A0A077YX06_TRITR Loading...

Kelch 1 and BACK and BTB domain containing protei n

AlphaFold DB , UniProt , Accession A0A077YX06, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 413 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	39.9	Very low	46.5	Very low	250 Å²	250	152.5 Å²	152.5	100%	1.232	82%	0.822	S	S	*	*				0	90.1	0	-66.8	177.9	-169.8	0	0	107.4
2	A	40.1	Very low	47.5	Very low	78 Å²	78	152.2 Å²	152.2	65%	0.645	82%	0.82	S	S	*	*			trans	-108.2	116.7	177.6	0	0	0	0	0	107.9	H4	A2-H4 PolarHBondContact O-N 3.25Å
3	N	39.4	Very low	48.9	Very low	155 Å²	155	159.8 Å²	159.8	83%	0.829	83%	0.833	S	S	*	*			trans	-74.6	107.6	177.5	-84.3	-17.6	0	0	0	109.5
4	H	51.3	Low	51	Low	168 Å²	168	161.6 Å²	161.6	78%	0.778	84%	0.835	S	S	*	*			trans	-83.9	112.4	166.6	-68.6	-64.8	0	0	0	109.2	A2	A2-H4 PolarHBondContact O-N 3.25Å
5	H	45.9	Very low	52.9	Low	185 Å²	185	164.8 Å²	164.8	86%	0.856	83%	0.832	S	S	*	*			trans	-92.6	109.7	163.1	-86.9	35.5	0	0	0	108.4
6	C	47.5	Very low	55	Low	105 Å²	105	165.1 Å²	165.1	71%	0.709	83%	0.83	S	S	*	*			trans	-102.1	120.8	173.1	-165.6	0	0	0	0	108.6
7	R	46.2	Very low	57	Low	252 Å²	252	164.7 Å²	164.7	95%	0.951	82%	0.817	S	S	*	*			trans	-96.3	110.7	162	-78.7	-175.6	176.4	-177.3	-0.5	106.8
8	I	49.5	Very low	58.7	Low	148 Å²	148	160.4 Å²	160.4	76%	0.759	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-92.8	122.1	176.7	-58.6	173.1	0	0	0	108.2
9	A	51	Low	60.3	Low	89 Å²	89	153.8 Å²	153.8	74%	0.736	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-99.2	143.7	158.9	0	0	0	0	0	108.5
10	P	46.8	Very low	61.7	Low	115 Å²	115	153.8 Å²	153.8	75%	0.747	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-90.4	150.2	-176.7	35.1	-29.9	0	0	0	111.6
11	V	54.3	Low	62.9	Low	133 Å²	133	148.9 Å²	148.9	81%	0.806	76%	0.764	S	S	*	*	S	Bend	trans	88.9	71.9	168	-157	0	0	0	0	116.4
12	D	57.6	Low	65.4	Low	148 Å²	148	143.4 Å²	143.4	79%	0.791	74%	0.736	S	S	*	*			trans	-179	122.6	138.4	-88.6	-28.7	0	0	0	107.8	E14	D12-E14 PolarHBondContact O-N 3.36Å
13	Y	66	Low	67.7	Low	252 Å²	252	149.3 Å²	149.3	99%	0.988	74%	0.741	S	S	*	*			trans	-81.6	56.5	-173.3	-75.4	-86.4	0	0	0	112.6
14	E	78.2	Confident	70.1	Confident	185 Å²	185	147.4 Å²	147.4	86%	0.864	73%	0.727	S	S	*	*			trans	-105.9	128.5	169.2	-64.4	-170.3	166	0	0	109.8	D12	D12-E14 PolarHBondContact O-N 3.36Å
15	W	80.1	Confident	71.9	Confident	209 Å²	209	141.4 Å²	141.4	79%	0.792	71%	0.711	S	S	*	*			trans	-119	111.5	175.5	179.6	72.4	0	0	0	109.6	Y17	W15-Y17 VanDerWaalsContact CH2-CB 3.49Å; W15-Y17 AromaticContact CH2-CD2 3.39Å; W15-Y17 HydrophobicContact CH2-CD2 3.39Å; W15-Y17 HydrophobicContact CH2-CE2 4.4Å; W15-Y17 AromaticContact CH2-CG 3.7Å; W15-Y17 HydrophobicContact CH2-CG 3.7Å; W15-Y17 AromaticContact CZ2-CD2 3.75Å; W15-Y17 HydrophobicContact CZ2-CD2 3.75Å; W15-Y17 HydrophobicContact CZ2-CG 4.33Å; W15-Y17 HydrophobicContact CZ3-CD2 4.29Å; W15-Y17 HydrophobicContact CZ3-CG 4.16Å
16	E	86	Confident	74.2	Confident	170 Å²	170	134 Å²	134	79%	0.794	68%	0.682	S	S	*	*			trans	-87.9	115.3	173.2	-171.1	-179.8	-172.7	0	0	110	V18	E16-V18 HydrophobicContact CG-CG2 4.39Å
17	Y	89.1	Confident	76.3	Confident	158 Å²	158	132.2 Å²	132.2	62%	0.62	66%	0.662	S	S	*	*			trans	-86	122.2	171.2	179.4	-117.5	0	0	0	111.2	W15 A19	W15-Y17 VanDerWaalsContact CH2-CB 3.49Å; W15-Y17 AromaticContact CH2-CD2 3.39Å; W15-Y17 HydrophobicContact CH2-CD2 3.39Å; W15-Y17 HydrophobicContact CH2-CE2 4.4Å; W15-Y17 AromaticContact CH2-CG 3.7Å; W15-Y17 HydrophobicContact CH2-CG 3.7Å; W15-Y17 AromaticContact CZ2-CD2 3.75Å; W15-Y17 HydrophobicContact CZ2-CD2 3.75Å; W15-Y17 HydrophobicContact CZ2-CG 4.33Å; W15-Y17 HydrophobicContact CZ3-CD2 4.29Å; W15-Y17 HydrophobicContact CZ3-CG 4.16Å; Y17-A19 HydrophobicContact CD1-CB 4.43Å; Y17-A19 HydrophobicContact CE1-CB 3.62Å
18	V	87.9	Confident	78.6	Confident	87 Å²	87	123.7 Å²	123.7	53%	0.527	64%	0.638	S	S	.	*			trans	-110.4	105.1	171.4	-175.5	0	0	0	0	109.4	E16 N20	E16-V18 HydrophobicContact CG-CG2 4.39Å; V18-N20 PolarHBondContact O-N 3.17Å; V18-N20 VanDerWaalsContact O-N 3.07Å
19	A	88.8	Confident	80.7	Confident	35 Å²	35	118.6 Å²	118.6	29%	0.289	62%	0.618	S	S	.	*			trans	-68.3	102.6	174.9	0	0	0	0	0	111	Y17 G21 H22	Y17-A19 HydrophobicContact CD1-CB 4.43Å; Y17-A19 HydrophobicContact CE1-CB 3.62Å; A19-G21 PolarHBondContact O-N 3.37Å; A19-H22 HydrophobicContact CB-CB 3.71Å; A19-H22 PolarHBondContact O-N 2.96Å
20	N	87.7	Confident	82.8	Confident	154 Å²	154	118 Å²	118	82%	0.824	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.6	121.8	174.5	-71.4	-36.2	0	0	0	110.2	V18	V18-N20 PolarHBondContact O-N 3.17Å; V18-N20 VanDerWaalsContact O-N 3.07Å
21	G	88.6	Confident	85	Confident	50 Å²	50	114.7 Å²	114.7	52%	0.515	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	87.5	-6.1	178.2	0	0	0	0	0	115.8	A19 R23 Q24 G25	A19-G21 PolarHBondContact O-N 3.37Å; G21-R23 VanDerWaalsContact C-N 3.27Å; G21-R23 PolarHBondContact O-N 2.85Å; G21-Q24 PolarHBondContact O-N 2.62Å; G21-Q24 VanDerWaalsContact O-N 3.08Å; G21-G25 PolarHBondContact O-N 3.39Å
22	H	90.6	Very high	86.9	Confident	136 Å²	136	113 Å²	113	63%	0.63	56%	0.556	S	S	*	*	H	α-helix	trans	-54.7	-43.7	177.5	177.3	-92.7	0	0	0	112.3	A19 G25 A26	A19-H22 HydrophobicContact CB-CB 3.71Å; A19-H22 PolarHBondContact O-N 2.96Å; H22-G25 PolarHBondContact O-N 3.15Å; H22-A26 WeakPolarHBondContact O-CB 3.13Å; H22-A26 PolarHBondContact O-N 2.71Å
23	R	88.5	Confident	88.7	Confident	202 Å²	202	108.3 Å²	108.3	76%	0.762	53%	0.531	S	S	*	.	H	α-helix	trans	-61.1	-47.3	176.4	-57.8	179.3	-169.7	174.7	2.5	111.4	G21 A26 F27	G21-R23 VanDerWaalsContact C-N 3.27Å; G21-R23 PolarHBondContact O-N 2.85Å; R23-A26 PolarHBondContact O-N 3.14Å; R23-F27 WeakPolarHBondContact O-CD2 3.35Å; R23-F27 PolarHBondContact O-N 3.1Å
24	Q	89.9	Confident	90.1	Very high	114 Å²	114	97.9 Å²	97.9	53%	0.533	49%	0.49	S	S	.	.	H	α-helix	trans	-63.9	-42.9	178.8	-173.4	62	43.2	0	0	111.6	G21 A26 F27 V28	G21-Q24 PolarHBondContact O-N 2.62Å; G21-Q24 VanDerWaalsContact O-N 3.08Å; Q24-A26 VanDerWaalsContact C-N 3.35Å; Q24-A26 PolarHBondContact O-N 3.27Å; Q24-F27 PolarHBondContact O-N 2.69Å; Q24-V28 WeakPolarHBondContact O-CG2 3.33Å; Q24-V28 PolarHBondContact O-N 3.33Å; Q24-V28 VanDerWaalsContact O-N 3.09Å
25	G	90.5	Very high	90.8	Very high	42 Å²	42	97.2 Å²	97.2	43%	0.433	48%	0.48	S	S	.	.	H	α-helix	trans	-62.1	-40.2	177.3	0	0	0	0	0	112.7	G21 H22 F27 V28 A29	G21-G25 PolarHBondContact O-N 3.39Å; H22-G25 PolarHBondContact O-N 3.15Å; G25-F27 PolarHBondContact O-N 2.9Å; G25-V28 PolarHBondContact O-N 3.02Å; G25-A29 PolarHBondContact O-N 2.61Å
26	A	92.7	Very high	91.4	Very high	30 Å²	30	91.7 Å²	91.7	25%	0.248	47%	0.466	C	S	.	.	H	α-helix	trans	-61.2	-44.1	175.5	0	0	0	0	0	112.3	H22 R23 Q24 V28 A29 F30	H22-A26 WeakPolarHBondContact O-CB 3.13Å; H22-A26 PolarHBondContact O-N 2.71Å; R23-A26 PolarHBondContact O-N 3.14Å; Q24-A26 VanDerWaalsContact C-N 3.35Å; Q24-A26 PolarHBondContact O-N 3.27Å; A26-V28 PolarHBondContact O-N 3.4Å; A26-A29 PolarHBondContact O-N 3.07Å; A26-F30 HydrophobicContact CB-CE2 4.15Å; A26-F30 HydrophobicContact CB-CZ 4.36Å; A26-F30 VanDerWaalsContact O-CD2 3.27Å; A26-F30 WeakPolarHBondContact O-CD2 3.38Å; A26-F30 WeakPolarHBondContact O-CG 3.4Å; A26-F30 PolarHBondContact O-N 2.88Å
27	F	93.2	Very high	91.7	Very high	68 Å²	68	85.8 Å²	85.8	30%	0.298	45%	0.45	S	S	.	.	H	α-helix	trans	-66.5	-34.9	177	-87.7	-86.1	0	0	0	113.2	R23 Q24 G25 F30 Q31 V57 T61	R23-F27 WeakPolarHBondContact O-CD2 3.35Å; R23-F27 PolarHBondContact O-N 3.1Å; Q24-F27 PolarHBondContact O-N 2.69Å; G25-F27 PolarHBondContact O-N 2.9Å; F27-F30 HydrophobicContact CD1-CD2 4.45Å; F27-F30 HydrophobicContact CG-CD2 4.48Å; F27-F30 PolarHBondContact O-N 2.78Å; F27-Q31 PolarHBondContact O-N 3.47Å; F27-V57 HydrophobicContact CE1-CG1 4.15Å; F27-T61 HydrophobicContact CE1-CG2 4.34Å; F27-T61 HydrophobicContact CZ-CG2 4.44Å
28	V	93	Very high	92	Very high	72 Å²	72	82.7 Å²	82.7	44%	0.436	44%	0.444	S	S	.	.	H	α-helix	trans	-61	-47.1	171.2	174	0	0	0	0	110.4	Q24 G25 A26 F30 Q31 E32	Q24-V28 WeakPolarHBondContact O-CG2 3.33Å; Q24-V28 PolarHBondContact O-N 3.33Å; Q24-V28 VanDerWaalsContact O-N 3.09Å; G25-V28 PolarHBondContact O-N 3.02Å; A26-V28 PolarHBondContact O-N 3.4Å; V28-F30 PolarHBondContact O-N 2.7Å; V28-Q31 WeakPolarHBondContact O-CB 3.22Å; V28-Q31 PolarHBondContact O-N 3.47Å; V28-E32 PolarHBondContact O-N 2.91Å; V28-E32 VanDerWaalsContact O-N 3.12Å
29	A	94	Very high	92.2	Very high	41 Å²	41	85.1 Å²	85.1	34%	0.339	45%	0.453	S	S	.	.	H	α-helix	trans	-63.6	-39.9	176.7	0	0	0	0	0	112.6	G25 A26 Q31 E32 L33	G25-A29 PolarHBondContact O-N 2.61Å; A26-A29 PolarHBondContact O-N 3.07Å; A29-Q31 VanDerWaalsContact C-N 3.29Å; A29-Q31 PolarHBondContact O-N 2.79Å; A29-E32 PolarHBondContact O-N 2.84Å; A29-L33 WeakPolarHBondContact O-CG 3.31Å; A29-L33 PolarHBondContact O-N 3.34Å
30	F	94.7	Very high	92.5	Very high	78 Å²	78	85.1 Å²	85.1	34%	0.342	45%	0.451	S	S	.	.	H	α-helix	trans	-63	-35.8	175.6	-63.3	-32.1	0	0	0	112.6	A26 F27 V28 L33 R34 V57 Y99	A26-F30 HydrophobicContact CB-CE2 4.15Å; A26-F30 HydrophobicContact CB-CZ 4.36Å; A26-F30 VanDerWaalsContact O-CD2 3.27Å; A26-F30 WeakPolarHBondContact O-CD2 3.38Å; A26-F30 WeakPolarHBondContact O-CG 3.4Å; A26-F30 PolarHBondContact O-N 2.88Å; F27-F30 HydrophobicContact CD1-CD2 4.45Å; F27-F30 HydrophobicContact CG-CD2 4.48Å; F27-F30 PolarHBondContact O-N 2.78Å; V28-F30 PolarHBondContact O-N 2.7Å; F30-L33 HydrophobicContact CD1-CD1 4.34Å; F30-R34 WeakPolarHBondContact O-CB 3.32Å; F30-R34 PolarHBondContact O-N 3.24Å; F30-V57 HydrophobicContact CB-CG2 4.45Å; F30-V57 HydrophobicContact CD2-CG2 4.21Å; F30-V57 HydrophobicContact CG-CG2 4.35Å; F30-Y99 HydrophobicContact CB-CD1 3.95Å; F30-Y99 HydrophobicContact CB-CE1 3.92Å; F30-Y99 WeakPolarHBondContact O-CE1 3.47Å
31	Q	93.4	Very high	92.8	Very high	45 Å²	45	81.3 Å²	81.3	21%	0.21	43%	0.431	C	S	.	.	H	α-helix	trans	-67.6	-39	175.6	178.2	56.9	7.1	0	0	111.7	F27 V28 A29 R34 R35 Y99 T100	F27-Q31 PolarHBondContact O-N 3.47Å; V28-Q31 WeakPolarHBondContact O-CB 3.22Å; V28-Q31 PolarHBondContact O-N 3.47Å; A29-Q31 VanDerWaalsContact C-N 3.29Å; A29-Q31 PolarHBondContact O-N 2.79Å; Q31-R34 PolarHBondContact O-N 2.93Å; Q31-R34 VanDerWaalsContact OE1-NE 3.09Å; Q31-R35 WeakPolarHBondContact O-CB 3.33Å; Q31-R35 PolarHBondContact O-N 3.13Å; Q31-Y99 HydrophobicContact CB-CD1 4.26Å; Q31-T100 HydrophobicContact CG-CG2 4.15Å
32	E	94.2	Very high	93	Very high	96 Å²	96	79.1 Å²	79.1	45%	0.449	41%	0.407	S	S	.	.	H	α-helix	trans	-63.9	-48.3	174.4	-69.7	175.3	166.8	0	0	111.3	V28 A29 R34 R35 D36	V28-E32 PolarHBondContact O-N 2.91Å; V28-E32 VanDerWaalsContact O-N 3.12Å; A29-E32 PolarHBondContact O-N 2.84Å; E32-R34 VanDerWaalsContact C-N 3.29Å; E32-R34 PolarHBondContact O-N 2.7Å; E32-R35 WeakPolarHBondContact O-CB 3.47Å; E32-R35 PolarHBondContact O-N 3.2Å; E32-R35 VanDerWaalsContact O-N 3.15Å; E32-D36 PolarHBondContact O-N 3.41Å
33	L	95.4	Very high	93.2	Very high	50 Å²	50	73.9 Å²	73.9	26%	0.262	39%	0.385	S	S	.	.	H	α-helix	trans	-56.2	-43.5	175.4	-71.3	171.2	0	0	0	111.8	A29 F30 D36 G37 L38 L39	A29-L33 WeakPolarHBondContact O-CG 3.31Å; A29-L33 PolarHBondContact O-N 3.34Å; F30-L33 HydrophobicContact CD1-CD1 4.34Å; L33-D36 CarbonylContact O-C 3.59Å; L33-D36 PolarHBondContact O-N 3.47Å; L33-G37 PolarHBondContact O-N 2.81Å; L33-G37 VanDerWaalsContact O-N 3.07Å; L33-L38 HydrophobicContact CD2-CB 3.91Å; L33-L38 HydrophobicContact CD2-CD1 4.06Å; L33-L38 PolarHBondContact O-N 3.37Å; L33-L39 HydrophobicContact CD1-CD1 4.4Å
34	R	95	Very high	93.5	Very high	33 Å²	33	64.3 Å²	64.3	13%	0.125	35%	0.349	C	S	.	.	H	α-helix	trans	-64.6	-44.2	177.7	-173.3	-175.9	65.4	93.9	-6.1	111.9	F30 Q31 E32 D36 G37 S52 N96 Y99	F30-R34 WeakPolarHBondContact O-CB 3.32Å; F30-R34 PolarHBondContact O-N 3.24Å; Q31-R34 PolarHBondContact O-N 2.93Å; Q31-R34 VanDerWaalsContact OE1-NE 3.09Å; E32-R34 VanDerWaalsContact C-N 3.29Å; E32-R34 PolarHBondContact O-N 2.7Å; R34-D36 PolarHBondContact O-N 3.3Å; R34-G37 PolarHBondContact O-N 2.98Å; R34-G37 VanDerWaalsContact O-N 3.09Å; R34-S52 WeakPolarHBondContact CG-O 3.37Å; R34-N96 PolarHBondContact NH2-OD1 3.08Å; R34-Y99 HydrophobicContact CB-CE1 4.03Å; R34-Y99 VanDerWaalsContact CD-CE2 3.48Å
35	R	93.4	Very high	93.6	Very high	172 Å²	172	60.5 Å²	60.5	65%	0.649	33%	0.332	S	S	*	.	H	α-helix	trans	-59.1	-38.3	178.4	-175.3	-168.4	66.3	-156.6	-7.4	111.2	Q31 E32 G37	Q31-R35 WeakPolarHBondContact O-CB 3.33Å; Q31-R35 PolarHBondContact O-N 3.13Å; E32-R35 WeakPolarHBondContact O-CB 3.47Å; E32-R35 PolarHBondContact O-N 3.2Å; E32-R35 VanDerWaalsContact O-N 3.15Å; R35-G37 VanDerWaalsContact C-N 3.28Å
36	D	93.5	Very high	93.7	Very high	92 Å²	92	58.5 Å²	58.5	49%	0.492	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-0.1	-178.7	-58	-7.4	0	0	0	112.3	E32 L33 R34 L38	E32-D36 PolarHBondContact O-N 3.41Å; L33-D36 CarbonylContact O-C 3.59Å; L33-D36 PolarHBondContact O-N 3.47Å; R34-D36 PolarHBondContact O-N 3.3Å; D36-L38 HydrophobicContact CB-CD1 4.17Å; D36-L38 HydrophobicContact CB-CG 4.11Å; D36-L38 PolarHBondContact O-N 3.33Å
37	G	92.5	Very high	93.6	Very high	46 Å²	46	63.8 Å²	63.8	47%	0.474	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	71	13.6	179.2	0	0	0	0	0	114.4	L33 R34 R35	L33-G37 PolarHBondContact O-N 2.81Å; L33-G37 VanDerWaalsContact O-N 3.07Å; R34-G37 PolarHBondContact O-N 2.98Å; R34-G37 VanDerWaalsContact O-N 3.09Å; R35-G37 VanDerWaalsContact C-N 3.28Å
38	L	93.8	Very high	93.3	Very high	93 Å²	93	64.4 Å²	64.4	49%	0.487	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	134.5	-176.5	-62.8	176.5	0	0	0	110.3	L33 D36 C40 H54	L33-L38 HydrophobicContact CD2-CB 3.91Å; L33-L38 HydrophobicContact CD2-CD1 4.06Å; L33-L38 PolarHBondContact O-N 3.37Å; D36-L38 HydrophobicContact CB-CD1 4.17Å; D36-L38 HydrophobicContact CB-CG 4.11Å; D36-L38 PolarHBondContact O-N 3.33Å; L38-C40 PolarHBondContact O-N 3.49Å; L38-C40 VanDerWaalsContact O-N 3.08Å; L38-H54 PolarHBondContact O-NE2 3.03Å
39	L	93	Very high	93.4	Very high	138 Å²	138	65.9 Å²	65.9	72%	0.723	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	11.5	177.5	-51.9	175.7	0	0	0	115.4	L33 D41 H54	L33-L39 HydrophobicContact CD1-CD1 4.4Å; L39-D41 PolarHBondContact O-N 2.96Å; L39-H54 PolarHBondContact O-CD2 2.91Å
40	C	94.2	Very high	93.4	Very high	36 Å²	36	71 Å²	71	24%	0.243	37%	0.368	C	S	.	.			trans	-66.3	120	171.8	-67.3	0	0	0	0	110.4	L38 A53	L38-C40 PolarHBondContact O-N 3.49Å; L38-C40 VanDerWaalsContact O-N 3.08Å; C40-A53 WeakPolarHBondContact CA-O 3.26Å
41	D	93.7	Very high	93.3	Very high	74 Å²	74	68 Å²	68	40%	0.396	36%	0.355	S	S	.	.			trans	-112.9	6.1	-175.5	60.8	-10.9	0	0	0	112.8	L39 A53 H54 R55	L39-D41 PolarHBondContact O-N 2.96Å; D41-A53 PolarHBondContact N-O 3.07Å; D41-H54 VanDerWaalsContact OD1-CA 3.23Å; D41-H54 WeakPolarHBondContact OD1-CA 3.3Å; D41-R55 PolarHBondContact O-NE 3Å; D41-R55 VanDerWaalsContact O-NE 3.1Å; D41-R55 WeakPolarHBondContact OD1-CG 3.41Å; D41-R55 PolarHBondContact OD1-N 3.23Å; D41-R55 WeakPolarHBondContact OD2-CB 3.22Å; D41-R55 WeakPolarHBondContact OD2-CD 3.23Å
42	V	93.9	Very high	93.4	Very high	3 Å²	3	68.4 Å²	68.4	2%	0.018	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	144.6	173	62.7	0	0	0	0	111.8	L44 A53 R55 L58 F69 I81	V42-L44 HydrophobicContact CG2-CD2 4.08Å; V42-A53 HydrophobicContact CG1-CB 4.2Å; V42-A53 WeakPolarHBondContact CG1-O 3.48Å; V42-A53 PolarHBondContact N-O 3.09Å; V42-A53 PolarHBondContact O-N 3.08Å; V42-R55 HydrophobicContact CB-CG 3.67Å; V42-R55 HydrophobicContact CG1-CG 3.65Å; V42-L58 HydrophobicContact CG1-CD1 4.01Å; V42-F69 HydrophobicContact CG2-CZ 4.23Å; V42-I81 HydrophobicContact CG2-CD1 3.56Å; V42-I81 HydrophobicContact CG2-CG1 4.05Å
43	T	94.9	Very high	93.5	Very high	27 Å²	27	63.9 Å²	63.9	17%	0.166	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	119.6	171.2	-57.6	0	0	0	0	109.8	L45 R50 L51 Q79 E80 I81	T43-L45 HydrophobicContact CG2-CD2 4.17Å; T43-R50 HydrophobicContact CG2-CB 3.86Å; T43-R50 HydrophobicContact CG2-CG 4.41Å; T43-L51 CarbonylContact C-O 3.58Å; T43-L51 WeakPolarHBondContact CA-O 3.44Å; T43-Q79 PolarHBondContact N-O 3Å; T43-E80 CarbonylContact O-C 3.53Å; T43-E80 VanDerWaalsContact O-CA 3.3Å; T43-E80 WeakPolarHBondContact O-CA 3.28Å; T43-I81 PolarHBondContact O-N 3.23Å
44	L	93.9	Very high	93.5	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	131.1	174.3	-52.1	179.4	0	0	0	109.2	V42 R50 L51 L58 F65 I81 I83 L91 I95	V42-L44 HydrophobicContact CG2-CD2 4.08Å; L44-R50 CarbonylContact O-C 3.6Å; L44-L51 HydrophobicContact CB-CB 4.38Å; L44-L51 PolarHBondContact N-O 3.1Å; L44-L51 PolarHBondContact O-N 2.91Å; L44-L58 HydrophobicContact CD1-CD1 4.18Å; L44-F65 HydrophobicContact CD1-CE1 4.42Å; L44-F65 HydrophobicContact CD1-CZ 3.89Å; L44-F65 HydrophobicContact CD2-CE1 3.96Å; L44-F65 HydrophobicContact CD2-CZ 4.25Å; L44-I81 CarbonylContact C-O 3.59Å; L44-I81 WeakPolarHBondContact CA-O 3.36Å; L44-I81 HydrophobicContact CD2-CB 4.11Å; L44-I81 HydrophobicContact CD2-CD1 4.49Å; L44-I83 HydrophobicContact CB-CD1 4.22Å; L44-I83 HydrophobicContact CD1-CD1 4Å; L44-I83 HydrophobicContact CD2-CD1 4.12Å; L44-I83 HydrophobicContact CG-CD1 4.33Å; L44-L91 HydrophobicContact CB-CD2 4.29Å; L44-L91 HydrophobicContact CD1-CD1 4.42Å; L44-I95 HydrophobicContact CD1-CD1 4.03Å; L44-I95 HydrophobicContact CD1-CG1 4.24Å
45	L	93.5	Very high	93.5	Very high	34 Å²	34	62.8 Å²	62.8	18%	0.178	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	125.6	176.4	-52.4	176.8	0	0	0	108.6	T43 K49 R50 E80 I81 N82 I83	T43-L45 HydrophobicContact CG2-CD2 4.17Å; L45-K49 WeakPolarHBondContact CA-O 3.23Å; L45-R50 HydrophobicContact CD2-CB 4.21Å; L45-R50 HydrophobicContact CD2-CG 3.57Å; L45-E80 HydrophobicContact CD1-CB 4.08Å; L45-E80 HydrophobicContact CG-CB 4.44Å; L45-I81 PolarHBondContact N-O 3.02Å; L45-N82 PolarHBondContact O-OD1 3.3Å; L45-I83 PolarHBondContact O-N 3.35Å
46	A	92.1	Very high	93.5	Very high	1 Å²	1	59.6 Å²	59.6	1%	0.008	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	131.8	172.7	0	0	0	0	0	109.1	G48 K49 F88 L91	A46-G48 PolarHBondContact O-N 2.8Å; A46-G48 VanDerWaalsContact O-N 3.08Å; A46-K49 PolarHBondContact N-O 3.34Å; A46-K49 VanDerWaalsContact N-O 3.1Å; A46-K49 PolarHBondContact O-N 2.86Å; A46-F88 HydrophobicContact CB-CB 4.39Å; A46-F88 HydrophobicContact CB-CD2 4.32Å; A46-L91 HydrophobicContact CB-CD2 3.74Å
47	E	90	Very high	93.5	Very high	140 Å²	140	55.5 Å²	55.5	65%	0.654	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.2	36.7	-179	-58.9	179.3	139.1	0	0	113.8	K49 F88	E47-K49 PolarHBondContact O-N 3.35Å; E47-F88 HydrophobicContact CB-CB 4.37Å; E47-F88 WeakPolarHBondContact OE2-CB 3.36Å; E47-F88 PolarHBondContact OE2-N 2.83Å
48	G	87.8	Confident	93.7	Very high	81 Å²	81	53.3 Å²	53.3	84%	0.835	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.9	-3.6	-179.7	0	0	0	0	0	115.6	A46	A46-G48 PolarHBondContact O-N 2.8Å; A46-G48 VanDerWaalsContact O-N 3.08Å
49	K	93.7	Very high	93.7	Very high	103 Å²	103	49.8 Å²	49.8	45%	0.448	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	155.5	175.9	-64.6	173.4	-178.1	170.7	0	110.8	L45 A46 E47 F88	L45-K49 WeakPolarHBondContact CA-O 3.23Å; A46-K49 PolarHBondContact N-O 3.34Å; A46-K49 VanDerWaalsContact N-O 3.1Å; A46-K49 PolarHBondContact O-N 2.86Å; E47-K49 PolarHBondContact O-N 3.35Å; K49-F88 HydrophobicContact CB-CD2 3.35Å; K49-F88 HydrophobicContact CB-CE1 4.42Å; K49-F88 HydrophobicContact CB-CE2 3.18Å; K49-F88 HydrophobicContact CB-CG 4.03Å; K49-F88 HydrophobicContact CB-CZ 3.78Å; K49-F88 HydrophobicContact CD-CB 4.26Å; K49-F88 HydrophobicContact CD-CD1 3.45Å; K49-F88 VanDerWaalsContact CD-CD1 3.45Å; K49-F88 HydrophobicContact CD-CD2 3.77Å; K49-F88 HydrophobicContact CD-CE1 3.55Å; K49-F88 HydrophobicContact CD-CE2 3.85Å; K49-F88 HydrophobicContact CD-CG 3.55Å; K49-F88 HydrophobicContact CD-CZ 3.74Å; K49-F88 HydrophobicContact CG-CD2 4.21Å; K49-F88 HydrophobicContact CG-CE2 4.18Å; K49-F88 HydrophobicContact CG-CG 4.42Å; K49-F88 HydrophobicContact CG-CZ 4.41Å
50	R	93.9	Very high	93.7	Very high	149 Å²	149	47 Å²	47	56%	0.562	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.2	135.1	-174	-55.8	-169.3	154.9	-140	-12	111.4	T43 L44 L45 E80	T43-R50 HydrophobicContact CG2-CB 3.86Å; T43-R50 HydrophobicContact CG2-CG 4.41Å; L44-R50 CarbonylContact O-C 3.6Å; L45-R50 HydrophobicContact CD2-CB 4.21Å; L45-R50 HydrophobicContact CD2-CG 3.57Å; R50-E80 IonicContact CZ-OE1 2.68Å; R50-E80 IonicContact CZ-OE2 3.83Å; R50-E80 IonicContact NH1-OE1 3.94Å; R50-E80 PolarHBondContact NH1-OE1 3.48Å; R50-E80 IonicContact NH2-OE1 2.85Å; R50-E80 PolarHBondContact NH2-OE1 3.38Å; R50-E80 IonicContact NH2-OE2 3.69Å; R50-E80 PolarHBondContact NH2-OE2 2.86Å
51	L	94.5	Very high	93.7	Very high	16 Å²	16	47.7 Å²	47.7	8%	0.084	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	111.8	173.7	-68.3	172.9	0	0	0	110.7	T43 L44 F88 L91 Q92	T43-L51 CarbonylContact C-O 3.58Å; T43-L51 WeakPolarHBondContact CA-O 3.44Å; L44-L51 HydrophobicContact CB-CB 4.38Å; L44-L51 PolarHBondContact N-O 3.1Å; L44-L51 PolarHBondContact O-N 2.91Å; L51-F88 HydrophobicContact CD1-CD2 4.26Å; L51-F88 HydrophobicContact CD1-CE2 3.84Å; L51-F88 HydrophobicContact CD1-CZ 4.34Å; L51-F88 HydrophobicContact CD2-CE2 3.79Å; L51-F88 HydrophobicContact CD2-CZ 3.67Å; L51-F88 HydrophobicContact CG-CD2 4.37Å; L51-F88 HydrophobicContact CG-CE2 3.53Å; L51-F88 HydrophobicContact CG-CZ 3.98Å; L51-L91 HydrophobicContact CD1-CD2 4.03Å; L51-L91 HydrophobicContact CD1-CG 4.02Å; L51-Q92 HydrophobicContact CD1-CB 4.11Å; L51-Q92 HydrophobicContact CD2-CG 4.39Å
52	S	95.1	Very high	93.8	Very high	53 Å²	53	44.3 Å²	44.3	37%	0.371	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	137.1	173.3	-58	0	0	0	0	111.3	R34	R34-S52 WeakPolarHBondContact CG-O 3.37Å
53	A	96	Very high	93.8	Very high	1 Å²	1	47 Å²	47	1%	0.008	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	177.9	179.7	0	0	0	0	0	111.4	C40 D41 V42 L58	C40-A53 WeakPolarHBondContact CA-O 3.26Å; D41-A53 PolarHBondContact N-O 3.07Å; V42-A53 HydrophobicContact CG1-CB 4.2Å; V42-A53 WeakPolarHBondContact CG1-O 3.48Å; V42-A53 PolarHBondContact N-O 3.09Å; V42-A53 PolarHBondContact O-N 3.08Å; A53-L58 HydrophobicContact CB-CD1 3.9Å; A53-L58 HydrophobicContact CB-CD2 4.44Å; A53-L58 HydrophobicContact CB-CG 4.25Å
54	H	95.5	Very high	93.6	Very high	13 Å²	13	48.7 Å²	48.7	6%	0.06	28%	0.277	C	S	.	.			trans	-108.5	121.1	176.7	-55.4	80	0	0	0	109.9	L38 L39 D41 V56 V57 L58 Y99	L38-H54 PolarHBondContact O-NE2 3.03Å; L39-H54 PolarHBondContact O-CD2 2.91Å; D41-H54 VanDerWaalsContact OD1-CA 3.23Å; D41-H54 WeakPolarHBondContact OD1-CA 3.3Å; H54-V56 HydrophobicContact CB-CG1 4.3Å; H54-V56 PolarHBondContact O-N 3.04Å; H54-V57 HydrophobicContact CB-CB 4.27Å; H54-V57 HydrophobicContact CB-CG2 3.89Å; H54-V57 PolarHBondContact O-N 3.5Å; H54-L58 PolarHBondContact O-N 3.31Å; H54-L58 VanDerWaalsContact O-N 3.07Å; H54-Y99 VanDerWaalsContact CB-OH 3.32Å; H54-Y99 WeakPolarHBondContact CB-OH 3.43Å; H54-Y99 PolarHBondContact N-OH 3.15Å; H54-Y99 AromaticContact ND1-CE1 3.85Å; H54-Y99 AromaticContact ND1-CZ 3.75Å; H54-Y99 PolarHBondContact ND1-OH 2.96Å
55	R	93.7	Very high	93.6	Very high	47 Å²	47	48.7 Å²	48.7	18%	0.177	28%	0.277	C	S	.	.	H	α-helix	trans	-53.7	-40.2	179.6	-67.8	169.5	167.7	-135.9	-8.9	111.8	D41 V42 V57 L58 A59 F69 K76 A78	D41-R55 PolarHBondContact O-NE 3Å; D41-R55 VanDerWaalsContact O-NE 3.1Å; D41-R55 WeakPolarHBondContact OD1-CG 3.41Å; D41-R55 PolarHBondContact OD1-N 3.23Å; D41-R55 WeakPolarHBondContact OD2-CB 3.22Å; D41-R55 WeakPolarHBondContact OD2-CD 3.23Å; V42-R55 HydrophobicContact CB-CG 3.67Å; V42-R55 HydrophobicContact CG1-CG 3.65Å; R55-V57 PolarHBondContact O-N 2.87Å; R55-L58 PolarHBondContact O-N 3.32Å; R55-A59 VanDerWaalsContact O-CB 3.23Å; R55-A59 WeakPolarHBondContact O-CB 3.31Å; R55-A59 PolarHBondContact O-N 3.46Å; R55-F69 HydrophobicContact CB-CD2 3.88Å; R55-F69 HydrophobicContact CB-CE2 3.99Å; R55-F69 HydrophobicContact CB-CG 4.39Å; R55-F69 HydrophobicContact CG-CD2 4.19Å; R55-F69 HydrophobicContact CG-CE1 4.35Å; R55-F69 HydrophobicContact CG-CE2 4Å; R55-F69 HydrophobicContact CG-CG 4.47Å; R55-F69 HydrophobicContact CG-CZ 4.09Å; R55-K76 PolarHBondContact NH1-O 3.22Å; R55-K76 PolarHBondContact NH2-O 3.07Å; R55-A78 PolarHBondContact NH2-O 3.4Å
56	V	93.6	Very high	93.5	Very high	104 Å²	104	54.9 Å²	54.9	63%	0.63	30%	0.298	S	S	*	.	H	α-helix	trans	-62.7	-40.9	179.1	68.2	0	0	0	0	112.3	H54 A60	H54-V56 HydrophobicContact CB-CG1 4.3Å; H54-V56 PolarHBondContact O-N 3.04Å; V56-A60 WeakPolarHBondContact O-CB 3.31Å; V56-A60 PolarHBondContact O-N 3.38Å
57	V	95.3	Very high	93.4	Very high	6 Å²	6	56.8 Å²	56.8	4%	0.036	32%	0.315	C	S	.	.	H	α-helix	trans	-71.7	-42.5	-179.9	-177.5	0	0	0	0	110.1	F27 F30 H54 R55 A60 T61 V98 Y99	F27-V57 HydrophobicContact CE1-CG1 4.15Å; F30-V57 HydrophobicContact CB-CG2 4.45Å; F30-V57 HydrophobicContact CD2-CG2 4.21Å; F30-V57 HydrophobicContact CG-CG2 4.35Å; H54-V57 HydrophobicContact CB-CB 4.27Å; H54-V57 HydrophobicContact CB-CG2 3.89Å; H54-V57 PolarHBondContact O-N 3.5Å; R55-V57 PolarHBondContact O-N 2.87Å; V57-A60 PolarHBondContact O-N 3.28Å; V57-T61 PolarHBondContact O-N 3.42Å; V57-T61 PolarHBondContact O-OG1 3.26Å; V57-V98 HydrophobicContact CG1-CG1 3.65Å; V57-Y99 HydrophobicContact CB-CE1 4.15Å; V57-Y99 HydrophobicContact CB-CE2 4.37Å; V57-Y99 HydrophobicContact CG1-CD1 4.18Å; V57-Y99 HydrophobicContact CG1-CD2 4.26Å; V57-Y99 HydrophobicContact CG1-CE1 3.85Å; V57-Y99 HydrophobicContact CG1-CE2 3.92Å; V57-Y99 HydrophobicContact CG1-CG 4.39Å; V57-Y99 HydrophobicContact CG2-CE1 3.97Å
58	L	95.2	Very high	93.4	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-63.3	-48.9	176.2	-63.9	-178.1	0	0	0	111.9	V42 L44 A53 H54 R55 A60 T61 I62 F65 F69 I95 V98	V42-L58 HydrophobicContact CG1-CD1 4.01Å; L44-L58 HydrophobicContact CD1-CD1 4.18Å; A53-L58 HydrophobicContact CB-CD1 3.9Å; A53-L58 HydrophobicContact CB-CD2 4.44Å; A53-L58 HydrophobicContact CB-CG 4.25Å; H54-L58 PolarHBondContact O-N 3.31Å; H54-L58 VanDerWaalsContact O-N 3.07Å; R55-L58 PolarHBondContact O-N 3.32Å; L58-A60 VanDerWaalsContact C-N 3.28Å; L58-A60 PolarHBondContact O-N 2.86Å; L58-T61 PolarHBondContact O-N 3.37Å; L58-T61 PolarHBondContact O-OG1 3.26Å; L58-I62 WeakPolarHBondContact O-CB 3.38Å; L58-I62 PolarHBondContact O-N 3Å; L58-F65 HydrophobicContact CB-CB 3.89Å; L58-F65 HydrophobicContact CB-CD2 3.94Å; L58-F65 HydrophobicContact CB-CG 3.98Å; L58-F65 HydrophobicContact CD1-CD1 4.49Å; L58-F65 HydrophobicContact CD1-CD2 4.33Å; L58-F65 HydrophobicContact CD1-CE2 4.46Å; L58-F65 HydrophobicContact CD1-CG 4.37Å; L58-F65 HydrophobicContact CD2-CD2 4.31Å; L58-F65 HydrophobicContact CD2-CE2 4.4Å; L58-F65 HydrophobicContact CG-CD2 4.42Å; L58-F69 HydrophobicContact CB-CE2 4.06Å; L58-F69 HydrophobicContact CD1-CE2 4.19Å; L58-I95 HydrophobicContact CD2-CD1 3.58Å; L58-V98 HydrophobicContact CD2-CG1 4.41Å
