A0A087YR88_POEFO Loading...

Gap junction protein beta 3

AlphaFold DB , UniProt , Accession A0A087YR88, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 268 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	46.5	Very low	53.5	Low	246 Å²	246	109.5 Å²	109.5	100%	1.212	55%	0.548	S	S	*	.				0	138.3	0	-74.2	-179.9	170.7	0	0	108.5	W3	M1-W3 PolarHBondContact O-N 3.17Å
2	D	63.2	Low	53	Low	114 Å²	114	104 Å²	104	61%	0.61	54%	0.54	S	S	*	.			trans	-71	121.2	179.7	-88.2	-72.3	0	0	0	113.2	K4 T5 F6	D2-K4 PolarHBondContact O-N 3.19Å; D2-T5 WeakPolarHBondContact CB-OG1 3.49Å; D2-T5 PolarHBondContact O-N 3.35Å; D2-F6 PolarHBondContact O-N 2.94Å
3	W	51.1	Low	53	Low	180 Å²	180	99.8 Å²	99.8	68%	0.682	52%	0.521	S	S	*	.	H	α-helix	trans	-55.5	-38	171.4	178.3	-97.8	0	0	0	111.8	M1 T5 F6 Q7	M1-W3 PolarHBondContact O-N 3.17Å; W3-T5 VanDerWaalsContact C-N 3.31Å; W3-T5 PolarHBondContact O-N 3.23Å; W3-F6 PolarHBondContact O-N 3.28Å; W3-Q7 WeakPolarHBondContact O-CB 3.42Å; W3-Q7 PolarHBondContact O-N 3.2Å
4	K	47.4	Very low	52.4	Low	169 Å²	169	99.4 Å²	99.4	74%	0.735	52%	0.52	S	S	*	.	H	α-helix	trans	-62	-36.2	177	-70	-179.3	179.3	174.4	0	112.7	D2 A8	D2-K4 PolarHBondContact O-N 3.19Å; K4-A8 VanDerWaalsContact O-CB 3.3Å; K4-A8 WeakPolarHBondContact O-CB 3.45Å; K4-A8 PolarHBondContact O-N 3.42Å
5	T	55.5	Low	52	Low	81 Å²	81	103.9 Å²	103.9	50%	0.497	53%	0.534	S	S	.	.	H	α-helix	trans	-72	-42.6	178.5	-51.5	0	0	0	0	110.7	D2 W3 A8 L9	D2-T5 WeakPolarHBondContact CB-OG1 3.49Å; D2-T5 PolarHBondContact O-N 3.35Å; W3-T5 VanDerWaalsContact C-N 3.31Å; W3-T5 PolarHBondContact O-N 3.23Å; T5-A8 PolarHBondContact O-N 2.98Å; T5-L9 WeakPolarHBondContact O-CG 3.37Å; T5-L9 PolarHBondContact O-N 3.24Å
6	F	56.5	Low	51.6	Low	90 Å²	90	105.9 Å²	105.9	40%	0.395	53%	0.534	S	S	.	.	H	α-helix	trans	-63.3	-46.4	173.3	-164	-112.6	0	0	0	111.4	D2 W3 A8 L9 L10 V30	D2-F6 PolarHBondContact O-N 2.94Å; W3-F6 PolarHBondContact O-N 3.28Å; F6-A8 VanDerWaalsContact C-N 3.28Å; F6-A8 PolarHBondContact O-N 3.39Å; F6-L9 WeakPolarHBondContact O-CB 3.43Å; F6-L9 PolarHBondContact O-N 3.4Å; F6-L9 VanDerWaalsContact O-N 3.15Å; F6-L10 HydrophobicContact CD1-CD1 3.77Å; F6-L10 HydrophobicContact CD1-CG 4.45Å; F6-L10 HydrophobicContact CE1-CD1 3.75Å; F6-L10 HydrophobicContact CE1-CG 4.46Å; F6-L10 WeakPolarHBondContact O-CG 3.48Å; F6-L10 PolarHBondContact O-N 3.5Å; F6-V30 HydrophobicContact CZ-CG2 3.86Å
7	Q	54.4	Low	51.5	Low	98 Å²	98	100.5 Å²	100.5	46%	0.458	51%	0.508	S	S	.	.	H	α-helix	trans	-62.2	-31.7	175.1	-170.8	173.5	-1.2	0	0	112.4	W3 S11	W3-Q7 WeakPolarHBondContact O-CB 3.42Å; W3-Q7 PolarHBondContact O-N 3.2Å; Q7-S11 WeakPolarHBondContact O-CB 3.47Å; Q7-S11 PolarHBondContact O-N 3.27Å; Q7-S11 PolarHBondContact O-OG 3.41Å
8	A	54.9	Low	51.9	Low	45 Å²	45	97.6 Å²	97.6	37%	0.372	50%	0.496	S	S	.	.	H	α-helix	trans	-68.4	-42.2	172.7	0	0	0	0	0	112.3	K4 T5 F6 L10 S11 G12	K4-A8 VanDerWaalsContact O-CB 3.3Å; K4-A8 WeakPolarHBondContact O-CB 3.45Å; K4-A8 PolarHBondContact O-N 3.42Å; T5-A8 PolarHBondContact O-N 2.98Å; F6-A8 VanDerWaalsContact C-N 3.28Å; F6-A8 PolarHBondContact O-N 3.39Å; A8-L10 VanDerWaalsContact C-N 3.31Å; A8-L10 PolarHBondContact O-N 3.07Å; A8-S11 PolarHBondContact O-N 3.49Å; A8-G12 PolarHBondContact O-N 3.42Å
9	L	56.7	Low	52.2	Low	44 Å²	44	95.5 Å²	95.5	23%	0.23	50%	0.495	C	S	.	.	H	α-helix	trans	-61.4	-39.5	174.3	-66.1	166.4	0	0	0	111.8	T5 F6 V13 F89 V92	T5-L9 WeakPolarHBondContact O-CG 3.37Å; T5-L9 PolarHBondContact O-N 3.24Å; F6-L9 WeakPolarHBondContact O-CB 3.43Å; F6-L9 PolarHBondContact O-N 3.4Å; F6-L9 VanDerWaalsContact O-N 3.15Å; L9-V13 WeakPolarHBondContact O-CG2 3.47Å; L9-F89 HydrophobicContact CD1-CE1 3.67Å; L9-F89 HydrophobicContact CD1-CZ 3.78Å; L9-F89 HydrophobicContact CD2-CD1 3.62Å; L9-F89 HydrophobicContact CD2-CE1 3.54Å; L9-F89 HydrophobicContact CD2-CG 4.37Å; L9-F89 HydrophobicContact CD2-CZ 4.22Å; L9-F89 HydrophobicContact CG-CE1 4.2Å; L9-V92 HydrophobicContact CD2-CB 4.32Å; L9-V92 HydrophobicContact CD2-CG1 4.27Å; L9-V92 HydrophobicContact CD2-CG2 4.23Å
10	L	54.6	Low	52.6	Low	69 Å²	69	97.9 Å²	97.9	36%	0.361	50%	0.502	S	S	.	.	H	α-helix	trans	-73.2	-45.2	176.6	-63.5	175.9	0	0	0	112.9	F6 A8 S26	F6-L10 HydrophobicContact CD1-CD1 3.77Å; F6-L10 HydrophobicContact CD1-CG 4.45Å; F6-L10 HydrophobicContact CE1-CD1 3.75Å; F6-L10 HydrophobicContact CE1-CG 4.46Å; F6-L10 WeakPolarHBondContact O-CG 3.48Å; F6-L10 PolarHBondContact O-N 3.5Å; A8-L10 VanDerWaalsContact C-N 3.31Å; A8-L10 PolarHBondContact O-N 3.07Å; L10-S26 WeakPolarHBondContact CD2-OG 3.46Å
11	S	47.7	Very low	53.2	Low	68 Å²	68	93.8 Å²	93.8	48%	0.476	48%	0.484	S	S	.	.	H	α-helix	trans	-83.3	-34.3	-170.8	63	0	0	0	0	114.1	Q7 A8 V13 N14	Q7-S11 WeakPolarHBondContact O-CB 3.47Å; Q7-S11 PolarHBondContact O-N 3.27Å; Q7-S11 PolarHBondContact O-OG 3.41Å; A8-S11 PolarHBondContact O-N 3.49Å; S11-V13 PolarHBondContact O-N 3.31Å; S11-V13 VanDerWaalsContact O-N 3.14Å; S11-N14 WeakPolarHBondContact O-CB 3.45Å; S11-N14 PolarHBondContact O-N 3.08Å
12	G	47.1	Very low	54.2	Low	44 Å²	44	82.8 Å²	82.8	45%	0.454	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-23.6	175.3	0	0	0	0	0	113	A8	A8-G12 PolarHBondContact O-N 3.42Å
13	V	53	Low	54.8	Low	49 Å²	49	81.1 Å²	81.1	30%	0.297	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-24.1	174.8	174.7	0	0	0	0	112.5	L9 S11 K15 R22	L9-V13 WeakPolarHBondContact O-CG2 3.47Å; S11-V13 PolarHBondContact O-N 3.31Å; S11-V13 VanDerWaalsContact O-N 3.14Å; V13-K15 PolarHBondContact O-N 3.26Å; V13-R22 HydrophobicContact CG1-CB 3.8Å; V13-R22 HydrophobicContact CG1-CG 3.99Å; V13-R22 PolarHBondContact O-NH1 3.02Å
14	N	45.4	Very low	56	Low	94 Å²	94	78.2 Å²	78.2	50%	0.503	41%	0.411	S	S	.	.			trans	-71.9	-32.1	-156.2	-159.7	3.6	0	0	0	115.5	S11 Y16 R22	S11-N14 WeakPolarHBondContact O-CB 3.45Å; S11-N14 PolarHBondContact O-N 3.08Å; N14-Y16 PolarHBondContact O-N 3.49Å; N14-R22 VanDerWaalsContact O-CZ 3.24Å; N14-R22 PolarHBondContact O-NH1 3.22Å; N14-R22 PolarHBondContact O-NH2 3.4Å
15	K	46	Very low	57.5	Low	167 Å²	167	71.3 Å²	71.3	73%	0.726	38%	0.382	S	S	*	.	S	Bend	trans	-71.2	-33.2	-151.6	-139.5	166.8	-176.3	169.1	0	119.6	V13	V13-K15 PolarHBondContact O-N 3.26Å
16	Y	45.6	Very low	58.7	Low	136 Å²	136	69.1 Å²	69.1	53%	0.533	37%	0.371	S	S	.	.	S	Bend	trans	-144.4	6.4	-167.2	-65.7	-64.2	0	0	0	121.9	N14 G120	N14-Y16 PolarHBondContact O-N 3.49Å; Y16-G120 WeakPolarHBondContact CD2-O 2.98Å; Y16-G120 WeakPolarHBondContact CE2-O 3.16Å
17	S	49.5	Very low	60.1	Low	14 Å²	14	68.7 Å²	68.7	10%	0.098	38%	0.375	C	S	.	.	S	Bend	trans	-91	-169.7	159.5	-45.9	0	0	0	0	110.6	A19 R22 K122 E203	S17-A19 PolarHBondContact O-N 3.27Å; S17-R22 PolarHBondContact O-NH2 2.91Å; S17-K122 PolarHBondContact OG-NZ 3.21Å; S17-E203 WeakPolarHBondContact CB-OE1 3.42Å; S17-E203 PolarHBondContact OG-OE1 2.86Å
18	T	59.5	Low	61.6	Low	48 Å²	48	64.5 Å²	64.5	29%	0.294	36%	0.356	S	S	.	.			trans	-53.7	125.3	164.8	28.3	0	0	0	0	110.2	R22 Y206	T18-R22 PolarHBondContact O-NE 3.12Å; T18-R22 PolarHBondContact O-NH2 2.96Å; T18-R22 VanDerWaalsContact O-NH2 3.13Å; T18-Y206 HydrophobicContact CG2-CD1 4.31Å; T18-Y206 HydrophobicContact CG2-CD2 4.33Å; T18-Y206 HydrophobicContact CG2-CE1 3.95Å; T18-Y206 HydrophobicContact CG2-CE2 3.94Å; T18-Y206 HydrophobicContact CG2-CG 4.5Å
19	A	58.2	Low	63.1	Low	58 Å²	58	65.2 Å²	65.2	48%	0.479	35%	0.351	S	S	.	.	H	α-helix	trans	-58.7	-50.1	176.1	0	0	0	0	0	110.5	S17 G21 R22 V23	S17-A19 PolarHBondContact O-N 3.27Å; A19-G21 PolarHBondContact O-N 3.19Å; A19-R22 PolarHBondContact O-N 2.93Å; A19-V23 WeakPolarHBondContact O-CG2 3.49Å; A19-V23 PolarHBondContact O-N 3.3Å
20	F	59.7	Low	64.6	Low	144 Å²	144	66 Å²	66	63%	0.632	36%	0.357	S	S	*	.	H	α-helix	trans	-42.3	-66.9	176.8	-164.4	-95.3	0	0	0	113.3	R22 V23 W24	F20-R22 VanDerWaalsContact C-N 3.27Å; F20-R22 PolarHBondContact O-N 3.21Å; F20-R22 VanDerWaalsContact O-N 3.12Å; F20-V23 PolarHBondContact O-N 3Å; F20-W24 AromaticContact CD1-CD1 3.5Å; F20-W24 VanDerWaalsContact CD1-CD1 3.5Å; F20-W24 AromaticContact CD1-NE1 3.87Å; F20-W24 AromaticContact CD2-CD1 3.84Å; F20-W24 AromaticContact CD2-NE1 3.53Å; F20-W24 AromaticContact CE1-CD1 3.49Å; F20-W24 VanDerWaalsContact CE1-CD1 3.49Å; F20-W24 HydrophobicContact CE1-CG 4.48Å; F20-W24 AromaticContact CE1-NE1 3.52Å; F20-W24 AromaticContact CE2-CD1 3.85Å; F20-W24 AromaticContact CE2-NE1 3.17Å; F20-W24 AromaticContact CG-CD1 3.68Å; F20-W24 AromaticContact CG-NE1 3.87Å; F20-W24 AromaticContact CZ-CD1 3.67Å; F20-W24 AromaticContact CZ-NE1 3.16Å; F20-W24 PolarHBondContact O-N 3.2Å
21	G	65.3	Low	66.3	Low	11 Å²	11	67 Å²	67	11%	0.113	36%	0.359	C	S	.	.	H	α-helix	trans	-57.8	-34.1	-171.8	0	0	0	0	0	114.7	A19 L25	A19-G21 PolarHBondContact O-N 3.19Å; G21-L25 WeakPolarHBondContact O-CB 3.15Å; G21-L25 VanDerWaalsContact O-CG 3.23Å; G21-L25 WeakPolarHBondContact O-CG 3.45Å; G21-L25 PolarHBondContact O-N 2.92Å
22	R	67.6	Low	68.4	Low	16 Å²	16	63.9 Å²	63.9	6%	0.06	34%	0.337	C	S	.	.	H	α-helix	trans	-85.3	-31.5	-178.6	-63.9	164.5	-58.4	153.5	14	113	V13 N14 S17 T18 A19 F20 S26 Y130	V13-R22 HydrophobicContact CG1-CB 3.8Å; V13-R22 HydrophobicContact CG1-CG 3.99Å; V13-R22 PolarHBondContact O-NH1 3.02Å; N14-R22 VanDerWaalsContact O-CZ 3.24Å; N14-R22 PolarHBondContact O-NH1 3.22Å; N14-R22 PolarHBondContact O-NH2 3.4Å; S17-R22 PolarHBondContact O-NH2 2.91Å; T18-R22 PolarHBondContact O-NE 3.12Å; T18-R22 PolarHBondContact O-NH2 2.96Å; T18-R22 VanDerWaalsContact O-NH2 3.13Å; A19-R22 PolarHBondContact O-N 2.93Å; F20-R22 VanDerWaalsContact C-N 3.27Å; F20-R22 PolarHBondContact O-N 3.21Å; F20-R22 VanDerWaalsContact O-N 3.12Å; R22-S26 VanDerWaalsContact O-CB 3.32Å; R22-S26 WeakPolarHBondContact O-CB 3.34Å; R22-S26 PolarHBondContact O-N 3.21Å; R22-Y130 WeakPolarHBondContact CD-OH 3.28Å
23	V	75.4	Confident	70.4	Confident	78 Å²	78	64.3 Å²	64.3	47%	0.473	33%	0.331	S	S	.	.	H	α-helix	trans	-62.9	-47.8	167.6	170.9	0	0	0	0	109.4	A19 F20 S26 V27	A19-V23 WeakPolarHBondContact O-CG2 3.49Å; A19-V23 PolarHBondContact O-N 3.3Å; F20-V23 PolarHBondContact O-N 3Å; V23-S26 WeakPolarHBondContact O-CB 3.48Å; V23-S26 PolarHBondContact O-N 3.05Å; V23-V27 HydrophobicContact CG1-CG2 4.37Å; V23-V27 WeakPolarHBondContact O-CG2 3.44Å; V23-V27 PolarHBondContact O-N 2.93Å
24	W	76.8	Confident	72.3	Confident	119 Å²	119	67.2 Å²	67.2	45%	0.451	34%	0.342	S	S	.	.	H	α-helix	trans	-63.4	-46.4	177	-76.9	106.5	0	0	0	113.3	F20 S26 V27 V28 L199	F20-W24 AromaticContact CD1-CD1 3.5Å; F20-W24 VanDerWaalsContact CD1-CD1 3.5Å; F20-W24 AromaticContact CD1-NE1 3.87Å; F20-W24 AromaticContact CD2-CD1 3.84Å; F20-W24 AromaticContact CD2-NE1 3.53Å; F20-W24 AromaticContact CE1-CD1 3.49Å; F20-W24 VanDerWaalsContact CE1-CD1 3.49Å; F20-W24 HydrophobicContact CE1-CG 4.48Å; F20-W24 AromaticContact CE1-NE1 3.52Å; F20-W24 AromaticContact CE2-CD1 3.85Å; F20-W24 AromaticContact CE2-NE1 3.17Å; F20-W24 AromaticContact CG-CD1 3.68Å; F20-W24 AromaticContact CG-NE1 3.87Å; F20-W24 AromaticContact CZ-CD1 3.67Å; F20-W24 AromaticContact CZ-NE1 3.16Å; F20-W24 PolarHBondContact O-N 3.2Å; W24-S26 PolarHBondContact O-N 3.03Å; W24-V27 PolarHBondContact O-N 3.24Å; W24-V28 WeakPolarHBondContact O-CG2 3.49Å; W24-V28 PolarHBondContact O-N 3.47Å; W24-L199 HydrophobicContact CB-CD1 3.99Å; W24-L199 HydrophobicContact CB-CD2 4.35Å
25	L	78.1	Confident	74.5	Confident	24 Å²	24	63.3 Å²	63.3	13%	0.126	32%	0.322	C	S	.	.	H	α-helix	trans	-55.9	-39.2	173.1	-80.3	168.4	0	0	0	112.1	G21 F29 L199 N200	G21-L25 WeakPolarHBondContact O-CB 3.15Å; G21-L25 VanDerWaalsContact O-CG 3.23Å; G21-L25 WeakPolarHBondContact O-CG 3.45Å; G21-L25 PolarHBondContact O-N 2.92Å; L25-F29 VanDerWaalsContact O-CB 3.24Å; L25-F29 WeakPolarHBondContact O-CB 3.42Å; L25-F29 PolarHBondContact O-N 2.9Å; L25-L199 HydrophobicContact CD2-CB 3.56Å; L25-L199 HydrophobicContact CD2-CD1 4.3Å; L25-L199 HydrophobicContact CG-CB 3.83Å; L25-L199 HydrophobicContact CG-CD1 4.41Å; L25-N200 WeakPolarHBondContact CD2-ND2 3.48Å
26	S	81.1	Confident	76.8	Confident	36 Å²	36	57.9 Å²	57.9	25%	0.252	30%	0.297	S	S	.	.	H	α-helix	trans	-69.7	-42.6	176.5	-171.2	0	0	0	0	112.9	L10 R22 V23 W24 F29 V30	L10-S26 WeakPolarHBondContact CD2-OG 3.46Å; R22-S26 VanDerWaalsContact O-CB 3.32Å; R22-S26 WeakPolarHBondContact O-CB 3.34Å; R22-S26 PolarHBondContact O-N 3.21Å; V23-S26 WeakPolarHBondContact O-CB 3.48Å; V23-S26 PolarHBondContact O-N 3.05Å; W24-S26 PolarHBondContact O-N 3.03Å; S26-F29 PolarHBondContact O-N 3.33Å; S26-V30 WeakPolarHBondContact O-CG2 3.42Å; S26-V30 PolarHBondContact O-N 2.8Å
27	V	85.3	Confident	79	Confident	81 Å²	81	54.2 Å²	54.2	49%	0.491	29%	0.289	S	S	.	.	H	α-helix	trans	-64.9	-46.1	179.3	167.9	0	0	0	0	110.4	V23 W24 F29 V30 F31	V23-V27 HydrophobicContact CG1-CG2 4.37Å; V23-V27 WeakPolarHBondContact O-CG2 3.44Å; V23-V27 PolarHBondContact O-N 2.93Å; W24-V27 PolarHBondContact O-N 3.24Å; V27-F29 VanDerWaalsContact C-N 3.34Å; V27-F29 PolarHBondContact O-N 3.18Å; V27-V30 PolarHBondContact O-N 3.29Å; V27-F31 VanDerWaalsContact O-CB 3.3Å; V27-F31 WeakPolarHBondContact O-CB 2.95Å; V27-F31 PolarHBondContact O-N 2.94Å
28	V	85.4	Confident	81.1	Confident	10 Å²	10	56.7 Å²	56.7	6%	0.061	30%	0.303	C	S	.	.	H	α-helix	trans	-64.5	-38.9	177	179.4	0	0	0	0	111	W24 R32 A192 L195 C196 L199	W24-V28 WeakPolarHBondContact O-CG2 3.49Å; W24-V28 PolarHBondContact O-N 3.47Å; V28-R32 VanDerWaalsContact O-CB 3.24Å; V28-R32 WeakPolarHBondContact O-CB 3.4Å; V28-R32 PolarHBondContact O-N 3.36Å; V28-A192 HydrophobicContact CG1-CB 4.13Å; V28-A192 WeakPolarHBondContact CG1-O 3.36Å; V28-L195 HydrophobicContact CG1-CD2 4.33Å; V28-L195 HydrophobicContact CG2-CD2 3.64Å; V28-L195 HydrophobicContact CG2-CG 4.19Å; V28-C196 VanDerWaalsContact CG1-SG 3.6Å; V28-L199 HydrophobicContact CG2-CD1 4.3Å
29	F	86.6	Confident	82.5	Confident	59 Å²	59	54.4 Å²	54.4	26%	0.259	29%	0.289	S	S	.	.	H	α-helix	trans	-64.1	-46.1	175.1	-178.6	-96.6	0	0	0	112.5	L25 S26 V27 R32 V33 L81 V84 T85	L25-F29 VanDerWaalsContact O-CB 3.24Å; L25-F29 WeakPolarHBondContact O-CB 3.42Å; L25-F29 PolarHBondContact O-N 2.9Å; S26-F29 PolarHBondContact O-N 3.33Å; V27-F29 VanDerWaalsContact C-N 3.34Å; V27-F29 PolarHBondContact O-N 3.18Å; F29-R32 PolarHBondContact O-N 3.26Å; F29-V33 HydrophobicContact CD1-CG2 4.28Å; F29-V33 HydrophobicContact CE1-CG2 3.67Å; F29-V33 HydrophobicContact CE2-CG2 4.23Å; F29-V33 HydrophobicContact CZ-CG2 3.62Å; F29-V33 WeakPolarHBondContact O-CG2 3.38Å; F29-V33 PolarHBondContact O-N 3.18Å; F29-L81 HydrophobicContact CD2-CD2 4.39Å; F29-L81 HydrophobicContact CE2-CD2 3.7Å; F29-L81 HydrophobicContact CZ-CD2 4.3Å; F29-V84 HydrophobicContact CD2-CG1 4.38Å; F29-V84 HydrophobicContact CE2-CG1 3.9Å; F29-T85 HydrophobicContact CE1-CG2 4.11Å; F29-T85 HydrophobicContact CE2-CG2 3.81Å; F29-T85 HydrophobicContact CZ-CG2 3.27Å
30	V	88.4	Confident	84.1	Confident	61 Å²	61	52.9 Å²	52.9	37%	0.37	28%	0.277	S	S	.	.	H	α-helix	trans	-65.9	-43.1	178.5	172.7	0	0	0	0	111.5	F6 S26 V27 R32 V33 M34	F6-V30 HydrophobicContact CZ-CG2 3.86Å; S26-V30 WeakPolarHBondContact O-CG2 3.42Å; S26-V30 PolarHBondContact O-N 2.8Å; V27-V30 PolarHBondContact O-N 3.29Å; V30-R32 VanDerWaalsContact C-N 3.3Å; V30-R32 PolarHBondContact O-N 2.93Å; V30-V33 PolarHBondContact O-N 3.29Å; V30-M34 PolarHBondContact O-N 3.12Å
31	F	89.8	Confident	85.4	Confident	90 Å²	90	52.2 Å²	52.2	40%	0.395	28%	0.276	S	S	.	.	H	α-helix	trans	-56	-44.9	172.3	171.5	-102.8	0	0	0	111.5	V27 M34 V35	V27-F31 VanDerWaalsContact O-CB 3.3Å; V27-F31 WeakPolarHBondContact O-CB 2.95Å; V27-F31 PolarHBondContact O-N 2.94Å; F31-M34 HydrophobicContact CD2-CE 3.98Å; F31-M34 HydrophobicContact CE2-CE 4.19Å; F31-M34 WeakPolarHBondContact O-CB 3.48Å; F31-M34 PolarHBondContact O-N 2.91Å; F31-V35 HydrophobicContact CD1-CG2 4.32Å; F31-V35 HydrophobicContact CD2-CG2 4.23Å; F31-V35 HydrophobicContact CE1-CG2 3.87Å; F31-V35 HydrophobicContact CE2-CG2 3.78Å; F31-V35 HydrophobicContact CG-CG2 4.49Å; F31-V35 HydrophobicContact CZ-CG2 3.58Å; F31-V35 WeakPolarHBondContact O-CG2 3.4Å; F31-V35 PolarHBondContact O-N 3.44Å
32	R	91.7	Very high	86.5	Confident	2 Å²	2	61 Å²	61	1%	0.008	31%	0.305	C	S	.	.	H	α-helix	trans	-67.5	-35.7	179.2	-174.4	175.7	160.6	-161.5	-3.4	113.4	V28 F29 V30 Y36 Q80 L81 E141 M189 A192 S193	V28-R32 VanDerWaalsContact O-CB 3.24Å; V28-R32 WeakPolarHBondContact O-CB 3.4Å; V28-R32 PolarHBondContact O-N 3.36Å; F29-R32 PolarHBondContact O-N 3.26Å; V30-R32 VanDerWaalsContact C-N 3.3Å; V30-R32 PolarHBondContact O-N 2.93Å; R32-Y36 VanDerWaalsContact O-CB 3.24Å; R32-Y36 WeakPolarHBondContact O-CB 3.37Å; R32-Y36 PolarHBondContact O-N 2.86Å; R32-Q80 VanDerWaalsContact NH2-CG 3.31Å; R32-L81 HydrophobicContact CG-CD2 4.24Å; R32-E141 IonicContact CZ-OE1 3.67Å; R32-E141 IonicContact CZ-OE2 2.78Å; R32-E141 VanDerWaalsContact NH1-CD 3.27Å; R32-E141 IonicContact NH1-OE1 2.68Å; R32-E141 PolarHBondContact NH1-OE1 2.81Å; R32-E141 VanDerWaalsContact NH1-OE1 3.12Å; R32-E141 IonicContact NH1-OE2 3.43Å; R32-E141 PolarHBondContact NH1-OE2 3.19Å; R32-E141 IonicContact NH2-OE1 2.7Å; R32-E141 PolarHBondContact NH2-OE1 3.22Å; R32-E141 IonicContact NH2-OE2 3.82Å; R32-M189 HydrophobicContact CG-CE 3.91Å; R32-M189 HydrophobicContact CG-SD 3.72Å; R32-A192 HydrophobicContact CB-CB 4.34Å; R32-A192 HydrophobicContact CG-CB 4.39Å; R32-S193 PolarHBondContact NE-OG 2.89Å; R32-S193 PolarHBondContact NH1-OG 3.11Å; R32-S193 PolarHBondContact NH2-OG 2.99Å
33	V	91.1	Very high	87.5	Confident	53 Å²	53	60.7 Å²	60.7	32%	0.321	31%	0.305	S	S	.	.	H	α-helix	trans	-65.1	-41.2	171	172.2	0	0	0	0	110.8	F29 V30 Y36 V37 L81	F29-V33 HydrophobicContact CD1-CG2 4.28Å; F29-V33 HydrophobicContact CE1-CG2 3.67Å; F29-V33 HydrophobicContact CE2-CG2 4.23Å; F29-V33 HydrophobicContact CZ-CG2 3.62Å; F29-V33 WeakPolarHBondContact O-CG2 3.38Å; F29-V33 PolarHBondContact O-N 3.18Å; V30-V33 PolarHBondContact O-N 3.29Å; V33-Y36 PolarHBondContact O-N 2.78Å; V33-V37 WeakPolarHBondContact O-CG2 3.34Å; V33-V37 PolarHBondContact O-N 3.13Å; V33-L81 HydrophobicContact CG2-CD1 4.4Å; V33-L81 HydrophobicContact CG2-CD2 4.12Å
34	M	91.3	Very high	88.1	Confident	110 Å²	110	58 Å²	58	54%	0.542	29%	0.286	S	S	.	.	H	α-helix	trans	-62.6	-48.1	175.8	-174.8	-168.3	77.8	0	0	111.8	V30 F31 Y36 V37 V38	V30-M34 PolarHBondContact O-N 3.12Å; F31-M34 HydrophobicContact CD2-CE 3.98Å; F31-M34 HydrophobicContact CE2-CE 4.19Å; F31-M34 WeakPolarHBondContact O-CB 3.48Å; F31-M34 PolarHBondContact O-N 2.91Å; M34-Y36 VanDerWaalsContact C-N 3.33Å; M34-Y36 PolarHBondContact O-N 3.05Å; M34-V37 PolarHBondContact O-N 3.33Å; M34-V38 WeakPolarHBondContact O-CG2 3.35Å; M34-V38 PolarHBondContact O-N 3.36Å; M34-V38 VanDerWaalsContact O-N 3.08Å
