophobicContact CB-CD2 4.27Å; K324-F328 WeakPolarHBondContact O-CB 3.49Å; K324-F328 VanDerWaalsContact O-CD2 3.27Å; K324-F328 WeakPolarHBondContact O-CD2 3.48Å; K324-F328 PolarHBondContact O-N 3.03Å
329	N	88.4	Confident	84	Confident	106 Å²	106	98 Å²	98	57%	0.567	52%	0.519	S	S	*	.	I	π-helix	trans	-100.8	-23.6	-175.2	-59.4	-27	0	0	0	112.9	D325 I333	D325-N329 WeakPolarHBondContact O-CA 3.38Å; D325-N329 WeakPolarHBondContact O-CB 3.47Å; D325-N329 PolarHBondContact O-N 3.39Å; D325-N329 WeakPolarHBondContact OD1-CB 3.42Å; D325-N329 PolarHBondContact OD1-ND2 2.98Å; N329-I333 WeakPolarHBondContact O-CD1 3.04Å
330	Q	85.5	Confident	83.5	Confident	70 Å²	70	97.7 Å²	97.7	33%	0.327	52%	0.52	S	S	.	.	S	Bend	trans	-106.4	-2.8	-172.4	-56.9	-167.2	16	0	0	115.4	D325 N332 I333	D325-Q330 PolarHBondContact O-N 3.04Å; D325-Q330 PolarHBondContact OD2-NE2 2.95Å; Q330-N332 PolarHBondContact O-N 3.28Å; Q330-N332 VanDerWaalsContact O-N 3.17Å; Q330-I333 HydrophobicContact CG-CD1 4.5Å; Q330-I333 PolarHBondContact O-N 2.85Å
331	I	74.2	Confident	82.9	Confident	111 Å²	111	101.4 Å²	101.4	57%	0.569	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-27.2	-176.3	-72.8	-172	0	0	0	113.3	L327	L327-I331 WeakPolarHBondContact O-CD1 3.19Å; L327-I331 VanDerWaalsContact O-CG1 3.23Å; L327-I331 WeakPolarHBondContact O-CG1 3.47Å
332	N	69.1	Low	82.3	Confident	149 Å²	149	104.2 Å²	104.2	80%	0.797	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.2	14.8	-178.5	-63.1	-31.4	0	0	0	113.7	Q330 S334	Q330-N332 PolarHBondContact O-N 3.28Å; Q330-N332 VanDerWaalsContact O-N 3.17Å; N332-S334 VanDerWaalsContact C-N 3.31Å
333	I	62.4	Low	81.5	Confident	140 Å²	140	105.4 Å²	105.4	72%	0.718	55%	0.553	S	S	*	*			trans	-93.2	12	179.4	-56	179.5	0	0	0	111.6	N329 Q330	N329-I333 WeakPolarHBondContact O-CD1 3.04Å; Q330-I333 HydrophobicContact CG-CD1 4.5Å; Q330-I333 PolarHBondContact O-N 2.85Å
334	S	53.8	Low	80.6	Confident	166 Å²	166	106.6 Å²	106.6	100%	1.161	56%	0.56	S	S	*	*			trans	-117.5	0	164.1	70	0	0	0	0	110.8	N332	N332-S334 VanDerWaalsContact C-N 3.31Å

Retrieved 334 of 334 residues in 265.7 ms (Link to these results)

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