A0A077YZA0_TRITR Loading...

Alpha:beta hydrolase fold protein

AlphaFold DB , UniProt , Accession A0A077YZA0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 927 aa.

						>A0A077YZA0_TRITR|A0A077YZA0
MDERSLSDELSCELSEPADEEEEEDLILSQWNQSLPITQISLPKLTRLRQLLSLRHISDATMVKFNVRALASADGLIFPRYSDRLERVAEKQLRPSGLKICKLSDSRINIANILEKNVPDGNVVGFFGYHLTKSSVMEVALSMNEADAMAIFQASGKAALVIPDQLHLMHPKLVFTLREFSRLTFWPPPDKFAKAKAITKNLNIDNCHLVSPRECKNLRAAEAIALPAARGRQMITNIINASEPEADKRVESLAQLKEQAKGYFYSQGSIGGIAKWKRFGVLNSYLKGFRLGELTLIGGSNGSGKKSFATEYALDLCLQQVRTLWCCLETPVGRIASMMVEQFSKYARGNEFVFRIPFIDRETFYESSSSQRSFDYWYDEMGNLPMQFVSFNTAKRTRLKELLETIEQQSVQHAIIDNLLAVQEANYAKNVQEIKRCFADIRRFAVTRNVHITGIADEMVIQTDSALGRVVQGLAEADNVLFLNLNPEAPETEKSLKSPTFPPLKTSKKMWRSRGCLFFLISTVGIAILIHHLHIPLPAEMSDRWRMHIFEICARVVYFYPVSFCICKKNVRRWQVVWTRLTVHSFCRFLSWIHRLKERHTLKVEDVVLGGVPCRVYIPESPDTGAAIVFIHGGGFVLLNVASYDLITRLLAKVTNMVTISVEYRLAPEHRFPSAVDDCENVIMHLLSEGYKKYHVNTSKITLIGDSAGGNLAAAVTQRMRNKGVKPTVKLQVLIYPLLQFSDFLTPSYQLAHRLLGGTSLPDPESIVRWSLLYFGIDPTYTQKVLKNMHVTEPLRSLFKRHQSHGILPSSYRDPSFYNASEAKVLPQDIDYTLARMMRRFLLDWQASPLMQPDMSGLPPALIVTTQFDPLRDDGYWYAVKLRNAGVNVTHMHYERGFHAMLNLHTEMTIGRKAIHDIGTFIRSCMA
					

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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	31.7	Very low	31.8	Very low	232 Å²	232	150.1 Å²	150.1	100%	1.143	78%	0.775	S	S	*	*				0	139.1	0	-83.2	168.7	63.5	0	0	106.3
2	D	32.7	Very low	31.4	Very low	138 Å²	138	147.3 Å²	147.3	74%	0.738	78%	0.775	S	S	*	*			trans	88.4	42.3	-176.6	-57.9	-13.4	0	0	0	118.9	R4	D2-R4 VanDerWaalsContact C-N 3.3Å
3	E	33.1	Very low	31	Very low	200 Å²	200	150.1 Å²	150.1	94%	0.935	78%	0.782	S	S	*	*	S	Bend	trans	-89.3	13.2	156.7	-82.9	-171.5	155.2	0	0	113
4	R	34.3	Very low	30.8	Very low	232 Å²	232	152.3 Å²	152.3	88%	0.875	79%	0.794	S	S	*	*	S	Bend	trans	-114.8	10	-170.8	-76.2	-171.6	-173.7	175.6	2.3	116.7	D2	D2-R4 VanDerWaalsContact C-N 3.3Å
5	S	34.6	Very low	30.7	Very low	73 Å²	73	149.1 Å²	149.1	51%	0.51	79%	0.79	S	S	.	*	S	Bend	trans	-113.2	-2.1	-175.5	57.2	0	0	0	0	116.7
6	L	30.1	Very low	30.6	Very low	145 Å²	145	151.4 Å²	151.4	76%	0.759	79%	0.794	S	S	*	*	S	Bend	trans	-96.8	-3.2	-173.5	-89.9	150.8	0	0	0	115.4
7	S	32.6	Very low	31	Very low	92 Å²	92	149.1 Å²	149.1	64%	0.643	79%	0.79	S	S	*	*	S	Bend	trans	-88.2	-17.9	177.3	54.4	0	0	0	0	114.2
8	D	33.2	Very low	31.5	Very low	116 Å²	116	143.9 Å²	143.9	62%	0.62	77%	0.773	S	S	*	*	S	Bend	trans	-100.6	-15	-170	-68	-9.8	0	0	0	113.7	L10 S11	D8-L10 PolarHBondContact O-N 2.74Å; D8-S11 PolarHBondContact O-OG 2.81Å
9	E	30.8	Very low	32.6	Very low	160 Å²	160	141.2 Å²	141.2	75%	0.748	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-1.7	178.3	-74.7	-174.2	160.7	0	0	114.7	S11	E9-S11 VanDerWaalsContact C-N 3.27Å
10	L	30.3	Very low	33.7	Very low	165 Å²	165	138.1 Å²	138.1	86%	0.864	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	14.7	171.3	-100.2	139.3	0	0	0	113.2	D8	D8-L10 PolarHBondContact O-N 2.74Å
11	S	26.2	Very low	34.8	Very low	98 Å²	98	137 Å²	137	69%	0.685	73%	0.729	S	S	*	*			trans	-106.7	19.6	179.4	67.7	0	0	0	0	114.5	D8 E9 E13	D8-S11 PolarHBondContact O-OG 2.81Å; E9-S11 VanDerWaalsContact C-N 3.27Å; S11-E13 PolarHBondContact O-N 3.37Å
12	C	27.4	Very low	36.5	Very low	116 Å²	116	132 Å²	132	78%	0.784	70%	0.703	S	S	*	*			trans	-72.5	102.3	173.6	-74.4	0	0	0	0	111.4
13	E	26.1	Very low	38.4	Very low	184 Å²	184	127.8 Å²	127.8	86%	0.86	68%	0.679	S	S	*	*			trans	28.5	97.8	147.7	-65.8	179.9	167.8	0	0	116.1	S11 S15	S11-E13 PolarHBondContact O-N 3.37Å; E13-S15 PolarHBondContact O-N 3.44Å
14	L	27.9	Very low	40.5	Very low	181 Å²	181	123.4 Å²	123.4	95%	0.948	66%	0.658	S	S	*	*			trans	-59.8	85.5	157.4	-73.5	158.1	0	0	0	108.5	E16	L14-E16 PolarHBondContact O-N 2.77Å
15	S	29.5	Very low	42.7	Very low	105 Å²	105	117.2 Å²	117.2	73%	0.734	64%	0.642	S	S	*	*			trans	-58.6	124.6	156.5	57.1	0	0	0	0	107.2	E13	E13-S15 PolarHBondContact O-N 3.44Å
16	E	28.6	Very low	45.2	Very low	185 Å²	185	117.4 Å²	117.4	86%	0.864	64%	0.637	S	S	*	*			trans	-38.9	126.5	176.3	-65.3	174.4	155.2	0	0	110.6	L14 A18	L14-E16 PolarHBondContact O-N 2.77Å; E16-A18 PolarHBondContact O-N 2.95Å
17	P	38.2	Very low	47.9	Very low	112 Å²	112	110.9 Å²	110.9	73%	0.727	60%	0.603	S	S	*	*			trans	-68.9	110.6	169.1	16.6	-6.4	0	0	0	106.2	D19	P17-D19 PolarHBondContact O-N 3.06Å
18	A	40.4	Very low	50.5	Low	57 Å²	57	107.5 Å²	107.5	47%	0.471	58%	0.578	S	S	.	*			trans	-46.1	139.5	163.9	0	0	0	0	0	108.9	E16 E20	E16-A18 PolarHBondContact O-N 2.95Å; A18-E20 PolarHBondContact O-N 3.38Å; A18-E20 VanDerWaalsContact O-N 3.09Å
19	D	51.8	Low	53.2	Low	92 Å²	92	104.5 Å²	104.5	49%	0.492	57%	0.566	S	S	.	*			trans	-43.3	115.6	-169.5	-72.5	-51.1	0	0	0	111.6	P17 E21 E22 E23	P17-D19 PolarHBondContact O-N 3.06Å; D19-E21 PolarHBondContact O-N 3.27Å; D19-E22 HydrophobicContact CB-CB 3.95Å; D19-E22 HydrophobicContact CB-CG 3.92Å; D19-E22 CarbonylContact O-C 3.35Å; D19-E22 WeakPolarHBondContact O-CA 3.45Å; D19-E22 WeakPolarHBondContact O-CB 3.4Å; D19-E22 PolarHBondContact O-N 3.42Å; D19-E23 PolarHBondContact O-N 3.47Å
20	E	54	Low	55.9	Low	78 Å²	78	99.7 Å²	99.7	36%	0.364	54%	0.543	S	S	.	.	H	α-helix	trans	-56.5	-23.7	179.2	-71.9	175.5	120.7	0	0	112.2	A18 E24 R836	A18-E20 PolarHBondContact O-N 3.38Å; A18-E20 VanDerWaalsContact O-N 3.09Å; E20-E24 VanDerWaalsContact O-CB 3.23Å; E20-E24 WeakPolarHBondContact O-CB 3.46Å; E20-E24 PolarHBondContact O-N 2.85Å; E20-R836 IonicContact OE1-CZ 3.97Å; E20-R836 IonicContact OE1-NH1 3.73Å; E20-R836 PolarHBondContact OE1-NH1 3.17Å; E20-R836 IonicContact OE1-NH2 2.94Å; E20-R836 PolarHBondContact OE1-NH2 2.8Å; E20-R836 IonicContact OE2-CZ 3.78Å; E20-R836 IonicContact OE2-NE 3.8Å; E20-R836 PolarHBondContact OE2-NE 3.22Å; E20-R836 IonicContact OE2-NH1 3.46Å; E20-R836 PolarHBondContact OE2-NH1 2.89Å; E20-R836 IonicContact OE2-NH2 2.76Å; E20-R836 PolarHBondContact OE2-NH2 3.44Å
21	E	58	Low	58.9	Low	117 Å²	117	93.1 Å²	93.1	55%	0.547	51%	0.507	S	S	.	.	H	α-helix	trans	-72	-40.9	172.1	-144	165.7	-150.7	0	0	110.7	D19 D25 R839	D19-E21 PolarHBondContact O-N 3.27Å; E21-D25 VanDerWaalsContact O-CB 3.23Å; E21-D25 WeakPolarHBondContact O-CB 3.23Å; E21-D25 VanDerWaalsContact O-CG 3.31Å; E21-D25 PolarHBondContact O-N 2.78Å; E21-R839 IonicContact OE1-CZ 3.77Å; E21-R839 IonicContact OE1-NH1 3.36Å; E21-R839 PolarHBondContact OE1-NH1 2.79Å; E21-R839 IonicContact OE1-NH2 2.99Å; E21-R839 IonicContact OE2-NH1 2.85Å
22	E	66.2	Low	61.9	Low	126 Å²	126	94 Å²	94	59%	0.589	50%	0.504	S	S	*	.	H	α-helix	trans	-66.3	-39.4	170.2	-77	-166.8	158.7	0	0	112.1	D19 D25 L26	D19-E22 HydrophobicContact CB-CB 3.95Å; D19-E22 HydrophobicContact CB-CG 3.92Å; D19-E22 CarbonylContact O-C 3.35Å; D19-E22 WeakPolarHBondContact O-CA 3.45Å; D19-E22 WeakPolarHBondContact O-CB 3.4Å; D19-E22 PolarHBondContact O-N 3.42Å; E22-D25 PolarHBondContact O-N 2.9Å; E22-L26 WeakPolarHBondContact O-CB 3.36Å; E22-L26 PolarHBondContact O-N 2.89Å
23	E	73.1	Confident	65	Low	49 Å²	49	93.7 Å²	93.7	23%	0.229	49%	0.491	C	S	.	.	H	α-helix	trans	-65	-44.8	176.3	-67.6	-169	158.7	0	0	111.2	D19 L26 I27 P119	D19-E23 PolarHBondContact O-N 3.47Å; E23-L26 PolarHBondContact O-N 2.96Å; E23-I27 WeakPolarHBondContact O-CD1 3.49Å; E23-I27 WeakPolarHBondContact O-CG1 3.46Å; E23-I27 PolarHBondContact O-N 3.29Å; E23-P119 HydrophobicContact CB-CB 4.31Å; E23-P119 HydrophobicContact CG-CB 3.98Å; E23-P119 VanDerWaalsContact OE1-CB 3.3Å; E23-P119 WeakPolarHBondContact OE1-CB 3.22Å; E23-P119 WeakPolarHBondContact OE2-CB 3.47Å; E23-P119 WeakPolarHBondContact OE2-CG 3.44Å
24	E	77.3	Confident	68.1	Low	109 Å²	109	85.1 Å²	85.1	51%	0.509	45%	0.451	S	S	.	.	H	α-helix	trans	-64.4	-43.4	175.7	-170.6	171.5	-179	0	0	111.1	E20 L26 I27 L28	E20-E24 VanDerWaalsContact O-CB 3.23Å; E20-E24 WeakPolarHBondContact O-CB 3.46Å; E20-E24 PolarHBondContact O-N 2.85Å; E24-L26 VanDerWaalsContact C-N 3.33Å; E24-L26 PolarHBondContact O-N 3.15Å; E24-I27 PolarHBondContact O-N 3.04Å; E24-L28 HydrophobicContact CG-CD1 4.02Å; E24-L28 HydrophobicContact CG-CG 4.4Å; E24-L28 WeakPolarHBondContact O-CB 3.46Å; E24-L28 VanDerWaalsContact O-CG 3.24Å; E24-L28 WeakPolarHBondContact O-CG 3.42Å; E24-L28 PolarHBondContact O-N 3.04Å
25	D	80.7	Confident	71.2	Confident	101 Å²	101	78.9 Å²	78.9	54%	0.54	42%	0.419	S	S	.	.	H	α-helix	trans	-63.4	-37.7	174.6	-82.4	-15.1	0	0	0	111.9	E21 E22 L28 S29	E21-D25 VanDerWaalsContact O-CB 3.23Å; E21-D25 WeakPolarHBondContact O-CB 3.23Å; E21-D25 VanDerWaalsContact O-CG 3.31Å; E21-D25 PolarHBondContact O-N 2.78Å; E22-D25 PolarHBondContact O-N 2.9Å; D25-L28 PolarHBondContact O-N 2.8Å; D25-S29 WeakPolarHBondContact O-CA 3.33Å; D25-S29 WeakPolarHBondContact O-CB 3.47Å; D25-S29 PolarHBondContact O-N 3.25Å
26	L	86.1	Confident	74.2	Confident	78 Å²	78	76.3 Å²	76.3	41%	0.408	40%	0.399	S	S	.	.	H	α-helix	trans	-65.9	-44.6	174.8	179.6	64.1	0	0	0	111.2	E22 E23 E24 S29 Q30 V118	E22-L26 WeakPolarHBondContact O-CB 3.36Å; E22-L26 PolarHBondContact O-N 2.89Å; E23-L26 PolarHBondContact O-N 2.96Å; E24-L26 VanDerWaalsContact C-N 3.33Å; E24-L26 PolarHBondContact O-N 3.15Å; L26-S29 PolarHBondContact O-N 3.21Å; L26-Q30 HydrophobicContact CD1-CG 4.34Å; L26-Q30 WeakPolarHBondContact O-CB 3.23Å; L26-Q30 VanDerWaalsContact O-CG 3.29Å; L26-Q30 WeakPolarHBondContact O-CG 3.37Å; L26-Q30 PolarHBondContact O-N 2.93Å; L26-V118 HydrophobicContact CD2-CG1 3.87Å; L26-V118 HydrophobicContact CG-CG1 3.92Å
27	I	88.6	Confident	77.2	Confident	8 Å²	8	67.7 Å²	67.7	4%	0.041	36%	0.359	C	S	.	.	H	α-helix	trans	-59.5	-50.9	174.7	-69.8	158.3	0	0	0	109.9	E23 E24 Q30 W31 P95 S96 L98 V118	E23-I27 WeakPolarHBondContact O-CD1 3.49Å; E23-I27 WeakPolarHBondContact O-CG1 3.46Å; E23-I27 PolarHBondContact O-N 3.29Å; E24-I27 PolarHBondContact O-N 3.04Å; I27-Q30 PolarHBondContact O-N 3.04Å; I27-W31 WeakPolarHBondContact O-CB 3.38Å; I27-W31 PolarHBondContact O-N 3.16Å; I27-P95 HydrophobicContact CG2-CG 4.11Å; I27-P95 WeakPolarHBondContact CG2-O 3.41Å; I27-S96 WeakPolarHBondContact CD1-O 3.43Å; I27-L98 HydrophobicContact CG2-CD1 4.28Å; I27-L98 HydrophobicContact CG2-CD2 4.38Å; I27-L98 HydrophobicContact CG2-CG 4.04Å; I27-V118 HydrophobicContact CG1-CG1 3.85Å
28	L	87.2	Confident	79.5	Confident	21 Å²	21	67.6 Å²	67.6	11%	0.11	36%	0.357	C	S	.	.	H	α-helix	trans	-66	-39.9	-178	-70.1	174.3	0	0	0	111.5	E24 D25 W31 N32 R94	E24-L28 HydrophobicContact CG-CD1 4.02Å; E24-L28 HydrophobicContact CG-CG 4.4Å; E24-L28 WeakPolarHBondContact O-CB 3.46Å; E24-L28 VanDerWaalsContact O-CG 3.24Å; E24-L28 WeakPolarHBondContact O-CG 3.42Å; E24-L28 PolarHBondContact O-N 3.04Å; D25-L28 PolarHBondContact O-N 2.8Å; L28-W31 PolarHBondContact O-N 2.92Å; L28-N32 WeakPolarHBondContact O-CB 3.26Å; L28-N32 PolarHBondContact O-N 3.32Å; L28-N32 PolarHBondContact O-ND2 3.42Å; L28-N32 VanDerWaalsContact O-ND2 3.11Å; L28-R94 HydrophobicContact CD2-CB 4.16Å; L28-R94 HydrophobicContact CD2-CG 4.26Å
29	S	88.7	Confident	81.8	Confident	52 Å²	52	70.7 Å²	70.7	36%	0.364	36%	0.362	S	S	.	.	H	α-helix	trans	-60.1	-52.6	175.8	179.5	0	0	0	0	111.1	D25 L26 W31 N32 Q33	D25-S29 WeakPolarHBondContact O-CA 3.33Å; D25-S29 WeakPolarHBondContact O-CB 3.47Å; D25-S29 PolarHBondContact O-N 3.25Å; L26-S29 PolarHBondContact O-N 3.21Å; S29-W31 VanDerWaalsContact C-N 3.33Å; S29-W31 PolarHBondContact O-N 3.21Å; S29-N32 PolarHBondContact O-N 3.21Å; S29-Q33 WeakPolarHBondContact O-CB 3Å; S29-Q33 VanDerWaalsContact O-CG 3.24Å; S29-Q33 WeakPolarHBondContact O-CG 3.5Å; S29-Q33 PolarHBondContact O-N 3.23Å; S29-Q33 PolarHBondContact OG-NE2 3.29Å; S29-Q33 VanDerWaalsContact OG-NE2 3.15Å
30	Q	88.6	Confident	83.6	Confident	60 Å²	60	67 Å²	67	28%	0.28	34%	0.341	S	S	.	.	H	α-helix	trans	-62	-41.3	176.8	-70.5	-70	-23.2	0	0	111.8	L26 I27 S34 L98	L26-Q30 HydrophobicContact CD1-CG 4.34Å; L26-Q30 WeakPolarHBondContact O-CB 3.23Å; L26-Q30 VanDerWaalsContact O-CG 3.29Å; L26-Q30 WeakPolarHBondContact O-CG 3.37Å; L26-Q30 PolarHBondContact O-N 2.93Å; I27-Q30 PolarHBondContact O-N 3.04Å; Q30-S34 WeakPolarHBondContact O-CB 3.19Å; Q30-S34 PolarHBondContact O-N 3.04Å; Q30-S34 VanDerWaalsContact O-N 3.09Å; Q30-L98 HydrophobicContact CB-CD1 3.78Å
31	W	91.8	Very high	85.1	Confident	27 Å²	27	66.1 Å²	66.1	10%	0.102	34%	0.344	C	S	.	.	H	α-helix	trans	-66.5	-42.4	178.8	-176.2	-109.2	0	0	0	112.7	I27 L28 S29 S34 N66 R68 I77 P79 P95 L98	I27-W31 WeakPolarHBondContact O-CB 3.38Å; I27-W31 PolarHBondContact O-N 3.16Å; L28-W31 PolarHBondContact O-N 2.92Å; S29-W31 VanDerWaalsContact C-N 3.33Å; S29-W31 PolarHBondContact O-N 3.21Å; W31-S34 WeakPolarHBondContact O-CB 3.46Å; W31-S34 PolarHBondContact O-N 3.01Å; W31-S34 PolarHBondContact O-OG 3.47Å; W31-N66 HydrophobicContact CH2-CB 3.98Å; W31-N66 VanDerWaalsContact CH2-O 3.27Å; W31-N66 WeakPolarHBondContact CH2-O 3.4Å; W31-N66 HydrophobicContact CZ2-CB 4.4Å; W31-R68 HydrophobicContact CH2-CG 3.82Å; W31-R68 HydrophobicContact CZ3-CB 4.32Å; W31-R68 HydrophobicContact CZ3-CG 3.97Å; W31-R68 PolarHBondContact O-NH1 3.24Å; W31-I77 HydrophobicContact CE3-CG2 4.39Å; W31-I77 HydrophobicContact CZ3-CG2 4.36Å; W31-P79 HydrophobicContact CE3-CB 4.4Å; W31-P79 HydrophobicContact CH2-CB 3.81Å; W31-P79 HydrophobicContact CH2-CG 3.71Å; W31-P79 HydrophobicContact CZ3-CB 3.66Å; W31-P79 HydrophobicContact CZ3-CG 3.85Å; W31-P95 HydrophobicContact CB-CG 4.09Å; W31-P95 HydrophobicContact CD2-CG 3.6Å; W31-P95 HydrophobicContact CE3-CG 4Å; W31-P95 HydrophobicContact CG-CG 3.62Å; W31-L98 HydrophobicContact CE3-CD2 3.74Å; W31-L98 HydrophobicContact CZ3-CD2 4.29Å
32	N	90.5	Very high	86.5	Confident	116 Å²	116	66.5 Å²	66.5	62%	0.62	35%	0.35	S	S	*	.	H	α-helix	trans	-70.8	-34.2	-179.8	-70.1	-22.4	0	0	0	111.7	L28 S29 S34	L28-N32 WeakPolarHBondContact O-CB 3.26Å; L28-N32 PolarHBondContact O-N 3.32Å; L28-N32 PolarHBondContact O-ND2 3.42Å; L28-N32 VanDerWaalsContact O-ND2 3.11Å; S29-N32 PolarHBondContact O-N 3.21Å; N32-S34 VanDerWaalsContact C-N 3.33Å
33	Q	91.6	Very high	87.5	Confident	109 Å²	109	65.3 Å²	65.3	51%	0.509	35%	0.352	S	S	.	.	H	α-helix	trans	-76.7	-17.8	175.1	-68.5	175.4	27	0	0	113.6	S29	S29-Q33 WeakPolarHBondContact O-CB 3Å; S29-Q33 VanDerWaalsContact O-CG 3.24Å; S29-Q33 WeakPolarHBondContact O-CG 3.5Å; S29-Q33 PolarHBondContact O-N 3.23Å; S29-Q33 PolarHBondContact OG-NE2 3.29Å; S29-Q33 VanDerWaalsContact OG-NE2 3.15Å
34	S	92.4	Very high	88.2	Confident	4 Å²	4	67.9 Å²	67.9	3%	0.028	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-66	152.4	-178.1	73.1	0	0	0	0	112.7	Q30 W31 N32 R68 A69 I77	Q30-S34 WeakPolarHBondContact O-CB 3.19Å; Q30-S34 PolarHBondContact O-N 3.04Å; Q30-S34 VanDerWaalsContact O-N 3.09Å; W31-S34 WeakPolarHBondContact O-CB 3.46Å; W31-S34 PolarHBondContact O-N 3.01Å; W31-S34 PolarHBondContact O-OG 3.47Å; N32-S34 VanDerWaalsContact C-N 3.33Å; S34-R68 PolarHBondContact O-NH2 2.88Å; S34-R68 WeakPolarHBondContact OG-CD 3.38Å; S34-R68 PolarHBondContact OG-NE 2.86Å; S34-R68 PolarHBondContact OG-NH1 2.95Å; S34-A69 CarbonylContact C-O 3.54Å; S34-A69 WeakPolarHBondContact CA-O 2.98Å; S34-A69 WeakPolarHBondContact CB-O 3.2Å; S34-I77 VanDerWaalsContact CB-CD1 3.45Å
35	L	92.3	Very high	88.7	Confident	51 Å²	51	63.1 Å²	63.1	27%	0.267	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	143.7	-178.3	-57.1	174.9	0	0	0	110.2	Q39 R68 A69	L35-Q39 HydrophobicContact CB-CB 4.44Å; L35-R68 WeakPolarHBondContact O-CB 3.41Å; L35-A69 HydrophobicContact CB-CB 4.49Å; L35-A69 PolarHBondContact N-O 3.37Å; L35-A69 PolarHBondContact O-N 3.45Å
36	P	91.7	Very high	89.1	Confident	50 Å²	50	61.5 Å²	61.5	33%	0.325	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.2	141.7	164.7	-23.6	33.8	0	0	0	110.7	T38 Q39	P36-T38 PolarHBondContact O-N 2.88Å; P36-Q39 WeakPolarHBondContact O-CB 3.26Å; P36-Q39 PolarHBondContact O-N 3.26Å
37	I	91.5	Very high	89.2	Confident	5 Å²	5	62.9 Å²	62.9	3%	0.026	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-61.1	-14.3	179	57.3	160.2	0	0	0	113.8	Q39 I40 M62 V63 V67 L76	I37-Q39 PolarHBondContact O-N 3.47Å; I37-I40 WeakPolarHBondContact O-CG2 3.48Å; I37-M62 HydrophobicContact CD1-CB 3.54Å; I37-M62 HydrophobicContact CD1-CE 4.11Å; I37-M62 HydrophobicContact CD1-CG 4.4Å; I37-M62 HydrophobicContact CD1-SD 4.1Å; I37-M62 HydrophobicContact CG2-CE 4.24Å; I37-V63 HydrophobicContact CD1-CG2 4.19Å; I37-V63 HydrophobicContact CG1-CG2 4.29Å; I37-V67 HydrophobicContact CG2-CG1 4.36Å; I37-V67 WeakPolarHBondContact CG2-O 3.36Å; I37-L76 HydrophobicContact CG2-CD2 4.21Å
38	T	87.7	Confident	89.2	Confident	110 Å²	110	62.6 Å²	62.6	68%	0.675	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-73.7	-13.2	174	51.1	0	0	0	0	113.1	P36	P36-T38 PolarHBondContact O-N 2.88Å
39	Q	89.2	Confident	89.4	Confident	122 Å²	122	63.2 Å²	63.2	57%	0.57	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-97	-7.2	-179.2	-63.2	-176	2.7	0	0	113.9	L35 P36 I37	L35-Q39 HydrophobicContact CB-CB 4.44Å; P36-Q39 WeakPolarHBondContact O-CB 3.26Å; P36-Q39 PolarHBondContact O-N 3.26Å; I37-Q39 PolarHBondContact O-N 3.47Å