35	V	92	Very high	88.5	Confident	12 Å²	12	54.6 Å²	54.6	7%	0.073	29%	0.288	C	S	.	.	H	α-helix	trans	-61.4	-41.5	176.4	172.9	0	0	0	0	111.1	F31 V38 A39 F185 F188 M189	F31-V35 HydrophobicContact CD1-CG2 4.32Å; F31-V35 HydrophobicContact CD2-CG2 4.23Å; F31-V35 HydrophobicContact CE1-CG2 3.87Å; F31-V35 HydrophobicContact CE2-CG2 3.78Å; F31-V35 HydrophobicContact CG-CG2 4.49Å; F31-V35 HydrophobicContact CZ-CG2 3.58Å; F31-V35 WeakPolarHBondContact O-CG2 3.4Å; F31-V35 PolarHBondContact O-N 3.44Å; V35-V38 PolarHBondContact O-N 2.88Å; V35-A39 WeakPolarHBondContact O-CB 3.32Å; V35-A39 PolarHBondContact O-N 2.9Å; V35-F185 HydrophobicContact CG1-CD1 3.91Å; V35-F185 HydrophobicContact CG1-CE1 4.35Å; V35-F188 HydrophobicContact CG1-CB 4.42Å; V35-M189 HydrophobicContact CB-SD 4.2Å; V35-M189 HydrophobicContact CG1-CG 4.11Å; V35-M189 HydrophobicContact CG1-SD 3.84Å
36	Y	93.8	Very high	88.9	Confident	54 Å²	54	57 Å²	57	21%	0.212	30%	0.302	C	S	.	.	H	α-helix	trans	-59.1	-45.5	175	166.9	-91.7	0	0	0	112.7	R32 V33 M34 A39 A40 I74 W77 A78 L81 M189	R32-Y36 VanDerWaalsContact O-CB 3.24Å; R32-Y36 WeakPolarHBondContact O-CB 3.37Å; R32-Y36 PolarHBondContact O-N 2.86Å; V33-Y36 PolarHBondContact O-N 2.78Å; M34-Y36 VanDerWaalsContact C-N 3.33Å; M34-Y36 PolarHBondContact O-N 3.05Å; Y36-A39 PolarHBondContact O-N 3.21Å; Y36-A40 WeakPolarHBondContact O-CB 3.29Å; Y36-A40 PolarHBondContact O-N 3.02Å; Y36-I74 HydrophobicContact CD2-CD1 3.67Å; Y36-I74 HydrophobicContact CD2-CG1 4.49Å; Y36-I74 HydrophobicContact CE2-CD1 3.5Å; Y36-I74 HydrophobicContact CE2-CG1 3.84Å; Y36-I74 WeakPolarHBondContact CE2-O 3.43Å; Y36-W77 HydrophobicContact CD2-CB 3.98Å; Y36-W77 HydrophobicContact CE2-CB 4.3Å; Y36-A78 HydrophobicContact CE2-CB 3.89Å; Y36-A78 WeakPolarHBondContact OH-CB 3.5Å; Y36-L81 HydrophobicContact CD1-CD1 3.98Å; Y36-L81 HydrophobicContact CD2-CD1 3.94Å; Y36-L81 HydrophobicContact CG-CD1 3.57Å; Y36-M189 HydrophobicContact CD2-CE 4.38Å
37	V	92.7	Very high	89.1	Confident	59 Å²	59	55.8 Å²	55.8	36%	0.358	29%	0.292	S	S	.	.	H	α-helix	trans	-65	-47.5	179.3	170.6	0	0	0	0	111	V33 M34 A39 A40 E41	V33-V37 WeakPolarHBondContact O-CG2 3.34Å; V33-V37 PolarHBondContact O-N 3.13Å; M34-V37 PolarHBondContact O-N 3.33Å; V37-A39 VanDerWaalsContact C-N 3.31Å; V37-A39 PolarHBondContact O-N 3.29Å; V37-A40 PolarHBondContact O-N 2.92Å; V37-E41 PolarHBondContact O-N 3.11Å
38	V	92.4	Very high	89.1	Confident	65 Å²	65	57.6 Å²	57.6	39%	0.394	30%	0.295	S	S	.	.	H	α-helix	trans	-60.1	-42.2	177.4	174	0	0	0	0	111.3	M34 V35 R42 F185	M34-V38 WeakPolarHBondContact O-CG2 3.35Å; M34-V38 PolarHBondContact O-N 3.36Å; M34-V38 VanDerWaalsContact O-N 3.08Å; V35-V38 PolarHBondContact O-N 2.88Å; V38-R42 HydrophobicContact CG1-CG 4.41Å; V38-R42 VanDerWaalsContact O-CB 3.26Å; V38-R42 WeakPolarHBondContact O-CB 3.32Å; V38-R42 WeakPolarHBondContact O-CG 3.48Å; V38-R42 PolarHBondContact O-N 2.56Å; V38-F185 HydrophobicContact CG1-CE1 4.2Å; V38-F185 HydrophobicContact CG1-CZ 4.18Å
39	A	90.8	Very high	89.2	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-61.7	-49.2	175.1	0	0	0	0	0	112.1	V35 Y36 V37 E41 V43 W44 I74 F185	V35-A39 WeakPolarHBondContact O-CB 3.32Å; V35-A39 PolarHBondContact O-N 2.9Å; Y36-A39 PolarHBondContact O-N 3.21Å; V37-A39 VanDerWaalsContact C-N 3.31Å; V37-A39 PolarHBondContact O-N 3.29Å; A39-E41 PolarHBondContact O-N 3.27Å; A39-V43 PolarHBondContact O-N 2.88Å; A39-W44 HydrophobicContact CB-CE3 3.82Å; A39-W44 HydrophobicContact CB-CZ3 3.75Å; A39-W44 PolarHBondContact O-N 3.5Å; A39-I74 HydrophobicContact CB-CD1 4.2Å; A39-F185 HydrophobicContact CB-CB 4.47Å; A39-F185 HydrophobicContact CB-CD1 3.9Å; A39-F185 HydrophobicContact CB-CE1 4.41Å; A39-F185 HydrophobicContact CB-CG 4.23Å
40	A	90.4	Very high	89.4	Confident	27 Å²	27	65.4 Å²	65.4	22%	0.223	33%	0.332	C	S	.	.	H	α-helix	trans	-58.6	-44.8	-179.2	0	0	0	0	0	112.4	Y36 V37 G45 I74	Y36-A40 WeakPolarHBondContact O-CB 3.29Å; Y36-A40 PolarHBondContact O-N 3.02Å; V37-A40 PolarHBondContact O-N 2.92Å; A40-G45 PolarHBondContact O-N 3.02Å; A40-I74 HydrophobicContact CB-CD1 3.88Å; A40-I74 HydrophobicContact CB-CG1 3.86Å
41	E	87.9	Confident	89.5	Confident	130 Å²	130	63 Å²	63	61%	0.607	32%	0.316	S	S	*	.	H	α-helix	trans	-78.3	-35.3	-176.9	-68.9	177.6	-174.9	0	0	113.6	V37 A39	V37-E41 PolarHBondContact O-N 3.11Å; A39-E41 PolarHBondContact O-N 3.27Å
42	R	87.8	Confident	89.7	Confident	195 Å²	195	63.8 Å²	63.8	74%	0.736	33%	0.325	S	S	*	.	H	α-helix	trans	-107.5	-23.7	-167.4	-56.2	-54.9	-168.9	84.5	1.5	115.6	V38	V38-R42 HydrophobicContact CG1-CG 4.41Å; V38-R42 VanDerWaalsContact O-CB 3.26Å; V38-R42 WeakPolarHBondContact O-CB 3.32Å; V38-R42 WeakPolarHBondContact O-CG 3.48Å; V38-R42 PolarHBondContact O-N 2.56Å
43	V	88.1	Confident	89.9	Confident	10 Å²	10	63.9 Å²	63.9	6%	0.061	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.4	-22.7	-169.2	178.4	0	0	0	0	112.6	A39 E181 K182 F185	A39-V43 PolarHBondContact O-N 2.88Å; V43-E181 HydrophobicContact CG1-CB 4.23Å; V43-E181 HydrophobicContact CG2-CB 4.5Å; V43-K182 HydrophobicContact CG1-CB 4.41Å; V43-K182 HydrophobicContact CG1-CG 3.49Å; V43-K182 VanDerWaalsContact CG1-CG 3.49Å; V43-K182 WeakPolarHBondContact O-CE 3.45Å; V43-F185 HydrophobicContact CB-CD2 4.43Å; V43-F185 HydrophobicContact CG1-CD2 4.34Å; V43-F185 HydrophobicContact CG2-CD2 3.86Å; V43-F185 HydrophobicContact CG2-CE2 3.6Å; V43-F185 HydrophobicContact CG2-CZ 4.4Å
44	W	89	Confident	90.1	Very high	20 Å²	20	67.2 Å²	67.2	8%	0.076	34%	0.342	C	S	.	.	S	Bend	trans	-115.7	3.3	174.9	-81.6	-82.5	0	0	0	114.6	A39 D47 H73 I74 W77 K182 F185	A39-W44 HydrophobicContact CB-CE3 3.82Å; A39-W44 HydrophobicContact CB-CZ3 3.75Å; A39-W44 PolarHBondContact O-N 3.5Å; W44-D47 WeakPolarHBondContact CA-OD1 3.32Å; W44-D47 VanDerWaalsContact CD1-OD2 3.24Å; W44-H73 HydrophobicContact CZ2-CB 4.01Å; W44-I74 HydrophobicContact CB-CB 4.11Å; W44-I74 HydrophobicContact CB-CG1 4.32Å; W44-I74 HydrophobicContact CB-CG2 4.04Å; W44-I74 HydrophobicContact CD2-CB 4.34Å; W44-I74 HydrophobicContact CE3-CD1 4.5Å; W44-I74 HydrophobicContact CG-CB 3.96Å; W44-I74 HydrophobicContact CG-CG2 4.15Å; W44-W77 HydrophobicContact CE3-CZ3 4.36Å; W44-W77 AromaticContact CH2-CH2 3.5Å; W44-W77 HydrophobicContact CH2-CH2 3.5Å; W44-W77 AromaticContact CH2-CZ3 3.57Å; W44-W77 HydrophobicContact CH2-CZ3 3.57Å; W44-W77 AromaticContact CZ2-CH2 3.86Å; W44-W77 HydrophobicContact CZ2-CH2 3.86Å; W44-W77 HydrophobicContact CZ2-CZ3 4.02Å; W44-W77 HydrophobicContact CZ3-CH2 4.18Å; W44-W77 AromaticContact CZ3-CZ3 3.79Å; W44-W77 HydrophobicContact CZ3-CZ3 3.79Å; W44-K182 HydrophobicContact CH2-CB 3.95Å; W44-K182 HydrophobicContact CH2-CG 3.99Å; W44-K182 WeakPolarHBondContact CH2-O 3.22Å; W44-K182 HydrophobicContact CZ2-CB 3.75Å; W44-K182 HydrophobicContact CZ2-CD 4.48Å; W44-K182 HydrophobicContact CZ2-CG 3.68Å; W44-K182 HydrophobicContact CZ3-CG 4.49Å; W44-F185 HydrophobicContact CH2-CB 3.9Å; W44-F185 HydrophobicContact CZ3-CB 3.71Å; W44-F185 HydrophobicContact CZ3-CG 4.31Å
45	G	85.2	Confident	90.2	Very high	48 Å²	48	63.8 Å²	63.8	50%	0.495	33%	0.327	S	S	.	.	S	Bend	trans	-70	-38.5	-176.9	0	0	0	0	0	113.9	A40	A40-G45 PolarHBondContact O-N 3.02Å
46	D	85.9	Confident	90.3	Very high	75 Å²	75	73.4 Å²	73.4	40%	0.401	37%	0.368	S	S	.	.	S	Bend	trans	-113.3	17.8	-175	-70.6	-61	0	0	0	113.3	Q48 K49 D50	D46-Q48 PolarHBondContact O-N 3.46Å; D46-K49 HydrophobicContact CB-CD 4.3Å; D46-K49 WeakPolarHBondContact O-CA 3.33Å; D46-K49 WeakPolarHBondContact O-CB 3.45Å; D46-K49 PolarHBondContact O-N 3.45Å; D46-K49 VanDerWaalsContact OD1-CD 3.31Å; D46-K49 WeakPolarHBondContact OD1-CD 3.4Å; D46-K49 WeakPolarHBondContact OD1-CE 3.43Å; D46-K49 IonicContact OD1-NZ 2.75Å; D46-K49 PolarHBondContact OD1-NZ 2.91Å; D46-D50 PolarHBondContact O-N 3.28Å; D46-D50 VanDerWaalsContact O-N 3.09Å
47	D	85.6	Confident	90.3	Very high	10 Å²	10	74.6 Å²	74.6	5%	0.053	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51	-32.1	-171.9	-106.3	43	0	0	0	116.2	W44 Y65 K182	W44-D47 WeakPolarHBondContact CA-OD1 3.32Å; W44-D47 VanDerWaalsContact CD1-OD2 3.24Å; D47-Y65 HydrophobicContact CB-CE2 4.32Å; D47-Y65 WeakPolarHBondContact O-CE2 3.42Å; D47-K182 WeakPolarHBondContact OD1-CE 3.28Å; D47-K182 IonicContact OD1-NZ 3.64Å; D47-K182 PolarHBondContact OD1-NZ 3.34Å; D47-K182 IonicContact OD2-NZ 3.69Å; D47-K182 PolarHBondContact OD2-NZ 3.02Å
48	Q	85.5	Confident	90.4	Very high	119 Å²	119	76.6 Å²	76.6	56%	0.556	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-16.2	179.9	-168.6	176.5	-0.1	0	0	113	D46 Y65	D46-Q48 PolarHBondContact O-N 3.46Å; Q48-Y65 HydrophobicContact CB-CE1 4.36Å; Q48-Y65 HydrophobicContact CB-CE2 4.25Å; Q48-Y65 HydrophobicContact CG-CD1 4.27Å; Q48-Y65 HydrophobicContact CG-CE1 4.32Å; Q48-Y65 HydrophobicContact CG-CG 4.41Å
49	K	87.8	Confident	90.5	Very high	160 Å²	160	75 Å²	75	70%	0.696	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-40.4	173.9	-56.9	179.8	-168.5	161.6	0	110.9	D46 F51	D46-K49 HydrophobicContact CB-CD 4.3Å; D46-K49 WeakPolarHBondContact O-CA 3.33Å; D46-K49 WeakPolarHBondContact O-CB 3.45Å; D46-K49 PolarHBondContact O-N 3.45Å; D46-K49 VanDerWaalsContact OD1-CD 3.31Å; D46-K49 WeakPolarHBondContact OD1-CD 3.4Å; D46-K49 WeakPolarHBondContact OD1-CE 3.43Å; D46-K49 IonicContact OD1-NZ 2.75Å; D46-K49 PolarHBondContact OD1-NZ 2.91Å; K49-F51 PolarHBondContact O-N 3.49Å
50	D	89.5	Confident	90.7	Very high	73 Å²	73	75 Å²	75	39%	0.39	39%	0.387	S	S	.	.	S	Bend	trans	-84	15.3	180	-55.1	-25.2	0	0	0	112.9	D46 G177 H178	D46-D50 PolarHBondContact O-N 3.28Å; D46-D50 VanDerWaalsContact O-N 3.09Å; D50-G177 WeakPolarHBondContact O-CA 3.25Å; D50-G177 PolarHBondContact O-N 3.18Å; D50-H178 IonicContact OD2-CD2 2.82Å
51	F	92.1	Very high	90.8	Very high	11 Å²	11	75.5 Å²	75.5	5%	0.048	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	90.9	172.8	-174.9	-94.9	0	0	0	109.2	K49 C53 P61 C64 Y65 I68 C174 I176	K49-F51 PolarHBondContact O-N 3.49Å; F51-C53 WeakPolarHBondContact CE1-SG 3.36Å; F51-P61 WeakPolarHBondContact CE1-O 3.49Å; F51-C64 HydrophobicContact CE1-CB 3.85Å; F51-C64 HydrophobicContact CZ-CB 3.98Å; F51-Y65 HydrophobicContact CB-CD2 3.88Å; F51-Y65 HydrophobicContact CD1-CD2 4.15Å; F51-Y65 HydrophobicContact CD1-CG 4.45Å; F51-Y65 HydrophobicContact CD2-CD2 4.05Å; F51-Y65 AromaticContact CG-CD2 3.77Å; F51-Y65 HydrophobicContact CG-CD2 3.77Å; F51-Y65 HydrophobicContact CG-CG 4.5Å; F51-I68 HydrophobicContact CE2-CG2 4.15Å; F51-I68 HydrophobicContact CZ-CG2 4.36Å; F51-C174 HydrophobicContact CE1-CB 4.08Å; F51-C174 HydrophobicContact CE2-CB 4.14Å; F51-C174 HydrophobicContact CZ-CB 3.62Å; F51-I176 HydrophobicContact CD2-CG1 4.25Å; F51-I176 HydrophobicContact CE2-CG1 4.13Å
52	D	94	Very high	91.1	Very high	107 Å²	107	73.9 Å²	73.9	57%	0.572	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.8	141.6	-178.6	-177.5	32.8	0	0	0	111.1	C174 Y175	D52-C174 CarbonylContact O-C 3.56Å; D52-C174 VanDerWaalsContact O-CA 3.31Å; D52-C174 WeakPolarHBondContact O-CA 3.23Å; D52-Y175 PolarHBondContact N-O 3.04Å; D52-Y175 PolarHBondContact O-N 3.37Å
53	C	95.1	Very high	91.4	Very high	4 Å²	4	66.7 Å²	66.7	3%	0.027	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	136.4	177	-64.2	0	0	0	0	109.9	F51 T55 P61 D173 C174	F51-C53 WeakPolarHBondContact CE1-SG 3.36Å; C53-T55 HydrophobicContact CB-CG2 3.94Å; C53-T55 PolarHBondContact O-N 3.06Å; C53-P61 HydrophobicContact CB-CG 4.24Å; C53-D173 WeakPolarHBondContact CA-O 3.34Å; C53-C174 HydrophobicContact CB-CB 4.1Å; C53-C174 WeakPolarHBondContact CB-SG 3.33Å; C53-C174 WeakPolarHBondContact SG-CB 3.45Å; C53-C174 CovalentContact SG-SG 2.04Å; C53-C174 PolarHBondContact SG-SG 3.47Å
54	N	95.3	Very high	91.7	Very high	122 Å²	122	66.2 Å²	66.2	65%	0.652	36%	0.358	S	S	*	.	S	Bend	trans	-71.7	70.6	179.8	-173.6	16	0	0	0	112	D173	N54-D173 HydrophobicContact CB-CB 4.46Å; N54-D173 PolarHBondContact N-O 3.29Å
55	T	94.2	Very high	91.9	Very high	38 Å²	38	66.6 Å²	66.6	23%	0.233	36%	0.359	C	S	.	.			trans	-160.3	152.9	-176.4	-173.1	0	0	0	0	110.8	C53 Q57 C60	C53-T55 HydrophobicContact CB-CG2 3.94Å; C53-T55 PolarHBondContact O-N 3.06Å; T55-Q57 WeakPolarHBondContact OG1-CB 3.39Å; T55-Q57 PolarHBondContact OG1-N 3.44Å; T55-Q57 VanDerWaalsContact OG1-N 3.17Å; T55-C60 HydrophobicContact CG2-CB 4.11Å
56	K	93.4	Very high	92.2	Very high	215 Å²	215	69.4 Å²	69.4	94%	0.935	36%	0.363	S	S	*	.			trans	-104	6.7	170.1	-63.8	-175.7	179.5	-179.6	0	112.6	P58	K56-P58 WeakPolarHBondContact O-CD 3.47Å
57	Q	93.7	Very high	92.5	Very high	78 Å²	78	71.1 Å²	71.1	36%	0.364	37%	0.368	S	S	.	.			trans	-76.5	118.4	-176.9	-178	61.2	18.2	0	0	110.9	T55 C60 P167	T55-Q57 WeakPolarHBondContact OG1-CB 3.39Å; T55-Q57 PolarHBondContact OG1-N 3.44Å; T55-Q57 VanDerWaalsContact OG1-N 3.17Å; Q57-C60 HydrophobicContact CB-CB 4.06Å; Q57-C60 HydrophobicContact CG-CB 4.14Å; Q57-C60 WeakPolarHBondContact O-CB 3.45Å; Q57-C60 PolarHBondContact O-N 2.74Å; Q57-P167 WeakPolarHBondContact CG-O 3.21Å
58	P	94.6	Very high	92.6	Very high	102 Å²	102	72.2 Å²	72.2	66%	0.662	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	142.6	178.5	26.1	-34.7	0	0	0	111.4	K56 C60	K56-P58 WeakPolarHBondContact O-CD 3.47Å; P58-C60 PolarHBondContact O-N 3.46Å; P58-C60 VanDerWaalsContact O-N 3.16Å
59	G	93.7	Very high	92.8	Very high	32 Å²	32	66.9 Å²	66.9	33%	0.33	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.4	-17.7	-179.8	0	0	0	0	0	115.8	N62 V63	G59-N62 PolarHBondContact O-N 3.18Å; G59-V63 PolarHBondContact O-N 3Å; G59-V63 VanDerWaalsContact O-N 3.15Å
60	C	94.8	Very high	92.8	Very high	0 Å²	0	63 Å²	63	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-58.7	-47	177.9	173.2	0	0	0	0	112.9	T55 Q57 P58 N62 V63 C64 C168	T55-C60 HydrophobicContact CG2-CB 4.11Å; Q57-C60 HydrophobicContact CB-CB 4.06Å; Q57-C60 HydrophobicContact CG-CB 4.14Å; Q57-C60 WeakPolarHBondContact O-CB 3.45Å; Q57-C60 PolarHBondContact O-N 2.74Å; P58-C60 PolarHBondContact O-N 3.46Å; P58-C60 VanDerWaalsContact O-N 3.16Å; C60-N62 VanDerWaalsContact C-N 3.31Å; C60-N62 PolarHBondContact O-N 3.27Å; C60-V63 VanDerWaalsContact O-CG2 3.29Å; C60-V63 WeakPolarHBondContact O-CG2 3.49Å; C60-V63 PolarHBondContact O-N 2.92Å; C60-C64 WeakPolarHBondContact O-CB 3.45Å; C60-C64 PolarHBondContact O-N 3.23Å; C60-C64 PolarHBondContact O-SG 3.47Å; C60-C168 VanDerWaalsContact CA-SG 3.58Å; C60-C168 HydrophobicContact CB-CB 4.11Å; C60-C168 WeakPolarHBondContact CB-SG 3.47Å; C60-C168 WeakPolarHBondContact SG-CB 3.31Å; C60-C168 CovalentContact SG-SG 2.03Å; C60-C168 PolarHBondContact SG-SG 2.97Å
61	P	93.3	Very high	92.8	Very high	37 Å²	37	63 Å²	63	24%	0.24	34%	0.339	C	S	.	.	H	α-helix	trans	-58.2	-39.7	174.5	-24.1	33.8	0	0	0	113.5	F51 C53 C64 Y65	F51-P61 WeakPolarHBondContact CE1-O 3.49Å; C53-P61 HydrophobicContact CB-CG 4.24Å; P61-C64 PolarHBondContact O-N 3.26Å; P61-Y65 VanDerWaalsContact O-CB 3.31Å; P61-Y65 WeakPolarHBondContact O-CB 3.32Å; P61-Y65 PolarHBondContact O-N 2.9Å
62	N	93.9	Very high	92.6	Very high	95 Å²	95	62.9 Å²	62.9	51%	0.508	34%	0.34	S	S	.	.	H	α-helix	trans	-63.7	-46.1	-179.6	-65.5	63.6	0	0	0	112.5	G59 C60 D66	G59-N62 PolarHBondContact O-N 3.18Å; C60-N62 VanDerWaalsContact C-N 3.31Å; C60-N62 PolarHBondContact O-N 3.27Å; N62-D66 PolarHBondContact O-N 3.39Å; N62-D66 VanDerWaalsContact O-N 3.08Å
63	V	94.7	Very high	92.4	Very high	45 Å²	45	58.1 Å²	58.1	27%	0.273	31%	0.314	S	S	.	.	H	α-helix	trans	-71.3	-35.2	179.2	-59.2	0	0	0	0	111.9	G59 C60 D66 H67 V165	G59-V63 PolarHBondContact O-N 3Å; G59-V63 VanDerWaalsContact O-N 3.15Å; C60-V63 VanDerWaalsContact O-CG2 3.29Å; C60-V63 WeakPolarHBondContact O-CG2 3.49Å; C60-V63 PolarHBondContact O-N 2.92Å; V63-D66 PolarHBondContact O-N 2.78Å; V63-H67 VanDerWaalsContact O-CB 3.25Å; V63-H67 WeakPolarHBondContact O-CB 3.4Å; V63-H67 PolarHBondContact O-N 3.27Å; V63-V165 HydrophobicContact CB-CG1 4.05Å; V63-V165 HydrophobicContact CG2-CB 4.14Å; V63-V165 HydrophobicContact CG2-CG1 3.95Å
64	C	94.4	Very high	92.1	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-66.3	-39.8	175.8	-65.8	0	0	0	0	111.9	F51 C60 P61 I68 C163 C168	F51-C64 HydrophobicContact CE1-CB 3.85Å; F51-C64 HydrophobicContact CZ-CB 3.98Å; C60-C64 WeakPolarHBondContact O-CB 3.45Å; C60-C64 PolarHBondContact O-N 3.23Å; C60-C64 PolarHBondContact O-SG 3.47Å; P61-C64 PolarHBondContact O-N 3.26Å; C64-I68 VanDerWaalsContact O-CG2 3.31Å; C64-I68 WeakPolarHBondContact O-CG2 3.33Å; C64-I68 PolarHBondContact O-N 3.37Å; C64-C163 WeakPolarHBondContact CA-SG 3.21Å; C64-C163 HydrophobicContact CB-CB 3.76Å; C64-C163 WeakPolarHBondContact CB-SG 3.24Å; C64-C163 WeakPolarHBondContact SG-CB 3.41Å; C64-C163 CovalentContact SG-SG 2.03Å; C64-C163 PolarHBondContact SG-SG 3.19Å; C64-C168 PolarHBondContact SG-SG 2.86Å
65	Y	92.6	Very high	92	Very high	27 Å²	27	60.2 Å²	60.2	11%	0.106	31%	0.314	C	S	.	.	H	α-helix	trans	-63.9	-46.9	174.8	178.9	-89.2	0	0	0	111.8	D47 Q48 F51 P61 H67 I68 F69	D47-Y65 HydrophobicContact CB-CE2 4.32Å; D47-Y65 WeakPolarHBondContact O-CE2 3.42Å; Q48-Y65 HydrophobicContact CB-CE1 4.36Å; Q48-Y65 HydrophobicContact CB-CE2 4.25Å; Q48-Y65 HydrophobicContact CG-CD1 4.27Å; Q48-Y65 HydrophobicContact CG-CE1 4.32Å; Q48-Y65 HydrophobicContact CG-CG 4.41Å; F51-Y65 HydrophobicContact CB-CD2 3.88Å; F51-Y65 HydrophobicContact CD1-CD2 4.15Å; F51-Y65 HydrophobicContact CD1-CG 4.45Å; F51-Y65 HydrophobicContact CD2-CD2 4.05Å; F51-Y65 AromaticContact CG-CD2 3.77Å; F51-Y65 HydrophobicContact CG-CD2 3.77Å; F51-Y65 HydrophobicContact CG-CG 4.5Å; P61-Y65 VanDerWaalsContact O-CB 3.31Å; P61-Y65 WeakPolarHBondContact O-CB 3.32Å; P61-Y65 PolarHBondContact O-N 2.9Å; Y65-H67 VanDerWaalsContact C-N 3.33Å; Y65-H67 PolarHBondContact O-N 3.2Å; Y65-I68 PolarHBondContact O-N 3.02Å; Y65-F69 AromaticContact CD2-CD2 3.72Å; Y65-F69 HydrophobicContact CD2-CD2 3.72Å; Y65-F69 HydrophobicContact CD2-CE2 4.24Å; Y65-F69 HydrophobicContact CE1-CB 4.49Å; Y65-F69 AromaticContact CE2-CD2 3.53Å; Y65-F69 HydrophobicContact CE2-CD2 3.53Å; Y65-F69 HydrophobicContact CE2-CE2 4.05Å; Y65-F69 HydrophobicContact CE2-CG 4.49Å; Y65-F69 HydrophobicContact CG-CD2 4.36Å; Y65-F69 WeakPolarHBondContact O-CB 3.15Å; Y65-F69 PolarHBondContact O-N 2.94Å