59	A	93.9	Very high	93.5	Very high	20 Å²	20	48.6 Å²	48.6	17%	0.165	25%	0.254	C	S	.	.	H	α-helix	trans	-65.6	-29.7	178.4	0	0	0	0	0	113.2	R55 T61 R66 F69	R55-A59 VanDerWaalsContact O-CB 3.23Å; R55-A59 WeakPolarHBondContact O-CB 3.31Å; R55-A59 PolarHBondContact O-N 3.46Å; A59-T61 VanDerWaalsContact C-N 3.33Å; A59-R66 HydrophobicContact CB-CB 4.4Å; A59-R66 VanDerWaalsContact O-CB 3.31Å; A59-R66 WeakPolarHBondContact O-CB 3.32Å; A59-R66 WeakPolarHBondContact O-CG 3.42Å; A59-F69 HydrophobicContact CB-CD2 4.17Å
60	A	94.1	Very high	93.1	Very high	80 Å²	80	47.9 Å²	47.9	66%	0.661	26%	0.259	S	S	*	.	H	α-helix	trans	-73	-26.8	177.7	0	0	0	0	0	113	V56 V57 L58	V56-A60 WeakPolarHBondContact O-CB 3.31Å; V56-A60 PolarHBondContact O-N 3.38Å; V57-A60 PolarHBondContact O-N 3.28Å; L58-A60 VanDerWaalsContact C-N 3.28Å; L58-A60 PolarHBondContact O-N 2.86Å
61	T	93.6	Very high	92.6	Very high	50 Å²	50	45 Å²	45	31%	0.307	25%	0.254	S	S	.	.	H	α-helix	trans	-112.3	-29.1	-170.1	53.4	0	0	0	0	114	F27 V57 L58 A59 V98	F27-T61 HydrophobicContact CE1-CG2 4.34Å; F27-T61 HydrophobicContact CZ-CG2 4.44Å; V57-T61 PolarHBondContact O-N 3.42Å; V57-T61 PolarHBondContact O-OG1 3.26Å; L58-T61 PolarHBondContact O-N 3.37Å; L58-T61 PolarHBondContact O-OG1 3.26Å; A59-T61 VanDerWaalsContact C-N 3.33Å; T61-V98 HydrophobicContact CG2-CG1 4.07Å; T61-V98 WeakPolarHBondContact OG1-CG1 3.29Å
62	I	95.4	Very high	91.3	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.01	28%	0.282	C	S	.	.			trans	-119.4	118.3	-174.1	-61.1	-179.8	0	0	0	109.8	L58 Y64 F65 R66 I94 V98 L120 I122	L58-I62 WeakPolarHBondContact O-CB 3.38Å; L58-I62 PolarHBondContact O-N 3Å; I62-Y64 VanDerWaalsContact C-N 3.31Å; I62-Y64 PolarHBondContact O-N 2.75Å; I62-F65 HydrophobicContact CB-CB 4.44Å; I62-F65 HydrophobicContact CB-CD2 3.77Å; I62-F65 HydrophobicContact CD1-CD2 3.7Å; I62-F65 HydrophobicContact CD1-CE2 3.78Å; I62-F65 HydrophobicContact CG1-CD2 4.28Å; I62-F65 HydrophobicContact CG2-CD2 3.67Å; I62-F65 HydrophobicContact CG2-CE2 4.28Å; I62-F65 HydrophobicContact CG2-CG 4.45Å; I62-F65 PolarHBondContact O-N 3.26Å; I62-R66 PolarHBondContact O-N 3.35Å; I62-I94 HydrophobicContact CD1-CG2 4.14Å; I62-V98 HydrophobicContact CD1-CG2 3.54Å; I62-V98 HydrophobicContact CG1-CG2 3.82Å; I62-L120 HydrophobicContact CG2-CB 4.01Å; I62-L120 WeakPolarHBondContact CG2-O 3.41Å; I62-I122 HydrophobicContact CD1-CD1 3.81Å; I62-I122 HydrophobicContact CG1-CD1 3.75Å; I62-I122 HydrophobicContact CG1-CG1 4.17Å; I62-I122 HydrophobicContact CG2-CD1 4.46Å; I62-I122 HydrophobicContact CG2-CG1 4.32Å
63	P	93.3	Very high	89.9	Confident	59 Å²	59	53.5 Å²	53.5	38%	0.383	29%	0.293	S	S	.	.	H	α-helix	trans	-57.4	-39.1	179.2	-27.1	36.1	0	0	0	114.1	F65 R66 A67 Q121	P63-F65 PolarHBondContact O-N 2.94Å; P63-R66 WeakPolarHBondContact O-CB 3.18Å; P63-R66 PolarHBondContact O-N 3.02Å; P63-A67 PolarHBondContact O-N 3.34Å; P63-Q121 HydrophobicContact CB-CB 4.26Å; P63-Q121 WeakPolarHBondContact CD-O 3.39Å; P63-Q121 HydrophobicContact CG-CB 4.31Å; P63-Q121 WeakPolarHBondContact CG-O 3.28Å
64	Y	92.2	Very high	88.3	Confident	63 Å²	63	61.3 Å²	61.3	25%	0.247	33%	0.331	C	S	.	.	H	α-helix	trans	-56.1	-51.7	176.1	177.4	-95.1	0	0	0	112.4	I62 R66 A67 M68 Y119 L120	I62-Y64 VanDerWaalsContact C-N 3.31Å; I62-Y64 PolarHBondContact O-N 2.75Å; Y64-R66 VanDerWaalsContact C-N 3.34Å; Y64-R66 PolarHBondContact O-N 2.97Å; Y64-A67 PolarHBondContact O-N 2.86Å; Y64-M68 HydrophobicContact CD1-CE 4.33Å; Y64-M68 HydrophobicContact CE1-CE 3.35Å; Y64-M68 HydrophobicContact CE1-SD 4.49Å; Y64-M68 WeakPolarHBondContact O-CB 3.41Å; Y64-M68 PolarHBondContact O-N 3.22Å; Y64-M68 VanDerWaalsContact OH-CE 3.26Å; Y64-M68 WeakPolarHBondContact OH-CE 3.38Å; Y64-Y119 HydrophobicContact CE2-CE1 4.05Å; Y64-L120 HydrophobicContact CD1-CD2 3.64Å; Y64-L120 HydrophobicContact CE1-CD2 4.24Å; Y64-L120 HydrophobicContact CG-CD2 3.97Å
65	F	92.9	Very high	86.8	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-70.3	-31.2	177.7	-69.8	-59.2	0	0	0	112.6	L44 L58 I62 P63 M68 F69 I83 L120	L44-F65 HydrophobicContact CD1-CE1 4.42Å; L44-F65 HydrophobicContact CD1-CZ 3.89Å; L44-F65 HydrophobicContact CD2-CE1 3.96Å; L44-F65 HydrophobicContact CD2-CZ 4.25Å; L58-F65 HydrophobicContact CB-CB 3.89Å; L58-F65 HydrophobicContact CB-CD2 3.94Å; L58-F65 HydrophobicContact CB-CG 3.98Å; L58-F65 HydrophobicContact CD1-CD1 4.49Å; L58-F65 HydrophobicContact CD1-CD2 4.33Å; L58-F65 HydrophobicContact CD1-CE2 4.46Å; L58-F65 HydrophobicContact CD1-CG 4.37Å; L58-F65 HydrophobicContact CD2-CD2 4.31Å; L58-F65 HydrophobicContact CD2-CE2 4.4Å; L58-F65 HydrophobicContact CG-CD2 4.42Å; I62-F65 HydrophobicContact CB-CB 4.44Å; I62-F65 HydrophobicContact CB-CD2 3.77Å; I62-F65 HydrophobicContact CD1-CD2 3.7Å; I62-F65 HydrophobicContact CD1-CE2 3.78Å; I62-F65 HydrophobicContact CG1-CD2 4.28Å; I62-F65 HydrophobicContact CG2-CD2 3.67Å; I62-F65 HydrophobicContact CG2-CE2 4.28Å; I62-F65 HydrophobicContact CG2-CG 4.45Å; I62-F65 PolarHBondContact O-N 3.26Å; P63-F65 PolarHBondContact O-N 2.94Å; F65-M68 HydrophobicContact CD1-SD 4.15Å; F65-M68 HydrophobicContact CE1-SD 4.46Å; F65-M68 PolarHBondContact O-N 3.42Å; F65-F69 HydrophobicContact CB-CD2 4.09Å; F65-F69 HydrophobicContact CB-CE2 3.77Å; F65-F69 HydrophobicContact CB-CZ 4.47Å; F65-F69 AromaticContact CD1-CE2 3.96Å; F65-F69 HydrophobicContact CD1-CE2 3.96Å; F65-F69 AromaticContact CD1-CZ 3.85Å; F65-F69 HydrophobicContact CD1-CZ 3.85Å; F65-F69 HydrophobicContact CG-CE2 4.14Å; F65-F69 HydrophobicContact CG-CZ 4.49Å; F65-F69 WeakPolarHBondContact O-CB 3.34Å; F65-F69 WeakPolarHBondContact O-CD2 3.49Å; F65-F69 VanDerWaalsContact O-CG 3.31Å; F65-F69 WeakPolarHBondContact O-CG 3.49Å; F65-F69 PolarHBondContact O-N 2.74Å; F65-I83 HydrophobicContact CE1-CD1 4.07Å; F65-I83 HydrophobicContact CZ-CD1 3.66Å; F65-L120 HydrophobicContact CE2-CD2 4.18Å; F65-L120 HydrophobicContact CZ-CD2 4.37Å
66	R	92.6	Very high	85.6	Confident	164 Å²	164	66.3 Å²	66.3	62%	0.619	36%	0.355	S	S	*	.	H	α-helix	trans	-58.8	-49.4	172	-168.5	175.6	174.1	177.7	-1.4	110.7	A59 I62 P63 Y64 T70	A59-R66 HydrophobicContact CB-CB 4.4Å; A59-R66 VanDerWaalsContact O-CB 3.31Å; A59-R66 WeakPolarHBondContact O-CB 3.32Å; A59-R66 WeakPolarHBondContact O-CG 3.42Å; I62-R66 PolarHBondContact O-N 3.35Å; P63-R66 WeakPolarHBondContact O-CB 3.18Å; P63-R66 PolarHBondContact O-N 3.02Å; Y64-R66 VanDerWaalsContact C-N 3.34Å; Y64-R66 PolarHBondContact O-N 2.97Å; R66-T70 HydrophobicContact CG-CG2 4.46Å; R66-T70 WeakPolarHBondContact O-CB 3.16Å; R66-T70 WeakPolarHBondContact O-CG2 3.27Å; R66-T70 PolarHBondContact O-N 3Å; R66-T70 PolarHBondContact O-OG1 2.93Å
67	A	90.1	Very high	84.5	Confident	42 Å²	42	66.1 Å²	66.1	35%	0.347	36%	0.358	S	S	.	.	H	α-helix	trans	-60.5	-49.1	176.5	0	0	0	0	0	110.8	P63 Y64 F69 T70 I71	P63-A67 PolarHBondContact O-N 3.34Å; Y64-A67 PolarHBondContact O-N 2.86Å; A67-F69 VanDerWaalsContact C-N 3.35Å; A67-F69 PolarHBondContact O-N 3.15Å; A67-T70 PolarHBondContact O-N 3.36Å; A67-I71 HydrophobicContact CB-CD1 4.01Å; A67-I71 VanDerWaalsContact O-CB 3.31Å; A67-I71 WeakPolarHBondContact O-CB 3.48Å; A67-I71 VanDerWaalsContact O-CG1 3.22Å; A67-I71 WeakPolarHBondContact O-CG1 3.48Å; A67-I71 PolarHBondContact O-N 3.23Å
68	M	89.4	Confident	83.9	Confident	27 Å²	27	67.2 Å²	67.2	13%	0.133	37%	0.368	C	S	.	.	H	α-helix	trans	-58.9	-39.9	-179.3	-176	-178.4	-77	0	0	113.6	Y64 F65 E75 I81	Y64-M68 HydrophobicContact CD1-CE 4.33Å; Y64-M68 HydrophobicContact CE1-CE 3.35Å; Y64-M68 HydrophobicContact CE1-SD 4.49Å; Y64-M68 WeakPolarHBondContact O-CB 3.41Å; Y64-M68 PolarHBondContact O-N 3.22Å; Y64-M68 VanDerWaalsContact OH-CE 3.26Å; Y64-M68 WeakPolarHBondContact OH-CE 3.38Å; F65-M68 HydrophobicContact CD1-SD 4.15Å; F65-M68 HydrophobicContact CE1-SD 4.46Å; F65-M68 PolarHBondContact O-N 3.42Å; M68-E75 HydrophobicContact CG-CB 3.71Å; M68-E75 HydrophobicContact CG-CG 4.39Å; M68-E75 HydrophobicContact SD-CB 4.24Å; M68-I81 HydrophobicContact CE-CG2 4.2Å; M68-I81 HydrophobicContact SD-CD1 3.76Å; M68-I81 HydrophobicContact SD-CG2 3.9Å
69	F	89.3	Confident	83.4	Confident	21 Å²	21	74.7 Å²	74.7	9%	0.092	40%	0.403	C	S	.	.	H	α-helix	trans	-91.4	-13.9	-175.9	-59.1	-33.4	0	0	0	114.8	V42 R55 L58 A59 F65 A67 I81	V42-F69 HydrophobicContact CG2-CZ 4.23Å; R55-F69 HydrophobicContact CB-CD2 3.88Å; R55-F69 HydrophobicContact CB-CE2 3.99Å; R55-F69 HydrophobicContact CB-CG 4.39Å; R55-F69 HydrophobicContact CG-CD2 4.19Å; R55-F69 HydrophobicContact CG-CE1 4.35Å; R55-F69 HydrophobicContact CG-CE2 4Å; R55-F69 HydrophobicContact CG-CG 4.47Å; R55-F69 HydrophobicContact CG-CZ 4.09Å; L58-F69 HydrophobicContact CB-CE2 4.06Å; L58-F69 HydrophobicContact CD1-CE2 4.19Å; A59-F69 HydrophobicContact CB-CD2 4.17Å; F65-F69 HydrophobicContact CB-CD2 4.09Å; F65-F69 HydrophobicContact CB-CE2 3.77Å; F65-F69 HydrophobicContact CB-CZ 4.47Å; F65-F69 AromaticContact CD1-CE2 3.96Å; F65-F69 HydrophobicContact CD1-CE2 3.96Å; F65-F69 AromaticContact CD1-CZ 3.85Å; F65-F69 HydrophobicContact CD1-CZ 3.85Å; F65-F69 HydrophobicContact CG-CE2 4.14Å; F65-F69 HydrophobicContact CG-CZ 4.49Å; F65-F69 WeakPolarHBondContact O-CB 3.34Å; F65-F69 WeakPolarHBondContact O-CD2 3.49Å; F65-F69 VanDerWaalsContact O-CG 3.31Å; F65-F69 WeakPolarHBondContact O-CG 3.49Å; F65-F69 PolarHBondContact O-N 2.74Å; A67-F69 VanDerWaalsContact C-N 3.35Å; A67-F69 PolarHBondContact O-N 3.15Å; F69-I81 HydrophobicContact CE1-CD1 3.41Å; F69-I81 VanDerWaalsContact CE1-CD1 3.41Å; F69-I81 HydrophobicContact CZ-CD1 3.82Å
70	T	86.6	Confident	83.3	Confident	89 Å²	89	77.8 Å²	77.8	55%	0.546	41%	0.414	S	S	.	.	H	α-helix	trans	-105.6	-24.9	-179.7	61.1	0	0	0	0	113.8	R66 A67	R66-T70 HydrophobicContact CG-CG2 4.46Å; R66-T70 WeakPolarHBondContact O-CB 3.16Å; R66-T70 WeakPolarHBondContact O-CG2 3.27Å; R66-T70 PolarHBondContact O-N 3Å; R66-T70 PolarHBondContact O-OG1 2.93Å; A67-T70 PolarHBondContact O-N 3.36Å
71	I	82.6	Confident	83.1	Confident	88 Å²	88	74.5 Å²	74.5	45%	0.451	39%	0.385	S	S	.	.	S	Bend	trans	-83	139.9	175.5	-58.3	171.4	0	0	0	109.3	A67 M73	A67-I71 HydrophobicContact CB-CD1 4.01Å; A67-I71 VanDerWaalsContact O-CB 3.31Å; A67-I71 WeakPolarHBondContact O-CB 3.48Å; A67-I71 VanDerWaalsContact O-CG1 3.22Å; A67-I71 WeakPolarHBondContact O-CG1 3.48Å; A67-I71 PolarHBondContact O-N 3.23Å; I71-M73 HydrophobicContact CG2-CE 4.15Å; I71-M73 HydrophobicContact CG2-CG 3.95Å; I71-M73 PolarHBondContact O-N 3.12Å
72	D	66	Low	83	Confident	128 Å²	128	76.9 Å²	76.9	68%	0.684	40%	0.396	S	S	*	.	S	Bend	trans	-70.9	77.1	175.1	-74	-41.4	0	0	0	111.4	K76	D72-K76 WeakPolarHBondContact OD1-CD 3.45Å; D72-K76 IonicContact OD1-NZ 2.62Å; D72-K76 PolarHBondContact OD1-NZ 3.41Å
73	M	66.7	Low	82.7	Confident	119 Å²	119	77 Å²	77	59%	0.586	40%	0.397	S	S	*	.	S	Bend	trans	-120.3	167.1	169.9	-66.3	-67.9	145.9	0	0	110.3	I71 E75 K76	I71-M73 HydrophobicContact CG2-CE 4.15Å; I71-M73 HydrophobicContact CG2-CG 3.95Å; I71-M73 PolarHBondContact O-N 3.12Å; M73-E75 WeakPolarHBondContact CB-OE2 3.47Å; M73-E75 PolarHBondContact O-N 3.32Å; M73-E75 VanDerWaalsContact O-N 3.15Å; M73-K76 WeakPolarHBondContact O-CB 3.32Å; M73-K76 PolarHBondContact O-N 3.44Å
74	M	62.2	Low	82.3	Confident	166 Å²	166	80.3 Å²	80.3	82%	0.818	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-58.9	-30.7	-175	-68.6	-146.5	-61.2	0	0	113	K76 S77	M74-K76 PolarHBondContact O-N 2.91Å; M74-S77 PolarHBondContact O-N 3.05Å; M74-S77 PolarHBondContact O-OG 3.39Å
75	E	64.4	Low	82	Confident	82 Å²	82	84.1 Å²	84.1	38%	0.383	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-65.3	-21.3	177.9	-62.1	79	-173.4	0	0	112.4	M68 M73 S77 A78	M68-E75 HydrophobicContact CG-CB 3.71Å; M68-E75 HydrophobicContact CG-CG 4.39Å; M68-E75 HydrophobicContact SD-CB 4.24Å; M73-E75 WeakPolarHBondContact CB-OE2 3.47Å; M73-E75 PolarHBondContact O-N 3.32Å; M73-E75 VanDerWaalsContact O-N 3.15Å; E75-S77 PolarHBondContact O-N 3.23Å; E75-S77 VanDerWaalsContact O-N 3.17Å; E75-A78 PolarHBondContact O-N 3.36Å; E75-A78 VanDerWaalsContact O-N 3.14Å
76	K	67.5	Low	81.9	Confident	82 Å²	82	84.6 Å²	84.6	36%	0.357	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-57	-34	177.7	-175.4	174.1	175.3	174.2	0	111.8	R55 D72 M73 M74	R55-K76 PolarHBondContact NH1-O 3.22Å; R55-K76 PolarHBondContact NH2-O 3.07Å; D72-K76 WeakPolarHBondContact OD1-CD 3.45Å; D72-K76 IonicContact OD1-NZ 2.62Å; D72-K76 PolarHBondContact OD1-NZ 3.41Å; M73-K76 WeakPolarHBondContact O-CB 3.32Å; M73-K76 PolarHBondContact O-N 3.44Å; M74-K76 PolarHBondContact O-N 2.91Å
77	S	71.2	Confident	81.9	Confident	100 Å²	100	78.1 Å²	78.1	70%	0.699	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-103.2	-4	178.3	48.1	0	0	0	0	114.6	M74 E75 Q79	M74-S77 PolarHBondContact O-N 3.05Å; M74-S77 PolarHBondContact O-OG 3.39Å; E75-S77 PolarHBondContact O-N 3.23Å; E75-S77 VanDerWaalsContact O-N 3.17Å; S77-Q79 PolarHBondContact O-N 3.24Å
78	A	81.7	Confident	82.1	Confident	30 Å²	30	76.9 Å²	76.9	25%	0.248	41%	0.406	C	S	.	.			trans	-73.2	123.1	-175.2	0	0	0	0	0	111.8	R55 E75 E80 I81	R55-A78 PolarHBondContact NH2-O 3.4Å; E75-A78 PolarHBondContact O-N 3.36Å; E75-A78 VanDerWaalsContact O-N 3.14Å; A78-E80 VanDerWaalsContact C-N 3.3Å; A78-I81 HydrophobicContact CB-CG1 4.39Å
79	Q	86.1	Confident	82.4	Confident	156 Å²	156	80.6 Å²	80.6	73%	0.729	43%	0.426	S	S	*	.	S	Bend	trans	-73	-27.1	173.2	-70.9	-171.8	-16.1	0	0	112.2	T43 S77	T43-Q79 PolarHBondContact N-O 3Å; S77-Q79 PolarHBondContact O-N 3.24Å
80	E	91.3	Very high	82.6	Confident	86 Å²	86	79.8 Å²	79.8	40%	0.402	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	129.7	179.1	-59.6	-171	175.3	0	0	110.2	T43 L45 R50 A78	T43-E80 CarbonylContact O-C 3.53Å; T43-E80 VanDerWaalsContact O-CA 3.3Å; T43-E80 WeakPolarHBondContact O-CA 3.28Å; L45-E80 HydrophobicContact CD1-CB 4.08Å; L45-E80 HydrophobicContact CG-CB 4.44Å; R50-E80 IonicContact CZ-OE1 2.68Å; R50-E80 IonicContact CZ-OE2 3.83Å; R50-E80 IonicContact NH1-OE1 3.94Å; R50-E80 PolarHBondContact NH1-OE1 3.48Å; R50-E80 IonicContact NH2-OE1 2.85Å; R50-E80 PolarHBondContact NH2-OE1 3.38Å; R50-E80 IonicContact NH2-OE2 3.69Å; R50-E80 PolarHBondContact NH2-OE2 2.86Å; A78-E80 VanDerWaalsContact C-N 3.3Å
81	I	90.6	Very high	83.1	Confident	10 Å²	10	75.6 Å²	75.6	5%	0.051	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	117.3	-175.3	-57.5	177.1	0	0	0	108.6	V42 T43 L44 L45 M68 F69 A78 I83	V42-I81 HydrophobicContact CG2-CD1 3.56Å; V42-I81 HydrophobicContact CG2-CG1 4.05Å; T43-I81 PolarHBondContact O-N 3.23Å; L44-I81 CarbonylContact C-O 3.59Å; L44-I81 WeakPolarHBondContact CA-O 3.36Å; L44-I81 HydrophobicContact CD2-CB 4.11Å; L44-I81 HydrophobicContact CD2-CD1 4.49Å; L45-I81 PolarHBondContact N-O 3.02Å; M68-I81 HydrophobicContact CE-CG2 4.2Å; M68-I81 HydrophobicContact SD-CD1 3.76Å; M68-I81 HydrophobicContact SD-CG2 3.9Å; F69-I81 HydrophobicContact CE1-CD1 3.41Å; F69-I81 VanDerWaalsContact CE1-CD1 3.41Å; F69-I81 HydrophobicContact CZ-CD1 3.82Å; A78-I81 HydrophobicContact CB-CG1 4.39Å; I81-I83 PolarHBondContact O-N 3.09Å
82	N	91.2	Very high	83.7	Confident	100 Å²	100	74.8 Å²	74.8	54%	0.535	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	111.5	177.9	-170.8	17.5	0	0	0	110.3	L45 Q84	L45-N82 PolarHBondContact O-OD1 3.3Å; N82-Q84 PolarHBondContact O-N 3.48Å
83	I	89.5	Confident	85.1	Confident	6 Å²	6	71.1 Å²	71.1	3%	0.031	37%	0.372	C	S	.	.			trans	-89.7	107.4	176.5	-58.8	-172.6	0	0	0	107.7	L44 L45 F65 I81 I86 L91	L44-I83 HydrophobicContact CB-CD1 4.22Å; L44-I83 HydrophobicContact CD1-CD1 4Å; L44-I83 HydrophobicContact CD2-CD1 4.12Å; L44-I83 HydrophobicContact CG-CD1 4.33Å; L45-I83 PolarHBondContact O-N 3.35Å; F65-I83 HydrophobicContact CE1-CD1 4.07Å; F65-I83 HydrophobicContact CZ-CD1 3.66Å; I81-I83 PolarHBondContact O-N 3.09Å; I83-I86 HydrophobicContact CG2-CB 3.97Å; I83-I86 HydrophobicContact CG2-CD1 3.87Å; I83-I86 HydrophobicContact CG2-CG1 3.97Å; I83-L91 HydrophobicContact CD1-CD1 3.84Å; I83-L91 HydrophobicContact CD1-CD2 3.87Å
84	Q	84.1	Confident	86.5	Confident	127 Å²	127	65.5 Å²	65.5	59%	0.593	35%	0.345	S	S	*	.			trans	-80.9	155.8	171.3	-58.4	-179.4	6.1	0	0	108.8	N82 I86	N82-Q84 PolarHBondContact O-N 3.48Å; Q84-I86 VanDerWaalsContact C-N 3.27Å; Q84-I86 PolarHBondContact O-N 3.28Å; Q84-I86 VanDerWaalsContact O-N 3.15Å
85	D	85.3	Confident	88	Confident	143 Å²	143	57.6 Å²	57.6	77%	0.765	31%	0.306	S	S	*	.	S	Bend	trans	70.4	0.4	174	-47.9	-44.5	0	0	0	118
86	I	92	Very high	89.5	Confident	10 Å²	10	55.8 Å²	55.8	5%	0.051	30%	0.299	C	S	.	.	S	Bend	trans	-118.7	123.7	173.6	-54.4	-178	0	0	0	110.6	I83 Q84 A90 L91 A116 Y119 L120	I83-I86 HydrophobicContact CG2-CB 3.97Å; I83-I86 HydrophobicContact CG2-CD1 3.87Å; I83-I86 HydrophobicContact CG2-CG1 3.97Å; Q84-I86 VanDerWaalsContact C-N 3.27Å; Q84-I86 PolarHBondContact O-N 3.28Å; Q84-I86 VanDerWaalsContact O-N 3.15Å; I86-A90 HydrophobicContact CG2-CB 4.4Å; I86-L91 HydrophobicContact CG2-CB 3.89Å; I86-A116 HydrophobicContact CD1-CB 4.19Å; I86-A116 HydrophobicContact CG1-CB 4.31Å; I86-A116 HydrophobicContact CG2-CB 3.66Å; I86-Y119 HydrophobicContact CD1-CD1 3.77Å; I86-Y119 HydrophobicContact CD1-CE1 4.34Å; I86-Y119 HydrophobicContact CD1-CG 4.47Å; I86-Y119 HydrophobicContact CG1-CD1 4.29Å; I86-L120 HydrophobicContact CD1-CD1 3.94Å; I86-L120 HydrophobicContact CD1-CD2 4.01Å; I86-L120 HydrophobicContact CD1-CG 3.78Å
87	G	92.1	Very high	90.8	Very high	29 Å²	29	53.9 Å²	53.9	30%	0.299	29%	0.29	S	S	.	.			trans	-63.9	145.4	173.1	0	0	0	0	0	112.1	D89 A90 L91	G87-D89 VanDerWaalsContact C-N 3.32Å; G87-D89 PolarHBondContact O-N 3.49Å; G87-A90 PolarHBondContact O-N 2.89Å; G87-L91 PolarHBondContact O-N 2.99Å
88	F	94.6	Very high	91.9	Very high	15 Å²	15	49.6 Å²	49.6	7%	0.066	26%	0.26	C	S	.	.	H	α-helix	trans	-59.3	-41.4	-171.6	175.7	-93.8	0	0	0	113.1	A46 E47 K49 L51 A90 L91 Q92	A46-F88 HydrophobicContact CB-CB 4.39Å; A46-F88 HydrophobicContact CB-CD2 4.32Å; E47-F88 HydrophobicContact CB-CB 4.37Å; E47-F88 WeakPolarHBondContact OE2-CB 3.36Å; E47-F88 PolarHBondContact OE2-N 2.83Å; K49-F88 HydrophobicContact CB-CD2 3.35Å; K49-F88 HydrophobicContact CB-CE1 4.42Å; K49-F88 HydrophobicContact CB-CE2 3.18Å; K49-F88 HydrophobicContact CB-CG 4.03Å; K49-F88 HydrophobicContact CB-CZ 3.78Å; K49-F88 HydrophobicContact CD-CB 4.26Å; K49-F88 HydrophobicContact CD-CD1 3.45Å; K49-F88 VanDerWaalsContact CD-CD1 3.45Å; K49-F88 HydrophobicContact CD-CD2 3.77Å; K49-F88 HydrophobicContact CD-CE1 3.55Å; K49-F88 HydrophobicContact CD-CE2 3.85Å; K49-F88 HydrophobicContact CD-CG 3.55Å; K49-F88 HydrophobicContact CD-CZ 3.74Å; K49-F88 HydrophobicContact CG-CD2 4.21Å; K49-F88 HydrophobicContact CG-CE2 4.18Å; K49-F88 HydrophobicContact CG-CG 4.42Å; K49-F88 HydrophobicContact CG-CZ 4.41Å; L51-F88 HydrophobicContact CD1-CD2 4.26Å; L51-F88 HydrophobicContact CD1-CE2 3.84Å; L51-F88 HydrophobicContact CD1-CZ 4.34Å; L51-F88 HydrophobicContact CD2-CE2 3.79Å; L51-F88 HydrophobicContact CD2-CZ 3.67Å; L51-F88 HydrophobicContact CG-CD2 4.37Å; L51-F88 HydrophobicContact CG-CE2 3.53Å; L51-F88 HydrophobicContact CG-CZ 3.98Å; F88-A90 PolarHBondContact O-N 3.33Å; F88-L91 PolarHBondContact O-N 3.24Å; F88-Q92 HydrophobicContact CE1-CB 4.48Å; F88-Q92 WeakPolarHBondContact O-CB 3.13Å; F88-Q92 PolarHBondContact O-N 3.5Å
89	D	94.4	Very high	92.6	Very high	106 Å²	106	48.2 Å²	48.2	57%	0.567	25%	0.248	S	C	*	.	H	α-helix	trans	-65.2	-42.3	-177.2	-62.6	-28.7	0	0	0	111.3	G87 Q92 D93	G87-D89 VanDerWaalsContact C-N 3.32Å; G87-D89 PolarHBondContact O-N 3.49Å; D89-Q92 PolarHBondContact O-N 3.26Å; D89-D93 PolarHBondContact O-N 3.21Å
90	A	95.2	Very high	92.9	Very high	4 Å²	4	43 Å²	43	3%	0.033	23%	0.228	C	C	.	.	H	α-helix	trans	-66.1	-41.3	176.4	0	0	0	0	0	111.6	I86 G87 F88 D93 I94 V113 A116	I86-A90 HydrophobicContact CG2-CB 4.4Å; G87-A90 PolarHBondContact O-N 2.89Å; F88-A90 PolarHBondContact O-N 3.33Å; A90-D93 PolarHBondContact O-N 3.21Å; A90-I94 VanDerWaalsContact O-CG1 3.29Å; A90-I94 WeakPolarHBondContact O-CG1 3.39Å; A90-I94 PolarHBondContact O-N 3.28Å; A90-V113 HydrophobicContact CB-CG2 4.46Å; A90-A116 HydrophobicContact CB-CB 4.22Å
91	L	95.5	Very high	93	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.4	-47.5	174.7	-178.3	63	0	0	0	110.8	L44 A46 L51 I83 I86 G87 F88 D93 I94 I95	L44-L91 HydrophobicContact CB-CD2 4.29Å; L44-L91 HydrophobicContact CD1-CD1 4.42Å; A46-L91 HydrophobicContact CB-CD2 3.74Å; L51-L91 HydrophobicContact CD1-CD2 4.03Å; L51-L91 HydrophobicContact CD1-CG 4.02Å; I83-L91 HydrophobicContact CD1-CD1 3.84Å; I83-L91 HydrophobicContact CD1-CD2 3.87Å; I86-L91 HydrophobicContact CG2-CB 3.89Å; G87-L91 PolarHBondContact O-N 2.99Å; F88-L91 PolarHBondContact O-N 3.24Å; L91-D93 VanDerWaalsContact C-N 3.33Å; L91-D93 PolarHBondContact O-N 3.36Å; L91-I94 PolarHBondContact O-N 2.96Å; L91-I95 HydrophobicContact CD1-CD1 4.32Å; L91-I95 HydrophobicContact CD1-CG1 4.31Å; L91-I95 HydrophobicContact CG-CG1 4.42Å; L91-I95 VanDerWaalsContact O-CG1 3.32Å; L91-I95 WeakPolarHBondContact O-CG1 3.49Å; L91-I95 PolarHBondContact O-N 2.84Å
92	Q	95.1	Very high	93.2	Very high	71 Å²	71	48.8 Å²	48.8	33%	0.332	27%	0.267	S	S	.	.	H	α-helix	trans	-59.4	-43.5	178.7	-179.2	175	-50.2	0	0	111.8	L51 F88 D89 I95 N96	L51-Q92 HydrophobicContact CD1-CB 4.11Å; L51-Q92 HydrophobicContact CD2-CG 4.39Å; F88-Q92 HydrophobicContact CE1-CB 4.48Å; F88-Q92 WeakPolarHBondContact O-CB 3.13Å; F88-Q92 PolarHBondContact O-N 3.5Å; D89-Q92 PolarHBondContact O-N 3.26Å; Q92-I95 PolarHBondContact O-N 3.31Å; Q92-N96 WeakPolarHBondContact O-CB 3.43Å; Q92-N96 PolarHBondContact O-N 3.45Å; Q92-N96 PolarHBondContact O-ND2 3.35Å
93	D	95.4	Very high	93.4	Very high	52 Å²	52	46.3 Å²	46.3	28%	0.278	25%	0.253	S	S	.	.	H	α-helix	trans	-64.1	-40.7	177	-76.3	-18.6	0	0	0	112.1	D89 A90 L91 N96 F97 I103	D89-D93 PolarHBondContact O-N 3.21Å; A90-D93 PolarHBondContact O-N 3.21Å; L91-D93 VanDerWaalsContact C-N 3.33Å; L91-D93 PolarHBondContact O-N 3.36Å; D93-N96 PolarHBondContact O-N 2.99Å; D93-F97 WeakPolarHBondContact O-CB 3.48Å; D93-F97 PolarHBondContact O-N 2.92Å; D93-I103 HydrophobicContact CB-CD1 4.12Å
94	I	96	Very high	93.6	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-66	-42.1	175.3	-70.1	172.5	0	0	0	111.1	I62 A90 L91 N96 F97 V98 V113 A116 L120 I122 L125	I62-I94 HydrophobicContact CD1-CG2 4.14Å; A90-I94 VanDerWaalsContact O-CG1 3.29Å; A90-I94 WeakPolarHBondContact O-CG1 3.39Å; A90-I94 PolarHBondContact O-N 3.28Å; L91-I94 PolarHBondContact O-N 2.96Å; I94-N96 VanDerWaalsContact C-N 3.35Å; I94-F97 WeakPolarHBondContact O-CB 3.3Å; I94-F97 PolarHBondContact O-N 3.05Å; I94-V98 WeakPolarHBondContact O-CG2 3.42Å; I94-V98 PolarHBondContact O-N 3.26Å; I94-V113 HydrophobicContact CG1-CG1 4.42Å; I94-A116 HydrophobicContact CD1-CB 3.45Å; I94-A116 VanDerWaalsContact CD1-CB 3.45Å; I94-L120 HydrophobicContact CD1-CD1 4.07Å; I94-L120 HydrophobicContact CG2-CD1 3.97Å; I94-I122 HydrophobicContact CG2-CD1 3.6Å; I94-L125 HydrophobicContact CD1-CD2 4.41Å; I94-L125 HydrophobicContact CG1-CD2 3.86Å
95	I	95.2	Very high	94.1	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-64.3	-42.5	175.3	-62.2	-40.3	0	0	0	110.2	L44 L58 L91 Q92 F97 V98 Y99	L44-I95 HydrophobicContact CD1-CD1 4.03Å; L44-I95 HydrophobicContact CD1-CG1 4.24Å; L58-I95 HydrophobicContact CD2-CD1 3.58Å; L91-I95 HydrophobicContact CD1-CD1 4.32Å; L91-I95 HydrophobicContact CD1-CG1 4.31Å; L91-I95 HydrophobicContact CG-CG1 4.42Å; L91-I95 VanDerWaalsContact O-CG1 3.32Å; L91-I95 WeakPolarHBondContact O-CG1 3.49Å; L91-I95 PolarHBondContact O-N 2.84Å; Q92-I95 PolarHBondContact O-N 3.31Å; I95-F97 VanDerWaalsContact C-N 3.27Å; I95-F97 PolarHBondContact O-N 3.49Å; I95-V98 WeakPolarHBondContact O-CB 3.29Å; I95-V98 PolarHBondContact O-N 3.01Å; I95-Y99 HydrophobicContact CG2-CD2 4.15Å; I95-Y99 HydrophobicContact CG2-CE2 4.07Å; I95-Y99 VanDerWaalsContact O-CD2 3.3Å; I95-Y99 WeakPolarHBondContact O-CD2 3.43Å; I95-Y99 PolarHBondContact O-N 3.35Å
96	N	94.8	Very high	94.6	Very high	43 Å²	43	43.5 Å²	43.5	23%	0.23	24%	0.243	C	C	.	.	H	α-helix	trans	-60.2	-39.5	174.2	-71.5	-28.4	0	0	0	111.7	R34 Q92 D93 I94 Y99 T100	R34-N96 PolarHBondContact NH2-OD1 3.08Å; Q92-N96 WeakPolarHBondContact O-CB 3.43Å; Q92-N96 PolarHBondContact O-N 3.45Å; Q92-N96 PolarHBondContact O-ND2 3.35Å; D93-N96 PolarHBondContact O-N 2.99Å; I94-N96 VanDerWaalsContact C-N 3.35Å; N96-Y99 PolarHBondContact O-N 3.48Å; N96-T100 WeakPolarHBondContact O-CB 3.39Å; N96-T100 WeakPolarHBondContact O-CG2 3.48Å; N96-T100 PolarHBondContact O-N 3.42Å; N96-T100 PolarHBondContact O-OG1 2.95Å
97	F	95.5	Very high	94.5	Very high	42 Å²	42	47.5 Å²	47.5	18%	0.184	26%	0.264	C	S	.	.	H	α-helix	trans	-61.9	-44.8	174.5	169.1	-102.7	0	0	0	112.4	D93 I94 I95 Y99 T100 G101 K102 I103 I122 L125	D93-F97 WeakPolarHBondContact O-CB 3.48Å; D93-F97 PolarHBondContact O-N 2.92Å; I94-F97 WeakPolarHBondContact O-CB 3.3Å; I94-F97 PolarHBondContact O-N 3.05Å; I95-F97 VanDerWaalsContact C-N 3.27Å; I95-F97 PolarHBondContact O-N 3.49Å; F97-Y99 PolarHBondContact O-N 3.06Å; F97-T100 PolarHBondContact O-N 3.23Å; F97-G101 VanDerWaalsContact O-CA 3.3Å; F97-G101 WeakPolarHBondContact O-CA 3.36Å; F97-G101 PolarHBondContact O-N 2.85Å; F97-K102 WeakPolarHBondContact CA-O 3.38Å; F97-I103 HydrophobicContact CB-CB 4.18Å; F97-I103 HydrophobicContact CB-CD1 4.33Å; F97-I103 HydrophobicContact CD2-CB 4.03Å; F97-I103 HydrophobicContact CD2-CG2 4.12Å; F97-I103 HydrophobicContact CG-CB 4.42Å; F97-I122 HydrophobicContact CE1-CG2 4.27Å; F97-L125 HydrophobicContact CD1-CD2 4.27Å
98	V	94.9	Very high	94.5	Very high	10 Å²	10	53.5 Å²	53.5	6%	0.061	29%	0.285	C	S	.	.	H	α-helix	trans	-55.2	-39.1	178.2	159.4	0	0	0	0	112.4	V57 L58 T61 I62 I94 I95	V57-V98 HydrophobicContact CG1-CG1 3.65Å; L58-V98 HydrophobicContact CD2-CG1 4.41Å; T61-V98 HydrophobicContact CG2-CG1 4.07Å; T61-V98 WeakPolarHBondContact OG1-CG1 3.29Å; I62-V98 HydrophobicContact CD1-CG2 3.54Å; I62-V98 HydrophobicContact CG1-CG2 3.82Å; I94-V98 WeakPolarHBondContact O-CG2 3.42Å; I94-V98 PolarHBondContact O-N 3.26Å; I95-V98 WeakPolarHBondContact O-CB 3.29Å; I95-V98 PolarHBondContact O-N 3.01Å
99	Y	95	Very high	94.5	Very high	1 Å²	1	53.7 Å²	53.7	0%	0.004	29%	0.287	C	S	.	.	H	α-helix	trans	-85.5	-31.8	-178.7	-79.9	-96.1	0	0	0	113.5	F30 Q31 R34 H54 V57 I95 N96 F97	F30-Y99 HydrophobicContact CB-CD1 3.95Å; F30-Y99 HydrophobicContact CB-CE1 3.92Å; F30-Y99 WeakPolarHBondContact O-CE1 3.47Å; Q31-Y99 HydrophobicContact CB-CD1 4.26Å; R34-Y99 HydrophobicContact CB-CE1 4.03Å; R34-Y99 VanDerWaalsContact CD-CE2 3.48Å; H54-Y99 VanDerWaalsContact CB-OH 3.32Å; H54-Y99 WeakPolarHBondContact CB-OH 3.43Å; H54-Y99 PolarHBondContact N-OH 3.15Å; H54-Y99 AromaticContact ND1-CE1 3.85Å; H54-Y99 AromaticContact ND1-CZ 3.75Å; H54-Y99 PolarHBondContact ND1-OH 2.96Å; V57-Y99 HydrophobicContact CB-CE1 4.15Å; V57-Y99 HydrophobicContact CB-CE2 4.37Å; V57-Y99 HydrophobicContact CG1-CD1 4.18Å; V57-Y99 HydrophobicContact CG1-CD2 4.26Å; V57-Y99 HydrophobicContact CG1-CE1 3.85Å; V57-Y99 HydrophobicContact CG1-CE2 3.92Å; V57-Y99 HydrophobicContact CG1-CG 4.39Å; V57-Y99 HydrophobicContact CG2-CE1 3.97Å; I95-Y99 HydrophobicContact CG2-CD2 4.15Å; I95-Y99 HydrophobicContact CG2-CE2 4.07Å; I95-Y99 VanDerWaalsContact O-CD2 3.3Å; I95-Y99 WeakPolarHBondContact O-CD2 3.43Å; I95-Y99 PolarHBondContact O-N 3.35Å; N96-Y99 PolarHBondContact O-N 3.48Å; F97-Y99 PolarHBondContact O-N 3.06Å