40	I	88.1	Confident	89.4	Confident	13 Å²	13	65.1 Å²	65.1	7%	0.067	34%	0.337	C	S	.	.	S	Bend	trans	-84.3	138.7	174.7	178	166.2	0	0	0	110.4	I37 L42 K44 L45 L48 A69 A73	I37-I40 WeakPolarHBondContact O-CG2 3.48Å; I40-L42 PolarHBondContact O-N 3.05Å; I40-K44 HydrophobicContact CD1-CB 3.96Å; I40-K44 HydrophobicContact CG1-CB 3.91Å; I40-L45 HydrophobicContact CD1-CB 4.44Å; I40-L45 HydrophobicContact CG1-CB 4.26Å; I40-L45 HydrophobicContact CG2-CB 3.84Å; I40-L45 HydrophobicContact CG2-CD1 4.04Å; I40-L45 HydrophobicContact CG2-CD2 4.08Å; I40-L45 HydrophobicContact CG2-CG 4.18Å; I40-L48 HydrophobicContact CD1-CD1 3.6Å; I40-A69 HydrophobicContact CB-CB 4.49Å; I40-A73 HydrophobicContact CD1-CB 4.29Å; I40-A73 WeakPolarHBondContact CD1-O 3.1Å; I40-A73 HydrophobicContact CG1-CB 4.18Å
41	S	86.8	Confident	89.3	Confident	61 Å²	61	64.7 Å²	64.7	43%	0.427	34%	0.337	S	S	.	.			trans	-57.5	136.5	177.6	66.9	0	0	0	0	111.4	P43 K44 L45	S41-P43 VanDerWaalsContact C-CD 3.44Å; S41-P43 VanDerWaalsContact C-N 3.33Å; S41-K44 PolarHBondContact O-N 3.42Å; S41-K44 WeakPolarHBondContact OG-CB 3.31Å; S41-K44 VanDerWaalsContact OG-CG 3.29Å; S41-K44 WeakPolarHBondContact OG-CG 3.23Å; S41-L45 PolarHBondContact O-N 3.16Å
42	L	87.4	Confident	89.2	Confident	125 Å²	125	64.6 Å²	64.6	65%	0.654	34%	0.338	S	S	*	.	H	α-helix	trans	-51.2	-40.8	-177.7	-175.3	64.3	0	0	0	114.3	I40 L45 T46	I40-L42 PolarHBondContact O-N 3.05Å; L42-L45 PolarHBondContact O-N 3.1Å; L42-T46 VanDerWaalsContact O-CB 3.26Å; L42-T46 WeakPolarHBondContact O-CB 3.48Å; L42-T46 PolarHBondContact O-N 3.47Å; L42-T46 PolarHBondContact O-OG1 2.89Å
43	P	87.5	Confident	89.3	Confident	100 Å²	100	62 Å²	62	65%	0.649	33%	0.329	S	S	*	.	H	α-helix	trans	-62.5	-45.4	176.9	-24.1	35.4	0	0	0	113.2	S41 T46 R47	S41-P43 VanDerWaalsContact C-CD 3.44Å; S41-P43 VanDerWaalsContact C-N 3.33Å; P43-T46 PolarHBondContact O-N 3.42Å; P43-R47 WeakPolarHBondContact O-CB 3.34Å; P43-R47 PolarHBondContact O-N 3.28Å
44	K	86.7	Confident	89.4	Confident	104 Å²	104	56.9 Å²	56.9	45%	0.452	31%	0.305	S	S	.	.	H	α-helix	trans	-64.3	-45.6	177.3	-69.2	-175.4	178.4	-174.9	0	111.4	I40 S41 T46 R47 L48 A73	I40-K44 HydrophobicContact CD1-CB 3.96Å; I40-K44 HydrophobicContact CG1-CB 3.91Å; S41-K44 PolarHBondContact O-N 3.42Å; S41-K44 WeakPolarHBondContact OG-CB 3.31Å; S41-K44 VanDerWaalsContact OG-CG 3.29Å; S41-K44 WeakPolarHBondContact OG-CG 3.23Å; K44-T46 PolarHBondContact O-N 2.97Å; K44-R47 PolarHBondContact O-N 2.97Å; K44-L48 WeakPolarHBondContact O-CG 3.43Å; K44-L48 PolarHBondContact O-N 3.1Å; K44-A73 WeakPolarHBondContact CD-O 3.41Å
45	L	88.7	Confident	89.3	Confident	8 Å²	8	64 Å²	64	4%	0.042	33%	0.331	C	S	.	.	H	α-helix	trans	-62.3	-43.1	177.4	-179.6	59	0	0	0	111.4	I40 S41 L42 R47 L48 R49	I40-L45 HydrophobicContact CD1-CB 4.44Å; I40-L45 HydrophobicContact CG1-CB 4.26Å; I40-L45 HydrophobicContact CG2-CB 3.84Å; I40-L45 HydrophobicContact CG2-CD1 4.04Å; I40-L45 HydrophobicContact CG2-CD2 4.08Å; I40-L45 HydrophobicContact CG2-CG 4.18Å; S41-L45 PolarHBondContact O-N 3.16Å; L42-L45 PolarHBondContact O-N 3.1Å; L45-R47 VanDerWaalsContact C-N 3.28Å; L45-R47 PolarHBondContact O-N 3.41Å; L45-L48 PolarHBondContact O-N 3.33Å; L45-R49 HydrophobicContact CD1-CG 4.31Å; L45-R49 HydrophobicContact CG-CG 4.48Å; L45-R49 WeakPolarHBondContact O-CB 3.23Å; L45-R49 VanDerWaalsContact O-CG 3.28Å; L45-R49 WeakPolarHBondContact O-CG 3.5Å; L45-R49 PolarHBondContact O-N 3.02Å
46	T	88.8	Confident	89.4	Confident	67 Å²	67	66 Å²	66	41%	0.411	34%	0.339	S	S	.	.	H	α-helix	trans	-60.1	-40.6	176.4	-59	0	0	0	0	111.2	L42 P43 K44 R49 Q50	L42-T46 VanDerWaalsContact O-CB 3.26Å; L42-T46 WeakPolarHBondContact O-CB 3.48Å; L42-T46 PolarHBondContact O-N 3.47Å; L42-T46 PolarHBondContact O-OG1 2.89Å; P43-T46 PolarHBondContact O-N 3.42Å; K44-T46 PolarHBondContact O-N 2.97Å; T46-R49 PolarHBondContact O-N 3.25Å; T46-Q50 PolarHBondContact O-N 3.45Å
47	R	86.8	Confident	89.5	Confident	108 Å²	108	63.9 Å²	63.9	41%	0.408	33%	0.325	S	S	.	.	H	α-helix	trans	-65.7	-47.6	176.8	-172.8	59.8	176.1	168.2	-0.3	112.3	P43 K44 L45 R49 Q50 L51	P43-R47 WeakPolarHBondContact O-CB 3.34Å; P43-R47 PolarHBondContact O-N 3.28Å; K44-R47 PolarHBondContact O-N 2.97Å; L45-R47 VanDerWaalsContact C-N 3.28Å; L45-R47 PolarHBondContact O-N 3.41Å; R47-R49 VanDerWaalsContact C-N 3.32Å; R47-R49 PolarHBondContact O-N 2.94Å; R47-Q50 PolarHBondContact O-N 3.04Å; R47-L51 HydrophobicContact CG-CD1 4.16Å; R47-L51 WeakPolarHBondContact O-CG 3.43Å; R47-L51 PolarHBondContact O-N 3.31Å; R47-L51 VanDerWaalsContact O-N 3.12Å
48	L	88.9	Confident	89.6	Confident	1 Å²	1	65.9 Å²	65.9	1%	0.005	34%	0.34	C	S	.	.	H	α-helix	trans	-59.5	-43	175.6	-73.8	167.7	0	0	0	111.4	I40 K44 L45 Q50 L51 L52 L76 L103	I40-L48 HydrophobicContact CD1-CD1 3.6Å; K44-L48 WeakPolarHBondContact O-CG 3.43Å; K44-L48 PolarHBondContact O-N 3.1Å; L45-L48 PolarHBondContact O-N 3.33Å; L48-Q50 VanDerWaalsContact C-N 3.33Å; L48-Q50 PolarHBondContact O-N 2.87Å; L48-L51 PolarHBondContact O-N 3.19Å; L48-L52 WeakPolarHBondContact O-CB 3.45Å; L48-L52 PolarHBondContact O-N 3.29Å; L48-L76 HydrophobicContact CB-CD1 4.46Å; L48-L76 HydrophobicContact CB-CG 4.47Å; L48-L76 HydrophobicContact CD1-CD2 4.29Å; L48-L76 HydrophobicContact CD1-CG 4.21Å; L48-L103 HydrophobicContact CD2-CD1 4.06Å; L48-L103 HydrophobicContact CD2-CD2 4.14Å; L48-L103 HydrophobicContact CD2-CG 3.81Å
49	R	91.4	Very high	89.9	Confident	34 Å²	34	64.2 Å²	64.2	13%	0.128	33%	0.326	C	S	.	.	H	α-helix	trans	-61	-40.1	176.3	-76.4	174.4	116.9	131.1	9.1	113	L45 T46 R47 S53 L54 R55 I57 D59	L45-R49 HydrophobicContact CD1-CG 4.31Å; L45-R49 HydrophobicContact CG-CG 4.48Å; L45-R49 WeakPolarHBondContact O-CB 3.23Å; L45-R49 VanDerWaalsContact O-CG 3.28Å; L45-R49 WeakPolarHBondContact O-CG 3.5Å; L45-R49 PolarHBondContact O-N 3.02Å; T46-R49 PolarHBondContact O-N 3.25Å; R47-R49 VanDerWaalsContact C-N 3.32Å; R47-R49 PolarHBondContact O-N 2.94Å; R49-S53 PolarHBondContact O-N 2.89Å; R49-L54 HydrophobicContact CB-CB 4.2Å; R49-L54 HydrophobicContact CG-CB 4.11Å; R49-L54 PolarHBondContact NE-O 2.99Å; R49-L54 PolarHBondContact O-N 3.31Å; R49-R55 PolarHBondContact O-N 3.07Å; R49-I57 PolarHBondContact NH2-O 3.24Å; R49-D59 IonicContact CZ-OD1 3.81Å; R49-D59 IonicContact NH1-OD1 2.86Å; R49-D59 PolarHBondContact NH1-OD1 3.45Å; R49-D59 IonicContact NH2-OD1 3.08Å; R49-D59 PolarHBondContact NH2-OD1 2.97Å
50	Q	88.7	Confident	90.1	Very high	92 Å²	92	61.5 Å²	61.5	43%	0.43	33%	0.325	S	S	.	.	H	α-helix	trans	-64.4	-45.4	178	-175.3	-179.8	8.4	0	0	111	T46 R47 L48	T46-Q50 PolarHBondContact O-N 3.45Å; R47-Q50 PolarHBondContact O-N 3.04Å; L48-Q50 VanDerWaalsContact C-N 3.33Å; L48-Q50 PolarHBondContact O-N 2.87Å
51	L	87.4	Confident	90.5	Very high	52 Å²	52	61.3 Å²	61.3	27%	0.272	32%	0.324	S	S	.	.	H	α-helix	trans	-73.9	-29.2	-175.9	-65.3	167.5	0	0	0	113	R47 L48 L103 I113	R47-L51 HydrophobicContact CG-CD1 4.16Å; R47-L51 WeakPolarHBondContact O-CG 3.43Å; R47-L51 PolarHBondContact O-N 3.31Å; R47-L51 VanDerWaalsContact O-N 3.12Å; L48-L51 PolarHBondContact O-N 3.19Å; L51-L103 HydrophobicContact CD1-CD2 3.37Å; L51-I113 HydrophobicContact CB-CD1 3.49Å; L51-I113 VanDerWaalsContact CB-CD1 3.49Å; L51-I113 HydrophobicContact CB-CG1 4.18Å; L51-I113 WeakPolarHBondContact O-CD1 3.33Å
52	L	89.8	Confident	90.9	Very high	24 Å²	24	58.4 Å²	58.4	13%	0.126	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	11.2	179.2	-67.9	165.5	0	0	0	113.9	L48 L54 L76 F78 C101 I113	L48-L52 WeakPolarHBondContact O-CB 3.45Å; L48-L52 PolarHBondContact O-N 3.29Å; L52-L54 HydrophobicContact CB-CD1 3.95Å; L52-L54 HydrophobicContact CB-CG 3.92Å; L52-L54 HydrophobicContact CD1-CD1 4.5Å; L52-L54 WeakPolarHBondContact O-CG 3.45Å; L52-L54 PolarHBondContact O-N 2.71Å; L52-L76 HydrophobicContact CD1-CB 4.27Å; L52-L76 HydrophobicContact CD1-CD1 3.79Å; L52-L76 HydrophobicContact CD1-CG 4.21Å; L52-F78 HydrophobicContact CD1-CE2 4.36Å; L52-F78 HydrophobicContact CD1-CZ 4.17Å; L52-C101 HydrophobicContact CD1-CB 4.1Å; L52-C101 HydrophobicContact CD2-CB 3.79Å; L52-I113 HydrophobicContact CD2-CD1 3.53Å; L52-I113 HydrophobicContact CD2-CG2 4.23Å; L52-I113 HydrophobicContact CG-CD1 3.73Å
53	S	91.8	Very high	91.2	Very high	63 Å²	63	56.1 Å²	56.1	44%	0.441	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	33.1	-176.2	-58.9	0	0	0	0	114.3	R49	R49-S53 PolarHBondContact O-N 2.89Å
54	L	93.2	Very high	91.4	Very high	1 Å²	1	57.1 Å²	57.1	1%	0.005	29%	0.289	C	S	.	.			trans	-103	10.2	179.8	-55.2	176.9	0	0	0	113.5	R49 L52 H56 I57 M62 L76 F78 A146 M149	R49-L54 HydrophobicContact CB-CB 4.2Å; R49-L54 HydrophobicContact CG-CB 4.11Å; R49-L54 PolarHBondContact NE-O 2.99Å; R49-L54 PolarHBondContact O-N 3.31Å; L52-L54 HydrophobicContact CB-CD1 3.95Å; L52-L54 HydrophobicContact CB-CG 3.92Å; L52-L54 HydrophobicContact CD1-CD1 4.5Å; L52-L54 WeakPolarHBondContact O-CG 3.45Å; L52-L54 PolarHBondContact O-N 2.71Å; L54-H56 PolarHBondContact O-N 3.34Å; L54-H56 VanDerWaalsContact O-N 3.16Å; L54-I57 HydrophobicContact CB-CB 4.44Å; L54-I57 HydrophobicContact CB-CG1 4.36Å; L54-I57 HydrophobicContact CD2-CG1 3.93Å; L54-I57 PolarHBondContact O-N 2.9Å; L54-I57 VanDerWaalsContact O-N 3.11Å; L54-M62 HydrophobicContact CD1-CE 4.22Å; L54-L76 HydrophobicContact CD1-CD1 3.93Å; L54-F78 HydrophobicContact CD1-CE1 4.24Å; L54-F78 HydrophobicContact CD1-CZ 4.1Å; L54-A146 HydrophobicContact CD2-CB 3.66Å; L54-M149 HydrophobicContact CD1-CE 4.31Å; L54-M149 HydrophobicContact CD2-CE 3.35Å; L54-M149 HydrophobicContact CG-CE 4.47Å
55	R	91.8	Very high	91.8	Very high	154 Å²	154	52.2 Å²	52.2	58%	0.581	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-34.4	-177	-179.5	179.2	-93.6	-172.2	-5.6	113.1	R49	R49-R55 PolarHBondContact O-N 3.07Å
56	H	93.2	Very high	92.1	Very high	93 Å²	93	54.7 Å²	54.7	43%	0.431	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	3.4	-178.1	-61	-77.4	0	0	0	114	L54 Q153 I224 A225	L54-H56 PolarHBondContact O-N 3.34Å; L54-H56 VanDerWaalsContact O-N 3.16Å; H56-Q153 PolarHBondContact O-NE2 3.44Å; H56-I224 HydrophobicContact CB-CG2 3.96Å; H56-A225 WeakPolarHBondContact CD2-CB 3.41Å; H56-A225 WeakPolarHBondContact NE2-CB 3.22Å
57	I	94.7	Very high	92.4	Very high	4 Å²	4	51.7 Å²	51.7	2%	0.021	26%	0.262	C	S	.	.	S	Bend	trans	-85.6	132.5	172.6	-55.7	-53	0	0	0	107.8	R49 L54 T61 M62 M149 A150	R49-I57 PolarHBondContact NH2-O 3.24Å; L54-I57 HydrophobicContact CB-CB 4.44Å; L54-I57 HydrophobicContact CB-CG1 4.36Å; L54-I57 HydrophobicContact CD2-CG1 3.93Å; L54-I57 PolarHBondContact O-N 2.9Å; L54-I57 VanDerWaalsContact O-N 3.11Å; I57-T61 HydrophobicContact CG2-CG2 3.8Å; I57-M62 HydrophobicContact CG2-CG 3.85Å; I57-M149 HydrophobicContact CD1-CB 3.97Å; I57-M149 HydrophobicContact CG1-CB 4.21Å; I57-M149 HydrophobicContact CG2-CB 3.92Å; I57-M149 HydrophobicContact CG2-CG 4.49Å; I57-M149 HydrophobicContact CG2-SD 3.94Å; I57-A150 HydrophobicContact CD1-CB 3.92Å
58	S	93.6	Very high	92.8	Very high	48 Å²	48	49.2 Å²	49.2	34%	0.336	25%	0.253	S	S	.	.			trans	-79.3	156.5	179.1	69.8	0	0	0	0	112.2	A60 T61 M62 Q153	S58-A60 PolarHBondContact O-N 2.94Å; S58-T61 WeakPolarHBondContact O-CB 3.42Å; S58-T61 PolarHBondContact O-N 2.8Å; S58-T61 VanDerWaalsContact O-N 3.1Å; S58-T61 PolarHBondContact OG-N 3.47Å; S58-T61 PolarHBondContact OG-OG1 2.88Å; S58-M62 PolarHBondContact O-N 2.83Å; S58-Q153 PolarHBondContact OG-OE1 3.26Å
59	D	93	Very high	93	Very high	75 Å²	75	49.2 Å²	49.2	40%	0.401	25%	0.253	S	S	.	.	H	α-helix	trans	-59.7	-38.1	176.3	-64.9	-1.2	0	0	0	111.2	R49 T61 M62 V63	R49-D59 IonicContact CZ-OD1 3.81Å; R49-D59 IonicContact NH1-OD1 2.86Å; R49-D59 PolarHBondContact NH1-OD1 3.45Å; R49-D59 IonicContact NH2-OD1 3.08Å; R49-D59 PolarHBondContact NH2-OD1 2.97Å; D59-T61 VanDerWaalsContact C-N 3.31Å; D59-T61 PolarHBondContact O-N 3Å; D59-M62 PolarHBondContact O-N 2.86Å; D59-V63 WeakPolarHBondContact O-CB 3.48Å; D59-V63 VanDerWaalsContact O-CG2 3.3Å; D59-V63 WeakPolarHBondContact O-CG2 3.31Å; D59-V63 PolarHBondContact O-N 2.7Å
60	A	93.9	Very high	93	Very high	64 Å²	64	48.2 Å²	48.2	53%	0.529	25%	0.25	S	S	.	.	H	α-helix	trans	-60.3	-39.4	176.1	0	0	0	0	0	112.5	S58 K64	S58-A60 PolarHBondContact O-N 2.94Å; A60-K64 WeakPolarHBondContact O-CG 3.36Å; A60-K64 PolarHBondContact O-N 2.86Å
61	T	95.7	Very high	92.9	Very high	9 Å²	9	46.7 Å²	46.7	6%	0.055	25%	0.254	C	S	.	.	H	α-helix	trans	-66.9	-47.1	174.6	-59.4	0	0	0	0	110.8	I57 S58 D59 V63 K64 F65 M149 F152 Q153	I57-T61 HydrophobicContact CG2-CG2 3.8Å; S58-T61 WeakPolarHBondContact O-CB 3.42Å; S58-T61 PolarHBondContact O-N 2.8Å; S58-T61 VanDerWaalsContact O-N 3.1Å; S58-T61 PolarHBondContact OG-N 3.47Å; S58-T61 PolarHBondContact OG-OG1 2.88Å; D59-T61 VanDerWaalsContact C-N 3.31Å; D59-T61 PolarHBondContact O-N 3Å; T61-V63 VanDerWaalsContact C-N 3.31Å; T61-V63 PolarHBondContact O-N 3.44Å; T61-K64 PolarHBondContact O-N 3.03Å; T61-F65 HydrophobicContact CG2-CD2 4.04Å; T61-F65 HydrophobicContact CG2-CE2 4.12Å; T61-F65 WeakPolarHBondContact O-CD2 3.34Å; T61-F65 PolarHBondContact O-N 3.13Å; T61-M149 HydrophobicContact CG2-CB 3.84Å; T61-M149 HydrophobicContact CG2-CG 4.04Å; T61-M149 HydrophobicContact CG2-SD 4.47Å; T61-F152 HydrophobicContact CG2-CD1 4.23Å; T61-Q153 HydrophobicContact CG2-CB 4.22Å; T61-Q153 PolarHBondContact OG1-OE1 2.83Å
62	M	95.5	Very high	92.8	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-59.5	-41.9	178.2	-68.1	-179.1	69.7	0	0	112	I37 L54 I57 S58 D59 F65 N66 V67 L76 M149	I37-M62 HydrophobicContact CD1-CB 3.54Å; I37-M62 HydrophobicContact CD1-CE 4.11Å; I37-M62 HydrophobicContact CD1-CG 4.4Å; I37-M62 HydrophobicContact CD1-SD 4.1Å; I37-M62 HydrophobicContact CG2-CE 4.24Å; L54-M62 HydrophobicContact CD1-CE 4.22Å; I57-M62 HydrophobicContact CG2-CG 3.85Å; S58-M62 PolarHBondContact O-N 2.83Å; D59-M62 PolarHBondContact O-N 2.86Å; M62-F65 CarbonylContact O-C 3.54Å; M62-F65 PolarHBondContact O-N 2.64Å; M62-N66 PolarHBondContact O-N 2.79Å; M62-V67 HydrophobicContact CB-CB 4.18Å; M62-V67 HydrophobicContact CB-CG2 4.39Å; M62-V67 HydrophobicContact CE-CB 4.23Å; M62-V67 HydrophobicContact CE-CG1 3.74Å; M62-V67 PolarHBondContact O-N 3.25Å; M62-L76 HydrophobicContact CE-CD1 3.9Å; M62-M149 HydrophobicContact CG-SD 4.13Å
63	V	93.8	Very high	92.5	Very high	77 Å²	77	46.9 Å²	46.9	47%	0.467	26%	0.262	S	S	.	.	H	α-helix	trans	-63.6	-43.4	175.4	170.9	0	0	0	0	111.4	I37 D59 T61 F65 N66	I37-V63 HydrophobicContact CD1-CG2 4.19Å; I37-V63 HydrophobicContact CG1-CG2 4.29Å; D59-V63 WeakPolarHBondContact O-CB 3.48Å; D59-V63 VanDerWaalsContact O-CG2 3.3Å; D59-V63 WeakPolarHBondContact O-CG2 3.31Å; D59-V63 PolarHBondContact O-N 2.7Å; T61-V63 VanDerWaalsContact C-N 3.31Å; T61-V63 PolarHBondContact O-N 3.44Å; V63-F65 VanDerWaalsContact C-N 3.29Å; V63-F65 PolarHBondContact O-N 3.2Å; V63-N66 WeakPolarHBondContact O-CA 3.15Å; V63-N66 PolarHBondContact O-N 2.93Å; V63-N66 PolarHBondContact O-OD1 3.48Å
64	K	93.2	Very high	92.2	Very high	122 Å²	122	45.9 Å²	45.9	53%	0.53	25%	0.252	S	S	.	.	H	α-helix	trans	-60.1	-39.3	175.8	-79.5	179.2	177.4	-177.9	0	112.3	A60 T61 N66 H130 L131 F152	A60-K64 WeakPolarHBondContact O-CG 3.36Å; A60-K64 PolarHBondContact O-N 2.86Å; T61-K64 PolarHBondContact O-N 3.03Å; K64-N66 PolarHBondContact O-N 2.68Å; K64-H130 PolarHBondContact O-NE2 3.34Å; K64-L131 HydrophobicContact CB-CD2 4.5Å; K64-L131 WeakPolarHBondContact O-CD2 3.33Å; K64-F152 HydrophobicContact CB-CE1 4.46Å; K64-F152 HydrophobicContact CD-CE1 3.63Å; K64-F152 HydrophobicContact CD-CZ 3.89Å
65	F	94.8	Very high	92.1	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	4.1	174.7	-82.8	-97.1	0	0	0	113.8	T61 M62 V63 V67 F127 L131 A148 M149 F152	T61-F65 HydrophobicContact CG2-CD2 4.04Å; T61-F65 HydrophobicContact CG2-CE2 4.12Å; T61-F65 WeakPolarHBondContact O-CD2 3.34Å; T61-F65 PolarHBondContact O-N 3.13Å; M62-F65 CarbonylContact O-C 3.54Å; M62-F65 PolarHBondContact O-N 2.64Å; V63-F65 VanDerWaalsContact C-N 3.29Å; V63-F65 PolarHBondContact O-N 3.2Å; F65-V67 HydrophobicContact CB-CG2 4.15Å; F65-V67 PolarHBondContact O-N 3Å; F65-F127 HydrophobicContact CB-CE1 4.23Å; F65-F127 HydrophobicContact CB-CE2 4.01Å; F65-F127 HydrophobicContact CB-CZ 3.54Å; F65-F127 AromaticContact CD1-CD1 3.76Å; F65-F127 HydrophobicContact CD1-CD1 3.76Å; F65-F127 AromaticContact CD1-CE1 3.23Å; F65-F127 HydrophobicContact CD1-CE1 3.23Å; F65-F127 HydrophobicContact CD1-CE2 4.14Å; F65-F127 HydrophobicContact CD1-CG 4.44Å; F65-F127 AromaticContact CD1-CZ 3.45Å; F65-F127 HydrophobicContact CD1-CZ 3.45Å; F65-F127 VanDerWaalsContact CD1-CZ 3.45Å; F65-F127 HydrophobicContact CE1-CD1 4.09Å; F65-F127 AromaticContact CE1-CE1 3.78Å; F65-F127 HydrophobicContact CE1-CE1 3.78Å; F65-F127 HydrophobicContact CE1-CZ 4.42Å; F65-F127 AromaticContact CG-CE1 3.96Å; F65-F127 HydrophobicContact CG-CE1 3.96Å; F65-F127 AromaticContact CG-CZ 3.79Å; F65-F127 HydrophobicContact CG-CZ 3.79Å; F65-L131 HydrophobicContact CD1-CD1 4.09Å; F65-L131 HydrophobicContact CD2-CD1 3.77Å; F65-L131 HydrophobicContact CE1-CD1 3.97Å; F65-L131 HydrophobicContact CE2-CD1 3.65Å; F65-L131 HydrophobicContact CG-CD1 4.02Å; F65-L131 HydrophobicContact CZ-CD1 3.76Å; F65-A148 HydrophobicContact CE1-CB 4.45Å; F65-M149 HydrophobicContact CB-CG 4.35Å; F65-M149 HydrophobicContact CB-SD 4.29Å; F65-M149 HydrophobicContact CD1-CG 4.18Å; F65-M149 HydrophobicContact CD2-CG 3.7Å; F65-M149 HydrophobicContact CD2-SD 4.48Å; F65-M149 HydrophobicContact CE1-CG 4.38Å; F65-M149 HydrophobicContact CE2-CG 3.91Å; F65-M149 HydrophobicContact CG-CG 3.82Å; F65-M149 HydrophobicContact CG-SD 4.39Å; F65-M149 HydrophobicContact CZ-CG 4.25Å; F65-F152 HydrophobicContact CD2-CD1 4.44Å; F65-F152 HydrophobicContact CE2-CB 3.58Å; F65-F152 AromaticContact CE2-CD1 3.59Å; F65-F152 HydrophobicContact CE2-CD1 3.59Å; F65-F152 HydrophobicContact CE2-CD2 4.18Å; F65-F152 HydrophobicContact CE2-CE1 4.29Å; F65-F152 AromaticContact CE2-CG 3.51Å; F65-F152 HydrophobicContact CE2-CG 3.51Å; F65-F152 HydrophobicContact CZ-CB 3.66Å; F65-F152 HydrophobicContact CZ-CD1 4.43Å; F65-F152 HydrophobicContact CZ-CD2 4.32Å; F65-F152 AromaticContact CZ-CG 3.89Å; F65-F152 HydrophobicContact CZ-CG 3.89Å