66	D	92.7	Very high	91.9	Very high	108 Å²	108	58.8 Å²	58.8	58%	0.578	30%	0.304	S	S	*	.	H	α-helix	trans	-65	-37.8	179.2	-164.3	68.4	0	0	0	111.8	N62 V63 F69 P70	N62-D66 PolarHBondContact O-N 3.39Å; N62-D66 VanDerWaalsContact O-N 3.08Å; V63-D66 PolarHBondContact O-N 2.78Å; D66-F69 CarbonylContact O-C 3.47Å; D66-P70 WeakPolarHBondContact O-CA 3.3Å; D66-P70 WeakPolarHBondContact O-CD 3.24Å; D66-P70 VanDerWaalsContact O-N 3.14Å
67	H	91.4	Very high	91.9	Very high	111 Å²	111	48.6 Å²	48.6	51%	0.514	26%	0.26	S	S	.	.	H	α-helix	trans	-67.5	-38.3	178.9	-172.7	43.9	0	0	0	113.6	V63 Y65 Y161 V165	V63-H67 VanDerWaalsContact O-CB 3.25Å; V63-H67 WeakPolarHBondContact O-CB 3.4Å; V63-H67 PolarHBondContact O-N 3.27Å; Y65-H67 VanDerWaalsContact C-N 3.33Å; Y65-H67 PolarHBondContact O-N 3.2Å; H67-Y161 PolarHBondContact CD2-OH 2.85Å; H67-V165 HydrophobicContact CB-CG2 4.12Å; H67-V165 WeakPolarHBondContact CD2-CG2 3.45Å
68	I	88.4	Confident	91.9	Very high	33 Å²	33	46 Å²	46	17%	0.169	25%	0.251	C	S	.	.	H	α-helix	trans	-84.6	-27	175.9	-166.3	-176.7	0	0	0	113.2	F51 C64 Y65 P70 Y161 I176	F51-I68 HydrophobicContact CE2-CG2 4.15Å; F51-I68 HydrophobicContact CZ-CG2 4.36Å; C64-I68 VanDerWaalsContact O-CG2 3.31Å; C64-I68 WeakPolarHBondContact O-CG2 3.33Å; C64-I68 PolarHBondContact O-N 3.37Å; Y65-I68 PolarHBondContact O-N 3.02Å; I68-P70 WeakPolarHBondContact O-CD 2.98Å; I68-Y161 HydrophobicContact CB-CD1 4.33Å; I68-Y161 HydrophobicContact CB-CE1 4.21Å; I68-Y161 HydrophobicContact CD1-CD1 4.24Å; I68-Y161 HydrophobicContact CD1-CD2 3.76Å; I68-Y161 HydrophobicContact CD1-CE2 4.37Å; I68-Y161 HydrophobicContact CD1-CG 3.69Å; I68-Y161 HydrophobicContact CG1-CD2 4.31Å; I68-Y161 HydrophobicContact CG1-CE2 4.44Å; I68-Y161 HydrophobicContact CG1-CG 4.46Å; I68-I176 HydrophobicContact CD1-CD1 3.63Å
69	F	89.4	Confident	91.9	Very high	6 Å²	6	44.7 Å²	44.7	3%	0.026	24%	0.239	C	C	.	.			trans	-121.6	53.2	-179.1	-60.9	-58.3	0	0	0	114.5	Y65 D66 I71 Y152 L157 I176	Y65-F69 AromaticContact CD2-CD2 3.72Å; Y65-F69 HydrophobicContact CD2-CD2 3.72Å; Y65-F69 HydrophobicContact CD2-CE2 4.24Å; Y65-F69 HydrophobicContact CE1-CB 4.49Å; Y65-F69 AromaticContact CE2-CD2 3.53Å; Y65-F69 HydrophobicContact CE2-CD2 3.53Å; Y65-F69 HydrophobicContact CE2-CE2 4.05Å; Y65-F69 HydrophobicContact CE2-CG 4.49Å; Y65-F69 HydrophobicContact CG-CD2 4.36Å; Y65-F69 WeakPolarHBondContact O-CB 3.15Å; Y65-F69 PolarHBondContact O-N 2.94Å; D66-F69 CarbonylContact O-C 3.47Å; F69-I71 PolarHBondContact O-N 2.92Å; F69-I71 VanDerWaalsContact O-N 3.1Å; F69-Y152 HydrophobicContact CD1-CE1 4.1Å; F69-Y152 HydrophobicContact CE1-CE1 4.42Å; F69-L157 HydrophobicContact CE1-CD1 3.69Å; F69-L157 HydrophobicContact CZ-CD1 3.87Å; F69-I176 HydrophobicContact CE2-CG2 4.3Å; F69-I176 HydrophobicContact CZ-CD1 4.16Å; F69-I176 HydrophobicContact CZ-CG2 3.95Å
70	P	88.1	Confident	91.9	Very high	78 Å²	78	43.2 Å²	43.2	51%	0.506	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-31.3	-175.7	24.1	-34.8	0	0	0	113	D66 I68	D66-P70 WeakPolarHBondContact O-CA 3.3Å; D66-P70 WeakPolarHBondContact O-CD 3.24Å; D66-P70 VanDerWaalsContact O-N 3.14Å; I68-P70 WeakPolarHBondContact O-CD 2.98Å
71	I	89.1	Confident	91.7	Very high	75 Å²	75	43.8 Å²	43.8	39%	0.385	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-138.6	102.5	163.8	-48.5	176.9	0	0	0	108.6	F69 R75 L76 Y152	F69-I71 PolarHBondContact O-N 2.92Å; F69-I71 VanDerWaalsContact O-N 3.1Å; I71-R75 HydrophobicContact CG2-CB 4.07Å; I71-L76 HydrophobicContact CB-CD2 4.44Å; I71-L76 HydrophobicContact CB-CG 4.44Å; I71-L76 HydrophobicContact CG2-CD2 3.81Å; I71-L76 HydrophobicContact CG2-CG 3.85Å; I71-Y152 PolarHBondContact O-OH 2.88Å
72	S	88.6	Confident	91.7	Very high	8 Å²	8	46.5 Å²	46.5	6%	0.056	24%	0.238	C	C	.	.			trans	-57.3	143.4	-177.2	62.2	0	0	0	0	113.9	I74 R75 L76 Y152	S72-I74 PolarHBondContact O-N 2.9Å; S72-R75 WeakPolarHBondContact O-CB 3.24Å; S72-R75 PolarHBondContact O-N 3.27Å; S72-R75 WeakPolarHBondContact OG-CD 3.38Å; S72-R75 WeakPolarHBondContact OG-CG 3.37Å; S72-L76 PolarHBondContact O-N 2.98Å; S72-Y152 VanDerWaalsContact CA-OH 3.28Å; S72-Y152 WeakPolarHBondContact CA-OH 3.46Å
73	H	88.7	Confident	91.6	Very high	6 Å²	6	47 Å²	47	3%	0.028	24%	0.235	C	C	.	.	H	α-helix	trans	-37.8	-49.8	177.1	-75.8	83.8	0	0	0	113.6	W44 R75 L76 W77 Y152	W44-H73 HydrophobicContact CZ2-CB 4.01Å; H73-R75 VanDerWaalsContact C-N 3.33Å; H73-R75 PolarHBondContact O-N 3.43Å; H73-L76 PolarHBondContact O-N 2.94Å; H73-W77 HydrophobicContact CB-CH2 4.02Å; H73-W77 HydrophobicContact CB-CZ2 4.04Å; H73-W77 HydrophobicContact CB-CZ3 4.36Å; H73-W77 AromaticContact CD2-CZ2 3.87Å; H73-W77 PolarHBondContact O-N 3.5Å; H73-Y152 HydrophobicContact CB-CE2 4.38Å; H73-Y152 AromaticContact CD2-CD2 3.79Å; H73-Y152 AromaticContact CD2-CE2 3.83Å; H73-Y152 AromaticContact CE1-CD1 3.45Å; H73-Y152 VanDerWaalsContact CE1-CD1 3.45Å; H73-Y152 WeakPolarHBondContact CE1-CD1 3.28Å; H73-Y152 AromaticContact CE1-CD2 3.47Å; H73-Y152 VanDerWaalsContact CE1-CD2 3.47Å; H73-Y152 WeakPolarHBondContact CE1-CD2 3.42Å; H73-Y152 AromaticContact CE1-CE1 3.49Å; H73-Y152 VanDerWaalsContact CE1-CE1 3.49Å; H73-Y152 WeakPolarHBondContact CE1-CE1 3.3Å; H73-Y152 AromaticContact CE1-CE2 3.47Å; H73-Y152 VanDerWaalsContact CE1-CE2 3.47Å; H73-Y152 WeakPolarHBondContact CE1-CE2 3.49Å; H73-Y152 AromaticContact CE1-CG 3.42Å; H73-Y152 VanDerWaalsContact CE1-CG 3.42Å; H73-Y152 AromaticContact CE1-CZ 3.46Å; H73-Y152 VanDerWaalsContact CE1-CZ 3.46Å; H73-Y152 AromaticContact CG-CE2 3.58Å; H73-Y152 AromaticContact CG-CZ 3.92Å; H73-Y152 PolarHBondContact N-OH 3.36Å; H73-Y152 VanDerWaalsContact N-OH 3.13Å; H73-Y152 AromaticContact ND1-CD2 3.85Å; H73-Y152 AromaticContact ND1-CE1 3.68Å; H73-Y152 AromaticContact ND1-CE2 3.36Å; H73-Y152 WeakPolarHBondContact ND1-CE2 3.08Å; H73-Y152 AromaticContact ND1-CZ 3.24Å; H73-Y152 PolarHBondContact ND1-OH 3.06Å; H73-Y152 AromaticContact NE2-CD2 3.45Å; H73-Y152 WeakPolarHBondContact NE2-CD2 3.46Å; H73-Y152 AromaticContact NE2-CE2 3.79Å; H73-Y152 AromaticContact NE2-CG 3.58Å
74	I	89.9	Confident	91.5	Very high	20 Å²	20	45.3 Å²	45.3	10%	0.103	23%	0.226	C	C	.	.	H	α-helix	trans	-63.6	-35.9	-177.1	-159.9	64.9	0	0	0	112.5	Y36 A39 A40 W44 S72 W77 A78	Y36-I74 HydrophobicContact CD2-CD1 3.67Å; Y36-I74 HydrophobicContact CD2-CG1 4.49Å; Y36-I74 HydrophobicContact CE2-CD1 3.5Å; Y36-I74 HydrophobicContact CE2-CG1 3.84Å; Y36-I74 WeakPolarHBondContact CE2-O 3.43Å; A39-I74 HydrophobicContact CB-CD1 4.2Å; A40-I74 HydrophobicContact CB-CD1 3.88Å; A40-I74 HydrophobicContact CB-CG1 3.86Å; W44-I74 HydrophobicContact CB-CB 4.11Å; W44-I74 HydrophobicContact CB-CG1 4.32Å; W44-I74 HydrophobicContact CB-CG2 4.04Å; W44-I74 HydrophobicContact CD2-CB 4.34Å; W44-I74 HydrophobicContact CE3-CD1 4.5Å; W44-I74 HydrophobicContact CG-CB 3.96Å; W44-I74 HydrophobicContact CG-CG2 4.15Å; S72-I74 PolarHBondContact O-N 2.9Å; I74-W77 HydrophobicContact CD1-CE3 3.84Å; I74-W77 HydrophobicContact CD1-CZ3 4.26Å; I74-W77 PolarHBondContact O-N 2.8Å; I74-A78 WeakPolarHBondContact O-CB 3.31Å; I74-A78 PolarHBondContact O-N 2.62Å
75	R	92.4	Very high	91.1	Very high	151 Å²	151	46.8 Å²	46.8	57%	0.57	23%	0.234	S	C	*	.	H	α-helix	trans	-67.7	-40	175.3	-65.3	173.9	-178.9	170.5	2.8	111.2	I71 S72 H73 A78 L79	I71-R75 HydrophobicContact CG2-CB 4.07Å; S72-R75 WeakPolarHBondContact O-CB 3.24Å; S72-R75 PolarHBondContact O-N 3.27Å; S72-R75 WeakPolarHBondContact OG-CD 3.38Å; S72-R75 WeakPolarHBondContact OG-CG 3.37Å; H73-R75 VanDerWaalsContact C-N 3.33Å; H73-R75 PolarHBondContact O-N 3.43Å; R75-A78 PolarHBondContact O-N 3.44Å; R75-L79 WeakPolarHBondContact O-CG 3.39Å; R75-L79 PolarHBondContact O-N 2.93Å
76	L	92.1	Very high	91	Very high	7 Å²	7	48.6 Å²	48.6	4%	0.037	25%	0.25	C	S	.	.	H	α-helix	trans	-65.3	-41.6	175.3	-69	175.4	0	0	0	111.8	I71 S72 H73 L79 Q80 I147 L148 I151 Y152	I71-L76 HydrophobicContact CB-CD2 4.44Å; I71-L76 HydrophobicContact CB-CG 4.44Å; I71-L76 HydrophobicContact CG2-CD2 3.81Å; I71-L76 HydrophobicContact CG2-CG 3.85Å; S72-L76 PolarHBondContact O-N 2.98Å; H73-L76 PolarHBondContact O-N 2.94Å; L76-L79 PolarHBondContact O-N 3.2Å; L76-Q80 WeakPolarHBondContact O-CB 3.45Å; L76-Q80 PolarHBondContact O-N 2.76Å; L76-I147 HydrophobicContact CD2-CG2 4.46Å; L76-L148 HydrophobicContact CB-CD2 3.93Å; L76-L148 HydrophobicContact CD1-CD2 3.66Å; L76-L148 HydrophobicContact CD1-CG 4.35Å; L76-L148 HydrophobicContact CG-CD2 4.46Å; L76-I151 HydrophobicContact CD1-CD1 4.26Å; L76-Y152 HydrophobicContact CD1-CE2 4.15Å
77	W	93.2	Very high	90.8	Very high	2 Å²	2	44 Å²	44	1%	0.008	23%	0.226	C	C	.	.	H	α-helix	trans	-67.3	-35.9	174.6	-61.6	-27.7	0	0	0	113.1	Y36 W44 H73 I74 Q80 L81 T186 M189	Y36-W77 HydrophobicContact CD2-CB 3.98Å; Y36-W77 HydrophobicContact CE2-CB 4.3Å; W44-W77 HydrophobicContact CE3-CZ3 4.36Å; W44-W77 AromaticContact CH2-CH2 3.5Å; W44-W77 HydrophobicContact CH2-CH2 3.5Å; W44-W77 AromaticContact CH2-CZ3 3.57Å; W44-W77 HydrophobicContact CH2-CZ3 3.57Å; W44-W77 AromaticContact CZ2-CH2 3.86Å; W44-W77 HydrophobicContact CZ2-CH2 3.86Å; W44-W77 HydrophobicContact CZ2-CZ3 4.02Å; W44-W77 HydrophobicContact CZ3-CH2 4.18Å; W44-W77 AromaticContact CZ3-CZ3 3.79Å; W44-W77 HydrophobicContact CZ3-CZ3 3.79Å; H73-W77 HydrophobicContact CB-CH2 4.02Å; H73-W77 HydrophobicContact CB-CZ2 4.04Å; H73-W77 HydrophobicContact CB-CZ3 4.36Å; H73-W77 AromaticContact CD2-CZ2 3.87Å; H73-W77 PolarHBondContact O-N 3.5Å; I74-W77 HydrophobicContact CD1-CE3 3.84Å; I74-W77 HydrophobicContact CD1-CZ3 4.26Å; I74-W77 PolarHBondContact O-N 2.8Å; W77-Q80 PolarHBondContact O-N 3.29Å; W77-L81 WeakPolarHBondContact O-CB 3.44Å; W77-L81 WeakPolarHBondContact O-CG 3.41Å; W77-L81 PolarHBondContact O-N 2.93Å; W77-T186 VanDerWaalsContact CH2-OG1 3.29Å; W77-T186 WeakPolarHBondContact CH2-OG1 3.48Å; W77-T186 HydrophobicContact CZ2-CG2 4.13Å; W77-T186 WeakPolarHBondContact CZ2-OG1 3.3Å; W77-M189 HydrophobicContact CB-CE 3.76Å; W77-M189 HydrophobicContact CD2-CB 4.26Å; W77-M189 HydrophobicContact CD2-CE 3.92Å; W77-M189 HydrophobicContact CD2-CG 4.14Å; W77-M189 HydrophobicContact CE3-CE 4.11Å; W77-M189 HydrophobicContact CE3-CG 4.05Å; W77-M189 HydrophobicContact CG-CE 3.75Å; W77-M189 HydrophobicContact CH2-CG 4.37Å; W77-M189 HydrophobicContact CZ2-CB 4.16Å; W77-M189 HydrophobicContact CZ2-CG 4.43Å; W77-M189 HydrophobicContact CZ3-CG 4.17Å
78	A	93.9	Very high	90.5	Very high	22 Å²	22	40.5 Å²	40.5	18%	0.182	21%	0.214	C	C	.	.	H	α-helix	trans	-59.9	-49.7	173.7	0	0	0	0	0	111	Y36 I74 R75 L81 I82	Y36-A78 HydrophobicContact CE2-CB 3.89Å; Y36-A78 WeakPolarHBondContact OH-CB 3.5Å; I74-A78 WeakPolarHBondContact O-CB 3.31Å; I74-A78 PolarHBondContact O-N 2.62Å; R75-A78 PolarHBondContact O-N 3.44Å; A78-L81 PolarHBondContact O-N 3.42Å; A78-I82 VanDerWaalsContact O-CG1 3.3Å; A78-I82 WeakPolarHBondContact O-CG1 3.45Å; A78-I82 PolarHBondContact O-N 2.96Å
79	L	94.1	Very high	90.3	Very high	75 Å²	75	43.9 Å²	43.9	39%	0.393	23%	0.228	S	C	.	.	H	α-helix	trans	-60.9	-45.5	175.7	-69.6	168.4	0	0	0	111.4	R75 L76 L81 I82 F83 F144	R75-L79 WeakPolarHBondContact O-CG 3.39Å; R75-L79 PolarHBondContact O-N 2.93Å; L76-L79 PolarHBondContact O-N 3.2Å; L79-L81 PolarHBondContact O-N 2.91Å; L79-I82 PolarHBondContact O-N 2.98Å; L79-F83 VanDerWaalsContact O-CD2 3.25Å; L79-F83 WeakPolarHBondContact O-CD2 3.4Å; L79-F83 PolarHBondContact O-N 3.29Å; L79-F144 HydrophobicContact CB-CE1 3.82Å; L79-F144 HydrophobicContact CB-CZ 3.88Å
80	Q	94.2	Very high	90.1	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-59	-44.6	177.6	-170.6	179.8	12.9	0	0	112.2	R32 L76 W77 F83 V84 E141 F144	R32-Q80 VanDerWaalsContact NH2-CG 3.31Å; L76-Q80 WeakPolarHBondContact O-CB 3.45Å; L76-Q80 PolarHBondContact O-N 2.76Å; W77-Q80 PolarHBondContact O-N 3.29Å; Q80-F83 PolarHBondContact O-N 3.14Å; Q80-V84 WeakPolarHBondContact O-CB 3.43Å; Q80-V84 WeakPolarHBondContact O-CG1 3.4Å; Q80-V84 PolarHBondContact O-N 3.18Å; Q80-E141 WeakPolarHBondContact CG-OE1 3.46Å; Q80-E141 PolarHBondContact NE2-OE1 3.03Å; Q80-F144 HydrophobicContact CB-CB 3.98Å; Q80-F144 HydrophobicContact CB-CD1 3.73Å; Q80-F144 HydrophobicContact CB-CD2 3.97Å; Q80-F144 HydrophobicContact CB-CE1 4.19Å; Q80-F144 HydrophobicContact CB-CE2 4.41Å; Q80-F144 HydrophobicContact CB-CG 3.62Å; Q80-F144 VanDerWaalsContact CD-CB 3.42Å; Q80-F144 HydrophobicContact CG-CB 3.49Å; Q80-F144 VanDerWaalsContact CG-CB 3.49Å; Q80-F144 HydrophobicContact CG-CD1 4.22Å; Q80-F144 HydrophobicContact CG-CD2 3.86Å; Q80-F144 HydrophobicContact CG-CG 3.6Å
81	L	91.7	Very high	89.9	Confident	13 Å²	13	45 Å²	45	7%	0.068	23%	0.229	C	C	.	.	H	α-helix	trans	-63.1	-42	175.6	-75.7	173.6	0	0	0	111.8	F29 R32 V33 Y36 W77 A78 L79 T85	F29-L81 HydrophobicContact CD2-CD2 4.39Å; F29-L81 HydrophobicContact CE2-CD2 3.7Å; F29-L81 HydrophobicContact CZ-CD2 4.3Å; R32-L81 HydrophobicContact CG-CD2 4.24Å; V33-L81 HydrophobicContact CG2-CD1 4.4Å; V33-L81 HydrophobicContact CG2-CD2 4.12Å; Y36-L81 HydrophobicContact CD1-CD1 3.98Å; Y36-L81 HydrophobicContact CD2-CD1 3.94Å; Y36-L81 HydrophobicContact CG-CD1 3.57Å; W77-L81 WeakPolarHBondContact O-CB 3.44Å; W77-L81 WeakPolarHBondContact O-CG 3.41Å; W77-L81 PolarHBondContact O-N 2.93Å; A78-L81 PolarHBondContact O-N 3.42Å; L79-L81 PolarHBondContact O-N 2.91Å; L81-T85 WeakPolarHBondContact O-CG2 3.37Å; L81-T85 PolarHBondContact O-N 3.14Å; L81-T85 VanDerWaalsContact O-N 3.16Å; L81-T85 PolarHBondContact O-OG1 3.24Å
82	I	91.5	Very high	89.6	Confident	94 Å²	94	42.9 Å²	42.9	48%	0.482	22%	0.219	S	C	.	.	H	α-helix	trans	-60	-57.1	174	-68.4	162.7	0	0	0	109.8	A78 L79 V84 T85 C86	A78-I82 VanDerWaalsContact O-CG1 3.3Å; A78-I82 WeakPolarHBondContact O-CG1 3.45Å; A78-I82 PolarHBondContact O-N 2.96Å; L79-I82 PolarHBondContact O-N 2.98Å; I82-V84 PolarHBondContact O-N 2.83Å; I82-T85 PolarHBondContact O-N 3.48Å; I82-T85 VanDerWaalsContact O-N 3.09Å; I82-T85 PolarHBondContact O-OG1 2.94Å; I82-C86 PolarHBondContact O-N 3.36Å; I82-C86 PolarHBondContact O-SG 3.41Å; I82-C86 VanDerWaalsContact O-SG 3.4Å
83	F	93.6	Very high	89.3	Confident	104 Å²	104	49 Å²	49	46%	0.456	25%	0.248	S	C	.	.	H	α-helix	trans	-62.3	-36.1	-176.2	-80.7	-72	0	0	0	113.4	L79 Q80 T85 C86 P87 I140 F144	L79-F83 VanDerWaalsContact O-CD2 3.25Å; L79-F83 WeakPolarHBondContact O-CD2 3.4Å; L79-F83 PolarHBondContact O-N 3.29Å; Q80-F83 PolarHBondContact O-N 3.14Å; F83-T85 VanDerWaalsContact C-N 3.34Å; F83-C86 PolarHBondContact O-N 3.48Å; F83-P87 WeakPolarHBondContact O-CD 3.43Å; F83-I140 HydrophobicContact CB-CD1 4.38Å; F83-I140 HydrophobicContact CB-CG2 3.72Å; F83-F144 HydrophobicContact CB-CE2 4.03Å; F83-F144 AromaticContact CD2-CE2 3.81Å; F83-F144 HydrophobicContact CD2-CE2 3.81Å; F83-F144 AromaticContact CD2-CZ 3.69Å; F83-F144 HydrophobicContact CD2-CZ 3.69Å; F83-F144 HydrophobicContact CE2-CZ 4.29Å; F83-F144 HydrophobicContact CG-CE2 4.19Å
84	V	90.6	Very high	89.1	Confident	11 Å²	11	51 Å²	51	7%	0.067	26%	0.258	C	S	.	.	H	α-helix	trans	-74.1	-23.4	176.8	81.2	0	0	0	0	112.9	F29 Q80 I82 K137 I140 E141	F29-V84 HydrophobicContact CD2-CG1 4.38Å; F29-V84 HydrophobicContact CE2-CG1 3.9Å; Q80-V84 WeakPolarHBondContact O-CB 3.43Å; Q80-V84 WeakPolarHBondContact O-CG1 3.4Å; Q80-V84 PolarHBondContact O-N 3.18Å; I82-V84 PolarHBondContact O-N 2.83Å; V84-K137 HydrophobicContact CG2-CB 4.21Å; V84-K137 HydrophobicContact CG2-CG 4.01Å; V84-I140 HydrophobicContact CB-CG2 4.47Å; V84-E141 HydrophobicContact CG2-CG 3.75Å
85	T	87.9	Confident	88.7	Confident	30 Å²	30	51.8 Å²	51.8	18%	0.184	26%	0.263	C	S	.	.	H	α-helix	trans	-74.7	-35.3	171.5	64.7	0	0	0	0	113	F29 L81 I82 F83 S88 F89	F29-T85 HydrophobicContact CE1-CG2 4.11Å; F29-T85 HydrophobicContact CE2-CG2 3.81Å; F29-T85 HydrophobicContact CZ-CG2 3.27Å; L81-T85 WeakPolarHBondContact O-CG2 3.37Å; L81-T85 PolarHBondContact O-N 3.14Å; L81-T85 VanDerWaalsContact O-N 3.16Å; L81-T85 PolarHBondContact O-OG1 3.24Å; I82-T85 PolarHBondContact O-N 3.48Å; I82-T85 VanDerWaalsContact O-N 3.09Å; I82-T85 PolarHBondContact O-OG1 2.94Å; F83-T85 VanDerWaalsContact C-N 3.34Å; T85-S88 WeakPolarHBondContact O-CA 3.38Å; T85-S88 WeakPolarHBondContact O-CB 3.4Å; T85-S88 PolarHBondContact O-N 2.65Å; T85-F89 WeakPolarHBondContact O-CD2 3.45Å; T85-F89 PolarHBondContact O-N 2.89Å
86	C	89.9	Confident	88.3	Confident	65 Å²	65	47.1 Å²	47.1	44%	0.439	26%	0.257	S	S	.	.	H	α-helix	trans	-52.5	-47.4	-175.2	-71.6	0	0	0	0	114.2	I82 F83 S88 F89 M90	I82-C86 PolarHBondContact O-N 3.36Å; I82-C86 PolarHBondContact O-SG 3.41Å; I82-C86 VanDerWaalsContact O-SG 3.4Å; F83-C86 PolarHBondContact O-N 3.48Å; C86-S88 VanDerWaalsContact C-N 3.27Å; C86-S88 PolarHBondContact O-N 2.95Å; C86-F89 PolarHBondContact O-N 3.11Å; C86-M90 WeakPolarHBondContact O-CB 3.24Å; C86-M90 PolarHBondContact O-N 3.01Å
87	P	89	Confident	88	Confident	12 Å²	12	53 Å²	53	8%	0.078	28%	0.279	C	S	.	.	H	α-helix	trans	-62.7	-28.5	172.9	-23.6	33.1	0	0	0	114.3	F83 V91 A136 K137 I140	F83-P87 WeakPolarHBondContact O-CD 3.43Å; P87-V91 WeakPolarHBondContact O-CG2 3.42Å; P87-V91 PolarHBondContact O-N 3.03Å; P87-A136 HydrophobicContact CB-CB 4.46Å; P87-A136 HydrophobicContact CG-CB 4.07Å; P87-K137 HydrophobicContact CB-CG 4.03Å; P87-K137 HydrophobicContact CG-CG 4.16Å; P87-I140 HydrophobicContact CG-CD1 4.17Å
88	S	84.1	Confident	87.5	Confident	37 Å²	37	54.5 Å²	54.5	26%	0.259	29%	0.285	S	S	.	.	H	α-helix	trans	-68.6	-50.3	174.2	-48.7	0	0	0	0	110.9	T85 C86 M90 V91 V92 K137	T85-S88 WeakPolarHBondContact O-CA 3.38Å; T85-S88 WeakPolarHBondContact O-CB 3.4Å; T85-S88 PolarHBondContact O-N 2.65Å; C86-S88 VanDerWaalsContact C-N 3.27Å; C86-S88 PolarHBondContact O-N 2.95Å; S88-M90 VanDerWaalsContact C-N 3.32Å; S88-M90 PolarHBondContact O-N 3.14Å; S88-V91 PolarHBondContact O-N 3.45Å; S88-V92 WeakPolarHBondContact O-CG2 3.39Å; S88-V92 PolarHBondContact O-N 2.94Å; S88-K137 WeakPolarHBondContact OG-CE 3.4Å; S88-K137 PolarHBondContact OG-NZ 2.7Å
89	F	84.2	Confident	86.9	Confident	105 Å²	105	57.9 Å²	57.9	46%	0.461	30%	0.3	S	S	.	.	H	α-helix	trans	-58.8	-43.1	175.9	-80.5	-75.5	0	0	0	111.5	L9 T85 C86 V91 V92 M93	L9-F89 HydrophobicContact CD1-CE1 3.67Å; L9-F89 HydrophobicContact CD1-CZ 3.78Å; L9-F89 HydrophobicContact CD2-CD1 3.62Å; L9-F89 HydrophobicContact CD2-CE1 3.54Å; L9-F89 HydrophobicContact CD2-CG 4.37Å; L9-F89 HydrophobicContact CD2-CZ 4.22Å; L9-F89 HydrophobicContact CG-CE1 4.2Å; T85-F89 WeakPolarHBondContact O-CD2 3.45Å; T85-F89 PolarHBondContact O-N 2.89Å; C86-F89 PolarHBondContact O-N 3.11Å; F89-V91 VanDerWaalsContact C-N 3.35Å; F89-V91 PolarHBondContact O-N 3.16Å; F89-V92 PolarHBondContact O-N 3.06Å; F89-M93 VanDerWaalsContact O-CB 3.24Å; F89-M93 WeakPolarHBondContact O-CB 3.2Å; F89-M93 PolarHBondContact O-N 3.38Å