100	T	93.6	Very high	94.5	Very high	48 Å²	48	48.6 Å²	48.6	29%	0.294	26%	0.26	S	S	.	.	H	α-helix	trans	-105.6	-18.5	-170.9	64.7	0	0	0	0	114.3	Q31 N96 F97 K102	Q31-T100 HydrophobicContact CG-CG2 4.15Å; N96-T100 WeakPolarHBondContact O-CB 3.39Å; N96-T100 WeakPolarHBondContact O-CG2 3.48Å; N96-T100 PolarHBondContact O-N 3.42Å; N96-T100 PolarHBondContact O-OG1 2.95Å; F97-T100 PolarHBondContact O-N 3.23Å; T100-K102 PolarHBondContact O-N 3Å; T100-K102 PolarHBondContact OG1-N 3.04Å; T100-K102 PolarHBondContact OG1-O 3.47Å
101	G	92.7	Very high	94.4	Very high	57 Å²	57	50 Å²	50	59%	0.588	27%	0.269	S	S	*	.	S	Bend	trans	67.8	13.7	-168.3	0	0	0	0	0	113.9	F97	F97-G101 VanDerWaalsContact O-CA 3.3Å; F97-G101 WeakPolarHBondContact O-CA 3.36Å; F97-G101 PolarHBondContact O-N 2.85Å
102	K	94.1	Very high	94.4	Very high	160 Å²	160	53 Å²	53	70%	0.696	29%	0.287	S	S	*	.			trans	-130.2	139.4	-173.6	-63.3	178.2	-175.9	177.6	0	111.1	F97 T100	F97-K102 WeakPolarHBondContact CA-O 3.38Å; T100-K102 PolarHBondContact O-N 3Å; T100-K102 PolarHBondContact OG1-N 3.04Å; T100-K102 PolarHBondContact OG1-O 3.47Å
103	I	95.5	Very high	94.4	Very high	47 Å²	47	49.6 Å²	49.6	24%	0.241	27%	0.272	C	S	.	.			trans	-143.7	144	174.1	-166.4	161.4	0	0	0	109.8	D93 F97 L105 V113 L125	D93-I103 HydrophobicContact CB-CD1 4.12Å; F97-I103 HydrophobicContact CB-CB 4.18Å; F97-I103 HydrophobicContact CB-CD1 4.33Å; F97-I103 HydrophobicContact CD2-CB 4.03Å; F97-I103 HydrophobicContact CD2-CG2 4.12Å; F97-I103 HydrophobicContact CG-CB 4.42Å; I103-L105 HydrophobicContact CD1-CD2 4.44Å; I103-L105 HydrophobicContact CG1-CD2 4.37Å; I103-L105 HydrophobicContact CG2-CD2 4.33Å; I103-L105 HydrophobicContact CG2-CG 4.34Å; I103-V113 HydrophobicContact CD1-CG1 3.69Å; I103-V113 HydrophobicContact CD1-CG2 4.33Å; I103-L125 HydrophobicContact CD1-CD1 4.12Å; I103-L125 HydrophobicContact CD1-CD2 4.23Å; I103-L125 HydrophobicContact CG2-CD1 3.78Å
104	L	95.1	Very high	94.5	Very high	141 Å²	141	47.1 Å²	47.1	74%	0.738	26%	0.258	S	S	*	.			trans	-102	111.5	175.5	-179.2	65.8	0	0	0	109.2	T106 S109	L104-T106 HydrophobicContact CG-CG2 4.46Å; L104-S109 PolarHBondContact O-OG 2.75Å
105	L	94.9	Very high	94.4	Very high	30 Å²	30	50 Å²	50	16%	0.157	27%	0.273	C	S	.	.			trans	-93	124.7	178.1	-60.5	176.8	0	0	0	110.4	I103 A110 V113 F132	I103-L105 HydrophobicContact CD1-CD2 4.44Å; I103-L105 HydrophobicContact CG1-CD2 4.37Å; I103-L105 HydrophobicContact CG2-CD2 4.33Å; I103-L105 HydrophobicContact CG2-CG 4.34Å; L105-A110 HydrophobicContact CB-CB 4.42Å; L105-V113 HydrophobicContact CD2-CB 4.41Å; L105-V113 HydrophobicContact CD2-CG1 4.09Å; L105-F132 HydrophobicContact CB-CD1 4.22Å; L105-F132 HydrophobicContact CB-CD2 4.32Å; L105-F132 HydrophobicContact CB-CG 4.12Å; L105-F132 HydrophobicContact CD1-CB 4.04Å; L105-F132 HydrophobicContact CD1-CG 4.47Å; L105-F132 WeakPolarHBondContact O-CZ 3.33Å
106	T	93.8	Very high	94.4	Very high	46 Å²	46	50.2 Å²	50.2	28%	0.282	27%	0.274	S	S	.	.			trans	-117.2	168.2	173.3	73.9	0	0	0	0	110.1	L104 Q108 S109 A110	L104-T106 HydrophobicContact CG-CG2 4.46Å; T106-Q108 PolarHBondContact O-N 2.81Å; T106-Q108 PolarHBondContact OG1-N 3Å; T106-Q108 PolarHBondContact OG1-OE1 2.89Å; T106-S109 PolarHBondContact N-OG 3.26Å; T106-S109 PolarHBondContact O-N 3.2Å; T106-S109 PolarHBondContact OG1-N 2.86Å; T106-S109 PolarHBondContact OG1-OG 2.7Å; T106-S109 VanDerWaalsContact OG1-OG 3.14Å; T106-A110 WeakPolarHBondContact O-CB 3.2Å; T106-A110 PolarHBondContact O-N 2.99Å
107	L	91.7	Very high	94.4	Very high	94 Å²	94	48.1 Å²	48.1	49%	0.492	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-24.7	173.7	-77.2	177.1	0	0	0	112.7	F132 K136	L107-F132 HydrophobicContact CD2-CE1 4.33Å; L107-K136 HydrophobicContact CD2-CB 3.72Å; L107-K136 HydrophobicContact CD2-CG 4.24Å
108	Q	91.6	Very high	94.4	Very high	156 Å²	156	47.5 Å²	47.5	73%	0.729	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-41.4	175.7	-60.5	91.5	7.1	0	0	112.5	T106	T106-Q108 PolarHBondContact O-N 2.81Å; T106-Q108 PolarHBondContact OG1-N 3Å; T106-Q108 PolarHBondContact OG1-OE1 2.89Å
109	S	93.8	Very high	94.3	Very high	18 Å²	18	50.8 Å²	50.8	13%	0.126	28%	0.278	C	S	.	.	H	α-helix	trans	-85.6	-30.8	-175.2	68.1	0	0	0	0	113.8	L104 T106 T112 V113	L104-S109 PolarHBondContact O-OG 2.75Å; T106-S109 PolarHBondContact N-OG 3.26Å; T106-S109 PolarHBondContact O-N 3.2Å; T106-S109 PolarHBondContact OG1-N 2.86Å; T106-S109 PolarHBondContact OG1-OG 2.7Å; T106-S109 VanDerWaalsContact OG1-OG 3.14Å; S109-T112 PolarHBondContact O-N 3.35Å; S109-T112 PolarHBondContact O-OG1 2.86Å; S109-V113 WeakPolarHBondContact O-CB 3.36Å; S109-V113 VanDerWaalsContact O-CG2 3.25Å; S109-V113 WeakPolarHBondContact O-CG2 3.44Å; S109-V113 PolarHBondContact O-N 3.27Å
110	A	94.8	Very high	94.2	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-58.9	-41.3	-174.6	0	0	0	0	0	113.9	L105 T106 L114 F132 L133	L105-A110 HydrophobicContact CB-CB 4.42Å; T106-A110 WeakPolarHBondContact O-CB 3.2Å; T106-A110 PolarHBondContact O-N 2.99Å; A110-L114 WeakPolarHBondContact O-CB 3.37Å; A110-L114 PolarHBondContact O-N 3.24Å; A110-F132 HydrophobicContact CB-CD1 3.72Å; A110-F132 HydrophobicContact CB-CE1 3.95Å; A110-L133 HydrophobicContact CB-CD2 3.86Å; A110-L133 HydrophobicContact CB-CG 4.33Å
111	P	93.6	Very high	94.2	Very high	32 Å²	32	53.8 Å²	53.8	21%	0.208	29%	0.288	C	S	.	.	H	α-helix	trans	-58.7	-48	174.9	-29	38.8	0	0	0	113.8	L114 M115 L148	P111-L114 PolarHBondContact O-N 3.2Å; P111-M115 WeakPolarHBondContact O-CG 3.42Å; P111-M115 PolarHBondContact O-N 3.24Å; P111-L148 HydrophobicContact CB-CD1 3.74Å; P111-L148 HydrophobicContact CB-CD2 4.18Å; P111-L148 HydrophobicContact CG-CD1 4.04Å
112	T	94.6	Very high	94.3	Very high	63 Å²	63	51.5 Å²	51.5	39%	0.387	26%	0.263	S	S	.	.	H	α-helix	trans	-71.4	-39.2	-176.8	54.2	0	0	0	0	111.4	S109 M115 A116	S109-T112 PolarHBondContact O-N 3.35Å; S109-T112 PolarHBondContact O-OG1 2.86Å; T112-M115 HydrophobicContact CG2-CE 4.3Å; T112-M115 PolarHBondContact O-N 3.41Å; T112-A116 VanDerWaalsContact O-CB 3.29Å; T112-A116 WeakPolarHBondContact O-CB 3.39Å; T112-A116 PolarHBondContact O-N 3.15Å
113	V	96.3	Very high	94.3	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.006	26%	0.26	C	S	.	.	H	α-helix	trans	-65	-39	173.9	174.7	0	0	0	0	111.1	A90 I94 I103 L105 S109 A116 S117 L125	A90-V113 HydrophobicContact CB-CG2 4.46Å; I94-V113 HydrophobicContact CG1-CG1 4.42Å; I103-V113 HydrophobicContact CD1-CG1 3.69Å; I103-V113 HydrophobicContact CD1-CG2 4.33Å; L105-V113 HydrophobicContact CD2-CB 4.41Å; L105-V113 HydrophobicContact CD2-CG1 4.09Å; S109-V113 WeakPolarHBondContact O-CB 3.36Å; S109-V113 VanDerWaalsContact O-CG2 3.25Å; S109-V113 WeakPolarHBondContact O-CG2 3.44Å; S109-V113 PolarHBondContact O-N 3.27Å; V113-A116 PolarHBondContact O-N 3.4Å; V113-S117 WeakPolarHBondContact O-CB 3.3Å; V113-S117 PolarHBondContact O-N 2.82Å; V113-S117 PolarHBondContact O-OG 3.04Å; V113-L125 HydrophobicContact CG1-CD1 4.19Å; V113-L125 HydrophobicContact CG1-CD2 3.85Å; V113-L125 HydrophobicContact CG1-CG 4.1Å
114	L	96.1	Very high	94.2	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-63.3	-46.1	175.8	176.5	61.2	0	0	0	112	A110 P111 A116 S117 A118 V126 C129 L133 L148	A110-L114 WeakPolarHBondContact O-CB 3.37Å; A110-L114 PolarHBondContact O-N 3.24Å; P111-L114 PolarHBondContact O-N 3.2Å; L114-A116 VanDerWaalsContact C-N 3.34Å; L114-S117 WeakPolarHBondContact CA-OG 3.33Å; L114-S117 PolarHBondContact O-N 3.16Å; L114-S117 PolarHBondContact O-OG 3.01Å; L114-S117 VanDerWaalsContact O-OG 3.04Å; L114-A118 WeakPolarHBondContact O-CB 3.34Å; L114-A118 PolarHBondContact O-N 3.24Å; L114-V126 HydrophobicContact CD1-CB 4.35Å; L114-V126 HydrophobicContact CD1-CG1 3.94Å; L114-V126 HydrophobicContact CD1-CG2 4.47Å; L114-C129 HydrophobicContact CB-CB 3.88Å; L114-C129 HydrophobicContact CD1-CB 3.85Å; L114-C129 HydrophobicContact CG-CB 4.34Å; L114-L133 HydrophobicContact CD2-CD1 3.67Å; L114-L148 HydrophobicContact CD2-CB 4.01Å; L114-L148 HydrophobicContact CD2-CD2 4.41Å
115	M	94.2	Very high	94.2	Very high	61 Å²	61	44.5 Å²	44.5	30%	0.3	24%	0.24	S	C	.	.	H	α-helix	trans	-63.5	-43.3	178.2	-70.1	-177.2	-67.3	0	0	111.3	P111 T112 Y119 L148 Y151	P111-M115 WeakPolarHBondContact O-CG 3.42Å; P111-M115 PolarHBondContact O-N 3.24Å; T112-M115 HydrophobicContact CG2-CE 4.3Å; T112-M115 PolarHBondContact O-N 3.41Å; M115-Y119 WeakPolarHBondContact O-CB 3.45Å; M115-Y119 PolarHBondContact O-N 3.26Å; M115-L148 HydrophobicContact CE-CD2 4.48Å; M115-L148 HydrophobicContact CG-CD2 3.74Å; M115-L148 HydrophobicContact SD-CD2 4.01Å; M115-Y151 HydrophobicContact CB-CD1 4.4Å; M115-Y151 HydrophobicContact CB-CE1 3.96Å; M115-Y151 HydrophobicContact CG-CD1 4.03Å; M115-Y151 HydrophobicContact CG-CE1 4.06Å
116	A	95.3	Very high	94.2	Very high	4 Å²	4	43.7 Å²	43.7	3%	0.033	24%	0.237	C	C	.	.	H	α-helix	trans	-68.3	-39.5	178.5	0	0	0	0	0	112.7	I86 A90 I94 T112 V113 L114 Y119 L120	I86-A116 HydrophobicContact CD1-CB 4.19Å; I86-A116 HydrophobicContact CG1-CB 4.31Å; I86-A116 HydrophobicContact CG2-CB 3.66Å; A90-A116 HydrophobicContact CB-CB 4.22Å; I94-A116 HydrophobicContact CD1-CB 3.45Å; I94-A116 VanDerWaalsContact CD1-CB 3.45Å; T112-A116 VanDerWaalsContact O-CB 3.29Å; T112-A116 WeakPolarHBondContact O-CB 3.39Å; T112-A116 PolarHBondContact O-N 3.15Å; V113-A116 PolarHBondContact O-N 3.4Å; L114-A116 VanDerWaalsContact C-N 3.34Å; A116-Y119 PolarHBondContact O-N 2.91Å; A116-L120 WeakPolarHBondContact O-CB 3.38Å; A116-L120 VanDerWaalsContact O-CG 3.28Å; A116-L120 WeakPolarHBondContact O-CG 3.35Å; A116-L120 PolarHBondContact O-N 3.07Å
117	S	95.3	Very high	94.2	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-69.8	-38	178.5	65.8	0	0	0	0	112.2	V113 L114 L120 Q121 I122 V126	V113-S117 WeakPolarHBondContact O-CB 3.3Å; V113-S117 PolarHBondContact O-N 2.82Å; V113-S117 PolarHBondContact O-OG 3.04Å; L114-S117 WeakPolarHBondContact CA-OG 3.33Å; L114-S117 PolarHBondContact O-N 3.16Å; L114-S117 PolarHBondContact O-OG 3.01Å; L114-S117 VanDerWaalsContact O-OG 3.04Å; S117-L120 PolarHBondContact O-N 2.86Å; S117-Q121 PolarHBondContact O-N 3.26Å; S117-I122 PolarHBondContact O-N 3.47Å; S117-V126 WeakPolarHBondContact OG-CG2 3.15Å
118	A	94.5	Very high	94.4	Very high	29 Å²	29	44.6 Å²	44.6	24%	0.24	25%	0.247	C	C	.	.	H	α-helix	trans	-64	-42.8	172.5	0	0	0	0	0	111.4	L114 Q121 V126 Y151	L114-A118 WeakPolarHBondContact O-CB 3.34Å; L114-A118 PolarHBondContact O-N 3.24Å; A118-Q121 PolarHBondContact O-N 3.39Å; A118-V126 HydrophobicContact CB-CG2 4.12Å; A118-Y151 HydrophobicContact CB-CD1 4.35Å; A118-Y151 HydrophobicContact CB-CE1 4.04Å
119	Y	93.2	Very high	94.6	Very high	79 Å²	79	37.2 Å²	37.2	31%	0.31	21%	0.212	S	C	.	.	H	α-helix	trans	-62.5	-44.5	175.5	-177.2	-88.1	0	0	0	112.3	Y64 I86 M115 A116 Q121	Y64-Y119 HydrophobicContact CE2-CE1 4.05Å; I86-Y119 HydrophobicContact CD1-CD1 3.77Å; I86-Y119 HydrophobicContact CD1-CE1 4.34Å; I86-Y119 HydrophobicContact CD1-CG 4.47Å; I86-Y119 HydrophobicContact CG1-CD1 4.29Å; M115-Y119 WeakPolarHBondContact O-CB 3.45Å; M115-Y119 PolarHBondContact O-N 3.26Å; A116-Y119 PolarHBondContact O-N 2.91Å; Y119-Q121 PolarHBondContact O-N 3.08Å
120	L	93.6	Very high	94.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-1.3	179.5	-66.2	173.9	0	0	0	113.9	I62 Y64 F65 I86 I94 A116 S117 I122	I62-L120 HydrophobicContact CG2-CB 4.01Å; I62-L120 WeakPolarHBondContact CG2-O 3.41Å; Y64-L120 HydrophobicContact CD1-CD2 3.64Å; Y64-L120 HydrophobicContact CE1-CD2 4.24Å; Y64-L120 HydrophobicContact CG-CD2 3.97Å; F65-L120 HydrophobicContact CE2-CD2 4.18Å; F65-L120 HydrophobicContact CZ-CD2 4.37Å; I86-L120 HydrophobicContact CD1-CD1 3.94Å; I86-L120 HydrophobicContact CD1-CD2 4.01Å; I86-L120 HydrophobicContact CD1-CG 3.78Å; I94-L120 HydrophobicContact CD1-CD1 4.07Å; I94-L120 HydrophobicContact CG2-CD1 3.97Å; A116-L120 WeakPolarHBondContact O-CB 3.38Å; A116-L120 VanDerWaalsContact O-CG 3.28Å; A116-L120 WeakPolarHBondContact O-CG 3.35Å; A116-L120 PolarHBondContact O-N 3.07Å; S117-L120 PolarHBondContact O-N 2.86Å; L120-I122 HydrophobicContact CB-CD1 4.04Å; L120-I122 HydrophobicContact CB-CG1 4Å; L120-I122 HydrophobicContact CD1-CD1 4.42Å
121	Q	93.1	Very high	94.6	Very high	111 Å²	111	38.1 Å²	38.1	52%	0.519	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	46.1	-179.6	-55.6	176.5	-0.2	0	0	113.5	P63 S117 A118 Y119	P63-Q121 HydrophobicContact CB-CB 4.26Å; P63-Q121 WeakPolarHBondContact CD-O 3.39Å; P63-Q121 HydrophobicContact CG-CB 4.31Å; P63-Q121 WeakPolarHBondContact CG-O 3.28Å; S117-Q121 PolarHBondContact O-N 3.26Å; A118-Q121 PolarHBondContact O-N 3.39Å; Y119-Q121 PolarHBondContact O-N 3.08Å
122	I	94.9	Very high	94.6	Very high	10 Å²	10	39.1 Å²	39.1	5%	0.051	22%	0.224	C	C	.	.			trans	-102.4	79.6	177.6	-48.4	175.7	0	0	0	109.3	I62 I94 F97 S117 L120 S124 L125 V126	I62-I122 HydrophobicContact CD1-CD1 3.81Å; I62-I122 HydrophobicContact CG1-CD1 3.75Å; I62-I122 HydrophobicContact CG1-CG1 4.17Å; I62-I122 HydrophobicContact CG2-CD1 4.46Å; I62-I122 HydrophobicContact CG2-CG1 4.32Å; I94-I122 HydrophobicContact CG2-CD1 3.6Å; F97-I122 HydrophobicContact CE1-CG2 4.27Å; S117-I122 PolarHBondContact O-N 3.47Å; L120-I122 HydrophobicContact CB-CD1 4.04Å; L120-I122 HydrophobicContact CB-CG1 4Å; L120-I122 HydrophobicContact CD1-CD1 4.42Å; I122-S124 VanDerWaalsContact C-N 3.3Å; I122-S124 PolarHBondContact O-N 3.25Å; I122-L125 HydrophobicContact CB-CB 4.21Å; I122-L125 HydrophobicContact CG2-CB 3.7Å; I122-L125 PolarHBondContact O-N 2.95Å; I122-V126 PolarHBondContact O-N 2.83Å
123	D	93.7	Very high	94.6	Very high	119 Å²	119	36.3 Å²	36.3	64%	0.636	21%	0.206	S	C	*	.	H	α-helix	trans	-56	-40.9	-172.5	-59.8	-35.3	0	0	0	113.3	L125 V126 D127	D123-L125 PolarHBondContact O-N 3.27Å; D123-V126 WeakPolarHBondContact O-CB 3.25Å; D123-V126 PolarHBondContact O-N 3.05Å; D123-V126 VanDerWaalsContact O-N 3.16Å; D123-D127 PolarHBondContact O-N 2.94Å
124	S	93.8	Very high	94.4	Very high	79 Å²	79	37.9 Å²	37.9	55%	0.552	21%	0.214	S	C	*	.	H	α-helix	trans	-60.9	-33.1	178.8	59.5	0	0	0	0	113.1	I122 A128	I122-S124 VanDerWaalsContact C-N 3.3Å; I122-S124 PolarHBondContact O-N 3.25Å; S124-A128 WeakPolarHBondContact O-CB 3.38Å; S124-A128 PolarHBondContact O-N 2.89Å
125	L	95.2	Very high	94.2	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-82.7	-33.9	177.9	-175.5	56.4	0	0	0	111.5	I94 F97 I103 V113 I122 D123 D127 A128 C129	I94-L125 HydrophobicContact CD1-CD2 4.41Å; I94-L125 HydrophobicContact CG1-CD2 3.86Å; F97-L125 HydrophobicContact CD1-CD2 4.27Å; I103-L125 HydrophobicContact CD1-CD1 4.12Å; I103-L125 HydrophobicContact CD1-CD2 4.23Å; I103-L125 HydrophobicContact CG2-CD1 3.78Å; V113-L125 HydrophobicContact CG1-CD1 4.19Å; V113-L125 HydrophobicContact CG1-CD2 3.85Å; V113-L125 HydrophobicContact CG1-CG 4.1Å; I122-L125 HydrophobicContact CB-CB 4.21Å; I122-L125 HydrophobicContact CG2-CB 3.7Å; I122-L125 PolarHBondContact O-N 2.95Å; D123-L125 PolarHBondContact O-N 3.27Å; L125-D127 VanDerWaalsContact C-N 3.34Å; L125-A128 PolarHBondContact O-N 3.41Å; L125-C129 WeakPolarHBondContact O-CB 3.19Å; L125-C129 PolarHBondContact O-N 2.88Å; L125-C129 PolarHBondContact O-SG 3.06Å
126	V	95.1	Very high	94	Very high	14 Å²	14	46.4 Å²	46.4	9%	0.085	26%	0.256	C	S	.	.	H	α-helix	trans	-58.4	-48.1	170.9	172	0	0	0	0	110.1	L114 S117 A118 I122 D123 A128 C129 N130	L114-V126 HydrophobicContact CD1-CB 4.35Å; L114-V126 HydrophobicContact CD1-CG1 3.94Å; L114-V126 HydrophobicContact CD1-CG2 4.47Å; S117-V126 WeakPolarHBondContact OG-CG2 3.15Å; A118-V126 HydrophobicContact CB-CG2 4.12Å; I122-V126 PolarHBondContact O-N 2.83Å; D123-V126 WeakPolarHBondContact O-CB 3.25Å; D123-V126 PolarHBondContact O-N 3.05Å; D123-V126 VanDerWaalsContact O-N 3.16Å; V126-A128 PolarHBondContact O-N 3.25Å; V126-C129 PolarHBondContact O-N 3.14Å; V126-N130 WeakPolarHBondContact CG1-ND2 3.3Å; V126-N130 WeakPolarHBondContact O-CB 3.4Å; V126-N130 PolarHBondContact O-N 3.24Å; V126-N130 PolarHBondContact O-ND2 3.43Å; V126-N130 VanDerWaalsContact O-ND2 3.15Å
127	D	94.3	Very high	93.7	Very high	112 Å²	112	48 Å²	48	60%	0.599	26%	0.263	S	S	*	.	H	α-helix	trans	-62.5	-44	177.9	-73	-23.6	0	0	0	112.3	D123 L125 C129 N130 G131	D123-D127 PolarHBondContact O-N 2.94Å; L125-D127 VanDerWaalsContact C-N 3.34Å; D127-C129 PolarHBondContact O-N 2.97Å; D127-N130 PolarHBondContact O-N 3.4Å; D127-G131 PolarHBondContact O-N 2.9Å
128	A	94.9	Very high	93.3	Very high	47 Å²	47	49.7 Å²	49.7	39%	0.388	28%	0.276	S	S	.	.	H	α-helix	trans	-62.6	-42.5	177	0	0	0	0	0	112.1	S124 L125 V126 G131 F132	S124-A128 WeakPolarHBondContact O-CB 3.38Å; S124-A128 PolarHBondContact O-N 2.89Å; L125-A128 PolarHBondContact O-N 3.41Å; V126-A128 PolarHBondContact O-N 3.25Å; A128-G131 PolarHBondContact O-N 3.38Å; A128-F132 PolarHBondContact O-N 2.92Å
129	C	95.7	Very high	92.6	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-65.3	-47.7	176.6	-68.9	0	0	0	0	111.4	L114 L125 V126 D127 G131 F132 L133	L114-C129 HydrophobicContact CB-CB 3.88Å; L114-C129 HydrophobicContact CD1-CB 3.85Å; L114-C129 HydrophobicContact CG-CB 4.34Å; L125-C129 WeakPolarHBondContact O-CB 3.19Å; L125-C129 PolarHBondContact O-N 2.88Å; L125-C129 PolarHBondContact O-SG 3.06Å; V126-C129 PolarHBondContact O-N 3.14Å; D127-C129 PolarHBondContact O-N 2.97Å; C129-G131 VanDerWaalsContact C-N 3.34Å; C129-G131 PolarHBondContact O-N 3.39Å; C129-F132 PolarHBondContact O-N 3.49Å; C129-L133 WeakPolarHBondContact O-CB 3.42Å; C129-L133 VanDerWaalsContact O-CG 3.26Å; C129-L133 WeakPolarHBondContact O-CG 3.47Å; C129-L133 PolarHBondContact O-N 3.5Å
130	N	94.3	Very high	92.1	Very high	8 Å²	8	56.7 Å²	56.7	4%	0.043	30%	0.296	C	S	.	.	H	α-helix	trans	-59.7	-44.3	176.6	-73.7	-36.2	0	0	0	111.3	V126 D127 F132 L133 I134 S152 C154	V126-N130 WeakPolarHBondContact CG1-ND2 3.3Å; V126-N130 WeakPolarHBondContact O-CB 3.4Å; V126-N130 PolarHBondContact O-N 3.24Å; V126-N130 PolarHBondContact O-ND2 3.43Å; V126-N130 VanDerWaalsContact O-ND2 3.15Å; D127-N130 PolarHBondContact O-N 3.4Å; N130-F132 VanDerWaalsContact C-N 3.34Å; N130-F132 PolarHBondContact O-N 2.82Å; N130-L133 PolarHBondContact O-N 2.89Å; N130-I134 WeakPolarHBondContact O-CB 3.46Å; N130-I134 WeakPolarHBondContact O-CG1 3.38Å; N130-I134 PolarHBondContact O-N 2.85Å; N130-S152 PolarHBondContact OD1-OG 3.14Å; N130-C154 WeakPolarHBondContact ND2-CB 3.1Å
131	G	94.1	Very high	91.7	Very high	30 Å²	30	57.9 Å²	57.9	31%	0.309	30%	0.303	S	S	.	.	H	α-helix	trans	-61	-38.7	176.1	0	0	0	0	0	113.4	D127 A128 C129 N135	D127-G131 PolarHBondContact O-N 2.9Å; A128-G131 PolarHBondContact O-N 3.38Å; C129-G131 VanDerWaalsContact C-N 3.34Å; C129-G131 PolarHBondContact O-N 3.39Å; G131-N135 PolarHBondContact O-ND2 3.33Å
132	F	95.1	Very high	91.4	Very high	53 Å²	53	52.9 Å²	52.9	23%	0.232	28%	0.279	C	S	.	.	H	α-helix	trans	-66	-46.8	173.6	176.9	-98.4	0	0	0	111.9	L105 L107 A110 A128 C129 N130 N135 K136	L105-F132 HydrophobicContact CB-CD1 4.22Å; L105-F132 HydrophobicContact CB-CD2 4.32Å; L105-F132 HydrophobicContact CB-CG 4.12Å; L105-F132 HydrophobicContact CD1-CB 4.04Å; L105-F132 HydrophobicContact CD1-CG 4.47Å; L105-F132 WeakPolarHBondContact O-CZ 3.33Å; L107-F132 HydrophobicContact CD2-CE1 4.33Å; A110-F132 HydrophobicContact CB-CD1 3.72Å; A110-F132 HydrophobicContact CB-CE1 3.95Å; A128-F132 PolarHBondContact O-N 2.92Å; C129-F132 PolarHBondContact O-N 3.49Å; N130-F132 VanDerWaalsContact C-N 3.34Å; N130-F132 PolarHBondContact O-N 2.82Å; F132-N135 PolarHBondContact O-N 3.15Å; F132-K136 HydrophobicContact CE1-CG 4.42Å; F132-K136 HydrophobicContact CE2-CG 4.42Å; F132-K136 HydrophobicContact CZ-CG 4.23Å; F132-K136 PolarHBondContact O-N 3.4Å
133	L	93.7	Very high	90.8	Very high	3 Å²	3	54.6 Å²	54.6	2%	0.016	29%	0.287	C	S	.	.	H	α-helix	trans	-66.6	-38.4	-177.1	-68.5	174.4	0	0	0	112.5	A110 L114 C129 N130 N135 K136 I137 L145 L148 L157	A110-L133 HydrophobicContact CB-CD2 3.86Å; A110-L133 HydrophobicContact CB-CG 4.33Å; L114-L133 HydrophobicContact CD2-CD1 3.67Å; C129-L133 WeakPolarHBondContact O-CB 3.42Å; C129-L133 VanDerWaalsContact O-CG 3.26Å; C129-L133 WeakPolarHBondContact O-CG 3.47Å; C129-L133 PolarHBondContact O-N 3.5Å; N130-L133 PolarHBondContact O-N 2.89Å; L133-N135 VanDerWaalsContact C-N 3.25Å; L133-N135 PolarHBondContact O-N 3.41Å; L133-K136 CarbonylContact O-C 3.42Å; L133-K136 PolarHBondContact O-N 3.25Å; L133-I137 PolarHBondContact O-N 3.22Å; L133-L145 HydrophobicContact CB-CD2 3.82Å; L133-L145 HydrophobicContact CD1-CD2 4.03Å; L133-L145 HydrophobicContact CD2-CD2 3.82Å; L133-L145 HydrophobicContact CG-CD2 4.09Å; L133-L148 HydrophobicContact CD1-CD1 4.3Å; L133-L157 HydrophobicContact CB-CD1 4.31Å; L133-L157 HydrophobicContact CB-CD2 4.49Å; L133-L157 HydrophobicContact CD1-CD2 4.36Å
134	I	92.1	Very high	90.6	Very high	34 Å²	34	52.5 Å²	52.5	17%	0.174	28%	0.276	C	S	.	.	H	α-helix	trans	-56.8	-40.6	175.4	-73.7	166.3	0	0	0	111.3	N130 K136 I137 Q156 L157 L160	N130-I134 WeakPolarHBondContact O-CB 3.46Å; N130-I134 WeakPolarHBondContact O-CG1 3.38Å; N130-I134 PolarHBondContact O-N 2.85Å; I134-K136 PolarHBondContact O-N 3.25Å; I134-I137 WeakPolarHBondContact O-CD1 3.42Å; I134-I137 WeakPolarHBondContact O-CG1 3.38Å; I134-Q156 HydrophobicContact CD1-CG 4.05Å; I134-L157 HydrophobicContact CG1-CB 4.33Å; I134-L157 HydrophobicContact CG1-CD1 3.85Å; I134-L160 HydrophobicContact CD1-CD1 4.49Å; I134-L160 HydrophobicContact CG1-CD1 4.26Å; I134-L160 HydrophobicContact CG2-CD1 3.58Å
135	N	91.4	Very high	90.4	Very high	133 Å²	133	48.9 Å²	48.9	71%	0.711	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-8.2	-179.7	-71.7	-52.1	0	0	0	113.8	G131 F132 L133	G131-N135 PolarHBondContact O-ND2 3.33Å; F132-N135 PolarHBondContact O-N 3.15Å; L133-N135 VanDerWaalsContact C-N 3.25Å; L133-N135 PolarHBondContact O-N 3.41Å
136	K	90.8	Very high	90.1	Very high	108 Å²	108	49.8 Å²	49.8	47%	0.47	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.7	22.1	-176.1	-59.7	-64.3	-179.3	-174.1	0	112.9	L107 F132 L133 I134 S138 N141	L107-K136 HydrophobicContact CD2-CB 3.72Å; L107-K136 HydrophobicContact CD2-CG 4.24Å; F132-K136 HydrophobicContact CE1-CG 4.42Å; F132-K136 HydrophobicContact CE2-CG 4.42Å; F132-K136 HydrophobicContact CZ-CG 4.23Å; F132-K136 PolarHBondContact O-N 3.4Å; L133-K136 CarbonylContact O-C 3.42Å; L133-K136 PolarHBondContact O-N 3.25Å; I134-K136 PolarHBondContact O-N 3.25Å; K136-S138 PolarHBondContact O-N 3.23Å; K136-N141 PolarHBondContact O-ND2 2.96Å
137	I	88.7	Confident	89.9	Confident	36 Å²	36	55.4 Å²	55.4	19%	0.185	28%	0.278	C	S	.	.			trans	-59.2	129.6	170.7	-62.6	168.1	0	0	0	109	L133 I134 L145 L160 F164	L133-I137 PolarHBondContact O-N 3.22Å; I134-I137 WeakPolarHBondContact O-CD1 3.42Å; I134-I137 WeakPolarHBondContact O-CG1 3.38Å; I137-L145 HydrophobicContact CB-CD1 4.21Å; I137-L145 HydrophobicContact CG1-CD1 3.73Å; I137-L145 HydrophobicContact CG2-CD1 4.43Å; I137-L160 HydrophobicContact CD1-CB 3.79Å; I137-F164 HydrophobicContact CG2-CB 4.03Å; I137-F164 HydrophobicContact CG2-CD1 3.9Å; I137-F164 HydrophobicContact CG2-CD2 4.09Å; I137-F164 HydrophobicContact CG2-CE1 4.39Å; I137-F164 HydrophobicContact CG2-CG 3.74Å
138	S	86.5	Confident	89.8	Confident	37 Å²	37	50.4 Å²	50.4	26%	0.259	25%	0.252	S	S	.	.			trans	-143.3	164.7	-179.6	79	0	0	0	0	110.1	K136 Y140 N141 I142	K136-S138 PolarHBondContact O-N 3.23Å; S138-Y140 PolarHBondContact O-N 2.87Å; S138-Y140 PolarHBondContact OG-N 2.69Å; S138-N141 WeakPolarHBondContact CA-OD1 3.47Å; S138-N141 PolarHBondContact N-OD1 2.95Å; S138-N141 PolarHBondContact O-N 3.24Å; S138-N141 PolarHBondContact O-OD1 3.39Å; S138-N141 VanDerWaalsContact OG-CG 3.24Å; S138-N141 PolarHBondContact OG-OD1 3.29Å; S138-I142 WeakPolarHBondContact O-CG1 3.14Å
139	R	81.1	Confident	89.6	Confident	118 Å²	118	48.2 Å²	48.2	45%	0.445	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-14	175.8	67.1	-176.8	174.8	-128.2	-2.6	115.1	Q175	R139-Q175 PolarHBondContact O-NE2 3.18Å
140	Y	82	Confident	89.4	Confident	136 Å²	136	54.4 Å²	54.4	53%	0.533	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-13.8	-175	-59.5	-72.7	0	0	0	113.6	S138 R177	S138-Y140 PolarHBondContact O-N 2.87Å; S138-Y140 PolarHBondContact OG-N 2.69Å; Y140-R177 PolarHBondContact O-NH1 3.29Å
141	N	85.2	Confident	89.2	Confident	26 Å²	26	59.3 Å²	59.3	14%	0.139	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.7	8.3	-174.2	63.3	-2.1	0	0	0	113.3	K136 S138 E143 D144 L145	K136-N141 PolarHBondContact O-ND2 2.96Å; S138-N141 WeakPolarHBondContact CA-OD1 3.47Å; S138-N141 PolarHBondContact N-OD1 2.95Å; S138-N141 PolarHBondContact O-N 3.24Å; S138-N141 PolarHBondContact O-OD1 3.39Å; S138-N141 VanDerWaalsContact OG-CG 3.24Å; S138-N141 PolarHBondContact OG-OD1 3.29Å; N141-E143 PolarHBondContact O-N 3.31Å; N141-D144 PolarHBondContact O-N 2.82Å; N141-L145 HydrophobicContact CB-CD1 4.45Å; N141-L145 HydrophobicContact CB-CG 4.37Å; N141-L145 WeakPolarHBondContact O-CB 3.27Å; N141-L145 WeakPolarHBondContact O-CG 3.26Å; N141-L145 PolarHBondContact O-N 3.2Å
142	I	86.7	Confident	89	Confident	5 Å²	5	58.7 Å²	58.7	3%	0.026	27%	0.27	C	S	.	.	H	α-helix	trans	-60.1	-50	-171.5	-48.1	176.1	0	0	0	112.2	S138 D144 L145 I146 A161 F164 M165	S138-I142 WeakPolarHBondContact O-CG1 3.14Å; I142-D144 PolarHBondContact O-N 3.31Å; I142-L145 PolarHBondContact O-N 3.4Å; I142-I146 HydrophobicContact CG2-CD1 4.07Å; I142-I146 WeakPolarHBondContact O-CG1 3.46Å; I142-I146 PolarHBondContact O-N 3.35Å; I142-A161 HydrophobicContact CG2-CB 4.16Å; I142-A161 WeakPolarHBondContact CG2-O 3.11Å; I142-F164 HydrophobicContact CD1-CD1 3.62Å; I142-F164 HydrophobicContact CD1-CE1 4.1Å; I142-F164 HydrophobicContact CG1-CD1 4.08Å; I142-M165 HydrophobicContact CB-CE 4.17Å; I142-M165 HydrophobicContact CG2-CB 3.99Å; I142-M165 HydrophobicContact CG2-CE 3.65Å; I142-M165 HydrophobicContact CG2-CG 4.49Å
143	E	83.3	Confident	88.8	Confident	47 Å²	47	63.2 Å²	63.2	22%	0.22	30%	0.297	C	S	.	.	H	α-helix	trans	-60.8	-46.5	-179.7	-66.9	175.7	167.3	0	0	111.4	N141 L145 I146 F147 M165 Y172 T181	N141-E143 PolarHBondContact O-N 3.31Å; E143-L145 VanDerWaalsContact C-N 3.27Å; E143-L145 PolarHBondContact O-N 2.71Å; E143-I146 PolarHBondContact O-N 3.45Å; E143-I146 VanDerWaalsContact O-N 3.14Å; E143-F147 PolarHBondContact O-N 3.07Å; E143-M165 HydrophobicContact CG-CE 4.1Å; E143-Y172 HydrophobicContact CG-CE2 3.98Å; E143-Y172 WeakPolarHBondContact CG-OH 3.32Å; E143-Y172 WeakPolarHBondContact OE1-CE2 3.22Å; E143-Y172 PolarHBondContact OE1-OH 2.83Å; E143-T181 PolarHBondContact OE1-OG1 2.94Å