66	N	94	Very high	92.2	Very high	60 Å²	60	38.5 Å²	38.5	32%	0.321	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	33.6	-176.2	-70.4	-19.2	0	0	0	112.9	W31 M62 V63 K64 R68 P79 Y81	W31-N66 HydrophobicContact CH2-CB 3.98Å; W31-N66 VanDerWaalsContact CH2-O 3.27Å; W31-N66 WeakPolarHBondContact CH2-O 3.4Å; W31-N66 HydrophobicContact CZ2-CB 4.4Å; M62-N66 PolarHBondContact O-N 2.79Å; V63-N66 WeakPolarHBondContact O-CA 3.15Å; V63-N66 PolarHBondContact O-N 2.93Å; V63-N66 PolarHBondContact O-OD1 3.48Å; K64-N66 PolarHBondContact O-N 2.68Å; N66-R68 PolarHBondContact O-N 3.32Å; N66-P79 HydrophobicContact CB-CG 3.78Å; N66-P79 VanDerWaalsContact O-CD 3.26Å; N66-P79 WeakPolarHBondContact O-CD 3.43Å; N66-P79 VanDerWaalsContact O-CG 3.28Å; N66-P79 WeakPolarHBondContact O-CG 3.4Å; N66-Y81 PolarHBondContact ND2-OH 2.98Å
67	V	95.4	Very high	92.3	Very high	4 Å²	4	34 Å²	34	2%	0.024	20%	0.203	C	C	.	.			trans	-65.4	130	172.2	-176.8	0	0	0	0	108.6	I37 M62 F65 L76 I77 F78 F127 M149	I37-V67 HydrophobicContact CG2-CG1 4.36Å; I37-V67 WeakPolarHBondContact CG2-O 3.36Å; M62-V67 HydrophobicContact CB-CB 4.18Å; M62-V67 HydrophobicContact CB-CG2 4.39Å; M62-V67 HydrophobicContact CE-CB 4.23Å; M62-V67 HydrophobicContact CE-CG1 3.74Å; M62-V67 PolarHBondContact O-N 3.25Å; F65-V67 HydrophobicContact CB-CG2 4.15Å; F65-V67 PolarHBondContact O-N 3Å; V67-L76 HydrophobicContact CG1-CB 4.36Å; V67-L76 HydrophobicContact CG1-CD1 4.33Å; V67-I77 WeakPolarHBondContact CA-O 3.32Å; V67-F78 HydrophobicContact CG1-CD1 4.17Å; V67-F78 HydrophobicContact CG1-CE1 4Å; V67-F78 HydrophobicContact CG2-CD1 3.85Å; V67-F78 HydrophobicContact CG2-CE1 4.08Å; V67-F127 HydrophobicContact CG2-CE2 4.02Å; V67-F127 HydrophobicContact CG2-CZ 3.87Å; V67-M149 HydrophobicContact CG2-CE 4.36Å; V67-M149 HydrophobicContact CG2-SD 4Å
68	R	94.7	Very high	92.4	Very high	57 Å²	57	34 Å²	34	22%	0.215	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	164.8	179.6	-65.6	-174.2	78.7	175.4	-1.8	110.5	W31 S34 L35 N66 L76 I77	W31-R68 HydrophobicContact CH2-CG 3.82Å; W31-R68 HydrophobicContact CZ3-CB 4.32Å; W31-R68 HydrophobicContact CZ3-CG 3.97Å; W31-R68 PolarHBondContact O-NH1 3.24Å; S34-R68 PolarHBondContact O-NH2 2.88Å; S34-R68 WeakPolarHBondContact OG-CD 3.38Å; S34-R68 PolarHBondContact OG-NE 2.86Å; S34-R68 PolarHBondContact OG-NH1 2.95Å; L35-R68 WeakPolarHBondContact O-CB 3.41Å; N66-R68 PolarHBondContact O-N 3.32Å; R68-L76 CarbonylContact O-C 3.49Å; R68-L76 WeakPolarHBondContact O-CA 3.42Å; R68-I77 PolarHBondContact N-O 3.34Å; R68-I77 PolarHBondContact O-N 3.38Å
69	A	93.4	Very high	92.4	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.008	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	149.9	172.6	0	0	0	0	0	110.3	S34 L35 I40 G75 L76	S34-A69 CarbonylContact C-O 3.54Å; S34-A69 WeakPolarHBondContact CA-O 2.98Å; S34-A69 WeakPolarHBondContact CB-O 3.2Å; L35-A69 HydrophobicContact CB-CB 4.49Å; L35-A69 PolarHBondContact N-O 3.37Å; L35-A69 PolarHBondContact O-N 3.45Å; I40-A69 HydrophobicContact CB-CB 4.49Å; A69-G75 WeakPolarHBondContact CA-O 3.4Å; A69-L76 HydrophobicContact CB-CD2 4.35Å
70	L	91.1	Very high	92.5	Very high	13 Å²	13	29 Å²	29	7%	0.068	17%	0.171	C	C	.	.			trans	-60.9	153.3	166.4	-72.5	172.3	0	0	0	110.4	S72 A73 G75 I77 I100 K102	L70-S72 PolarHBondContact O-N 3.09Å; L70-A73 WeakPolarHBondContact O-CA 3.35Å; L70-A73 PolarHBondContact O-N 2.99Å; L70-G75 PolarHBondContact N-O 3.24Å; L70-I77 HydrophobicContact CD2-CD1 3.83Å; L70-I77 HydrophobicContact CD2-CG1 3.87Å; L70-I77 HydrophobicContact CG-CG1 4.19Å; L70-I100 HydrophobicContact CD1-CG2 3.72Å; L70-I100 HydrophobicContact CD2-CD1 4.36Å; L70-I100 HydrophobicContact CD2-CG2 3.78Å; L70-I100 HydrophobicContact CG-CG2 4.04Å; L70-K102 HydrophobicContact CD1-CB 4.1Å; L70-K102 HydrophobicContact CD1-CD 4.16Å; L70-K102 HydrophobicContact CD1-CG 3.98Å
71	A	87	Confident	92.4	Very high	60 Å²	60	26 Å²	26	50%	0.496	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-32.7	176.1	0	0	0	0	0	112.9	A73	A71-A73 PolarHBondContact O-N 2.89Å
72	S	84.7	Confident	92	Very high	63 Å²	63	27 Å²	27	44%	0.441	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-8.8	173.3	44.2	0	0	0	0	114.5	L70 D74	L70-S72 PolarHBondContact O-N 3.09Å; S72-D74 VanDerWaalsContact CB-OD1 3.29Å; S72-D74 WeakPolarHBondContact CB-OD1 3.29Å; S72-D74 PolarHBondContact O-N 3.43Å; S72-D74 PolarHBondContact OG-OD1 3.24Å
73	A	83.5	Confident	91.3	Very high	17 Å²	17	29.3 Å²	29.3	14%	0.14	17%	0.166	C	C	.	.	S	Bend	trans	55.7	25.8	-177.8	0	0	0	0	0	114.7	I40 K44 L70 A71	I40-A73 HydrophobicContact CD1-CB 4.29Å; I40-A73 WeakPolarHBondContact CD1-O 3.1Å; I40-A73 HydrophobicContact CG1-CB 4.18Å; K44-A73 WeakPolarHBondContact CD-O 3.41Å; L70-A73 WeakPolarHBondContact O-CA 3.35Å; L70-A73 PolarHBondContact O-N 2.99Å; A71-A73 PolarHBondContact O-N 2.89Å
74	D	86.2	Confident	90.6	Very high	41 Å²	41	26 Å²	26	22%	0.219	15%	0.145	C	C	.	.	S	Bend	trans	-116.7	11.1	-179.6	64.2	-5.1	0	0	0	113.1	S72 K102 L103	S72-D74 VanDerWaalsContact CB-OD1 3.29Å; S72-D74 WeakPolarHBondContact CB-OD1 3.29Å; S72-D74 PolarHBondContact O-N 3.43Å; S72-D74 PolarHBondContact OG-OD1 3.24Å; D74-K102 WeakPolarHBondContact OD1-CE 3.48Å; D74-K102 WeakPolarHBondContact OD2-CE 3.24Å; D74-K102 IonicContact OD2-NZ 2.97Å; D74-L103 WeakPolarHBondContact O-CG 3.38Å; D74-L103 PolarHBondContact O-N 3.36Å
75	G	90.6	Very high	89.5	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	166.3	176.9	0	0	0	0	0	113.3	A69 L70 C101	A69-G75 WeakPolarHBondContact CA-O 3.4Å; L70-G75 PolarHBondContact N-O 3.24Å; G75-C101 CarbonylContact C-O 3.49Å; G75-C101 WeakPolarHBondContact CA-O 3.44Å
76	L	94.8	Very high	88.3	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	148.4	177	-64.1	-176.4	0	0	0	111.1	I37 L48 L52 L54 M62 V67 R68 A69 F78 C101	I37-L76 HydrophobicContact CG2-CD2 4.21Å; L48-L76 HydrophobicContact CB-CD1 4.46Å; L48-L76 HydrophobicContact CB-CG 4.47Å; L48-L76 HydrophobicContact CD1-CD2 4.29Å; L48-L76 HydrophobicContact CD1-CG 4.21Å; L52-L76 HydrophobicContact CD1-CB 4.27Å; L52-L76 HydrophobicContact CD1-CD1 3.79Å; L52-L76 HydrophobicContact CD1-CG 4.21Å; L54-L76 HydrophobicContact CD1-CD1 3.93Å; M62-L76 HydrophobicContact CE-CD1 3.9Å; V67-L76 HydrophobicContact CG1-CB 4.36Å; V67-L76 HydrophobicContact CG1-CD1 4.33Å; R68-L76 CarbonylContact O-C 3.49Å; R68-L76 WeakPolarHBondContact O-CA 3.42Å; A69-L76 HydrophobicContact CB-CD2 4.35Å; L76-F78 HydrophobicContact CB-CE2 4.03Å; L76-F78 HydrophobicContact CB-CZ 4.13Å; L76-F78 HydrophobicContact CD1-CZ 4.33Å; L76-C101 PolarHBondContact N-O 3.41Å; L76-C101 PolarHBondContact O-N 3.37Å
77	I	94.9	Very high	86.9	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	126.9	175.9	-51.1	-176.6	0	0	0	108.4	W31 S34 V67 R68 L70 L98 K99 I100	W31-I77 HydrophobicContact CE3-CG2 4.39Å; W31-I77 HydrophobicContact CZ3-CG2 4.36Å; S34-I77 VanDerWaalsContact CB-CD1 3.45Å; V67-I77 WeakPolarHBondContact CA-O 3.32Å; R68-I77 PolarHBondContact N-O 3.34Å; R68-I77 PolarHBondContact O-N 3.38Å; L70-I77 HydrophobicContact CD2-CD1 3.83Å; L70-I77 HydrophobicContact CD2-CG1 3.87Å; L70-I77 HydrophobicContact CG-CG1 4.19Å; I77-L98 HydrophobicContact CG2-CB 3.97Å; I77-L98 HydrophobicContact CG2-CD1 4.11Å; I77-L98 HydrophobicContact CG2-CD2 3.83Å; I77-L98 HydrophobicContact CG2-CG 4.18Å; I77-K99 WeakPolarHBondContact CA-O 3.29Å; I77-I100 HydrophobicContact CG1-CG1 4.34Å; I77-I100 HydrophobicContact CG2-CG1 4.43Å
78	F	95.7	Very high	85.2	Confident	3 Å²	3	35 Å²	35	1%	0.013	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	105.8	175.7	-57.8	-86.4	0	0	0	109.4	L52 L54 V67 L76 K99 C101 F127 E145 M149	L52-F78 HydrophobicContact CD1-CE2 4.36Å; L52-F78 HydrophobicContact CD1-CZ 4.17Å; L54-F78 HydrophobicContact CD1-CE1 4.24Å; L54-F78 HydrophobicContact CD1-CZ 4.1Å; V67-F78 HydrophobicContact CG1-CD1 4.17Å; V67-F78 HydrophobicContact CG1-CE1 4Å; V67-F78 HydrophobicContact CG2-CD1 3.85Å; V67-F78 HydrophobicContact CG2-CE1 4.08Å; L76-F78 HydrophobicContact CB-CE2 4.03Å; L76-F78 HydrophobicContact CB-CZ 4.13Å; L76-F78 HydrophobicContact CD1-CZ 4.33Å; F78-K99 HydrophobicContact CB-CB 4.28Å; F78-K99 PolarHBondContact N-O 2.88Å; F78-K99 PolarHBondContact O-N 3.45Å; F78-C101 HydrophobicContact CE2-CB 4.1Å; F78-F127 HydrophobicContact CB-CD2 3.83Å; F78-F127 HydrophobicContact CB-CE2 3.82Å; F78-F127 AromaticContact CD1-CE2 3.8Å; F78-F127 HydrophobicContact CD1-CE2 3.8Å; F78-F127 AromaticContact CD1-CZ 3.88Å; F78-F127 HydrophobicContact CD1-CZ 3.88Å; F78-F127 HydrophobicContact CG-CE2 4.32Å; F78-E145 HydrophobicContact CB-CG 3.88Å; F78-E145 HydrophobicContact CD1-CB 3.66Å; F78-E145 HydrophobicContact CD1-CG 3.65Å; F78-E145 HydrophobicContact CD2-CG 4.41Å; F78-E145 HydrophobicContact CE1-CB 3.83Å; F78-E145 HydrophobicContact CE1-CG 4.27Å; F78-E145 HydrophobicContact CG-CB 4.22Å; F78-E145 HydrophobicContact CG-CG 3.73Å; F78-M149 HydrophobicContact CE1-CE 3.96Å
79	P	95	Very high	82.7	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	140.9	-176.9	30.1	-36.5	0	0	0	112.7	W31 N66 Y81 P95 L98 F127	W31-P79 HydrophobicContact CE3-CB 4.4Å; W31-P79 HydrophobicContact CH2-CB 3.81Å; W31-P79 HydrophobicContact CH2-CG 3.71Å; W31-P79 HydrophobicContact CZ3-CB 3.66Å; W31-P79 HydrophobicContact CZ3-CG 3.85Å; N66-P79 HydrophobicContact CB-CG 3.78Å; N66-P79 VanDerWaalsContact O-CD 3.26Å; N66-P79 WeakPolarHBondContact O-CD 3.43Å; N66-P79 VanDerWaalsContact O-CG 3.28Å; N66-P79 WeakPolarHBondContact O-CG 3.4Å; P79-Y81 HydrophobicContact CB-CE2 3.82Å; P79-Y81 HydrophobicContact CG-CE2 3.87Å; P79-P95 HydrophobicContact CB-CB 3.78Å; P79-L98 HydrophobicContact CB-CD2 4.25Å; P79-F127 VanDerWaalsContact O-CD2 3.24Å; P79-F127 WeakPolarHBondContact O-CD2 3.44Å
80	R	94.2	Very high	81.1	Confident	19 Å²	19	42 Å²	42	7%	0.072	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	139.8	174.9	-65.1	-179.6	177.4	152.5	1.8	109.4	P95 S96 G97 N117 G125 F127	R80-P95 CarbonylContact O-C 3.52Å; R80-P95 WeakPolarHBondContact O-CA 3.34Å; R80-S96 PolarHBondContact O-N 3.49Å; R80-G97 WeakPolarHBondContact CB-O 3.25Å; R80-G97 PolarHBondContact N-O 3.17Å; R80-G97 PolarHBondContact O-N 3.21Å; R80-N117 PolarHBondContact NH1-OD1 2.86Å; R80-N117 PolarHBondContact NH2-OD1 3.26Å; R80-G125 WeakPolarHBondContact CD-O 3.32Å; R80-F127 HydrophobicContact CG-CB 4.42Å
81	Y	92.3	Very high	79.7	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-123.2	138.3	-177.1	-60.2	-83.1	0	0	0	110.4	N66 P79 L93 R94 P95 G125 F126 H130	N66-Y81 PolarHBondContact ND2-OH 2.98Å; P79-Y81 HydrophobicContact CB-CE2 3.82Å; P79-Y81 HydrophobicContact CG-CE2 3.87Å; Y81-L93 HydrophobicContact CD1-CB 4.45Å; Y81-L93 HydrophobicContact CD1-CD2 3.27Å; Y81-L93 HydrophobicContact CD1-CG 3.71Å; Y81-L93 HydrophobicContact CE1-CB 4.3Å; Y81-L93 HydrophobicContact CE1-CD2 3.82Å; Y81-L93 HydrophobicContact CE1-CG 4.05Å; Y81-L93 HydrophobicContact CG-CD2 3.72Å; Y81-R94 WeakPolarHBondContact CD1-O 3.48Å; Y81-P95 HydrophobicContact CE1-CB 4.1Å; Y81-G125 WeakPolarHBondContact O-CA 3.31Å; Y81-F126 PolarHBondContact N-O 3.38Å; Y81-F126 PolarHBondContact O-N 3.43Å; Y81-H130 HydrophobicContact CD1-CB 4.37Å; Y81-H130 HydrophobicContact CD2-CB 3.67Å; Y81-H130 AromaticContact CD2-CG 3.6Å; Y81-H130 AromaticContact CD2-ND1 3.28Å; Y81-H130 VanDerWaalsContact CD2-ND1 3.28Å; Y81-H130 WeakPolarHBondContact CD2-ND1 3.32Å; Y81-H130 HydrophobicContact CE2-CB 3.97Å; Y81-H130 AromaticContact CE2-CE1 3.71Å; Y81-H130 AromaticContact CE2-CG 3.52Å; Y81-H130 AromaticContact CE2-ND1 3.29Å; Y81-H130 VanDerWaalsContact CE2-ND1 3.29Å; Y81-H130 WeakPolarHBondContact CE2-ND1 3.39Å; Y81-H130 HydrophobicContact CG-CB 3.88Å
82	S	87.8	Confident	78.8	Confident	31 Å²	31	55.6 Å²	55.6	22%	0.217	29%	0.291	C	S	.	.	S	Bend	trans	-101	-4.8	174	66.9	0	0	0	0	113.5	S96 V124	S82-S96 WeakPolarHBondContact CB-OG 3.45Å; S82-S96 PolarHBondContact N-OG 2.93Å; S82-S96 VanDerWaalsContact N-OG 3.11Å; S82-S96 PolarHBondContact OG-OG 2.9Å; S82-V124 WeakPolarHBondContact CB-O 3.42Å
83	D	80.7	Confident	78.6	Confident	48 Å²	48	53.6 Å²	53.6	26%	0.257	28%	0.275	S	S	.	.	S	Bend	trans	-138.3	170	-179.6	-140.6	-29	0	0	0	112.2	R87 V88 L93 Y129	D83-R87 WeakPolarHBondContact OD1-CB 3.43Å; D83-R87 VanDerWaalsContact OD1-CD 3.27Å; D83-R87 WeakPolarHBondContact OD1-CD 3.43Å; D83-V88 HydrophobicContact CB-CG2 4.07Å; D83-L93 HydrophobicContact CB-CD1 4.5Å; D83-L93 WeakPolarHBondContact O-CD2 3.24Å; D83-Y129 WeakPolarHBondContact O-CD1 3.49Å
84	R	77.8	Confident	78.7	Confident	8 Å²	8	59.1 Å²	59.1	3%	0.03	29%	0.293	C	S	.	.			trans	-107.7	150.7	178.5	-53.5	177.7	-155.7	-161.3	1	109.4	E86 R87 Y129 K133 E179	R84-E86 PolarHBondContact O-N 3Å; R84-E86 VanDerWaalsContact O-N 3.11Å; R84-R87 PolarHBondContact O-N 3.46Å; R84-Y129 HydrophobicContact CG-CD1 4.34Å; R84-Y129 HydrophobicContact CG-CE1 3.71Å; R84-Y129 PolarHBondContact NE-OH 2.95Å; R84-Y129 PolarHBondContact NH2-OH 3.33Å; R84-K133 VanDerWaalsContact NH1-C 3.29Å; R84-K133 PolarHBondContact NH1-O 3.31Å; R84-E179 IonicContact CZ-OE2 3.78Å; R84-E179 IonicContact NH2-OE2 3.21Å; R84-E179 PolarHBondContact NH2-OE2 3.32Å
85	L	71.8	Confident	79	Confident	94 Å²	94	57.5 Å²	57.5	49%	0.492	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-57.9	-31.1	-179.3	-152.6	125	0	0	0	112.6	R87 V88 L93	L85-R87 VanDerWaalsContact C-N 3.28Å; L85-R87 PolarHBondContact O-N 3.01Å; L85-V88 PolarHBondContact O-N 2.9Å; L85-L93 HydrophobicContact CD1-CB 4.02Å
86	E	68.7	Low	78.9	Confident	104 Å²	104	59.1 Å²	59.1	49%	0.486	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-67.5	-21.6	177.7	-64.6	174.2	178.3	0	0	114.4	R84 K133 S134	R84-E86 PolarHBondContact O-N 3Å; R84-E86 VanDerWaalsContact O-N 3.11Å; E86-K133 VanDerWaalsContact OE1-CB 3.25Å; E86-K133 WeakPolarHBondContact OE1-CB 3.25Å; E86-K133 WeakPolarHBondContact OE1-CD 3.43Å; E86-K133 VanDerWaalsContact OE1-CG 3.27Å; E86-K133 WeakPolarHBondContact OE1-CG 3.44Å; E86-S134 VanDerWaalsContact OE2-CB 3.25Å; E86-S134 WeakPolarHBondContact OE2-CB 3.44Å; E86-S134 PolarHBondContact OE2-N 3.12Å; E86-S134 PolarHBondContact OE2-OG 2.76Å
87	R	64.3	Low	78.8	Confident	130 Å²	130	59.2 Å²	59.2	49%	0.491	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-98	-10.1	-176.8	-73.1	-176	177.6	178.8	1.6	112.9	D83 R84 L85 E179	D83-R87 WeakPolarHBondContact OD1-CB 3.43Å; D83-R87 VanDerWaalsContact OD1-CD 3.27Å; D83-R87 WeakPolarHBondContact OD1-CD 3.43Å; R84-R87 PolarHBondContact O-N 3.46Å; L85-R87 VanDerWaalsContact C-N 3.28Å; L85-R87 PolarHBondContact O-N 3.01Å; R87-E179 IonicContact CZ-OE1 3.75Å; R87-E179 IonicContact NH1-OE1 2.75Å; R87-E179 PolarHBondContact NH1-OE1 2.79Å; R87-E179 IonicContact NH1-OE2 3.65Å; R87-E179 IonicContact NH2-OE1 3.98Å; R87-E179 PolarHBondContact NH2-OE1 2.91Å; R87-E179 IonicContact NH2-OE2 2.63Å
88	V	60.4	Low	78.7	Confident	46 Å²	46	59.2 Å²	59.2	28%	0.279	30%	0.296	S	S	.	.			trans	-107	132.6	-177.5	-170	0	0	0	0	108.9	D83 L85 E90 L93	D83-V88 HydrophobicContact CB-CG2 4.07Å; L85-V88 PolarHBondContact O-N 2.9Å; V88-E90 HydrophobicContact CG1-CB 4.02Å; V88-E90 HydrophobicContact CG1-CG 4.14Å; V88-E90 PolarHBondContact O-N 3.37Å; V88-L93 HydrophobicContact CB-CD1 4.23Å; V88-L93 HydrophobicContact CG2-CD1 3.57Å
89	A	41.8	Very low	78.6	Confident	114 Å²	114	59.9 Å²	59.9	94%	0.942	30%	0.299	S	S	*	.	S	Bend	trans	-69.2	-14.8	179.8	0	0	0	0	0	113.3
90	E	59.9	Low	78.4	Confident	90 Å²	90	60.7 Å²	60.7	42%	0.421	30%	0.303	S	S	.	.	S	Bend	trans	-76.1	148.4	-179	-61.4	-170.1	176.8	0	0	112.3	V88 Q92 R94	V88-E90 HydrophobicContact CG1-CB 4.02Å; V88-E90 HydrophobicContact CG1-CG 4.14Å; V88-E90 PolarHBondContact O-N 3.37Å; E90-Q92 PolarHBondContact O-N 3.3Å; E90-R94 IonicContact OE1-NE 3.31Å; E90-R94 IonicContact OE1-NH2 2.79Å; E90-R94 IonicContact OE2-CZ 3.08Å; E90-R94 IonicContact OE2-NE 2.87Å; E90-R94 PolarHBondContact OE2-NE 3.13Å; E90-R94 VanDerWaalsContact OE2-NE 3.08Å; E90-R94 IonicContact OE2-NH2 2.69Å
91	K	60.9	Low	78.3	Confident	204 Å²	204	59.9 Å²	59.9	89%	0.887	30%	0.3	S	S	*	.	S	Bend	trans	-67.8	-15.9	176	-70.1	-175.8	179	178.9	0	113.7
92	Q	69.6	Low	78.1	Confident	155 Å²	155	63.9 Å²	63.9	72%	0.724	32%	0.318	S	S	*	.	S	Bend	trans	-138	140.7	-178	-67.5	-174.6	1.7	0	0	109.9	E90	E90-Q92 PolarHBondContact O-N 3.3Å