90	M	86.2	Confident	86.5	Confident	94 Å²	94	56.9 Å²	56.9	46%	0.463	29%	0.294	S	S	.	.	H	α-helix	trans	-56.8	-44.9	175.8	-175.6	-166.2	70	0	0	112.2	C86 S88 H94	C86-M90 WeakPolarHBondContact O-CB 3.24Å; C86-M90 PolarHBondContact O-N 3.01Å; S88-M90 VanDerWaalsContact C-N 3.32Å; S88-M90 PolarHBondContact O-N 3.14Å; M90-H94 WeakPolarHBondContact O-CB 3.29Å; M90-H94 PolarHBondContact O-N 2.95Å
91	V	83.8	Confident	86.2	Confident	14 Å²	14	62 Å²	62	9%	0.085	31%	0.313	C	S	.	.	H	α-helix	trans	-67.9	-43.9	178.6	168.1	0	0	0	0	111.8	P87 S88 F89 H94 V95 Y130 S133	P87-V91 WeakPolarHBondContact O-CG2 3.42Å; P87-V91 PolarHBondContact O-N 3.03Å; S88-V91 PolarHBondContact O-N 3.45Å; F89-V91 VanDerWaalsContact C-N 3.35Å; F89-V91 PolarHBondContact O-N 3.16Å; V91-H94 PolarHBondContact O-N 2.86Å; V91-V95 WeakPolarHBondContact O-CG2 3.37Å; V91-V95 PolarHBondContact O-N 3.46Å; V91-Y130 HydrophobicContact CG1-CD2 4.03Å; V91-S133 VanDerWaalsContact CG2-CB 3.46Å; V91-S133 WeakPolarHBondContact CG2-OG 3.23Å
92	V	81.4	Confident	85.8	Confident	29 Å²	29	62.2 Å²	62.2	18%	0.176	31%	0.314	C	S	.	.	H	α-helix	trans	-65.2	-43.5	179.1	174.1	0	0	0	0	110.8	L9 S88 F89 H94 V95 A96	L9-V92 HydrophobicContact CD2-CB 4.32Å; L9-V92 HydrophobicContact CD2-CG1 4.27Å; L9-V92 HydrophobicContact CD2-CG2 4.23Å; S88-V92 WeakPolarHBondContact O-CG2 3.39Å; S88-V92 PolarHBondContact O-N 2.94Å; F89-V92 PolarHBondContact O-N 3.06Å; V92-H94 PolarHBondContact O-N 3.16Å; V92-V95 PolarHBondContact O-N 2.95Å; V92-A96 PolarHBondContact O-N 3.49Å
93	M	83	Confident	85.5	Confident	136 Å²	136	65.9 Å²	65.9	67%	0.67	32%	0.321	S	S	*	.	H	α-helix	trans	-60.8	-43.6	173.5	-177	64.3	84.2	0	0	111.6	F89 V95 A96 Y97	F89-M93 VanDerWaalsContact O-CB 3.24Å; F89-M93 WeakPolarHBondContact O-CB 3.2Å; F89-M93 PolarHBondContact O-N 3.38Å; M93-V95 VanDerWaalsContact C-N 3.32Å; M93-V95 PolarHBondContact O-N 2.95Å; M93-A96 PolarHBondContact O-N 3.15Å; M93-Y97 WeakPolarHBondContact O-CB 3.44Å; M93-Y97 PolarHBondContact O-N 3.24Å
94	H	83.8	Confident	85.3	Confident	50 Å²	50	67 Å²	67	23%	0.231	33%	0.326	C	S	.	.	H	α-helix	trans	-65.3	-31	176.9	173.2	-97.7	0	0	0	113.1	M90 V91 V92 R98 L126 T129	M90-H94 WeakPolarHBondContact O-CB 3.29Å; M90-H94 PolarHBondContact O-N 2.95Å; V91-H94 PolarHBondContact O-N 2.86Å; V92-H94 PolarHBondContact O-N 3.16Å; H94-R98 VanDerWaalsContact CE1-CD 3.4Å; H94-R98 WeakPolarHBondContact CE1-CD 3.3Å; H94-R98 WeakPolarHBondContact O-CB 3.21Å; H94-R98 WeakPolarHBondContact O-CD 3.37Å; H94-R98 WeakPolarHBondContact O-CG 3.46Å; H94-R98 PolarHBondContact O-N 3.34Å; H94-L126 WeakPolarHBondContact ND1-CD1 3.43Å; H94-T129 PolarHBondContact CE1-OG1 3.02Å; H94-T129 PolarHBondContact ND1-OG1 2.91Å
95	V	82.6	Confident	85.1	Confident	35 Å²	35	68.6 Å²	68.6	21%	0.212	33%	0.332	C	S	.	.	H	α-helix	trans	-69.5	-56.2	170.2	171.3	0	0	0	0	110.3	V91 V92 M93 Y97 R98 D99 L126	V91-V95 WeakPolarHBondContact O-CG2 3.37Å; V91-V95 PolarHBondContact O-N 3.46Å; V92-V95 PolarHBondContact O-N 2.95Å; M93-V95 VanDerWaalsContact C-N 3.32Å; M93-V95 PolarHBondContact O-N 2.95Å; V95-Y97 VanDerWaalsContact C-N 3.29Å; V95-Y97 PolarHBondContact O-N 2.68Å; V95-R98 WeakPolarHBondContact O-CA 3.47Å; V95-R98 WeakPolarHBondContact O-CB 3.41Å; V95-R98 PolarHBondContact O-N 3.12Å; V95-D99 PolarHBondContact O-N 3.05Å; V95-L126 HydrophobicContact CG2-CD1 3.78Å
96	A	83.2	Confident	85	Confident	53 Å²	53	71.1 Å²	71.1	44%	0.438	34%	0.339	S	S	.	.	H	α-helix	trans	-57.2	-41	-178	0	0	0	0	0	112.8	V92 M93 R98 D99 E100	V92-A96 PolarHBondContact O-N 3.49Å; M93-A96 PolarHBondContact O-N 3.15Å; A96-R98 VanDerWaalsContact C-N 3.34Å; A96-R98 PolarHBondContact O-N 3.5Å; A96-D99 PolarHBondContact O-N 2.86Å; A96-E100 VanDerWaalsContact O-CB 3.28Å; A96-E100 WeakPolarHBondContact O-CB 3.42Å; A96-E100 PolarHBondContact O-N 2.9Å
97	Y	85.6	Confident	84.9	Confident	131 Å²	131	72.3 Å²	72.3	51%	0.514	35%	0.353	S	S	.	.	H	α-helix	trans	-63.4	-35.8	175.2	175.1	-97.3	0	0	0	113.1	M93 V95 R101	M93-Y97 WeakPolarHBondContact O-CB 3.44Å; M93-Y97 PolarHBondContact O-N 3.24Å; V95-Y97 VanDerWaalsContact C-N 3.29Å; V95-Y97 PolarHBondContact O-N 2.68Å; Y97-R101 WeakPolarHBondContact O-CB 3.48Å; Y97-R101 PolarHBondContact O-N 2.7Å; Y97-R101 PolarHBondContact OH-NH2 3.28Å
98	R	82.3	Confident	84.9	Confident	34 Å²	34	80 Å²	80	13%	0.128	39%	0.385	C	S	.	.	H	α-helix	trans	-72.5	-44.8	175.9	-76.8	173.7	55.9	75.7	20.7	111.7	H94 V95 A96 E100 R101 E102 Y116	H94-R98 VanDerWaalsContact CE1-CD 3.4Å; H94-R98 WeakPolarHBondContact CE1-CD 3.3Å; H94-R98 WeakPolarHBondContact O-CB 3.21Å; H94-R98 WeakPolarHBondContact O-CD 3.37Å; H94-R98 WeakPolarHBondContact O-CG 3.46Å; H94-R98 PolarHBondContact O-N 3.34Å; V95-R98 WeakPolarHBondContact O-CA 3.47Å; V95-R98 WeakPolarHBondContact O-CB 3.41Å; V95-R98 PolarHBondContact O-N 3.12Å; A96-R98 VanDerWaalsContact C-N 3.34Å; A96-R98 PolarHBondContact O-N 3.5Å; R98-E100 VanDerWaalsContact C-N 3.29Å; R98-E100 PolarHBondContact O-N 3.42Å; R98-R101 WeakPolarHBondContact O-CB 3.33Å; R98-R101 PolarHBondContact O-N 3Å; R98-R101 VanDerWaalsContact O-N 3.12Å; R98-E102 IonicContact NH2-OE1 3.73Å; R98-E102 PolarHBondContact O-N 3.37Å; R98-Y116 VanDerWaalsContact NH1-CE1 3.32Å; R98-Y116 VanDerWaalsContact NH1-CZ 3.25Å
99	D	82.1	Confident	85	Confident	93 Å²	93	85 Å²	85	50%	0.497	40%	0.403	S	S	.	.	H	α-helix	trans	-62.1	-40.2	178.3	-64.2	-9.4	0	0	0	110.5	V95 A96 E102 R103	V95-D99 PolarHBondContact O-N 3.05Å; A96-D99 PolarHBondContact O-N 2.86Å; D99-E102 PolarHBondContact O-N 3.28Å; D99-R103 PolarHBondContact O-N 3.38Å
100	E	86.6	Confident	85	Confident	54 Å²	54	82 Å²	82	25%	0.252	40%	0.401	S	S	.	.	H	α-helix	trans	-64.7	-38.6	172.9	176.8	58.4	-172.6	0	0	112.9	A96 R98 R103 K104	A96-E100 VanDerWaalsContact O-CB 3.28Å; A96-E100 WeakPolarHBondContact O-CB 3.42Å; A96-E100 PolarHBondContact O-N 2.9Å; R98-E100 VanDerWaalsContact C-N 3.29Å; R98-E100 PolarHBondContact O-N 3.42Å; E100-R103 VanDerWaalsContact CD-NH2 3.34Å; E100-R103 PolarHBondContact O-N 3.32Å; E100-R103 IonicContact OE1-NH2 3.81Å; E100-R103 PolarHBondContact OE1-NH2 3.14Å; E100-R103 IonicContact OE2-CZ 3.94Å; E100-R103 IonicContact OE2-NE 3.12Å; E100-R103 PolarHBondContact OE2-NE 3.18Å; E100-R103 IonicContact OE2-NH2 3.12Å; E100-R103 PolarHBondContact OE2-NH2 2.98Å; E100-K104 HydrophobicContact CG-CD 4.38Å; E100-K104 WeakPolarHBondContact O-CB 3.24Å; E100-K104 PolarHBondContact O-N 3.39Å; E100-K104 WeakPolarHBondContact OE1-CE 3.36Å; E100-K104 IonicContact OE1-NZ 2.62Å; E100-K104 PolarHBondContact OE1-NZ 2.86Å
101	R	86.1	Confident	84.6	Confident	107 Å²	107	85.1 Å²	85.1	40%	0.404	42%	0.415	S	S	.	.	H	α-helix	trans	-66.3	-38.5	174.5	-168.3	-166.8	-76.9	-158.7	-7.3	111.4	Y97 R98 H105 L115 Y116	Y97-R101 WeakPolarHBondContact O-CB 3.48Å; Y97-R101 PolarHBondContact O-N 2.7Å; Y97-R101 PolarHBondContact OH-NH2 3.28Å; R98-R101 WeakPolarHBondContact O-CB 3.33Å; R98-R101 PolarHBondContact O-N 3Å; R98-R101 VanDerWaalsContact O-N 3.12Å; R101-H105 PolarHBondContact O-N 3.46Å; R101-L115 HydrophobicContact CG-CD2 3.86Å; R101-Y116 PolarHBondContact NH1-OH 3.15Å
102	E	84.3	Confident	84.2	Confident	19 Å²	19	91.2 Å²	91.2	9%	0.089	45%	0.447	C	S	.	.	H	α-helix	trans	-66.2	-42.5	173.7	-73.1	-172.3	-153.8	0	0	112	R98 D99 K104 H105 R106 Y116 T119	R98-E102 IonicContact NH2-OE1 3.73Å; R98-E102 PolarHBondContact O-N 3.37Å; D99-E102 PolarHBondContact O-N 3.28Å; E102-K104 PolarHBondContact O-N 3.2Å; E102-H105 WeakPolarHBondContact O-CB 3.43Å; E102-H105 PolarHBondContact O-N 2.95Å; E102-H105 VanDerWaalsContact O-N 3.12Å; E102-R106 PolarHBondContact O-N 2.83Å; E102-Y116 HydrophobicContact CG-CD2 3.82Å; E102-Y116 HydrophobicContact CG-CE2 4.39Å; E102-Y116 VanDerWaalsContact OE1-CD2 3.31Å; E102-Y116 WeakPolarHBondContact OE1-CD2 3.49Å; E102-T119 WeakPolarHBondContact OE1-CG2 3.34Å; E102-T119 WeakPolarHBondContact OE2-CG2 3.49Å
103	R	86	Confident	83.8	Confident	171 Å²	171	90.9 Å²	90.9	65%	0.645	45%	0.446	S	S	*	.	H	α-helix	trans	-56.7	-48.1	174.3	-174	170.1	73.2	136.9	3.6	111.4	D99 E100 H105 R106 A107	D99-R103 PolarHBondContact O-N 3.38Å; E100-R103 VanDerWaalsContact CD-NH2 3.34Å; E100-R103 PolarHBondContact O-N 3.32Å; E100-R103 IonicContact OE1-NH2 3.81Å; E100-R103 PolarHBondContact OE1-NH2 3.14Å; E100-R103 IonicContact OE2-CZ 3.94Å; E100-R103 IonicContact OE2-NE 3.12Å; E100-R103 PolarHBondContact OE2-NE 3.18Å; E100-R103 IonicContact OE2-NH2 3.12Å; E100-R103 PolarHBondContact OE2-NH2 2.98Å; R103-H105 VanDerWaalsContact C-N 3.29Å; R103-H105 PolarHBondContact O-N 3.09Å; R103-R106 PolarHBondContact O-N 3.45Å; R103-A107 PolarHBondContact O-N 3.37Å; R103-A107 VanDerWaalsContact O-N 3.16Å
104	K	88.5	Confident	83.3	Confident	127 Å²	127	89.7 Å²	89.7	55%	0.552	44%	0.437	S	S	*	.	H	α-helix	trans	-66.5	-23.8	176.2	-80	169.3	165.9	146.4	0	114.2	E100 E102	E100-K104 HydrophobicContact CG-CD 4.38Å; E100-K104 WeakPolarHBondContact O-CB 3.24Å; E100-K104 PolarHBondContact O-N 3.39Å; E100-K104 WeakPolarHBondContact OE1-CE 3.36Å; E100-K104 IonicContact OE1-NZ 2.62Å; E100-K104 PolarHBondContact OE1-NZ 2.86Å; E102-K104 PolarHBondContact O-N 3.2Å
105	H	85.6	Confident	82.6	Confident	44 Å²	44	90.8 Å²	90.8	20%	0.204	44%	0.444	C	S	.	.	H	α-helix	trans	-75.6	-49.6	174.1	-167.6	-75.8	0	0	0	111.7	R101 E102 R103 A107 K108 F109 S113 L115	R101-H105 PolarHBondContact O-N 3.46Å; E102-H105 WeakPolarHBondContact O-CB 3.43Å; E102-H105 PolarHBondContact O-N 2.95Å; E102-H105 VanDerWaalsContact O-N 3.12Å; R103-H105 VanDerWaalsContact C-N 3.29Å; R103-H105 PolarHBondContact O-N 3.09Å; H105-A107 VanDerWaalsContact C-N 3.27Å; H105-A107 PolarHBondContact O-N 3.33Å; H105-K108 PolarHBondContact O-N 3.38Å; H105-F109 AromaticContact CD2-CD2 3.91Å; H105-F109 AromaticContact CE1-CD2 3.39Å; H105-F109 WeakPolarHBondContact CE1-CD2 3.07Å; H105-F109 AromaticContact CE1-CG 3.89Å; H105-F109 AromaticContact CG-CD2 3.97Å; H105-F109 AromaticContact ND1-CD2 3.65Å; H105-F109 AromaticContact NE2-CD2 3.58Å; H105-F109 AromaticContact NE2-CE2 3.81Å; H105-F109 PolarHBondContact O-N 2.98Å; H105-S113 PolarHBondContact ND1-OG 3.4Å; H105-S113 VanDerWaalsContact ND1-OG 3.15Å; H105-L115 HydrophobicContact CB-CB 4.2Å; H105-L115 HydrophobicContact CB-CD2 4.47Å
106	R	86.9	Confident	81.9	Confident	84 Å²	84	92.2 Å²	92.2	32%	0.317	45%	0.446	S	S	.	.	H	α-helix	trans	-58.6	-39.9	178.4	-70.1	172.2	-175.2	-113.6	24.8	112.2	E102 R103 K108 G110 E111 S113	E102-R106 PolarHBondContact O-N 2.83Å; R103-R106 PolarHBondContact O-N 3.45Å; R106-K108 PolarHBondContact O-N 2.89Å; R106-K108 VanDerWaalsContact O-N 3.16Å; R106-G110 CarbonylContact O-C 3.35Å; R106-G110 WeakPolarHBondContact O-CA 3.24Å; R106-G110 PolarHBondContact O-N 3.41Å; R106-E111 PolarHBondContact NH1-O 2.9Å; R106-S113 VanDerWaalsContact CG-O 3.28Å; R106-S113 WeakPolarHBondContact CG-O 3.45Å
107	A	87.9	Confident	80.4	Confident	90 Å²	90	95.9 Å²	95.9	74%	0.744	46%	0.464	S	S	*	.	H	α-helix	trans	-64	-13.7	174.9	0	0	0	0	0	114.8	R103 H105	R103-A107 PolarHBondContact O-N 3.37Å; R103-A107 VanDerWaalsContact O-N 3.16Å; H105-A107 VanDerWaalsContact C-N 3.27Å; H105-A107 PolarHBondContact O-N 3.33Å
108	K	88.5	Confident	79	Confident	172 Å²	172	94.3 Å²	94.3	75%	0.748	46%	0.464	S	S	*	.	H	α-helix	trans	-108	-30.8	177.9	-73.5	-169.3	173.4	-162.8	0	114.4	H105 R106	H105-K108 PolarHBondContact O-N 3.38Å; R106-K108 PolarHBondContact O-N 2.89Å; R106-K108 VanDerWaalsContact O-N 3.16Å
109	F	85.6	Confident	77.6	Confident	143 Å²	143	96.3 Å²	96.3	63%	0.627	48%	0.48	S	S	*	.	H	α-helix	trans	-122.7	15.7	-171.1	-60.8	-80	0	0	0	113.3	H105 S113	H105-F109 AromaticContact CD2-CD2 3.91Å; H105-F109 AromaticContact CE1-CD2 3.39Å; H105-F109 WeakPolarHBondContact CE1-CD2 3.07Å; H105-F109 AromaticContact CE1-CG 3.89Å; H105-F109 AromaticContact CG-CD2 3.97Å; H105-F109 AromaticContact ND1-CD2 3.65Å; H105-F109 AromaticContact NE2-CD2 3.58Å; H105-F109 AromaticContact NE2-CE2 3.81Å; H105-F109 PolarHBondContact O-N 2.98Å; F109-S113 WeakPolarHBondContact CB-OG 3.43Å; F109-S113 WeakPolarHBondContact O-CB 3.39Å; F109-S113 PolarHBondContact O-OG 3.32Å
110	G	85.3	Confident	76	Confident	42 Å²	42	93.4 Å²	93.4	43%	0.433	47%	0.472	S	S	.	.			trans	83.8	160.4	-178.7	0	0	0	0	0	113.8	R106 D112 S113	R106-G110 CarbonylContact O-C 3.35Å; R106-G110 WeakPolarHBondContact O-CA 3.24Å; R106-G110 PolarHBondContact O-N 3.41Å; G110-D112 VanDerWaalsContact C-N 3.3Å; G110-D112 PolarHBondContact O-N 3.28Å; G110-S113 WeakPolarHBondContact O-CB 3.27Å; G110-S113 PolarHBondContact O-N 2.79Å; G110-S113 VanDerWaalsContact O-N 3.11Å; G110-S113 PolarHBondContact O-OG 2.96Å
111	E	77.2	Confident	74.3	Confident	160 Å²	160	96.6 Å²	96.6	75%	0.748	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-34.7	-172.7	-72.8	-141.1	94.2	0	0	114.2	R106 S113	R106-E111 PolarHBondContact NH1-O 2.9Å; E111-S113 PolarHBondContact O-N 3.22Å
112	D	76	Confident	72.7	Confident	141 Å²	141	93.4 Å²	93.4	75%	0.754	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-21.4	179.3	-81.7	-53.1	0	0	0	113.9	G110 K114	G110-D112 VanDerWaalsContact C-N 3.3Å; G110-D112 PolarHBondContact O-N 3.28Å; D112-K114 PolarHBondContact O-N 3.28Å
113	S	73.2	Confident	71.2	Confident	23 Å²	23	97.8 Å²	97.8	16%	0.161	50%	0.495	C	S	.	.			trans	-67.2	118.7	-178.8	74.2	0	0	0	0	111.8	H105 R106 F109 G110 E111	H105-S113 PolarHBondContact ND1-OG 3.4Å; H105-S113 VanDerWaalsContact ND1-OG 3.15Å; R106-S113 VanDerWaalsContact CG-O 3.28Å; R106-S113 WeakPolarHBondContact CG-O 3.45Å; F109-S113 WeakPolarHBondContact CB-OG 3.43Å; F109-S113 WeakPolarHBondContact O-CB 3.39Å; F109-S113 PolarHBondContact O-OG 3.32Å; G110-S113 WeakPolarHBondContact O-CB 3.27Å; G110-S113 PolarHBondContact O-N 2.79Å; G110-S113 VanDerWaalsContact O-N 3.11Å; G110-S113 PolarHBondContact O-OG 2.96Å; E111-S113 PolarHBondContact O-N 3.22Å
114	K	72.3	Confident	70.4	Confident	111 Å²	111	92.4 Å²	92.4	48%	0.483	49%	0.492	S	S	.	.			trans	-123.3	100.6	-177	-72.6	162	-172.4	122.4	0	110	D112 Y116	D112-K114 PolarHBondContact O-N 3.28Å; K114-Y116 PolarHBondContact O-N 2.85Å; K114-Y116 VanDerWaalsContact O-N 3.14Å
115	L	69.4	Low	69.5	Low	73 Å²	73	88.5 Å²	88.5	38%	0.382	49%	0.488	S	S	.	.	S	Bend	trans	-57	-26.8	179.3	-178.1	59	0	0	0	113.6	R101 H105	R101-L115 HydrophobicContact CG-CD2 3.86Å; H105-L115 HydrophobicContact CB-CB 4.2Å; H105-L115 HydrophobicContact CB-CD2 4.47Å
116	Y	66.4	Low	69.1	Low	65 Å²	65	88.1 Å²	88.1	26%	0.255	49%	0.487	S	S	.	.	S	Bend	trans	-124.3	120.3	175.1	-63.5	-73.2	0	0	0	111	R98 R101 E102 K114 N118 T119	R98-Y116 VanDerWaalsContact NH1-CE1 3.32Å; R98-Y116 VanDerWaalsContact NH1-CZ 3.25Å; R101-Y116 PolarHBondContact NH1-OH 3.15Å; E102-Y116 HydrophobicContact CG-CD2 3.82Å; E102-Y116 HydrophobicContact CG-CE2 4.39Å; E102-Y116 VanDerWaalsContact OE1-CD2 3.31Å; E102-Y116 WeakPolarHBondContact OE1-CD2 3.49Å; K114-Y116 PolarHBondContact O-N 2.85Å; K114-Y116 VanDerWaalsContact O-N 3.14Å; Y116-N118 PolarHBondContact O-N 3Å; Y116-T119 WeakPolarHBondContact O-CG2 3.43Å
117	T	52.7	Low	68.7	Low	130 Å²	130	84.9 Å²	84.9	80%	0.798	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	125.9	176.2	47.6	0	0	0	0	110.6
118	N	55.7	Low	68.4	Low	97 Å²	97	87.9 Å²	87.9	52%	0.519	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.3	57.8	-176.7	-72.9	-111.6	0	0	0	115.4	Y116 G120 K121	Y116-N118 PolarHBondContact O-N 3Å; N118-G120 PolarHBondContact O-N 3.07Å; N118-G120 VanDerWaalsContact O-N 3.11Å; N118-K121 HydrophobicContact CB-CB 4.49Å; N118-K121 HydrophobicContact CB-CD 4.2Å; N118-K121 PolarHBondContact O-N 3.3Å; N118-K121 PolarHBondContact OD1-NZ 2.9Å
119	T	52.9	Low	68.3	Low	76 Å²	76	81.3 Å²	81.3	47%	0.466	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.2	-41	174.6	64.1	0	0	0	0	114.5	E102 Y116 K121	E102-T119 WeakPolarHBondContact OE1-CG2 3.34Å; E102-T119 WeakPolarHBondContact OE2-CG2 3.49Å; Y116-T119 WeakPolarHBondContact O-CG2 3.43Å; T119-K121 VanDerWaalsContact C-N 3.26Å; T119-K121 PolarHBondContact O-N 3.04Å
120	G	48.5	Very low	68.2	Low	33 Å²	33	75.6 Å²	75.6	34%	0.34	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	2.3	-179.8	0	0	0	0	0	116.6	Y16 N118	Y16-G120 WeakPolarHBondContact CD2-O 2.98Å; Y16-G120 WeakPolarHBondContact CE2-O 3.16Å; N118-G120 PolarHBondContact O-N 3.07Å; N118-G120 VanDerWaalsContact O-N 3.11Å
121	K	51.5	Low	68.2	Low	121 Å²	121	74.1 Å²	74.1	53%	0.526	40%	0.398	S	S	.	.	S	Bend	trans	-119	124.8	178	-65.8	172.3	-173.6	153.3	0	109.7	N118 T119 H123	N118-K121 HydrophobicContact CB-CB 4.49Å; N118-K121 HydrophobicContact CB-CD 4.2Å; N118-K121 PolarHBondContact O-N 3.3Å; N118-K121 PolarHBondContact OD1-NZ 2.9Å; T119-K121 VanDerWaalsContact C-N 3.26Å; T119-K121 PolarHBondContact O-N 3.04Å; K121-H123 VanDerWaalsContact C-N 3.28Å; K121-H123 PolarHBondContact O-N 3.45Å
122	K	52.3	Low	68.8	Low	40 Å²	40	70.4 Å²	70.4	17%	0.174	38%	0.382	C	S	.	.			trans	-59.7	86.3	169.4	-74.6	-175.9	172.9	177.2	0	110.5	S17 W127 Y130	S17-K122 PolarHBondContact OG-NZ 3.21Å; K122-W127 HydrophobicContact CB-CB 4.09Å; K122-W127 HydrophobicContact CB-CG 4.4Å; K122-Y130 VanDerWaalsContact NZ-CG 3.32Å; K122-Y130 VanDerWaalsContact NZ-CZ 3.31Å
123	H	53.6	Low	69.5	Low	111 Å²	111	63.9 Å²	63.9	51%	0.514	35%	0.348	S	S	.	.			trans	-131.3	155.7	172.1	-76.7	113.7	0	0	0	109.4	K121 R214	K121-H123 VanDerWaalsContact C-N 3.28Å; K121-H123 PolarHBondContact O-N 3.45Å; H123-R214 PolarHBondContact NE2-NH1 2.81Å; H123-R214 VanDerWaalsContact NE2-NH1 3.11Å
124	G	68.3	Low	70.2	Confident	58 Å²	58	62.9 Å²	62.9	60%	0.598	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	-150.4	-173.7	0	0	0	0	0	112.8	L126 W127	G124-L126 VanDerWaalsContact C-N 3.3Å; G124-L126 PolarHBondContact O-N 2.87Å; G124-W127 PolarHBondContact O-N 2.96Å; G124-W127 VanDerWaalsContact O-N 3.14Å
125	G	70.5	Confident	71.2	Confident	44 Å²	44	62.8 Å²	62.8	45%	0.454	34%	0.341	S	S	.	.	H	α-helix	trans	-56.3	-33.7	-169.4	0	0	0	0	0	115.6	W127 W128 T129	G125-W127 VanDerWaalsContact C-N 3.27Å; G125-W127 PolarHBondContact O-N 2.92Å; G125-W128 WeakPolarHBondContact O-CA 3.32Å; G125-W128 WeakPolarHBondContact O-CB 3.47Å; G125-W128 PolarHBondContact O-N 3.27Å; G125-T129 PolarHBondContact O-N 3.31Å; G125-T129 PolarHBondContact O-OG1 3.46Å