144	D	87.7	Confident	88.6	Confident	75 Å²	75	64 Å²	64	40%	0.401	30%	0.303	S	S	.	.	H	α-helix	trans	-58.4	-43	178	-55.9	-42.2	0	0	0	110	N141 I142 F147 L148 R177	N141-D144 PolarHBondContact O-N 2.82Å; I142-D144 PolarHBondContact O-N 3.31Å; D144-F147 PolarHBondContact O-N 3.46Å; D144-L148 WeakPolarHBondContact O-CB 3.45Å; D144-L148 WeakPolarHBondContact O-CD1 3.16Å; D144-L148 WeakPolarHBondContact O-CG 3.39Å; D144-L148 PolarHBondContact O-N 3.21Å; D144-R177 IonicContact OD1-NH1 2.62Å; D144-R177 IonicContact OD2-CZ 3.1Å; D144-R177 IonicContact OD2-NH1 2.94Å; D144-R177 PolarHBondContact OD2-NH1 2.84Å
145	L	91.2	Very high	88.6	Confident	3 Å²	3	65.6 Å²	65.6	2%	0.016	32%	0.321	C	S	.	.	H	α-helix	trans	-67.8	-36.2	177.1	-69.9	179.9	0	0	0	113.4	L133 I137 N141 I142 E143 L148 G149 L157 A161	L133-L145 HydrophobicContact CB-CD2 3.82Å; L133-L145 HydrophobicContact CD1-CD2 4.03Å; L133-L145 HydrophobicContact CD2-CD2 3.82Å; L133-L145 HydrophobicContact CG-CD2 4.09Å; I137-L145 HydrophobicContact CB-CD1 4.21Å; I137-L145 HydrophobicContact CG1-CD1 3.73Å; I137-L145 HydrophobicContact CG2-CD1 4.43Å; N141-L145 HydrophobicContact CB-CD1 4.45Å; N141-L145 HydrophobicContact CB-CG 4.37Å; N141-L145 WeakPolarHBondContact O-CB 3.27Å; N141-L145 WeakPolarHBondContact O-CG 3.26Å; N141-L145 PolarHBondContact O-N 3.2Å; I142-L145 PolarHBondContact O-N 3.4Å; E143-L145 VanDerWaalsContact C-N 3.27Å; E143-L145 PolarHBondContact O-N 2.71Å; L145-L148 HydrophobicContact CD2-CD1 4.33Å; L145-G149 PolarHBondContact O-N 3.18Å; L145-L157 HydrophobicContact CB-CD1 4.41Å; L145-L157 HydrophobicContact CD2-CD1 4.42Å; L145-A161 HydrophobicContact CB-CB 4.4Å
146	I	88.7	Confident	88.6	Confident	21 Å²	21	65.1 Å²	65.1	11%	0.108	31%	0.314	C	S	.	.	H	α-helix	trans	-65.4	-44.8	174.3	-69.4	169	0	0	0	109.9	I142 E143 G149 K150 A161 M165	I142-I146 HydrophobicContact CG2-CD1 4.07Å; I142-I146 WeakPolarHBondContact O-CG1 3.46Å; I142-I146 PolarHBondContact O-N 3.35Å; E143-I146 PolarHBondContact O-N 3.45Å; E143-I146 VanDerWaalsContact O-N 3.14Å; I146-G149 PolarHBondContact O-N 3.44Å; I146-K150 HydrophobicContact CG2-CD 4.29Å; I146-K150 WeakPolarHBondContact O-CG 3.26Å; I146-K150 PolarHBondContact O-N 2.99Å; I146-A161 HydrophobicContact CD1-CB 4.36Å; I146-A161 HydrophobicContact CG1-CB 3.6Å; I146-M165 HydrophobicContact CD1-CE 3.49Å; I146-M165 VanDerWaalsContact CD1-CE 3.49Å; I146-M165 HydrophobicContact CD1-SD 4.3Å
147	F	89.9	Confident	88.6	Confident	131 Å²	131	60 Å²	60	58%	0.575	29%	0.292	S	S	*	.	H	α-helix	trans	-59.9	-49.4	176.2	176.1	-97	0	0	0	111.1	E143 D144 G149 K150 Y151	E143-F147 PolarHBondContact O-N 3.07Å; D144-F147 PolarHBondContact O-N 3.46Å; F147-G149 VanDerWaalsContact C-N 3.35Å; F147-G149 PolarHBondContact O-N 3.3Å; F147-K150 PolarHBondContact O-N 3.25Å; F147-Y151 WeakPolarHBondContact O-CB 3.3Å; F147-Y151 PolarHBondContact O-N 3.22Å
148	L	92.1	Very high	88.8	Confident	8 Å²	8	59.4 Å²	59.4	4%	0.042	29%	0.29	C	S	.	.	H	α-helix	trans	-61.1	-41.7	177.8	-71.4	167.9	0	0	0	112.3	P111 L114 M115 L133 D144 L145 Y151 S152	P111-L148 HydrophobicContact CB-CD1 3.74Å; P111-L148 HydrophobicContact CB-CD2 4.18Å; P111-L148 HydrophobicContact CG-CD1 4.04Å; L114-L148 HydrophobicContact CD2-CB 4.01Å; L114-L148 HydrophobicContact CD2-CD2 4.41Å; M115-L148 HydrophobicContact CE-CD2 4.48Å; M115-L148 HydrophobicContact CG-CD2 3.74Å; M115-L148 HydrophobicContact SD-CD2 4.01Å; L133-L148 HydrophobicContact CD1-CD1 4.3Å; D144-L148 WeakPolarHBondContact O-CB 3.45Å; D144-L148 WeakPolarHBondContact O-CD1 3.16Å; D144-L148 WeakPolarHBondContact O-CG 3.39Å; D144-L148 PolarHBondContact O-N 3.21Å; L145-L148 HydrophobicContact CD2-CD1 4.33Å; L148-Y151 PolarHBondContact O-N 3.42Å; L148-S152 WeakPolarHBondContact O-CB 3.44Å; L148-S152 PolarHBondContact O-N 2.82Å; L148-S152 PolarHBondContact O-OG 2.95Å; L148-S152 VanDerWaalsContact O-OG 3.06Å
149	G	91.3	Very high	89	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.01	30%	0.302	C	S	.	.	H	α-helix	trans	-66.2	-36.1	177.5	0	0	0	0	0	112.9	L145 I146 F147 N153 C154 V158	L145-G149 PolarHBondContact O-N 3.18Å; I146-G149 PolarHBondContact O-N 3.44Å; F147-G149 VanDerWaalsContact C-N 3.35Å; F147-G149 PolarHBondContact O-N 3.3Å; G149-N153 CarbonylContact O-C 3.58Å; G149-N153 PolarHBondContact O-N 3.44Å; G149-N153 VanDerWaalsContact O-N 3.15Å; G149-C154 PolarHBondContact O-N 3Å; G149-V158 VanDerWaalsContact C-CG2 3.44Å
150	K	91.3	Very high	89.4	Confident	130 Å²	130	59.9 Å²	59.9	57%	0.565	30%	0.298	S	S	*	.	H	α-helix	trans	-67.9	-41.2	171.7	-72.4	178.5	179.5	-177.8	0	111.3	I146 F147 N153 V158	I146-K150 HydrophobicContact CG2-CD 4.29Å; I146-K150 WeakPolarHBondContact O-CG 3.26Å; I146-K150 PolarHBondContact O-N 2.99Å; F147-K150 PolarHBondContact O-N 3.25Å; K150-N153 PolarHBondContact O-N 3.33Å; K150-V158 HydrophobicContact CG-CG2 4.12Å
151	Y	90.7	Very high	89.8	Confident	110 Å²	110	53.4 Å²	53.4	43%	0.431	27%	0.273	S	S	.	.	H	α-helix	trans	-64.1	-45	178.2	-174.4	-89.2	0	0	0	112.4	M115 A118 F147 L148 N153	M115-Y151 HydrophobicContact CB-CD1 4.4Å; M115-Y151 HydrophobicContact CB-CE1 3.96Å; M115-Y151 HydrophobicContact CG-CD1 4.03Å; M115-Y151 HydrophobicContact CG-CE1 4.06Å; A118-Y151 HydrophobicContact CB-CD1 4.35Å; A118-Y151 HydrophobicContact CB-CE1 4.04Å; F147-Y151 WeakPolarHBondContact O-CB 3.3Å; F147-Y151 PolarHBondContact O-N 3.22Å; L148-Y151 PolarHBondContact O-N 3.42Å; Y151-N153 VanDerWaalsContact C-N 3.26Å; Y151-N153 PolarHBondContact O-N 2.97Å
152	S	89.6	Confident	90	Very high	17 Å²	17	54.1 Å²	54.1	12%	0.119	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	2	179	69.2	0	0	0	0	114.1	N130 L148 C154	N130-S152 PolarHBondContact OD1-OG 3.14Å; L148-S152 WeakPolarHBondContact O-CB 3.44Å; L148-S152 PolarHBondContact O-N 2.82Å; L148-S152 PolarHBondContact O-OG 2.95Å; L148-S152 VanDerWaalsContact O-OG 3.06Å; S152-C154 PolarHBondContact O-N 2.87Å; S152-C154 WeakPolarHBondContact OG-CB 3.44Å
153	N	90.6	Very high	90	Very high	148 Å²	148	57.3 Å²	57.3	79%	0.791	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	32	-173.8	-161.6	27.4	0	0	0	113.8	G149 K150 Y151 A155	G149-N153 CarbonylContact O-C 3.58Å; G149-N153 PolarHBondContact O-N 3.44Å; G149-N153 VanDerWaalsContact O-N 3.15Å; K150-N153 PolarHBondContact O-N 3.33Å; Y151-N153 VanDerWaalsContact C-N 3.26Å; Y151-N153 PolarHBondContact O-N 2.97Å; N153-A155 PolarHBondContact O-N 3.41Å
154	C	90.6	Very high	90.3	Very high	21 Å²	21	57.8 Å²	57.8	14%	0.142	30%	0.298	C	S	.	.			trans	-92.5	90.4	178.9	-171.3	0	0	0	0	111.5	N130 G149 S152 Q156 L157 V158	N130-C154 WeakPolarHBondContact ND2-CB 3.1Å; G149-C154 PolarHBondContact O-N 3Å; S152-C154 PolarHBondContact O-N 2.87Å; S152-C154 WeakPolarHBondContact OG-CB 3.44Å; C154-Q156 PolarHBondContact O-N 3.35Å; C154-L157 HydrophobicContact CB-CB 4.15Å; C154-L157 PolarHBondContact O-N 3.29Å; C154-V158 PolarHBondContact O-N 3.23Å
155	A	91.4	Very high	90.3	Very high	66 Å²	66	54.9 Å²	54.9	55%	0.545	28%	0.282	S	S	.	.	H	α-helix	trans	-58.4	-33.5	179.2	0	0	0	0	0	113.4	N153 V158 N159	N153-A155 PolarHBondContact O-N 3.41Å; A155-V158 PolarHBondContact O-N 3.17Å; A155-N159 WeakPolarHBondContact O-CB 3.19Å; A155-N159 PolarHBondContact O-N 3.37Å; A155-N159 PolarHBondContact O-ND2 3.3Å
156	Q	91.5	Very high	90	Very high	124 Å²	124	55 Å²	55	58%	0.579	28%	0.282	S	S	*	.	H	α-helix	trans	-65.1	-45.7	179.1	-175.8	177.5	-7.2	0	0	112.1	I134 C154 N159 L160	I134-Q156 HydrophobicContact CD1-CG 4.05Å; C154-Q156 PolarHBondContact O-N 3.35Å; Q156-N159 PolarHBondContact O-N 3.41Å; Q156-L160 HydrophobicContact CG-CD1 4.04Å; Q156-L160 WeakPolarHBondContact O-CB 3.38Å; Q156-L160 WeakPolarHBondContact O-CG 3.33Å; Q156-L160 PolarHBondContact O-N 2.96Å
157	L	91.6	Very high	89.9	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-62.2	-44.9	177.7	178	60.4	0	0	0	110.7	L133 I134 L145 C154 L160 A161	L133-L157 HydrophobicContact CB-CD1 4.31Å; L133-L157 HydrophobicContact CB-CD2 4.49Å; L133-L157 HydrophobicContact CD1-CD2 4.36Å; I134-L157 HydrophobicContact CG1-CB 4.33Å; I134-L157 HydrophobicContact CG1-CD1 3.85Å; L145-L157 HydrophobicContact CB-CD1 4.41Å; L145-L157 HydrophobicContact CD2-CD1 4.42Å; C154-L157 HydrophobicContact CB-CB 4.15Å; C154-L157 PolarHBondContact O-N 3.29Å; L157-L160 PolarHBondContact O-N 2.94Å; L157-A161 VanDerWaalsContact O-CB 3.26Å; L157-A161 WeakPolarHBondContact O-CB 3.42Å; L157-A161 PolarHBondContact O-N 3.34Å
158	V	91.7	Very high	89.6	Confident	23 Å²	23	56.9 Å²	56.9	14%	0.139	29%	0.288	C	S	.	.	H	α-helix	trans	-61	-50.5	177.8	177.7	0	0	0	0	111	G149 K150 C154 A155 L160 A161 C162	G149-V158 VanDerWaalsContact C-CG2 3.44Å; K150-V158 HydrophobicContact CG-CG2 4.12Å; C154-V158 PolarHBondContact O-N 3.23Å; A155-V158 PolarHBondContact O-N 3.17Å; V158-L160 PolarHBondContact O-N 3.02Å; V158-A161 PolarHBondContact O-N 2.93Å; V158-C162 WeakPolarHBondContact O-CB 3.47Å; V158-C162 PolarHBondContact O-N 2.92Å; V158-C162 PolarHBondContact O-SG 2.91Å
159	N	90.4	Very high	89.3	Confident	97 Å²	97	56.5 Å²	56.5	52%	0.519	29%	0.286	S	S	.	.	H	α-helix	trans	-61.5	-42.6	-178.5	-74	-25.9	0	0	0	112.2	A155 Q156 N163	A155-N159 WeakPolarHBondContact O-CB 3.19Å; A155-N159 PolarHBondContact O-N 3.37Å; A155-N159 PolarHBondContact O-ND2 3.3Å; Q156-N159 PolarHBondContact O-N 3.41Å; N159-N163 WeakPolarHBondContact O-CB 3.4Å; N159-N163 PolarHBondContact O-N 3.25Å; N159-N163 PolarHBondContact O-ND2 3.43Å
160	L	90.4	Very high	88.9	Confident	68 Å²	68	60 Å²	60	36%	0.356	30%	0.304	S	S	.	.	H	α-helix	trans	-67.2	-42.3	177.5	-70.9	175.1	0	0	0	111.8	I134 I137 Q156 L157 V158 N163 F164	I134-L160 HydrophobicContact CD1-CD1 4.49Å; I134-L160 HydrophobicContact CG1-CD1 4.26Å; I134-L160 HydrophobicContact CG2-CD1 3.58Å; I137-L160 HydrophobicContact CD1-CB 3.79Å; Q156-L160 HydrophobicContact CG-CD1 4.04Å; Q156-L160 WeakPolarHBondContact O-CB 3.38Å; Q156-L160 WeakPolarHBondContact O-CG 3.33Å; Q156-L160 PolarHBondContact O-N 2.96Å; L157-L160 PolarHBondContact O-N 2.94Å; V158-L160 PolarHBondContact O-N 3.02Å; L160-N163 PolarHBondContact O-N 2.65Å; L160-F164 WeakPolarHBondContact O-CB 3.06Å; L160-F164 PolarHBondContact O-N 3.24Å
161	A	91	Very high	88.5	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-65.1	-43	177	0	0	0	0	0	111.9	I142 L145 I146 L157 V158 F164 M165	I142-A161 HydrophobicContact CG2-CB 4.16Å; I142-A161 WeakPolarHBondContact CG2-O 3.11Å; L145-A161 HydrophobicContact CB-CB 4.4Å; I146-A161 HydrophobicContact CD1-CB 4.36Å; I146-A161 HydrophobicContact CG1-CB 3.6Å; L157-A161 VanDerWaalsContact O-CB 3.26Å; L157-A161 WeakPolarHBondContact O-CB 3.42Å; L157-A161 PolarHBondContact O-N 3.34Å; V158-A161 PolarHBondContact O-N 2.93Å; A161-F164 PolarHBondContact O-N 3.38Å; A161-M165 PolarHBondContact O-N 3.14Å
162	C	88.6	Confident	88.1	Confident	42 Å²	42	53.3 Å²	53.3	28%	0.284	28%	0.279	S	S	.	.	H	α-helix	trans	-63	-46.9	175	-69.8	0	0	0	0	112	V158 F164 M165 L166	V158-C162 WeakPolarHBondContact O-CB 3.47Å; V158-C162 PolarHBondContact O-N 2.92Å; V158-C162 PolarHBondContact O-SG 2.91Å; C162-F164 PolarHBondContact O-N 3.49Å; C162-M165 WeakPolarHBondContact O-CA 3.26Å; C162-M165 WeakPolarHBondContact O-CB 3.26Å; C162-M165 PolarHBondContact O-N 3.35Å; C162-M165 VanDerWaalsContact O-N 3.08Å; C162-L166 WeakPolarHBondContact O-CG 3.47Å; C162-L166 PolarHBondContact O-N 3.36Å
163	N	87.4	Confident	87.9	Confident	71 Å²	71	53 Å²	53	38%	0.38	28%	0.277	S	S	.	.	H	α-helix	trans	-59.9	-37.7	175.7	-74.6	-37.9	0	0	0	111.9	N159 L160 K167	N159-N163 WeakPolarHBondContact O-CB 3.4Å; N159-N163 PolarHBondContact O-N 3.25Å; N159-N163 PolarHBondContact O-ND2 3.43Å; L160-N163 PolarHBondContact O-N 2.65Å; N163-K167 WeakPolarHBondContact O-CB 3.49Å; N163-K167 PolarHBondContact O-N 2.93Å; N163-K167 VanDerWaalsContact O-N 3.12Å
164	F	88.3	Confident	87.7	Confident	57 Å²	57	50 Å²	50	25%	0.25	26%	0.263	C	S	.	.	H	α-helix	trans	-67.9	-39.5	174.8	-163.7	-88.2	0	0	0	111.6	I137 I142 L160 A161 C162 K167 Y168	I137-F164 HydrophobicContact CG2-CB 4.03Å; I137-F164 HydrophobicContact CG2-CD1 3.9Å; I137-F164 HydrophobicContact CG2-CD2 4.09Å; I137-F164 HydrophobicContact CG2-CE1 4.39Å; I137-F164 HydrophobicContact CG2-CG 3.74Å; I142-F164 HydrophobicContact CD1-CD1 3.62Å; I142-F164 HydrophobicContact CD1-CE1 4.1Å; I142-F164 HydrophobicContact CG1-CD1 4.08Å; L160-F164 WeakPolarHBondContact O-CB 3.06Å; L160-F164 PolarHBondContact O-N 3.24Å; A161-F164 PolarHBondContact O-N 3.38Å; C162-F164 PolarHBondContact O-N 3.49Å; F164-K167 PolarHBondContact O-N 3.48Å; F164-Y168 AromaticContact CD1-CD2 3.81Å; F164-Y168 HydrophobicContact CD1-CD2 3.81Å; F164-Y168 HydrophobicContact CD1-CE2 4.32Å; F164-Y168 HydrophobicContact CD2-CD2 4.22Å; F164-Y168 AromaticContact CD2-CE2 3.99Å; F164-Y168 HydrophobicContact CD2-CE2 3.99Å; F164-Y168 AromaticContact CE1-CD2 3.52Å; F164-Y168 HydrophobicContact CE1-CD2 3.52Å; F164-Y168 AromaticContact CE1-CE2 3.85Å; F164-Y168 HydrophobicContact CE1-CE2 3.85Å; F164-Y168 HydrophobicContact CE1-CG 4.42Å; F164-Y168 AromaticContact CE2-CD2 3.98Å; F164-Y168 HydrophobicContact CE2-CD2 3.98Å; F164-Y168 AromaticContact CE2-CE2 3.49Å; F164-Y168 HydrophobicContact CE2-CE2 3.49Å; F164-Y168 VanDerWaalsContact CE2-CE2 3.49Å; F164-Y168 HydrophobicContact CG-CD2 4.15Å; F164-Y168 HydrophobicContact CG-CE2 4.39Å; F164-Y168 AromaticContact CZ-CD2 3.61Å; F164-Y168 HydrophobicContact CZ-CD2 3.61Å; F164-Y168 AromaticContact CZ-CE2 3.41Å; F164-Y168 HydrophobicContact CZ-CE2 3.41Å; F164-Y168 VanDerWaalsContact CZ-CE2 3.41Å; F164-Y168 WeakPolarHBondContact O-CD2 3.36Å; F164-Y168 PolarHBondContact O-N 2.99Å; F164-Y168 VanDerWaalsContact O-N 3.13Å
165	M	87.2	Confident	87.3	Confident	14 Å²	14	50.9 Å²	50.9	7%	0.069	27%	0.266	C	S	.	.	H	α-helix	trans	-59.9	-47.2	173.8	-164.7	177.1	-82.7	0	0	111.7	I142 E143 I146 A161 C162 K167 Y168 F169 Y172 L189	I142-M165 HydrophobicContact CB-CE 4.17Å; I142-M165 HydrophobicContact CG2-CB 3.99Å; I142-M165 HydrophobicContact CG2-CE 3.65Å; I142-M165 HydrophobicContact CG2-CG 4.49Å; E143-M165 HydrophobicContact CG-CE 4.1Å; I146-M165 HydrophobicContact CD1-CE 3.49Å; I146-M165 VanDerWaalsContact CD1-CE 3.49Å; I146-M165 HydrophobicContact CD1-SD 4.3Å; A161-M165 PolarHBondContact O-N 3.14Å; C162-M165 WeakPolarHBondContact O-CA 3.26Å; C162-M165 WeakPolarHBondContact O-CB 3.26Å; C162-M165 PolarHBondContact O-N 3.35Å; C162-M165 VanDerWaalsContact O-N 3.08Å; M165-K167 VanDerWaalsContact C-N 3.32Å; M165-K167 PolarHBondContact O-N 3.25Å; M165-Y168 CarbonylContact O-C 3.56Å; M165-Y168 PolarHBondContact O-N 3.1Å; M165-F169 VanDerWaalsContact O-CA 3.31Å; M165-F169 WeakPolarHBondContact O-CA 3.47Å; M165-F169 PolarHBondContact O-N 2.93Å; M165-Y172 HydrophobicContact CE-CE1 4.12Å; M165-Y172 HydrophobicContact CE-CE2 4.42Å; M165-Y172 HydrophobicContact CG-CD1 4.01Å; M165-Y172 HydrophobicContact CG-CE1 4.1Å; M165-Y172 HydrophobicContact SD-CD1 4.31Å; M165-Y172 HydrophobicContact SD-CE1 3.79Å; M165-L189 HydrophobicContact CB-CD1 4.31Å; M165-L189 HydrophobicContact CG-CD1 3.84Å; M165-L189 HydrophobicContact CG-CD2 4.3Å; M165-L189 HydrophobicContact SD-CD1 3.72Å; M165-L189 HydrophobicContact SD-CD2 3.83Å; M165-L189 HydrophobicContact SD-CG 4.41Å
166	L	86.8	Confident	87	Confident	5 Å²	5	55.2 Å²	55.2	3%	0.026	28%	0.275	C	S	.	.	H	α-helix	trans	-61.6	-40	179.4	-69.7	166.7	0	0	0	112.1	C162 L189 D192 K194 L195 V196	C162-L166 WeakPolarHBondContact O-CG 3.47Å; C162-L166 PolarHBondContact O-N 3.36Å; L166-L189 HydrophobicContact CD2-CD1 3.56Å; L166-L189 HydrophobicContact CD2-CG 4.46Å; L166-L189 HydrophobicContact CG-CD1 4.09Å; L166-D192 HydrophobicContact CD1-CB 4.15Å; L166-D192 VanDerWaalsContact CD1-OD2 3.3Å; L166-D192 WeakPolarHBondContact CD1-OD2 3.32Å; L166-D192 HydrophobicContact CD2-CB 3.71Å; L166-K194 HydrophobicContact CD1-CB 4.18Å; L166-L195 HydrophobicContact CD2-CB 4.28Å; L166-L195 HydrophobicContact CD2-CD1 3.75Å; L166-V196 PolarHBondContact O-N 3.27Å; L166-V196 VanDerWaalsContact O-N 3.13Å
167	K	85.4	Confident	86.5	Confident	119 Å²	119	53.9 Å²	53.9	52%	0.517	26%	0.264	S	S	.	.	H	α-helix	trans	-67	-36.4	178.1	-175.8	178.8	177.5	-172.5	0	113.1	N163 F164 M165	N163-K167 WeakPolarHBondContact O-CB 3.49Å; N163-K167 PolarHBondContact O-N 2.93Å; N163-K167 VanDerWaalsContact O-N 3.12Å; F164-K167 PolarHBondContact O-N 3.48Å; M165-K167 VanDerWaalsContact C-N 3.32Å; M165-K167 PolarHBondContact O-N 3.25Å
168	Y	83.5	Confident	86.2	Confident	74 Å²	74	54 Å²	54	29%	0.29	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	22	-177.3	-66.3	-75.9	0	0	0	113	F164 M165 L170 Q171 Y172	F164-Y168 AromaticContact CD1-CD2 3.81Å; F164-Y168 HydrophobicContact CD1-CD2 3.81Å; F164-Y168 HydrophobicContact CD1-CE2 4.32Å; F164-Y168 HydrophobicContact CD2-CD2 4.22Å; F164-Y168 AromaticContact CD2-CE2 3.99Å; F164-Y168 HydrophobicContact CD2-CE2 3.99Å; F164-Y168 AromaticContact CE1-CD2 3.52Å; F164-Y168 HydrophobicContact CE1-CD2 3.52Å; F164-Y168 AromaticContact CE1-CE2 3.85Å; F164-Y168 HydrophobicContact CE1-CE2 3.85Å; F164-Y168 HydrophobicContact CE1-CG 4.42Å; F164-Y168 AromaticContact CE2-CD2 3.98Å; F164-Y168 HydrophobicContact CE2-CD2 3.98Å; F164-Y168 AromaticContact CE2-CE2 3.49Å; F164-Y168 HydrophobicContact CE2-CE2 3.49Å; F164-Y168 VanDerWaalsContact CE2-CE2 3.49Å; F164-Y168 HydrophobicContact CG-CD2 4.15Å; F164-Y168 HydrophobicContact CG-CE2 4.39Å; F164-Y168 AromaticContact CZ-CD2 3.61Å; F164-Y168 HydrophobicContact CZ-CD2 3.61Å; F164-Y168 AromaticContact CZ-CE2 3.41Å; F164-Y168 HydrophobicContact CZ-CE2 3.41Å; F164-Y168 VanDerWaalsContact CZ-CE2 3.41Å; F164-Y168 WeakPolarHBondContact O-CD2 3.36Å; F164-Y168 PolarHBondContact O-N 2.99Å; F164-Y168 VanDerWaalsContact O-N 3.13Å; M165-Y168 CarbonylContact O-C 3.56Å; M165-Y168 PolarHBondContact O-N 3.1Å; Y168-L170 VanDerWaalsContact C-N 3.28Å; Y168-L170 PolarHBondContact O-N 3.41Å; Y168-Q171 PolarHBondContact O-N 3.43Å; Y168-Y172 PolarHBondContact O-N 3.22Å
169	F	86.1	Confident	85.9	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-53.2	-43.5	-174.1	173.7	-104.8	0	0	0	112.9	M165 Q171 Y172 S173 F178 L189 L190 L195 V197 A206	M165-F169 VanDerWaalsContact O-CA 3.31Å; M165-F169 WeakPolarHBondContact O-CA 3.47Å; M165-F169 PolarHBondContact O-N 2.93Å; F169-Q171 VanDerWaalsContact C-N 3.3Å; F169-Q171 PolarHBondContact O-N 2.9Å; F169-Y172 PolarHBondContact O-N 3.02Å; F169-Y172 VanDerWaalsContact O-N 3.11Å; F169-S173 WeakPolarHBondContact O-CB 3.38Å; F169-S173 PolarHBondContact O-N 3.43Å; F169-F178 HydrophobicContact CE2-CE2 4.18Å; F169-L189 HydrophobicContact CD2-CD2 3.66Å; F169-L189 HydrophobicContact CD2-CG 4.09Å; F169-L189 HydrophobicContact CE2-CD2 3.64Å; F169-L189 HydrophobicContact CE2-CG 4.19Å; F169-L190 HydrophobicContact CE2-CD2 4.34Å; F169-L190 HydrophobicContact CZ-CD2 3.86Å; F169-L195 HydrophobicContact CB-CD1 3.63Å; F169-L195 HydrophobicContact CD1-CD1 3.83Å; F169-L195 HydrophobicContact CD1-CD2 4.32Å; F169-L195 HydrophobicContact CD1-CG 4.27Å; F169-L195 HydrophobicContact CD2-CD1 3.77Å; F169-L195 HydrophobicContact CE1-CD1 4.42Å; F169-L195 HydrophobicContact CE1-CD2 4.33Å; F169-L195 HydrophobicContact CE2-CD1 4.37Å; F169-L195 HydrophobicContact CG-CD1 3.46Å; F169-L195 VanDerWaalsContact CG-CD1 3.46Å; F169-L195 HydrophobicContact CG-CG 4.36Å; F169-V197 HydrophobicContact CD1-CG1 3.64Å; F169-V197 HydrophobicContact CE1-CG1 4.13Å; F169-A206 HydrophobicContact CE1-CB 4.05Å; F169-A206 HydrophobicContact CZ-CB 3.77Å
170	L	83.1	Confident	85.6	Confident	73 Å²	73	57.7 Å²	57.7	38%	0.382	28%	0.279	S	S	.	.	H	α-helix	trans	-59.1	-42.4	-180	-172.7	66.4	0	0	0	111.9	Y168 S173 D202	Y168-L170 VanDerWaalsContact C-N 3.28Å; Y168-L170 PolarHBondContact O-N 3.41Å; L170-S173 PolarHBondContact O-OG 3.5Å; L170-D202 HydrophobicContact CD1-CB 3.92Å
171	Q	81.8	Confident	85.3	Confident	93 Å²	93	55.2 Å²	55.2	44%	0.435	27%	0.266	S	S	.	.	H	α-helix	trans	-73.9	-29.4	177.7	-63.6	-179.4	9.1	0	0	112.6	Y168 F169 T174 Q175	Y168-Q171 PolarHBondContact O-N 3.43Å; F169-Q171 VanDerWaalsContact C-N 3.3Å; F169-Q171 PolarHBondContact O-N 2.9Å; Q171-T174 PolarHBondContact O-OG1 3.47Å; Q171-Q175 WeakPolarHBondContact O-CG 3.45Å
172	Y	84	Confident	85.1	Confident	8 Å²	8	57.6 Å²	57.6	3%	0.031	28%	0.283	C	S	.	.	H	α-helix	trans	-72.1	-40.4	174.9	173.3	-118.4	0	0	0	111.2	E143 M165 Y168 F169 T174 Q175 F178 T181 L189	E143-Y172 HydrophobicContact CG-CE2 3.98Å; E143-Y172 WeakPolarHBondContact CG-OH 3.32Å; E143-Y172 WeakPolarHBondContact OE1-CE2 3.22Å; E143-Y172 PolarHBondContact OE1-OH 2.83Å; M165-Y172 HydrophobicContact CE-CE1 4.12Å; M165-Y172 HydrophobicContact CE-CE2 4.42Å; M165-Y172 HydrophobicContact CG-CD1 4.01Å; M165-Y172 HydrophobicContact CG-CE1 4.1Å; M165-Y172 HydrophobicContact SD-CD1 4.31Å; M165-Y172 HydrophobicContact SD-CE1 3.79Å; Y168-Y172 PolarHBondContact O-N 3.22Å; F169-Y172 PolarHBondContact O-N 3.02Å; F169-Y172 VanDerWaalsContact O-N 3.11Å; Y172-T174 PolarHBondContact O-N 2.91Å; Y172-T174 VanDerWaalsContact O-N 3.08Å; Y172-Q175 WeakPolarHBondContact O-CB 3.33Å; Y172-Q175 PolarHBondContact O-N 3.4Å; Y172-F178 AromaticContact CD1-CD2 3.84Å; Y172-F178 HydrophobicContact CD1-CD2 3.84Å; Y172-F178 HydrophobicContact CD1-CE2 4.47Å; Y172-F178 AromaticContact CE1-CD2 3.5Å; Y172-F178 HydrophobicContact CE1-CD2 3.5Å; Y172-F178 VanDerWaalsContact CE1-CD2 3.5Å; Y172-F178 HydrophobicContact CE1-CE2 4.2Å; Y172-F178 HydrophobicContact CE1-CG 4.48Å; Y172-F178 HydrophobicContact CE2-CB 4.47Å; Y172-F178 WeakPolarHBondContact O-CB 3.49Å; Y172-T181 PolarHBondContact OH-OG1 3.47Å; Y172-L189 HydrophobicContact CD1-CD2 4.35Å; Y172-L189 HydrophobicContact CE1-CD2 4.04Å
173	S	84.3	Confident	85.1	Confident	10 Å²	10	58 Å²	58	7%	0.07	28%	0.279	C	S	.	.	H	α-helix	trans	-60.6	-21.5	179.3	78	0	0	0	0	114.1	F169 L170 R209	F169-S173 WeakPolarHBondContact O-CB 3.38Å; F169-S173 PolarHBondContact O-N 3.43Å; L170-S173 PolarHBondContact O-OG 3.5Å; S173-R209 VanDerWaalsContact O-CD 3.31Å; S173-R209 WeakPolarHBondContact O-CD 3.31Å; S173-R209 PolarHBondContact O-NE 3.33Å
174	T	85.8	Confident	85.1	Confident	84 Å²	84	60.1 Å²	60.1	52%	0.515	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-13	177.9	58.4	0	0	0	0	113.5	Q171 Y172 R209	Q171-T174 PolarHBondContact O-OG1 3.47Å; Y172-T174 PolarHBondContact O-N 2.91Å; Y172-T174 VanDerWaalsContact O-N 3.08Å; T174-R209 PolarHBondContact O-NH2 3.02Å
175	Q	84.1	Confident	84.9	Confident	40 Å²	40	59.8 Å²	59.8	19%	0.187	29%	0.291	C	S	.	.	S	Bend	trans	-77.4	158.2	179.3	-60.5	-179.8	11.5	0	0	111.6	R139 Q171 Y172 R177	R139-Q175 PolarHBondContact O-NE2 3.18Å; Q171-Q175 WeakPolarHBondContact O-CG 3.45Å; Y172-Q175 WeakPolarHBondContact O-CB 3.33Å; Y172-Q175 PolarHBondContact O-N 3.4Å; Q175-R177 VanDerWaalsContact C-N 3.35Å
176	E	84.5	Confident	84.9	Confident	158 Å²	158	59.1 Å²	59.1	74%	0.738	29%	0.287	S	S	*	.	S	Bend	trans	-71.2	-31.3	174.2	-67.4	-174.3	169.3	0	0	112.4	F178 L179	E176-F178 PolarHBondContact O-N 3.48Å; E176-L179 WeakPolarHBondContact O-CA 3.46Å; E176-L179 WeakPolarHBondContact O-CB 3.22Å; E176-L179 PolarHBondContact O-N 3.03Å
177	R	81.5	Confident	85	Confident	96 Å²	96	59.4 Å²	59.4	36%	0.362	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-58	-37.6	177.5	-68.5	-170.2	-179.4	-156.7	3	112.7	Y140 D144 Q175 L179 Q180 T181	Y140-R177 PolarHBondContact O-NH1 3.29Å; D144-R177 IonicContact OD1-NH1 2.62Å; D144-R177 IonicContact OD2-CZ 3.1Å; D144-R177 IonicContact OD2-NH1 2.94Å; D144-R177 PolarHBondContact OD2-NH1 2.84Å; Q175-R177 VanDerWaalsContact C-N 3.35Å; R177-L179 PolarHBondContact O-N 3.5Å; R177-L179 VanDerWaalsContact O-N 3.13Å; R177-Q180 WeakPolarHBondContact O-CA 3.22Å; R177-Q180 WeakPolarHBondContact O-CB 3.5Å; R177-Q180 PolarHBondContact O-N 3.16Å; R177-T181 PolarHBondContact O-N 3.14Å
178	F	84.9	Confident	84.9	Confident	1 Å²	1	59 Å²	59	0%	0.004	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-56.1	-31.7	173.3	179	-107.2	0	0	0	112.8	F169 Y172 E176 Q180 T181 L186 A206 W210	F169-F178 HydrophobicContact CE2-CE2 4.18Å; Y172-F178 AromaticContact CD1-CD2 3.84Å; Y172-F178 HydrophobicContact CD1-CD2 3.84Å; Y172-F178 HydrophobicContact CD1-CE2 4.47Å; Y172-F178 AromaticContact CE1-CD2 3.5Å; Y172-F178 HydrophobicContact CE1-CD2 3.5Å; Y172-F178 VanDerWaalsContact CE1-CD2 3.5Å; Y172-F178 HydrophobicContact CE1-CE2 4.2Å; Y172-F178 HydrophobicContact CE1-CG 4.48Å; Y172-F178 HydrophobicContact CE2-CB 4.47Å; Y172-F178 WeakPolarHBondContact O-CB 3.49Å; E176-F178 PolarHBondContact O-N 3.48Å; F178-Q180 PolarHBondContact O-N 3.47Å; F178-T181 WeakPolarHBondContact CA-OG1 3.44Å; F178-T181 WeakPolarHBondContact O-CB 3.49Å; F178-T181 PolarHBondContact O-N 3.18Å; F178-T181 PolarHBondContact O-OG1 3.27Å; F178-T181 VanDerWaalsContact O-OG1 3.05Å; F178-L186 HydrophobicContact CE2-CD1 3.56Å; F178-L186 HydrophobicContact CZ-CD1 3.65Å; F178-A206 HydrophobicContact CE1-CB 4.26Å; F178-A206 WeakPolarHBondContact CE1-O 3.49Å; F178-A206 HydrophobicContact CZ-CB 4.11Å; F178-W210 HydrophobicContact CE1-CB 3.89Å; F178-W210 HydrophobicContact CZ-CB 4.38Å
179	L	85.1	Confident	85.1	Confident	41 Å²	41	56.1 Å²	56.1	22%	0.215	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-69.5	-18.9	176.6	-54.6	-179.7	0	0	0	112.5	E176 R177 R209 A213 R218	E176-L179 WeakPolarHBondContact O-CA 3.46Å; E176-L179 WeakPolarHBondContact O-CB 3.22Å; E176-L179 PolarHBondContact O-N 3.03Å; R177-L179 PolarHBondContact O-N 3.5Å; R177-L179 VanDerWaalsContact O-N 3.13Å; L179-R209 HydrophobicContact CD2-CG 3.9Å; L179-A213 HydrophobicContact CB-CB 4.15Å; L179-A213 HydrophobicContact CD1-CB 4.1Å; L179-A213 HydrophobicContact CD2-CB 3.85Å; L179-A213 HydrophobicContact CG-CB 4.26Å; L179-R218 PolarHBondContact O-NH1 2.93Å; L179-R218 PolarHBondContact O-NH2 2.87Å
180	Q	84.6	Confident	85.1	Confident	158 Å²	158	56.2 Å²	56.2	74%	0.738	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-94.3	-9.5	179.2	-59.8	177.6	-6.6	0	0	112.7	R177 F178	R177-Q180 WeakPolarHBondContact O-CA 3.22Å; R177-Q180 WeakPolarHBondContact O-CB 3.5Å; R177-Q180 PolarHBondContact O-N 3.16Å; F178-Q180 PolarHBondContact O-N 3.47Å
181	T	83.9	Confident	85.2	Confident	16 Å²	16	59.1 Å²	59.1	10%	0.098	29%	0.293	C	S	.	.			trans	-58.8	138	179.3	-47.7	0	0	0	0	111.8	E143 Y172 R177 F178 L186 W210	E143-T181 PolarHBondContact OE1-OG1 2.94Å; Y172-T181 PolarHBondContact OH-OG1 3.47Å; R177-T181 PolarHBondContact O-N 3.14Å; F178-T181 WeakPolarHBondContact CA-OG1 3.44Å; F178-T181 WeakPolarHBondContact O-CB 3.49Å; F178-T181 PolarHBondContact O-N 3.18Å; F178-T181 PolarHBondContact O-OG1 3.27Å; F178-T181 VanDerWaalsContact O-OG1 3.05Å; T181-L186 HydrophobicContact CG2-CB 4.46Å; T181-W210 PolarHBondContact O-NE1 3.31Å