93	L	80.3	Confident	77.7	Confident	22 Å²	22	64.6 Å²	64.6	12%	0.115	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-89.2	124.6	178.5	-165.1	78.5	0	0	0	109.9	Y81 D83 L85 V88 H130	Y81-L93 HydrophobicContact CD1-CB 4.45Å; Y81-L93 HydrophobicContact CD1-CD2 3.27Å; Y81-L93 HydrophobicContact CD1-CG 3.71Å; Y81-L93 HydrophobicContact CE1-CB 4.3Å; Y81-L93 HydrophobicContact CE1-CD2 3.82Å; Y81-L93 HydrophobicContact CE1-CG 4.05Å; Y81-L93 HydrophobicContact CG-CD2 3.72Å; D83-L93 HydrophobicContact CB-CD1 4.5Å; D83-L93 WeakPolarHBondContact O-CD2 3.24Å; L85-L93 HydrophobicContact CD1-CB 4.02Å; V88-L93 HydrophobicContact CB-CD1 4.23Å; V88-L93 HydrophobicContact CG2-CD1 3.57Å; L93-H130 HydrophobicContact CD2-CB 3.44Å; L93-H130 VanDerWaalsContact CD2-CB 3.44Å
94	R	85.9	Confident	77.2	Confident	133 Å²	133	63.8 Å²	63.8	50%	0.502	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-83.5	140	174.7	-59.3	178.6	-168.1	-155.6	-0.8	110.4	L28 Y81 E90	L28-R94 HydrophobicContact CD2-CB 4.16Å; L28-R94 HydrophobicContact CD2-CG 4.26Å; Y81-R94 WeakPolarHBondContact CD1-O 3.48Å; E90-R94 IonicContact OE1-NE 3.31Å; E90-R94 IonicContact OE1-NH2 2.79Å; E90-R94 IonicContact OE2-CZ 3.08Å; E90-R94 IonicContact OE2-NE 2.87Å; E90-R94 PolarHBondContact OE2-NE 3.13Å; E90-R94 VanDerWaalsContact OE2-NE 3.08Å; E90-R94 IonicContact OE2-NH2 2.69Å
95	P	91.4	Very high	76.4	Confident	7 Å²	7	70.2 Å²	70.2	5%	0.045	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-66.4	138.6	175.4	28.7	-33.7	0	0	0	110.4	I27 W31 P79 R80 Y81 L98	I27-P95 HydrophobicContact CG2-CG 4.11Å; I27-P95 WeakPolarHBondContact CG2-O 3.41Å; W31-P95 HydrophobicContact CB-CG 4.09Å; W31-P95 HydrophobicContact CD2-CG 3.6Å; W31-P95 HydrophobicContact CE3-CG 4Å; W31-P95 HydrophobicContact CG-CG 3.62Å; P79-P95 HydrophobicContact CB-CB 3.78Å; R80-P95 CarbonylContact O-C 3.52Å; R80-P95 WeakPolarHBondContact O-CA 3.34Å; Y81-P95 HydrophobicContact CE1-CB 4.1Å; P95-L98 HydrophobicContact CB-CD2 3.82Å; P95-L98 HydrophobicContact CG-CD2 3.83Å
96	S	89.3	Confident	75.4	Confident	34 Å²	34	70.9 Å²	70.9	24%	0.238	36%	0.364	C	S	.	.	S	Bend	trans	-85	-14.6	174	-48.7	0	0	0	0	112.4	I27 R80 S82 V124	I27-S96 WeakPolarHBondContact CD1-O 3.43Å; R80-S96 PolarHBondContact O-N 3.49Å; S82-S96 WeakPolarHBondContact CB-OG 3.45Å; S82-S96 PolarHBondContact N-OG 2.93Å; S82-S96 VanDerWaalsContact N-OG 3.11Å; S82-S96 PolarHBondContact OG-OG 2.9Å; S96-V124 WeakPolarHBondContact O-CG2 3.11Å
97	G	91.6	Very high	74.2	Confident	1 Å²	1	76.5 Å²	76.5	1%	0.01	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.4	165.8	174.5	0	0	0	0	0	110.7	R80 V118	R80-G97 WeakPolarHBondContact CB-O 3.25Å; R80-G97 PolarHBondContact N-O 3.17Å; R80-G97 PolarHBondContact O-N 3.21Å; G97-V118 CarbonylContact C-O 3.2Å; G97-V118 WeakPolarHBondContact CA-O 3.49Å
98	L	93.3	Very high	73.4	Confident	0 Å²	0	77.9 Å²	77.9	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	144.8	-177.4	-51.3	174	0	0	0	110.2	I27 Q30 W31 I77 P79 P95 I100 N117 V118	I27-L98 HydrophobicContact CG2-CD1 4.28Å; I27-L98 HydrophobicContact CG2-CD2 4.38Å; I27-L98 HydrophobicContact CG2-CG 4.04Å; Q30-L98 HydrophobicContact CB-CD1 3.78Å; W31-L98 HydrophobicContact CE3-CD2 3.74Å; W31-L98 HydrophobicContact CZ3-CD2 4.29Å; I77-L98 HydrophobicContact CG2-CB 3.97Å; I77-L98 HydrophobicContact CG2-CD1 4.11Å; I77-L98 HydrophobicContact CG2-CD2 3.83Å; I77-L98 HydrophobicContact CG2-CG 4.18Å; P79-L98 HydrophobicContact CB-CD2 4.25Å; P95-L98 HydrophobicContact CB-CD2 3.82Å; P95-L98 HydrophobicContact CG-CD2 3.83Å; L98-I100 HydrophobicContact CB-CG1 4.42Å; L98-N117 CarbonylContact O-C 3.36Å; L98-N117 WeakPolarHBondContact O-CA 3.5Å; L98-V118 HydrophobicContact CB-CB 4.16Å; L98-V118 HydrophobicContact CB-CG2 4.49Å; L98-V118 PolarHBondContact N-O 3.44Å; L98-V118 PolarHBondContact O-N 2.97Å
99	K	92.8	Very high	72.9	Confident	18 Å²	18	82.9 Å²	82.9	8%	0.078	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	122.6	158.4	-175.9	-172.7	177.2	-176.6	0	108.1	I77 F78 E115 K116 E145	I77-K99 WeakPolarHBondContact CA-O 3.29Å; F78-K99 HydrophobicContact CB-CB 4.28Å; F78-K99 PolarHBondContact N-O 2.88Å; F78-K99 PolarHBondContact O-N 3.45Å; K99-E115 WeakPolarHBondContact CE-OE2 3.32Å; K99-E115 VanDerWaalsContact NZ-CD 3.29Å; K99-E115 IonicContact NZ-OE1 3.16Å; K99-E115 PolarHBondContact NZ-OE1 3.15Å; K99-E115 VanDerWaalsContact NZ-OE1 3.1Å; K99-E115 IonicContact NZ-OE2 3.99Å; K99-E115 PolarHBondContact NZ-OE2 3.2Å; K99-K116 CarbonylContact C-O 3.51Å; K99-K116 WeakPolarHBondContact CA-O 3.44Å; K99-E145 WeakPolarHBondContact CD-OE1 3.14Å; K99-E145 IonicContact NZ-OE1 3.11Å; K99-E145 IonicContact NZ-OE2 3.05Å; K99-E145 PolarHBondContact NZ-OE2 3.08Å
100	I	92.2	Very high	73.3	Confident	17 Å²	17	84 Å²	84	9%	0.087	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	125.9	-179.1	-59.2	176.6	0	0	0	108.2	L70 I77 L98 E115 K116 V118	L70-I100 HydrophobicContact CD1-CG2 3.72Å; L70-I100 HydrophobicContact CD2-CD1 4.36Å; L70-I100 HydrophobicContact CD2-CG2 3.78Å; L70-I100 HydrophobicContact CG-CG2 4.04Å; I77-I100 HydrophobicContact CG1-CG1 4.34Å; I77-I100 HydrophobicContact CG2-CG1 4.43Å; L98-I100 HydrophobicContact CB-CG1 4.42Å; I100-E115 CarbonylContact O-C 3.58Å; I100-E115 WeakPolarHBondContact O-CA 3.44Å; I100-K116 PolarHBondContact N-O 3.12Å; I100-K116 PolarHBondContact O-N 3.02Å; I100-V118 HydrophobicContact CD1-CG2 3.75Å; I100-V118 HydrophobicContact CG1-CG2 4.34Å
101	C	91.3	Very high	73.1	Confident	1 Å²	1	81.4 Å²	81.4	1%	0.007	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	107.8	176.1	-68.1	0	0	0	0	109.1	L52 G75 L76 F78 I113 L114	L52-C101 HydrophobicContact CD1-CB 4.1Å; L52-C101 HydrophobicContact CD2-CB 3.79Å; G75-C101 CarbonylContact C-O 3.49Å; G75-C101 WeakPolarHBondContact CA-O 3.44Å; L76-C101 PolarHBondContact N-O 3.41Å; L76-C101 PolarHBondContact O-N 3.37Å; F78-C101 HydrophobicContact CE2-CB 4.1Å; C101-I113 HydrophobicContact CB-CG2 3.71Å; C101-L114 WeakPolarHBondContact CA-O 3.28Å
102	K	88	Confident	73.4	Confident	85 Å²	85	76.4 Å²	76.4	37%	0.37	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	145.1	-175.3	-168.6	-177.2	-178.6	-177	0	111.5	L70 D74 I113 L114	L70-K102 HydrophobicContact CD1-CB 4.1Å; L70-K102 HydrophobicContact CD1-CD 4.16Å; L70-K102 HydrophobicContact CD1-CG 3.98Å; D74-K102 WeakPolarHBondContact OD1-CE 3.48Å; D74-K102 WeakPolarHBondContact OD2-CE 3.24Å; D74-K102 IonicContact OD2-NZ 2.97Å; K102-I113 CarbonylContact O-C 3.56Å; K102-I113 WeakPolarHBondContact O-CA 3.42Å; K102-L114 PolarHBondContact N-O 3.43Å; K102-L114 PolarHBondContact O-N 3.5Å
103	L	80.7	Confident	73.8	Confident	45 Å²	45	71.2 Å²	71.2	24%	0.236	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	131.1	171.3	-65	168.8	0	0	0	110.8	L48 L51 D74	L48-L103 HydrophobicContact CD2-CD1 4.06Å; L48-L103 HydrophobicContact CD2-CD2 4.14Å; L48-L103 HydrophobicContact CD2-CG 3.81Å; L51-L103 HydrophobicContact CD1-CD2 3.37Å; D74-L103 WeakPolarHBondContact O-CG 3.38Å; D74-L103 PolarHBondContact O-N 3.36Å
104	S	69.5	Low	73.9	Confident	32 Å²	32	75.3 Å²	75.3	22%	0.224	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-70.3	149.9	169.1	71	0	0	0	0	110.8	N112	S104-N112 WeakPolarHBondContact CB-O 3.41Å; S104-N112 PolarHBondContact N-O 3.33Å; S104-N112 PolarHBondContact OG-N 3.23Å; S104-N112 VanDerWaalsContact OG-N 3.14Å; S104-N112 PolarHBondContact OG-O 2.92Å
105	D	61	Low	73.9	Confident	143 Å²	143	74.8 Å²	74.8	77%	0.765	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-48.5	149.9	-173.9	-138.2	-13.2	0	0	0	114.5	R107	D105-R107 PolarHBondContact O-N 3.45Å
106	S	49.9	Very low	73.8	Confident	107 Å²	107	79.1 Å²	79.1	75%	0.748	41%	0.407	S	S	*	.			trans	-66.1	41	-159.8	57.4	0	0	0	0	117.3
107	R	44.2	Very low	73.7	Confident	222 Å²	222	79.6 Å²	79.6	84%	0.838	41%	0.407	S	S	*	.			trans	-72.3	131.4	172.9	-65.8	-169.9	-163	173.8	6.3	110.4	D105 N109	D105-R107 PolarHBondContact O-N 3.45Å; R107-N109 PolarHBondContact O-N 3.01Å
108	I	48.3	Very low	73.5	Confident	160 Å²	160	79.9 Å²	79.9	82%	0.821	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-7.5	-152	-71.6	165.4	0	0	0	116.2
109	N	48.3	Very low	73	Confident	150 Å²	150	80.1 Å²	80.1	80%	0.802	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.1	-19.3	-170.2	-85	-24.9	0	0	0	119.2	R107	R107-N109 PolarHBondContact O-N 3.01Å
110	I	50.7	Low	72.3	Confident	138 Å²	138	84.1 Å²	84.1	71%	0.708	43%	0.432	S	S	*	.			trans	-153.2	110.6	171.5	-52.4	177.5	0	0	0	108.6	N112	I110-N112 PolarHBondContact O-N 3.08Å
111	A	57	Low	71.2	Confident	36 Å²	36	85.5 Å²	85.5	30%	0.298	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-76.4	119.4	172.1	0	0	0	0	0	109.1
112	N	65.6	Low	70.3	Confident	98 Å²	98	89.2 Å²	89.2	52%	0.524	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-95.3	151.4	172.9	-69	-19.7	0	0	0	109.7	S104 I110	S104-N112 WeakPolarHBondContact CB-O 3.41Å; S104-N112 PolarHBondContact N-O 3.33Å; S104-N112 PolarHBondContact OG-N 3.23Å; S104-N112 VanDerWaalsContact OG-N 3.14Å; S104-N112 PolarHBondContact OG-O 2.92Å; I110-N112 PolarHBondContact O-N 3.08Å
113	I	77.7	Confident	70.1	Confident	46 Å²	46	85.4 Å²	85.4	24%	0.236	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	124.6	170.2	-68.7	160	0	0	0	107.7	L51 L52 C101 K102 E115	L51-I113 HydrophobicContact CB-CD1 3.49Å; L51-I113 VanDerWaalsContact CB-CD1 3.49Å; L51-I113 HydrophobicContact CB-CG1 4.18Å; L51-I113 WeakPolarHBondContact O-CD1 3.33Å; L52-I113 HydrophobicContact CD2-CD1 3.53Å; L52-I113 HydrophobicContact CD2-CG2 4.23Å; L52-I113 HydrophobicContact CG-CD1 3.73Å; C101-I113 HydrophobicContact CB-CG2 3.71Å; K102-I113 CarbonylContact O-C 3.56Å; K102-I113 WeakPolarHBondContact O-CA 3.42Å; I113-E115 HydrophobicContact CG2-CG 4.13Å
114	L	83.6	Confident	70.2	Confident	108 Å²	108	85 Å²	85	57%	0.565	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	118.3	166.5	-65.9	170.3	0	0	0	108	C101 K102	C101-L114 WeakPolarHBondContact CA-O 3.28Å; K102-L114 PolarHBondContact N-O 3.43Å; K102-L114 PolarHBondContact O-N 3.5Å
115	E	86.5	Confident	71.3	Confident	122 Å²	122	83.5 Å²	83.5	57%	0.57	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	128.9	172.9	-57.2	-163.4	157.7	0	0	109.8	K99 I100 I113	K99-E115 WeakPolarHBondContact CE-OE2 3.32Å; K99-E115 VanDerWaalsContact NZ-CD 3.29Å; K99-E115 IonicContact NZ-OE1 3.16Å; K99-E115 PolarHBondContact NZ-OE1 3.15Å; K99-E115 VanDerWaalsContact NZ-OE1 3.1Å; K99-E115 IonicContact NZ-OE2 3.99Å; K99-E115 PolarHBondContact NZ-OE2 3.2Å; I100-E115 CarbonylContact O-C 3.58Å; I100-E115 WeakPolarHBondContact O-CA 3.44Å; I113-E115 HydrophobicContact CG2-CG 4.13Å
116	K	87.9	Confident	72.8	Confident	99 Å²	99	76.7 Å²	76.7	43%	0.43	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	134.7	174.8	-179.1	173.2	-177	169.5	0	109.8	K99 I100 D120	K99-K116 CarbonylContact C-O 3.51Å; K99-K116 WeakPolarHBondContact CA-O 3.44Å; I100-K116 PolarHBondContact N-O 3.12Å; I100-K116 PolarHBondContact O-N 3.02Å; K116-D120 VanDerWaalsContact CE-CG 3.49Å; K116-D120 VanDerWaalsContact CE-OD1 3.26Å; K116-D120 WeakPolarHBondContact CE-OD1 3.42Å; K116-D120 WeakPolarHBondContact CE-OD2 3.33Å; K116-D120 IonicContact NZ-OD2 2.81Å; K116-D120 PolarHBondContact NZ-OD2 3.03Å; K116-D120 VanDerWaalsContact NZ-OD2 3.13Å
117	N	87.8	Confident	75	Confident	44 Å²	44	71.6 Å²	71.6	24%	0.235	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	145.6	168.2	-65.1	-67.8	0	0	0	108.9	R80 L98 P119 D120	R80-N117 PolarHBondContact NH1-OD1 2.86Å; R80-N117 PolarHBondContact NH2-OD1 3.26Å; L98-N117 CarbonylContact O-C 3.36Å; L98-N117 WeakPolarHBondContact O-CA 3.5Å; N117-P119 CarbonylContact C-O 2.99Å; N117-P119 WeakPolarHBondContact CB-O 3.43Å; N117-P119 CarbonylContact O-C 3.56Å; N117-D120 PolarHBondContact O-N 3.25Å
118	V	87.3	Confident	77.4	Confident	6 Å²	6	61 Å²	61	4%	0.036	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	111.4	173.4	-171.3	0	0	0	0	106.9	L26 I27 G97 L98 I100	L26-V118 HydrophobicContact CD2-CG1 3.87Å; L26-V118 HydrophobicContact CG-CG1 3.92Å; I27-V118 HydrophobicContact CG1-CG1 3.85Å; G97-V118 CarbonylContact C-O 3.2Å; G97-V118 WeakPolarHBondContact CA-O 3.49Å; L98-V118 HydrophobicContact CB-CB 4.16Å; L98-V118 HydrophobicContact CB-CG2 4.49Å; L98-V118 PolarHBondContact N-O 3.44Å; L98-V118 PolarHBondContact O-N 2.97Å; I100-V118 HydrophobicContact CD1-CG2 3.75Å; I100-V118 HydrophobicContact CG1-CG2 4.34Å
119	P	83	Confident	79.5	Confident	5 Å²	5	53.5 Å²	53.5	3%	0.032	29%	0.293	C	S	.	.	S	Bend	cis	-67.3	159.6	-1.3	32	-37.3	0	0	0	113.2	E23 N117 V124	E23-P119 HydrophobicContact CB-CB 4.31Å; E23-P119 HydrophobicContact CG-CB 3.98Å; E23-P119 VanDerWaalsContact OE1-CB 3.3Å; E23-P119 WeakPolarHBondContact OE1-CB 3.22Å; E23-P119 WeakPolarHBondContact OE2-CB 3.47Å; E23-P119 WeakPolarHBondContact OE2-CG 3.44Å; N117-P119 CarbonylContact C-O 2.99Å; N117-P119 WeakPolarHBondContact CB-O 3.43Å; N117-P119 CarbonylContact O-C 3.56Å; P119-V124 HydrophobicContact CG-CG2 4.37Å
120	D	77.5	Confident	81.5	Confident	102 Å²	102	47.7 Å²	47.7	55%	0.545	26%	0.261	S	S	.	.	S	Bend	trans	-67.4	144	175.4	-80.6	-46.1	0	0	0	109.7	K116 N117 N122	K116-D120 VanDerWaalsContact CE-CG 3.49Å; K116-D120 VanDerWaalsContact CE-OD1 3.26Å; K116-D120 WeakPolarHBondContact CE-OD1 3.42Å; K116-D120 WeakPolarHBondContact CE-OD2 3.33Å; K116-D120 IonicContact NZ-OD2 2.81Å; K116-D120 PolarHBondContact NZ-OD2 3.03Å; K116-D120 VanDerWaalsContact NZ-OD2 3.13Å; N117-D120 PolarHBondContact O-N 3.25Å; D120-N122 VanDerWaalsContact C-N 3.27Å; D120-N122 PolarHBondContact O-N 3.04Å; D120-N122 VanDerWaalsContact O-N 3.09Å
121	G	70	Confident	83.4	Confident	47 Å²	47	43.4 Å²	43.4	49%	0.485	24%	0.239	S	C	.	.	S	Bend	trans	78	-20.6	175.5	0	0	0	0	0	117.5	L168	G121-L168 VanDerWaalsContact O-CD2 3.25Å; G121-L168 WeakPolarHBondContact O-CD2 3.49Å
122	N	72.8	Confident	85	Confident	78 Å²	78	41.9 Å²	41.9	42%	0.417	23%	0.226	S	C	.	.			trans	-126.3	134.1	-177.1	-83.3	-34.3	0	0	0	114.4	D120 V124	D120-N122 VanDerWaalsContact C-N 3.27Å; D120-N122 PolarHBondContact O-N 3.04Å; D120-N122 VanDerWaalsContact O-N 3.09Å; N122-V124 HydrophobicContact CB-CG1 4.33Å
123	V	82.4	Confident	85.7	Confident	5 Å²	5	43 Å²	43	3%	0.03	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-96.7	103.2	171	-175.7	0	0	0	0	108.8	G125 P163 L168 H170 L173	V123-G125 VanDerWaalsContact CG1-O 3.3Å; V123-G125 WeakPolarHBondContact CG1-O 3.32Å; V123-P163 HydrophobicContact CB-CG 4.37Å; V123-P163 HydrophobicContact CG2-CB 4.07Å; V123-P163 HydrophobicContact CG2-CG 4.1Å; V123-L168 WeakPolarHBondContact CB-O 3.39Å; V123-L168 HydrophobicContact CG2-CB 4.25Å; V123-L168 PolarHBondContact N-O 3.22Å; V123-H170 WeakPolarHBondContact O-CB 3.4Å; V123-H170 PolarHBondContact O-N 2.93Å; V123-L173 HydrophobicContact CG1-CD1 4.34Å; V123-L173 WeakPolarHBondContact O-CD1 3.48Å
124	V	83.8	Confident	85.6	Confident	38 Å²	38	43.8 Å²	43.8	23%	0.23	24%	0.236	C	C	.	.			trans	-102.2	4.9	-174	-70.6	0	0	0	0	114.4	S82 S96 P119 N122 H170	S82-V124 WeakPolarHBondContact CB-O 3.42Å; S96-V124 WeakPolarHBondContact O-CG2 3.11Å; P119-V124 HydrophobicContact CG-CG2 4.37Å; N122-V124 HydrophobicContact CB-CG1 4.33Å; V124-H170 HydrophobicContact CG1-CB 4.4Å
125	G	91.2	Very high	85.4	Confident	0 Å²	0	43 Å²	43	0%	0	24%	0.24	C	C	.	.	S	Bend	trans	-161.2	177.2	173	0	0	0	0	0	111.9	R80 Y81 V123	R80-G125 WeakPolarHBondContact CD-O 3.32Å; Y81-G125 WeakPolarHBondContact O-CA 3.31Å; V123-G125 VanDerWaalsContact CG1-O 3.3Å; V123-G125 WeakPolarHBondContact CG1-O 3.32Å
126	F	94	Very high	85	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-109.3	138.2	172.8	-60.2	-65.1	0	0	0	111.1	Y81 G128 Y129 L160 V161 I162 M169 L173 T176 L177	Y81-F126 PolarHBondContact N-O 3.38Å; Y81-F126 PolarHBondContact O-N 3.43Å; F126-G128 PolarHBondContact O-N 2.99Å; F126-Y129 HydrophobicContact CD2-CD2 4.48Å; F126-Y129 PolarHBondContact O-N 2.93Å; F126-L160 HydrophobicContact CB-CB 4.28Å; F126-L160 HydrophobicContact CB-CD2 4.43Å; F126-L160 HydrophobicContact CD2-CD1 4.35Å; F126-V161 WeakPolarHBondContact CD1-O 3.45Å; F126-I162 HydrophobicContact CD1-CG2 4.27Å; F126-I162 HydrophobicContact CE1-CG2 3.83Å; F126-M169 HydrophobicContact CE1-CE 3.71Å; F126-M169 HydrophobicContact CE1-SD 4.08Å; F126-M169 HydrophobicContact CZ-CE 4.22Å; F126-M169 HydrophobicContact CZ-SD 4.05Å; F126-L173 HydrophobicContact CD2-CD2 4.22Å; F126-L173 HydrophobicContact CE1-CB 4.27Å; F126-L173 HydrophobicContact CE1-CD1 4.33Å; F126-L173 HydrophobicContact CE2-CB 3.81Å; F126-L173 HydrophobicContact CE2-CD2 4Å; F126-L173 HydrophobicContact CE2-CG 4.35Å; F126-L173 HydrophobicContact CZ-CB 3.55Å; F126-L173 HydrophobicContact CZ-CD1 4.34Å; F126-L173 HydrophobicContact CZ-CD2 4.47Å; F126-L173 HydrophobicContact CZ-CG 4.34Å; F126-T176 HydrophobicContact CE2-CG2 4.3Å; F126-L177 HydrophobicContact CE1-CD1 4.36Å; F126-L177 HydrophobicContact CE1-CD2 4.4Å; F126-L177 HydrophobicContact CE1-CG 4.47Å; F126-L177 HydrophobicContact CE2-CD2 3.88Å; F126-L177 HydrophobicContact CE2-CG 3.95Å; F126-L177 HydrophobicContact CZ-CD1 3.8Å; F126-L177 HydrophobicContact CZ-CD2 3.73Å; F126-L177 HydrophobicContact CZ-CG 3.56Å