126	L	76.4	Confident	72.3	Confident	36 Å²	36	61.1 Å²	61.1	19%	0.188	34%	0.337	C	S	.	.	H	α-helix	trans	-68.1	-23.2	-178.7	-176.4	60.8	0	0	0	113.7	H94 V95 G124 Y130	H94-L126 WeakPolarHBondContact ND1-CD1 3.43Å; V95-L126 HydrophobicContact CG2-CD1 3.78Å; G124-L126 VanDerWaalsContact C-N 3.3Å; G124-L126 PolarHBondContact O-N 2.87Å; L126-Y130 WeakPolarHBondContact O-CB 3.17Å
127	W	78.6	Confident	73.5	Confident	16 Å²	16	59.9 Å²	59.9	6%	0.061	33%	0.333	C	S	.	.	H	α-helix	trans	-76.7	-34.9	168.7	-174.5	86.8	0	0	0	111.5	K122 G124 G125 L131 R211	K122-W127 HydrophobicContact CB-CB 4.09Å; K122-W127 HydrophobicContact CB-CG 4.4Å; G124-W127 PolarHBondContact O-N 2.96Å; G124-W127 VanDerWaalsContact O-N 3.14Å; G125-W127 VanDerWaalsContact C-N 3.27Å; G125-W127 PolarHBondContact O-N 2.92Å; W127-L131 HydrophobicContact CE3-CD2 4.3Å; W127-L131 HydrophobicContact CH2-CD2 3.51Å; W127-L131 HydrophobicContact CZ2-CD2 4.16Å; W127-L131 HydrophobicContact CZ3-CD2 3.57Å; W127-L131 WeakPolarHBondContact O-CB 3.49Å; W127-L131 PolarHBondContact O-N 3.16Å; W127-R211 HydrophobicContact CZ2-CB 4.07Å; W127-R211 HydrophobicContact CZ2-CG 4.34Å
128	W	82.4	Confident	75.4	Confident	153 Å²	153	54.2 Å²	54.2	58%	0.58	30%	0.299	S	S	*	.	H	α-helix	trans	-72.1	-46.2	-177.5	-161.7	-115.4	0	0	0	112	G125 Y130 L131 I132	G125-W128 WeakPolarHBondContact O-CA 3.32Å; G125-W128 WeakPolarHBondContact O-CB 3.47Å; G125-W128 PolarHBondContact O-N 3.27Å; W128-Y130 VanDerWaalsContact C-N 3.3Å; W128-Y130 PolarHBondContact O-N 2.78Å; W128-L131 HydrophobicContact CE3-CD2 4.46Å; W128-L131 HydrophobicContact CZ3-CD2 4.3Å; W128-L131 PolarHBondContact O-N 3.42Å; W128-I132 HydrophobicContact CG-CD1 4.3Å; W128-I132 WeakPolarHBondContact O-CB 3.39Å; W128-I132 WeakPolarHBondContact O-CG1 3.24Å; W128-I132 PolarHBondContact O-N 3.33Å
129	T	84.8	Confident	77.4	Confident	35 Å²	35	51.5 Å²	51.5	22%	0.215	29%	0.294	C	S	.	.	H	α-helix	trans	-63	-37.2	174.7	55.5	0	0	0	0	111.9	H94 G125 S133	H94-T129 PolarHBondContact CE1-OG1 3.02Å; H94-T129 PolarHBondContact ND1-OG1 2.91Å; G125-T129 PolarHBondContact O-N 3.31Å; G125-T129 PolarHBondContact O-OG1 3.46Å; T129-S133 WeakPolarHBondContact O-CB 3.39Å; T129-S133 PolarHBondContact O-N 2.95Å
130	Y	83.8	Confident	79.4	Confident	22 Å²	22	49.8 Å²	49.8	9%	0.086	28%	0.281	C	S	.	.	H	α-helix	trans	-63.5	-48.1	173	-165.2	-86	0	0	0	111.9	R22 V91 K122 L126 W128 S133 L134 E203 L207	R22-Y130 WeakPolarHBondContact CD-OH 3.28Å; V91-Y130 HydrophobicContact CG1-CD2 4.03Å; K122-Y130 VanDerWaalsContact NZ-CG 3.32Å; K122-Y130 VanDerWaalsContact NZ-CZ 3.31Å; L126-Y130 WeakPolarHBondContact O-CB 3.17Å; W128-Y130 VanDerWaalsContact C-N 3.3Å; W128-Y130 PolarHBondContact O-N 2.78Å; Y130-S133 PolarHBondContact O-N 2.9Å; Y130-S133 PolarHBondContact O-OG 3.33Å; Y130-L134 HydrophobicContact CD1-CD1 4.14Å; Y130-L134 HydrophobicContact CD1-CG 4.27Å; Y130-L134 HydrophobicContact CE1-CD1 3.73Å; Y130-L134 HydrophobicContact CE1-CD2 4.28Å; Y130-L134 HydrophobicContact CE1-CG 3.98Å; Y130-L134 PolarHBondContact O-N 3.07Å; Y130-L134 VanDerWaalsContact O-N 3.14Å; Y130-E203 VanDerWaalsContact CE1-OE1 3.24Å; Y130-E203 WeakPolarHBondContact CE1-OE1 3.39Å; Y130-E203 VanDerWaalsContact OH-CD 3.23Å; Y130-E203 PolarHBondContact OH-OE1 3.38Å; Y130-E203 PolarHBondContact OH-OE2 3.45Å; Y130-L207 HydrophobicContact CD1-CD1 3.72Å; Y130-L207 HydrophobicContact CE1-CD1 3.61Å
131	L	86.3	Confident	81.7	Confident	12 Å²	12	48.2 Å²	48.2	6%	0.063	27%	0.265	C	S	.	.	H	α-helix	trans	-64	-45.3	-179.6	-176.9	64	0	0	0	112.1	W127 W128 S133 L134 F135 I204	W127-L131 HydrophobicContact CE3-CD2 4.3Å; W127-L131 HydrophobicContact CH2-CD2 3.51Å; W127-L131 HydrophobicContact CZ2-CD2 4.16Å; W127-L131 HydrophobicContact CZ3-CD2 3.57Å; W127-L131 WeakPolarHBondContact O-CB 3.49Å; W127-L131 PolarHBondContact O-N 3.16Å; W128-L131 HydrophobicContact CE3-CD2 4.46Å; W128-L131 HydrophobicContact CZ3-CD2 4.3Å; W128-L131 PolarHBondContact O-N 3.42Å; L131-S133 VanDerWaalsContact C-N 3.27Å; L131-S133 PolarHBondContact O-N 3.32Å; L131-L134 PolarHBondContact O-N 3.49Å; L131-F135 HydrophobicContact CD1-CD2 4.05Å; L131-F135 HydrophobicContact CD1-CE2 3.6Å; L131-F135 HydrophobicContact CD1-CZ 4.39Å; L131-F135 HydrophobicContact CD2-CE2 4.09Å; L131-F135 HydrophobicContact CG-CD2 3.89Å; L131-F135 HydrophobicContact CG-CE2 3.64Å; L131-F135 WeakPolarHBondContact O-CD2 3.46Å; L131-F135 PolarHBondContact O-N 3.25Å; L131-F135 VanDerWaalsContact O-N 3.09Å; L131-I204 HydrophobicContact CD1-CG2 4.38Å
132	I	89.5	Confident	83.8	Confident	81 Å²	81	46.6 Å²	46.6	42%	0.415	26%	0.261	S	S	.	.	H	α-helix	trans	-58.2	-41.3	173.5	-72.1	174.1	0	0	0	110.5	W128 L134 F135 A136	W128-I132 HydrophobicContact CG-CD1 4.3Å; W128-I132 WeakPolarHBondContact O-CB 3.39Å; W128-I132 WeakPolarHBondContact O-CG1 3.24Å; W128-I132 PolarHBondContact O-N 3.33Å; I132-L134 VanDerWaalsContact C-N 3.32Å; I132-L134 PolarHBondContact O-N 3.29Å; I132-F135 PolarHBondContact O-N 2.88Å; I132-A136 VanDerWaalsContact O-CB 3.29Å; I132-A136 WeakPolarHBondContact O-CB 3.49Å; I132-A136 PolarHBondContact O-N 2.96Å
133	S	89.4	Confident	85.9	Confident	4 Å²	4	46.8 Å²	46.8	3%	0.028	27%	0.27	C	S	.	.	H	α-helix	trans	-63.2	-34.7	178.3	81	0	0	0	0	113.4	V91 T129 Y130 L131 K137	V91-S133 VanDerWaalsContact CG2-CB 3.46Å; V91-S133 WeakPolarHBondContact CG2-OG 3.23Å; T129-S133 WeakPolarHBondContact O-CB 3.39Å; T129-S133 PolarHBondContact O-N 2.95Å; Y130-S133 PolarHBondContact O-N 2.9Å; Y130-S133 PolarHBondContact O-OG 3.33Å; L131-S133 VanDerWaalsContact C-N 3.27Å; L131-S133 PolarHBondContact O-N 3.32Å; S133-K137 WeakPolarHBondContact O-CB 3.24Å; S133-K137 VanDerWaalsContact O-CG 3.23Å; S133-K137 WeakPolarHBondContact O-CG 3.4Å; S133-K137 PolarHBondContact O-N 3.45Å
134	L	89.1	Confident	87.8	Confident	3 Å²	3	42.8 Å²	42.8	2%	0.016	25%	0.251	C	S	.	.	H	α-helix	trans	-71.4	-43.4	175.9	-67.4	-175.5	0	0	0	111.5	Y130 L131 I132 K137 T138 N200 E203 I204 L207	Y130-L134 HydrophobicContact CD1-CD1 4.14Å; Y130-L134 HydrophobicContact CD1-CG 4.27Å; Y130-L134 HydrophobicContact CE1-CD1 3.73Å; Y130-L134 HydrophobicContact CE1-CD2 4.28Å; Y130-L134 HydrophobicContact CE1-CG 3.98Å; Y130-L134 PolarHBondContact O-N 3.07Å; Y130-L134 VanDerWaalsContact O-N 3.14Å; L131-L134 PolarHBondContact O-N 3.49Å; I132-L134 VanDerWaalsContact C-N 3.32Å; I132-L134 PolarHBondContact O-N 3.29Å; L134-K137 PolarHBondContact O-N 2.86Å; L134-T138 WeakPolarHBondContact O-CB 3.43Å; L134-T138 PolarHBondContact O-N 2.7Å; L134-T138 PolarHBondContact O-OG1 3.4Å; L134-N200 WeakPolarHBondContact CD2-OD1 3.42Å; L134-E203 HydrophobicContact CD1-CB 4.1Å; L134-E203 HydrophobicContact CD1-CG 3.98Å; L134-I204 HydrophobicContact CB-CD1 3.92Å; L134-I204 HydrophobicContact CB-CG1 3.64Å; L134-I204 HydrophobicContact CD1-CG1 3.79Å; L134-I204 HydrophobicContact CG-CG1 4.39Å; L134-L207 HydrophobicContact CD1-CD1 3.95Å
135	F	92.1	Very high	89	Confident	109 Å²	109	41.3 Å²	41.3	48%	0.478	23%	0.229	S	C	.	.	H	α-helix	trans	-62.5	-43.7	174.2	-77.4	-61.4	0	0	0	111.7	L131 I132 T138 G139 I204	L131-F135 HydrophobicContact CD1-CD2 4.05Å; L131-F135 HydrophobicContact CD1-CE2 3.6Å; L131-F135 HydrophobicContact CD1-CZ 4.39Å; L131-F135 HydrophobicContact CD2-CE2 4.09Å; L131-F135 HydrophobicContact CG-CD2 3.89Å; L131-F135 HydrophobicContact CG-CE2 3.64Å; L131-F135 WeakPolarHBondContact O-CD2 3.46Å; L131-F135 PolarHBondContact O-N 3.25Å; L131-F135 VanDerWaalsContact O-N 3.09Å; I132-F135 PolarHBondContact O-N 2.88Å; F135-T138 PolarHBondContact O-N 3.43Å; F135-G139 PolarHBondContact O-N 2.8Å; F135-I204 HydrophobicContact CD1-CD1 3.93Å; F135-I204 HydrophobicContact CE1-CD1 4.02Å; F135-I204 HydrophobicContact CE1-CG2 3.95Å; F135-I204 HydrophobicContact CE2-CG2 4.39Å; F135-I204 HydrophobicContact CG-CD1 4.41Å; F135-I204 HydrophobicContact CZ-CG2 3.7Å
136	A	93.1	Very high	90.1	Very high	38 Å²	38	47 Å²	47	31%	0.314	24%	0.238	S	C	.	.	H	α-helix	trans	-60.4	-47.5	176.4	0	0	0	0	0	111.8	P87 I132 T138 G139 I140	P87-A136 HydrophobicContact CB-CB 4.46Å; P87-A136 HydrophobicContact CG-CB 4.07Å; I132-A136 VanDerWaalsContact O-CB 3.29Å; I132-A136 WeakPolarHBondContact O-CB 3.49Å; I132-A136 PolarHBondContact O-N 2.96Å; A136-T138 PolarHBondContact O-N 2.68Å; A136-G139 PolarHBondContact O-N 2.84Å; A136-I140 WeakPolarHBondContact O-CB 3.04Å; A136-I140 WeakPolarHBondContact O-CD1 3.48Å; A136-I140 WeakPolarHBondContact O-CG1 3.21Å; A136-I140 PolarHBondContact O-N 2.98Å
137	K	91.7	Very high	90.8	Very high	38 Å²	38	48.5 Å²	48.5	17%	0.165	25%	0.246	C	C	.	.	H	α-helix	trans	-56.4	-48.6	173.3	-77.3	172.3	175.9	-167.8	0	112.4	V84 P87 S88 S133 L134 I140 E141	V84-K137 HydrophobicContact CG2-CB 4.21Å; V84-K137 HydrophobicContact CG2-CG 4.01Å; P87-K137 HydrophobicContact CB-CG 4.03Å; P87-K137 HydrophobicContact CG-CG 4.16Å; S88-K137 WeakPolarHBondContact OG-CE 3.4Å; S88-K137 PolarHBondContact OG-NZ 2.7Å; S133-K137 WeakPolarHBondContact O-CB 3.24Å; S133-K137 VanDerWaalsContact O-CG 3.23Å; S133-K137 WeakPolarHBondContact O-CG 3.4Å; S133-K137 PolarHBondContact O-N 3.45Å; L134-K137 PolarHBondContact O-N 2.86Å; K137-I140 PolarHBondContact O-N 3.32Å; K137-E141 WeakPolarHBondContact O-CB 3.38Å; K137-E141 VanDerWaalsContact O-CG 3.24Å; K137-E141 WeakPolarHBondContact O-CG 3.38Å; K137-E141 PolarHBondContact O-N 3.44Å
138	T	93.9	Very high	91.4	Very high	12 Å²	12	47.8 Å²	47.8	7%	0.074	24%	0.244	C	C	.	.	H	α-helix	trans	-64	-43.7	-177.2	-51	0	0	0	0	110.6	L134 F135 A136 I142 I197 N200 I201	L134-T138 WeakPolarHBondContact O-CB 3.43Å; L134-T138 PolarHBondContact O-N 2.7Å; L134-T138 PolarHBondContact O-OG1 3.4Å; F135-T138 PolarHBondContact O-N 3.43Å; A136-T138 PolarHBondContact O-N 2.68Å; T138-I142 HydrophobicContact CG2-CD1 3.91Å; T138-I142 WeakPolarHBondContact O-CB 3.23Å; T138-I142 VanDerWaalsContact O-CG1 3.24Å; T138-I142 WeakPolarHBondContact O-CG1 3.4Å; T138-I142 PolarHBondContact O-N 3.12Å; T138-I197 HydrophobicContact CG2-CG2 4.34Å; T138-N200 WeakPolarHBondContact OG1-CB 3.31Å; T138-I201 HydrophobicContact CG2-CD1 4.26Å; T138-I201 HydrophobicContact CG2-CG1 3.95Å
139	G	96.4	Very high	91.7	Very high	40 Å²	40	44.8 Å²	44.8	41%	0.412	24%	0.236	S	C	.	.	H	α-helix	trans	-65.1	-42.3	175.7	0	0	0	0	0	113.4	F135 A136 A143	F135-G139 PolarHBondContact O-N 2.8Å; A136-G139 PolarHBondContact O-N 2.84Å; G139-A143 VanDerWaalsContact O-CB 3.23Å; G139-A143 WeakPolarHBondContact O-CB 3.4Å; G139-A143 PolarHBondContact O-N 3.49Å
140	I	95.8	Very high	91.9	Very high	39 Å²	39	49.9 Å²	49.9	20%	0.2	26%	0.257	C	S	.	.	H	α-helix	trans	-61.3	-48.7	175.3	-73.3	165.2	0	0	0	110.7	F83 V84 P87 A136 K137 I142 A143 F144	F83-I140 HydrophobicContact CB-CD1 4.38Å; F83-I140 HydrophobicContact CB-CG2 3.72Å; V84-I140 HydrophobicContact CB-CG2 4.47Å; P87-I140 HydrophobicContact CG-CD1 4.17Å; A136-I140 WeakPolarHBondContact O-CB 3.04Å; A136-I140 WeakPolarHBondContact O-CD1 3.48Å; A136-I140 WeakPolarHBondContact O-CG1 3.21Å; A136-I140 PolarHBondContact O-N 2.98Å; K137-I140 PolarHBondContact O-N 3.32Å; I140-I142 PolarHBondContact O-N 2.84Å; I140-A143 PolarHBondContact O-N 2.93Å; I140-F144 HydrophobicContact CG2-CD2 3.91Å; I140-F144 HydrophobicContact CG2-CE2 4.13Å; I140-F144 WeakPolarHBondContact O-CD2 3.46Å; I140-F144 PolarHBondContact O-N 3.24Å
141	E	95.3	Very high	92.1	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.5	-42	-179.9	-71.8	-87.1	83.3	0	0	112.2	R32 Q80 V84 K137 L145 I197	R32-E141 IonicContact CZ-OE1 3.67Å; R32-E141 IonicContact CZ-OE2 2.78Å; R32-E141 VanDerWaalsContact NH1-CD 3.27Å; R32-E141 IonicContact NH1-OE1 2.68Å; R32-E141 PolarHBondContact NH1-OE1 2.81Å; R32-E141 VanDerWaalsContact NH1-OE1 3.12Å; R32-E141 IonicContact NH1-OE2 3.43Å; R32-E141 PolarHBondContact NH1-OE2 3.19Å; R32-E141 IonicContact NH2-OE1 2.7Å; R32-E141 PolarHBondContact NH2-OE1 3.22Å; R32-E141 IonicContact NH2-OE2 3.82Å; Q80-E141 WeakPolarHBondContact CG-OE1 3.46Å; Q80-E141 PolarHBondContact NE2-OE1 3.03Å; V84-E141 HydrophobicContact CG2-CG 3.75Å; K137-E141 WeakPolarHBondContact O-CB 3.38Å; K137-E141 VanDerWaalsContact O-CG 3.24Å; K137-E141 WeakPolarHBondContact O-CG 3.38Å; K137-E141 PolarHBondContact O-N 3.44Å; E141-L145 WeakPolarHBondContact O-CB 3.18Å; E141-L145 WeakPolarHBondContact O-CG 3.33Å; E141-L145 PolarHBondContact O-N 3.31Å; E141-I197 HydrophobicContact CB-CD1 3.89Å; E141-I197 HydrophobicContact CB-CG1 3.64Å
142	I	96.3	Very high	92	Very high	87 Å²	87	52.5 Å²	52.5	45%	0.446	27%	0.27	S	S	.	.	H	α-helix	trans	-64.2	-44.6	174.4	-70	168.8	0	0	0	110.7	T138 I140 L145 Y146 I197	T138-I142 HydrophobicContact CG2-CD1 3.91Å; T138-I142 WeakPolarHBondContact O-CB 3.23Å; T138-I142 VanDerWaalsContact O-CG1 3.24Å; T138-I142 WeakPolarHBondContact O-CG1 3.4Å; T138-I142 PolarHBondContact O-N 3.12Å; I140-I142 PolarHBondContact O-N 2.84Å; I142-L145 PolarHBondContact O-N 2.96Å; I142-Y146 WeakPolarHBondContact O-CB 3.35Å; I142-Y146 PolarHBondContact O-N 3.25Å; I142-I197 HydrophobicContact CD1-CG2 4.47Å; I142-I197 HydrophobicContact CG1-CD1 3.83Å; I142-I197 HydrophobicContact CG1-CG1 4.31Å; I142-I197 HydrophobicContact CG1-CG2 4.39Å
143	A	95.9	Very high	91.1	Very high	44 Å²	44	54.6 Å²	54.6	36%	0.364	28%	0.282	S	S	.	.	H	α-helix	trans	-62.8	-44.9	-179.8	0	0	0	0	0	112.1	G139 I140 Y146 I147	G139-A143 VanDerWaalsContact O-CB 3.23Å; G139-A143 WeakPolarHBondContact O-CB 3.4Å; G139-A143 PolarHBondContact O-N 3.49Å; I140-A143 PolarHBondContact O-N 2.93Å; A143-Y146 PolarHBondContact O-N 2.85Å; A143-I147 WeakPolarHBondContact O-CB 3.39Å; A143-I147 WeakPolarHBondContact O-CD1 3.26Å; A143-I147 VanDerWaalsContact O-CG1 3.22Å; A143-I147 WeakPolarHBondContact O-CG1 3.37Å; A143-I147 PolarHBondContact O-N 2.94Å
144	F	94.9	Very high	90.3	Very high	27 Å²	27	57.4 Å²	57.4	12%	0.118	30%	0.302	C	S	.	.	H	α-helix	trans	-67.8	-37.8	176.6	-87.6	-80.5	0	0	0	112.8	L79 Q80 F83 I140 I147 L148	L79-F144 HydrophobicContact CB-CE1 3.82Å; L79-F144 HydrophobicContact CB-CZ 3.88Å; Q80-F144 HydrophobicContact CB-CB 3.98Å; Q80-F144 HydrophobicContact CB-CD1 3.73Å; Q80-F144 HydrophobicContact CB-CD2 3.97Å; Q80-F144 HydrophobicContact CB-CE1 4.19Å; Q80-F144 HydrophobicContact CB-CE2 4.41Å; Q80-F144 HydrophobicContact CB-CG 3.62Å; Q80-F144 VanDerWaalsContact CD-CB 3.42Å; Q80-F144 HydrophobicContact CG-CB 3.49Å; Q80-F144 VanDerWaalsContact CG-CB 3.49Å; Q80-F144 HydrophobicContact CG-CD1 4.22Å; Q80-F144 HydrophobicContact CG-CD2 3.86Å; Q80-F144 HydrophobicContact CG-CG 3.6Å; F83-F144 HydrophobicContact CB-CE2 4.03Å; F83-F144 AromaticContact CD2-CE2 3.81Å; F83-F144 HydrophobicContact CD2-CE2 3.81Å; F83-F144 AromaticContact CD2-CZ 3.69Å; F83-F144 HydrophobicContact CD2-CZ 3.69Å; F83-F144 HydrophobicContact CE2-CZ 4.29Å; F83-F144 HydrophobicContact CG-CE2 4.19Å; I140-F144 HydrophobicContact CG2-CD2 3.91Å; I140-F144 HydrophobicContact CG2-CE2 4.13Å; I140-F144 WeakPolarHBondContact O-CD2 3.46Å; I140-F144 PolarHBondContact O-N 3.24Å; F144-I147 PolarHBondContact O-N 3.31Å; F144-L148 WeakPolarHBondContact O-CB 3.44Å; F144-L148 WeakPolarHBondContact O-CD1 3.33Å; F144-L148 VanDerWaalsContact O-CG 3.29Å; F144-L148 WeakPolarHBondContact O-CG 3.42Å; F144-L148 PolarHBondContact O-N 3.37Å
145	L	93	Very high	89.6	Confident	27 Å²	27	58.6 Å²	58.6	14%	0.141	31%	0.307	C	S	.	.	H	α-helix	trans	-65	-39	172.8	-75.2	-177.7	0	0	0	112.4	E141 I142 L148 H149 V190 I197	E141-L145 WeakPolarHBondContact O-CB 3.18Å; E141-L145 WeakPolarHBondContact O-CG 3.33Å; E141-L145 PolarHBondContact O-N 3.31Å; I142-L145 PolarHBondContact O-N 2.96Å; L145-L148 HydrophobicContact CD2-CD1 4.46Å; L145-L148 PolarHBondContact O-N 3.4Å; L145-H149 WeakPolarHBondContact O-CB 3.29Å; L145-H149 PolarHBondContact O-N 3.41Å; L145-V190 HydrophobicContact CD2-CB 4.41Å; L145-V190 HydrophobicContact CD2-CG1 4.16Å; L145-V190 HydrophobicContact CD2-CG2 4.13Å; L145-I197 HydrophobicContact CD1-CD1 3.56Å
146	Y	93.3	Very high	88.9	Confident	163 Å²	163	60.9 Å²	60.9	64%	0.639	31%	0.314	S	S	*	.	H	α-helix	trans	-63.6	-46.6	174.7	178.9	-93.6	0	0	0	111.6	I142 A143 L148 H149 H150	I142-Y146 WeakPolarHBondContact O-CB 3.35Å; I142-Y146 PolarHBondContact O-N 3.25Å; A143-Y146 PolarHBondContact O-N 2.85Å; Y146-L148 PolarHBondContact O-N 2.94Å; Y146-H149 PolarHBondContact O-N 3.12Å; Y146-H150 WeakPolarHBondContact O-CB 3.21Å; Y146-H150 PolarHBondContact O-N 3.07Å
147	I	92.4	Very high	88.4	Confident	68 Å²	68	59.7 Å²	59.7	35%	0.349	30%	0.302	S	S	.	.	H	α-helix	trans	-59.7	-46.1	175.9	-70.8	164	0	0	0	110.8	L76 A143 F144 H150 I151	L76-I147 HydrophobicContact CD2-CG2 4.46Å; A143-I147 WeakPolarHBondContact O-CB 3.39Å; A143-I147 WeakPolarHBondContact O-CD1 3.26Å; A143-I147 VanDerWaalsContact O-CG1 3.22Å; A143-I147 WeakPolarHBondContact O-CG1 3.37Å; A143-I147 PolarHBondContact O-N 2.94Å; F144-I147 PolarHBondContact O-N 3.31Å; I147-H150 PolarHBondContact O-N 3.44Å; I147-I151 HydrophobicContact CG2-CD1 3.64Å; I147-I151 HydrophobicContact CG2-CG1 4.43Å; I147-I151 WeakPolarHBondContact O-CB 3.23Å; I147-I151 WeakPolarHBondContact O-CG1 3.38Å; I147-I151 PolarHBondContact O-N 3.46Å
148	L	90.1	Very high	88.1	Confident	2 Å²	2	59.5 Å²	59.5	1%	0.01	30%	0.304	C	S	.	.	H	α-helix	trans	-60.8	-45.1	176.2	-77.3	162.4	0	0	0	112.1	L76 F144 L145 Y146 H150 Y152 F155	L76-L148 HydrophobicContact CB-CD2 3.93Å; L76-L148 HydrophobicContact CD1-CD2 3.66Å; L76-L148 HydrophobicContact CD1-CG 4.35Å; L76-L148 HydrophobicContact CG-CD2 4.46Å; F144-L148 WeakPolarHBondContact O-CB 3.44Å; F144-L148 WeakPolarHBondContact O-CD1 3.33Å; F144-L148 VanDerWaalsContact O-CG 3.29Å; F144-L148 WeakPolarHBondContact O-CG 3.42Å; F144-L148 PolarHBondContact O-N 3.37Å; L145-L148 HydrophobicContact CD2-CD1 4.46Å; L145-L148 PolarHBondContact O-N 3.4Å; Y146-L148 PolarHBondContact O-N 2.94Å; L148-H150 VanDerWaalsContact C-N 3.32Å; L148-H150 PolarHBondContact O-N 2.96Å; L148-Y152 HydrophobicContact CD2-CD2 4.22Å; L148-Y152 HydrophobicContact CD2-CE2 4.44Å; L148-Y152 WeakPolarHBondContact O-CB 3.34Å; L148-Y152 PolarHBondContact O-N 3.44Å; L148-F155 HydrophobicContact CB-CE1 4.02Å
149	H	89.5	Confident	87.8	Confident	89 Å²	89	67.8 Å²	67.8	41%	0.412	33%	0.334	S	S	.	.	H	α-helix	trans	-65.9	-34.6	178.9	-169	-52.4	0	0	0	112.4	L145 Y146 D153 S154 F155	L145-H149 WeakPolarHBondContact O-CB 3.29Å; L145-H149 PolarHBondContact O-N 3.41Å; Y146-H149 PolarHBondContact O-N 3.12Å; H149-D153 PolarHBondContact O-N 3Å; H149-S154 PolarHBondContact CE1-OG 3.26Å; H149-F155 HydrophobicContact CB-CZ 4.15Å; H149-F155 AromaticContact CD2-CE2 3.9Å