182	S	86.6	Confident	85.3	Confident	49 Å²	49	57.3 Å²	57.3	34%	0.343	29%	0.286	S	S	.	.			trans	-67.3	156	177.2	90	0	0	0	0	111.9	E184 S185 L186	S182-E184 VanDerWaalsContact C-N 3.31Å; S182-E184 VanDerWaalsContact CB-OE2 3.3Å; S182-E184 WeakPolarHBondContact CB-OE2 2.78Å; S182-E184 PolarHBondContact O-N 3.35Å; S182-E184 PolarHBondContact OG-OE2 3.39Å; S182-S185 PolarHBondContact O-N 3.06Å; S182-S185 PolarHBondContact OG-N 3.24Å; S182-S185 PolarHBondContact OG-OG 3.34Å; S182-S185 VanDerWaalsContact OG-OG 3.05Å; S182-L186 WeakPolarHBondContact O-CB 3.41Å; S182-L186 PolarHBondContact O-N 2.86Å
183	Y	88	Confident	85.2	Confident	52 Å²	52	63.2 Å²	63.2	20%	0.204	32%	0.318	C	S	.	.	H	α-helix	trans	-59.2	-42.5	177.6	164.7	-103	0	0	0	111.8	L186 V187 F221 S224 L225	Y183-L186 PolarHBondContact O-N 3.3Å; Y183-V187 HydrophobicContact CD2-CG2 3.93Å; Y183-V187 HydrophobicContact CE1-CG2 4.17Å; Y183-V187 HydrophobicContact CE2-CG2 3.44Å; Y183-V187 VanDerWaalsContact CE2-CG2 3.44Å; Y183-V187 HydrophobicContact CG-CG2 4.49Å; Y183-V187 WeakPolarHBondContact O-CG2 3.38Å; Y183-V187 PolarHBondContact O-N 2.92Å; Y183-F221 HydrophobicContact CD1-CD1 4.08Å; Y183-F221 HydrophobicContact CD1-CE1 4Å; Y183-F221 HydrophobicContact CD2-CB 3.67Å; Y183-F221 AromaticContact CD2-CD1 3.64Å; Y183-F221 HydrophobicContact CD2-CD1 3.64Å; Y183-F221 HydrophobicContact CD2-CD2 4.21Å; Y183-F221 HydrophobicContact CD2-CE1 4.3Å; Y183-F221 AromaticContact CD2-CG 3.58Å; Y183-F221 HydrophobicContact CD2-CG 3.58Å; Y183-F221 HydrophobicContact CE1-CD1 4.07Å; Y183-F221 HydrophobicContact CE1-CE1 4.2Å; Y183-F221 HydrophobicContact CE2-CB 3.69Å; Y183-F221 AromaticContact CE2-CD1 3.62Å; Y183-F221 HydrophobicContact CE2-CD1 3.62Å; Y183-F221 HydrophobicContact CE2-CE1 4.47Å; Y183-F221 AromaticContact CE2-CG 3.84Å; Y183-F221 HydrophobicContact CE2-CG 3.84Å; Y183-F221 AromaticContact CG-CD1 3.86Å; Y183-F221 HydrophobicContact CG-CD1 3.86Å; Y183-F221 HydrophobicContact CG-CD2 4.39Å; Y183-F221 HydrophobicContact CG-CE1 4.05Å; Y183-F221 HydrophobicContact CG-CG 4.05Å; Y183-F221 HydrophobicContact CG-CZ 4.39Å; Y183-F221 AromaticContact CZ-CD1 3.84Å; Y183-S224 WeakPolarHBondContact OH-CB 3.46Å; Y183-S224 PolarHBondContact OH-OG 3.44Å; Y183-L225 HydrophobicContact CD2-CD2 4.3Å; Y183-L225 HydrophobicContact CD2-CG 4.47Å; Y183-L225 HydrophobicContact CE2-CD2 4.18Å; Y183-L225 HydrophobicContact CE2-CG 4.2Å
184	E	87.3	Confident	85	Confident	115 Å²	115	69.3 Å²	69.3	54%	0.537	34%	0.343	S	S	.	.	H	α-helix	trans	-63	-48.2	-178.8	-55.1	75.2	-158.9	0	0	110.6	S182 L186 V187 D188	S182-E184 VanDerWaalsContact C-N 3.31Å; S182-E184 VanDerWaalsContact CB-OE2 3.3Å; S182-E184 WeakPolarHBondContact CB-OE2 2.78Å; S182-E184 PolarHBondContact O-N 3.35Å; S182-E184 PolarHBondContact OG-OE2 3.39Å; E184-L186 VanDerWaalsContact C-N 3.29Å; E184-L186 PolarHBondContact O-N 3.19Å; E184-V187 PolarHBondContact O-N 3.39Å; E184-D188 PolarHBondContact O-N 3.05Å
185	S	84.6	Confident	84.9	Confident	49 Å²	49	66 Å²	66	34%	0.343	32%	0.322	S	S	.	.	H	α-helix	trans	-64.4	-36.1	-179.7	-55.3	0	0	0	0	111.7	S182 L189	S182-S185 PolarHBondContact O-N 3.06Å; S182-S185 PolarHBondContact OG-N 3.24Å; S182-S185 PolarHBondContact OG-OG 3.34Å; S182-S185 VanDerWaalsContact OG-OG 3.05Å; S185-L189 WeakPolarHBondContact O-CB 3.25Å; S185-L189 PolarHBondContact O-N 3.44Å; S185-L189 VanDerWaalsContact O-N 3.1Å
186	L	87.5	Confident	84.7	Confident	0 Å²	0	68 Å²	68	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-68.2	-43.6	176	-178.8	62.3	0	0	0	111.6	F178 T181 S182 Y183 E184 D188 L189 L190 W210 L225	F178-L186 HydrophobicContact CE2-CD1 3.56Å; F178-L186 HydrophobicContact CZ-CD1 3.65Å; T181-L186 HydrophobicContact CG2-CB 4.46Å; S182-L186 WeakPolarHBondContact O-CB 3.41Å; S182-L186 PolarHBondContact O-N 2.86Å; Y183-L186 PolarHBondContact O-N 3.3Å; E184-L186 VanDerWaalsContact C-N 3.29Å; E184-L186 PolarHBondContact O-N 3.19Å; L186-D188 VanDerWaalsContact C-N 3.34Å; L186-L189 PolarHBondContact O-N 3.02Å; L186-L190 HydrophobicContact CD1-CD1 3.94Å; L186-L190 HydrophobicContact CD1-CG 4Å; L186-L190 HydrophobicContact CD2-CD1 4.44Å; L186-L190 HydrophobicContact CG-CD1 3.8Å; L186-L190 HydrophobicContact CG-CG 4.26Å; L186-L190 WeakPolarHBondContact O-CB 3.25Å; L186-L190 WeakPolarHBondContact O-CG 3.41Å; L186-L190 PolarHBondContact O-N 3.43Å; L186-W210 HydrophobicContact CD2-CB 4.27Å; L186-W210 HydrophobicContact CD2-CD2 3.51Å; L186-W210 HydrophobicContact CD2-CE3 3.84Å; L186-W210 HydrophobicContact CD2-CG 3.7Å; L186-W210 HydrophobicContact CD2-CZ2 4.38Å; L186-W210 HydrophobicContact CD2-CZ3 4.4Å; L186-L225 HydrophobicContact CD2-CD1 4.25Å; L186-L225 HydrophobicContact CD2-CD2 3.8Å; L186-L225 HydrophobicContact CG-CD2 4.06Å
187	V	87.7	Confident	84.5	Confident	11 Å²	11	62.3 Å²	62.3	7%	0.067	31%	0.313	C	S	.	.	H	α-helix	trans	-62.6	-43.1	177.6	168.9	0	0	0	0	111.2	Y183 E184 L189 L190 K191 L225	Y183-V187 HydrophobicContact CD2-CG2 3.93Å; Y183-V187 HydrophobicContact CE1-CG2 4.17Å; Y183-V187 HydrophobicContact CE2-CG2 3.44Å; Y183-V187 VanDerWaalsContact CE2-CG2 3.44Å; Y183-V187 HydrophobicContact CG-CG2 4.49Å; Y183-V187 WeakPolarHBondContact O-CG2 3.38Å; Y183-V187 PolarHBondContact O-N 2.92Å; E184-V187 PolarHBondContact O-N 3.39Å; V187-L189 VanDerWaalsContact C-N 3.32Å; V187-L189 PolarHBondContact O-N 2.91Å; V187-L190 PolarHBondContact O-N 3.18Å; V187-K191 HydrophobicContact CG1-CD 3.75Å; V187-K191 VanDerWaalsContact CG1-CE 3.47Å; V187-K191 HydrophobicContact CG1-CG 4.29Å; V187-K191 WeakPolarHBondContact O-CB 3.38Å; V187-K191 VanDerWaalsContact O-CG 3.32Å; V187-K191 WeakPolarHBondContact O-CG 3.21Å; V187-K191 PolarHBondContact O-N 3.32Å; V187-L225 HydrophobicContact CG2-CD2 3.85Å
188	D	85.2	Confident	84.2	Confident	110 Å²	110	62 Å²	62	59%	0.588	33%	0.325	S	S	*	.	H	α-helix	trans	-62.2	-41.3	177.5	-70.3	-17	0	0	0	111.4	E184 L186 D192	E184-D188 PolarHBondContact O-N 3.05Å; L186-D188 VanDerWaalsContact C-N 3.34Å; D188-D192 PolarHBondContact O-N 3.45Å
189	L	86	Confident	83.8	Confident	14 Å²	14	65.1 Å²	65.1	7%	0.073	34%	0.344	C	S	.	.	H	α-helix	trans	-66.2	-40.6	177.1	-174.1	67.8	0	0	0	112.7	M165 L166 F169 Y172 S185 L186 V187	M165-L189 HydrophobicContact CB-CD1 4.31Å; M165-L189 HydrophobicContact CG-CD1 3.84Å; M165-L189 HydrophobicContact CG-CD2 4.3Å; M165-L189 HydrophobicContact SD-CD1 3.72Å; M165-L189 HydrophobicContact SD-CD2 3.83Å; M165-L189 HydrophobicContact SD-CG 4.41Å; L166-L189 HydrophobicContact CD2-CD1 3.56Å; L166-L189 HydrophobicContact CD2-CG 4.46Å; L166-L189 HydrophobicContact CG-CD1 4.09Å; F169-L189 HydrophobicContact CD2-CD2 3.66Å; F169-L189 HydrophobicContact CD2-CG 4.09Å; F169-L189 HydrophobicContact CE2-CD2 3.64Å; F169-L189 HydrophobicContact CE2-CG 4.19Å; Y172-L189 HydrophobicContact CD1-CD2 4.35Å; Y172-L189 HydrophobicContact CE1-CD2 4.04Å; S185-L189 WeakPolarHBondContact O-CB 3.25Å; S185-L189 PolarHBondContact O-N 3.44Å; S185-L189 VanDerWaalsContact O-N 3.1Å; L186-L189 PolarHBondContact O-N 3.02Å; V187-L189 VanDerWaalsContact C-N 3.32Å; V187-L189 PolarHBondContact O-N 2.91Å
190	L	85.9	Confident	83.7	Confident	3 Å²	3	63.7 Å²	63.7	2%	0.016	34%	0.336	C	S	.	.	H	α-helix	trans	-76.5	-28.8	-177.4	-70.8	177.8	0	0	0	113.3	F169 L186 V187 D192 V203 I207 L225 C228	F169-L190 HydrophobicContact CE2-CD2 4.34Å; F169-L190 HydrophobicContact CZ-CD2 3.86Å; L186-L190 HydrophobicContact CD1-CD1 3.94Å; L186-L190 HydrophobicContact CD1-CG 4Å; L186-L190 HydrophobicContact CD2-CD1 4.44Å; L186-L190 HydrophobicContact CG-CD1 3.8Å; L186-L190 HydrophobicContact CG-CG 4.26Å; L186-L190 WeakPolarHBondContact O-CB 3.25Å; L186-L190 WeakPolarHBondContact O-CG 3.41Å; L186-L190 PolarHBondContact O-N 3.43Å; V187-L190 PolarHBondContact O-N 3.18Å; L190-D192 VanDerWaalsContact C-N 3.32Å; L190-V203 HydrophobicContact CD2-CG1 3.55Å; L190-I207 HydrophobicContact CD1-CD1 3.87Å; L190-I207 HydrophobicContact CD1-CG1 3.67Å; L190-L225 HydrophobicContact CD1-CD2 3.89Å; L190-C228 HydrophobicContact CB-CB 3.84Å
191	K	86.2	Confident	83.5	Confident	133 Å²	133	57 Å²	57	58%	0.578	31%	0.306	S	S	*	.	H	α-helix	trans	-77.5	-16.5	176.9	-77	178.3	175.6	173.6	0	113.4	V187 D193	V187-K191 HydrophobicContact CG1-CD 3.75Å; V187-K191 VanDerWaalsContact CG1-CE 3.47Å; V187-K191 HydrophobicContact CG1-CG 4.29Å; V187-K191 WeakPolarHBondContact O-CB 3.38Å; V187-K191 VanDerWaalsContact O-CG 3.32Å; V187-K191 WeakPolarHBondContact O-CG 3.21Å; V187-K191 PolarHBondContact O-N 3.32Å; K191-D193 PolarHBondContact O-N 2.97Å
192	D	84.3	Confident	83.5	Confident	55 Å²	55	57.2 Å²	57.2	29%	0.294	31%	0.306	S	S	.	.			trans	-71	124.9	-176	-161	-46.8	0	0	0	111.3	L166 D188 L190 K194 L195	L166-D192 HydrophobicContact CD1-CB 4.15Å; L166-D192 VanDerWaalsContact CD1-OD2 3.3Å; L166-D192 WeakPolarHBondContact CD1-OD2 3.32Å; L166-D192 HydrophobicContact CD2-CB 3.71Å; D188-D192 PolarHBondContact O-N 3.45Å; L190-D192 VanDerWaalsContact C-N 3.32Å; D192-K194 PolarHBondContact O-N 2.45Å; D192-K194 VanDerWaalsContact OD1-CB 3.31Å; D192-K194 WeakPolarHBondContact OD1-CB 3.46Å; D192-K194 PolarHBondContact OD1-N 3.13Å; D192-L195 WeakPolarHBondContact O-CB 3.38Å; D192-L195 PolarHBondContact O-N 3.34Å
193	D	80.6	Confident	83.4	Confident	133 Å²	133	55 Å²	55	71%	0.711	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-16	179.5	-69.9	-35.2	0	0	0	113.7	K191 L195 R230	K191-D193 PolarHBondContact O-N 2.97Å; D193-L195 VanDerWaalsContact C-N 3.26Å; D193-L195 PolarHBondContact O-N 3.25Å; D193-R230 IonicContact OD1-CZ 2.7Å; D193-R230 IonicContact OD1-NE 3.92Å; D193-R230 IonicContact OD1-NH2 3.91Å; D193-R230 PolarHBondContact OD1-NH2 3.13Å
194	K	80.8	Confident	83.2	Confident	137 Å²	137	52.9 Å²	52.9	60%	0.596	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	3.4	177.2	-59.4	172.9	-176.5	170.8	0	113.3	L166 D192 V196	L166-K194 HydrophobicContact CD1-CB 4.18Å; D192-K194 PolarHBondContact O-N 2.45Å; D192-K194 VanDerWaalsContact OD1-CB 3.31Å; D192-K194 WeakPolarHBondContact OD1-CB 3.46Å; D192-K194 PolarHBondContact OD1-N 3.13Å; K194-V196 WeakPolarHBondContact O-CG2 3Å; K194-V196 PolarHBondContact O-N 2.98Å; K194-V196 VanDerWaalsContact O-N 3.16Å
195	L	83.4	Confident	83.1	Confident	14 Å²	14	53.7 Å²	53.7	7%	0.073	28%	0.28	C	S	.	.			trans	-58	116.9	178	-170.3	71.4	0	0	0	110.7	L166 F169 D192 D193 V197 V203	L166-L195 HydrophobicContact CD2-CB 4.28Å; L166-L195 HydrophobicContact CD2-CD1 3.75Å; F169-L195 HydrophobicContact CB-CD1 3.63Å; F169-L195 HydrophobicContact CD1-CD1 3.83Å; F169-L195 HydrophobicContact CD1-CD2 4.32Å; F169-L195 HydrophobicContact CD1-CG 4.27Å; F169-L195 HydrophobicContact CD2-CD1 3.77Å; F169-L195 HydrophobicContact CE1-CD1 4.42Å; F169-L195 HydrophobicContact CE1-CD2 4.33Å; F169-L195 HydrophobicContact CE2-CD1 4.37Å; F169-L195 HydrophobicContact CG-CD1 3.46Å; F169-L195 VanDerWaalsContact CG-CD1 3.46Å; F169-L195 HydrophobicContact CG-CG 4.36Å; D192-L195 WeakPolarHBondContact O-CB 3.38Å; D192-L195 PolarHBondContact O-N 3.34Å; D193-L195 VanDerWaalsContact C-N 3.26Å; D193-L195 PolarHBondContact O-N 3.25Å; L195-V197 HydrophobicContact CD2-CG1 4.11Å; L195-V197 HydrophobicContact CG-CG1 4.08Å; L195-V197 PolarHBondContact O-N 2.86Å; L195-V203 HydrophobicContact CD2-CG2 3.87Å
196	V	79.6	Confident	83.2	Confident	84 Å²	84	51.5 Å²	51.5	51%	0.509	27%	0.265	S	S	.	.			trans	-90.5	100.7	-179	-175.7	0	0	0	0	109.2	L166 K194	L166-V196 PolarHBondContact O-N 3.27Å; L166-V196 VanDerWaalsContact O-N 3.13Å; K194-V196 WeakPolarHBondContact O-CG2 3Å; K194-V196 PolarHBondContact O-N 2.98Å; K194-V196 VanDerWaalsContact O-N 3.16Å
197	V	80.6	Confident	83.1	Confident	37 Å²	37	51.7 Å²	51.7	22%	0.224	27%	0.266	C	S	.	.			trans	-129.8	151.4	176	-72.2	0	0	0	0	111.3	F169 L195 V203	F169-V197 HydrophobicContact CD1-CG1 3.64Å; F169-V197 HydrophobicContact CE1-CG1 4.13Å; L195-V197 HydrophobicContact CD2-CG1 4.11Å; L195-V197 HydrophobicContact CG-CG1 4.08Å; L195-V197 PolarHBondContact O-N 2.86Å; V197-V203 HydrophobicContact CB-CG2 4.31Å; V197-V203 HydrophobicContact CG1-CG2 3.9Å; V197-V203 HydrophobicContact CG2-CG2 3.91Å
198	C	74.7	Confident	83	Confident	91 Å²	91	54 Å²	54	62%	0.615	28%	0.275	S	S	*	.	S	Bend	trans	-70.2	-44.5	174.5	-61.7	0	0	0	0	110.6	D202	C198-D202 WeakPolarHBondContact CB-OD2 3.31Å
199	T	77.6	Confident	83.1	Confident	65 Å²	65	53.8 Å²	53.8	40%	0.399	27%	0.266	S	S	.	.			trans	-144.1	154.6	178.2	63.3	0	0	0	0	110.9	L201 D202	T199-L201 PolarHBondContact O-N 3.37Å; T199-L201 WeakPolarHBondContact OG1-CB 3.39Å; T199-L201 PolarHBondContact OG1-N 3.44Å; T199-D202 PolarHBondContact N-OD2 2.77Å; T199-D202 WeakPolarHBondContact O-CB 3.48Å; T199-D202 PolarHBondContact O-N 2.88Å; T199-D202 PolarHBondContact OG1-OD2 3Å
200	E	82.2	Confident	83.3	Confident	12 Å²	12	53.3 Å²	53.3	6%	0.056	26%	0.263	C	S	.	.	H	α-helix	trans	-61.4	-13.9	169.2	-71.4	-72.1	155.8	0	0	112.5	D202 V203 F204 V229 R230 L233 L234	E200-D202 VanDerWaalsContact C-N 3.27Å; E200-D202 PolarHBondContact O-N 2.79Å; E200-V203 WeakPolarHBondContact O-CB 3.18Å; E200-V203 PolarHBondContact O-N 3.36Å; E200-F204 PolarHBondContact O-N 3.38Å; E200-V229 HydrophobicContact CB-CG1 4.39Å; E200-R230 HydrophobicContact CG-CB 3.92Å; E200-R230 IonicContact OE1-CZ 2.78Å; E200-R230 IonicContact OE1-NH1 2.82Å; E200-R230 PolarHBondContact OE1-NH1 3.28Å; E200-R230 PolarHBondContact OE2-N 3.28Å; E200-L233 HydrophobicContact CG-CB 3.91Å; E200-L233 HydrophobicContact CG-CD1 3.9Å; E200-L233 HydrophobicContact CG-CG 4.43Å; E200-L234 HydrophobicContact CB-CD2 3.83Å; E200-L234 HydrophobicContact CB-CG 4.08Å
201	L	80.5	Confident	83.3	Confident	18 Å²	18	53.3 Å²	53.3	9%	0.094	26%	0.263	C	S	.	.	H	α-helix	trans	-68.5	-31.8	173.3	-175	62.6	0	0	0	110.9	T199 V203 F204 R205 L234 V242	T199-L201 PolarHBondContact O-N 3.37Å; T199-L201 WeakPolarHBondContact OG1-CB 3.39Å; T199-L201 PolarHBondContact OG1-N 3.44Å; L201-V203 VanDerWaalsContact C-N 3.33Å; L201-F204 HydrophobicContact CD1-CD1 4.37Å; L201-F204 PolarHBondContact O-N 3.31Å; L201-R205 WeakPolarHBondContact O-CB 3.37Å; L201-R205 VanDerWaalsContact O-CG 3.25Å; L201-R205 WeakPolarHBondContact O-CG 3.32Å; L201-R205 PolarHBondContact O-N 3.03Å; L201-L234 HydrophobicContact CB-CD2 3.88Å; L201-V242 HydrophobicContact CD1-CB 4.4Å; L201-V242 HydrophobicContact CD1-CG1 4.04Å
202	D	84	Confident	83.3	Confident	20 Å²	20	52.3 Å²	52.3	11%	0.107	26%	0.259	C	S	.	.	H	α-helix	trans	-69.9	-35.4	176.7	-56.2	-48.2	0	0	0	111.1	L170 C198 T199 E200 R205 A206	L170-D202 HydrophobicContact CD1-CB 3.92Å; C198-D202 WeakPolarHBondContact CB-OD2 3.31Å; T199-D202 PolarHBondContact N-OD2 2.77Å; T199-D202 WeakPolarHBondContact O-CB 3.48Å; T199-D202 PolarHBondContact O-N 2.88Å; T199-D202 PolarHBondContact OG1-OD2 3Å; E200-D202 VanDerWaalsContact C-N 3.27Å; E200-D202 PolarHBondContact O-N 2.79Å; D202-R205 PolarHBondContact O-N 3.26Å; D202-R205 IonicContact OD1-NH1 3.86Å; D202-R205 PolarHBondContact OD1-NH1 2.64Å; D202-A206 WeakPolarHBondContact O-CB 3.38Å; D202-A206 PolarHBondContact O-N 2.97Å
203	V	84.8	Confident	83.4	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.006	27%	0.267	C	S	.	.	H	α-helix	trans	-61.7	-49	170.9	-174.1	0	0	0	0	110.6	L190 L195 V197 E200 L201 R205 A206 I207 V229	L190-V203 HydrophobicContact CD2-CG1 3.55Å; L195-V203 HydrophobicContact CD2-CG2 3.87Å; V197-V203 HydrophobicContact CB-CG2 4.31Å; V197-V203 HydrophobicContact CG1-CG2 3.9Å; V197-V203 HydrophobicContact CG2-CG2 3.91Å; E200-V203 WeakPolarHBondContact O-CB 3.18Å; E200-V203 PolarHBondContact O-N 3.36Å; L201-V203 VanDerWaalsContact C-N 3.33Å; V203-R205 VanDerWaalsContact C-N 3.34Å; V203-R205 PolarHBondContact O-N 3.21Å; V203-A206 WeakPolarHBondContact O-CB 3.33Å; V203-A206 PolarHBondContact O-N 3.33Å; V203-I207 HydrophobicContact CG1-CD1 4.2Å; V203-I207 WeakPolarHBondContact O-CG1 3.34Å; V203-I207 PolarHBondContact O-N 2.93Å; V203-V229 HydrophobicContact CG1-CG2 4.26Å
204	F	82.8	Confident	83.6	Confident	8 Å²	8	48 Å²	48	4%	0.035	24%	0.243	C	C	.	.	H	α-helix	trans	-60.1	-42.2	176.2	178.1	-97.7	0	0	0	112.3	E200 L201 A206 I207 K208 L226 V242 I243 V249	E200-F204 PolarHBondContact O-N 3.38Å; L201-F204 HydrophobicContact CD1-CD1 4.37Å; L201-F204 PolarHBondContact O-N 3.31Å; F204-A206 VanDerWaalsContact C-N 3.35Å; F204-A206 PolarHBondContact O-N 3.46Å; F204-I207 PolarHBondContact O-N 3.5Å; F204-K208 WeakPolarHBondContact O-CB 3.48Å; F204-K208 PolarHBondContact O-N 3.08Å; F204-L226 HydrophobicContact CD2-CD2 3.8Å; F204-L226 HydrophobicContact CE2-CD2 3.71Å; F204-V242 HydrophobicContact CE1-CG1 4.4Å; F204-I243 HydrophobicContact CD1-CG1 4.08Å; F204-I243 HydrophobicContact CD2-CD1 4.24Å; F204-I243 HydrophobicContact CD2-CG1 4.1Å; F204-I243 HydrophobicContact CE1-CG1 3.88Å; F204-I243 HydrophobicContact CE2-CB 4.48Å; F204-I243 HydrophobicContact CE2-CD1 4.42Å; F204-I243 HydrophobicContact CE2-CG1 3.89Å; F204-I243 HydrophobicContact CE2-CG2 4.13Å; F204-I243 HydrophobicContact CG-CD1 4.36Å; F204-I243 HydrophobicContact CG-CG1 4.2Å; F204-I243 HydrophobicContact CZ-CB 4.28Å; F204-I243 HydrophobicContact CZ-CG1 3.78Å; F204-I243 HydrophobicContact CZ-CG2 4.29Å; F204-V249 HydrophobicContact CE2-CG2 4.34Å; F204-V249 HydrophobicContact CZ-CG2 4.26Å
205	R	85.2	Confident	83.6	Confident	132 Å²	132	45.6 Å²	45.6	50%	0.498	24%	0.237	S	C	.	.	H	α-helix	trans	-62.3	-40.3	175.8	-74.8	168.2	179	157	-4.8	112.1	L201 D202 V203 K208 R209	L201-R205 WeakPolarHBondContact O-CB 3.37Å; L201-R205 VanDerWaalsContact O-CG 3.25Å; L201-R205 WeakPolarHBondContact O-CG 3.32Å; L201-R205 PolarHBondContact O-N 3.03Å; D202-R205 PolarHBondContact O-N 3.26Å; D202-R205 IonicContact OD1-NH1 3.86Å; D202-R205 PolarHBondContact OD1-NH1 2.64Å; V203-R205 VanDerWaalsContact C-N 3.34Å; V203-R205 PolarHBondContact O-N 3.21Å; R205-K208 PolarHBondContact O-N 3.31Å; R205-R209 WeakPolarHBondContact O-CB 3.3Å; R205-R209 PolarHBondContact O-N 3.27Å
206	A	86.8	Confident	83.4	Confident	3 Å²	3	50.9 Å²	50.9	3%	0.025	27%	0.27	C	S	.	.	H	α-helix	trans	-62.9	-47.7	175.5	0	0	0	0	0	111.2	F169 F178 D202 V203 F204 K208 R209 W210	F169-A206 HydrophobicContact CE1-CB 4.05Å; F169-A206 HydrophobicContact CZ-CB 3.77Å; F178-A206 HydrophobicContact CE1-CB 4.26Å; F178-A206 WeakPolarHBondContact CE1-O 3.49Å; F178-A206 HydrophobicContact CZ-CB 4.11Å; D202-A206 WeakPolarHBondContact O-CB 3.38Å; D202-A206 PolarHBondContact O-N 2.97Å; V203-A206 WeakPolarHBondContact O-CB 3.33Å; V203-A206 PolarHBondContact O-N 3.33Å; F204-A206 VanDerWaalsContact C-N 3.35Å; F204-A206 PolarHBondContact O-N 3.46Å; A206-K208 PolarHBondContact O-N 2.83Å; A206-R209 PolarHBondContact O-N 3.24Å; A206-W210 PolarHBondContact O-N 3.46Å
207	I	86.5	Confident	83.6	Confident	5 Å²	5	51.5 Å²	51.5	3%	0.026	27%	0.27	C	S	.	.	H	α-helix	trans	-57.9	-48.6	175	-67.7	163.9	0	0	0	110.6	L190 V203 F204 R209 W210 V211 L225 V229	L190-I207 HydrophobicContact CD1-CD1 3.87Å; L190-I207 HydrophobicContact CD1-CG1 3.67Å; V203-I207 HydrophobicContact CG1-CD1 4.2Å; V203-I207 WeakPolarHBondContact O-CG1 3.34Å; V203-I207 PolarHBondContact O-N 2.93Å; F204-I207 PolarHBondContact O-N 3.5Å; I207-R209 VanDerWaalsContact C-N 3.29Å; I207-R209 PolarHBondContact O-N 3.32Å; I207-W210 PolarHBondContact O-N 2.89Å; I207-V211 HydrophobicContact CG2-CG2 4.15Å; I207-V211 VanDerWaalsContact O-CG2 3.25Å; I207-V211 WeakPolarHBondContact O-CG2 3.35Å; I207-V211 PolarHBondContact O-N 3.29Å; I207-L225 HydrophobicContact CD1-CB 4.31Å; I207-L225 HydrophobicContact CG1-CB 4.41Å; I207-L225 HydrophobicContact CG2-CB 3.83Å; I207-L225 HydrophobicContact CG2-CD1 4.12Å; I207-V229 HydrophobicContact CD1-CG2 3.33Å
208	K	84.8	Confident	83.8	Confident	58 Å²	58	51.6 Å²	51.6	25%	0.252	27%	0.267	S	S	.	.	H	α-helix	trans	-55.4	-45	177.7	178.2	176.4	-174.5	172.2	0	111.5	F204 R205 A206 V211 K212 D246 L248	F204-K208 WeakPolarHBondContact O-CB 3.48Å; F204-K208 PolarHBondContact O-N 3.08Å; R205-K208 PolarHBondContact O-N 3.31Å; A206-K208 PolarHBondContact O-N 2.83Å; K208-V211 PolarHBondContact O-N 2.84Å; K208-K212 VanDerWaalsContact CE-CE 3.45Å; K208-K212 HydrophobicContact CG-CD 4.3Å; K208-K212 HydrophobicContact CG-CG 4.49Å; K208-K212 WeakPolarHBondContact O-CB 3.39Å; K208-K212 VanDerWaalsContact O-CG 3.32Å; K208-K212 WeakPolarHBondContact O-CG 3.32Å; K208-K212 PolarHBondContact O-N 2.88Å; K208-D246 VanDerWaalsContact CD-OD2 3.27Å; K208-D246 WeakPolarHBondContact CD-OD2 3.27Å; K208-D246 WeakPolarHBondContact CE-OD1 3.06Å; K208-D246 WeakPolarHBondContact CE-OD2 3.43Å; K208-D246 VanDerWaalsContact NZ-CG 3.29Å; K208-D246 IonicContact NZ-OD1 3.25Å; K208-D246 PolarHBondContact NZ-OD1 3.11Å; K208-D246 IonicContact NZ-OD2 2.65Å; K208-D246 PolarHBondContact NZ-OD2 3.28Å; K208-L248 HydrophobicContact CG-CD1 3.98Å
209	R	87.4	Confident	84	Confident	106 Å²	106	48.6 Å²	48.6	40%	0.4	25%	0.249	S	C	.	.	H	α-helix	trans	-63.3	-44.9	178.5	-176.9	-179.5	173.9	121.2	-0.6	111.6	S173 T174 L179 R205 A206 I207 K212 A213	S173-R209 VanDerWaalsContact O-CD 3.31Å; S173-R209 WeakPolarHBondContact O-CD 3.31Å; S173-R209 PolarHBondContact O-NE 3.33Å; T174-R209 PolarHBondContact O-NH2 3.02Å; L179-R209 HydrophobicContact CD2-CG 3.9Å; R205-R209 WeakPolarHBondContact O-CB 3.3Å; R205-R209 PolarHBondContact O-N 3.27Å; A206-R209 PolarHBondContact O-N 3.24Å; I207-R209 VanDerWaalsContact C-N 3.29Å; I207-R209 PolarHBondContact O-N 3.32Å; R209-K212 PolarHBondContact O-N 3.49Å; R209-A213 PolarHBondContact O-N 3.5Å
210	W	90	Very high	84.2	Confident	5 Å²	5	52.8 Å²	52.8	2%	0.019	26%	0.261	C	S	.	.	H	α-helix	trans	-63.6	-41.6	178.2	-174	87.8	0	0	0	112.6	F178 T181 L186 A206 I207 R218 F221 L225	F178-W210 HydrophobicContact CE1-CB 3.89Å; F178-W210 HydrophobicContact CZ-CB 4.38Å; T181-W210 PolarHBondContact O-NE1 3.31Å; L186-W210 HydrophobicContact CD2-CB 4.27Å; L186-W210 HydrophobicContact CD2-CD2 3.51Å; L186-W210 HydrophobicContact CD2-CE3 3.84Å; L186-W210 HydrophobicContact CD2-CG 3.7Å; L186-W210 HydrophobicContact CD2-CZ2 4.38Å; L186-W210 HydrophobicContact CD2-CZ3 4.4Å; A206-W210 PolarHBondContact O-N 3.46Å; I207-W210 PolarHBondContact O-N 2.89Å; W210-R218 HydrophobicContact CE3-CB 4.29Å; W210-R218 HydrophobicContact CE3-CG 4.32Å; W210-R218 HydrophobicContact CH2-CB 4.24Å; W210-R218 HydrophobicContact CH2-CG 3.78Å; W210-R218 HydrophobicContact CZ2-CG 4.36Å; W210-R218 HydrophobicContact CZ3-CB 3.74Å; W210-R218 HydrophobicContact CZ3-CG 3.76Å; W210-R218 VanDerWaalsContact O-CD 3.26Å; W210-R218 WeakPolarHBondContact O-CD 3.4Å; W210-R218 PolarHBondContact O-NH1 3.03Å; W210-F221 HydrophobicContact CH2-CD2 4.3Å; W210-F221 HydrophobicContact CZ3-CB 4.5Å; W210-L225 HydrophobicContact CE3-CD1 3.74Å; W210-L225 HydrophobicContact CZ3-CD1 3.63Å
211	V	86.8	Confident	84.2	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.012	27%	0.27	C	S	.	.	H	α-helix	trans	-68.9	-42.3	178.3	173.5	0	0	0	0	111.3	I207 K208 A213 D214 L215 V222 L225 L248	I207-V211 HydrophobicContact CG2-CG2 4.15Å; I207-V211 VanDerWaalsContact O-CG2 3.25Å; I207-V211 WeakPolarHBondContact O-CG2 3.35Å; I207-V211 PolarHBondContact O-N 3.29Å; K208-V211 PolarHBondContact O-N 2.84Å; V211-A213 PolarHBondContact O-N 2.86Å; V211-D214 CarbonylContact O-C 3.51Å; V211-D214 VanDerWaalsContact O-C 3.3Å; V211-D214 PolarHBondContact O-N 3.4Å; V211-L215 HydrophobicContact CG1-CD2 4.2Å; V211-L215 PolarHBondContact O-N 2.96Å; V211-V222 HydrophobicContact CB-CG2 4.33Å; V211-V222 HydrophobicContact CG1-CG2 3.6Å; V211-V222 HydrophobicContact CG2-CG2 3.74Å; V211-L225 HydrophobicContact CG2-CD1 4.21Å; V211-L248 HydrophobicContact CG1-CD1 4.39Å; V211-L248 HydrophobicContact CG1-CD2 4.39Å
212	K	86.3	Confident	84.2	Confident	113 Å²	113	54.3 Å²	54.3	49%	0.491	27%	0.268	S	S	.	.	H	α-helix	trans	-62.9	-25.3	179.3	-80	-168.4	173	-161.9	0	113.9	K208 R209 D214 L248	K208-K212 VanDerWaalsContact CE-CE 3.45Å; K208-K212 HydrophobicContact CG-CD 4.3Å; K208-K212 HydrophobicContact CG-CG 4.49Å; K208-K212 WeakPolarHBondContact O-CB 3.39Å; K208-K212 VanDerWaalsContact O-CG 3.32Å; K208-K212 WeakPolarHBondContact O-CG 3.32Å; K208-K212 PolarHBondContact O-N 2.88Å; R209-K212 PolarHBondContact O-N 3.49Å; K212-D214 VanDerWaalsContact C-N 3.32Å; K212-D214 PolarHBondContact O-N 3Å; K212-L248 HydrophobicContact CG-CD1 4.05Å
213	A	86.5	Confident	83.8	Confident	55 Å²	55	62.7 Å²	62.7	46%	0.455	30%	0.298	S	S	.	.	H	α-helix	trans	-69.4	-27.7	179.4	0	0	0	0	0	113.6	L179 R209 V211	L179-A213 HydrophobicContact CB-CB 4.15Å; L179-A213 HydrophobicContact CD1-CB 4.1Å; L179-A213 HydrophobicContact CD2-CB 3.85Å; L179-A213 HydrophobicContact CG-CB 4.26Å; R209-A213 PolarHBondContact O-N 3.5Å; V211-A213 PolarHBondContact O-N 2.86Å
214	D	84.4	Confident	83.6	Confident	41 Å²	41	64.9 Å²	64.9	22%	0.219	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-147.8	77.8	173.9	177.9	-1	0	0	0	109.2	V211 K212 T216 N217 R218	V211-D214 CarbonylContact O-C 3.51Å; V211-D214 VanDerWaalsContact O-C 3.3Å; V211-D214 PolarHBondContact O-N 3.4Å; K212-D214 VanDerWaalsContact C-N 3.32Å; K212-D214 PolarHBondContact O-N 3Å; D214-T216 PolarHBondContact O-N 2.85Å; D214-T216 PolarHBondContact OD1-N 3.28Å; D214-T216 PolarHBondContact OD1-OG1 3.09Å; D214-N217 PolarHBondContact OD1-N 3.29Å; D214-N217 PolarHBondContact OD1-ND2 3.49Å; D214-N217 WeakPolarHBondContact OD2-CB 3.49Å; D214-N217 PolarHBondContact OD2-ND2 2.93Å; D214-R218 HydrophobicContact CB-CG 4.05Å; D214-R218 WeakPolarHBondContact O-CB 3.36Å; D214-R218 VanDerWaalsContact O-CG 3.27Å; D214-R218 WeakPolarHBondContact O-CG 3.31Å; D214-R218 PolarHBondContact O-N 3.45Å
215	L	80.5	Confident	83.7	Confident	88 Å²	88	64.5 Å²	64.5	46%	0.461	31%	0.311	S	S	.	.	H	α-helix	trans	-59.2	-34.9	-179.3	-70.2	169.4	0	0	0	111.9	V211 A219 L248	V211-L215 HydrophobicContact CG1-CD2 4.2Å; V211-L215 PolarHBondContact O-N 2.96Å; L215-A219 WeakPolarHBondContact O-CB 3.42Å; L215-A219 PolarHBondContact O-N 3.44Å; L215-L248 HydrophobicContact CD2-CD2 3.51Å
216	T	79.8	Confident	83.4	Confident	125 Å²	125	60 Å²	60	77%	0.767	30%	0.297	S	S	*	.	H	α-helix	trans	-63.5	-49.1	-176.6	35.7	0	0	0	0	112.7	D214	D214-T216 PolarHBondContact O-N 2.85Å; D214-T216 PolarHBondContact OD1-N 3.28Å; D214-T216 PolarHBondContact OD1-OG1 3.09Å
217	N	82.5	Confident	83.2	Confident	97 Å²	97	65.2 Å²	65.2	52%	0.519	33%	0.329	S	S	.	.	H	α-helix	trans	-94.2	-23.4	-176.6	-59.1	-55.2	0	0	0	113.2	D214 K220	D214-N217 PolarHBondContact OD1-N 3.29Å; D214-N217 PolarHBondContact OD1-ND2 3.49Å; D214-N217 WeakPolarHBondContact OD2-CB 3.49Å; D214-N217 PolarHBondContact OD2-ND2 2.93Å; N217-K220 VanDerWaalsContact O-CE 3.28Å; N217-K220 WeakPolarHBondContact O-CE 3.48Å
218	R	85.8	Confident	82.9	Confident	38 Å²	38	65.6 Å²	65.6	14%	0.143	33%	0.332	C	S	.	.	H	α-helix	trans	-96.8	-14.1	-171.9	-57	176.8	-178.4	-176.7	-1.2	114.4	L179 W210 D214 K220 F221	L179-R218 PolarHBondContact O-NH1 2.93Å; L179-R218 PolarHBondContact O-NH2 2.87Å; W210-R218 HydrophobicContact CE3-CB 4.29Å; W210-R218 HydrophobicContact CE3-CG 4.32Å; W210-R218 HydrophobicContact CH2-CB 4.24Å; W210-R218 HydrophobicContact CH2-CG 3.78Å; W210-R218 HydrophobicContact CZ2-CG 4.36Å; W210-R218 HydrophobicContact CZ3-CB 3.74Å; W210-R218 HydrophobicContact CZ3-CG 3.76Å; W210-R218 VanDerWaalsContact O-CD 3.26Å; W210-R218 WeakPolarHBondContact O-CD 3.4Å; W210-R218 PolarHBondContact O-NH1 3.03Å; D214-R218 HydrophobicContact CB-CG 4.05Å; D214-R218 WeakPolarHBondContact O-CB 3.36Å; D214-R218 VanDerWaalsContact O-CG 3.27Å; D214-R218 WeakPolarHBondContact O-CG 3.31Å; D214-R218 PolarHBondContact O-N 3.45Å; R218-K220 PolarHBondContact O-N 3.21Å; R218-F221 PolarHBondContact O-N 2.95Å