127	F	95.5	Very high	84.8	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-67.5	128.5	166.6	178.9	-102.6	0	0	0	108.7	F65 V67 F78 P79 R80 E145 A148 M149 L160 V161	F65-F127 HydrophobicContact CB-CE1 4.23Å; F65-F127 HydrophobicContact CB-CE2 4.01Å; F65-F127 HydrophobicContact CB-CZ 3.54Å; F65-F127 AromaticContact CD1-CD1 3.76Å; F65-F127 HydrophobicContact CD1-CD1 3.76Å; F65-F127 AromaticContact CD1-CE1 3.23Å; F65-F127 HydrophobicContact CD1-CE1 3.23Å; F65-F127 HydrophobicContact CD1-CE2 4.14Å; F65-F127 HydrophobicContact CD1-CG 4.44Å; F65-F127 AromaticContact CD1-CZ 3.45Å; F65-F127 HydrophobicContact CD1-CZ 3.45Å; F65-F127 VanDerWaalsContact CD1-CZ 3.45Å; F65-F127 HydrophobicContact CE1-CD1 4.09Å; F65-F127 AromaticContact CE1-CE1 3.78Å; F65-F127 HydrophobicContact CE1-CE1 3.78Å; F65-F127 HydrophobicContact CE1-CZ 4.42Å; F65-F127 AromaticContact CG-CE1 3.96Å; F65-F127 HydrophobicContact CG-CE1 3.96Å; F65-F127 AromaticContact CG-CZ 3.79Å; F65-F127 HydrophobicContact CG-CZ 3.79Å; V67-F127 HydrophobicContact CG2-CE2 4.02Å; V67-F127 HydrophobicContact CG2-CZ 3.87Å; F78-F127 HydrophobicContact CB-CD2 3.83Å; F78-F127 HydrophobicContact CB-CE2 3.82Å; F78-F127 AromaticContact CD1-CE2 3.8Å; F78-F127 HydrophobicContact CD1-CE2 3.8Å; F78-F127 AromaticContact CD1-CZ 3.88Å; F78-F127 HydrophobicContact CD1-CZ 3.88Å; F78-F127 HydrophobicContact CG-CE2 4.32Å; P79-F127 VanDerWaalsContact O-CD2 3.24Å; P79-F127 WeakPolarHBondContact O-CD2 3.44Å; R80-F127 HydrophobicContact CG-CB 4.42Å; F127-E145 HydrophobicContact CB-CG 4.46Å; F127-E145 HydrophobicContact CD1-CB 4.02Å; F127-E145 HydrophobicContact CD1-CG 3.77Å; F127-E145 HydrophobicContact CD2-CG 4.23Å; F127-E145 HydrophobicContact CE1-CB 3.73Å; F127-E145 HydrophobicContact CE1-CG 3.93Å; F127-E145 HydrophobicContact CE2-CG 4.43Å; F127-E145 HydrophobicContact CG-CG 3.91Å; F127-E145 HydrophobicContact CZ-CB 4.14Å; F127-E145 HydrophobicContact CZ-CG 4.26Å; F127-A148 HydrophobicContact CD1-CB 4.36Å; F127-A148 HydrophobicContact CE1-CB 4.49Å; F127-M149 HydrophobicContact CE1-CE 4.36Å; F127-M149 HydrophobicContact CE1-CG 4Å; F127-M149 HydrophobicContact CE1-SD 4.47Å; F127-M149 HydrophobicContact CZ-CE 4.16Å; F127-M149 HydrophobicContact CZ-CG 4.21Å; F127-M149 HydrophobicContact CZ-SD 4.13Å; F127-L160 WeakPolarHBondContact O-CA 3.22Å; F127-V161 HydrophobicContact CB-CB 4.05Å; F127-V161 HydrophobicContact CB-CG2 3.99Å; F127-V161 HydrophobicContact CD1-CG2 3.7Å; F127-V161 HydrophobicContact CG-CG2 4.29Å; F127-V161 PolarHBondContact O-N 3.11Å
128	G	93.9	Very high	84.8	Confident	0 Å²	0	40 Å²	40	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.1	-5.9	-178.2	0	0	0	0	0	116.3	F126 H130 L131	F126-G128 PolarHBondContact O-N 2.99Å; G128-H130 VanDerWaalsContact C-N 3.3Å; G128-H130 PolarHBondContact O-N 3.03Å; G128-L131 WeakPolarHBondContact O-CB 3.44Å; G128-L131 PolarHBondContact O-N 2.87Å; G128-L131 VanDerWaalsContact O-N 3.12Å
129	Y	93.3	Very high	85	Confident	2 Å²	2	40 Å²	40	1%	0.008	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-66.1	-31.1	-176.3	-171.9	-116.1	0	0	0	114	D83 R84 F126 L131 T132 L160 T176 E179 F180	D83-Y129 WeakPolarHBondContact O-CD1 3.49Å; R84-Y129 HydrophobicContact CG-CD1 4.34Å; R84-Y129 HydrophobicContact CG-CE1 3.71Å; R84-Y129 PolarHBondContact NE-OH 2.95Å; R84-Y129 PolarHBondContact NH2-OH 3.33Å; F126-Y129 HydrophobicContact CD2-CD2 4.48Å; F126-Y129 PolarHBondContact O-N 2.93Å; Y129-L131 PolarHBondContact O-N 3.14Å; Y129-L131 VanDerWaalsContact O-N 3.16Å; Y129-T132 HydrophobicContact CD2-CG2 4.39Å; Y129-T132 WeakPolarHBondContact O-CB 3.32Å; Y129-T132 PolarHBondContact O-N 3.29Å; Y129-T132 PolarHBondContact O-OG1 2.87Å; Y129-L160 VanDerWaalsContact CA-CD2 3.45Å; Y129-L160 HydrophobicContact CD2-CD1 4.09Å; Y129-L160 HydrophobicContact CD2-CD2 4.2Å; Y129-T176 HydrophobicContact CD2-CG2 4.33Å; Y129-T176 HydrophobicContact CE1-CG2 4.11Å; Y129-T176 HydrophobicContact CE2-CG2 3.42Å; Y129-T176 VanDerWaalsContact CE2-CG2 3.42Å; Y129-T176 WeakPolarHBondContact OH-CG2 3.31Å; Y129-E179 PolarHBondContact OH-OE2 2.83Å; Y129-F180 HydrophobicContact CD2-CZ 4.39Å; Y129-F180 HydrophobicContact CE2-CE2 4.1Å; Y129-F180 AromaticContact CE2-CZ 3.85Å; Y129-F180 HydrophobicContact CE2-CZ 3.85Å
130	H	90.9	Very high	85.6	Confident	27 Å²	27	39.8 Å²	39.8	13%	0.125	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-63.1	-18	175.3	68.2	-64.1	0	0	0	113.8	K64 Y81 L93 G128 T132	K64-H130 PolarHBondContact O-NE2 3.34Å; Y81-H130 HydrophobicContact CD1-CB 4.37Å; Y81-H130 HydrophobicContact CD2-CB 3.67Å; Y81-H130 AromaticContact CD2-CG 3.6Å; Y81-H130 AromaticContact CD2-ND1 3.28Å; Y81-H130 VanDerWaalsContact CD2-ND1 3.28Å; Y81-H130 WeakPolarHBondContact CD2-ND1 3.32Å; Y81-H130 HydrophobicContact CE2-CB 3.97Å; Y81-H130 AromaticContact CE2-CE1 3.71Å; Y81-H130 AromaticContact CE2-CG 3.52Å; Y81-H130 AromaticContact CE2-ND1 3.29Å; Y81-H130 VanDerWaalsContact CE2-ND1 3.29Å; Y81-H130 WeakPolarHBondContact CE2-ND1 3.39Å; Y81-H130 HydrophobicContact CG-CB 3.88Å; L93-H130 HydrophobicContact CD2-CB 3.44Å; L93-H130 VanDerWaalsContact CD2-CB 3.44Å; G128-H130 VanDerWaalsContact C-N 3.3Å; G128-H130 PolarHBondContact O-N 3.03Å; H130-T132 VanDerWaalsContact C-N 3.31Å
131	L	90.6	Very high	86.4	Confident	49 Å²	49	35 Å²	35	26%	0.257	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-83.4	-7.3	174.5	-60.9	176.8	0	0	0	112.9	K64 F65 G128 Y129 F152	K64-L131 HydrophobicContact CB-CD2 4.5Å; K64-L131 WeakPolarHBondContact O-CD2 3.33Å; F65-L131 HydrophobicContact CD1-CD1 4.09Å; F65-L131 HydrophobicContact CD2-CD1 3.77Å; F65-L131 HydrophobicContact CE1-CD1 3.97Å; F65-L131 HydrophobicContact CE2-CD1 3.65Å; F65-L131 HydrophobicContact CG-CD1 4.02Å; F65-L131 HydrophobicContact CZ-CD1 3.76Å; G128-L131 WeakPolarHBondContact O-CB 3.44Å; G128-L131 PolarHBondContact O-N 2.87Å; G128-L131 VanDerWaalsContact O-N 3.12Å; Y129-L131 PolarHBondContact O-N 3.14Å; Y129-L131 VanDerWaalsContact O-N 3.16Å; L131-F152 HydrophobicContact CD1-CD2 4.29Å; L131-F152 HydrophobicContact CD1-CE2 4.02Å; L131-F152 HydrophobicContact CD1-CZ 4.22Å
132	T	89.1	Confident	87.6	Confident	4 Å²	4	32.7 Å²	32.7	3%	0.025	18%	0.179	C	C	.	.			trans	-86.9	141.8	175.5	71.2	0	0	0	0	110.8	Y129 H130 V139 A158 L160 F180	Y129-T132 HydrophobicContact CD2-CG2 4.39Å; Y129-T132 WeakPolarHBondContact O-CB 3.32Å; Y129-T132 PolarHBondContact O-N 3.29Å; Y129-T132 PolarHBondContact O-OG1 2.87Å; H130-T132 VanDerWaalsContact C-N 3.31Å; T132-V139 HydrophobicContact CG2-CG2 4.35Å; T132-A158 HydrophobicContact CG2-CB 3.78Å; T132-L160 HydrophobicContact CG2-CD2 4.23Å; T132-F180 HydrophobicContact CG2-CE1 4.32Å; T132-F180 HydrophobicContact CG2-CZ 4.11Å
133	K	81.9	Confident	88.5	Confident	120 Å²	120	29.7 Å²	29.7	52%	0.522	16%	0.163	S	C	.	.			trans	-110.2	161.8	172.3	-66.1	-172.1	178.3	-175.3	0	110	R84 E86 S135 V136	R84-K133 VanDerWaalsContact NH1-C 3.29Å; R84-K133 PolarHBondContact NH1-O 3.31Å; E86-K133 VanDerWaalsContact OE1-CB 3.25Å; E86-K133 WeakPolarHBondContact OE1-CB 3.25Å; E86-K133 WeakPolarHBondContact OE1-CD 3.43Å; E86-K133 VanDerWaalsContact OE1-CG 3.27Å; E86-K133 WeakPolarHBondContact OE1-CG 3.44Å; K133-S135 PolarHBondContact O-N 2.82Å; K133-S135 VanDerWaalsContact O-N 3.1Å; K133-V136 HydrophobicContact CB-CG2 4.17Å; K133-V136 WeakPolarHBondContact O-CB 3.28Å; K133-V136 PolarHBondContact O-N 3.37Å
134	S	75.6	Confident	89	Confident	63 Å²	63	30.6 Å²	30.6	44%	0.441	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-24.8	176.9	-54.6	0	0	0	0	112.9	E86	E86-S134 VanDerWaalsContact OE2-CB 3.25Å; E86-S134 WeakPolarHBondContact OE2-CB 3.44Å; E86-S134 PolarHBondContact OE2-N 3.12Å; E86-S134 PolarHBondContact OE2-OG 2.76Å
135	S	78	Confident	89.6	Confident	92 Å²	92	29.2 Å²	29.2	64%	0.643	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-14.5	175	64.2	0	0	0	0	114.8	K133 M137	K133-S135 PolarHBondContact O-N 2.82Å; K133-S135 VanDerWaalsContact O-N 3.1Å; S135-M137 PolarHBondContact O-N 2.78Å
136	V	78.7	Confident	89.8	Confident	42 Å²	42	29.5 Å²	29.5	26%	0.255	16%	0.161	S	C	.	.			trans	-79.7	107.3	-179.7	177	0	0	0	0	108.4	K133 E138 F180	K133-V136 HydrophobicContact CB-CG2 4.17Å; K133-V136 WeakPolarHBondContact O-CB 3.28Å; K133-V136 PolarHBondContact O-N 3.37Å; V136-E138 WeakPolarHBondContact CG1-O 3.34Å; V136-F180 WeakPolarHBondContact O-CD1 3.37Å
137	M	82.8	Confident	89.9	Confident	94 Å²	94	29.5 Å²	29.5	46%	0.463	16%	0.161	S	C	.	.			trans	-94.2	-17.7	-179.8	-60.4	-56.9	-61.2	0	0	112.9	S135 F180 S181 R182	S135-M137 PolarHBondContact O-N 2.78Å; M137-F180 CarbonylContact O-C 3.58Å; M137-S181 WeakPolarHBondContact CB-OG 3.35Å; M137-S181 PolarHBondContact O-N 2.78Å; M137-S181 PolarHBondContact O-OG 3.49Å; M137-R182 PolarHBondContact O-N 3.47Å; M137-R182 VanDerWaalsContact O-N 3.14Å
138	E	88.5	Confident	90	Very high	67 Å²	67	29.5 Å²	29.5	31%	0.313	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	133.6	-178.7	-46.4	-168	156.2	0	0	111.1	V136 K157 R182	V136-E138 WeakPolarHBondContact CG1-O 3.34Å; E138-K157 IonicContact OE2-NZ 3.66Å; E138-K157 PolarHBondContact OE2-NZ 3.3Å; E138-R182 VanDerWaalsContact CA-O 3.32Å; E138-R182 WeakPolarHBondContact CA-O 3.46Å; E138-R182 HydrophobicContact CB-CB 4.15Å; E138-R182 HydrophobicContact CG-CB 3.84Å; E138-R182 IonicContact OE1-CZ 3.94Å; E138-R182 IonicContact OE1-NE 3.91Å; E138-R182 PolarHBondContact OE1-NE 3.03Å; E138-R182 IonicContact OE1-NH2 3.45Å
139	V	92.3	Very high	90.1	Very high	5 Å²	5	29.5 Å²	29.5	3%	0.03	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	143.5	177.6	71.7	0	0	0	0	111.4	T132 L141 A158 L160 F180 R182 L183 T184	T132-V139 HydrophobicContact CG2-CG2 4.35Å; V139-L141 HydrophobicContact CG1-CD2 4.46Å; V139-A158 HydrophobicContact CG2-CB 3.97Å; V139-A158 VanDerWaalsContact CG2-O 3.25Å; V139-A158 WeakPolarHBondContact CG2-O 3.43Å; V139-L160 HydrophobicContact CG1-CD1 4.23Å; V139-L160 HydrophobicContact CG2-CD1 3.98Å; V139-L160 HydrophobicContact CG2-CD2 4.29Å; V139-L160 HydrophobicContact CG2-CG 3.66Å; V139-F180 HydrophobicContact CB-CD1 4.13Å; V139-F180 HydrophobicContact CB-CE1 4.21Å; V139-F180 HydrophobicContact CB-CG 4.35Å; V139-F180 HydrophobicContact CG1-CB 4.12Å; V139-F180 HydrophobicContact CG1-CD1 3.84Å; V139-F180 HydrophobicContact CG1-CD2 3.6Å; V139-F180 HydrophobicContact CG1-CE1 4.13Å; V139-F180 HydrophobicContact CG1-CE2 3.9Å; V139-F180 HydrophobicContact CG1-CG 3.56Å; V139-F180 HydrophobicContact CG1-CZ 4.15Å; V139-R182 PolarHBondContact N-O 3.36Å; V139-R182 VanDerWaalsContact N-O 3.07Å; V139-L183 HydrophobicContact CG1-CD2 3.28Å; V139-L183 WeakPolarHBondContact O-CA 3.43Å; V139-T184 PolarHBondContact O-N 3.08Å; V139-T184 VanDerWaalsContact O-N 3.07Å
140	A	94.5	Very high	90.3	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.008	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	144.8	173	0	0	0	0	0	110.6	I151 A158 A159 L160 T184 I239	A140-I151 HydrophobicContact CB-CD1 4.29Å; A140-I151 HydrophobicContact CB-CG2 3.79Å; A140-A158 PolarHBondContact N-O 3.42Å; A140-A159 HydrophobicContact CB-CB 4.15Å; A140-A159 CarbonylContact O-C 3.23Å; A140-A159 VanDerWaalsContact O-CA 3.27Å; A140-A159 WeakPolarHBondContact O-CA 3.21Å; A140-L160 PolarHBondContact O-N 3.38Å; A140-T184 CarbonylContact C-O 3.58Å; A140-T184 VanDerWaalsContact CA-O 3.25Å; A140-T184 WeakPolarHBondContact CA-O 3.43Å; A140-I239 HydrophobicContact CB-CD1 3.96Å
141	L	94.6	Very high	90.5	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	143.5	172	-53.7	-179	0	0	0	109.5	V139 L160 I162 L177 L183 T184 F185 W186	V139-L141 HydrophobicContact CG1-CD2 4.46Å; L141-L160 CarbonylContact C-O 3.59Å; L141-L160 WeakPolarHBondContact CA-O 3.37Å; L141-L160 HydrophobicContact CD2-CB 3.95Å; L141-L160 HydrophobicContact CD2-CD1 4.3Å; L141-L160 HydrophobicContact CD2-CG 4.44Å; L141-I162 HydrophobicContact CD1-CD1 4.5Å; L141-I162 HydrophobicContact CD2-CG2 4.27Å; L141-L177 HydrophobicContact CD2-CD2 3.79Å; L141-L183 HydrophobicContact CD1-CB 4.36Å; L141-L183 HydrophobicContact CD1-CD1 4.22Å; L141-L183 HydrophobicContact CD1-CD2 4.48Å; L141-L183 HydrophobicContact CD2-CD2 4.43Å; L141-L183 HydrophobicContact CG-CD2 4.48Å; L141-T184 PolarHBondContact N-O 2.93Å; L141-F185 HydrophobicContact CB-CB 4.1Å; L141-F185 HydrophobicContact CB-CD2 3.71Å; L141-F185 HydrophobicContact CB-CE2 4.38Å; L141-F185 HydrophobicContact CB-CG 4Å; L141-F185 WeakPolarHBondContact O-CD2 3.4Å; L141-W186 PolarHBondContact O-N 3.32Å
142	S	94.9	Very high	90.8	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	169.9	174.9	69.1	0	0	0	0	110	N144 A148 L160 V161 I162	S142-N144 PolarHBondContact OG-O 3.48Å; S142-A148 WeakPolarHBondContact OG-CB 3.36Å; S142-A148 PolarHBondContact OG-N 3.04Å; S142-L160 PolarHBondContact N-O 3.21Å; S142-L160 PolarHBondContact OG-O 3.24Å; S142-V161 WeakPolarHBondContact O-CA 3.4Å; S142-I162 PolarHBondContact O-N 2.89Å
143	M	92.9	Very high	91.1	Very high	14 Å²	14	28.7 Å²	28.7	7%	0.069	16%	0.155	C	C	.	.	S	Bend	trans	-103.6	3.2	-178.9	-56.3	-171.1	84.2	0	0	113.9	D164 F185 P187 K191 A195 I198	M143-D164 VanDerWaalsContact CE-CA 3.46Å; M143-D164 HydrophobicContact CE-CB 3.33Å; M143-F185 HydrophobicContact CG-CE2 3.68Å; M143-F185 HydrophobicContact CG-CZ 3.77Å; M143-F185 HydrophobicContact SD-CZ 4.2Å; M143-P187 HydrophobicContact CG-CB 4.2Å; M143-P187 HydrophobicContact SD-CB 3.77Å; M143-K191 HydrophobicContact CE-CB 4.35Å; M143-K191 HydrophobicContact CE-CD 4.06Å; M143-K191 HydrophobicContact SD-CB 3.54Å; M143-K191 VanDerWaalsContact SD-CB 3.54Å; M143-K191 HydrophobicContact SD-CD 3.82Å; M143-K191 HydrophobicContact SD-CG 4.31Å; M143-A195 HydrophobicContact SD-CB 4.41Å; M143-I198 HydrophobicContact CE-CD1 4.06Å
144	N	93.1	Very high	91.6	Very high	24 Å²	24	23.7 Å²	23.7	13%	0.128	14%	0.137	C	C	.	.	S	Bend	trans	-161.7	162.9	178.4	63.4	76.1	0	0	0	111.4	S142 A146 D147 A148 V161 R219	S142-N144 PolarHBondContact OG-O 3.48Å; N144-A146 PolarHBondContact O-N 2.86Å; N144-A146 PolarHBondContact OD1-N 3.47Å; N144-D147 PolarHBondContact ND2-OD2 2.76Å; N144-D147 PolarHBondContact O-N 3.17Å; N144-D147 PolarHBondContact OD1-N 3.42Å; N144-D147 PolarHBondContact OD1-OD2 2.92Å; N144-A148 PolarHBondContact O-N 3.2Å; N144-V161 VanDerWaalsContact C-CG2 3.5Å; N144-V161 WeakPolarHBondContact O-CG2 3.39Å; N144-R219 PolarHBondContact ND2-NH2 2.95Å; N144-R219 PolarHBondContact OD1-NH2 3.3Å
145	E	95.2	Very high	92.4	Very high	10 Å²	10	22 Å²	22	5%	0.047	13%	0.125	C	C	.	.	H	α-helix	trans	-68.3	-33.3	-171.2	-62.8	77.5	-167.2	0	0	113.4	F78 K99 F127 M149 V161	F78-E145 HydrophobicContact CB-CG 3.88Å; F78-E145 HydrophobicContact CD1-CB 3.66Å; F78-E145 HydrophobicContact CD1-CG 3.65Å; F78-E145 HydrophobicContact CD2-CG 4.41Å; F78-E145 HydrophobicContact CE1-CB 3.83Å; F78-E145 HydrophobicContact CE1-CG 4.27Å; F78-E145 HydrophobicContact CG-CB 4.22Å; F78-E145 HydrophobicContact CG-CG 3.73Å; K99-E145 WeakPolarHBondContact CD-OE1 3.14Å; K99-E145 IonicContact NZ-OE1 3.11Å; K99-E145 IonicContact NZ-OE2 3.05Å; K99-E145 PolarHBondContact NZ-OE2 3.08Å; F127-E145 HydrophobicContact CB-CG 4.46Å; F127-E145 HydrophobicContact CD1-CB 4.02Å; F127-E145 HydrophobicContact CD1-CG 3.77Å; F127-E145 HydrophobicContact CD2-CG 4.23Å; F127-E145 HydrophobicContact CE1-CB 3.73Å; F127-E145 HydrophobicContact CE1-CG 3.93Å; F127-E145 HydrophobicContact CE2-CG 4.43Å; F127-E145 HydrophobicContact CG-CG 3.91Å; F127-E145 HydrophobicContact CZ-CB 4.14Å; F127-E145 HydrophobicContact CZ-CG 4.26Å; E145-M149 HydrophobicContact CB-CE 4.22Å; E145-M149 WeakPolarHBondContact O-CB 3.39Å; E145-M149 VanDerWaalsContact O-CE 3.29Å; E145-M149 WeakPolarHBondContact O-CE 3.33Å; E145-M149 WeakPolarHBondContact O-CG 3.47Å; E145-M149 PolarHBondContact O-N 3.31Å; E145-V161 HydrophobicContact CG-CG2 4.32Å
146	A	95.5	Very high	93	Very high	5 Å²	5	20.2 Å²	20.2	4%	0.041	12%	0.121	C	C	.	.	H	α-helix	trans	-65.7	-43.2	178.9	0	0	0	0	0	112.1	L54 N144 A150 A221	L54-A146 HydrophobicContact CD2-CB 3.66Å; N144-A146 PolarHBondContact O-N 2.86Å; N144-A146 PolarHBondContact OD1-N 3.47Å; A146-A150 WeakPolarHBondContact O-CB 3.46Å; A146-A150 PolarHBondContact O-N 3.46Å; A146-A221 HydrophobicContact CB-CB 4.04Å
147	D	96.3	Very high	93.6	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-69.4	-41.9	178.4	-68.6	-24.9	0	0	0	111.6	N144 M149 A150 I151 R219 A220 A221	N144-D147 PolarHBondContact ND2-OD2 2.76Å; N144-D147 PolarHBondContact O-N 3.17Å; N144-D147 PolarHBondContact OD1-N 3.42Å; N144-D147 PolarHBondContact OD1-OD2 2.92Å; D147-M149 VanDerWaalsContact C-N 3.34Å; D147-M149 PolarHBondContact O-N 2.75Å; D147-A150 PolarHBondContact O-N 3.37Å; D147-I151 VanDerWaalsContact O-CG1 3.31Å; D147-I151 WeakPolarHBondContact O-CG1 3.26Å; D147-I151 PolarHBondContact O-N 2.71Å; D147-R219 IonicContact OD1-CZ 3.39Å; D147-R219 IonicContact OD1-NE 2.77Å; D147-R219 PolarHBondContact OD1-NE 2.91Å; D147-R219 IonicContact OD1-NH2 3.29Å; D147-R219 PolarHBondContact OD1-NH2 2.76Å; D147-R219 IonicContact OD2-CZ 2.75Å; D147-R219 VanDerWaalsContact OD2-CZ 3.29Å; D147-R219 IonicContact OD2-NE 3.54Å; D147-R219 PolarHBondContact OD2-NE 3.3Å; D147-R219 IonicContact OD2-NH2 2.85Å; D147-R219 PolarHBondContact OD2-NH2 3.47Å; D147-A220 HydrophobicContact CB-CB 4.05Å; D147-A220 PolarHBondContact OD1-N 3.37Å; D147-A221 VanDerWaalsContact OD1-CB 3.24Å; D147-A221 WeakPolarHBondContact OD1-CB 3.49Å; D147-A221 PolarHBondContact OD1-N 3.01Å