150	H	88.9	Confident	87.6	Confident	142 Å²	142	68.9 Å²	68.9	66%	0.657	33%	0.331	S	S	*	.	H	α-helix	trans	-77.4	-38.3	-179.7	-173.2	51	0	0	0	112.8	Y146 I147 L148	Y146-H150 WeakPolarHBondContact O-CB 3.21Å; Y146-H150 PolarHBondContact O-N 3.07Å; I147-H150 PolarHBondContact O-N 3.44Å; L148-H150 VanDerWaalsContact C-N 3.32Å; L148-H150 PolarHBondContact O-N 2.96Å
151	I	87.8	Confident	87.4	Confident	72 Å²	72	69.6 Å²	69.6	37%	0.369	33%	0.331	S	S	.	.	H	α-helix	trans	-76	-37.1	178.4	-67.9	174.6	0	0	0	111.8	L76 I147	L76-I151 HydrophobicContact CD1-CD1 4.26Å; I147-I151 HydrophobicContact CG2-CD1 3.64Å; I147-I151 HydrophobicContact CG2-CG1 4.43Å; I147-I151 WeakPolarHBondContact O-CB 3.23Å; I147-I151 WeakPolarHBondContact O-CG1 3.38Å; I147-I151 PolarHBondContact O-N 3.46Å
152	Y	83.2	Confident	87.3	Confident	18 Å²	18	75.5 Å²	75.5	7%	0.071	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	33.7	-171.9	-68.1	-59.6	0	0	0	114.3	F69 I71 S72 H73 L76 L148 S154 F155 Y156	F69-Y152 HydrophobicContact CD1-CE1 4.1Å; F69-Y152 HydrophobicContact CE1-CE1 4.42Å; I71-Y152 PolarHBondContact O-OH 2.88Å; S72-Y152 VanDerWaalsContact CA-OH 3.28Å; S72-Y152 WeakPolarHBondContact CA-OH 3.46Å; H73-Y152 HydrophobicContact CB-CE2 4.38Å; H73-Y152 AromaticContact CD2-CD2 3.79Å; H73-Y152 AromaticContact CD2-CE2 3.83Å; H73-Y152 AromaticContact CE1-CD1 3.45Å; H73-Y152 VanDerWaalsContact CE1-CD1 3.45Å; H73-Y152 WeakPolarHBondContact CE1-CD1 3.28Å; H73-Y152 AromaticContact CE1-CD2 3.47Å; H73-Y152 VanDerWaalsContact CE1-CD2 3.47Å; H73-Y152 WeakPolarHBondContact CE1-CD2 3.42Å; H73-Y152 AromaticContact CE1-CE1 3.49Å; H73-Y152 VanDerWaalsContact CE1-CE1 3.49Å; H73-Y152 WeakPolarHBondContact CE1-CE1 3.3Å; H73-Y152 AromaticContact CE1-CE2 3.47Å; H73-Y152 VanDerWaalsContact CE1-CE2 3.47Å; H73-Y152 WeakPolarHBondContact CE1-CE2 3.49Å; H73-Y152 AromaticContact CE1-CG 3.42Å; H73-Y152 VanDerWaalsContact CE1-CG 3.42Å; H73-Y152 AromaticContact CE1-CZ 3.46Å; H73-Y152 VanDerWaalsContact CE1-CZ 3.46Å; H73-Y152 AromaticContact CG-CE2 3.58Å; H73-Y152 AromaticContact CG-CZ 3.92Å; H73-Y152 PolarHBondContact N-OH 3.36Å; H73-Y152 VanDerWaalsContact N-OH 3.13Å; H73-Y152 AromaticContact ND1-CD2 3.85Å; H73-Y152 AromaticContact ND1-CE1 3.68Å; H73-Y152 AromaticContact ND1-CE2 3.36Å; H73-Y152 WeakPolarHBondContact ND1-CE2 3.08Å; H73-Y152 AromaticContact ND1-CZ 3.24Å; H73-Y152 PolarHBondContact ND1-OH 3.06Å; H73-Y152 AromaticContact NE2-CD2 3.45Å; H73-Y152 WeakPolarHBondContact NE2-CD2 3.46Å; H73-Y152 AromaticContact NE2-CE2 3.79Å; H73-Y152 AromaticContact NE2-CG 3.58Å; L76-Y152 HydrophobicContact CD1-CE2 4.15Å; L148-Y152 HydrophobicContact CD2-CD2 4.22Å; L148-Y152 HydrophobicContact CD2-CE2 4.44Å; L148-Y152 WeakPolarHBondContact O-CB 3.34Å; L148-Y152 PolarHBondContact O-N 3.44Å; Y152-S154 PolarHBondContact O-N 2.77Å; Y152-F155 CarbonylContact O-C 3.48Å; Y152-F155 VanDerWaalsContact O-CA 3.23Å; Y152-F155 WeakPolarHBondContact O-CA 3.43Å; Y152-F155 PolarHBondContact O-N 3.25Å; Y152-Y156 PolarHBondContact O-N 2.93Å
153	D	72.1	Confident	87.3	Confident	124 Å²	124	71.3 Å²	71.3	66%	0.663	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	23.1	82.7	175.6	-163.8	4.1	0	0	0	114.4	H149 F155 Y156	H149-D153 PolarHBondContact O-N 3Å; D153-F155 VanDerWaalsContact C-N 3.25Å; D153-F155 PolarHBondContact O-N 2.8Å; D153-Y156 WeakPolarHBondContact O-CB 3.26Å; D153-Y156 PolarHBondContact O-N 3.32Å
154	S	72.3	Confident	87.2	Confident	63 Å²	63	76.7 Å²	76.7	44%	0.441	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	61.2	28.9	179.3	-46.9	0	0	0	0	114.7	H149 Y152 Y156	H149-S154 PolarHBondContact CE1-OG 3.26Å; Y152-S154 PolarHBondContact O-N 2.77Å; S154-Y156 PolarHBondContact O-N 3.21Å
155	F	73.6	Confident	87.2	Confident	29 Å²	29	77.3 Å²	77.3	13%	0.127	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	64.1	20.9	-177.2	-44.6	-77	0	0	0	114.2	L148 H149 Y152 D153 L157 T186 Y187 V190	L148-F155 HydrophobicContact CB-CE1 4.02Å; H149-F155 HydrophobicContact CB-CZ 4.15Å; H149-F155 AromaticContact CD2-CE2 3.9Å; Y152-F155 CarbonylContact O-C 3.48Å; Y152-F155 VanDerWaalsContact O-CA 3.23Å; Y152-F155 WeakPolarHBondContact O-CA 3.43Å; Y152-F155 PolarHBondContact O-N 3.25Å; D153-F155 VanDerWaalsContact C-N 3.25Å; D153-F155 PolarHBondContact O-N 2.8Å; F155-L157 PolarHBondContact O-N 2.82Å; F155-T186 HydrophobicContact CB-CG2 3.97Å; F155-T186 HydrophobicContact CD1-CG2 3.76Å; F155-T186 HydrophobicContact CG-CG2 4.13Å; F155-Y187 HydrophobicContact CB-CE1 4.45Å; F155-V190 HydrophobicContact CD1-CG2 3.96Å; F155-V190 HydrophobicContact CE1-CG2 3.52Å; F155-V190 HydrophobicContact CE2-CG1 4.24Å; F155-V190 HydrophobicContact CZ-CG1 4.01Å; F155-V190 HydrophobicContact CZ-CG2 3.84Å
156	Y	77.8	Confident	87.2	Confident	157 Å²	157	82 Å²	82	62%	0.616	39%	0.388	S	S	*	.			trans	-87.7	94.5	-176.1	-171.9	-91.2	0	0	0	112.4	Y152 D153 S154 P158	Y152-Y156 PolarHBondContact O-N 2.93Å; D153-Y156 WeakPolarHBondContact O-CB 3.26Å; D153-Y156 PolarHBondContact O-N 3.32Å; S154-Y156 PolarHBondContact O-N 3.21Å; Y156-P158 HydrophobicContact CE1-CB 4.05Å; Y156-P158 WeakPolarHBondContact O-CD 3.43Å
157	L	83.2	Confident	87.3	Confident	13 Å²	13	76.7 Å²	76.7	7%	0.068	37%	0.374	C	S	.	.			trans	-78.7	121.7	165.2	-158.2	66.4	0	0	0	110.5	F69 F155 I176 P179 K182 K183	F69-L157 HydrophobicContact CE1-CD1 3.69Å; F69-L157 HydrophobicContact CZ-CD1 3.87Å; F155-L157 PolarHBondContact O-N 2.82Å; L157-I176 HydrophobicContact CD1-CD1 4.19Å; L157-I176 HydrophobicContact CD2-CG2 4.14Å; L157-I176 HydrophobicContact CG-CD1 4.38Å; L157-P179 HydrophobicContact CD2-CB 4.19Å; L157-K182 HydrophobicContact CD2-CB 3.84Å; L157-K182 HydrophobicContact CD2-CD 3.83Å; L157-K182 HydrophobicContact CD2-CG 4.45Å; L157-K183 HydrophobicContact CB-CD 3.95Å; L157-K183 HydrophobicContact CB-CG 3.86Å; L157-K183 WeakPolarHBondContact O-CD 3.45Å; L157-K183 PolarHBondContact O-NZ 3.29Å
158	P	85.2	Confident	87.4	Confident	33 Å²	33	74.2 Å²	74.2	21%	0.214	36%	0.362	C	S	.	.			trans	-75.9	169.4	172.4	32.9	-35.3	0	0	0	111.3	Y156 L160 I176	Y156-P158 HydrophobicContact CE1-CB 4.05Å; Y156-P158 WeakPolarHBondContact O-CD 3.43Å; P158-L160 WeakPolarHBondContact CB-O 3.29Å; P158-I176 HydrophobicContact CG-CD1 4.22Å
159	R	87.4	Confident	87.5	Confident	187 Å²	187	78 Å²	78	71%	0.706	39%	0.387	S	S	*	.	S	Bend	trans	-87.8	-27	169.7	-66.4	-166.2	-73.1	-108.5	-1.2	113.2	I176 P179	R159-I176 PolarHBondContact O-N 2.92Å; R159-P179 HydrophobicContact CB-CG 4.46Å; R159-P179 HydrophobicContact CG-CG 3.82Å
160	L	91.4	Very high	87.7	Confident	63 Å²	63	79.7 Å²	79.7	33%	0.33	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	131.6	-177.4	169.9	64.8	0	0	0	107.8	P158 D173 C174 Y175	P158-L160 WeakPolarHBondContact CB-O 3.29Å; L160-D173 HydrophobicContact CD1-CB 3.6Å; L160-C174 WeakPolarHBondContact CA-O 3.35Å; L160-Y175 HydrophobicContact CB-CE1 4.49Å; L160-Y175 HydrophobicContact CD1-CD1 4.31Å; L160-Y175 HydrophobicContact CD1-CE1 3.98Å
161	Y	91.6	Very high	87.9	Confident	53 Å²	53	76.5 Å²	76.5	21%	0.208	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	140.4	169.6	177.5	-114.9	0	0	0	109.2	H67 I68 C163 C174	H67-Y161 PolarHBondContact CD2-OH 2.85Å; I68-Y161 HydrophobicContact CB-CD1 4.33Å; I68-Y161 HydrophobicContact CB-CE1 4.21Å; I68-Y161 HydrophobicContact CD1-CD1 4.24Å; I68-Y161 HydrophobicContact CD1-CD2 3.76Å; I68-Y161 HydrophobicContact CD1-CE2 4.37Å; I68-Y161 HydrophobicContact CD1-CG 3.69Å; I68-Y161 HydrophobicContact CG1-CD2 4.31Å; I68-Y161 HydrophobicContact CG1-CE2 4.44Å; I68-Y161 HydrophobicContact CG1-CG 4.46Å; Y161-C163 HydrophobicContact CD1-CB 3.98Å; Y161-C163 HydrophobicContact CE1-CB 3.69Å; Y161-C174 PolarHBondContact N-O 2.88Å; Y161-C174 PolarHBondContact O-N 3.36Å
162	K	94.2	Very high	88.3	Confident	124 Å²	124	73.5 Å²	73.5	54%	0.539	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	118.1	175.2	-68.1	-168.2	176.6	-79.2	0	108.4	V171 V172 D173	K162-V171 HydrophobicContact CB-CG1 3.85Å; K162-V171 HydrophobicContact CD-CG1 4.38Å; K162-V171 HydrophobicContact CG-CG1 4.44Å; K162-V172 WeakPolarHBondContact CA-O 3.35Å; K162-D173 WeakPolarHBondContact CG-OD1 3.45Å; K162-D173 IonicContact NZ-OD1 2.63Å; K162-D173 PolarHBondContact NZ-OD1 2.93Å; K162-D173 IonicContact NZ-OD2 2.69Å
163	C	95	Very high	88.9	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	130.2	-171.2	179.7	0	0	0	0	111.2	C64 Y161 V171 V172	C64-C163 WeakPolarHBondContact CA-SG 3.21Å; C64-C163 HydrophobicContact CB-CB 3.76Å; C64-C163 WeakPolarHBondContact CB-SG 3.24Å; C64-C163 WeakPolarHBondContact SG-CB 3.41Å; C64-C163 CovalentContact SG-SG 2.03Å; C64-C163 PolarHBondContact SG-SG 3.19Å; Y161-C163 HydrophobicContact CD1-CB 3.98Å; Y161-C163 HydrophobicContact CE1-CB 3.69Å; C163-V171 CarbonylContact O-C 3.58Å; C163-V171 WeakPolarHBondContact O-CA 3.49Å; C163-V172 HydrophobicContact CB-CG2 3.9Å; C163-V172 PolarHBondContact N-O 3.37Å; C163-V172 PolarHBondContact O-N 2.83Å
164	E	95.4	Very high	90	Very high	156 Å²	156	68.8 Å²	68.8	73%	0.729	35%	0.35	S	S	*	.			trans	-123.1	30	-179.2	-156	176.2	160.9	0	0	111.3	V171	E164-V171 HydrophobicContact CB-CG2 4.17Å; E164-V171 HydrophobicContact CG-CG2 3.77Å; E164-V171 WeakPolarHBondContact OE2-CG2 3.47Å
165	V	94.6	Very high	91	Very high	40 Å²	40	71.2 Å²	71.2	24%	0.242	35%	0.351	C	S	.	.			trans	-94.3	132.5	-172.3	-174.5	0	0	0	0	111	V63 H67 C168	V63-V165 HydrophobicContact CB-CG1 4.05Å; V63-V165 HydrophobicContact CG2-CB 4.14Å; V63-V165 HydrophobicContact CG2-CG1 3.95Å; H67-V165 HydrophobicContact CB-CG2 4.12Å; H67-V165 WeakPolarHBondContact CD2-CG2 3.45Å; V165-C168 WeakPolarHBondContact O-CB 3.47Å; V165-C168 PolarHBondContact O-N 3.2Å; V165-C168 PolarHBondContact O-SG 3.24Å
166	V	92.9	Very high	91.9	Very high	126 Å²	126	70.2 Å²	70.2	76%	0.764	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	128.1	173.1	180	0	0	0	0	109.8
167	P	94.6	Very high	92.4	Very high	51 Å²	51	63.5 Å²	63.5	33%	0.331	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	cis	-101	20.6	20.7	40.4	-37.8	0	0	0	115.7	Q57	Q57-P167 WeakPolarHBondContact CG-O 3.21Å
168	C	94.1	Very high	92.7	Very high	16 Å²	16	67.2 Å²	67.2	11%	0.108	34%	0.342	C	S	.	.			trans	-61.7	137.3	175.7	-55.7	0	0	0	0	111	C60 C64 V165 V172	C60-C168 VanDerWaalsContact CA-SG 3.58Å; C60-C168 HydrophobicContact CB-CB 4.11Å; C60-C168 WeakPolarHBondContact CB-SG 3.47Å; C60-C168 WeakPolarHBondContact SG-CB 3.31Å; C60-C168 CovalentContact SG-SG 2.03Å; C60-C168 PolarHBondContact SG-SG 2.97Å; C64-C168 PolarHBondContact SG-SG 2.86Å; V165-C168 WeakPolarHBondContact O-CB 3.47Å; V165-C168 PolarHBondContact O-N 3.2Å; V165-C168 PolarHBondContact O-SG 3.24Å; C168-V172 HydrophobicContact CB-CG1 4.39Å; C168-V172 HydrophobicContact CB-CG2 4.36Å
169	P	92.3	Very high	92.9	Very high	82 Å²	82	66.6 Å²	66.6	53%	0.532	34%	0.338	S	S	.	.	S	Bend	trans	-80.7	-18.9	-169.1	31.5	-36.5	0	0	0	114.4
170	N	93.2	Very high	93	Very high	125 Å²	125	61.9 Å²	61.9	67%	0.668	33%	0.33	S	S	*	.	S	Bend	trans	-156.6	-178.1	178.1	-74.7	-78.2	0	0	0	107	V172	N170-V172 PolarHBondContact O-N 3.3Å; N170-V172 VanDerWaalsContact O-N 3.16Å
171	V	95.1	Very high	92.9	Very high	74 Å²	74	62.8 Å²	62.8	45%	0.448	33%	0.332	S	S	.	.			trans	-57.1	117.1	164	-176.8	0	0	0	0	109.8	K162 C163 E164	K162-V171 HydrophobicContact CB-CG1 3.85Å; K162-V171 HydrophobicContact CD-CG1 4.38Å; K162-V171 HydrophobicContact CG-CG1 4.44Å; C163-V171 CarbonylContact O-C 3.58Å; C163-V171 WeakPolarHBondContact O-CA 3.49Å; E164-V171 HydrophobicContact CB-CG2 4.17Å; E164-V171 HydrophobicContact CG-CG2 3.77Å; E164-V171 WeakPolarHBondContact OE2-CG2 3.47Å
172	V	95.8	Very high	92.9	Very high	9 Å²	9	60.4 Å²	60.4	6%	0.055	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	146.4	175.8	-62.1	0	0	0	0	111.7	K162 C163 C168 N170	K162-V172 WeakPolarHBondContact CA-O 3.35Å; C163-V172 HydrophobicContact CB-CG2 3.9Å; C163-V172 PolarHBondContact N-O 3.37Å; C163-V172 PolarHBondContact O-N 2.83Å; C168-V172 HydrophobicContact CB-CG1 4.39Å; C168-V172 HydrophobicContact CB-CG2 4.36Å; N170-V172 PolarHBondContact O-N 3.3Å; N170-V172 VanDerWaalsContact O-N 3.16Å
173	D	95.8	Very high	92.7	Very high	43 Å²	43	56.3 Å²	56.3	23%	0.23	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	116.6	172.7	-79.1	-33.5	0	0	0	109.9	C53 N54 L160 K162	C53-D173 WeakPolarHBondContact CA-O 3.34Å; N54-D173 HydrophobicContact CB-CB 4.46Å; N54-D173 PolarHBondContact N-O 3.29Å; L160-D173 HydrophobicContact CD1-CB 3.6Å; K162-D173 WeakPolarHBondContact CG-OD1 3.45Å; K162-D173 IonicContact NZ-OD1 2.63Å; K162-D173 PolarHBondContact NZ-OD1 2.93Å; K162-D173 IonicContact NZ-OD2 2.69Å
174	C	94.8	Very high	92.5	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	129	178.1	-64.1	0	0	0	0	111.8	F51 D52 C53 L160 Y161	F51-C174 HydrophobicContact CE1-CB 4.08Å; F51-C174 HydrophobicContact CE2-CB 4.14Å; F51-C174 HydrophobicContact CZ-CB 3.62Å; D52-C174 CarbonylContact O-C 3.56Å; D52-C174 VanDerWaalsContact O-CA 3.31Å; D52-C174 WeakPolarHBondContact O-CA 3.23Å; C53-C174 HydrophobicContact CB-CB 4.1Å; C53-C174 WeakPolarHBondContact CB-SG 3.33Å; C53-C174 WeakPolarHBondContact SG-CB 3.45Å; C53-C174 CovalentContact SG-SG 2.04Å; C53-C174 PolarHBondContact SG-SG 3.47Å; L160-C174 WeakPolarHBondContact CA-O 3.35Å; Y161-C174 PolarHBondContact N-O 2.88Å; Y161-C174 PolarHBondContact O-N 3.36Å
175	Y	93.6	Very high	92.4	Very high	114 Å²	114	54.5 Å²	54.5	45%	0.447	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	137.3	-177.8	-61.6	-84	0	0	0	111	D52 L160	D52-Y175 PolarHBondContact N-O 3.04Å; D52-Y175 PolarHBondContact O-N 3.37Å; L160-Y175 HydrophobicContact CB-CE1 4.49Å; L160-Y175 HydrophobicContact CD1-CD1 4.31Å; L160-Y175 HydrophobicContact CD1-CE1 3.98Å
176	I	91.6	Very high	92.2	Very high	9 Å²	9	52.8 Å²	52.8	5%	0.046	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	117.9	-177.9	-54.4	176.1	0	0	0	109	F51 I68 F69 L157 P158 R159 P179	F51-I176 HydrophobicContact CD2-CG1 4.25Å; F51-I176 HydrophobicContact CE2-CG1 4.13Å; I68-I176 HydrophobicContact CD1-CD1 3.63Å; F69-I176 HydrophobicContact CE2-CG2 4.3Å; F69-I176 HydrophobicContact CZ-CD1 4.16Å; F69-I176 HydrophobicContact CZ-CG2 3.95Å; L157-I176 HydrophobicContact CD1-CD1 4.19Å; L157-I176 HydrophobicContact CD2-CG2 4.14Å; L157-I176 HydrophobicContact CG-CD1 4.38Å; P158-I176 HydrophobicContact CG-CD1 4.22Å; R159-I176 PolarHBondContact O-N 2.92Å; I176-P179 VanDerWaalsContact O-CD 3.26Å; I176-P179 WeakPolarHBondContact O-CD 3.45Å; I176-P179 WeakPolarHBondContact O-CG 3.36Å
177	G	89.1	Confident	92.1	Very high	15 Å²	15	53 Å²	53	16%	0.155	28%	0.279	C	S	.	.	S	Bend	trans	-57.4	144.6	175	0	0	0	0	0	114	D50 P179 K182	D50-G177 WeakPolarHBondContact O-CA 3.25Å; D50-G177 PolarHBondContact O-N 3.18Å; G177-P179 VanDerWaalsContact C-CD 3.49Å; G177-K182 WeakPolarHBondContact O-CD 3.43Å; G177-K182 VanDerWaalsContact O-CE 3.24Å; G177-K182 WeakPolarHBondContact O-CE 3.29Å; G177-K182 PolarHBondContact O-NZ 2.95Å
178	H	88.8	Confident	92	Very high	92 Å²	92	55.9 Å²	55.9	43%	0.426	29%	0.287	S	S	.	.	S	Bend	trans	44.7	44.4	175.7	-63.7	-86.3	0	0	0	116.5	D50 T180 E181 K182	D50-H178 IonicContact OD2-CD2 2.82Å; H178-T180 PolarHBondContact O-N 3.29Å; H178-E181 HydrophobicContact CB-CB 4.41Å; H178-E181 IonicContact CE1-OE1 3.24Å; H178-E181 IonicContact CG-OE1 3.9Å; H178-E181 IonicContact ND1-OE1 2.7Å; H178-E181 PolarHBondContact ND1-OE1 3.39Å; H178-E181 IonicContact ND1-OE2 2.96Å; H178-E181 PolarHBondContact O-N 3.38Å; H178-K182 VanDerWaalsContact O-CG 3.29Å; H178-K182 WeakPolarHBondContact O-CG 3.39Å; H178-K182 PolarHBondContact O-N 3.27Å
179	P	89.4	Confident	91.9	Very high	19 Å²	19	55.2 Å²	55.2	12%	0.123	28%	0.282	C	S	.	.	H	α-helix	trans	-75.3	-24.3	-166.6	32.3	-33.4	0	0	0	113	L157 R159 I176 G177 K183	L157-P179 HydrophobicContact CD2-CB 4.19Å; R159-P179 HydrophobicContact CB-CG 4.46Å; R159-P179 HydrophobicContact CG-CG 3.82Å; I176-P179 VanDerWaalsContact O-CD 3.26Å; I176-P179 WeakPolarHBondContact O-CD 3.45Å; I176-P179 WeakPolarHBondContact O-CG 3.36Å; G177-P179 VanDerWaalsContact C-CD 3.49Å; P179-K183 WeakPolarHBondContact O-CD 3.39Å; P179-K183 VanDerWaalsContact O-CG 3.26Å; P179-K183 WeakPolarHBondContact O-CG 3.44Å; P179-K183 PolarHBondContact O-N 2.87Å
180	T	89.8	Confident	91.9	Very high	89 Å²	89	52.4 Å²	52.4	55%	0.546	26%	0.263	S	S	.	.	H	α-helix	trans	-70.4	-47.1	172.2	38.3	0	0	0	0	111.6	H178 K183 V184	H178-T180 PolarHBondContact O-N 3.29Å; T180-K183 PolarHBondContact O-N 3.49Å; T180-V184 WeakPolarHBondContact O-CG2 3.36Å; T180-V184 PolarHBondContact O-N 2.91Å
181	E	90.3	Very high	91.9	Very high	81 Å²	81	48.3 Å²	48.3	38%	0.379	25%	0.25	S	S	.	.	H	α-helix	trans	-63.7	-46.5	178.3	-67.8	169.1	-117.6	0	0	110.8	V43 H178 K183 V184 F185	V43-E181 HydrophobicContact CG1-CB 4.23Å; V43-E181 HydrophobicContact CG2-CB 4.5Å; H178-E181 HydrophobicContact CB-CB 4.41Å; H178-E181 IonicContact CE1-OE1 3.24Å; H178-E181 IonicContact CG-OE1 3.9Å; H178-E181 IonicContact ND1-OE1 2.7Å; H178-E181 PolarHBondContact ND1-OE1 3.39Å; H178-E181 IonicContact ND1-OE2 2.96Å; H178-E181 PolarHBondContact O-N 3.38Å; E181-K183 VanDerWaalsContact C-N 3.28Å; E181-K183 PolarHBondContact O-N 2.9Å; E181-V184 WeakPolarHBondContact O-CB 3.12Å; E181-V184 PolarHBondContact O-N 3.43Å; E181-F185 WeakPolarHBondContact O-CD2 3.35Å; E181-F185 PolarHBondContact O-N 3.46Å
182	K	90.6	Very high	91.8	Very high	4 Å²	4	45.1 Å²	45.1	2%	0.017	23%	0.232	C	C	.	.	H	α-helix	trans	-51.3	-46.5	174.1	-73	170.3	-176.5	177.6	0	111.8	V43 W44 D47 L157 G177 H178 F185 T186	V43-K182 HydrophobicContact CG1-CB 4.41Å; V43-K182 HydrophobicContact CG1-CG 3.49Å; V43-K182 VanDerWaalsContact CG1-CG 3.49Å; V43-K182 WeakPolarHBondContact O-CE 3.45Å; W44-K182 HydrophobicContact CH2-CB 3.95Å; W44-K182 HydrophobicContact CH2-CG 3.99Å; W44-K182 WeakPolarHBondContact CH2-O 3.22Å; W44-K182 HydrophobicContact CZ2-CB 3.75Å; W44-K182 HydrophobicContact CZ2-CD 4.48Å; W44-K182 HydrophobicContact CZ2-CG 3.68Å; W44-K182 HydrophobicContact CZ3-CG 4.49Å; D47-K182 WeakPolarHBondContact OD1-CE 3.28Å; D47-K182 IonicContact OD1-NZ 3.64Å; D47-K182 PolarHBondContact OD1-NZ 3.34Å; D47-K182 IonicContact OD2-NZ 3.69Å; D47-K182 PolarHBondContact OD2-NZ 3.02Å; L157-K182 HydrophobicContact CD2-CB 3.84Å; L157-K182 HydrophobicContact CD2-CD 3.83Å; L157-K182 HydrophobicContact CD2-CG 4.45Å; G177-K182 WeakPolarHBondContact O-CD 3.43Å; G177-K182 VanDerWaalsContact O-CE 3.24Å; G177-K182 WeakPolarHBondContact O-CE 3.29Å; G177-K182 PolarHBondContact O-NZ 2.95Å; H178-K182 VanDerWaalsContact O-CG 3.29Å; H178-K182 WeakPolarHBondContact O-CG 3.39Å; H178-K182 PolarHBondContact O-N 3.27Å; K182-F185 PolarHBondContact O-N 3.19Å; K182-T186 WeakPolarHBondContact O-CB 3.24Å; K182-T186 PolarHBondContact O-N 3.31Å; K182-T186 PolarHBondContact O-OG1 2.75Å; K182-T186 VanDerWaalsContact O-OG1 3.05Å