219	A	77.8	Confident	82.6	Confident	29 Å²	29	63.2 Å²	63.2	24%	0.24	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-53.1	-41	177.6	0	0	0	0	0	112.7	L215 F221 V222 F252	L215-A219 WeakPolarHBondContact O-CB 3.42Å; L215-A219 PolarHBondContact O-N 3.44Å; A219-F221 PolarHBondContact O-N 3.43Å; A219-V222 WeakPolarHBondContact O-CB 3.39Å; A219-V222 VanDerWaalsContact O-CG2 3.3Å; A219-V222 WeakPolarHBondContact O-CG2 3.37Å; A219-V222 PolarHBondContact O-N 2.97Å; A219-F252 HydrophobicContact CB-CE1 3.87Å; A219-F252 HydrophobicContact CB-CZ 3.64Å; A219-F252 WeakPolarHBondContact O-CE1 3.47Å; A219-F252 VanDerWaalsContact O-CZ 3.26Å; A219-F252 WeakPolarHBondContact O-CZ 3.43Å
220	K	82.3	Confident	82.1	Confident	152 Å²	152	61.1 Å²	61.1	66%	0.661	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-60.9	-25.7	178.3	66.6	-170.9	-179.2	-175.3	0	114.6	N217 R218	N217-K220 VanDerWaalsContact O-CE 3.28Å; N217-K220 WeakPolarHBondContact O-CE 3.48Å; R218-K220 PolarHBondContact O-N 3.21Å
221	F	82.6	Confident	81.2	Confident	56 Å²	56	63.1 Å²	63.1	25%	0.246	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-88.7	-8.2	-177	-61.7	-58.5	0	0	0	113.6	Y183 W210 R218 A219 R223 S224 L225	Y183-F221 HydrophobicContact CD1-CD1 4.08Å; Y183-F221 HydrophobicContact CD1-CE1 4Å; Y183-F221 HydrophobicContact CD2-CB 3.67Å; Y183-F221 AromaticContact CD2-CD1 3.64Å; Y183-F221 HydrophobicContact CD2-CD1 3.64Å; Y183-F221 HydrophobicContact CD2-CD2 4.21Å; Y183-F221 HydrophobicContact CD2-CE1 4.3Å; Y183-F221 AromaticContact CD2-CG 3.58Å; Y183-F221 HydrophobicContact CD2-CG 3.58Å; Y183-F221 HydrophobicContact CE1-CD1 4.07Å; Y183-F221 HydrophobicContact CE1-CE1 4.2Å; Y183-F221 HydrophobicContact CE2-CB 3.69Å; Y183-F221 AromaticContact CE2-CD1 3.62Å; Y183-F221 HydrophobicContact CE2-CD1 3.62Å; Y183-F221 HydrophobicContact CE2-CE1 4.47Å; Y183-F221 AromaticContact CE2-CG 3.84Å; Y183-F221 HydrophobicContact CE2-CG 3.84Å; Y183-F221 AromaticContact CG-CD1 3.86Å; Y183-F221 HydrophobicContact CG-CD1 3.86Å; Y183-F221 HydrophobicContact CG-CD2 4.39Å; Y183-F221 HydrophobicContact CG-CE1 4.05Å; Y183-F221 HydrophobicContact CG-CG 4.05Å; Y183-F221 HydrophobicContact CG-CZ 4.39Å; Y183-F221 AromaticContact CZ-CD1 3.84Å; W210-F221 HydrophobicContact CH2-CD2 4.3Å; W210-F221 HydrophobicContact CZ3-CB 4.5Å; R218-F221 PolarHBondContact O-N 2.95Å; A219-F221 PolarHBondContact O-N 3.43Å; F221-R223 VanDerWaalsContact C-N 3.31Å; F221-R223 PolarHBondContact O-N 3.08Å; F221-S224 PolarHBondContact O-N 2.98Å; F221-L225 HydrophobicContact CB-CD1 4.27Å; F221-L225 WeakPolarHBondContact O-CG 3.43Å; F221-L225 PolarHBondContact O-N 2.93Å
222	V	80	Confident	80.5	Confident	7 Å²	7	69 Å²	69	4%	0.042	35%	0.352	C	S	.	.	H	α-helix	trans	-58.8	-42.5	-174.8	175.1	0	0	0	0	111.6	V211 A219 S224 L225 L226 F252	V211-V222 HydrophobicContact CB-CG2 4.33Å; V211-V222 HydrophobicContact CG1-CG2 3.6Å; V211-V222 HydrophobicContact CG2-CG2 3.74Å; A219-V222 WeakPolarHBondContact O-CB 3.39Å; A219-V222 VanDerWaalsContact O-CG2 3.3Å; A219-V222 WeakPolarHBondContact O-CG2 3.37Å; A219-V222 PolarHBondContact O-N 2.97Å; V222-S224 PolarHBondContact O-N 2.8Å; V222-L225 PolarHBondContact O-N 3.21Å; V222-L226 HydrophobicContact CG1-CD1 3.72Å; V222-L226 HydrophobicContact CG1-CG 4.05Å; V222-L226 WeakPolarHBondContact O-CB 3.41Å; V222-L226 VanDerWaalsContact O-CG 3.25Å; V222-L226 WeakPolarHBondContact O-CG 3.43Å; V222-L226 PolarHBondContact O-N 3.48Å; V222-F252 HydrophobicContact CB-CD2 4.07Å; V222-F252 HydrophobicContact CB-CE1 4.42Å; V222-F252 HydrophobicContact CB-CE2 3.7Å; V222-F252 HydrophobicContact CB-CZ 3.89Å; V222-F252 HydrophobicContact CG1-CD2 3.71Å; V222-F252 HydrophobicContact CG1-CE2 3.68Å; V222-F252 HydrophobicContact CG1-CZ 4.38Å; V222-F252 HydrophobicContact CG2-CD2 4.37Å; V222-F252 HydrophobicContact CG2-CE1 4.47Å; V222-F252 HydrophobicContact CG2-CE2 3.53Å; V222-F252 HydrophobicContact CG2-CZ 3.58Å
223	R	75.9	Confident	79.8	Confident	195 Å²	195	67.6 Å²	67.6	74%	0.736	35%	0.35	S	S	*	.	H	α-helix	trans	-57.4	-49.1	178.1	-173.9	174.8	-175.4	146.3	0.5	111.5	F221 L226 T227	F221-R223 VanDerWaalsContact C-N 3.31Å; F221-R223 PolarHBondContact O-N 3.08Å; R223-L226 PolarHBondContact O-N 3.3Å; R223-T227 WeakPolarHBondContact O-CG2 3.48Å; R223-T227 PolarHBondContact O-N 3.37Å
224	S	81.9	Confident	79	Confident	47 Å²	47	65.6 Å²	65.6	33%	0.329	33%	0.331	S	S	.	.	H	α-helix	trans	-66.3	-39.8	-179.8	-54.6	0	0	0	0	112.1	Y183 F221 V222 T227 C228	Y183-S224 WeakPolarHBondContact OH-CB 3.46Å; Y183-S224 PolarHBondContact OH-OG 3.44Å; F221-S224 PolarHBondContact O-N 2.98Å; V222-S224 PolarHBondContact O-N 2.8Å; S224-T227 PolarHBondContact O-N 3.35Å; S224-T227 PolarHBondContact O-OG1 3.42Å; S224-C228 PolarHBondContact O-SG 3.33Å
225	L	83.1	Confident	78.3	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-66.6	-38.4	176.8	-67.8	170.2	0	0	0	111.9	Y183 L186 V187 L190 I207 W210 V211 F221 V222 T227 C228	Y183-L225 HydrophobicContact CD2-CD2 4.3Å; Y183-L225 HydrophobicContact CD2-CG 4.47Å; Y183-L225 HydrophobicContact CE2-CD2 4.18Å; Y183-L225 HydrophobicContact CE2-CG 4.2Å; L186-L225 HydrophobicContact CD2-CD1 4.25Å; L186-L225 HydrophobicContact CD2-CD2 3.8Å; L186-L225 HydrophobicContact CG-CD2 4.06Å; V187-L225 HydrophobicContact CG2-CD2 3.85Å; L190-L225 HydrophobicContact CD1-CD2 3.89Å; I207-L225 HydrophobicContact CD1-CB 4.31Å; I207-L225 HydrophobicContact CG1-CB 4.41Å; I207-L225 HydrophobicContact CG2-CB 3.83Å; I207-L225 HydrophobicContact CG2-CD1 4.12Å; W210-L225 HydrophobicContact CE3-CD1 3.74Å; W210-L225 HydrophobicContact CZ3-CD1 3.63Å; V211-L225 HydrophobicContact CG2-CD1 4.21Å; F221-L225 HydrophobicContact CB-CD1 4.27Å; F221-L225 WeakPolarHBondContact O-CG 3.43Å; F221-L225 PolarHBondContact O-N 2.93Å; V222-L225 PolarHBondContact O-N 3.21Å; L225-T227 VanDerWaalsContact C-N 3.28Å; L225-T227 PolarHBondContact O-N 2.99Å; L225-C228 VanDerWaalsContact O-CB 3.31Å; L225-C228 WeakPolarHBondContact O-CB 3.46Å; L225-C228 PolarHBondContact O-N 3.11Å
226	L	79.3	Confident	77.8	Confident	38 Å²	38	71.9 Å²	71.9	20%	0.199	36%	0.361	C	S	.	.	H	α-helix	trans	-66.1	-28.8	176.6	-71.5	176.3	0	0	0	112.8	F204 V222 R223 C228 V229	F204-L226 HydrophobicContact CD2-CD2 3.8Å; F204-L226 HydrophobicContact CE2-CD2 3.71Å; V222-L226 HydrophobicContact CG1-CD1 3.72Å; V222-L226 HydrophobicContact CG1-CG 4.05Å; V222-L226 WeakPolarHBondContact O-CB 3.41Å; V222-L226 VanDerWaalsContact O-CG 3.25Å; V222-L226 WeakPolarHBondContact O-CG 3.43Å; V222-L226 PolarHBondContact O-N 3.48Å; R223-L226 PolarHBondContact O-N 3.3Å; L226-C228 PolarHBondContact O-N 2.98Å; L226-V229 PolarHBondContact O-N 3.06Å; L226-V229 VanDerWaalsContact O-N 3.13Å
227	T	82.3	Confident	77	Confident	112 Å²	112	73.2 Å²	73.2	69%	0.687	36%	0.358	S	S	*	.	H	α-helix	trans	-65.7	-18.9	172	64.2	0	0	0	0	113.5	R223 S224 L225	R223-T227 WeakPolarHBondContact O-CG2 3.48Å; R223-T227 PolarHBondContact O-N 3.37Å; S224-T227 PolarHBondContact O-N 3.35Å; S224-T227 PolarHBondContact O-OG1 3.42Å; L225-T227 VanDerWaalsContact C-N 3.28Å; L225-T227 PolarHBondContact O-N 2.99Å
228	C	80.3	Confident	75.9	Confident	14 Å²	14	70.3 Å²	70.3	10%	0.095	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-15.5	175.8	-54.2	0	0	0	0	112.4	L190 S224 L225 L226	L190-C228 HydrophobicContact CB-CB 3.84Å; S224-C228 PolarHBondContact O-SG 3.33Å; L225-C228 VanDerWaalsContact O-CB 3.31Å; L225-C228 WeakPolarHBondContact O-CB 3.46Å; L225-C228 PolarHBondContact O-N 3.11Å; L226-C228 PolarHBondContact O-N 2.98Å
229	V	79.7	Confident	74.7	Confident	8 Å²	8	70.8 Å²	70.8	5%	0.048	35%	0.35	C	S	.	.	S	Bend	trans	-82	127.2	178	-175.3	0	0	0	0	109.2	E200 V203 I207 L226 L231	E200-V229 HydrophobicContact CB-CG1 4.39Å; V203-V229 HydrophobicContact CG1-CG2 4.26Å; I207-V229 HydrophobicContact CD1-CG2 3.33Å; L226-V229 PolarHBondContact O-N 3.06Å; L226-V229 VanDerWaalsContact O-N 3.13Å; V229-L231 HydrophobicContact CB-CD2 4.2Å; V229-L231 HydrophobicContact CB-CG 4.49Å; V229-L231 HydrophobicContact CG1-CD2 3.83Å; V229-L231 HydrophobicContact CG1-CG 4.42Å; V229-L231 PolarHBondContact O-N 3.42Å
230	R	76.1	Confident	73.9	Confident	61 Å²	61	71 Å²	71	23%	0.23	35%	0.352	C	S	.	.			trans	-78.5	71.5	177.3	-57.3	-175.4	-170.6	97.2	0.9	110.1	D193 E200 H232 L233	D193-R230 IonicContact OD1-CZ 2.7Å; D193-R230 IonicContact OD1-NE 3.92Å; D193-R230 IonicContact OD1-NH2 3.91Å; D193-R230 PolarHBondContact OD1-NH2 3.13Å; E200-R230 HydrophobicContact CG-CB 3.92Å; E200-R230 IonicContact OE1-CZ 2.78Å; E200-R230 IonicContact OE1-NH1 2.82Å; E200-R230 PolarHBondContact OE1-NH1 3.28Å; E200-R230 PolarHBondContact OE2-N 3.28Å; R230-H232 PolarHBondContact O-N 2.9Å; R230-L233 HydrophobicContact CB-CD1 3.84Å; R230-L233 HydrophobicContact CB-CG 4.08Å; R230-L233 HydrophobicContact CG-CD1 4.5Å; R230-L233 WeakPolarHBondContact O-CB 3.31Å; R230-L233 PolarHBondContact O-N 3.42Å
231	L	71	Confident	72.8	Confident	47 Å²	47	69.5 Å²	69.5	25%	0.246	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-53.1	-27.5	-174.6	-64.7	176.4	0	0	0	113.5	V229 L233 L234 L239 I243	V229-L231 HydrophobicContact CB-CD2 4.2Å; V229-L231 HydrophobicContact CB-CG 4.49Å; V229-L231 HydrophobicContact CG1-CD2 3.83Å; V229-L231 HydrophobicContact CG1-CG 4.42Å; V229-L231 PolarHBondContact O-N 3.42Å; L231-L233 PolarHBondContact O-N 3.13Å; L231-L234 HydrophobicContact CD2-CD1 3.87Å; L231-L234 WeakPolarHBondContact O-CB 3.42Å; L231-L234 PolarHBondContact O-N 2.82Å; L231-L239 HydrophobicContact CB-CD2 4.4Å; L231-L239 HydrophobicContact CD2-CD2 4.18Å; L231-I243 HydrophobicContact CD2-CD1 3.93Å
232	H	71.8	Confident	71.9	Confident	126 Å²	126	69.1 Å²	69.1	58%	0.583	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-66.6	-18.9	176.6	61.7	-91.8	0	0	0	114.2	R230	R230-H232 PolarHBondContact O-N 2.9Å
233	L	72.3	Confident	71	Confident	84 Å²	84	69.5 Å²	69.5	44%	0.44	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-87.4	-11.9	175.5	-59.7	178.7	0	0	0	112.7	E200 R230 L231	E200-L233 HydrophobicContact CG-CB 3.91Å; E200-L233 HydrophobicContact CG-CD1 3.9Å; E200-L233 HydrophobicContact CG-CG 4.43Å; R230-L233 HydrophobicContact CB-CD1 3.84Å; R230-L233 HydrophobicContact CB-CG 4.08Å; R230-L233 HydrophobicContact CG-CD1 4.5Å; R230-L233 WeakPolarHBondContact O-CB 3.31Å; R230-L233 PolarHBondContact O-N 3.42Å; L231-L233 PolarHBondContact O-N 3.13Å
234	L	69.7	Low	70.3	Confident	12 Å²	12	63.2 Å²	63.2	6%	0.063	34%	0.336	C	S	.	.	S	Bend	trans	-77.7	137.2	179.9	-68.8	173.6	0	0	0	111.5	E200 L201 L231 K236 L239 I243	E200-L234 HydrophobicContact CB-CD2 3.83Å; E200-L234 HydrophobicContact CB-CG 4.08Å; L201-L234 HydrophobicContact CB-CD2 3.88Å; L231-L234 HydrophobicContact CD2-CD1 3.87Å; L231-L234 WeakPolarHBondContact O-CB 3.42Å; L231-L234 PolarHBondContact O-N 2.82Å; L234-K236 PolarHBondContact O-N 3.4Å; L234-L239 HydrophobicContact CB-CD1 4.17Å; L234-L239 HydrophobicContact CB-CD2 4.33Å; L234-L239 HydrophobicContact CB-CG 3.9Å; L234-L239 HydrophobicContact CD1-CD2 4.04Å; L234-L239 HydrophobicContact CD1-CG 4.39Å; L234-I243 HydrophobicContact CD1-CD1 3.35Å
235	P	69.6	Low	69.3	Low	76 Å²	76	64.4 Å²	64.4	49%	0.494	34%	0.344	S	S	.	.			trans	-56.8	138.8	169.7	-22.3	32.2	0	0	0	110.8	Q237 C238 L239	P235-Q237 PolarHBondContact O-N 3.12Å; P235-C238 WeakPolarHBondContact O-CB 3.39Å; P235-C238 PolarHBondContact O-N 3.13Å; P235-L239 PolarHBondContact O-N 3.27Å
236	K	69.4	Low	68.6	Low	186 Å²	186	64.9 Å²	64.9	81%	0.809	35%	0.346	S	S	*	.	H	α-helix	trans	-51.8	-35.6	179.9	-68	-175.5	178.5	-178.8	0	112.9	L234 L239 A240	L234-K236 PolarHBondContact O-N 3.4Å; K236-L239 PolarHBondContact O-N 3.13Å; K236-A240 PolarHBondContact O-N 2.96Å
237	Q	63.4	Low	68.1	Low	153 Å²	153	68.7 Å²	68.7	72%	0.715	37%	0.367	S	S	*	.	H	α-helix	trans	-65.7	-39.6	177.7	-65.8	171.8	-1.2	0	0	112.4	P235 A240 N241	P235-Q237 PolarHBondContact O-N 3.12Å; Q237-A240 PolarHBondContact O-N 3.29Å; Q237-N241 VanDerWaalsContact O-CB 3.31Å; Q237-N241 WeakPolarHBondContact O-CB 3.34Å; Q237-N241 PolarHBondContact O-N 2.68Å
238	C	60	Low	67.3	Low	35 Å²	35	64.6 Å²	64.6	24%	0.236	34%	0.341	C	S	.	.	H	α-helix	trans	-70.6	-36.8	178.4	-61.5	0	0	0	0	111.9	P235 A240 V242	P235-C238 WeakPolarHBondContact O-CB 3.39Å; P235-C238 PolarHBondContact O-N 3.13Å; C238-A240 VanDerWaalsContact C-N 3.33Å; C238-A240 PolarHBondContact O-N 2.79Å; C238-V242 WeakPolarHBondContact O-CB 3.33Å; C238-V242 PolarHBondContact O-N 2.85Å
239	L	61.4	Low	66.6	Low	48 Å²	48	64.8 Å²	64.8	25%	0.251	34%	0.341	S	S	.	.	I	π-helix	trans	-59.1	-44.8	174.2	-78.5	158.7	0	0	0	111.3	L231 L234 P235 K236 I243 L244	L231-L239 HydrophobicContact CB-CD2 4.4Å; L231-L239 HydrophobicContact CD2-CD2 4.18Å; L234-L239 HydrophobicContact CB-CD1 4.17Å; L234-L239 HydrophobicContact CB-CD2 4.33Å; L234-L239 HydrophobicContact CB-CG 3.9Å; L234-L239 HydrophobicContact CD1-CD2 4.04Å; L234-L239 HydrophobicContact CD1-CG 4.39Å; P235-L239 PolarHBondContact O-N 3.27Å; K236-L239 PolarHBondContact O-N 3.13Å; L239-I243 HydrophobicContact CD2-CD1 3.9Å; L239-L244 WeakPolarHBondContact O-CG 3.49Å; L239-L244 PolarHBondContact O-N 3.23Å; L239-L244 VanDerWaalsContact O-N 3.09Å
240	A	60.2	Low	65.8	Low	34 Å²	34	68.5 Å²	68.5	28%	0.281	36%	0.358	S	S	.	.	I	π-helix	trans	-71.8	-46.4	178.9	0	0	0	0	0	113.4	K236 Q237 C238	K236-A240 PolarHBondContact O-N 2.96Å; Q237-A240 PolarHBondContact O-N 3.29Å; C238-A240 VanDerWaalsContact C-N 3.33Å; C238-A240 PolarHBondContact O-N 2.79Å
241	N	59.5	Low	65	Low	121 Å²	121	69.6 Å²	69.6	65%	0.647	37%	0.369	S	S	*	.	I	π-helix	trans	-90.2	-13.9	-168.4	-68	-5.7	0	0	0	114.9	Q237 S245	Q237-N241 VanDerWaalsContact O-CB 3.31Å; Q237-N241 WeakPolarHBondContact O-CB 3.34Å; Q237-N241 PolarHBondContact O-N 2.68Å; N241-S245 PolarHBondContact O-OG 3.23Å
242	V	62.1	Low	64.4	Low	48 Å²	48	69.7 Å²	69.7	29%	0.291	37%	0.367	S	S	.	.	I	π-helix	trans	-122.2	-43.2	-175.3	-172.5	0	0	0	0	111.9	L201 F204 C238 D246	L201-V242 HydrophobicContact CD1-CB 4.4Å; L201-V242 HydrophobicContact CD1-CG1 4.04Å; F204-V242 HydrophobicContact CE1-CG1 4.4Å; C238-V242 WeakPolarHBondContact O-CB 3.33Å; C238-V242 PolarHBondContact O-N 2.85Å; V242-D246 WeakPolarHBondContact O-CB 3.31Å
243	I	62.9	Low	63.3	Low	14 Å²	14	64.8 Å²	64.8	7%	0.072	35%	0.348	C	S	.	.	I	π-helix	trans	-86.3	-50.7	-176.1	-64.2	173.7	0	0	0	110.4	F204 L231 L234 L239 S245 D246 V249	F204-I243 HydrophobicContact CD1-CG1 4.08Å; F204-I243 HydrophobicContact CD2-CD1 4.24Å; F204-I243 HydrophobicContact CD2-CG1 4.1Å; F204-I243 HydrophobicContact CE1-CG1 3.88Å; F204-I243 HydrophobicContact CE2-CB 4.48Å; F204-I243 HydrophobicContact CE2-CD1 4.42Å; F204-I243 HydrophobicContact CE2-CG1 3.89Å; F204-I243 HydrophobicContact CE2-CG2 4.13Å; F204-I243 HydrophobicContact CG-CD1 4.36Å; F204-I243 HydrophobicContact CG-CG1 4.2Å; F204-I243 HydrophobicContact CZ-CB 4.28Å; F204-I243 HydrophobicContact CZ-CG1 3.78Å; F204-I243 HydrophobicContact CZ-CG2 4.29Å; L231-I243 HydrophobicContact CD2-CD1 3.93Å; L234-I243 HydrophobicContact CD1-CD1 3.35Å; L239-I243 HydrophobicContact CD2-CD1 3.9Å; I243-S245 VanDerWaalsContact C-N 3.3Å; I243-S245 PolarHBondContact O-N 3.45Å; I243-D246 PolarHBondContact O-N 3.16Å; I243-V249 HydrophobicContact CG2-CG1 4.45Å; I243-V249 HydrophobicContact CG2-CG2 4.19Å; I243-V249 WeakPolarHBondContact O-CB 3.47Å
244	L	60.7	Low	62.1	Low	64 Å²	64	66.6 Å²	66.6	34%	0.335	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-23.2	-178.6	-71.5	174.8	0	0	0	113.3	L239 Q250	L239-L244 WeakPolarHBondContact O-CG 3.49Å; L239-L244 PolarHBondContact O-N 3.23Å; L239-L244 VanDerWaalsContact O-N 3.09Å; L244-Q250 WeakPolarHBondContact O-CG 2.88Å; L244-Q250 PolarHBondContact O-NE2 3.42Å
245	S	61	Low	60.7	Low	71 Å²	71	70.8 Å²	70.8	50%	0.497	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-5.7	175.2	61.3	0	0	0	0	113.6	N241 I243	N241-S245 PolarHBondContact O-OG 3.23Å; I243-S245 VanDerWaalsContact C-N 3.3Å; I243-S245 PolarHBondContact O-N 3.45Å
246	D	67.7	Low	59.2	Low	10 Å²	10	70.5 Å²	70.5	5%	0.053	37%	0.372	C	S	.	.			trans	-75.9	127	-177.3	-145	-49.3	0	0	0	110.5	K208 V242 I243 L248 V249 Q250	K208-D246 VanDerWaalsContact CD-OD2 3.27Å; K208-D246 WeakPolarHBondContact CD-OD2 3.27Å; K208-D246 WeakPolarHBondContact CE-OD1 3.06Å; K208-D246 WeakPolarHBondContact CE-OD2 3.43Å; K208-D246 VanDerWaalsContact NZ-CG 3.29Å; K208-D246 IonicContact NZ-OD1 3.25Å; K208-D246 PolarHBondContact NZ-OD1 3.11Å; K208-D246 IonicContact NZ-OD2 2.65Å; K208-D246 PolarHBondContact NZ-OD2 3.28Å; V242-D246 WeakPolarHBondContact O-CB 3.31Å; I243-D246 PolarHBondContact O-N 3.16Å; D246-L248 PolarHBondContact O-N 2.62Å; D246-L248 VanDerWaalsContact O-N 3.09Å; D246-V249 HydrophobicContact CB-CG2 4.24Å; D246-V249 PolarHBondContact O-N 2.93Å; D246-Q250 PolarHBondContact O-N 3.28Å
247	D	68.1	Low	57.4	Low	119 Å²	119	67.2 Å²	67.2	64%	0.636	35%	0.354	S	S	*	.	H	α-helix	trans	-53.5	-33.5	178.5	-65.1	-39.4	0	0	0	112.3	N251	D247-N251 VanDerWaalsContact O-CB 3.22Å; D247-N251 WeakPolarHBondContact O-CB 3.49Å; D247-N251 PolarHBondContact O-N 2.76Å; D247-N251 PolarHBondContact O-ND2 3.36Å; D247-N251 VanDerWaalsContact O-ND2 3.16Å
248	L	66.5	Low	56	Low	26 Å²	26	66.3 Å²	66.3	14%	0.136	35%	0.353	C	S	.	.	H	α-helix	trans	-60.7	-56.6	176.4	-68.3	172.9	0	0	0	110.2	K208 V211 K212 L215 D246 Q250 N251 F252	K208-L248 HydrophobicContact CG-CD1 3.98Å; V211-L248 HydrophobicContact CG1-CD1 4.39Å; V211-L248 HydrophobicContact CG1-CD2 4.39Å; K212-L248 HydrophobicContact CG-CD1 4.05Å; L215-L248 HydrophobicContact CD2-CD2 3.51Å; D246-L248 PolarHBondContact O-N 2.62Å; D246-L248 VanDerWaalsContact O-N 3.09Å; L248-Q250 VanDerWaalsContact C-N 3.3Å; L248-Q250 PolarHBondContact O-N 2.76Å; L248-N251 PolarHBondContact O-N 2.88Å; L248-F252 HydrophobicContact CB-CE2 4.25Å; L248-F252 WeakPolarHBondContact O-CD2 3.48Å; L248-F252 WeakPolarHBondContact O-CE2 3.25Å; L248-F252 WeakPolarHBondContact O-CG 3.47Å; L248-F252 PolarHBondContact O-N 3.37Å
249	V	66.3	Low	54.7	Low	17 Å²	17	73 Å²	73	10%	0.103	38%	0.383	C	S	.	.	H	α-helix	trans	-65.8	-36.3	-177.3	-176.9	0	0	0	0	110.9	F204 I243 D246 F252 A253	F204-V249 HydrophobicContact CE2-CG2 4.34Å; F204-V249 HydrophobicContact CZ-CG2 4.26Å; I243-V249 HydrophobicContact CG2-CG1 4.45Å; I243-V249 HydrophobicContact CG2-CG2 4.19Å; I243-V249 WeakPolarHBondContact O-CB 3.47Å; D246-V249 HydrophobicContact CB-CG2 4.24Å; D246-V249 PolarHBondContact O-N 2.93Å; V249-F252 PolarHBondContact O-N 2.87Å; V249-A253 WeakPolarHBondContact O-CB 3.31Å; V249-A253 PolarHBondContact O-N 3.36Å
250	Q	62.3	Low	53.5	Low	86 Å²	86	75.8 Å²	75.8	40%	0.402	40%	0.395	S	S	.	.	H	α-helix	trans	-65.4	-43.5	175.3	-77.4	-75	-20	0	0	112.7	L244 D246 L248 F252 A253 K254	L244-Q250 WeakPolarHBondContact O-CG 2.88Å; L244-Q250 PolarHBondContact O-NE2 3.42Å; D246-Q250 PolarHBondContact O-N 3.28Å; L248-Q250 VanDerWaalsContact C-N 3.3Å; L248-Q250 PolarHBondContact O-N 2.76Å; Q250-F252 VanDerWaalsContact C-N 3.33Å; Q250-A253 WeakPolarHBondContact O-CB 3.36Å; Q250-A253 PolarHBondContact O-N 2.97Å; Q250-K254 WeakPolarHBondContact O-CG 3.41Å; Q250-K254 PolarHBondContact O-N 3.49Å
251	N	60.4	Low	52.3	Low	84 Å²	84	81 Å²	81	45%	0.449	42%	0.418	S	S	.	.	H	α-helix	trans	-65.7	-38.6	176.4	-71.3	-22.4	0	0	0	111	D247 L248 A253 K254 D255	D247-N251 VanDerWaalsContact O-CB 3.22Å; D247-N251 WeakPolarHBondContact O-CB 3.49Å; D247-N251 PolarHBondContact O-N 2.76Å; D247-N251 PolarHBondContact O-ND2 3.36Å; D247-N251 VanDerWaalsContact O-ND2 3.16Å; L248-N251 PolarHBondContact O-N 2.88Å; N251-A253 VanDerWaalsContact C-N 3.34Å; N251-A253 PolarHBondContact O-N 3.32Å; N251-K254 WeakPolarHBondContact O-CB 3.47Å; N251-K254 PolarHBondContact O-N 3.09Å; N251-D255 PolarHBondContact O-N 3.06Å; N251-D255 VanDerWaalsContact O-N 3.14Å
252	F	56.7	Low	51.1	Low	50 Å²	50	83.2 Å²	83.2	22%	0.219	43%	0.43	C	S	.	.	H	α-helix	trans	-67.4	-32.5	172.1	-67	-61	0	0	0	113.2	A219 V222 L248 V249 Q250 K254 D255 V256	A219-F252 HydrophobicContact CB-CE1 3.87Å; A219-F252 HydrophobicContact CB-CZ 3.64Å; A219-F252 WeakPolarHBondContact O-CE1 3.47Å; A219-F252 VanDerWaalsContact O-CZ 3.26Å; A219-F252 WeakPolarHBondContact O-CZ 3.43Å; V222-F252 HydrophobicContact CB-CD2 4.07Å; V222-F252 HydrophobicContact CB-CE1 4.42Å; V222-F252 HydrophobicContact CB-CE2 3.7Å; V222-F252 HydrophobicContact CB-CZ 3.89Å; V222-F252 HydrophobicContact CG1-CD2 3.71Å; V222-F252 HydrophobicContact CG1-CE2 3.68Å; V222-F252 HydrophobicContact CG1-CZ 4.38Å; V222-F252 HydrophobicContact CG2-CD2 4.37Å; V222-F252 HydrophobicContact CG2-CE1 4.47Å; V222-F252 HydrophobicContact CG2-CE2 3.53Å; V222-F252 HydrophobicContact CG2-CZ 3.58Å; L248-F252 HydrophobicContact CB-CE2 4.25Å; L248-F252 WeakPolarHBondContact O-CD2 3.48Å; L248-F252 WeakPolarHBondContact O-CE2 3.25Å; L248-F252 WeakPolarHBondContact O-CG 3.47Å; L248-F252 PolarHBondContact O-N 3.37Å; V249-F252 PolarHBondContact O-N 2.87Å; Q250-F252 VanDerWaalsContact C-N 3.33Å; F252-K254 VanDerWaalsContact C-N 3.26Å; F252-K254 PolarHBondContact O-N 3.02Å; F252-D255 PolarHBondContact O-N 3.19Å; F252-V256 WeakPolarHBondContact O-CG2 3.38Å; F252-V256 PolarHBondContact O-N 3.45Å
253	A	50	Low	49.5	Very low	22 Å²	22	84.3 Å²	84.3	18%	0.182	45%	0.451	C	S	.	.	H	α-helix	trans	-67.3	-27.9	173.7	0	0	0	0	0	112.2	V249 Q250 N251 R257	V249-A253 WeakPolarHBondContact O-CB 3.31Å; V249-A253 PolarHBondContact O-N 3.36Å; Q250-A253 WeakPolarHBondContact O-CB 3.36Å; Q250-A253 PolarHBondContact O-N 2.97Å; N251-A253 VanDerWaalsContact C-N 3.34Å; N251-A253 PolarHBondContact O-N 3.32Å; A253-R257 PolarHBondContact O-N 2.95Å
254	K	46.7	Very low	47.9	Very low	122 Å²	122	88.8 Å²	88.8	53%	0.53	48%	0.484	S	S	.	.	H	α-helix	trans	-73.9	-40.6	173.2	-69.7	174.6	-177.5	173.9	0	112.1	Q250 N251 F252 V256 R257 L258	Q250-K254 WeakPolarHBondContact O-CG 3.41Å; Q250-K254 PolarHBondContact O-N 3.49Å; N251-K254 WeakPolarHBondContact O-CB 3.47Å; N251-K254 PolarHBondContact O-N 3.09Å; F252-K254 VanDerWaalsContact C-N 3.26Å; F252-K254 PolarHBondContact O-N 3.02Å; K254-V256 PolarHBondContact O-N 3.06Å; K254-R257 PolarHBondContact O-N 3.36Å; K254-R257 VanDerWaalsContact O-N 3.07Å; K254-L258 PolarHBondContact O-N 3.18Å
255	D	40.9	Very low	46.6	Very low	101 Å²	101	90.6 Å²	90.6	54%	0.54	50%	0.502	S	S	.	.	H	α-helix	trans	-63.8	-28.5	176.5	-72.8	-20.5	0	0	0	112.7	N251 F252	N251-D255 PolarHBondContact O-N 3.06Å; N251-D255 VanDerWaalsContact O-N 3.14Å; F252-D255 PolarHBondContact O-N 3.19Å
256	V	36.2	Very low	45.1	Very low	69 Å²	69	96.5 Å²	96.5	42%	0.418	52%	0.522	S	S	.	.	H	α-helix	trans	-72.9	-33.5	173.2	175	0	0	0	0	112.2	F252 K254 L258 M259	F252-V256 WeakPolarHBondContact O-CG2 3.38Å; F252-V256 PolarHBondContact O-N 3.45Å; K254-V256 PolarHBondContact O-N 3.06Å; V256-L258 VanDerWaalsContact C-N 3.31Å; V256-L258 PolarHBondContact O-N 3.32Å; V256-M259 PolarHBondContact O-N 2.88Å
257	R	32.2	Very low	43.4	Very low	118 Å²	118	103.1 Å²	103.1	45%	0.445	56%	0.557	S	S	.	*	H	α-helix	trans	-69.4	-27.5	178.6	-73.2	-180	-177.9	-164.8	-1.5	113	A253 K254 M259 E260 L274	A253-R257 PolarHBondContact O-N 2.95Å; K254-R257 PolarHBondContact O-N 3.36Å; K254-R257 VanDerWaalsContact O-N 3.07Å; R257-M259 PolarHBondContact O-N 2.79Å; R257-E260 PolarHBondContact O-N 2.97Å; R257-L274 HydrophobicContact CG-CD1 4.33Å; R257-L274 HydrophobicContact CG-CD2 4.02Å
258	L	34.2	Very low	41.7	Very low	133 Å²	133	106.4 Å²	106.4	70%	0.696	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-0.9	178.8	-68.8	171.7	0	0	0	114.2	K254 V256	K254-L258 PolarHBondContact O-N 3.18Å; V256-L258 VanDerWaalsContact C-N 3.31Å; V256-L258 PolarHBondContact O-N 3.32Å
259	M	33.3	Very low	39.9	Very low	175 Å²	175	113.5 Å²	113.5	86%	0.862	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.7	1.1	176.5	-71.2	-165.6	162.6	0	0	114.4	V256 R257	V256-M259 PolarHBondContact O-N 2.88Å; R257-M259 PolarHBondContact O-N 2.79Å
260	E	36.4	Very low	38	Very low	107 Å²	107	121.2 Å²	121.2	50%	0.5	64%	0.64	S	S	.	*			trans	-110.4	10.1	-176	-68.8	-174.9	162.1	0	0	114.4	R257 D262 R277	R257-E260 PolarHBondContact O-N 2.97Å; E260-D262 VanDerWaalsContact C-N 3.35Å; E260-D262 PolarHBondContact O-N 2.95Å; E260-R277 IonicContact OE1-CZ 3.73Å; E260-R277 IonicContact OE1-NH1 2.88Å; E260-R277 PolarHBondContact OE1-NH1 2.94Å
261	D	33.5	Very low	36.3	Very low	143 Å²	143	125 Å²	125	77%	0.765	66%	0.66	S	S	*	*			trans	-85.2	17.8	-171.6	-103.1	-4.7	0	0	0	116.5	G263	D261-G263 PolarHBondContact O-N 3Å
262	D	34.1	Very low	34.9	Very low	168 Å²	168	124 Å²	124	90%	0.898	66%	0.659	S	S	*	*	S	Bend	trans	-98.5	86	171.4	-81.7	-25.4	0	0	0	111.5	E260	E260-D262 VanDerWaalsContact C-N 3.35Å; E260-D262 PolarHBondContact O-N 2.95Å
263	G	29.7	Very low	33.7	Very low	71 Å²	71	127.8 Å²	127.8	73%	0.732	68%	0.681	S	S	*	*	S	Bend	trans	74.1	93.3	144.9	0	0	0	0	0	117.7	D261	D261-G263 PolarHBondContact O-N 3Å
264	S	30.1	Very low	32.8	Very low	109 Å²	109	130 Å²	130	76%	0.762	69%	0.689	S	S	*	*				173.1	122.6	116.7	53.6	0	0	0	0	110.7
265	S	31.6	Very low	32	Very low	102 Å²	102	132.3 Å²	132.3	71%	0.713	70%	0.695	S	S	*	*			trans	54.5	105.4	149.7	54	0	0	0	0	118.1	D267	S265-D267 PolarHBondContact O-N 3.25Å
266	E	29.4	Very low	31.4	Very low	195 Å²	195	131.2 Å²	131.2	91%	0.911	69%	0.694	S	S	*	*			trans	-45.3	111	150.4	-60.6	174.1	144.3	0	0	111
267	D	32.9	Very low	31	Very low	149 Å²	149	137.4 Å²	137.4	80%	0.797	71%	0.71	S	S	*	*			trans	-136.4	111.4	152.1	-89.9	-33.7	0	0	0	107.6	S265 L269	S265-D267 PolarHBondContact O-N 3.25Å; D267-L269 PolarHBondContact O-N 3.47Å
268	E	32.8	Very low	31.2	Very low	187 Å²	187	136.7 Å²	136.7	87%	0.874	71%	0.714	S	S	*	*			trans	28.4	80.4	152.9	-66.6	-177.8	150.3	0	0	118.8	E270	E268-E270 PolarHBondContact O-N 3.44Å
269	L	27.4	Very low	31	Very low	175 Å²	175	134.1 Å²	134.1	92%	0.916	70%	0.704	S	S	*	*				47	61	115	-132.1	96.7	0	0	0	119.9	D267	D267-L269 PolarHBondContact O-N 3.47Å
270	E	28.3	Very low	30.7	Very low	179 Å²	179	129.7 Å²	129.7	84%	0.836	70%	0.703	S	S	*	*			trans	-128.9	137.7	144.1	-78.6	-166.3	158.6	0	0	110.1	E268 P272	E268-E270 PolarHBondContact O-N 3.44Å; E270-P272 WeakPolarHBondContact O-CD 3.49Å
271	M	26.1	Very low	30.4	Very low	165 Å²	165	129.8 Å²	129.8	81%	0.813	71%	0.706	S	S	*	*			trans	-95.2	80.8	-178.8	-86	-112.4	-65.6	0	0	113
272	P	31.3	Very low	30.1	Very low	65 Å²	65	130.7 Å²	130.7	42%	0.422	71%	0.711	S	S	.	*			trans	-115.1	-14.8	163.5	34.3	-27.1	0	0	0	114.8	E270 L274 R275	E270-P272 WeakPolarHBondContact O-CD 3.49Å; P272-L274 PolarHBondContact O-N 3.48Å; P272-R275 PolarHBondContact O-N 3.18Å