148	A	96.8	Very high	94	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-56.9	-48.1	174.3	0	0	0	0	0	111.7	F65 F127 S142 N144 A150 I151 F152 A159 V161	F65-A148 HydrophobicContact CE1-CB 4.45Å; F127-A148 HydrophobicContact CD1-CB 4.36Å; F127-A148 HydrophobicContact CE1-CB 4.49Å; S142-A148 WeakPolarHBondContact OG-CB 3.36Å; S142-A148 PolarHBondContact OG-N 3.04Å; N144-A148 PolarHBondContact O-N 3.2Å; A148-A150 VanDerWaalsContact C-N 3.35Å; A148-A150 PolarHBondContact O-N 3.11Å; A148-I151 PolarHBondContact O-N 2.82Å; A148-F152 PolarHBondContact O-N 2.87Å; A148-A159 HydrophobicContact CB-CB 4.02Å; A148-A159 WeakPolarHBondContact O-CB 3.37Å; A148-V161 HydrophobicContact CB-CG2 3.66Å
149	M	97.3	Very high	94.3	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-66	-36.5	177.9	-75.4	-172.6	-78.2	0	0	112.4	L54 I57 T61 M62 F65 V67 F78 F127 E145 D147 F152 Q153	L54-M149 HydrophobicContact CD1-CE 4.31Å; L54-M149 HydrophobicContact CD2-CE 3.35Å; L54-M149 HydrophobicContact CG-CE 4.47Å; I57-M149 HydrophobicContact CD1-CB 3.97Å; I57-M149 HydrophobicContact CG1-CB 4.21Å; I57-M149 HydrophobicContact CG2-CB 3.92Å; I57-M149 HydrophobicContact CG2-CG 4.49Å; I57-M149 HydrophobicContact CG2-SD 3.94Å; T61-M149 HydrophobicContact CG2-CB 3.84Å; T61-M149 HydrophobicContact CG2-CG 4.04Å; T61-M149 HydrophobicContact CG2-SD 4.47Å; M62-M149 HydrophobicContact CG-SD 4.13Å; F65-M149 HydrophobicContact CB-CG 4.35Å; F65-M149 HydrophobicContact CB-SD 4.29Å; F65-M149 HydrophobicContact CD1-CG 4.18Å; F65-M149 HydrophobicContact CD2-CG 3.7Å; F65-M149 HydrophobicContact CD2-SD 4.48Å; F65-M149 HydrophobicContact CE1-CG 4.38Å; F65-M149 HydrophobicContact CE2-CG 3.91Å; F65-M149 HydrophobicContact CG-CG 3.82Å; F65-M149 HydrophobicContact CG-SD 4.39Å; F65-M149 HydrophobicContact CZ-CG 4.25Å; V67-M149 HydrophobicContact CG2-CE 4.36Å; V67-M149 HydrophobicContact CG2-SD 4Å; F78-M149 HydrophobicContact CE1-CE 3.96Å; F127-M149 HydrophobicContact CE1-CE 4.36Å; F127-M149 HydrophobicContact CE1-CG 4Å; F127-M149 HydrophobicContact CE1-SD 4.47Å; F127-M149 HydrophobicContact CZ-CE 4.16Å; F127-M149 HydrophobicContact CZ-CG 4.21Å; F127-M149 HydrophobicContact CZ-SD 4.13Å; E145-M149 HydrophobicContact CB-CE 4.22Å; E145-M149 WeakPolarHBondContact O-CB 3.39Å; E145-M149 VanDerWaalsContact O-CE 3.29Å; E145-M149 WeakPolarHBondContact O-CE 3.33Å; E145-M149 WeakPolarHBondContact O-CG 3.47Å; E145-M149 PolarHBondContact O-N 3.31Å; D147-M149 VanDerWaalsContact C-N 3.34Å; D147-M149 PolarHBondContact O-N 2.75Å; M149-F152 PolarHBondContact O-N 3.29Å; M149-Q153 WeakPolarHBondContact O-CB 3.17Å; M149-Q153 PolarHBondContact O-N 2.7Å
150	A	96.5	Very high	94.5	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-64.5	-44.8	175.7	0	0	0	0	0	111.8	I57 A146 D147 A148 F152 Q153 A154 A220 I224	I57-A150 HydrophobicContact CD1-CB 3.92Å; A146-A150 WeakPolarHBondContact O-CB 3.46Å; A146-A150 PolarHBondContact O-N 3.46Å; D147-A150 PolarHBondContact O-N 3.37Å; A148-A150 VanDerWaalsContact C-N 3.35Å; A148-A150 PolarHBondContact O-N 3.11Å; A150-F152 PolarHBondContact O-N 2.96Å; A150-Q153 PolarHBondContact O-N 2.75Å; A150-A154 WeakPolarHBondContact O-CB 3.37Å; A150-A154 PolarHBondContact O-N 2.91Å; A150-A220 HydrophobicContact CB-CB 4.01Å; A150-A220 WeakPolarHBondContact CB-O 3.13Å; A150-I224 HydrophobicContact CB-CB 4.19Å; A150-I224 HydrophobicContact CB-CD1 4.08Å; A150-I224 HydrophobicContact CB-CG2 3.9Å
151	I	96	Very high	94.6	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-58.1	-50.2	175.7	-70.2	165.1	0	0	0	110.5	A140 D147 A148 A154 S155 A159 W186 A220 I235 I239	A140-I151 HydrophobicContact CB-CD1 4.29Å; A140-I151 HydrophobicContact CB-CG2 3.79Å; D147-I151 VanDerWaalsContact O-CG1 3.31Å; D147-I151 WeakPolarHBondContact O-CG1 3.26Å; D147-I151 PolarHBondContact O-N 2.71Å; A148-I151 PolarHBondContact O-N 2.82Å; I151-A154 PolarHBondContact O-N 2.83Å; I151-S155 WeakPolarHBondContact O-CB 3.29Å; I151-S155 PolarHBondContact O-N 3.41Å; I151-S155 PolarHBondContact O-OG 3.46Å; I151-A159 HydrophobicContact CB-CB 4.03Å; I151-A159 HydrophobicContact CG2-CB 3.93Å; I151-W186 HydrophobicContact CD1-CB 4.42Å; I151-W186 HydrophobicContact CD1-CE3 4.34Å; I151-W186 HydrophobicContact CG1-CE3 4.3Å; I151-A220 HydrophobicContact CD1-CB 4.18Å; I151-A220 HydrophobicContact CG1-CB 3.67Å; I151-I235 HydrophobicContact CG1-CG2 4.44Å; I151-I239 HydrophobicContact CD1-CD1 4.34Å; I151-I239 HydrophobicContact CG1-CD1 4.41Å; I151-I239 HydrophobicContact CG2-CD1 4.05Å; I151-I239 HydrophobicContact CG2-CG1 3.99Å
152	F	95.7	Very high	94.4	Very high	29 Å²	29	13.6 Å²	13.6	13%	0.127	9%	0.087	C	C	.	.	H	α-helix	trans	-63.8	-43.8	179.8	179.5	-90.5	0	0	0	112.3	T61 K64 F65 L131 A148 M149 A150 A154 G156 K157	T61-F152 HydrophobicContact CG2-CD1 4.23Å; K64-F152 HydrophobicContact CB-CE1 4.46Å; K64-F152 HydrophobicContact CD-CE1 3.63Å; K64-F152 HydrophobicContact CD-CZ 3.89Å; F65-F152 HydrophobicContact CD2-CD1 4.44Å; F65-F152 HydrophobicContact CE2-CB 3.58Å; F65-F152 AromaticContact CE2-CD1 3.59Å; F65-F152 HydrophobicContact CE2-CD1 3.59Å; F65-F152 HydrophobicContact CE2-CD2 4.18Å; F65-F152 HydrophobicContact CE2-CE1 4.29Å; F65-F152 AromaticContact CE2-CG 3.51Å; F65-F152 HydrophobicContact CE2-CG 3.51Å; F65-F152 HydrophobicContact CZ-CB 3.66Å; F65-F152 HydrophobicContact CZ-CD1 4.43Å; F65-F152 HydrophobicContact CZ-CD2 4.32Å; F65-F152 AromaticContact CZ-CG 3.89Å; F65-F152 HydrophobicContact CZ-CG 3.89Å; L131-F152 HydrophobicContact CD1-CD2 4.29Å; L131-F152 HydrophobicContact CD1-CE2 4.02Å; L131-F152 HydrophobicContact CD1-CZ 4.22Å; A148-F152 PolarHBondContact O-N 2.87Å; M149-F152 PolarHBondContact O-N 3.29Å; A150-F152 PolarHBondContact O-N 2.96Å; F152-A154 VanDerWaalsContact C-N 3.33Å; F152-A154 PolarHBondContact O-N 3.16Å; F152-G156 VanDerWaalsContact O-CA 3.23Å; F152-G156 WeakPolarHBondContact O-CA 3.44Å; F152-G156 PolarHBondContact O-N 3.1Å; F152-K157 WeakPolarHBondContact CA-O 3.22Å; F152-K157 WeakPolarHBondContact CD2-O 3.43Å
153	Q	95.4	Very high	94.1	Very high	35 Å²	35	14.5 Å²	14.5	16%	0.164	9%	0.092	C	C	.	.	H	α-helix	trans	-64.9	-35.7	-179.5	-178.7	169.6	-73.2	0	0	112.9	H56 S58 T61 M149 A150 I224	H56-Q153 PolarHBondContact O-NE2 3.44Å; S58-Q153 PolarHBondContact OG-OE1 3.26Å; T61-Q153 HydrophobicContact CG2-CB 4.22Å; T61-Q153 PolarHBondContact OG1-OE1 2.83Å; M149-Q153 WeakPolarHBondContact O-CB 3.17Å; M149-Q153 PolarHBondContact O-N 2.7Å; A150-Q153 PolarHBondContact O-N 2.75Å; Q153-I224 HydrophobicContact CB-CD1 3.92Å; Q153-I224 HydrophobicContact CG-CD1 3.98Å; Q153-I224 VanDerWaalsContact NE2-CD1 3.29Å
154	A	93.6	Very high	93.6	Very high	16 Å²	16	16.2 Å²	16.2	13%	0.132	10%	0.102	C	C	.	.	H	α-helix	trans	-83	-41.5	-178.3	0	0	0	0	0	113.2	A150 I151 F152 I224 R232 I235 T236	A150-A154 WeakPolarHBondContact O-CB 3.37Å; A150-A154 PolarHBondContact O-N 2.91Å; I151-A154 PolarHBondContact O-N 2.83Å; F152-A154 VanDerWaalsContact C-N 3.33Å; F152-A154 PolarHBondContact O-N 3.16Å; A154-I224 HydrophobicContact CB-CD1 4.41Å; A154-R232 HydrophobicContact CB-CB 4.28Å; A154-R232 HydrophobicContact CB-CG 4.13Å; A154-I235 HydrophobicContact CB-CB 3.76Å; A154-I235 HydrophobicContact CB-CD1 3.69Å; A154-I235 HydrophobicContact CB-CG1 4.33Å; A154-I235 HydrophobicContact CB-CG2 3.66Å; A154-T236 PolarHBondContact O-OG1 3.32Å
155	S	91.2	Very high	93.1	Very high	28 Å²	28	19.2 Å²	19.2	20%	0.196	12%	0.115	C	C	.	.	H	α-helix	trans	-107.5	-17.3	-170.8	70.8	0	0	0	0	114.9	I151 K157	I151-S155 WeakPolarHBondContact O-CB 3.29Å; I151-S155 PolarHBondContact O-N 3.41Å; I151-S155 PolarHBondContact O-OG 3.46Å; S155-K157 PolarHBondContact O-N 2.93Å; S155-K157 PolarHBondContact OG-N 3.46Å
156	G	90.8	Very high	92.3	Very high	54 Å²	54	20.7 Å²	20.7	56%	0.557	12%	0.123	S	C	*	.			trans	72.4	-6.6	-170.9	0	0	0	0	0	114.9	F152	F152-G156 VanDerWaalsContact O-CA 3.23Å; F152-G156 WeakPolarHBondContact O-CA 3.44Å; F152-G156 PolarHBondContact O-N 3.1Å
157	K	91.1	Very high	91.5	Very high	52 Å²	52	27.3 Å²	27.3	23%	0.226	15%	0.153	C	C	.	.			trans	-75.5	142.3	177.4	-76.2	-179.5	164.9	-163.8	0	110.8	E138 F152 S155 I239 N240	E138-K157 IonicContact OE2-NZ 3.66Å; E138-K157 PolarHBondContact OE2-NZ 3.3Å; F152-K157 WeakPolarHBondContact CA-O 3.22Å; F152-K157 WeakPolarHBondContact CD2-O 3.43Å; S155-K157 PolarHBondContact O-N 2.93Å; S155-K157 PolarHBondContact OG-N 3.46Å; K157-I239 HydrophobicContact CB-CG2 4.21Å; K157-I239 HydrophobicContact CD-CG2 3.35Å; K157-I239 HydrophobicContact CG-CG2 4.36Å; K157-I239 PolarHBondContact NZ-O 3.19Å; K157-N240 WeakPolarHBondContact CE-OD1 3.38Å; K157-N240 PolarHBondContact NZ-OD1 3.1Å
158	A	92.2	Very high	90.8	Very high	9 Å²	9	29.1 Å²	29.1	7%	0.074	16%	0.162	C	C	.	.			trans	-61.7	139.8	176	0	0	0	0	0	110.3	T132 V139 A140	T132-A158 HydrophobicContact CG2-CB 3.78Å; V139-A158 HydrophobicContact CG2-CB 3.97Å; V139-A158 VanDerWaalsContact CG2-O 3.25Å; V139-A158 WeakPolarHBondContact CG2-O 3.43Å; A140-A158 PolarHBondContact N-O 3.42Å
159	A	95.5	Very high	90.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	130.6	-179.9	0	0	0	0	0	109.9	A140 A148 I151	A140-A159 HydrophobicContact CB-CB 4.15Å; A140-A159 CarbonylContact O-C 3.23Å; A140-A159 VanDerWaalsContact O-CA 3.27Å; A140-A159 WeakPolarHBondContact O-CA 3.21Å; A148-A159 HydrophobicContact CB-CB 4.02Å; A148-A159 WeakPolarHBondContact O-CB 3.37Å; I151-A159 HydrophobicContact CB-CB 4.03Å; I151-A159 HydrophobicContact CG2-CB 3.93Å
160	L	95.7	Very high	89.4	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	150.1	-179.5	-50.2	179.7	0	0	0	110.7	F126 F127 Y129 T132 V139 A140 L141 S142 L177 F180	F126-L160 HydrophobicContact CB-CB 4.28Å; F126-L160 HydrophobicContact CB-CD2 4.43Å; F126-L160 HydrophobicContact CD2-CD1 4.35Å; F127-L160 WeakPolarHBondContact O-CA 3.22Å; Y129-L160 VanDerWaalsContact CA-CD2 3.45Å; Y129-L160 HydrophobicContact CD2-CD1 4.09Å; Y129-L160 HydrophobicContact CD2-CD2 4.2Å; T132-L160 HydrophobicContact CG2-CD2 4.23Å; V139-L160 HydrophobicContact CG1-CD1 4.23Å; V139-L160 HydrophobicContact CG2-CD1 3.98Å; V139-L160 HydrophobicContact CG2-CD2 4.29Å; V139-L160 HydrophobicContact CG2-CG 3.66Å; A140-L160 PolarHBondContact O-N 3.38Å; L141-L160 CarbonylContact C-O 3.59Å; L141-L160 WeakPolarHBondContact CA-O 3.37Å; L141-L160 HydrophobicContact CD2-CB 3.95Å; L141-L160 HydrophobicContact CD2-CD1 4.3Å; L141-L160 HydrophobicContact CD2-CG 4.44Å; S142-L160 PolarHBondContact N-O 3.21Å; S142-L160 PolarHBondContact OG-O 3.24Å; L160-L177 HydrophobicContact CD1-CD2 4.08Å; L160-F180 HydrophobicContact CD1-CE2 4.13Å; L160-F180 HydrophobicContact CD1-CZ 4.47Å
161	V	95.5	Very high	88.5	Confident	9 Å²	9	37.6 Å²	37.6	6%	0.055	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	123.7	173	179.5	0	0	0	0	109.7	F126 F127 S142 N144 E145 A148	F126-V161 WeakPolarHBondContact CD1-O 3.45Å; F127-V161 HydrophobicContact CB-CB 4.05Å; F127-V161 HydrophobicContact CB-CG2 3.99Å; F127-V161 HydrophobicContact CD1-CG2 3.7Å; F127-V161 HydrophobicContact CG-CG2 4.29Å; F127-V161 PolarHBondContact O-N 3.11Å; S142-V161 WeakPolarHBondContact O-CA 3.4Å; N144-V161 VanDerWaalsContact C-CG2 3.5Å; N144-V161 WeakPolarHBondContact O-CG2 3.39Å; E145-V161 HydrophobicContact CG-CG2 4.32Å; A148-V161 HydrophobicContact CB-CG2 3.66Å
162	I	92	Very high	87.8	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.233	C	C	.	.			trans	-106.2	143.7	171.5	71.1	175.4	0	0	0	109.9	F126 L141 S142 M169 L177 F185 I198	F126-I162 HydrophobicContact CD1-CG2 4.27Å; F126-I162 HydrophobicContact CE1-CG2 3.83Å; L141-I162 HydrophobicContact CD1-CD1 4.5Å; L141-I162 HydrophobicContact CD2-CG2 4.27Å; S142-I162 PolarHBondContact O-N 2.89Å; I162-M169 HydrophobicContact CB-CE 3.89Å; I162-M169 HydrophobicContact CG2-CE 4.12Å; I162-L177 HydrophobicContact CG2-CD1 4.32Å; I162-F185 HydrophobicContact CD1-CD1 4.28Å; I162-F185 HydrophobicContact CD1-CE1 3.58Å; I162-F185 HydrophobicContact CD1-CE2 3.93Å; I162-F185 HydrophobicContact CD1-CZ 3.39Å; I162-F185 HydrophobicContact CG1-CE2 4.19Å; I162-F185 HydrophobicContact CG1-CZ 3.93Å; I162-I198 HydrophobicContact CD1-CG2 3.88Å
163	P	87.4	Confident	87.3	Confident	18 Å²	18	41.8 Å²	41.8	12%	0.117	23%	0.228	C	C	.	.			trans	-64.5	152.9	174.9	28.2	-33	0	0	0	111	V123 Q165 M169	V123-P163 HydrophobicContact CB-CG 4.37Å; V123-P163 HydrophobicContact CG2-CB 4.07Å; V123-P163 HydrophobicContact CG2-CG 4.1Å; P163-Q165 PolarHBondContact O-N 3.45Å; P163-M169 VanDerWaalsContact CD-CE 3.47Å; P163-M169 HydrophobicContact CG-CB 4.03Å; P163-M169 HydrophobicContact CG-CE 3.99Å
164	D	82.8	Confident	86.7	Confident	51 Å²	51	41.6 Å²	41.6	27%	0.273	23%	0.229	S	C	.	.	S	Bend	trans	-76.2	-10.9	176.1	62.5	-3.7	0	0	0	113.7	M143 K191	M143-D164 VanDerWaalsContact CE-CA 3.46Å; M143-D164 HydrophobicContact CE-CB 3.33Å; D164-K191 IonicContact OD2-NZ 3.46Å; D164-K191 PolarHBondContact OD2-NZ 2.95Å
165	Q	82.1	Confident	86.1	Confident	87 Å²	87	47.1 Å²	47.1	41%	0.407	25%	0.25	S	S	.	.	S	Bend	trans	-118.4	107.6	174.4	-66	-179.6	0.4	0	0	109.7	P163 H167 L168	P163-Q165 PolarHBondContact O-N 3.45Å; Q165-H167 PolarHBondContact O-N 2.88Å; Q165-H167 PolarHBondContact OE1-CE1 2.87Å; Q165-H167 PolarHBondContact OE1-NE2 2.96Å; Q165-L168 HydrophobicContact CB-CD1 3.87Å; Q165-L168 HydrophobicContact CB-CG 3.95Å; Q165-L168 PolarHBondContact O-N 2.91Å; Q165-L168 VanDerWaalsContact O-N 3.16Å
166	L	78	Confident	85.8	Confident	41 Å²	41	46.4 Å²	46.4	22%	0.215	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-63.7	-26.3	-174.1	-169.1	65	0	0	0	113.1	L168 M169 I198 N201 L202	L166-L168 VanDerWaalsContact C-N 3.25Å; L166-L168 PolarHBondContact O-N 3.39Å; L166-M169 HydrophobicContact CD1-CB 4.39Å; L166-M169 HydrophobicContact CD1-CE 4.08Å; L166-M169 HydrophobicContact CD1-SD 4.12Å; L166-M169 VanDerWaalsContact O-CB 3.27Å; L166-M169 WeakPolarHBondContact O-CB 2.98Å; L166-M169 PolarHBondContact O-N 2.68Å; L166-I198 HydrophobicContact CD1-CG2 4.45Å; L166-N201 HydrophobicContact CD2-CB 3.67Å; L166-L202 HydrophobicContact CD1-CD2 3.91Å; L166-L202 HydrophobicContact CD1-CG 4.48Å
167	H	79.3	Confident	85.6	Confident	144 Å²	144	43.8 Å²	43.8	67%	0.667	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-68	-23.3	178.3	67.9	-96.8	0	0	0	113.3	Q165 M169	Q165-H167 PolarHBondContact O-N 2.88Å; Q165-H167 PolarHBondContact OE1-CE1 2.87Å; Q165-H167 PolarHBondContact OE1-NE2 2.96Å; H167-M169 PolarHBondContact O-N 3.27Å
168	L	81.2	Confident	85.3	Confident	39 Å²	39	47 Å²	47	20%	0.204	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-75	-14.7	172.6	-56.3	177.6	0	0	0	111.9	G121 V123 Q165 L166	G121-L168 VanDerWaalsContact O-CD2 3.25Å; G121-L168 WeakPolarHBondContact O-CD2 3.49Å; V123-L168 WeakPolarHBondContact CB-O 3.39Å; V123-L168 HydrophobicContact CG2-CB 4.25Å; V123-L168 PolarHBondContact N-O 3.22Å; Q165-L168 HydrophobicContact CB-CD1 3.87Å; Q165-L168 HydrophobicContact CB-CG 3.95Å; Q165-L168 PolarHBondContact O-N 2.91Å; Q165-L168 VanDerWaalsContact O-N 3.16Å; L166-L168 VanDerWaalsContact C-N 3.25Å; L166-L168 PolarHBondContact O-N 3.39Å
169	M	84.4	Confident	84.8	Confident	9 Å²	9	50.3 Å²	50.3	4%	0.044	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-82.7	122.5	-178.5	-170.5	-174.2	-68.7	0	0	110.2	F126 I162 P163 L166 H167 L173 V174	F126-M169 HydrophobicContact CE1-CE 3.71Å; F126-M169 HydrophobicContact CE1-SD 4.08Å; F126-M169 HydrophobicContact CZ-CE 4.22Å; F126-M169 HydrophobicContact CZ-SD 4.05Å; I162-M169 HydrophobicContact CB-CE 3.89Å; I162-M169 HydrophobicContact CG2-CE 4.12Å; P163-M169 VanDerWaalsContact CD-CE 3.47Å; P163-M169 HydrophobicContact CG-CB 4.03Å; P163-M169 HydrophobicContact CG-CE 3.99Å; L166-M169 HydrophobicContact CD1-CB 4.39Å; L166-M169 HydrophobicContact CD1-CE 4.08Å; L166-M169 HydrophobicContact CD1-SD 4.12Å; L166-M169 VanDerWaalsContact O-CB 3.27Å; L166-M169 WeakPolarHBondContact O-CB 2.98Å; L166-M169 PolarHBondContact O-N 2.68Å; H167-M169 PolarHBondContact O-N 3.27Å; M169-L173 HydrophobicContact CG-CB 3.69Å; M169-L173 HydrophobicContact CG-CD1 3.77Å; M169-L173 HydrophobicContact CG-CG 4.31Å; M169-L173 HydrophobicContact SD-CB 3.82Å; M169-V174 HydrophobicContact SD-CG2 3.96Å
170	H	81	Confident	84.4	Confident	83 Å²	83	50.5 Å²	50.5	38%	0.384	24%	0.243	S	C	.	.			trans	-58.6	134	175.5	-174.6	-87.4	0	0	0	110.9	V123 V124 K172 L173	V123-H170 WeakPolarHBondContact O-CB 3.4Å; V123-H170 PolarHBondContact O-N 2.93Å; V124-H170 HydrophobicContact CG1-CB 4.4Å; H170-K172 VanDerWaalsContact ND1-CB 3.32Å; H170-K172 WeakPolarHBondContact ND1-CB 3.14Å; H170-K172 PolarHBondContact ND1-N 2.91Å; H170-K172 PolarHBondContact O-N 3.39Å; H170-L173 HydrophobicContact CB-CG 4.43Å; H170-L173 VanDerWaalsContact O-CB 3.31Å; H170-L173 WeakPolarHBondContact O-CB 3.46Å; H170-L173 PolarHBondContact O-N 3.39Å