183	K	89.8	Confident	91.6	Very high	37 Å²	37	44.8 Å²	44.8	16%	0.161	23%	0.23	C	C	.	.	H	α-helix	trans	-66	-40.2	177.2	-69.7	171.5	98.3	156.6	0	112.8	L157 P179 T180 E181 T186 Y187	L157-K183 HydrophobicContact CB-CD 3.95Å; L157-K183 HydrophobicContact CB-CG 3.86Å; L157-K183 WeakPolarHBondContact O-CD 3.45Å; L157-K183 PolarHBondContact O-NZ 3.29Å; P179-K183 WeakPolarHBondContact O-CD 3.39Å; P179-K183 VanDerWaalsContact O-CG 3.26Å; P179-K183 WeakPolarHBondContact O-CG 3.44Å; P179-K183 PolarHBondContact O-N 2.87Å; T180-K183 PolarHBondContact O-N 3.49Å; E181-K183 VanDerWaalsContact C-N 3.28Å; E181-K183 PolarHBondContact O-N 2.9Å; K183-T186 PolarHBondContact O-N 3.08Å; K183-Y187 HydrophobicContact CB-CE2 4.32Å; K183-Y187 WeakPolarHBondContact O-CD2 3.37Å; K183-Y187 PolarHBondContact O-N 3.47Å
184	V	91.6	Very high	91.5	Very high	76 Å²	76	44.8 Å²	44.8	46%	0.461	24%	0.236	S	C	.	.	H	α-helix	trans	-61.1	-47.6	175.3	170	0	0	0	0	111.2	T180 E181 Y187 F188	T180-V184 WeakPolarHBondContact O-CG2 3.36Å; T180-V184 PolarHBondContact O-N 2.91Å; E181-V184 WeakPolarHBondContact O-CB 3.12Å; E181-V184 PolarHBondContact O-N 3.43Å; V184-Y187 PolarHBondContact O-N 3.04Å; V184-F188 HydrophobicContact CG1-CD2 3.85Å; V184-F188 HydrophobicContact CG1-CE2 3.54Å; V184-F188 VanDerWaalsContact O-CD2 3.24Å; V184-F188 WeakPolarHBondContact O-CD2 3.47Å; V184-F188 PolarHBondContact O-N 2.91Å
185	F	91.6	Very high	91.4	Very high	43 Å²	43	48.7 Å²	48.7	19%	0.189	26%	0.256	C	S	.	.	H	α-helix	trans	-63.9	-39.7	175.3	-80.7	-78.4	0	0	0	112.4	V35 V38 A39 V43 W44 E181 K182 Y187 F188 M189	V35-F185 HydrophobicContact CG1-CD1 3.91Å; V35-F185 HydrophobicContact CG1-CE1 4.35Å; V38-F185 HydrophobicContact CG1-CE1 4.2Å; V38-F185 HydrophobicContact CG1-CZ 4.18Å; A39-F185 HydrophobicContact CB-CB 4.47Å; A39-F185 HydrophobicContact CB-CD1 3.9Å; A39-F185 HydrophobicContact CB-CE1 4.41Å; A39-F185 HydrophobicContact CB-CG 4.23Å; V43-F185 HydrophobicContact CB-CD2 4.43Å; V43-F185 HydrophobicContact CG1-CD2 4.34Å; V43-F185 HydrophobicContact CG2-CD2 3.86Å; V43-F185 HydrophobicContact CG2-CE2 3.6Å; V43-F185 HydrophobicContact CG2-CZ 4.4Å; W44-F185 HydrophobicContact CH2-CB 3.9Å; W44-F185 HydrophobicContact CZ3-CB 3.71Å; W44-F185 HydrophobicContact CZ3-CG 4.31Å; E181-F185 WeakPolarHBondContact O-CD2 3.35Å; E181-F185 PolarHBondContact O-N 3.46Å; K182-F185 PolarHBondContact O-N 3.19Å; F185-Y187 PolarHBondContact O-N 3.34Å; F185-F188 PolarHBondContact O-N 3.02Å; F185-M189 WeakPolarHBondContact O-CB 3.26Å; F185-M189 WeakPolarHBondContact O-CG 3.45Å; F185-M189 PolarHBondContact O-N 3.06Å
186	T	91.1	Very high	91.3	Very high	4 Å²	4	43.5 Å²	43.5	3%	0.025	24%	0.237	C	C	.	.	H	α-helix	trans	-57.4	-47.7	171.9	-67.3	0	0	0	0	111.7	W77 F155 K182 K183 F188 M189 V190	W77-T186 VanDerWaalsContact CH2-OG1 3.29Å; W77-T186 WeakPolarHBondContact CH2-OG1 3.48Å; W77-T186 HydrophobicContact CZ2-CG2 4.13Å; W77-T186 WeakPolarHBondContact CZ2-OG1 3.3Å; F155-T186 HydrophobicContact CB-CG2 3.97Å; F155-T186 HydrophobicContact CD1-CG2 3.76Å; F155-T186 HydrophobicContact CG-CG2 4.13Å; K182-T186 WeakPolarHBondContact O-CB 3.24Å; K182-T186 PolarHBondContact O-N 3.31Å; K182-T186 PolarHBondContact O-OG1 2.75Å; K182-T186 VanDerWaalsContact O-OG1 3.05Å; K183-T186 PolarHBondContact O-N 3.08Å; T186-F188 PolarHBondContact O-N 2.89Å; T186-M189 PolarHBondContact O-N 3.01Å; T186-V190 HydrophobicContact CG2-CG2 4.13Å; T186-V190 WeakPolarHBondContact O-CB 3.48Å; T186-V190 VanDerWaalsContact O-CG2 3.27Å; T186-V190 WeakPolarHBondContact O-CG2 3.41Å; T186-V190 PolarHBondContact O-N 3.26Å
187	Y	91.3	Very high	91.4	Very high	129 Å²	129	44.1 Å²	44.1	51%	0.506	24%	0.24	S	C	.	.	H	α-helix	trans	-64.1	-38.3	178.7	-70.7	-53.5	0	0	0	112.8	F155 K183 V184 F185 G191	F155-Y187 HydrophobicContact CB-CE1 4.45Å; K183-Y187 HydrophobicContact CB-CE2 4.32Å; K183-Y187 WeakPolarHBondContact O-CD2 3.37Å; K183-Y187 PolarHBondContact O-N 3.47Å; V184-Y187 PolarHBondContact O-N 3.04Å; F185-Y187 PolarHBondContact O-N 3.34Å; Y187-G191 PolarHBondContact O-N 3.43Å
188	F	92.4	Very high	91.5	Very high	113 Å²	113	47.4 Å²	47.4	50%	0.496	26%	0.257	S	S	.	.	H	α-helix	trans	-63.5	-43.8	173	-77.5	-60.1	0	0	0	112.4	V35 V184 F185 T186 A192	V35-F188 HydrophobicContact CG1-CB 4.42Å; V184-F188 HydrophobicContact CG1-CD2 3.85Å; V184-F188 HydrophobicContact CG1-CE2 3.54Å; V184-F188 VanDerWaalsContact O-CD2 3.24Å; V184-F188 WeakPolarHBondContact O-CD2 3.47Å; V184-F188 PolarHBondContact O-N 2.91Å; F185-F188 PolarHBondContact O-N 3.02Å; T186-F188 PolarHBondContact O-N 2.89Å; F188-A192 VanDerWaalsContact O-CB 3.3Å; F188-A192 WeakPolarHBondContact O-CB 3.28Å; F188-A192 PolarHBondContact O-N 2.7Å
189	M	91.5	Very high	91.5	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-66.6	-42.2	178.9	-72.1	-66.7	-76.3	0	0	112.3	R32 V35 Y36 W77 F185 T186 S193	R32-M189 HydrophobicContact CG-CE 3.91Å; R32-M189 HydrophobicContact CG-SD 3.72Å; V35-M189 HydrophobicContact CB-SD 4.2Å; V35-M189 HydrophobicContact CG1-CG 4.11Å; V35-M189 HydrophobicContact CG1-SD 3.84Å; Y36-M189 HydrophobicContact CD2-CE 4.38Å; W77-M189 HydrophobicContact CB-CE 3.76Å; W77-M189 HydrophobicContact CD2-CB 4.26Å; W77-M189 HydrophobicContact CD2-CE 3.92Å; W77-M189 HydrophobicContact CD2-CG 4.14Å; W77-M189 HydrophobicContact CE3-CE 4.11Å; W77-M189 HydrophobicContact CE3-CG 4.05Å; W77-M189 HydrophobicContact CG-CE 3.75Å; W77-M189 HydrophobicContact CH2-CG 4.37Å; W77-M189 HydrophobicContact CZ2-CB 4.16Å; W77-M189 HydrophobicContact CZ2-CG 4.43Å; W77-M189 HydrophobicContact CZ3-CG 4.17Å; F185-M189 WeakPolarHBondContact O-CB 3.26Å; F185-M189 WeakPolarHBondContact O-CG 3.45Å; F185-M189 PolarHBondContact O-N 3.06Å; T186-M189 PolarHBondContact O-N 3.01Å; M189-S193 WeakPolarHBondContact O-CB 3.48Å; M189-S193 PolarHBondContact O-N 2.88Å; M189-S193 PolarHBondContact O-OG 3.4Å
190	V	92.7	Very high	91.5	Very high	24 Å²	24	43.6 Å²	43.6	15%	0.145	24%	0.238	C	C	.	.	H	α-helix	trans	-67.1	-45.7	176.1	170.9	0	0	0	0	110.7	L145 F155 T186 A192 S193 A194	L145-V190 HydrophobicContact CD2-CB 4.41Å; L145-V190 HydrophobicContact CD2-CG1 4.16Å; L145-V190 HydrophobicContact CD2-CG2 4.13Å; F155-V190 HydrophobicContact CD1-CG2 3.96Å; F155-V190 HydrophobicContact CE1-CG2 3.52Å; F155-V190 HydrophobicContact CE2-CG1 4.24Å; F155-V190 HydrophobicContact CZ-CG1 4.01Å; F155-V190 HydrophobicContact CZ-CG2 3.84Å; T186-V190 HydrophobicContact CG2-CG2 4.13Å; T186-V190 WeakPolarHBondContact O-CB 3.48Å; T186-V190 VanDerWaalsContact O-CG2 3.27Å; T186-V190 WeakPolarHBondContact O-CG2 3.41Å; T186-V190 PolarHBondContact O-N 3.26Å; V190-A192 PolarHBondContact O-N 3.3Å; V190-S193 WeakPolarHBondContact O-CB 3.43Å; V190-S193 PolarHBondContact O-N 3.38Å; V190-S193 VanDerWaalsContact O-N 3.16Å; V190-A194 PolarHBondContact O-N 3.16Å
191	G	93.5	Very high	91.6	Very high	38 Å²	38	42.7 Å²	42.7	39%	0.392	23%	0.229	S	C	.	.	H	α-helix	trans	-61.7	-43	177.5	0	0	0	0	0	113	Y187 S193 A194 L195	Y187-G191 PolarHBondContact O-N 3.43Å; G191-S193 VanDerWaalsContact C-N 3.32Å; G191-S193 PolarHBondContact O-N 3.2Å; G191-A194 PolarHBondContact O-N 2.7Å; G191-L195 WeakPolarHBondContact O-CB 2.99Å; G191-L195 PolarHBondContact O-N 3.24Å
192	A	92.2	Very high	91.6	Very high	8 Å²	8	42.2 Å²	42.2	7%	0.066	23%	0.234	C	C	.	.	H	α-helix	trans	-63.8	-36.6	173.6	0	0	0	0	0	112.4	V28 R32 F188 V190 C196	V28-A192 HydrophobicContact CG1-CB 4.13Å; V28-A192 WeakPolarHBondContact CG1-O 3.36Å; R32-A192 HydrophobicContact CB-CB 4.34Å; R32-A192 HydrophobicContact CG-CB 4.39Å; F188-A192 VanDerWaalsContact O-CB 3.3Å; F188-A192 WeakPolarHBondContact O-CB 3.28Å; F188-A192 PolarHBondContact O-N 2.7Å; V190-A192 PolarHBondContact O-N 3.3Å; A192-C196 WeakPolarHBondContact O-CB 3.39Å; A192-C196 PolarHBondContact O-N 3.05Å
193	S	93	Very high	91.4	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.007	23%	0.234	C	C	.	.	H	α-helix	trans	-68.5	-42.7	175.6	-54.5	0	0	0	0	111.9	R32 M189 V190 G191 C196 I197	R32-S193 PolarHBondContact NE-OG 2.89Å; R32-S193 PolarHBondContact NH1-OG 3.11Å; R32-S193 PolarHBondContact NH2-OG 2.99Å; M189-S193 WeakPolarHBondContact O-CB 3.48Å; M189-S193 PolarHBondContact O-N 2.88Å; M189-S193 PolarHBondContact O-OG 3.4Å; V190-S193 WeakPolarHBondContact O-CB 3.43Å; V190-S193 PolarHBondContact O-N 3.38Å; V190-S193 VanDerWaalsContact O-N 3.16Å; G191-S193 VanDerWaalsContact C-N 3.32Å; G191-S193 PolarHBondContact O-N 3.2Å; S193-C196 WeakPolarHBondContact O-CB 3.43Å; S193-C196 PolarHBondContact O-N 3.43Å; S193-I197 WeakPolarHBondContact O-CG1 3.35Å; S193-I197 PolarHBondContact O-N 3.43Å
194	A	93.7	Very high	91.3	Very high	44 Å²	44	41 Å²	41	36%	0.364	23%	0.23	S	C	.	.	H	α-helix	trans	-62	-43.1	174.5	0	0	0	0	0	111.9	V190 G191 C196 I197 V198	V190-A194 PolarHBondContact O-N 3.16Å; G191-A194 PolarHBondContact O-N 2.7Å; A194-C196 PolarHBondContact O-N 3.44Å; A194-I197 PolarHBondContact O-N 2.74Å; A194-V198 WeakPolarHBondContact O-CG2 3.47Å; A194-V198 PolarHBondContact O-N 3.32Å
195	L	92.4	Very high	91.2	Very high	81 Å²	81	42 Å²	42	42%	0.424	23%	0.232	S	C	.	.	H	α-helix	trans	-62.4	-41.1	173.7	-179.5	58.6	0	0	0	111.8	V28 G191 V198 L199	V28-L195 HydrophobicContact CG1-CD2 4.33Å; V28-L195 HydrophobicContact CG2-CD2 3.64Å; V28-L195 HydrophobicContact CG2-CG 4.19Å; G191-L195 WeakPolarHBondContact O-CB 2.99Å; G191-L195 PolarHBondContact O-N 3.24Å; L195-V198 PolarHBondContact O-N 3.45Å; L195-L199 HydrophobicContact CD1-CD1 4.15Å; L195-L199 HydrophobicContact CD1-CG 4.18Å; L195-L199 HydrophobicContact CG-CD1 4.03Å; L195-L199 HydrophobicContact CG-CG 4.5Å; L195-L199 WeakPolarHBondContact O-CB 3.06Å; L195-L199 VanDerWaalsContact O-CG 3.28Å; L195-L199 WeakPolarHBondContact O-CG 3.43Å; L195-L199 PolarHBondContact O-N 2.97Å
196	C	90.9	Very high	91	Very high	6 Å²	6	43.8 Å²	43.8	4%	0.041	24%	0.237	C	C	.	.	H	α-helix	trans	-58.8	-44.8	171.2	-88.1	0	0	0	0	112.3	V28 A192 S193 A194 L199 N200	V28-C196 VanDerWaalsContact CG1-SG 3.6Å; A192-C196 WeakPolarHBondContact O-CB 3.39Å; A192-C196 PolarHBondContact O-N 3.05Å; S193-C196 WeakPolarHBondContact O-CB 3.43Å; S193-C196 PolarHBondContact O-N 3.43Å; A194-C196 PolarHBondContact O-N 3.44Å; C196-L199 PolarHBondContact O-N 3.45Å; C196-N200 WeakPolarHBondContact O-CB 3.46Å; C196-N200 PolarHBondContact O-N 3.09Å; C196-N200 PolarHBondContact O-ND2 2.89Å
197	I	92.6	Very high	90.6	Very high	21 Å²	21	44.1 Å²	44.1	11%	0.108	24%	0.239	C	C	.	.	H	α-helix	trans	-60.2	-49.9	177.3	-71.9	162.9	0	0	0	110.5	T138 E141 I142 L145 S193 A194 L199 N200 I201	T138-I197 HydrophobicContact CG2-CG2 4.34Å; E141-I197 HydrophobicContact CB-CD1 3.89Å; E141-I197 HydrophobicContact CB-CG1 3.64Å; I142-I197 HydrophobicContact CD1-CG2 4.47Å; I142-I197 HydrophobicContact CG1-CD1 3.83Å; I142-I197 HydrophobicContact CG1-CG1 4.31Å; I142-I197 HydrophobicContact CG1-CG2 4.39Å; L145-I197 HydrophobicContact CD1-CD1 3.56Å; S193-I197 WeakPolarHBondContact O-CG1 3.35Å; S193-I197 PolarHBondContact O-N 3.43Å; A194-I197 PolarHBondContact O-N 2.74Å; I197-L199 PolarHBondContact O-N 3.19Å; I197-N200 PolarHBondContact O-N 3.42Å; I197-I201 HydrophobicContact CG2-CD1 3.66Å; I197-I201 HydrophobicContact CG2-CG1 4.46Å; I197-I201 WeakPolarHBondContact O-CB 3.47Å; I197-I201 VanDerWaalsContact O-CG1 3.31Å; I197-I201 WeakPolarHBondContact O-CG1 3.39Å; I197-I201 PolarHBondContact O-N 2.92Å
198	V	92.3	Very high	90.4	Very high	85 Å²	85	41 Å²	41	52%	0.515	23%	0.23	S	C	.	.	H	α-helix	trans	-58.3	-47.9	177.8	173.2	0	0	0	0	111.1	A194 L195 N200 I201 C202	A194-V198 WeakPolarHBondContact O-CG2 3.47Å; A194-V198 PolarHBondContact O-N 3.32Å; L195-V198 PolarHBondContact O-N 3.45Å; V198-N200 PolarHBondContact O-N 2.86Å; V198-I201 PolarHBondContact O-N 3.4Å; V198-C202 WeakPolarHBondContact O-CB 3.43Å; V198-C202 PolarHBondContact O-N 3.48Å; V198-C202 PolarHBondContact O-SG 2.92Å
199	L	89.3	Confident	90.1	Very high	26 Å²	26	38.8 Å²	38.8	14%	0.136	23%	0.229	C	C	.	.	H	α-helix	trans	-63.8	-38.8	179.5	-72	171.2	0	0	0	113	W24 L25 V28 L195 C196 I197 C202 E203	W24-L199 HydrophobicContact CB-CD1 3.99Å; W24-L199 HydrophobicContact CB-CD2 4.35Å; L25-L199 HydrophobicContact CD2-CB 3.56Å; L25-L199 HydrophobicContact CD2-CD1 4.3Å; L25-L199 HydrophobicContact CG-CB 3.83Å; L25-L199 HydrophobicContact CG-CD1 4.41Å; V28-L199 HydrophobicContact CG2-CD1 4.3Å; L195-L199 HydrophobicContact CD1-CD1 4.15Å; L195-L199 HydrophobicContact CD1-CG 4.18Å; L195-L199 HydrophobicContact CG-CD1 4.03Å; L195-L199 HydrophobicContact CG-CG 4.5Å; L195-L199 WeakPolarHBondContact O-CB 3.06Å; L195-L199 VanDerWaalsContact O-CG 3.28Å; L195-L199 WeakPolarHBondContact O-CG 3.43Å; L195-L199 PolarHBondContact O-N 2.97Å; C196-L199 PolarHBondContact O-N 3.45Å; I197-L199 PolarHBondContact O-N 3.19Å; L199-C202 PolarHBondContact O-N 2.95Å; L199-E203 PolarHBondContact O-N 2.91Å
200	N	89.8	Confident	89.7	Confident	5 Å²	5	43.1 Å²	43.1	3%	0.027	25%	0.248	C	C	.	.	H	α-helix	trans	-65.5	-44.9	174.2	-78.7	-75	0	0	0	111.1	L25 L134 T138 C196 I197 V198 C202 E203 I204	L25-N200 WeakPolarHBondContact CD2-ND2 3.48Å; L134-N200 WeakPolarHBondContact CD2-OD1 3.42Å; T138-N200 WeakPolarHBondContact OG1-CB 3.31Å; C196-N200 WeakPolarHBondContact O-CB 3.46Å; C196-N200 PolarHBondContact O-N 3.09Å; C196-N200 PolarHBondContact O-ND2 2.89Å; I197-N200 PolarHBondContact O-N 3.42Å; V198-N200 PolarHBondContact O-N 2.86Å; N200-C202 VanDerWaalsContact C-N 3.34Å; N200-C202 PolarHBondContact O-N 3.33Å; N200-E203 PolarHBondContact O-N 2.99Å; N200-I204 WeakPolarHBondContact O-CG1 3.45Å; N200-I204 PolarHBondContact O-N 3Å
201	I	91	Very high	89.2	Confident	69 Å²	69	46.7 Å²	46.7	35%	0.354	26%	0.259	S	S	.	.	H	α-helix	trans	-60.3	-43.6	176.4	-70	169.7	0	0	0	110.7	T138 I197 V198 E203 I204 I205	T138-I201 HydrophobicContact CG2-CD1 4.26Å; T138-I201 HydrophobicContact CG2-CG1 3.95Å; I197-I201 HydrophobicContact CG2-CD1 3.66Å; I197-I201 HydrophobicContact CG2-CG1 4.46Å; I197-I201 WeakPolarHBondContact O-CB 3.47Å; I197-I201 VanDerWaalsContact O-CG1 3.31Å; I197-I201 WeakPolarHBondContact O-CG1 3.39Å; I197-I201 PolarHBondContact O-N 2.92Å; V198-I201 PolarHBondContact O-N 3.4Å; I201-E203 PolarHBondContact O-N 3.02Å; I201-I204 PolarHBondContact O-N 3.46Å; I201-I205 HydrophobicContact CG2-CD1 3.76Å; I201-I205 HydrophobicContact CG2-CG1 4.41Å; I201-I205 WeakPolarHBondContact O-CG1 3.31Å; I201-I205 PolarHBondContact O-N 2.92Å
202	C	89.9	Confident	88.9	Confident	72 Å²	72	49 Å²	49	49%	0.486	26%	0.261	S	S	.	.	H	α-helix	trans	-61.2	-39.1	174.7	-69.7	0	0	0	0	112.9	V198 L199 N200 Y206	V198-C202 WeakPolarHBondContact O-CB 3.43Å; V198-C202 PolarHBondContact O-N 3.48Å; V198-C202 PolarHBondContact O-SG 2.92Å; L199-C202 PolarHBondContact O-N 2.95Å; N200-C202 VanDerWaalsContact C-N 3.34Å; N200-C202 PolarHBondContact O-N 3.33Å; C202-Y206 WeakPolarHBondContact O-CB 3.47Å; C202-Y206 PolarHBondContact O-N 3.46Å
203	E	87	Confident	88.6	Confident	4 Å²	4	50.9 Å²	50.9	2%	0.019	28%	0.277	C	S	.	.	H	α-helix	trans	-68.9	-40.2	173.5	-168.5	177.6	-176.1	0	0	111.9	S17 Y130 L134 L199 N200 I201 I205 Y206 L207	S17-E203 WeakPolarHBondContact CB-OE1 3.42Å; S17-E203 PolarHBondContact OG-OE1 2.86Å; Y130-E203 VanDerWaalsContact CE1-OE1 3.24Å; Y130-E203 WeakPolarHBondContact CE1-OE1 3.39Å; Y130-E203 VanDerWaalsContact OH-CD 3.23Å; Y130-E203 PolarHBondContact OH-OE1 3.38Å; Y130-E203 PolarHBondContact OH-OE2 3.45Å; L134-E203 HydrophobicContact CD1-CB 4.1Å; L134-E203 HydrophobicContact CD1-CG 3.98Å; L199-E203 PolarHBondContact O-N 2.91Å; N200-E203 PolarHBondContact O-N 2.99Å; I201-E203 PolarHBondContact O-N 3.02Å; E203-I205 PolarHBondContact O-N 3.42Å; E203-Y206 PolarHBondContact O-N 3.24Å; E203-L207 HydrophobicContact CG-CD1 3.8Å; E203-L207 HydrophobicContact CG-CG 4.05Å; E203-L207 WeakPolarHBondContact O-CB 3.4Å; E203-L207 VanDerWaalsContact O-CG 3.29Å; E203-L207 WeakPolarHBondContact O-CG 3.48Å; E203-L207 PolarHBondContact O-N 3.39Å
204	I	88.5	Confident	88.1	Confident	11 Å²	11	55.6 Å²	55.6	6%	0.056	29%	0.294	C	S	.	.	H	α-helix	trans	-56.2	-52.7	175.1	-69.3	166.2	0	0	0	110	L131 L134 F135 N200 I201 Y206 L207 I208	L131-I204 HydrophobicContact CD1-CG2 4.38Å; L134-I204 HydrophobicContact CB-CD1 3.92Å; L134-I204 HydrophobicContact CB-CG1 3.64Å; L134-I204 HydrophobicContact CD1-CG1 3.79Å; L134-I204 HydrophobicContact CG-CG1 4.39Å; F135-I204 HydrophobicContact CD1-CD1 3.93Å; F135-I204 HydrophobicContact CE1-CD1 4.02Å; F135-I204 HydrophobicContact CE1-CG2 3.95Å; F135-I204 HydrophobicContact CE2-CG2 4.39Å; F135-I204 HydrophobicContact CG-CD1 4.41Å; F135-I204 HydrophobicContact CZ-CG2 3.7Å; N200-I204 WeakPolarHBondContact O-CG1 3.45Å; N200-I204 PolarHBondContact O-N 3Å; I201-I204 PolarHBondContact O-N 3.46Å; I204-Y206 PolarHBondContact O-N 3.38Å; I204-L207 PolarHBondContact O-N 3.04Å; I204-I208 HydrophobicContact CG2-CD1 3.67Å; I204-I208 VanDerWaalsContact O-CG1 3.32Å; I204-I208 WeakPolarHBondContact O-CG1 3.19Å; I204-I208 PolarHBondContact O-N 3.24Å
205	I	88.8	Confident	87.6	Confident	98 Å²	98	57.9 Å²	57.9	50%	0.503	30%	0.299	S	S	.	.	H	α-helix	trans	-58.9	-48.6	178.7	-67.3	167.9	0	0	0	110.5	I201 E203 L207 I208 S209	I201-I205 HydrophobicContact CG2-CD1 3.76Å; I201-I205 HydrophobicContact CG2-CG1 4.41Å; I201-I205 WeakPolarHBondContact O-CG1 3.31Å; I201-I205 PolarHBondContact O-N 2.92Å; E203-I205 PolarHBondContact O-N 3.42Å; I205-L207 VanDerWaalsContact C-N 3.33Å; I205-L207 PolarHBondContact O-N 3.23Å; I205-I208 PolarHBondContact O-N 2.82Å; I205-S209 WeakPolarHBondContact O-CB 3.04Å; I205-S209 PolarHBondContact O-N 2.96Å; I205-S209 PolarHBondContact O-OG 3.47Å
206	Y	86.2	Confident	87.4	Confident	80 Å²	80	58.8 Å²	58.8	31%	0.314	30%	0.303	S	S	.	.	H	α-helix	trans	-57.5	-43.7	178	174.5	-100.2	0	0	0	112.6	T18 C202 E203 I204 K210	T18-Y206 HydrophobicContact CG2-CD1 4.31Å; T18-Y206 HydrophobicContact CG2-CD2 4.33Å; T18-Y206 HydrophobicContact CG2-CE1 3.95Å; T18-Y206 HydrophobicContact CG2-CE2 3.94Å; T18-Y206 HydrophobicContact CG2-CG 4.5Å; C202-Y206 WeakPolarHBondContact O-CB 3.47Å; C202-Y206 PolarHBondContact O-N 3.46Å; E203-Y206 PolarHBondContact O-N 3.24Å; I204-Y206 PolarHBondContact O-N 3.38Å; Y206-K210 HydrophobicContact CE1-CD 3.81Å; Y206-K210 HydrophobicContact CE2-CD 4.48Å; Y206-K210 WeakPolarHBondContact O-CB 3.39Å; Y206-K210 PolarHBondContact O-N 3.13Å; Y206-K210 WeakPolarHBondContact OH-CD 3.31Å; Y206-K210 PolarHBondContact OH-NZ 2.88Å