273	N	31.1	Very low	29.8	Very low	128 Å²	128	129 Å²	129	68%	0.684	71%	0.707	S	S	*	*	H	α-helix	trans	-83	-14.1	-164.1	-70.8	-20	0	0	0	116.7
274	L	29.6	Very low	29.6	Very low	68 Å²	68	128.7 Å²	128.7	36%	0.356	70%	0.703	S	S	.	*	H	α-helix	trans	-80	-16.4	169.2	-97.6	104.6	0	0	0	113.8	R257 P272 C276	R257-L274 HydrophobicContact CG-CD1 4.33Å; R257-L274 HydrophobicContact CG-CD2 4.02Å; P272-L274 PolarHBondContact O-N 3.48Å; L274-C276 VanDerWaalsContact C-N 3.34Å
275	R	30.5	Very low	29.5	Very low	171 Å²	171	132.1 Å²	132.1	65%	0.645	71%	0.707	S	S	*	*	H	α-helix	trans	-75	-27.5	177.1	-122.7	177.1	-175.7	-177.1	2.7	112.1	P272 T279	P272-R275 PolarHBondContact O-N 3.18Å; R275-T279 PolarHBondContact O-OG1 2.92Å; R275-T279 VanDerWaalsContact O-OG1 3.13Å
276	C	29	Very low	29.3	Very low	79 Å²	79	135 Å²	135	53%	0.534	71%	0.712	S	S	.	*	H	α-helix	trans	-86.6	-21.7	-170.6	-63.9	0	0	0	0	114.8	L274 T279	L274-C276 VanDerWaalsContact C-N 3.34Å; C276-T279 PolarHBondContact O-OG1 3.01Å
277	R	28.5	Very low	29.2	Very low	198 Å²	198	134.6 Å²	134.6	75%	0.747	71%	0.711	S	S	*	*	H	α-helix	trans	-87.2	-20.9	-179.7	-91.3	-178.5	174	171.8	0.3	114.9	E260 T279	E260-R277 IonicContact OE1-CZ 3.73Å; E260-R277 IonicContact OE1-NH1 2.88Å; E260-R277 PolarHBondContact OE1-NH1 2.94Å; R277-T279 VanDerWaalsContact C-N 3.28Å
278	I	35	Very low	28.9	Very low	104 Å²	104	132.4 Å²	132.4	53%	0.533	71%	0.713	S	S	.	*	S	Bend	trans	-81.4	-15.8	172.5	-59.8	177.1	0	0	0	110.6
279	T	30.5	Very low	28.6	Very low	78 Å²	78	129.7 Å²	129.7	48%	0.479	71%	0.705	S	S	.	*			trans	-109.7	85.3	174.6	56.6	0	0	0	0	110.1	R275 C276 R277 I281	R275-T279 PolarHBondContact O-OG1 2.92Å; R275-T279 VanDerWaalsContact O-OG1 3.13Å; C276-T279 PolarHBondContact O-OG1 3.01Å; R277-T279 VanDerWaalsContact C-N 3.28Å; T279-I281 PolarHBondContact O-N 2.84Å
280	G	27.3	Very low	28.5	Very low	82 Å²	82	127 Å²	127	85%	0.845	70%	0.698	S	S	*	*			trans	-67.6	37.7	172.4	0	0	0	0	0	114.7
281	I	30.1	Very low	28.5	Very low	109 Å²	109	129.2 Å²	129.2	56%	0.559	70%	0.698	S	S	*	*			trans	-131	111	174.6	-56.7	178.8	0	0	0	107.8	T279 V283	T279-I281 PolarHBondContact O-N 2.84Å; I281-V283 VanDerWaalsContact O-CG2 3.31Å; I281-V283 WeakPolarHBondContact O-CG2 3.46Å; I281-V283 PolarHBondContact O-N 3.46Å; I281-V283 VanDerWaalsContact O-N 3.11Å
282	N	26.2	Very low	28.6	Very low	162 Å²	162	127.3 Å²	127.3	87%	0.866	69%	0.691	S	S	*	*			trans	-67.9	99.6	171.5	-138.2	-12.6	0	0	0	107.6	G284	N282-G284 PolarHBondContact O-N 3.07Å
283	V	27.6	Very low	28.5	Very low	134 Å²	134	133.2 Å²	133.2	81%	0.812	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	35.8	-175.2	-160.8	0	0	0	0	111.6	I281	I281-V283 VanDerWaalsContact O-CG2 3.31Å; I281-V283 WeakPolarHBondContact O-CG2 3.46Å; I281-V283 PolarHBondContact O-N 3.46Å; I281-V283 VanDerWaalsContact O-N 3.11Å
284	G	27	Very low	28.4	Very low	63 Å²	63	133.5 Å²	133.5	65%	0.649	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	-14.6	-172.7	0	0	0	0	0	116	N282	N282-G284 PolarHBondContact O-N 3.07Å
285	E	26.9	Very low	28.2	Very low	182 Å²	182	138 Å²	138	85%	0.85	73%	0.731	S	S	*	*			trans	-140.7	79.6	-173.4	-71.1	179.1	169	0	0	110.9
286	I	28.2	Very low	28	Very low	161 Å²	161	136 Å²	136	83%	0.826	74%	0.737	S	S	*	*			trans	-126.2	90	159.2	-58.7	179.8	0	0	0	106.5	A288	I286-A288 PolarHBondContact O-N 2.9Å
287	E	27.1	Very low	27.9	Very low	188 Å²	188	135.4 Å²	135.4	88%	0.879	74%	0.738	S	S	*	*			trans	-56.2	129.5	170	-72	-175.3	147.4	0	0	110.2	N289	E287-N289 PolarHBondContact O-N 2.51Å; E287-N289 VanDerWaalsContact O-N 3.14Å
288	A	26.5	Very low	27.9	Very low	102 Å²	102	134.1 Å²	134.1	84%	0.843	74%	0.738	S	S	*	*			trans	-67.1	106.4	178.4	0	0	0	0	0	110.7	I286 P290	I286-A288 PolarHBondContact O-N 2.9Å; A288-P290 WeakPolarHBondContact O-CD 3.46Å
289	N	25.6	Very low	27.6	Very low	131 Å²	131	136.4 Å²	136.4	70%	0.701	75%	0.746	S	S	*	*			trans	-92.2	112.1	166.1	-167.6	-18.2	0	0	0	109.7	E287 R291	E287-N289 PolarHBondContact O-N 2.51Å; E287-N289 VanDerWaalsContact O-N 3.14Å; N289-R291 PolarHBondContact O-N 3.47Å
290	P	26.6	Very low	27.6	Very low	119 Å²	119	135.6 Å²	135.6	77%	0.773	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	36.2	-165.4	33	-36.1	0	0	0	114.9	A288	A288-P290 WeakPolarHBondContact O-CD 3.46Å
291	R	27.8	Very low	27.9	Very low	224 Å²	224	138.5 Å²	138.5	85%	0.845	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.6	15	177.6	-75.8	-170.6	175.1	174.9	-0.6	115.8	N289	N289-R291 PolarHBondContact O-N 3.47Å
292	N	29.1	Very low	27.8	Very low	125 Å²	125	139.5 Å²	139.5	67%	0.668	73%	0.73	S	S	*	*			trans	-121.8	96	-178.7	-129.1	-12.4	0	0	0	111.5	N294	N292-N294 PolarHBondContact O-N 3.18Å; N292-N294 PolarHBondContact OD1-ND2 3.19Å
293	W	27.9	Very low	27.8	Very low	189 Å²	189	134.6 Å²	134.6	72%	0.716	71%	0.709	S	S	*	*			trans	-71.6	39.6	-179.7	-78.2	78.9	0	0	0	113.9	L295 H324	W293-L295 PolarHBondContact O-N 2.84Å; W293-H324 AromaticContact CZ2-NE2 3.79Å
294	N	28.4	Very low	27.7	Very low	135 Å²	135	129.9 Å²	129.9	72%	0.722	69%	0.688	S	S	*	*			trans	-91.9	18.1	-175.5	-85.1	-28.1	0	0	0	115	N292	N292-N294 PolarHBondContact O-N 3.18Å; N292-N294 PolarHBondContact OD1-ND2 3.19Å
295	L	26.5	Very low	27.6	Very low	162 Å²	162	135 Å²	135	85%	0.848	70%	0.7	S	S	*	*	S	Bend	trans	-130.5	15.8	-167.5	-103.9	144	0	0	0	117.5	W293	W293-L295 PolarHBondContact O-N 2.84Å
296	V	26	Very low	27.6	Very low	128 Å²	128	131.7 Å²	131.7	78%	0.776	70%	0.697	S	S	*	*	S	Bend	trans	-124.7	-9.5	178.3	-166.3	0	0	0	0	115.3
297	A	27.2	Very low	27.5	Very low	68 Å²	68	130.9 Å²	130.9	56%	0.562	70%	0.699	S	S	*	*			trans	-101.8	27.9	-173.1	0	0	0	0	0	116.3	H299	A297-H299 PolarHBondContact O-N 3.44Å
298	K	28.9	Very low	27.3	Very low	171 Å²	171	126.1 Å²	126.1	74%	0.743	69%	0.687	S	S	*	*			trans	-78.9	14.8	-177.6	-93	-173.9	178.3	-177.5	0	116
299	H	28	Very low	27.2	Very low	151 Å²	151	130 Å²	130	70%	0.699	69%	0.687	S	S	*	*			trans	-121.8	66.4	172.5	-65.8	101.2	0	0	0	110.9	A297 Y301	A297-H299 PolarHBondContact O-N 3.44Å; H299-Y301 HydrophobicContact CB-CE2 4.39Å
300	I	31.4	Very low	27.3	Very low	62 Å²	62	134.5 Å²	134.5	32%	0.318	70%	0.7	S	S	.	*			trans	-106.4	102.1	165.1	-60.3	179.8	0	0	0	106.5	R316 V318	I300-R316 HydrophobicContact CD1-CB 4.04Å; I300-R316 HydrophobicContact CD1-CG 4.45Å; I300-V318 HydrophobicContact CD1-CG2 4.48Å
301	Y	32.8	Very low	27.5	Very low	142 Å²	142	131.6 Å²	131.6	56%	0.557	68%	0.683	S	S	*	*			trans	-76	120	176	-72.5	-91.1	0	0	0	109.3	H299	H299-Y301 HydrophobicContact CB-CE2 4.39Å
302	L	27.5	Very low	27.9	Very low	131 Å²	131	124.3 Å²	124.3	69%	0.686	66%	0.66	S	S	*	*			trans	-94.2	106.9	165.1	-79.1	160.8	0	0	0	107.8
303	S	26.2	Very low	28.4	Very low	58 Å²	58	121.8 Å²	121.8	41%	0.406	65%	0.652	S	S	.	*			trans	-120.1	82.8	168.2	163.4	0	0	0	0	107.6
304	G	26	Very low	28.9	Very low	36 Å²	36	118 Å²	118	37%	0.371	65%	0.645	S	S	.	*			trans	-136.5	92.7	-179.5	0	0	0	0	0	111.5
305	N	25.7	Very low	30.1	Very low	171 Å²	171	114.7 Å²	114.7	91%	0.914	63%	0.625	S	S	*	*			trans	-135.3	93.6	155	-94.8	-18.8	0	0	0	107.2
306	S	26.8	Very low	31.8	Very low	111 Å²	111	114 Å²	114	78%	0.776	61%	0.611	S	S	*	*			trans	-147.4	129.9	149.4	-152.4	0	0	0	0	110.9	S308	S306-S308 PolarHBondContact O-N 3.14Å
307	V	24.8	Very low	33.6	Very low	145 Å²	145	109.3 Å²	109.3	88%	0.879	58%	0.584	S	S	*	*			trans	-80.9	98.9	-176.7	176	0	0	0	0	107.4
308	S	24.2	Very low	35.6	Very low	88 Å²	88	108.2 Å²	108.2	62%	0.615	57%	0.57	S	S	*	*	S	Bend	trans	173.9	136.8	147.6	41.9	0	0	0	0	110.7	S306	S306-S308 PolarHBondContact O-N 3.14Å
309	Q	24.4	Very low	37.6	Very low	184 Å²	184	100.8 Å²	100.8	86%	0.86	54%	0.539	S	S	*	.	S	Bend	trans	55.2	102.6	156.8	-62.7	-179.2	-5.4	0	0	118.2	S311	Q309-S311 VanDerWaalsContact C-N 3.34Å; Q309-S311 PolarHBondContact O-N 3.49Å; Q309-S311 VanDerWaalsContact O-N 3.08Å
310	K	26.6	Very low	39.6	Very low	224 Å²	224	93.8 Å²	93.8	97%	0.974	51%	0.508	S	S	*	.	S	Bend	trans	46.5	46.4	158.1	-69.3	-178	174.1	179.8	0	114.9
311	S	31.9	Very low	41.4	Very low	58 Å²	58	92.2 Å²	92.2	41%	0.406	51%	0.506	S	S	.	.			trans	-83.2	144.8	-179.9	-173.4	0	0	0	0	112	Q309 C313	Q309-S311 VanDerWaalsContact C-N 3.34Å; Q309-S311 PolarHBondContact O-N 3.49Å; Q309-S311 VanDerWaalsContact O-N 3.08Å; S311-C313 PolarHBondContact O-N 2.92Å
312	I	35.8	Very low	43.3	Very low	71 Å²	71	90.3 Å²	90.3	36%	0.364	51%	0.506	S	S	.	.			trans	-68.3	26.8	-171.8	-143.5	151.3	0	0	0	113.6	L314 Q315 P383	I312-L314 VanDerWaalsContact C-N 3.27Å; I312-L314 PolarHBondContact O-N 2.93Å; I312-Q315 PolarHBondContact O-N 3.29Å; I312-P383 HydrophobicContact CD1-CB 3.47Å; I312-P383 VanDerWaalsContact CD1-CB 3.47Å; I312-P383 HydrophobicContact CD1-CG 3.8Å
313	C	40.1	Very low	45.4	Very low	73 Å²	73	87.3 Å²	87.3	49%	0.493	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	22.4	-151	-152.9	0	0	0	0	115.5	S311	S311-C313 PolarHBondContact O-N 2.92Å
314	L	38.1	Very low	47.6	Very low	108 Å²	108	93.2 Å²	93.2	57%	0.565	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.5	10.1	177.6	-82.6	172	0	0	0	114.2	I312	I312-L314 VanDerWaalsContact C-N 3.27Å; I312-L314 PolarHBondContact O-N 2.93Å
315	Q	53.3	Low	49.8	Very low	66 Å²	66	96.1 Å²	96.1	31%	0.308	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	121.3	-173.2	-88.7	-177.1	-14.8	0	0	110.7	I312 C317 C333 Y334	I312-Q315 PolarHBondContact O-N 3.29Å; Q315-C317 PolarHBondContact O-N 3.3Å; Q315-C333 WeakPolarHBondContact CB-SG 3.35Å; Q315-C333 WeakPolarHBondContact CG-SG 3.33Å; Q315-C333 PolarHBondContact OE1-SG 2.81Å; Q315-Y334 WeakPolarHBondContact CA-O 3.28Å
316	R	62.2	Low	52.1	Low	148 Å²	148	88.8 Å²	88.8	56%	0.558	50%	0.497	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83	103.9	174.1	-74	-179.9	177.3	168.4	0.2	107.9	I300 Y334	I300-R316 HydrophobicContact CD1-CB 4.04Å; I300-R316 HydrophobicContact CD1-CG 4.45Å; R316-Y334 PolarHBondContact N-O 2.8Å; R316-Y334 PolarHBondContact O-N 2.8Å
317	C	63.9	Low	54.4	Low	30 Å²	30	84.1 Å²	84.1	20%	0.203	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	132.7	177.3	-61.5	0	0	0	0	111.4	Q315 E332 L363	Q315-C317 PolarHBondContact O-N 3.3Å; C317-E332 CarbonylContact C-O 3.54Å; C317-E332 VanDerWaalsContact CA-O 3.27Å; C317-E332 WeakPolarHBondContact CA-O 3.49Å; C317-L363 HydrophobicContact CB-CD1 4.11Å
318	V	68.6	Low	56.8	Low	45 Å²	45	79.6 Å²	79.6	27%	0.273	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	118	166.9	178.5	0	0	0	0	106.6	I300 V331 E332 W341	I300-V318 HydrophobicContact CD1-CG2 4.48Å; V318-V331 CarbonylContact O-C 3.57Å; V318-V331 VanDerWaalsContact O-CA 3.28Å; V318-V331 WeakPolarHBondContact O-CA 3.1Å; V318-E332 PolarHBondContact N-O 3.45Å; V318-E332 PolarHBondContact O-N 3.35Å; V318-W341 HydrophobicContact CB-CZ3 4.49Å; V318-W341 HydrophobicContact CG2-CH2 3.8Å; V318-W341 HydrophobicContact CG2-CZ3 3.75Å
319	V	70.5	Confident	59.7	Low	15 Å²	15	77.4 Å²	77.4	9%	0.091	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	113.3	-178.6	176.3	0	0	0	0	107.9	V331 M347 V356 W388	V319-V331 HydrophobicContact CG1-CG2 4.17Å; V319-V331 HydrophobicContact CG2-CG1 3.86Å; V319-V331 HydrophobicContact CG2-CG2 4.48Å; V319-M347 HydrophobicContact CG1-CE 3.84Å; V319-M347 HydrophobicContact CG1-CG 4.22Å; V319-M347 HydrophobicContact CG1-SD 3.35Å; V319-M347 WeakPolarHBondContact CG1-SD 3.42Å; V319-V356 HydrophobicContact CB-CG2 3.9Å; V319-V356 HydrophobicContact CG1-CG2 4.19Å; V319-V356 HydrophobicContact CG2-CG1 4.14Å; V319-V356 HydrophobicContact CG2-CG2 4.4Å; V319-W388 HydrophobicContact CG1-CH2 3.57Å; V319-W388 HydrophobicContact CG1-CZ2 3.78Å; V319-W388 HydrophobicContact CG2-CH2 4.18Å; V319-W388 HydrophobicContact CG2-CZ2 4.17Å
320	G	70.7	Confident	62.4	Low	4 Å²	4	70.5 Å²	70.5	4%	0.041	39%	0.39	C	S	.	.			trans	75.8	-147.7	-176.1	0	0	0	0	0	112.8	L328 S330 M347 R351	G320-L328 WeakPolarHBondContact CA-O 3.46Å; G320-S330 PolarHBondContact N-O 2.72Å; G320-M347 VanDerWaalsContact CA-CE 3.48Å; G320-R351 WeakPolarHBondContact CA-O 3.39Å
321	G	70	Confident	65	Low	28 Å²	28	59.9 Å²	59.9	29%	0.289	35%	0.345	S	S	.	.			trans	131.1	-171.8	-177.3	0	0	0	0	0	112.1	P327 L328 R351	G321-P327 CarbonylContact O-C 3.3Å; G321-P327 VanDerWaalsContact O-CA 3.28Å; G321-P327 WeakPolarHBondContact O-CA 3.32Å; G321-L328 PolarHBondContact O-N 2.85Å; G321-R351 PolarHBondContact N-O 3.42Å; G321-R351 VanDerWaalsContact N-O 3.08Å
322	N	71.9	Confident	67.2	Low	103 Å²	103	61 Å²	61	55%	0.551	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.1	123.8	177.4	-167.7	19.5	0	0	0	109	G326	N322-G326 VanDerWaalsContact OD1-CA 3.24Å; N322-G326 WeakPolarHBondContact OD1-CA 3.27Å; N322-G326 PolarHBondContact OD1-O 3.08Å; N322-G326 VanDerWaalsContact OD1-O 3.11Å
323	N	72.2	Confident	69.1	Low	68 Å²	68	57.7 Å²	57.7	36%	0.364	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	-174.7	172.4	72.4	4.8	0	0	0	110.2	A325 G326 L328	N323-A325 PolarHBondContact O-N 2.82Å; N323-A325 VanDerWaalsContact O-N 3.08Å; N323-A325 VanDerWaalsContact OD1-CA 3.31Å; N323-A325 WeakPolarHBondContact OD1-CA 3.45Å; N323-A325 WeakPolarHBondContact OD1-CB 3.35Å; N323-A325 PolarHBondContact OD1-N 3.4Å; N323-G326 PolarHBondContact N-O 2.92Å; N323-G326 PolarHBondContact O-N 3.31Å; N323-G326 PolarHBondContact OD1-N 3.25Å; N323-G326 VanDerWaalsContact OD1-N 3.08Å; N323-G326 PolarHBondContact OD1-O 3.19Å; N323-G326 VanDerWaalsContact OD1-O 3.06Å; N323-L328 HydrophobicContact CB-CD1 4.35Å
324	H	71.3	Confident	70.5	Confident	181 Å²	181	56.5 Å²	56.5	84%	0.838	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-17.3	177.6	-62.7	-64.6	0	0	0	114.1	W293	W293-H324 AromaticContact CZ2-NE2 3.79Å
325	A	73.6	Confident	71.5	Confident	98 Å²	98	52.5 Å²	52.5	81%	0.81	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-3.5	177.3	0	0	0	0	0	113.5	N323	N323-A325 PolarHBondContact O-N 2.82Å; N323-A325 VanDerWaalsContact O-N 3.08Å; N323-A325 VanDerWaalsContact OD1-CA 3.31Å; N323-A325 WeakPolarHBondContact OD1-CA 3.45Å; N323-A325 WeakPolarHBondContact OD1-CB 3.35Å; N323-A325 PolarHBondContact OD1-N 3.4Å
326	G	72.8	Confident	71.7	Confident	17 Å²	17	53.2 Å²	53.2	18%	0.175	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	115.7	-166.3	177.8	0	0	0	0	0	114.6	N322 N323	N322-G326 VanDerWaalsContact OD1-CA 3.24Å; N322-G326 WeakPolarHBondContact OD1-CA 3.27Å; N322-G326 PolarHBondContact OD1-O 3.08Å; N322-G326 VanDerWaalsContact OD1-O 3.11Å; N323-G326 PolarHBondContact N-O 2.92Å; N323-G326 PolarHBondContact O-N 3.31Å; N323-G326 PolarHBondContact OD1-N 3.25Å; N323-G326 VanDerWaalsContact OD1-N 3.08Å; N323-G326 PolarHBondContact OD1-O 3.19Å; N323-G326 VanDerWaalsContact OD1-O 3.06Å
327	P	75.9	Confident	71.5	Confident	13 Å²	13	56.1 Å²	56.1	8%	0.084	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	147.1	-178.7	-27.2	38.5	0	0	0	113.1	G321 R350 A371	G321-P327 CarbonylContact O-C 3.3Å; G321-P327 VanDerWaalsContact O-CA 3.28Å; G321-P327 WeakPolarHBondContact O-CA 3.32Å; P327-R350 HydrophobicContact CB-CB 4.12Å; P327-R350 VanDerWaalsContact O-CD 3.3Å; P327-R350 WeakPolarHBondContact O-CD 3.43Å; P327-A371 HydrophobicContact CG-CB 3.96Å
328	L	75.8	Confident	71.7	Confident	49 Å²	49	61.2 Å²	61.2	26%	0.257	33%	0.332	S	S	.	.	B	Isolated β-bridge	trans	-107.6	149.6	-176.5	-64.6	175.4	0	0	0	111.8	G320 G321 N323 R351	G320-L328 WeakPolarHBondContact CA-O 3.46Å; G321-L328 PolarHBondContact O-N 2.85Å; N323-L328 HydrophobicContact CB-CD1 4.35Å; L328-R351 PolarHBondContact O-N 3.47Å
329	C	84.9	Confident	71.9	Confident	42 Å²	42	65 Å²	65	28%	0.284	35%	0.35	S	S	.	.			trans	-102.9	-5.7	165.1	57	0	0	0	0	112.4	S346 M347 R350	C329-S346 CarbonylContact O-C 3.46Å; C329-S346 VanDerWaalsContact O-CA 3.3Å; C329-S346 WeakPolarHBondContact O-CA 3.2Å; C329-S346 WeakPolarHBondContact O-CB 3.24Å; C329-M347 HydrophobicContact CB-CB 4.31Å; C329-M347 WeakPolarHBondContact CB-O 3.47Å; C329-M347 PolarHBondContact O-N 2.92Å; C329-R350 HydrophobicContact CB-CG 4.05Å
330	S	79.7	Confident	71.6	Confident	39 Å²	39	66 Å²	66	27%	0.273	36%	0.36	S	S	.	.			trans	-65.2	144.6	-178.7	53.1	0	0	0	0	111.3	G320	G320-S330 PolarHBondContact N-O 2.72Å
331	V	82.5	Confident	71.9	Confident	2 Å²	2	72.3 Å²	72.3	1%	0.012	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	125.6	174.9	-176.8	0	0	0	0	107.9	V318 V319 L344 M347 W388	V318-V331 CarbonylContact O-C 3.57Å; V318-V331 VanDerWaalsContact O-CA 3.28Å; V318-V331 WeakPolarHBondContact O-CA 3.1Å; V319-V331 HydrophobicContact CG1-CG2 4.17Å; V319-V331 HydrophobicContact CG2-CG1 3.86Å; V319-V331 HydrophobicContact CG2-CG2 4.48Å; V331-L344 HydrophobicContact CB-CB 4.16Å; V331-L344 HydrophobicContact CG1-CB 4Å; V331-L344 HydrophobicContact CG1-CD1 4.08Å; V331-L344 HydrophobicContact CG1-CG 4.48Å; V331-L344 PolarHBondContact O-N 3.21Å; V331-M347 HydrophobicContact CG2-CG 4.1Å; V331-W388 HydrophobicContact CG1-CZ2 4.36Å; V331-W388 HydrophobicContact CG2-CZ2 3.69Å
332	E	77.4	Confident	72.3	Confident	82 Å²	82	73.6 Å²	73.6	38%	0.383	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	142.3	-177.7	-61.8	-175	126.7	0	0	109.6	C317 V318 W341	C317-E332 CarbonylContact C-O 3.54Å; C317-E332 VanDerWaalsContact CA-O 3.27Å; C317-E332 WeakPolarHBondContact CA-O 3.49Å; V318-E332 PolarHBondContact N-O 3.45Å; V318-E332 PolarHBondContact O-N 3.35Å; E332-W341 HydrophobicContact CB-CE3 3.87Å; E332-W341 HydrophobicContact CB-CZ3 4.28Å
333	C	75.2	Confident	72.8	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	123.8	-172.4	165	0	0	0	0	109.1	Q315 T342 L344	Q315-C333 WeakPolarHBondContact CB-SG 3.35Å; Q315-C333 WeakPolarHBondContact CG-SG 3.33Å; Q315-C333 PolarHBondContact OE1-SG 2.81Å; C333-T342 PolarHBondContact N-O 2.97Å; C333-T342 PolarHBondContact O-N 2.88Å; C333-T342 PolarHBondContact O-OG1 3.23Å; C333-L344 HydrophobicContact CB-CD1 3.74Å; C333-L344 HydrophobicContact CB-CD2 4.45Å; C333-L344 HydrophobicContact CB-CG 3.92Å
334	Y	69.4	Low	73.4	Confident	49 Å²	49	71.8 Å²	71.8	19%	0.192	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	121.1	179.4	-179.7	-106.8	0	0	0	111.2	Q315 R316 V336 D339 W341	Q315-Y334 WeakPolarHBondContact CA-O 3.28Å; R316-Y334 PolarHBondContact N-O 2.8Å; R316-Y334 PolarHBondContact O-N 2.8Å; Y334-V336 HydrophobicContact CD1-CG2 4Å; Y334-V336 HydrophobicContact CE1-CB 4.43Å; Y334-V336 HydrophobicContact CE1-CG2 3.95Å; Y334-D339 PolarHBondContact OH-OD1 2.99Å; Y334-W341 AromaticContact CD2-CD1 3.9Å; Y334-W341 AromaticContact CD2-CD2 3.99Å; Y334-W341 HydrophobicContact CD2-CD2 3.99Å; Y334-W341 AromaticContact CD2-CE2 3.7Å; Y334-W341 HydrophobicContact CD2-CG 4.13Å; Y334-W341 HydrophobicContact CD2-CZ2 4.2Å; Y334-W341 AromaticContact CD2-NE1 3.62Å; Y334-W341 HydrophobicContact CG-CD2 4.41Å; Y334-W341 HydrophobicContact CG-CZ2 4.26Å
335	D	59.2	Low	74.1	Confident	23 Å²	23	64.3 Å²	64.3	12%	0.123	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	106.9	172	-173.6	-13.7	0	0	0	110.2	R337 Q338 D339 A340	D335-R337 PolarHBondContact O-N 3.4Å; D335-R337 WeakPolarHBondContact OD1-CB 3.29Å; D335-R337 PolarHBondContact OD1-N 3.48Å; D335-Q338 HydrophobicContact CB-CB 4.25Å; D335-Q338 PolarHBondContact O-N 3.36Å; D335-Q338 WeakPolarHBondContact OD2-CG 3.45Å; D335-Q338 PolarHBondContact OD2-NE2 2.9Å; D335-D339 PolarHBondContact O-N 2.98Å; D335-A340 PolarHBondContact N-O 3.23Å; D335-A340 PolarHBondContact O-N 3.24Å
336	V	57.9	Low	74.8	Confident	82 Å²	82	62.9 Å²	62.9	50%	0.497	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-26	178.8	-176.5	0	0	0	0	112.4	Y334	Y334-V336 HydrophobicContact CD1-CG2 4Å; Y334-V336 HydrophobicContact CE1-CB 4.43Å; Y334-V336 HydrophobicContact CE1-CG2 3.95Å
337	R	58.5	Low	75.5	Confident	208 Å²	208	62.5 Å²	62.5	79%	0.785	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-30.7	-179.7	-61.4	-177	178.9	-179.9	2.6	112.5	D335	D335-R337 PolarHBondContact O-N 3.4Å; D335-R337 WeakPolarHBondContact OD1-CB 3.29Å; D335-R337 PolarHBondContact OD1-N 3.48Å
338	Q	67.7	Low	76.1	Confident	138 Å²	138	66.3 Å²	66.3	65%	0.645	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-8.6	-177.3	-63.1	-177.7	48.3	0	0	112.7	D335 A340	D335-Q338 HydrophobicContact CB-CB 4.25Å; D335-Q338 PolarHBondContact O-N 3.36Å; D335-Q338 WeakPolarHBondContact OD2-CG 3.45Å; D335-Q338 PolarHBondContact OD2-NE2 2.9Å; Q338-A340 HydrophobicContact CB-CB 4.1Å; Q338-A340 PolarHBondContact O-N 2.79Å
339	D	72.9	Confident	76.5	Confident	123 Å²	123	65.4 Å²	65.4	66%	0.658	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	42.7	-172.3	-167.2	23	0	0	0	111.7	Y334 D335	Y334-D339 PolarHBondContact OH-OD1 2.99Å; D335-D339 PolarHBondContact O-N 2.98Å
340	A	65.3	Low	76.4	Confident	36 Å²	36	70.6 Å²	70.6	30%	0.298	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	143.7	-172.3	0	0	0	0	0	111.3	D335 Q338	D335-A340 PolarHBondContact N-O 3.23Å; D335-A340 PolarHBondContact O-N 3.24Å; Q338-A340 HydrophobicContact CB-CB 4.1Å; Q338-A340 PolarHBondContact O-N 2.79Å
341	W	75.7	Confident	76.4	Confident	138 Å²	138	68.8 Å²	68.8	52%	0.523	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	134.2	169.7	-69.6	90.5	0	0	0	109.8	V318 E332 Y334	V318-W341 HydrophobicContact CB-CZ3 4.49Å; V318-W341 HydrophobicContact CG2-CH2 3.8Å; V318-W341 HydrophobicContact CG2-CZ3 3.75Å; E332-W341 HydrophobicContact CB-CE3 3.87Å; E332-W341 HydrophobicContact CB-CZ3 4.28Å; Y334-W341 AromaticContact CD2-CD1 3.9Å; Y334-W341 AromaticContact CD2-CD2 3.99Å; Y334-W341 HydrophobicContact CD2-CD2 3.99Å; Y334-W341 AromaticContact CD2-CE2 3.7Å; Y334-W341 HydrophobicContact CD2-CG 4.13Å; Y334-W341 HydrophobicContact CD2-CZ2 4.2Å; Y334-W341 AromaticContact CD2-NE1 3.62Å; Y334-W341 HydrophobicContact CG-CD2 4.41Å; Y334-W341 HydrophobicContact CG-CZ2 4.26Å
342	T	78.6	Confident	76	Confident	55 Å²	55	69 Å²	69	34%	0.337	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	129.1	174.6	51.6	0	0	0	0	109.5	C333	C333-T342 PolarHBondContact N-O 2.97Å; C333-T342 PolarHBondContact O-N 2.88Å; C333-T342 PolarHBondContact O-OG1 3.23Å
343	S	81.6	Confident	75.8	Confident	95 Å²	95	72.2 Å²	72.2	66%	0.664	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	132.6	174.7	-52.3	0	0	0	0	110.5
344	L	85.6	Confident	75.6	Confident	37 Å²	37	73.5 Å²	73.5	19%	0.194	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	175	172	-60.8	-179.1	0	0	0	110	V331 C333 S346 Y381	V331-L344 HydrophobicContact CB-CB 4.16Å; V331-L344 HydrophobicContact CG1-CB 4Å; V331-L344 HydrophobicContact CG1-CD1 4.08Å; V331-L344 HydrophobicContact CG1-CG 4.48Å; V331-L344 PolarHBondContact O-N 3.21Å; C333-L344 HydrophobicContact CB-CD1 3.74Å; C333-L344 HydrophobicContact CB-CD2 4.45Å; C333-L344 HydrophobicContact CB-CG 3.92Å; L344-S346 PolarHBondContact O-N 2.89Å; L344-Y381 HydrophobicContact CD1-CE1 4.19Å
345	A	86.6	Confident	75.9	Confident	25 Å²	25	71.8 Å²	71.8	21%	0.207	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-56	138.4	173.8	0	0	0	0	0	111.8	Y381 N386 W388	A345-Y381 HydrophobicContact CB-CE2 4.36Å; A345-N386 WeakPolarHBondContact CB-O 3.47Å; A345-N386 WeakPolarHBondContact CB-OD1 3.4Å; A345-N386 PolarHBondContact N-OD1 3.11Å; A345-W388 VanDerWaalsContact O-CD1 3.28Å; A345-W388 PolarHBondContact O-NE1 3.42Å
346	S	88.4	Confident	76.7	Confident	68 Å²	68	72.6 Å²	72.6	48%	0.476	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-74.6	146.6	179.5	-61.5	0	0	0	0	110.8	C329 L344 W388	C329-S346 CarbonylContact O-C 3.46Å; C329-S346 VanDerWaalsContact O-CA 3.3Å; C329-S346 WeakPolarHBondContact O-CA 3.2Å; C329-S346 WeakPolarHBondContact O-CB 3.24Å; L344-S346 PolarHBondContact O-N 2.89Å; S346-W388 VanDerWaalsContact O-CD1 3.31Å
347	M	85.9	Confident	77.7	Confident	8 Å²	8	70.1 Å²	70.1	4%	0.039	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-61.6	156.9	171.5	-68.4	-178	-66.7	0	0	111.1	V319 G320 C329 V331 V349 R351 W388	V319-M347 HydrophobicContact CG1-CE 3.84Å; V319-M347 HydrophobicContact CG1-CG 4.22Å; V319-M347 HydrophobicContact CG1-SD 3.35Å; V319-M347 WeakPolarHBondContact CG1-SD 3.42Å; G320-M347 VanDerWaalsContact CA-CE 3.48Å; C329-M347 HydrophobicContact CB-CB 4.31Å; C329-M347 WeakPolarHBondContact CB-O 3.47Å; C329-M347 PolarHBondContact O-N 2.92Å; V331-M347 HydrophobicContact CG2-CG 4.1Å; M347-V349 VanDerWaalsContact C-N 3.29Å; M347-V349 WeakPolarHBondContact CB-O 3.39Å; M347-V349 PolarHBondContact O-N 2.85Å; M347-R351 HydrophobicContact CE-CB 3.96Å; M347-R351 HydrophobicContact CE-CG 4.02Å; M347-R351 HydrophobicContact SD-CG 4.13Å; M347-W388 HydrophobicContact CG-CD2 3.71Å; M347-W388 HydrophobicContact CG-CE3 4.06Å; M347-W388 HydrophobicContact CG-CG 4.21Å; M347-W388 HydrophobicContact CG-CH2 4.19Å; M347-W388 HydrophobicContact CG-CZ2 3.86Å; M347-W388 HydrophobicContact CG-CZ3 4.28Å; M347-W388 HydrophobicContact SD-CH2 4.39Å
348	N	88.6	Confident	78.5	Confident	93 Å²	93	62.2 Å²	62.2	50%	0.497	33%	0.332	S	S	.	.	S	Bend	trans	-71.6	-28.5	177.2	-61.4	-79.7	0	0	0	111.8	E379 W388 F390	N348-E379 VanDerWaalsContact CB-OE2 3.29Å; N348-E379 WeakPolarHBondContact CB-OE2 3.33Å; N348-E379 PolarHBondContact N-OE2 2.8Å; N348-E379 PolarHBondContact ND2-OE2 2.87Å; N348-W388 PolarHBondContact ND2-O 2.92Å; N348-F390 HydrophobicContact CB-CE1 4.34Å; N348-F390 HydrophobicContact CB-CE2 3.61Å; N348-F390 HydrophobicContact CB-CZ 3.49Å; N348-F390 VanDerWaalsContact CB-CZ 3.49Å
349	V	85	Confident	78.9	Confident	31 Å²	31	62.9 Å²	62.9	19%	0.188	33%	0.33	C	S	.	.	S	Bend	trans	-120.7	144.4	178.7	-169.6	0	0	0	0	110.1	M347 R351 D370 L375 E379 F390	M347-V349 VanDerWaalsContact C-N 3.29Å; M347-V349 WeakPolarHBondContact CB-O 3.39Å; M347-V349 PolarHBondContact O-N 2.85Å; V349-R351 WeakPolarHBondContact O-CG 3.35Å; V349-R351 PolarHBondContact O-N 3.01Å; V349-D370 HydrophobicContact CG1-CB 4.43Å; V349-L375 HydrophobicContact CG1-CD1 3.76Å; V349-L375 HydrophobicContact CG1-CD2 3.8Å; V349-L375 HydrophobicContact CG1-CG 4.45Å; V349-E379 PolarHBondContact N-OE1 3.08Å; V349-F390 HydrophobicContact CG2-CE1 3.69Å; V349-F390 HydrophobicContact CG2-CZ 3.59Å
350	R	83.3	Confident	79.1	Confident	151 Å²	151	63.9 Å²	63.9	57%	0.57	34%	0.335	S	S	*	.			trans	-71.5	126.2	171	-67	-178.6	-72	-118.6	2	109.2	P327 C329 D370	P327-R350 HydrophobicContact CB-CB 4.12Å; P327-R350 VanDerWaalsContact O-CD 3.3Å; P327-R350 WeakPolarHBondContact O-CD 3.43Å; C329-R350 HydrophobicContact CB-CG 4.05Å; R350-D370 WeakPolarHBondContact O-CA 3.48Å; R350-D370 WeakPolarHBondContact O-CB 3.34Å