171	P	78.3	Confident	83.7	Confident	86 Å²	86	53 Å²	53	56%	0.558	26%	0.261	S	S	*	.	H	α-helix	trans	-53.7	-32.2	-172.6	-30	35	0	0	0	115.4	L173 V174 F175	P171-L173 PolarHBondContact O-N 3.46Å; P171-V174 PolarHBondContact O-N 2.93Å; P171-F175 VanDerWaalsContact O-CD2 3.27Å; P171-F175 WeakPolarHBondContact O-CD2 3.48Å
172	K	80.4	Confident	83.1	Confident	115 Å²	115	55.8 Å²	55.8	50%	0.5	27%	0.27	S	S	.	.	H	α-helix	trans	-56.3	-32.7	175.4	-171.1	-177.3	174	-168.7	0	112.9	H170 F175 T176	H170-K172 VanDerWaalsContact ND1-CB 3.32Å; H170-K172 WeakPolarHBondContact ND1-CB 3.14Å; H170-K172 PolarHBondContact ND1-N 2.91Å; H170-K172 PolarHBondContact O-N 3.39Å; K172-F175 PolarHBondContact O-N 3.07Å; K172-T176 PolarHBondContact O-N 2.68Å; K172-T176 VanDerWaalsContact O-N 3.16Å; K172-T176 PolarHBondContact O-OG1 3.32Å
173	L	85.3	Confident	83	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-71.7	-31.6	-178	-62.8	-175.3	0	0	0	112.4	V123 F126 M169 H170 P171 F175 T176 L177	V123-L173 HydrophobicContact CG1-CD1 4.34Å; V123-L173 WeakPolarHBondContact O-CD1 3.48Å; F126-L173 HydrophobicContact CD2-CD2 4.22Å; F126-L173 HydrophobicContact CE1-CB 4.27Å; F126-L173 HydrophobicContact CE1-CD1 4.33Å; F126-L173 HydrophobicContact CE2-CB 3.81Å; F126-L173 HydrophobicContact CE2-CD2 4Å; F126-L173 HydrophobicContact CE2-CG 4.35Å; F126-L173 HydrophobicContact CZ-CB 3.55Å; F126-L173 HydrophobicContact CZ-CD1 4.34Å; F126-L173 HydrophobicContact CZ-CD2 4.47Å; F126-L173 HydrophobicContact CZ-CG 4.34Å; M169-L173 HydrophobicContact CG-CB 3.69Å; M169-L173 HydrophobicContact CG-CD1 3.77Å; M169-L173 HydrophobicContact CG-CG 4.31Å; M169-L173 HydrophobicContact SD-CB 3.82Å; H170-L173 HydrophobicContact CB-CG 4.43Å; H170-L173 VanDerWaalsContact O-CB 3.31Å; H170-L173 WeakPolarHBondContact O-CB 3.46Å; H170-L173 PolarHBondContact O-N 3.39Å; P171-L173 PolarHBondContact O-N 3.46Å; L173-F175 VanDerWaalsContact C-N 3.31Å; L173-F175 PolarHBondContact O-N 3.28Å; L173-T176 VanDerWaalsContact O-CB 3.3Å; L173-T176 WeakPolarHBondContact O-CB 3.38Å; L173-T176 PolarHBondContact O-N 3.08Å; L173-T176 VanDerWaalsContact O-N 3.09Å; L173-L177 PolarHBondContact O-N 3.15Å
174	V	82.6	Confident	83.2	Confident	30 Å²	30	55.1 Å²	55.1	18%	0.182	27%	0.266	C	S	.	.	H	α-helix	trans	-61.7	-41.7	173.6	-179.8	0	0	0	0	110.6	M169 P171 T176 L177 R178 L202	M169-V174 HydrophobicContact SD-CG2 3.96Å; P171-V174 PolarHBondContact O-N 2.93Å; V174-T176 VanDerWaalsContact C-N 3.29Å; V174-T176 PolarHBondContact O-N 3.47Å; V174-L177 PolarHBondContact O-N 3.41Å; V174-R178 PolarHBondContact O-N 2.88Å; V174-L202 HydrophobicContact CG1-CD2 3.98Å; V174-L202 HydrophobicContact CG2-CD2 4.21Å
175	F	80.6	Confident	83.7	Confident	133 Å²	133	52.7 Å²	52.7	58%	0.583	25%	0.253	S	S	*	.	H	α-helix	trans	-66	-33.4	174.2	-65.2	-75.3	0	0	0	112.5	P171 K172 L173 R178	P171-F175 VanDerWaalsContact O-CD2 3.27Å; P171-F175 WeakPolarHBondContact O-CD2 3.48Å; K172-F175 PolarHBondContact O-N 3.07Å; L173-F175 VanDerWaalsContact C-N 3.31Å; L173-F175 PolarHBondContact O-N 3.28Å; F175-R178 WeakPolarHBondContact O-CB 3.49Å; F175-R178 PolarHBondContact O-N 3.33Å
176	T	85.4	Confident	84.4	Confident	12 Å²	12	48.7 Å²	48.7	7%	0.074	23%	0.234	C	C	.	.	H	α-helix	trans	-65.1	-40.3	177.8	-54.7	0	0	0	0	111.3	F126 Y129 K172 L173 V174 R178 E179	F126-T176 HydrophobicContact CE2-CG2 4.3Å; Y129-T176 HydrophobicContact CD2-CG2 4.33Å; Y129-T176 HydrophobicContact CE1-CG2 4.11Å; Y129-T176 HydrophobicContact CE2-CG2 3.42Å; Y129-T176 VanDerWaalsContact CE2-CG2 3.42Å; Y129-T176 WeakPolarHBondContact OH-CG2 3.31Å; K172-T176 PolarHBondContact O-N 2.68Å; K172-T176 VanDerWaalsContact O-N 3.16Å; K172-T176 PolarHBondContact O-OG1 3.32Å; L173-T176 VanDerWaalsContact O-CB 3.3Å; L173-T176 WeakPolarHBondContact O-CB 3.38Å; L173-T176 PolarHBondContact O-N 3.08Å; L173-T176 VanDerWaalsContact O-N 3.09Å; V174-T176 VanDerWaalsContact C-N 3.29Å; V174-T176 PolarHBondContact O-N 3.47Å; T176-R178 VanDerWaalsContact C-N 3.25Å; T176-R178 PolarHBondContact O-N 3.37Å; T176-E179 WeakPolarHBondContact O-CB 3.25Å; T176-E179 PolarHBondContact O-N 2.81Å
177	L	87.7	Confident	85.1	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.3	-29.7	174.9	-66.8	177.2	0	0	0	112.8	F126 L141 L160 I162 L173 V174 E179 F180 L183 L202 I204	F126-L177 HydrophobicContact CE1-CD1 4.36Å; F126-L177 HydrophobicContact CE1-CD2 4.4Å; F126-L177 HydrophobicContact CE1-CG 4.47Å; F126-L177 HydrophobicContact CE2-CD2 3.88Å; F126-L177 HydrophobicContact CE2-CG 3.95Å; F126-L177 HydrophobicContact CZ-CD1 3.8Å; F126-L177 HydrophobicContact CZ-CD2 3.73Å; F126-L177 HydrophobicContact CZ-CG 3.56Å; L141-L177 HydrophobicContact CD2-CD2 3.79Å; L160-L177 HydrophobicContact CD1-CD2 4.08Å; I162-L177 HydrophobicContact CG2-CD1 4.32Å; L173-L177 PolarHBondContact O-N 3.15Å; V174-L177 PolarHBondContact O-N 3.41Å; L177-E179 PolarHBondContact O-N 3.37Å; L177-F180 PolarHBondContact O-N 3.46Å; L177-L183 HydrophobicContact CB-CD1 4.36Å; L177-L202 HydrophobicContact CD1-CD1 4.19Å; L177-L202 HydrophobicContact CD1-CD2 4.15Å; L177-I204 HydrophobicContact CB-CD1 3.78Å
178	R	83.7	Confident	85.7	Confident	119 Å²	119	40.2 Å²	40.2	45%	0.449	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-11.3	176.7	-70	178.5	178.8	176.8	2.7	114.1	V174 F175 T176 F180 L202 I204	V174-R178 PolarHBondContact O-N 2.88Å; F175-R178 WeakPolarHBondContact O-CB 3.49Å; F175-R178 PolarHBondContact O-N 3.33Å; T176-R178 VanDerWaalsContact C-N 3.25Å; T176-R178 PolarHBondContact O-N 3.37Å; R178-F180 PolarHBondContact O-N 3.41Å; R178-L202 PolarHBondContact NH2-O 2.94Å; R178-I204 HydrophobicContact CG-CD1 4.13Å; R178-I204 HydrophobicContact CG-CG1 3.94Å
179	E	82.7	Confident	86.2	Confident	78 Å²	78	40.1 Å²	40.1	36%	0.364	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-22.4	173.9	-64.1	-174.2	145.5	0	0	112.3	R84 R87 Y129 T176 L177	R84-E179 IonicContact CZ-OE2 3.78Å; R84-E179 IonicContact NH2-OE2 3.21Å; R84-E179 PolarHBondContact NH2-OE2 3.32Å; R87-E179 IonicContact CZ-OE1 3.75Å; R87-E179 IonicContact NH1-OE1 2.75Å; R87-E179 PolarHBondContact NH1-OE1 2.79Å; R87-E179 IonicContact NH1-OE2 3.65Å; R87-E179 IonicContact NH2-OE1 3.98Å; R87-E179 PolarHBondContact NH2-OE1 2.91Å; R87-E179 IonicContact NH2-OE2 2.63Å; Y129-E179 PolarHBondContact OH-OE2 2.83Å; T176-E179 WeakPolarHBondContact O-CB 3.25Å; T176-E179 PolarHBondContact O-N 2.81Å; L177-E179 PolarHBondContact O-N 3.37Å
180	F	85.6	Confident	86.6	Confident	5 Å²	5	46 Å²	46	2%	0.022	23%	0.228	C	C	.	.			trans	-87.1	132.7	-178.7	-59.7	-75.4	0	0	0	110.9	Y129 T132 V136 M137 V139 L160 L177 R178 R182 L183	Y129-F180 HydrophobicContact CD2-CZ 4.39Å; Y129-F180 HydrophobicContact CE2-CE2 4.1Å; Y129-F180 AromaticContact CE2-CZ 3.85Å; Y129-F180 HydrophobicContact CE2-CZ 3.85Å; T132-F180 HydrophobicContact CG2-CE1 4.32Å; T132-F180 HydrophobicContact CG2-CZ 4.11Å; V136-F180 WeakPolarHBondContact O-CD1 3.37Å; M137-F180 CarbonylContact O-C 3.58Å; V139-F180 HydrophobicContact CB-CD1 4.13Å; V139-F180 HydrophobicContact CB-CE1 4.21Å; V139-F180 HydrophobicContact CB-CG 4.35Å; V139-F180 HydrophobicContact CG1-CB 4.12Å; V139-F180 HydrophobicContact CG1-CD1 3.84Å; V139-F180 HydrophobicContact CG1-CD2 3.6Å; V139-F180 HydrophobicContact CG1-CE1 4.13Å; V139-F180 HydrophobicContact CG1-CE2 3.9Å; V139-F180 HydrophobicContact CG1-CG 3.56Å; V139-F180 HydrophobicContact CG1-CZ 4.15Å; L160-F180 HydrophobicContact CD1-CE2 4.13Å; L160-F180 HydrophobicContact CD1-CZ 4.47Å; L177-F180 PolarHBondContact O-N 3.46Å; R178-F180 PolarHBondContact O-N 3.41Å; F180-R182 VanDerWaalsContact C-N 3.32Å; F180-L183 HydrophobicContact CB-CD2 3.7Å; F180-L183 HydrophobicContact CB-CG 4.43Å; F180-L183 HydrophobicContact CD2-CD2 4.09Å; F180-L183 HydrophobicContact CG-CD2 4.17Å
181	S	81.9	Confident	87.1	Confident	53 Å²	53	44.8 Å²	44.8	37%	0.371	22%	0.221	S	C	.	.	S	Bend	trans	-75.3	-22.1	178.8	67.9	0	0	0	0	112.8	M137 N206	M137-S181 WeakPolarHBondContact CB-OG 3.35Å; M137-S181 PolarHBondContact O-N 2.78Å; M137-S181 PolarHBondContact O-OG 3.49Å; S181-N206 WeakPolarHBondContact O-CB 3.37Å; S181-N206 VanDerWaalsContact O-CG 3.31Å; S181-N206 PolarHBondContact O-ND2 2.68Å
182	R	82.8	Confident	87.7	Confident	66 Å²	66	43.1 Å²	43.1	25%	0.249	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	126.7	177.2	-161.5	-171.2	-58.9	-115.1	0.1	110.4	M137 E138 V139 F180 S242	M137-R182 PolarHBondContact O-N 3.47Å; M137-R182 VanDerWaalsContact O-N 3.14Å; E138-R182 VanDerWaalsContact CA-O 3.32Å; E138-R182 WeakPolarHBondContact CA-O 3.46Å; E138-R182 HydrophobicContact CB-CB 4.15Å; E138-R182 HydrophobicContact CG-CB 3.84Å; E138-R182 IonicContact OE1-CZ 3.94Å; E138-R182 IonicContact OE1-NE 3.91Å; E138-R182 PolarHBondContact OE1-NE 3.03Å; E138-R182 IonicContact OE1-NH2 3.45Å; V139-R182 PolarHBondContact N-O 3.36Å; V139-R182 VanDerWaalsContact N-O 3.07Å; F180-R182 VanDerWaalsContact C-N 3.32Å; R182-S242 PolarHBondContact NH1-O 3.43Å
183	L	89.9	Confident	88.2	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	131.7	172.9	-61.1	176.4	0	0	0	109.1	V139 L141 L177 F180 I204 N206 C207 H208	V139-L183 HydrophobicContact CG1-CD2 3.28Å; V139-L183 WeakPolarHBondContact O-CA 3.43Å; L141-L183 HydrophobicContact CD1-CB 4.36Å; L141-L183 HydrophobicContact CD1-CD1 4.22Å; L141-L183 HydrophobicContact CD1-CD2 4.48Å; L141-L183 HydrophobicContact CD2-CD2 4.43Å; L141-L183 HydrophobicContact CG-CD2 4.48Å; L177-L183 HydrophobicContact CB-CD1 4.36Å; F180-L183 HydrophobicContact CB-CD2 3.7Å; F180-L183 HydrophobicContact CB-CG 4.43Å; F180-L183 HydrophobicContact CD2-CD2 4.09Å; F180-L183 HydrophobicContact CG-CD2 4.17Å; L183-I204 HydrophobicContact CD1-CB 4.32Å; L183-I204 HydrophobicContact CD1-CD1 3.52Å; L183-I204 HydrophobicContact CD1-CG1 4.49Å; L183-I204 HydrophobicContact CD1-CG2 3.77Å; L183-N206 PolarHBondContact N-O 2.99Å; L183-C207 HydrophobicContact CB-CB 4.05Å; L183-C207 HydrophobicContact CD1-CB 4.47Å; L183-C207 CarbonylContact O-C 3.58Å; L183-C207 WeakPolarHBondContact O-CA 3.49Å; L183-H208 PolarHBondContact O-N 3.25Å
184	T	92.3	Very high	88.4	Confident	5 Å²	5	46.6 Å²	46.6	3%	0.031	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	104.7	171.3	-63.6	0	0	0	0	109.1	V139 A140 L141 H208 V210 I239 S242	V139-T184 PolarHBondContact O-N 3.08Å; V139-T184 VanDerWaalsContact O-N 3.07Å; A140-T184 CarbonylContact C-O 3.58Å; A140-T184 VanDerWaalsContact CA-O 3.25Å; A140-T184 WeakPolarHBondContact CA-O 3.43Å; L141-T184 PolarHBondContact N-O 2.93Å; T184-H208 CarbonylContact C-O 3.56Å; T184-H208 WeakPolarHBondContact CA-O 2.97Å; T184-V210 HydrophobicContact CG2-CG2 3.71Å; T184-I239 HydrophobicContact CG2-CD1 3.89Å; T184-S242 WeakPolarHBondContact CG2-OG 3.49Å; T184-S242 WeakPolarHBondContact OG1-CB 3.37Å; T184-S242 PolarHBondContact OG1-OG 3.23Å; T184-S242 VanDerWaalsContact OG1-OG 3.08Å
185	F	93.4	Very high	88.7	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	111.1	-178.6	-169.2	-174.6	0	0	0	111	L141 M143 I162 P187 A195 I198 H208 L209 V210	L141-F185 HydrophobicContact CB-CB 4.1Å; L141-F185 HydrophobicContact CB-CD2 3.71Å; L141-F185 HydrophobicContact CB-CE2 4.38Å; L141-F185 HydrophobicContact CB-CG 4Å; L141-F185 WeakPolarHBondContact O-CD2 3.4Å; M143-F185 HydrophobicContact CG-CE2 3.68Å; M143-F185 HydrophobicContact CG-CZ 3.77Å; M143-F185 HydrophobicContact SD-CZ 4.2Å; I162-F185 HydrophobicContact CD1-CD1 4.28Å; I162-F185 HydrophobicContact CD1-CE1 3.58Å; I162-F185 HydrophobicContact CD1-CE2 3.93Å; I162-F185 HydrophobicContact CD1-CZ 3.39Å; I162-F185 HydrophobicContact CG1-CE2 4.19Å; I162-F185 HydrophobicContact CG1-CZ 3.93Å; F185-P187 HydrophobicContact CE2-CB 4.18Å; F185-P187 HydrophobicContact CZ-CB 4.46Å; F185-P187 VanDerWaalsContact O-CD 3.26Å; F185-P187 WeakPolarHBondContact O-CD 3.29Å; F185-A195 HydrophobicContact CD1-CB 4.19Å; F185-A195 HydrophobicContact CE1-CB 3.54Å; F185-A195 HydrophobicContact CE2-CB 4.47Å; F185-A195 HydrophobicContact CZ-CB 3.69Å; F185-I198 HydrophobicContact CE1-CB 4.42Å; F185-I198 HydrophobicContact CE1-CG2 4.3Å; F185-H208 PolarHBondContact N-O 3.4Å; F185-L209 HydrophobicContact CB-CD1 4.06Å; F185-L209 HydrophobicContact CD1-CD1 3.86Å; F185-L209 HydrophobicContact CG-CD1 4.02Å; F185-V210 PolarHBondContact O-N 3.13Å
186	W	94.9	Very high	89.1	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.008	23%	0.228	C	C	.	.			trans	-108.7	94.6	173.7	-170.4	-9	0	0	0	110.8	L141 I151 V210 C215 L218 A220 A223 I235 I238 I239	L141-W186 PolarHBondContact O-N 3.32Å; I151-W186 HydrophobicContact CD1-CB 4.42Å; I151-W186 HydrophobicContact CD1-CE3 4.34Å; I151-W186 HydrophobicContact CG1-CE3 4.3Å; W186-V210 HydrophobicContact CB-CB 4.18Å; W186-V210 HydrophobicContact CB-CG2 4.01Å; W186-V210 HydrophobicContact CD2-CG1 4.46Å; W186-V210 HydrophobicContact CG-CB 4.19Å; W186-V210 HydrophobicContact CG-CG1 4.25Å; W186-V210 HydrophobicContact CG-CG2 4.34Å; W186-C215 HydrophobicContact CZ2-CB 3.55Å; W186-L218 PolarHBondContact NE1-O 3.23Å; W186-A220 HydrophobicContact CD2-CB 4.4Å; W186-A220 HydrophobicContact CE3-CB 4.29Å; W186-A220 HydrophobicContact CH2-CB 4.37Å; W186-A220 HydrophobicContact CZ2-CB 4.45Å; W186-A220 HydrophobicContact CZ3-CB 4.29Å; W186-A223 HydrophobicContact CH2-CB 4.3Å; W186-A223 HydrophobicContact CZ2-CB 4.48Å; W186-I235 HydrophobicContact CH2-CB 4.45Å; W186-I235 HydrophobicContact CH2-CG1 3.8Å; W186-I235 HydrophobicContact CZ3-CB 4.18Å; W186-I235 HydrophobicContact CZ3-CG1 3.94Å; W186-I235 HydrophobicContact CZ3-CG2 4.05Å; W186-I238 HydrophobicContact CD2-CG2 4.28Å; W186-I238 HydrophobicContact CE3-CB 4.47Å; W186-I238 HydrophobicContact CE3-CG2 3.79Å; W186-I238 HydrophobicContact CH2-CD1 3.5Å; W186-I238 VanDerWaalsContact CH2-CD1 3.5Å; W186-I238 HydrophobicContact CH2-CG2 4.46Å; W186-I238 HydrophobicContact CZ2-CD1 3.89Å; W186-I238 HydrophobicContact CZ3-CB 4.06Å; W186-I238 HydrophobicContact CZ3-CD1 3.94Å; W186-I238 HydrophobicContact CZ3-CG2 3.87Å; W186-I239 HydrophobicContact CE3-CD1 3.96Å; W186-I239 HydrophobicContact CE3-CG1 4.47Å
187	P	93.6	Very high	89.2	Confident	3 Å²	3	47.3 Å²	47.3	2%	0.019	24%	0.244	C	C	.	.			trans	-83.8	159.3	174.8	36.2	-38.2	0	0	0	112.1	M143 F185 F192 A195 L209	M143-P187 HydrophobicContact CG-CB 4.2Å; M143-P187 HydrophobicContact SD-CB 3.77Å; F185-P187 HydrophobicContact CE2-CB 4.18Å; F185-P187 HydrophobicContact CZ-CB 4.46Å; F185-P187 VanDerWaalsContact O-CD 3.26Å; F185-P187 WeakPolarHBondContact O-CD 3.29Å; P187-F192 HydrophobicContact CG-CD2 3.99Å; P187-A195 HydrophobicContact CB-CB 3.49Å; P187-A195 VanDerWaalsContact CB-CB 3.49Å; P187-A195 HydrophobicContact CG-CB 3.53Å; P187-L209 HydrophobicContact CG-CD1 4.05Å
188	P	92.9	Very high	89.1	Confident	4 Å²	4	47.7 Å²	47.7	3%	0.026	25%	0.246	C	C	.	.			trans	-54.7	142.2	162.2	-25.8	36	0	0	0	111.6	D190 K191 F192 R219	P188-D190 VanDerWaalsContact C-N 3.26Å; P188-D190 WeakPolarHBondContact CB-OD1 3.38Å; P188-D190 PolarHBondContact O-N 3.2Å; P188-K191 CarbonylContact O-C 3.59Å; P188-K191 PolarHBondContact O-N 3.13Å; P188-F192 PolarHBondContact O-N 3.14Å; P188-R219 HydrophobicContact CB-CB 4.49Å
189	P	91.8	Very high	89.2	Confident	38 Å²	38	43.2 Å²	43.2	25%	0.247	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-54.1	-38.1	-176.4	-26.7	32.8	0	0	0	114.4	K191 F192 P212 N217	P189-K191 VanDerWaalsContact C-N 3.29Å; P189-K191 PolarHBondContact O-N 2.67Å; P189-F192 WeakPolarHBondContact O-CB 3.48Å; P189-F192 PolarHBondContact O-N 3.17Å; P189-P212 HydrophobicContact CB-CB 4.43Å; P189-N217 HydrophobicContact CG-CB 4.46Å; P189-N217 WeakPolarHBondContact CG-O 3.37Å
190	D	91.6	Very high	89.1	Confident	131 Å²	131	47.9 Å²	47.9	70%	0.701	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-68.6	-23.3	177.4	62.6	-57.5	0	0	0	113.4	P188	P188-D190 VanDerWaalsContact C-N 3.26Å; P188-D190 WeakPolarHBondContact CB-OD1 3.38Å; P188-D190 PolarHBondContact O-N 3.2Å
191	K	91.9	Very high	88.7	Confident	58 Å²	58	53 Å²	53	25%	0.252	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-100.4	6.5	177.4	-61.6	-163.7	178.7	-167.6	0	113.7	M143 D164 P188 P189 A193 K194 A195	M143-K191 HydrophobicContact CE-CB 4.35Å; M143-K191 HydrophobicContact CE-CD 4.06Å; M143-K191 HydrophobicContact SD-CB 3.54Å; M143-K191 VanDerWaalsContact SD-CB 3.54Å; M143-K191 HydrophobicContact SD-CD 3.82Å; M143-K191 HydrophobicContact SD-CG 4.31Å; D164-K191 IonicContact OD2-NZ 3.46Å; D164-K191 PolarHBondContact OD2-NZ 2.95Å; P188-K191 CarbonylContact O-C 3.59Å; P188-K191 PolarHBondContact O-N 3.13Å; P189-K191 VanDerWaalsContact C-N 3.29Å; P189-K191 PolarHBondContact O-N 2.67Å; K191-A193 VanDerWaalsContact C-N 3.31Å; K191-A193 PolarHBondContact O-N 2.83Å; K191-K194 PolarHBondContact O-N 3.29Å; K191-K194 VanDerWaalsContact O-N 3.08Å; K191-A195 PolarHBondContact O-N 2.79Å