207	L	84.1	Confident	87.1	Confident	10 Å²	10	63.7 Å²	63.7	5%	0.052	33%	0.33	C	S	.	.	H	α-helix	trans	-71	-34.3	-179.1	-72	174.8	0	0	0	113	Y130 L134 E203 I204 I205 R211	Y130-L207 HydrophobicContact CD1-CD1 3.72Å; Y130-L207 HydrophobicContact CE1-CD1 3.61Å; L134-L207 HydrophobicContact CD1-CD1 3.95Å; E203-L207 HydrophobicContact CG-CD1 3.8Å; E203-L207 HydrophobicContact CG-CG 4.05Å; E203-L207 WeakPolarHBondContact O-CB 3.4Å; E203-L207 VanDerWaalsContact O-CG 3.29Å; E203-L207 WeakPolarHBondContact O-CG 3.48Å; E203-L207 PolarHBondContact O-N 3.39Å; I204-L207 PolarHBondContact O-N 3.04Å; I205-L207 VanDerWaalsContact C-N 3.33Å; I205-L207 PolarHBondContact O-N 3.23Å; L207-R211 WeakPolarHBondContact O-CB 3.31Å; L207-R211 PolarHBondContact O-N 3.18Å
208	I	86.1	Confident	86.6	Confident	64 Å²	64	69 Å²	69	33%	0.328	35%	0.352	S	S	.	.	H	α-helix	trans	-67.9	-54.5	173.7	-70.1	170.5	0	0	0	109.6	I204 I205 K210 R211 I212	I204-I208 HydrophobicContact CG2-CD1 3.67Å; I204-I208 VanDerWaalsContact O-CG1 3.32Å; I204-I208 WeakPolarHBondContact O-CG1 3.19Å; I204-I208 PolarHBondContact O-N 3.24Å; I205-I208 PolarHBondContact O-N 2.82Å; I208-K210 VanDerWaalsContact C-N 3.33Å; I208-K210 PolarHBondContact O-N 2.87Å; I208-R211 CarbonylContact O-C 3.57Å; I208-R211 WeakPolarHBondContact O-CA 3.08Å; I208-R211 WeakPolarHBondContact O-CB 3.49Å; I208-R211 PolarHBondContact O-N 3.44Å; I208-I212 HydrophobicContact CG2-CD1 3.66Å; I208-I212 HydrophobicContact CG2-CG1 4.31Å; I208-I212 WeakPolarHBondContact O-CG1 3.45Å; I208-I212 PolarHBondContact O-N 2.93Å
209	S	86.3	Confident	86	Confident	67 Å²	67	67.9 Å²	67.9	47%	0.469	35%	0.347	S	S	.	.	H	α-helix	trans	-57.8	-43	178.8	-62.9	0	0	0	0	112.2	I205 R211 I212 A213	I205-S209 WeakPolarHBondContact O-CB 3.04Å; I205-S209 PolarHBondContact O-N 2.96Å; I205-S209 PolarHBondContact O-OG 3.47Å; S209-R211 PolarHBondContact O-N 3.06Å; S209-I212 PolarHBondContact O-N 3.36Å; S209-A213 WeakPolarHBondContact O-CB 2.98Å; S209-A213 PolarHBondContact O-N 3.39Å
210	K	83.4	Confident	85.7	Confident	91 Å²	91	73.3 Å²	73.3	40%	0.396	37%	0.37	S	S	.	.	H	α-helix	trans	-68.1	-15.8	174.7	-168.5	172.5	-170.7	175	0	113.5	Y206 I208 R214	Y206-K210 HydrophobicContact CE1-CD 3.81Å; Y206-K210 HydrophobicContact CE2-CD 4.48Å; Y206-K210 WeakPolarHBondContact O-CB 3.39Å; Y206-K210 PolarHBondContact O-N 3.13Å; Y206-K210 WeakPolarHBondContact OH-CD 3.31Å; Y206-K210 PolarHBondContact OH-NZ 2.88Å; I208-K210 VanDerWaalsContact C-N 3.33Å; I208-K210 PolarHBondContact O-N 2.87Å; K210-R214 WeakPolarHBondContact O-CG 3.49Å; K210-R214 PolarHBondContact O-NE 2.62Å
211	R	82.9	Confident	85.1	Confident	99 Å²	99	83 Å²	83	37%	0.374	41%	0.406	S	S	.	.	H	α-helix	trans	-88.5	-43.8	169.6	-173.2	170.1	176.9	149	-1.8	111.3	W127 L207 I208 S209 R214 I215	W127-R211 HydrophobicContact CZ2-CB 4.07Å; W127-R211 HydrophobicContact CZ2-CG 4.34Å; L207-R211 WeakPolarHBondContact O-CB 3.31Å; L207-R211 PolarHBondContact O-N 3.18Å; I208-R211 CarbonylContact O-C 3.57Å; I208-R211 WeakPolarHBondContact O-CA 3.08Å; I208-R211 WeakPolarHBondContact O-CB 3.49Å; I208-R211 PolarHBondContact O-N 3.44Å; S209-R211 PolarHBondContact O-N 3.06Å; R211-R214 PolarHBondContact O-N 3.05Å; R211-I215 HydrophobicContact CG-CD1 4.07Å; R211-I215 WeakPolarHBondContact O-CG1 3.5Å; R211-I215 PolarHBondContact O-N 2.97Å
212	I	86.1	Confident	84.2	Confident	88 Å²	88	87.3 Å²	87.3	45%	0.451	42%	0.418	S	S	.	.	H	α-helix	trans	-57.6	-50.9	176.7	-67.6	171.5	0	0	0	110.6	I208 S209 R214 I215 I216	I208-I212 HydrophobicContact CG2-CD1 3.66Å; I208-I212 HydrophobicContact CG2-CG1 4.31Å; I208-I212 WeakPolarHBondContact O-CG1 3.45Å; I208-I212 PolarHBondContact O-N 2.93Å; S209-I212 PolarHBondContact O-N 3.36Å; I212-R214 VanDerWaalsContact C-N 3.26Å; I212-R214 PolarHBondContact O-N 2.96Å; I212-I215 WeakPolarHBondContact O-CA 3.25Å; I212-I215 WeakPolarHBondContact O-CB 3.34Å; I212-I215 PolarHBondContact O-N 3.09Å; I212-I216 HydrophobicContact CG2-CD1 3.68Å; I212-I216 HydrophobicContact CG2-CG1 4.29Å; I212-I216 WeakPolarHBondContact O-CG1 3.32Å; I212-I216 PolarHBondContact O-N 3.34Å
213	A	86	Confident	83.3	Confident	47 Å²	47	89.5 Å²	89.5	39%	0.388	43%	0.425	S	S	.	.	H	α-helix	trans	-57.8	-35.8	178	0	0	0	0	0	113.2	S209 N217	S209-A213 WeakPolarHBondContact O-CB 2.98Å; S209-A213 PolarHBondContact O-N 3.39Å; A213-N217 WeakPolarHBondContact O-CB 3.08Å; A213-N217 VanDerWaalsContact O-CG 3.23Å; A213-N217 PolarHBondContact O-N 3.27Å
214	R	82.7	Confident	82.1	Confident	100 Å²	100	95 Å²	95	38%	0.377	45%	0.45	S	S	.	.	H	α-helix	trans	-71.1	-31.3	174.7	-77.9	-175.3	-70.7	149.6	-4.9	113.1	H123 K210 R211 I212 K218	H123-R214 PolarHBondContact NE2-NH1 2.81Å; H123-R214 VanDerWaalsContact NE2-NH1 3.11Å; K210-R214 WeakPolarHBondContact O-CG 3.49Å; K210-R214 PolarHBondContact O-NE 2.62Å; R211-R214 PolarHBondContact O-N 3.05Å; I212-R214 VanDerWaalsContact C-N 3.26Å; I212-R214 PolarHBondContact O-N 2.96Å; R214-K218 WeakPolarHBondContact O-CB 3.09Å; R214-K218 PolarHBondContact O-N 3.47Å
215	I	83.4	Confident	80.6	Confident	92 Å²	92	101.3 Å²	101.3	47%	0.472	48%	0.479	S	S	.	.	H	α-helix	trans	-71.3	-49.7	174.5	-67.1	165.1	0	0	0	109.5	R211 I212 N217 K218 C219	R211-I215 HydrophobicContact CG-CD1 4.07Å; R211-I215 WeakPolarHBondContact O-CG1 3.5Å; R211-I215 PolarHBondContact O-N 2.97Å; I212-I215 WeakPolarHBondContact O-CA 3.25Å; I212-I215 WeakPolarHBondContact O-CB 3.34Å; I212-I215 PolarHBondContact O-N 3.09Å; I215-N217 PolarHBondContact O-N 2.84Å; I215-K218 WeakPolarHBondContact O-CA 3.45Å; I215-K218 WeakPolarHBondContact O-CB 3.39Å; I215-K218 PolarHBondContact O-N 2.89Å; I215-C219 PolarHBondContact O-N 3.48Å; I215-C219 PolarHBondContact O-SG 2.75Å
216	I	87.3	Confident	79.1	Confident	99 Å²	99	103.5 Å²	103.5	51%	0.508	49%	0.489	S	S	.	.	H	α-helix	trans	-55.9	-49.3	177.7	-65.8	171.3	0	0	0	110.8	I212 K218 C219 K220	I212-I216 HydrophobicContact CG2-CD1 3.68Å; I212-I216 HydrophobicContact CG2-CG1 4.29Å; I212-I216 WeakPolarHBondContact O-CG1 3.32Å; I212-I216 PolarHBondContact O-N 3.34Å; I216-K218 VanDerWaalsContact C-N 3.25Å; I216-K218 PolarHBondContact O-N 2.69Å; I216-C219 PolarHBondContact O-N 2.8Å; I216-C219 VanDerWaalsContact O-N 3.12Å; I216-K220 PolarHBondContact O-N 2.94Å
217	N	84.8	Confident	77.6	Confident	110 Å²	110	102.1 Å²	102.1	59%	0.588	49%	0.494	S	S	*	.	H	α-helix	trans	-63.8	-28.9	178.4	-71.2	-4.5	0	0	0	113	A213 I215 R221	A213-N217 WeakPolarHBondContact O-CB 3.08Å; A213-N217 VanDerWaalsContact O-CG 3.23Å; A213-N217 PolarHBondContact O-N 3.27Å; I215-N217 PolarHBondContact O-N 2.84Å; N217-R221 PolarHBondContact O-N 3.18Å
218	K	82.3	Confident	76.1	Confident	132 Å²	132	105.8 Å²	105.8	57%	0.574	52%	0.516	S	S	*	.	H	α-helix	trans	-74.1	-37.5	173.6	-170.9	177.2	-179.5	-178.4	0	112	R214 I215 I216 R222	R214-K218 WeakPolarHBondContact O-CB 3.09Å; R214-K218 PolarHBondContact O-N 3.47Å; I215-K218 WeakPolarHBondContact O-CA 3.45Å; I215-K218 WeakPolarHBondContact O-CB 3.39Å; I215-K218 PolarHBondContact O-N 2.89Å; I216-K218 VanDerWaalsContact C-N 3.25Å; I216-K218 PolarHBondContact O-N 2.69Å; K218-R222 PolarHBondContact O-N 2.73Å
219	C	81.2	Confident	74.2	Confident	62 Å²	62	109.3 Å²	109.3	42%	0.419	53%	0.532	S	S	.	.	H	α-helix	trans	-68	-47.2	174	-64.7	0	0	0	0	111.4	I215 I216 R221 R222 N223	I215-C219 PolarHBondContact O-N 3.48Å; I215-C219 PolarHBondContact O-SG 2.75Å; I216-C219 PolarHBondContact O-N 2.8Å; I216-C219 VanDerWaalsContact O-N 3.12Å; C219-R221 VanDerWaalsContact C-N 3.28Å; C219-R221 PolarHBondContact O-N 2.63Å; C219-R222 WeakPolarHBondContact O-CA 3.29Å; C219-R222 WeakPolarHBondContact O-CB 3.15Å; C219-R222 PolarHBondContact O-N 2.04Å; C219-N223 PolarHBondContact O-N 3.1Å; C219-N223 PolarHBondContact O-OD1 3.45Å
220	K	82.6	Confident	72.3	Confident	140 Å²	140	112.6 Å²	112.6	61%	0.609	54%	0.539	S	S	*	.	H	α-helix	trans	-57.7	-39.2	176.7	-170	171.4	-178.3	175.9	0	112.3	I216 H224	I216-K220 PolarHBondContact O-N 2.94Å; K220-H224 PolarHBondContact O-CD2 3.16Å; K220-H224 PolarHBondContact O-N 3.09Å
221	R	76	Confident	70.7	Confident	207 Å²	207	113.8 Å²	113.8	78%	0.781	55%	0.55	S	S	*	*	H	α-helix	trans	-64.5	-34.6	172.3	-98.2	-174	160.2	-166.6	-7.5	114	N217 C219 H225	N217-R221 PolarHBondContact O-N 3.18Å; C219-R221 VanDerWaalsContact C-N 3.28Å; C219-R221 PolarHBondContact O-N 2.63Å; R221-H225 PolarHBondContact O-N 3.26Å
222	R	72.1	Confident	69	Low	161 Å²	161	115 Å²	115	61%	0.608	56%	0.564	S	S	*	*	H	α-helix	trans	-69.5	-44.5	175.6	-80.5	177.1	161.6	-176.9	-11	111.8	K218 C219 H224 H225 M226	K218-R222 PolarHBondContact O-N 2.73Å; C219-R222 WeakPolarHBondContact O-CA 3.29Å; C219-R222 WeakPolarHBondContact O-CB 3.15Å; C219-R222 PolarHBondContact O-N 2.04Å; R222-H224 VanDerWaalsContact C-N 3.34Å; R222-H224 PolarHBondContact O-N 2.92Å; R222-H225 PolarHBondContact O-N 2.89Å; R222-M226 PolarHBondContact O-N 3.39Å; R222-M226 VanDerWaalsContact O-N 3.08Å
223	N	70.8	Confident	67	Low	118 Å²	118	120.8 Å²	120.8	63%	0.631	58%	0.582	S	S	*	*	H	α-helix	trans	-60.9	-42.1	178.2	-71.3	39.3	0	0	0	111.8	C219 H225 M226 A227	C219-N223 PolarHBondContact O-N 3.1Å; C219-N223 PolarHBondContact O-OD1 3.45Å; N223-H225 VanDerWaalsContact C-N 3.3Å; N223-H225 PolarHBondContact O-N 2.03Å; N223-M226 PolarHBondContact O-N 2.87Å; N223-A227 PolarHBondContact O-N 2.96Å
224	H	61.6	Low	64.6	Low	120 Å²	120	125.1 Å²	125.1	56%	0.556	60%	0.598	S	S	*	*	H	α-helix	trans	-59.5	-39.3	172.7	-88.1	-72.6	0	0	0	113	K220 R222 M226 A227 V228	K220-H224 PolarHBondContact O-CD2 3.16Å; K220-H224 PolarHBondContact O-N 3.09Å; R222-H224 VanDerWaalsContact C-N 3.34Å; R222-H224 PolarHBondContact O-N 2.92Å; H224-M226 VanDerWaalsContact C-N 3.34Å; H224-M226 PolarHBondContact O-N 3.08Å; H224-A227 PolarHBondContact O-N 2.03Å; H224-V228 WeakPolarHBondContact O-CG2 3.34Å; H224-V228 PolarHBondContact O-N 3.48Å
225	H	58.7	Low	62.5	Low	142 Å²	142	127 Å²	127	66%	0.657	62%	0.616	S	S	*	*	H	α-helix	trans	-70.8	-28.7	-179.1	-132.8	-63.8	0	0	0	113.4	R221 R222 N223	R221-H225 PolarHBondContact O-N 3.26Å; R222-H225 PolarHBondContact O-N 2.89Å; N223-H225 VanDerWaalsContact C-N 3.3Å; N223-H225 PolarHBondContact O-N 2.03Å
226	M	55.9	Low	60.5	Low	144 Å²	144	129.8 Å²	129.8	71%	0.709	63%	0.632	S	S	*	*	H	α-helix	trans	-85.9	-23.1	175.5	-63.3	-171.7	103.3	0	0	113	R222 N223 H224 H230	R222-M226 PolarHBondContact O-N 3.39Å; R222-M226 VanDerWaalsContact O-N 3.08Å; N223-M226 PolarHBondContact O-N 2.87Å; H224-M226 VanDerWaalsContact C-N 3.34Å; H224-M226 PolarHBondContact O-N 3.08Å; M226-H230 PolarHBondContact O-N 3.16Å
227	A	56.1	Low	58.3	Low	52 Å²	52	132.6 Å²	132.6	43%	0.43	65%	0.648	S	S	.	*	H	α-helix	trans	-65	-54.4	170.2	0	0	0	0	0	111	N223 H224 Q229 H230 D231	N223-A227 PolarHBondContact O-N 2.96Å; H224-A227 PolarHBondContact O-N 2.03Å; A227-Q229 VanDerWaalsContact C-N 3.27Å; A227-Q229 PolarHBondContact O-N 3.17Å; A227-H230 WeakPolarHBondContact O-CB 3.46Å; A227-H230 PolarHBondContact O-N 3.31Å; A227-D231 PolarHBondContact O-N 3.21Å
228	V	52.5	Low	55.7	Low	86 Å²	86	135.3 Å²	135.3	52%	0.521	66%	0.655	S	S	.	*	H	α-helix	trans	-56.5	-40.7	179.7	175.2	0	0	0	0	112	H224 H230 D231 D232	H224-V228 WeakPolarHBondContact O-CG2 3.34Å; H224-V228 PolarHBondContact O-N 3.48Å; V228-H230 PolarHBondContact O-N 3.18Å; V228-D231 PolarHBondContact O-N 3.07Å; V228-D232 PolarHBondContact O-N 3.37Å
229	Q	44.9	Very low	53.3	Low	139 Å²	139	137.5 Å²	137.5	65%	0.65	67%	0.666	S	S	*	*	H	α-helix	trans	-70.7	-10.1	179.7	-164.9	170.2	0.8	0	0	113.9	A227	A227-Q229 VanDerWaalsContact C-N 3.27Å; A227-Q229 PolarHBondContact O-N 3.17Å
230	H	48	Very low	50.9	Low	135 Å²	135	140.5 Å²	140.5	63%	0.625	68%	0.678	S	S	*	*	H	α-helix	trans	-91.8	-25.9	172.8	-161.3	-49.7	0	0	0	112.3	M226 A227 V228	M226-H230 PolarHBondContact O-N 3.16Å; A227-H230 WeakPolarHBondContact O-CB 3.46Å; A227-H230 PolarHBondContact O-N 3.31Å; V228-H230 PolarHBondContact O-N 3.18Å
231	D	48.3	Very low	48.5	Very low	117 Å²	117	142.9 Å²	142.9	63%	0.626	69%	0.685	S	S	*	*	H	α-helix	trans	-73.2	-44.1	175.7	-64.7	-43.7	0	0	0	110.9	A227 V228 Y233 N234	A227-D231 PolarHBondContact O-N 3.21Å; V228-D231 PolarHBondContact O-N 3.07Å; D231-Y233 VanDerWaalsContact C-N 3.27Å; D231-Y233 PolarHBondContact O-N 3.39Å; D231-N234 PolarHBondContact O-N 3.15Å
232	D	48.7	Very low	46.3	Very low	123 Å²	123	140.8 Å²	140.8	66%	0.658	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-60.7	-29.3	179.9	-79.6	-31.7	0	0	0	113.8	V228 N234	V228-D232 PolarHBondContact O-N 3.37Å; D232-N234 VanDerWaalsContact C-N 3.32Å; D232-N234 PolarHBondContact O-N 3.16Å
233	Y	42.5	Very low	44.4	Very low	211 Å²	211	139.5 Å²	139.5	83%	0.827	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-83	-7.9	-178.3	-154.2	-97.6	0	0	0	113.7	D231	D231-Y233 VanDerWaalsContact C-N 3.27Å; D231-Y233 PolarHBondContact O-N 3.39Å
234	N	36.5	Very low	42.3	Very low	138 Å²	138	138.3 Å²	138.3	74%	0.738	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-109.6	8	-168.8	-140.6	31.6	0	0	0	113.7	D231 D232	D231-N234 PolarHBondContact O-N 3.15Å; D232-N234 VanDerWaalsContact C-N 3.32Å; D232-N234 PolarHBondContact O-N 3.16Å
235	N	39.2	Very low	40.9	Very low	139 Å²	139	140.3 Å²	140.3	74%	0.743	72%	0.72	S	S	*	*	S	Bend	trans	-114.2	-10.3	-174	-162.1	51.5	0	0	0	114.5	N237	N235-N237 VanDerWaalsContact C-N 3.32Å; N235-N237 PolarHBondContact O-N 2.87Å
236	D	40.9	Very low	39.8	Very low	151 Å²	151	138.9 Å²	138.9	81%	0.807	72%	0.723	S	S	*	*	S	Bend	trans	-92.2	48.6	178.6	-87	-18.7	0	0	0	112.6
237	N	41	Very low	38.5	Very low	158 Å²	158	140.6 Å²	140.6	85%	0.845	73%	0.726	S	S	*	*			trans	-151.6	140.6	167.3	-119	-48.2	0	0	0	113.5	N235	N235-N237 VanDerWaalsContact C-N 3.32Å; N235-N237 PolarHBondContact O-N 2.87Å
238	F	30.8	Very low	37	Very low	167 Å²	167	147.9 Å²	147.9	73%	0.732	74%	0.743	S	S	*	*			trans	77.4	85.1	171.4	-149.9	-89.7	0	0	0	118.7
239	H	31.4	Very low	35.8	Very low	177 Å²	177	149.9 Å²	149.9	82%	0.819	75%	0.75	S	S	*	*				-154	151.7	112.8	-110	-73.2	0	0	0	110.8
240	N	30.8	Very low	35.1	Very low	125 Å²	125	150.8 Å²	150.8	67%	0.668	76%	0.757	S	S	*	*			trans	-140.7	140.9	-160.4	-154.2	14.9	0	0	0	112.7
241	Y	32.3	Very low	34.2	Very low	191 Å²	191	151 Å²	151	75%	0.749	76%	0.762	S	S	*	*			trans	35.5	131.9	171.2	-69.3	-71.2	0	0	0	121.7
242	N	29.9	Very low	33.3	Very low	162 Å²	162	151.6 Å²	151.6	87%	0.866	77%	0.765	S	S	*	*				-159.8	152.7	110.1	-103.6	-44.1	0	0	0	115.6
243	V	31.9	Very low	32.3	Very low	134 Å²	134	154 Å²	154	81%	0.812	77%	0.77	S	S	*	*			trans	-60.5	140.1	-166.2	174.7	0	0	0	0	117.4
244	A	26.7	Very low	32.1	Very low	94 Å²	94	149.3 Å²	149.3	78%	0.777	77%	0.765	S	S	*	*			trans	-166.4	140.9	137.8	0	0	0	0	0	114.2
245	L	32.2	Very low	32	Very low	162 Å²	162	151 Å²	151	85%	0.848	77%	0.768	S	S	*	*			trans	-140.7	152	160.4	-128.2	91.9	0	0	0	105.7
246	P	35	Very low	31.8	Very low	111 Å²	111	150.2 Å²	150.2	72%	0.721	77%	0.771	S	S	*	*				-158.7	160.2	60.1	43	-21.8	0	0	0	120.1
247	K	28.1	Very low	31.5	Very low	181 Å²	181	152.2 Å²	152.2	79%	0.787	77%	0.773	S	S	*	*			trans	72.6	137.1	140.6	-108.5	-179.2	-178.9	178.7	0	123.8
248	R	25.9	Very low	31	Very low	205 Å²	205	152.9 Å²	152.9	77%	0.774	78%	0.775	S	S	*	*			trans	78.1	145.1	155	-62.8	-166.3	-93	-171.4	-5.3	118.3
249	D	26.1	Very low	31	Very low	128 Å²	128	156.1 Å²	156.1	68%	0.684	78%	0.782	S	S	*	*			cis	-161.3	145.2	-16.3	-99	-24	0	0	0	110
250	M	31.1	Very low	31.2	Very low	158 Å²	158	152.2 Å²	152.2	78%	0.778	78%	0.78	S	S	*	*			trans	54.3	150.7	156.7	-58.2	-166.1	81.1	0	0	121.8
251	D	28.7	Very low	31.3	Very low	138 Å²	138	152 Å²	152	74%	0.738	79%	0.788	S	S	*	*			cis	179.1	175.6	-30.3	-97.8	-24.5	0	0	0	107.5
252	D	28.6	Very low	31.4	Very low	131 Å²	131	147.2 Å²	147.2	70%	0.701	79%	0.788	S	S	*	*			cis	-139.5	-85.6	-1.8	171.6	39.1	0	0	0	111.2
253	K	28.9	Very low	32.1	Very low	172 Å²	172	144.8 Å²	144.8	75%	0.748	78%	0.782	S	S	*	*			trans	-169.6	-168.5	-159.9	-107.1	160.5	-170.2	160.7	0	110.5
254	P	37.5	Very low	32.2	Very low	113 Å²	113	145.5 Å²	145.5	73%	0.734	78%	0.781	S	S	*	*			cis	-129.9	170.2	6.6	42.3	-26.7	0	0	0	117.5
255	H	34.4	Very low	32.9	Very low	173 Å²	173	148.3 Å²	148.3	80%	0.801	78%	0.782	S	S	*	*			trans	-72.7	157	156.4	-77.4	-84	0	0	0	112
256	P	34.6	Very low	33.2	Very low	124 Å²	124	147 Å²	147	81%	0.805	78%	0.781	S	S	*	*			trans	-96.1	141.3	139.2	-10	28.4	0	0	0	111.9
257	K	34.7	Very low	33.2	Very low	192 Å²	192	149.5 Å²	149.5	84%	0.835	79%	0.787	S	S	*	*			trans	-105.4	159.1	158	-64	176.2	179.8	175.7	0	108.2
258	I	31.4	Very low	33.8	Very low	173 Å²	173	150.4 Å²	150.4	89%	0.887	82%	0.816	S	S	*	*			trans	169.3	154	143.5	-93.6	151.1	0	0	0	108.1
259	R	31	Very low	34.2	Very low	235 Å²	235	147.7 Å²	147.7	89%	0.887	82%	0.819	S	S	*	*			cis	-168	143.2	-48.2	-179	173	177.6	170	-0.7	104.4
260	A	35.1	Very low	34.6	Very low	95 Å²	95	148.7 Å²	148.7	79%	0.785	83%	0.826	S	S	*	*			trans	-72	159.9	-177.6	0	0	0	0	0	113.6
261	S	32.6	Very low	34.8	Very low	119 Å²	119	148.2 Å²	148.2	83%	0.832	83%	0.828	S	S	*	*			trans	-153.7	138.9	153	-158.6	0	0	0	0	112.5
262	A	35.3	Very low	35.2	Very low	91 Å²	91	148.8 Å²	148.8	75%	0.752	83%	0.834	S	S	*	*			trans	-140.2	143.6	157.5	0	0	0	0	0	105.8
263	P	44.4	Very low	35.6	Very low	112 Å²	112	149.9 Å²	149.9	73%	0.727	84%	0.842	S	S	*	*				-144.3	-165.8	106.8	40.6	-22.8	0	0	0	110.4
264	N	33.9	Very low	36	Very low	148 Å²	148	148.5 Å²	148.5	79%	0.791	85%	0.848	S	S	*	*			cis	-157.9	166.2	20.3	-143.2	-3.5	0	0	0	113.2
265	L	40.5	Very low	35.9	Very low	154 Å²	154	151 Å²	151	81%	0.806	86%	0.856	S	S	*	*			trans	-104.7	148.2	164.1	-89.8	110.2	0	0	0	110.5
266	T	39.2	Very low	36.1	Very low	135 Å²	135	149.3 Å²	149.3	83%	0.828	86%	0.861	S	S	*	*			trans	-147.9	143.1	157.2	39.3	0	0	0	0	110.6
267	L	35.2	Very low	36.2	Very low	163 Å²	163	151.4 Å²	151.4	85%	0.853	87%	0.865	S	S	*	*			trans	-74.8	149.3	169.9	-87.7	68.7	0	0	0	111.7
268	S	40.8	Very low	36.3	Very low	200 Å²	200	147.7 Å²	147.7	100%	1.399	87%	0.868	S	S	*	*				-158.2	0	129.1	-72.6	0	0	0	0	108.6

Retrieved 268 of 268 residues in 65.3 ms (Link to these results)

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