351	R	78.9	Confident	79.5	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-130.8	125	-176.5	-49.6	-174.7	173.8	-100.3	-4.1	110.9	G320 G321 L328 M347 V349 T354 S365 G367 L375 T377 E379	G320-R351 WeakPolarHBondContact CA-O 3.39Å; G321-R351 PolarHBondContact N-O 3.42Å; G321-R351 VanDerWaalsContact N-O 3.08Å; L328-R351 PolarHBondContact O-N 3.47Å; M347-R351 HydrophobicContact CE-CB 3.96Å; M347-R351 HydrophobicContact CE-CG 4.02Å; M347-R351 HydrophobicContact SD-CG 4.13Å; V349-R351 WeakPolarHBondContact O-CG 3.35Å; V349-R351 PolarHBondContact O-N 3.01Å; R351-T354 HydrophobicContact CB-CG2 4.08Å; R351-S365 WeakPolarHBondContact CD-OG 3.24Å; R351-G367 PolarHBondContact NH1-O 3.08Å; R351-L375 HydrophobicContact CB-CD1 4.3Å; R351-L375 HydrophobicContact CG-CD1 3.64Å; R351-T377 PolarHBondContact NH1-O 3.06Å; R351-T377 PolarHBondContact NH1-OG1 3.13Å; R351-T377 PolarHBondContact NH2-OG1 3.08Å; R351-E379 IonicContact CZ-OE1 3.29Å; R351-E379 VanDerWaalsContact CZ-OE1 3.25Å; R351-E379 IonicContact NE-OE1 2.92Å; R351-E379 PolarHBondContact NE-OE1 3.07Å; R351-E379 IonicContact NH2-OE1 2.72Å; R351-E379 PolarHBondContact NH2-OE1 3.23Å
352	S	74.8	Confident	79.7	Confident	8 Å²	8	58.1 Å²	58.1	6%	0.056	32%	0.318	C	S	.	.	B	Isolated β-bridge	trans	-110.5	155.6	163	65.3	0	0	0	0	109.7	T354 G368 F369	S352-T354 PolarHBondContact O-N 3.06Å; S352-G368 CarbonylContact O-C 3.56Å; S352-G368 WeakPolarHBondContact O-CA 3.31Å; S352-F369 PolarHBondContact N-O 3Å; S352-F369 PolarHBondContact O-N 2.83Å; S352-F369 PolarHBondContact OG-O 3.06Å
353	M	71.9	Confident	79.9	Confident	149 Å²	149	56.7 Å²	56.7	73%	0.734	31%	0.307	S	S	*	.	S	Bend	trans	52.8	30.9	179.1	-50.8	-179	84.6	0	0	113.8
354	T	71.6	Confident	80	Confident	27 Å²	27	54.1 Å²	54.1	17%	0.166	29%	0.285	C	S	.	.			trans	-81.5	149.3	179.5	-170.6	0	0	0	0	111.2	R351 S352 V356 S365 F366 G367	R351-T354 HydrophobicContact CB-CG2 4.08Å; S352-T354 PolarHBondContact O-N 3.06Å; T354-V356 HydrophobicContact CG2-CG2 4.09Å; T354-S365 PolarHBondContact OG1-OG 2.78Å; T354-S365 VanDerWaalsContact OG1-OG 3.06Å; T354-F366 PolarHBondContact OG1-O 3.2Å; T354-G367 PolarHBondContact OG1-O 2.75Å; T354-G367 VanDerWaalsContact OG1-O 3.06Å
355	A	76.2	Confident	79.8	Confident	12 Å²	12	52.4 Å²	52.4	10%	0.099	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	132.5	172.8	0	0	0	0	0	109.8	S365 F366 A404	A355-S365 CarbonylContact O-C 3.59Å; A355-S365 WeakPolarHBondContact O-CA 3.49Å; A355-F366 HydrophobicContact CB-CB 4.45Å; A355-F366 PolarHBondContact N-O 2.91Å; A355-F366 VanDerWaalsContact N-O 3.13Å; A355-F366 PolarHBondContact O-N 3.27Å; A355-A404 HydrophobicContact CB-CB 4.39Å
356	V	75.4	Confident	79.6	Confident	40 Å²	40	52.4 Å²	52.4	24%	0.242	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	132.1	-177.4	-173.2	0	0	0	0	110.2	V319 T354 F364	V319-V356 HydrophobicContact CB-CG2 3.9Å; V319-V356 HydrophobicContact CG1-CG2 4.19Å; V319-V356 HydrophobicContact CG2-CG1 4.14Å; V319-V356 HydrophobicContact CG2-CG2 4.4Å; T354-V356 HydrophobicContact CG2-CG2 4.09Å; V356-F364 CarbonylContact C-O 3.52Å; V356-F364 WeakPolarHBondContact CA-O 3.28Å
357	V	79.4	Confident	79	Confident	31 Å²	31	49.2 Å²	49.2	19%	0.188	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	138.2	179.8	-179.9	0	0	0	0	109.7	F364 F366	V357-F364 PolarHBondContact N-O 3.05Å; V357-F364 PolarHBondContact O-N 2.97Å; V357-F366 HydrophobicContact CB-CE2 4.3Å; V357-F366 HydrophobicContact CG2-CE2 4.29Å
358	E	76	Confident	78.6	Confident	42 Å²	42	49.7 Å²	49.7	20%	0.196	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	127.1	166.8	-168.1	-118.6	138.4	0	0	109.4	G361 C362 L363	E358-G361 PolarHBondContact OE1-N 3.04Å; E358-C362 WeakPolarHBondContact CA-O 3.3Å; E358-L363 HydrophobicContact CB-CD2 4.12Å; E358-L363 HydrophobicContact CG-CD2 4.24Å
359	Y	74.8	Confident	77.9	Confident	151 Å²	151	49.1 Å²	49.1	59%	0.592	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-144	128.1	174.7	-179.7	-97.7	0	0	0	109.7	G361 C362 F364	Y359-G361 PolarHBondContact O-N 2.82Å; Y359-C362 PolarHBondContact N-O 2.87Å; Y359-C362 PolarHBondContact O-N 2.83Å; Y359-F364 HydrophobicContact CD1-CE2 4.18Å; Y359-F364 HydrophobicContact CD1-CZ 4.33Å; Y359-F364 HydrophobicContact CG-CE2 4.49Å; Y359-F364 WeakPolarHBondContact O-CE2 3.49Å
360	D	78	Confident	77.7	Confident	144 Å²	144	49.5 Å²	49.5	77%	0.77	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.4	41.3	-180	-160.4	30.1	0	0	0	113.5	C362	D360-C362 PolarHBondContact O-N 2.91Å
361	G	74	Confident	77.4	Confident	25 Å²	25	44.7 Å²	44.7	26%	0.258	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.3	8.3	-179.6	0	0	0	0	0	115.2	E358 Y359 P383	E358-G361 PolarHBondContact OE1-N 3.04Å; Y359-G361 PolarHBondContact O-N 2.82Å; G361-P383 VanDerWaalsContact O-CD 3.24Å; G361-P383 WeakPolarHBondContact O-CD 3.29Å; G361-P383 WeakPolarHBondContact O-CG 3.5Å
362	C	80.1	Confident	77.5	Confident	29 Å²	29	51.7 Å²	51.7	20%	0.196	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	151.8	172.5	-63.1	0	0	0	0	110.8	E358 Y359 D360 F364 V380 Y381	E358-C362 WeakPolarHBondContact CA-O 3.3Å; Y359-C362 PolarHBondContact N-O 2.87Å; Y359-C362 PolarHBondContact O-N 2.83Å; D360-C362 PolarHBondContact O-N 2.91Å; C362-F364 HydrophobicContact CB-CD2 4.41Å; C362-F364 HydrophobicContact CB-CE2 3.76Å; C362-F364 HydrophobicContact CB-CZ 4.41Å; C362-V380 HydrophobicContact CB-CG2 3.72Å; C362-Y381 WeakPolarHBondContact CA-O 3.4Å; C362-Y381 VanDerWaalsContact CB-O 3.29Å; C362-Y381 WeakPolarHBondContact CB-O 3.47Å
363	L	82.3	Confident	77.7	Confident	24 Å²	24	56.2 Å²	56.2	13%	0.126	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	125.6	173.9	-58	170.3	0	0	0	109.8	C317 E358 V380 Y381 W388	C317-L363 HydrophobicContact CB-CD1 4.11Å; E358-L363 HydrophobicContact CB-CD2 4.12Å; E358-L363 HydrophobicContact CG-CD2 4.24Å; L363-V380 CarbonylContact O-C 3.6Å; L363-V380 WeakPolarHBondContact O-CA 3.49Å; L363-Y381 HydrophobicContact CB-CD1 4.4Å; L363-Y381 HydrophobicContact CD1-CD1 3.98Å; L363-Y381 HydrophobicContact CG-CD1 4.25Å; L363-Y381 PolarHBondContact N-O 3.47Å; L363-Y381 VanDerWaalsContact N-O 3.11Å; L363-Y381 PolarHBondContact O-N 2.88Å; L363-W388 HydrophobicContact CB-CH2 4.37Å
364	F	83	Confident	78	Confident	42 Å²	42	53.9 Å²	53.9	18%	0.184	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	129.1	178.3	-68.4	-106.8	0	0	0	109.2	V356 V357 Y359 C362 F366 E379 V380 L391	V356-F364 CarbonylContact C-O 3.52Å; V356-F364 WeakPolarHBondContact CA-O 3.28Å; V357-F364 PolarHBondContact N-O 3.05Å; V357-F364 PolarHBondContact O-N 2.97Å; Y359-F364 HydrophobicContact CD1-CE2 4.18Å; Y359-F364 HydrophobicContact CD1-CZ 4.33Å; Y359-F364 HydrophobicContact CG-CE2 4.49Å; Y359-F364 WeakPolarHBondContact O-CE2 3.49Å; C362-F364 HydrophobicContact CB-CD2 4.41Å; C362-F364 HydrophobicContact CB-CE2 3.76Å; C362-F364 HydrophobicContact CB-CZ 4.41Å; F364-F366 HydrophobicContact CB-CD2 4.26Å; F364-F366 HydrophobicContact CB-CE1 4.5Å; F364-F366 HydrophobicContact CB-CE2 3.37Å; F364-F366 HydrophobicContact CB-CZ 3.52Å; F364-F366 AromaticContact CD1-CZ 3.99Å; F364-F366 HydrophobicContact CD1-CZ 3.99Å; F364-F366 HydrophobicContact CG-CE2 4.37Å; F364-F366 HydrophobicContact CG-CZ 4.11Å; F364-E379 CarbonylContact C-O 3.51Å; F364-E379 WeakPolarHBondContact CA-O 2.96Å; F364-V380 HydrophobicContact CD1-CB 4.12Å; F364-V380 HydrophobicContact CD1-CG2 4.04Å; F364-V380 HydrophobicContact CD2-CG2 4.13Å; F364-V380 HydrophobicContact CE1-CB 4.02Å; F364-V380 HydrophobicContact CE1-CG2 3.72Å; F364-V380 HydrophobicContact CE2-CG2 3.82Å; F364-V380 HydrophobicContact CG-CG2 4.21Å; F364-V380 HydrophobicContact CZ-CB 4.4Å; F364-V380 HydrophobicContact CZ-CG2 3.6Å; F364-L391 HydrophobicContact CD1-CD1 3.63Å; F364-L391 HydrophobicContact CE1-CD1 4.02Å; F364-L391 HydrophobicContact CE1-CD2 4.2Å
365	S	82	Confident	78.1	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	123	177	-178.1	0	0	0	0	108.9	R351 T354 A355 S378 E379	R351-S365 WeakPolarHBondContact CD-OG 3.24Å; T354-S365 PolarHBondContact OG1-OG 2.78Å; T354-S365 VanDerWaalsContact OG1-OG 3.06Å; A355-S365 CarbonylContact O-C 3.59Å; A355-S365 WeakPolarHBondContact O-CA 3.49Å; S365-S378 CarbonylContact O-C 3.54Å; S365-S378 VanDerWaalsContact O-CA 3.22Å; S365-S378 WeakPolarHBondContact O-CA 3.12Å; S365-S378 WeakPolarHBondContact O-CB 3.19Å; S365-E379 PolarHBondContact N-O 2.87Å; S365-E379 PolarHBondContact O-N 2.84Å
366	F	81.8	Confident	78.3	Confident	26 Å²	26	57.6 Å²	57.6	11%	0.114	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	126.7	-174.5	-58.7	-83.1	0	0	0	110.6	T354 A355 V357 F364 S378 L391 I397	T354-F366 PolarHBondContact OG1-O 3.2Å; A355-F366 HydrophobicContact CB-CB 4.45Å; A355-F366 PolarHBondContact N-O 2.91Å; A355-F366 VanDerWaalsContact N-O 3.13Å; A355-F366 PolarHBondContact O-N 3.27Å; V357-F366 HydrophobicContact CB-CE2 4.3Å; V357-F366 HydrophobicContact CG2-CE2 4.29Å; F364-F366 HydrophobicContact CB-CD2 4.26Å; F364-F366 HydrophobicContact CB-CE1 4.5Å; F364-F366 HydrophobicContact CB-CE2 3.37Å; F364-F366 HydrophobicContact CB-CZ 3.52Å; F364-F366 AromaticContact CD1-CZ 3.99Å; F364-F366 HydrophobicContact CD1-CZ 3.99Å; F364-F366 HydrophobicContact CG-CE2 4.37Å; F364-F366 HydrophobicContact CG-CZ 4.11Å; F366-S378 WeakPolarHBondContact CD1-OG 3.27Å; F366-L391 HydrophobicContact CE1-CD1 4.33Å; F366-I397 HydrophobicContact CD1-CG2 4.28Å; F366-I397 HydrophobicContact CE1-CD1 4.1Å; F366-I397 HydrophobicContact CE1-CG2 4.49Å
367	G	77	Confident	78.6	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.01	32%	0.32	C	S	.	.			trans	55.2	-147.1	175.3	0	0	0	0	0	114	R351 T354 L375 T377	R351-G367 PolarHBondContact NH1-O 3.08Å; T354-G367 PolarHBondContact OG1-O 2.75Å; T354-G367 VanDerWaalsContact OG1-O 3.06Å; G367-L375 WeakPolarHBondContact CA-O 3.34Å; G367-T377 PolarHBondContact N-O 3.11Å
368	G	76.7	Confident	78.9	Confident	17 Å²	17	56.8 Å²	56.8	18%	0.175	31%	0.313	C	S	.	.			trans	113.9	-164.1	-176.4	0	0	0	0	0	112.1	S352 P374 L375	S352-G368 CarbonylContact O-C 3.56Å; S352-G368 WeakPolarHBondContact O-CA 3.31Å; G368-P374 WeakPolarHBondContact O-CA 3.3Å; G368-L375 PolarHBondContact O-N 3.43Å
369	F	73.8	Confident	79.4	Confident	82 Å²	82	54.8 Å²	54.8	36%	0.36	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-135	129.8	-177.9	-171.3	-103.7	0	0	0	110.6	S352 A371 D373	S352-F369 PolarHBondContact N-O 3Å; S352-F369 PolarHBondContact O-N 2.83Å; S352-F369 PolarHBondContact OG-O 3.06Å; F369-A371 WeakPolarHBondContact CE1-O 3.39Å; F369-D373 WeakPolarHBondContact CD2-O 3.49Å
370	D	80.7	Confident	80.1	Confident	39 Å²	39	48.7 Å²	48.7	21%	0.209	28%	0.282	C	S	.	.			trans	-100.1	12.9	-173.1	75.5	-3.8	0	0	0	115	V349 R350 H372 D373 L375	V349-D370 HydrophobicContact CG1-CB 4.43Å; R350-D370 WeakPolarHBondContact O-CA 3.48Å; R350-D370 WeakPolarHBondContact O-CB 3.34Å; D370-H372 PolarHBondContact OD1-N 2.85Å; D370-D373 PolarHBondContact N-O 2.94Å; D370-D373 PolarHBondContact OD1-N 2.99Å; D370-L375 HydrophobicContact CB-CD1 4.08Å; D370-L375 HydrophobicContact CB-CD2 3.92Å; D370-L375 HydrophobicContact CB-CG 4.05Å
371	A	77.2	Confident	80.4	Confident	49 Å²	49	42.1 Å²	42.1	41%	0.405	25%	0.247	S	C	.	.	S	Bend	trans	92.9	-25.1	-174	0	0	0	0	0	114.5	P327 F369	P327-A371 HydrophobicContact CG-CB 3.96Å; F369-A371 WeakPolarHBondContact CE1-O 3.39Å
372	H	80.1	Confident	80.8	Confident	147 Å²	147	43.2 Å²	43.2	68%	0.681	25%	0.247	S	C	*	.	S	Bend	trans	-109.8	-51.9	179.9	-61.7	-52.1	0	0	0	110.6	D370	D370-H372 PolarHBondContact OD1-N 2.85Å
373	D	79	Confident	80.8	Confident	103 Å²	103	43.7 Å²	43.7	55%	0.551	25%	0.25	S	C	*	.	S	Bend	trans	-131.1	149.8	-169.7	-67.9	-61.5	0	0	0	111.9	F369 D370 L375	F369-D373 WeakPolarHBondContact CD2-O 3.49Å; D370-D373 PolarHBondContact N-O 2.94Å; D370-D373 PolarHBondContact OD1-N 2.99Å; D373-L375 PolarHBondContact O-N 3.07Å
374	P	78.7	Confident	80.7	Confident	101 Å²	101	51.6 Å²	51.6	66%	0.656	28%	0.283	S	S	*	.	B	Isolated β-bridge	trans	-63.6	132.3	164.6	27.6	-32.3	0	0	0	109.7	G368	G368-P374 WeakPolarHBondContact O-CA 3.3Å
375	L	73.9	Confident	80.8	Confident	18 Å²	18	55.3 Å²	55.3	9%	0.094	30%	0.301	C	S	.	.			trans	-84.3	127.3	-178.8	-67.4	173.2	0	0	0	110.6	V349 R351 G367 G368 D370 D373	V349-L375 HydrophobicContact CG1-CD1 3.76Å; V349-L375 HydrophobicContact CG1-CD2 3.8Å; V349-L375 HydrophobicContact CG1-CG 4.45Å; R351-L375 HydrophobicContact CB-CD1 4.3Å; R351-L375 HydrophobicContact CG-CD1 3.64Å; G367-L375 WeakPolarHBondContact CA-O 3.34Å; G368-L375 PolarHBondContact O-N 3.43Å; D370-L375 HydrophobicContact CB-CD1 4.08Å; D370-L375 HydrophobicContact CB-CD2 3.92Å; D370-L375 HydrophobicContact CB-CG 4.05Å; D373-L375 PolarHBondContact O-N 3.07Å
376	C	80.7	Confident	81.1	Confident	98 Å²	98	58.9 Å²	58.9	66%	0.662	32%	0.32	S	S	*	.			trans	-94.5	-0.6	169.6	63	0	0	0	0	113.4	G399	C376-G399 WeakPolarHBondContact CA-O 3.45Å
377	T	80.4	Confident	81.3	Confident	47 Å²	47	62.8 Å²	62.8	29%	0.288	34%	0.339	S	S	.	.			trans	-85.8	151	-178.9	54.7	0	0	0	0	110.9	R351 G367	R351-T377 PolarHBondContact NH1-O 3.06Å; R351-T377 PolarHBondContact NH1-OG1 3.13Å; R351-T377 PolarHBondContact NH2-OG1 3.08Å; G367-T377 PolarHBondContact N-O 3.11Å
378	S	85.6	Confident	81.9	Confident	7 Å²	7	63.4 Å²	63.4	5%	0.049	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	146.7	172.4	-52	0	0	0	0	109.1	S365 F366 L391	S365-S378 CarbonylContact O-C 3.54Å; S365-S378 VanDerWaalsContact O-CA 3.22Å; S365-S378 WeakPolarHBondContact O-CA 3.12Å; S365-S378 WeakPolarHBondContact O-CB 3.19Å; F366-S378 WeakPolarHBondContact CD1-OG 3.27Å; S378-L391 PolarHBondContact O-N 3.04Å
379	E	87.6	Confident	82.5	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	148.2	-178	-67.5	176.5	-114.4	0	0	110.2	N348 V349 R351 F364 S365 W388 Q389 F390	N348-E379 VanDerWaalsContact CB-OE2 3.29Å; N348-E379 WeakPolarHBondContact CB-OE2 3.33Å; N348-E379 PolarHBondContact N-OE2 2.8Å; N348-E379 PolarHBondContact ND2-OE2 2.87Å; V349-E379 PolarHBondContact N-OE1 3.08Å; R351-E379 IonicContact CZ-OE1 3.29Å; R351-E379 VanDerWaalsContact CZ-OE1 3.25Å; R351-E379 IonicContact NE-OE1 2.92Å; R351-E379 PolarHBondContact NE-OE1 3.07Å; R351-E379 IonicContact NH2-OE1 2.72Å; R351-E379 PolarHBondContact NH2-OE1 3.23Å; F364-E379 CarbonylContact C-O 3.51Å; F364-E379 WeakPolarHBondContact CA-O 2.96Å; S365-E379 PolarHBondContact N-O 2.87Å; S365-E379 PolarHBondContact O-N 2.84Å; E379-W388 HydrophobicContact CB-CE3 3.72Å; E379-W388 HydrophobicContact CB-CZ3 4.25Å; E379-Q389 CarbonylContact C-O 3.43Å; E379-Q389 VanDerWaalsContact CA-O 3.27Å; E379-Q389 WeakPolarHBondContact CA-O 3.22Å; E379-F390 HydrophobicContact CG-CD1 3.59Å; E379-F390 HydrophobicContact CG-CE1 3.75Å; E379-F390 HydrophobicContact CG-CG 4.36Å
380	V	88.7	Confident	83.2	Confident	23 Å²	23	68.4 Å²	68.4	14%	0.139	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	132.9	175	62.4	0	0	0	0	110	C362 L363 F364 W388 Q389 L391	C362-V380 HydrophobicContact CB-CG2 3.72Å; L363-V380 CarbonylContact O-C 3.6Å; L363-V380 WeakPolarHBondContact O-CA 3.49Å; F364-V380 HydrophobicContact CD1-CB 4.12Å; F364-V380 HydrophobicContact CD1-CG2 4.04Å; F364-V380 HydrophobicContact CD2-CG2 4.13Å; F364-V380 HydrophobicContact CE1-CB 4.02Å; F364-V380 HydrophobicContact CE1-CG2 3.72Å; F364-V380 HydrophobicContact CE2-CG2 3.82Å; F364-V380 HydrophobicContact CG-CG2 4.21Å; F364-V380 HydrophobicContact CZ-CB 4.4Å; F364-V380 HydrophobicContact CZ-CG2 3.6Å; V380-W388 CarbonylContact O-C 3.47Å; V380-W388 WeakPolarHBondContact O-CA 3.42Å; V380-Q389 HydrophobicContact CG1-CB 4.26Å; V380-Q389 PolarHBondContact N-O 2.96Å; V380-Q389 PolarHBondContact O-N 3.48Å; V380-L391 HydrophobicContact CB-CD1 4.47Å; V380-L391 HydrophobicContact CB-CD2 4.01Å; V380-L391 HydrophobicContact CB-CG 4.28Å; V380-L391 HydrophobicContact CG1-CD2 3.71Å; V380-L391 HydrophobicContact CG1-CG 4.25Å
381	Y	85.7	Confident	83.3	Confident	7 Å²	7	69.7 Å²	69.7	3%	0.027	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	124	173	176.5	-107.2	0	0	0	110	L344 A345 C362 L363 P383 N386 E387 W388	L344-Y381 HydrophobicContact CD1-CE1 4.19Å; A345-Y381 HydrophobicContact CB-CE2 4.36Å; C362-Y381 WeakPolarHBondContact CA-O 3.4Å; C362-Y381 VanDerWaalsContact CB-O 3.29Å; C362-Y381 WeakPolarHBondContact CB-O 3.47Å; L363-Y381 HydrophobicContact CB-CD1 4.4Å; L363-Y381 HydrophobicContact CD1-CD1 3.98Å; L363-Y381 HydrophobicContact CG-CD1 4.25Å; L363-Y381 PolarHBondContact N-O 3.47Å; L363-Y381 VanDerWaalsContact N-O 3.11Å; L363-Y381 PolarHBondContact O-N 2.88Å; Y381-P383 HydrophobicContact CD1-CG 4.11Å; Y381-P383 HydrophobicContact CE1-CB 4.02Å; Y381-P383 HydrophobicContact CE1-CG 3.89Å; Y381-N386 PolarHBondContact OH-OD1 2.87Å; Y381-E387 WeakPolarHBondContact CA-O 3.48Å; Y381-W388 AromaticContact CD2-CD1 3.8Å; Y381-W388 HydrophobicContact CD2-CD2 4.2Å; Y381-W388 AromaticContact CD2-CE2 3.8Å; Y381-W388 HydrophobicContact CD2-CG 4.21Å; Y381-W388 HydrophobicContact CD2-CZ2 4.34Å; Y381-W388 AromaticContact CD2-NE1 3.51Å; Y381-W388 HydrophobicContact CG-CD2 4.39Å; Y381-W388 AromaticContact CG-CE2 3.99Å; Y381-W388 HydrophobicContact CG-CZ2 4.13Å
382	N	82.1	Confident	82.5	Confident	48 Å²	48	73.6 Å²	73.6	26%	0.257	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	113.1	172.9	-177.9	-13.2	0	0	0	109.8	K384 E385 N386 E387	N382-K384 PolarHBondContact O-N 2.84Å; N382-K384 WeakPolarHBondContact OD1-CB 3.42Å; N382-K384 PolarHBondContact OD1-N 2.87Å; N382-E385 PolarHBondContact O-N 3.26Å; N382-N386 WeakPolarHBondContact O-CA 3.43Å; N382-N386 PolarHBondContact O-N 2.85Å; N382-E387 PolarHBondContact N-O 2.83Å
383	P	79.8	Confident	81	Confident	39 Å²	39	71.7 Å²	71.7	25%	0.253	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-18.6	-178.4	-19.8	31.4	0	0	0	115	I312 G361 Y381	I312-P383 HydrophobicContact CD1-CB 3.47Å; I312-P383 VanDerWaalsContact CD1-CB 3.47Å; I312-P383 HydrophobicContact CD1-CG 3.8Å; G361-P383 VanDerWaalsContact O-CD 3.24Å; G361-P383 WeakPolarHBondContact O-CD 3.29Å; G361-P383 WeakPolarHBondContact O-CG 3.5Å; Y381-P383 HydrophobicContact CD1-CG 4.11Å; Y381-P383 HydrophobicContact CE1-CB 4.02Å; Y381-P383 HydrophobicContact CE1-CG 3.89Å
384	K	80.8	Confident	79.3	Confident	189 Å²	189	71.8 Å²	71.8	82%	0.822	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-38.7	177.3	-66.1	178.8	179.8	170.7	0	111.6	N382	N382-K384 PolarHBondContact O-N 2.84Å; N382-K384 WeakPolarHBondContact OD1-CB 3.42Å; N382-K384 PolarHBondContact OD1-N 2.87Å
385	E	85.1	Confident	77.7	Confident	121 Å²	121	73.5 Å²	73.5	57%	0.565	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-16.4	-179.2	-54.3	-54.2	138.5	0	0	112	N382 E387	N382-E385 PolarHBondContact O-N 3.26Å; E385-E387 VanDerWaalsContact C-N 3.3Å; E385-E387 HydrophobicContact CB-CB 4.37Å; E385-E387 PolarHBondContact O-N 2.72Å
386	N	87.1	Confident	76	Confident	74 Å²	74	76.3 Å²	76.3	40%	0.396	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	49.6	-171.4	-176	38.1	0	0	0	110.9	A345 Y381 N382	A345-N386 WeakPolarHBondContact CB-O 3.47Å; A345-N386 WeakPolarHBondContact CB-OD1 3.4Å; A345-N386 PolarHBondContact N-OD1 3.11Å; Y381-N386 PolarHBondContact OH-OD1 2.87Å; N382-N386 WeakPolarHBondContact O-CA 3.43Å; N382-N386 PolarHBondContact O-N 2.85Å
387	E	87.7	Confident	74.1	Confident	109 Å²	109	76.9 Å²	76.9	51%	0.509	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	149.9	-178.2	-73.9	-172.9	169.2	0	0	111.6	Y381 N382 E385	Y381-E387 WeakPolarHBondContact CA-O 3.48Å; N382-E387 PolarHBondContact N-O 2.83Å; E385-E387 VanDerWaalsContact C-N 3.3Å; E385-E387 HydrophobicContact CB-CB 4.37Å; E385-E387 PolarHBondContact O-N 2.72Å
388	W	89.4	Confident	72.2	Confident	14 Å²	14	83.7 Å²	83.7	5%	0.053	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	132.6	172.6	-71.9	88.6	0	0	0	110.8	V319 V331 A345 S346 M347 N348 L363 E379 V380 Y381	V319-W388 HydrophobicContact CG1-CH2 3.57Å; V319-W388 HydrophobicContact CG1-CZ2 3.78Å; V319-W388 HydrophobicContact CG2-CH2 4.18Å; V319-W388 HydrophobicContact CG2-CZ2 4.17Å; V331-W388 HydrophobicContact CG1-CZ2 4.36Å; V331-W388 HydrophobicContact CG2-CZ2 3.69Å; A345-W388 VanDerWaalsContact O-CD1 3.28Å; A345-W388 PolarHBondContact O-NE1 3.42Å; S346-W388 VanDerWaalsContact O-CD1 3.31Å; M347-W388 HydrophobicContact CG-CD2 3.71Å; M347-W388 HydrophobicContact CG-CE3 4.06Å; M347-W388 HydrophobicContact CG-CG 4.21Å; M347-W388 HydrophobicContact CG-CH2 4.19Å; M347-W388 HydrophobicContact CG-CZ2 3.86Å; M347-W388 HydrophobicContact CG-CZ3 4.28Å; M347-W388 HydrophobicContact SD-CH2 4.39Å; N348-W388 PolarHBondContact ND2-O 2.92Å; L363-W388 HydrophobicContact CB-CH2 4.37Å; E379-W388 HydrophobicContact CB-CE3 3.72Å; E379-W388 HydrophobicContact CB-CZ3 4.25Å; V380-W388 CarbonylContact O-C 3.47Å; V380-W388 WeakPolarHBondContact O-CA 3.42Å; Y381-W388 AromaticContact CD2-CD1 3.8Å; Y381-W388 HydrophobicContact CD2-CD2 4.2Å; Y381-W388 AromaticContact CD2-CE2 3.8Å; Y381-W388 HydrophobicContact CD2-CG 4.21Å; Y381-W388 HydrophobicContact CD2-CZ2 4.34Å; Y381-W388 AromaticContact CD2-NE1 3.51Å; Y381-W388 HydrophobicContact CG-CD2 4.39Å; Y381-W388 AromaticContact CG-CE2 3.99Å; Y381-W388 HydrophobicContact CG-CZ2 4.13Å
389	Q	89	Confident	70.1	Confident	109 Å²	109	83.8 Å²	83.8	51%	0.509	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	141.3	177.7	-63.5	-177.8	-4	0	0	110.6	E379 V380	E379-Q389 CarbonylContact C-O 3.43Å; E379-Q389 VanDerWaalsContact CA-O 3.27Å; E379-Q389 WeakPolarHBondContact CA-O 3.22Å; V380-Q389 HydrophobicContact CG1-CB 4.26Å; V380-Q389 PolarHBondContact N-O 2.96Å; V380-Q389 PolarHBondContact O-N 3.48Å
390	F	88.8	Confident	67.8	Low	95 Å²	95	87.4 Å²	87.4	42%	0.417	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	135.6	173.9	-72.9	-72.7	0	0	0	111.2	N348 V349 E379 N392	N348-F390 HydrophobicContact CB-CE1 4.34Å; N348-F390 HydrophobicContact CB-CE2 3.61Å; N348-F390 HydrophobicContact CB-CZ 3.49Å; N348-F390 VanDerWaalsContact CB-CZ 3.49Å; V349-F390 HydrophobicContact CG2-CE1 3.69Å; V349-F390 HydrophobicContact CG2-CZ 3.59Å; E379-F390 HydrophobicContact CG-CD1 3.59Å; E379-F390 HydrophobicContact CG-CE1 3.75Å; E379-F390 HydrophobicContact CG-CG 4.36Å; F390-N392 PolarHBondContact O-N 3.49Å
391	L	81.3	Confident	65.6	Low	65 Å²	65	89.9 Å²	89.9	34%	0.34	52%	0.516	S	S	.	.			trans	-81.4	109.6	168.4	-64	170.2	0	0	0	108.1	F364 F366 S378 V380	F364-L391 HydrophobicContact CD1-CD1 3.63Å; F364-L391 HydrophobicContact CE1-CD1 4.02Å; F364-L391 HydrophobicContact CE1-CD2 4.2Å; F366-L391 HydrophobicContact CE1-CD1 4.33Å; S378-L391 PolarHBondContact O-N 3.04Å; V380-L391 HydrophobicContact CB-CD1 4.47Å; V380-L391 HydrophobicContact CB-CD2 4.01Å; V380-L391 HydrophobicContact CB-CG 4.28Å; V380-L391 HydrophobicContact CG1-CD2 3.71Å; V380-L391 HydrophobicContact CG1-CG 4.25Å
392	N	61.3	Low	63.5	Low	131 Å²	131	95.2 Å²	95.2	70%	0.701	55%	0.549	S	S	*	.			trans	-63.1	141	177.9	-71	-29.8	0	0	0	111	F390 S394	F390-N392 PolarHBondContact O-N 3.49Å; N392-S394 PolarHBondContact O-N 3.49Å
393	A	48.9	Very low	61.3	Low	108 Å²	108	96 Å²	96	89%	0.893	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	7.3	-173.2	0	0	0	0	0	116.2	N395	A393-N395 VanDerWaalsContact C-N 3.28Å; A393-N395 PolarHBondContact O-N 2.81Å
394	S	42.4	Very low	59.3	Low	104 Å²	104	95.9 Å²	95.9	73%	0.727	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-12.2	175.6	55.1	0	0	0	0	113.7	N392	N392-S394 PolarHBondContact O-N 3.49Å
395	N	45.4	Very low	57.1	Low	137 Å²	137	92.5 Å²	92.5	73%	0.733	56%	0.56	S	S	*	*	S	Bend	trans	-112.7	66.6	177.3	-72	-6.9	0	0	0	112	A393 I397	A393-N395 VanDerWaalsContact C-N 3.28Å; A393-N395 PolarHBondContact O-N 2.81Å; N395-I397 VanDerWaalsContact C-N 3.32Å; N395-I397 PolarHBondContact O-N 3.48Å
396	G	38.2	Very low	54.7	Low	78 Å²	78	91.8 Å²	91.8	80%	0.804	56%	0.564	S	S	*	*	S	Bend	trans	59.8	0.3	145.1	0	0	0	0	0	122.3
397	I	41.7	Very low	51.9	Low	110 Å²	110	93.2 Å²	93.2	56%	0.564	58%	0.577	S	S	*	*			trans	-118.1	94.8	-176.7	-51.9	176.5	0	0	0	110.3	F366 N395 G399	F366-I397 HydrophobicContact CD1-CG2 4.28Å; F366-I397 HydrophobicContact CE1-CD1 4.1Å; F366-I397 HydrophobicContact CE1-CG2 4.49Å; N395-I397 VanDerWaalsContact C-N 3.32Å; N395-I397 PolarHBondContact O-N 3.48Å; I397-G399 PolarHBondContact O-N 3.36Å
398	Q	40.8	Very low	49.3	Very low	189 Å²	189	93.1 Å²	93.1	88%	0.883	58%	0.579	S	S	*	*			trans	-79.6	104.3	167.3	-74.6	-177.9	-11.8	0	0	109	G400	Q398-G400 PolarHBondContact O-N 3.4Å; Q398-G400 VanDerWaalsContact O-N 3.07Å
399	G	40.7	Very low	46.3	Very low	9 Å²	9	98.3 Å²	98.3	9%	0.093	61%	0.612	C	S	.	*			trans	-76.1	88.3	-176	0	0	0	0	0	112.8	C376 I397	C376-G399 WeakPolarHBondContact CA-O 3.45Å; I397-G399 PolarHBondContact O-N 3.36Å
400	G	39.4	Very low	43.5	Very low	76 Å²	76	100.5 Å²	100.5	78%	0.784	62%	0.622	S	S	*	*			trans	-106.1	9.5	161.4	0	0	0	0	0	113.3	Q398	Q398-G400 PolarHBondContact O-N 3.4Å; Q398-G400 VanDerWaalsContact O-N 3.07Å
401	C	41.5	Very low	40.6	Very low	75 Å²	75	102.1 Å²	102.1	51%	0.507	64%	0.64	S	S	.	*			trans	-103.6	128.4	-164.2	-60.6	0	0	0	0	112.3	A403	C401-A403 PolarHBondContact O-N 3.46Å
402	T	41.3	Very low	38.1	Very low	119 Å²	119	107 Å²	107	73%	0.73	67%	0.666	S	S	*	*	S	Bend	trans	-80.4	1.4	171.6	58.9	0	0	0	0	113
403	A	37	Very low	36.5	Very low	64 Å²	64	113.5 Å²	113.5	53%	0.529	69%	0.692	S	S	.	*			trans	-157.3	124.9	174.4	0	0	0	0	0	109.4	C401	C401-A403 PolarHBondContact O-N 3.46Å
404	A	37.3	Very low	35.8	Very low	37 Å²	37	113.8 Å²	113.8	31%	0.306	68%	0.682	S	S	.	*			trans	-112.7	122.2	167.3	0	0	0	0	0	108.2	A355	A355-A404 HydrophobicContact CB-CB 4.39Å
405	T	34.3	Very low	35.5	Very low	118 Å²	118	114.3 Å²	114.3	72%	0.724	68%	0.679	S	S	*	*			trans	-112.1	119.2	164.4	-75.7	0	0	0	0	106.2
406	V	34.3	Very low	34.9	Very low	106 Å²	106	113 Å²	113	64%	0.642	68%	0.676	S	S	*	*			trans	-100.4	115.6	173	-176.7	0	0	0	0	107.9	I408	V406-I408 PolarHBondContact O-N 2.81Å
407	P	28.4	Very low	34.7	Very low	104 Å²	104	115.1 Å²	115.1	68%	0.675	67%	0.669	S	S	*	*			trans	-76.9	119.9	170.6	29.2	-28	0	0	0	109.1	V409	P407-V409 PolarHBondContact O-N 2.78Å
408	I	33.4	Very low	34.3	Very low	107 Å²	107	115.4 Å²	115.4	55%	0.549	68%	0.675	S	S	.	*			trans	-83.4	106.1	171.1	-57.9	174.6	0	0	0	107.8	V406	V406-I408 PolarHBondContact O-N 2.81Å
409	V	26.3	Very low	33.9	Very low	124 Å²	124	110.5 Å²	110.5	75%	0.752	66%	0.661	S	S	*	*			trans	-86.4	105.1	162.3	-176.6	0	0	0	0	106.5	P407 T411	P407-V409 PolarHBondContact O-N 2.78Å; V409-T411 PolarHBondContact O-N 2.96Å
410	H	31	Very low	33.4	Very low	155 Å²	155	117.7 Å²	117.7	72%	0.718	70%	0.702	S	S	*	*			trans	-73.8	106.3	166.4	-88.7	-68	0	0	0	108.8	L412	H410-L412 PolarHBondContact O-N 2.85Å
411	T	26.8	Very low	32.9	Very low	128 Å²	128	120.9 Å²	120.9	79%	0.785	70%	0.696	S	S	*	*			trans	-72	109.2	150.4	38.7	0	0	0	0	107.2	V409 E413	V409-T411 PolarHBondContact O-N 2.96Å; T411-E413 PolarHBondContact O-N 2.83Å
412	L	29	Very low	32.2	Very low	168 Å²	168	124.8 Å²	124.8	88%	0.88	71%	0.711	S	S	*	*			trans	-69.5	113.7	168.8	-76.3	156.5	0	0	0	108.4	H410	H410-L412 PolarHBondContact O-N 2.85Å
413	E	27.3	Very low	31.4	Very low	267 Å²	267	125.3 Å²	125.3	100%	1.248	71%	0.71	S	S	*	*			trans	-109.1	0	148.4	-81.7	-170.4	163.6	0	0	109	T411	T411-E413 PolarHBondContact O-N 2.83Å

Retrieved 413 of 413 residues in 178.3 ms (Link to these results)

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