192	F	91.9	Very high	88.2	Confident	52 Å²	52	50.6 Å²	50.6	23%	0.228	26%	0.261	C	S	.	.	H	α-helix	trans	-56.2	-40.3	-176.6	-176.2	-104.7	0	0	0	113.5	P187 P188 P189 K194 A195 K196 L209 V210 P212	P187-F192 HydrophobicContact CG-CD2 3.99Å; P188-F192 PolarHBondContact O-N 3.14Å; P189-F192 WeakPolarHBondContact O-CB 3.48Å; P189-F192 PolarHBondContact O-N 3.17Å; F192-K194 PolarHBondContact O-N 3.14Å; F192-A195 PolarHBondContact O-N 2.84Å; F192-K196 PolarHBondContact O-N 2.97Å; F192-L209 HydrophobicContact CD2-CD2 4.42Å; F192-L209 HydrophobicContact CD2-CG 4.45Å; F192-L209 HydrophobicContact CE2-CD1 4.38Å; F192-L209 HydrophobicContact CE2-CD2 3.71Å; F192-L209 HydrophobicContact CE2-CG 3.73Å; F192-L209 HydrophobicContact CZ-CD2 3.93Å; F192-L209 HydrophobicContact CZ-CG 4.34Å; F192-V210 WeakPolarHBondContact CE2-O 3.5Å; F192-P212 HydrophobicContact CB-CG 4.06Å; F192-P212 HydrophobicContact CD1-CG 4.27Å; F192-P212 HydrophobicContact CD2-CG 4.06Å; F192-P212 HydrophobicContact CG-CG 3.86Å
193	A	89.6	Confident	87.5	Confident	79 Å²	79	52.6 Å²	52.6	65%	0.653	28%	0.277	S	S	*	.	H	α-helix	trans	-62.4	-42.2	177.4	0	0	0	0	0	112.5	K191 K196 A197	K191-A193 VanDerWaalsContact C-N 3.31Å; K191-A193 PolarHBondContact O-N 2.83Å; A193-K196 PolarHBondContact O-N 2.67Å; A193-A197 PolarHBondContact O-N 2.67Å
194	K	89.7	Confident	86.5	Confident	111 Å²	111	53.5 Å²	53.5	48%	0.483	28%	0.282	S	S	.	.	H	α-helix	trans	-65.5	-43.8	175.4	-69.3	-177.1	176.9	-179.3	0	111.1	K191 F192 K196 A197 I198	K191-K194 PolarHBondContact O-N 3.29Å; K191-K194 VanDerWaalsContact O-N 3.08Å; F192-K194 PolarHBondContact O-N 3.14Å; K194-K196 VanDerWaalsContact C-N 3.29Å; K194-K196 PolarHBondContact O-N 2.85Å; K194-A197 WeakPolarHBondContact O-CB 3.17Å; K194-A197 PolarHBondContact O-N 2.74Å; K194-A197 VanDerWaalsContact O-N 3.13Å; K194-I198 WeakPolarHBondContact O-CG1 3.41Å; K194-I198 PolarHBondContact O-N 2.93Å
195	A	89.8	Confident	85.2	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-61.1	-37.3	177.3	0	0	0	0	0	112.8	M143 F185 P187 K191 F192 I198 T199 L209	M143-A195 HydrophobicContact SD-CB 4.41Å; F185-A195 HydrophobicContact CD1-CB 4.19Å; F185-A195 HydrophobicContact CE1-CB 3.54Å; F185-A195 HydrophobicContact CE2-CB 4.47Å; F185-A195 HydrophobicContact CZ-CB 3.69Å; P187-A195 HydrophobicContact CB-CB 3.49Å; P187-A195 VanDerWaalsContact CB-CB 3.49Å; P187-A195 HydrophobicContact CG-CB 3.53Å; K191-A195 PolarHBondContact O-N 2.79Å; F192-A195 PolarHBondContact O-N 2.84Å; A195-I198 PolarHBondContact O-N 2.9Å; A195-T199 WeakPolarHBondContact O-CB 3.41Å; A195-T199 PolarHBondContact O-N 3.43Å; A195-T199 PolarHBondContact O-OG1 3.13Å; A195-L209 HydrophobicContact CB-CD1 3.87Å
196	K	88.8	Confident	84.2	Confident	139 Å²	139	63.8 Å²	63.8	60%	0.604	34%	0.337	S	S	*	.	H	α-helix	trans	-62.6	-42.3	173	-168.8	175.1	-178.5	177.5	0	112.3	F192 A193 K194 T199 K200 L209	F192-K196 PolarHBondContact O-N 2.97Å; A193-K196 PolarHBondContact O-N 2.67Å; K194-K196 VanDerWaalsContact C-N 3.29Å; K194-K196 PolarHBondContact O-N 2.85Å; K196-T199 PolarHBondContact O-N 2.99Å; K196-K200 PolarHBondContact O-N 3.24Å; K196-K200 VanDerWaalsContact O-N 3.16Å; K196-L209 HydrophobicContact CB-CD2 3.86Å; K196-L209 HydrophobicContact CG-CD2 4.2Å
197	A	86.1	Confident	83.7	Confident	51 Å²	51	64.8 Å²	64.8	42%	0.421	34%	0.343	S	S	.	.	H	α-helix	trans	-65	-43.1	174.9	0	0	0	0	0	112.2	A193 K194 T199 K200 N201	A193-A197 PolarHBondContact O-N 2.67Å; K194-A197 WeakPolarHBondContact O-CB 3.17Å; K194-A197 PolarHBondContact O-N 2.74Å; K194-A197 VanDerWaalsContact O-N 3.13Å; A197-T199 PolarHBondContact O-N 3.42Å; A197-K200 PolarHBondContact O-N 3.43Å; A197-N201 PolarHBondContact O-N 3.25Å
198	I	86.2	Confident	83.4	Confident	8 Å²	8	66.9 Å²	66.9	4%	0.041	35%	0.353	C	S	.	.	H	α-helix	trans	-60.5	-46.7	176.2	-68	166.5	0	0	0	110.8	M143 I162 L166 F185 K194 A195 K200 N201 L202	M143-I198 HydrophobicContact CE-CD1 4.06Å; I162-I198 HydrophobicContact CD1-CG2 3.88Å; L166-I198 HydrophobicContact CD1-CG2 4.45Å; F185-I198 HydrophobicContact CE1-CB 4.42Å; F185-I198 HydrophobicContact CE1-CG2 4.3Å; K194-I198 WeakPolarHBondContact O-CG1 3.41Å; K194-I198 PolarHBondContact O-N 2.93Å; A195-I198 PolarHBondContact O-N 2.9Å; I198-K200 VanDerWaalsContact C-N 3.29Å; I198-K200 PolarHBondContact O-N 3Å; I198-N201 PolarHBondContact O-N 3.46Å; I198-N201 VanDerWaalsContact O-N 3.1Å; I198-L202 HydrophobicContact CG2-CD1 3.69Å; I198-L202 HydrophobicContact CG2-CG 4.04Å; I198-L202 WeakPolarHBondContact O-CG 3.26Å; I198-L202 PolarHBondContact O-N 2.94Å
199	T	85.1	Confident	83.3	Confident	24 Å²	24	68.3 Å²	68.3	15%	0.147	36%	0.36	C	S	.	.	H	α-helix	trans	-59.7	-41.2	-180	-53.2	0	0	0	0	111.4	A195 K196 A197 C207	A195-T199 WeakPolarHBondContact O-CB 3.41Å; A195-T199 PolarHBondContact O-N 3.43Å; A195-T199 PolarHBondContact O-OG1 3.13Å; K196-T199 PolarHBondContact O-N 2.99Å; A197-T199 PolarHBondContact O-N 3.42Å; T199-C207 HydrophobicContact CG2-CB 3.97Å
200	K	82.2	Confident	83.3	Confident	176 Å²	176	66.6 Å²	66.6	77%	0.765	35%	0.349	S	S	*	.	H	α-helix	trans	-64.1	-41.3	174.7	-167.8	-179.9	179.9	-175.2	0	112.3	K196 A197 I198	K196-K200 PolarHBondContact O-N 3.24Å; K196-K200 VanDerWaalsContact O-N 3.16Å; A197-K200 PolarHBondContact O-N 3.43Å; I198-K200 VanDerWaalsContact C-N 3.29Å; I198-K200 PolarHBondContact O-N 3Å
201	N	76	Confident	83.3	Confident	112 Å²	112	61.8 Å²	61.8	60%	0.599	33%	0.326	S	S	*	.	H	α-helix	trans	-75.9	-30	-178.2	-72	-10.5	0	0	0	113.8	L166 A197 I198 N203	L166-N201 HydrophobicContact CD2-CB 3.67Å; A197-N201 PolarHBondContact O-N 3.25Å; I198-N201 PolarHBondContact O-N 3.46Å; I198-N201 VanDerWaalsContact O-N 3.1Å; N201-N203 PolarHBondContact O-N 3.29Å
202	L	72.5	Confident	83.2	Confident	3 Å²	3	60.3 Å²	60.3	2%	0.016	32%	0.322	C	S	.	.	H	α-helix	trans	-65.7	-25.9	176.5	-75.1	172.7	0	0	0	112	L166 V174 L177 R178 I198 I204	L166-L202 HydrophobicContact CD1-CD2 3.91Å; L166-L202 HydrophobicContact CD1-CG 4.48Å; V174-L202 HydrophobicContact CG1-CD2 3.98Å; V174-L202 HydrophobicContact CG2-CD2 4.21Å; L177-L202 HydrophobicContact CD1-CD1 4.19Å; L177-L202 HydrophobicContact CD1-CD2 4.15Å; R178-L202 PolarHBondContact NH2-O 2.94Å; I198-L202 HydrophobicContact CG2-CD1 3.69Å; I198-L202 HydrophobicContact CG2-CG 4.04Å; I198-L202 WeakPolarHBondContact O-CG 3.26Å; I198-L202 PolarHBondContact O-N 2.94Å; L202-I204 HydrophobicContact CB-CD1 3.95Å; L202-I204 HydrophobicContact CB-CG1 3.96Å; L202-I204 HydrophobicContact CD1-CD1 4.44Å; L202-I204 PolarHBondContact O-N 3.15Å
203	N	68.4	Low	83.1	Confident	108 Å²	108	68.6 Å²	68.6	58%	0.578	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	53.6	-178.5	-164.4	59.4	0	0	0	111.2	N201	N201-N203 PolarHBondContact O-N 3.29Å
204	I	68.3	Low	82.9	Confident	20 Å²	20	69.5 Å²	69.5	10%	0.103	34%	0.342	C	S	.	.			trans	-115.3	104.5	178.4	-53.9	176	0	0	0	107.3	L177 R178 L183 L202 N206 C207	L177-I204 HydrophobicContact CB-CD1 3.78Å; R178-I204 HydrophobicContact CG-CD1 4.13Å; R178-I204 HydrophobicContact CG-CG1 3.94Å; L183-I204 HydrophobicContact CD1-CB 4.32Å; L183-I204 HydrophobicContact CD1-CD1 3.52Å; L183-I204 HydrophobicContact CD1-CG1 4.49Å; L183-I204 HydrophobicContact CD1-CG2 3.77Å; L202-I204 HydrophobicContact CB-CD1 3.95Å; L202-I204 HydrophobicContact CB-CG1 3.96Å; L202-I204 HydrophobicContact CD1-CD1 4.44Å; L202-I204 PolarHBondContact O-N 3.15Å; I204-N206 PolarHBondContact O-N 2.79Å; I204-C207 HydrophobicContact CB-CB 4.46Å; I204-C207 PolarHBondContact O-N 3.15Å
205	D	65.3	Low	82.9	Confident	145 Å²	145	64.3 Å²	64.3	78%	0.775	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-20.8	-173	-58	-33.1	0	0	0	113.2
206	N	71.4	Confident	82.9	Confident	76 Å²	76	70.6 Å²	70.6	41%	0.406	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	28.7	-175.8	-57	-17.7	0	0	0	113.7	S181 L183 I204	S181-N206 WeakPolarHBondContact O-CB 3.37Å; S181-N206 VanDerWaalsContact O-CG 3.31Å; S181-N206 PolarHBondContact O-ND2 2.68Å; L183-N206 PolarHBondContact N-O 2.99Å; I204-N206 PolarHBondContact O-N 2.79Å
207	C	84.1	Confident	83.1	Confident	22 Å²	22	69 Å²	69	15%	0.149	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	109.2	176.5	-169	0	0	0	0	111.9	L183 T199 I204	L183-C207 HydrophobicContact CB-CB 4.05Å; L183-C207 HydrophobicContact CD1-CB 4.47Å; L183-C207 CarbonylContact O-C 3.58Å; L183-C207 WeakPolarHBondContact O-CA 3.49Å; T199-C207 HydrophobicContact CG2-CB 3.97Å; I204-C207 HydrophobicContact CB-CB 4.46Å; I204-C207 PolarHBondContact O-N 3.15Å
208	H	88.2	Confident	83.4	Confident	47 Å²	47	68.7 Å²	68.7	22%	0.218	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	117.8	171.7	176.5	82	0	0	0	110.3	L183 T184 F185 E214 S242	L183-H208 PolarHBondContact O-N 3.25Å; T184-H208 CarbonylContact C-O 3.56Å; T184-H208 WeakPolarHBondContact CA-O 2.97Å; F185-H208 PolarHBondContact N-O 3.4Å; H208-E214 IonicContact CE1-OE1 3Å; H208-S242 VanDerWaalsContact CD2-CB 3.42Å; H208-S242 WeakPolarHBondContact CD2-CB 3.39Å; H208-S242 PolarHBondContact CD2-OG 3.28Å; H208-S242 VanDerWaalsContact CD2-OG 3.22Å
209	L	90.9	Very high	83.8	Confident	35 Å²	35	70.6 Å²	70.6	18%	0.183	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	113.8	177.2	179.4	68.5	0	0	0	110.2	F185 P187 F192 A195 K196 S211	F185-L209 HydrophobicContact CB-CD1 4.06Å; F185-L209 HydrophobicContact CD1-CD1 3.86Å; F185-L209 HydrophobicContact CG-CD1 4.02Å; P187-L209 HydrophobicContact CG-CD1 4.05Å; F192-L209 HydrophobicContact CD2-CD2 4.42Å; F192-L209 HydrophobicContact CD2-CG 4.45Å; F192-L209 HydrophobicContact CE2-CD1 4.38Å; F192-L209 HydrophobicContact CE2-CD2 3.71Å; F192-L209 HydrophobicContact CE2-CG 3.73Å; F192-L209 HydrophobicContact CZ-CD2 3.93Å; F192-L209 HydrophobicContact CZ-CG 4.34Å; A195-L209 HydrophobicContact CB-CD1 3.87Å; K196-L209 HydrophobicContact CB-CD2 3.86Å; K196-L209 HydrophobicContact CG-CD2 4.2Å; L209-S211 PolarHBondContact O-N 2.71Å
210	V	92.1	Very high	84.2	Confident	1 Å²	1	69.4 Å²	69.4	1%	0.006	34%	0.336	C	S	.	.			trans	-68.9	120.9	179.9	-178.7	0	0	0	0	110	T184 F185 W186 F192 E214 C215 I238	T184-V210 HydrophobicContact CG2-CG2 3.71Å; F185-V210 PolarHBondContact O-N 3.13Å; W186-V210 HydrophobicContact CB-CB 4.18Å; W186-V210 HydrophobicContact CB-CG2 4.01Å; W186-V210 HydrophobicContact CD2-CG1 4.46Å; W186-V210 HydrophobicContact CG-CB 4.19Å; W186-V210 HydrophobicContact CG-CG1 4.25Å; W186-V210 HydrophobicContact CG-CG2 4.34Å; F192-V210 WeakPolarHBondContact CE2-O 3.5Å; V210-E214 HydrophobicContact CG1-CB 4.22Å; V210-C215 HydrophobicContact CG1-CB 4.16Å; V210-I238 HydrophobicContact CB-CG2 4.33Å; V210-I238 HydrophobicContact CG1-CG2 3.65Å; V210-I238 HydrophobicContact CG2-CG2 3.67Å
211	S	90.8	Very high	84.8	Confident	30 Å²	30	61.5 Å²	61.5	21%	0.21	30%	0.304	C	S	.	.			trans	-77.2	152	179.2	70.3	0	0	0	0	112.4	L209 R213 E214 C215	L209-S211 PolarHBondContact O-N 2.71Å; S211-R213 PolarHBondContact O-N 2.89Å; S211-R213 VanDerWaalsContact O-N 3.1Å; S211-E214 WeakPolarHBondContact CB-OE2 3.36Å; S211-E214 PolarHBondContact N-OE2 3.45Å; S211-E214 PolarHBondContact O-N 2.85Å; S211-E214 VanDerWaalsContact O-N 3.12Å; S211-E214 VanDerWaalsContact OG-CD 3.26Å; S211-E214 VanDerWaalsContact OG-CG 3.27Å; S211-E214 WeakPolarHBondContact OG-CG 3.46Å; S211-E214 PolarHBondContact OG-N 3.33Å; S211-E214 PolarHBondContact OG-OE2 3.32Å; S211-C215 PolarHBondContact O-N 2.83Å; S211-C215 PolarHBondContact O-SG 3.19Å; S211-C215 VanDerWaalsContact O-SG 3.33Å
212	P	90	Very high	85.6	Confident	27 Å²	27	60.7 Å²	60.7	18%	0.175	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-27.9	174.7	-25.8	35.3	0	0	0	113.1	P189 F192 C215 K216 N217	P189-P212 HydrophobicContact CB-CB 4.43Å; F192-P212 HydrophobicContact CB-CG 4.06Å; F192-P212 HydrophobicContact CD1-CG 4.27Å; F192-P212 HydrophobicContact CD2-CG 4.06Å; F192-P212 HydrophobicContact CG-CG 3.86Å; P212-C215 VanDerWaalsContact CA-SG 3.59Å; P212-K216 PolarHBondContact O-N 3.23Å; P212-K216 VanDerWaalsContact O-N 3.1Å; P212-N217 WeakPolarHBondContact CB-OD1 3.42Å; P212-N217 PolarHBondContact O-N 3.5Å
213	R	88.8	Confident	86.6	Confident	227 Å²	227	60.5 Å²	60.5	86%	0.857	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-45.5	177	-68.2	-176.3	179.9	-178.1	-0.1	112.1	S211 C215 K216	S211-R213 PolarHBondContact O-N 2.89Å; S211-R213 VanDerWaalsContact O-N 3.1Å; R213-C215 VanDerWaalsContact C-N 3.26Å; R213-C215 PolarHBondContact O-N 2.77Å; R213-K216 PolarHBondContact O-N 3.5Å
214	E	86.9	Confident	87.8	Confident	97 Å²	97	56 Å²	56	45%	0.453	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-36.5	179	-73.3	162.2	143.2	0	0	111.9	H208 V210 S211	H208-E214 IonicContact CE1-OE1 3Å; V210-E214 HydrophobicContact CG1-CB 4.22Å; S211-E214 WeakPolarHBondContact CB-OE2 3.36Å; S211-E214 PolarHBondContact N-OE2 3.45Å; S211-E214 PolarHBondContact O-N 2.85Å; S211-E214 VanDerWaalsContact O-N 3.12Å; S211-E214 VanDerWaalsContact OG-CD 3.26Å; S211-E214 VanDerWaalsContact OG-CG 3.27Å; S211-E214 WeakPolarHBondContact OG-CG 3.46Å; S211-E214 PolarHBondContact OG-N 3.33Å; S211-E214 PolarHBondContact OG-OE2 3.32Å
215	C	88.5	Confident	88.9	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.014	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	12.5	178.8	67.2	0	0	0	0	114.7	W186 V210 S211 P212 R213 N217 L218 M234 I238	W186-C215 HydrophobicContact CZ2-CB 3.55Å; V210-C215 HydrophobicContact CG1-CB 4.16Å; S211-C215 PolarHBondContact O-N 2.83Å; S211-C215 PolarHBondContact O-SG 3.19Å; S211-C215 VanDerWaalsContact O-SG 3.33Å; P212-C215 VanDerWaalsContact CA-SG 3.59Å; R213-C215 VanDerWaalsContact C-N 3.26Å; R213-C215 PolarHBondContact O-N 2.77Å; C215-N217 PolarHBondContact O-N 3.13Å; C215-L218 WeakPolarHBondContact O-CB 3.46Å; C215-L218 PolarHBondContact O-N 2.99Å; C215-L218 PolarHBondContact SG-O 3.35Å; C215-L218 VanDerWaalsContact SG-O 3.34Å; C215-M234 HydrophobicContact CB-CE 4.44Å; C215-M234 WeakPolarHBondContact O-CE 3.39Å; C215-I238 HydrophobicContact CB-CD1 3.88Å
216	K	90.8	Very high	90.1	Very high	133 Å²	133	52.7 Å²	52.7	58%	0.578	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	36.7	-179.5	-55.4	-178	179.2	-178.5	0	114	P212 R213 L218 M234	P212-K216 PolarHBondContact O-N 3.23Å; P212-K216 VanDerWaalsContact O-N 3.1Å; R213-K216 PolarHBondContact O-N 3.5Å; K216-L218 PolarHBondContact O-N 2.95Å; K216-M234 HydrophobicContact CB-CE 4.01Å; K216-M234 HydrophobicContact CD-CE 4.12Å; K216-M234 HydrophobicContact CG-CE 3.87Å
217	N	91.9	Very high	90.8	Very high	106 Å²	106	53.8 Å²	53.8	57%	0.567	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	28.5	-175.1	-56.2	-55.4	0	0	0	113.8	P189 P212 C215	P189-N217 HydrophobicContact CG-CB 4.46Å; P189-N217 WeakPolarHBondContact CG-O 3.37Å; P212-N217 WeakPolarHBondContact CB-OD1 3.42Å; P212-N217 PolarHBondContact O-N 3.5Å; C215-N217 PolarHBondContact O-N 3.13Å
218	L	93.3	Very high	90	Very high	43 Å²	43	56 Å²	56	23%	0.225	29%	0.29	C	S	.	.			trans	-105.3	139	173.1	-60.9	172.8	0	0	0	109.8	W186 C215 K216 E222 A223 L226	W186-L218 PolarHBondContact NE1-O 3.23Å; C215-L218 WeakPolarHBondContact O-CB 3.46Å; C215-L218 PolarHBondContact O-N 2.99Å; C215-L218 PolarHBondContact SG-O 3.35Å; C215-L218 VanDerWaalsContact SG-O 3.34Å; K216-L218 PolarHBondContact O-N 2.95Å; L218-E222 HydrophobicContact CB-CB 4.44Å; L218-E222 HydrophobicContact CD2-CB 4.12Å; L218-A223 HydrophobicContact CB-CB 4.34Å; L218-L226 HydrophobicContact CD1-CD1 3.84Å; L218-L226 HydrophobicContact CD1-CG 4.48Å
219	R	93.9	Very high	89.6	Confident	48 Å²	48	57.8 Å²	57.8	18%	0.181	31%	0.314	C	S	.	.			trans	-81.6	160.2	161.7	54.5	179.4	-63.9	-167.6	-12.3	110.5	N144 D147 P188 A221 E222 A223	N144-R219 PolarHBondContact ND2-NH2 2.95Å; N144-R219 PolarHBondContact OD1-NH2 3.3Å; D147-R219 IonicContact OD1-CZ 3.39Å; D147-R219 IonicContact OD1-NE 2.77Å; D147-R219 PolarHBondContact OD1-NE 2.91Å; D147-R219 IonicContact OD1-NH2 3.29Å; D147-R219 PolarHBondContact OD1-NH2 2.76Å; D147-R219 IonicContact OD2-CZ 2.75Å; D147-R219 VanDerWaalsContact OD2-CZ 3.29Å; D147-R219 IonicContact OD2-NE 3.54Å; D147-R219 PolarHBondContact OD2-NE 3.3Å; D147-R219 IonicContact OD2-NH2 2.85Å; D147-R219 PolarHBondContact OD2-NH2 3.47Å; P188-R219 HydrophobicContact CB-CB 4.49Å; R219-A221 VanDerWaalsContact C-N 3.28Å; R219-A221 PolarHBondContact O-N 3.31Å; R219-E222 HydrophobicContact CG-CB 4.21Å; R219-E222 HydrophobicContact CG-CG 3.67Å; R219-E222 WeakPolarHBondContact CG-OE2 3.44Å; R219-E222 PolarHBondContact N-OE2 3.23Å; R219-E222 VanDerWaalsContact N-OE2 3.17Å; R219-E222 WeakPolarHBondContact O-CB 3.36Å; R219-E222 PolarHBondContact O-N 2.87Å; R219-A223 PolarHBondContact O-N 3.08Å
220	A	94.3	Very high	89.5	Confident	0 Å²	0	64 Å²	64	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-57.7	-37.9	-173.9	0	0	0	0	0	113.5	D147 A150 I151 W186 E222 A223 I224	D147-A220 HydrophobicContact CB-CB 4.05Å; D147-A220 PolarHBondContact OD1-N 3.37Å; A150-A220 HydrophobicContact CB-CB 4.01Å; A150-A220 WeakPolarHBondContact CB-O 3.13Å; I151-A220 HydrophobicContact CD1-CB 4.18Å; I151-A220 HydrophobicContact CG1-CB 3.67Å; W186-A220 HydrophobicContact CD2-CB 4.4Å; W186-A220 HydrophobicContact CE3-CB 4.29Å; W186-A220 HydrophobicContact CH2-CB 4.37Å; W186-A220 HydrophobicContact CZ2-CB 4.45Å; W186-A220 HydrophobicContact CZ3-CB 4.29Å; A220-E222 VanDerWaalsContact C-N 3.27Å; A220-E222 PolarHBondContact O-N 2.97Å; A220-A223 PolarHBondContact O-N 3.46Å; A220-I224 PolarHBondContact O-N 2.88Å
221	A	93.7	Very high	89.4	Confident	10 Å²	10	63.9 Å²	63.9	8%	0.083	33%	0.334	C	S	.	.	H	α-helix	trans	-65.9	-23.5	176.3	0	0	0	0	0	114.3	A146 D147 R219 I224	A146-A221 HydrophobicContact CB-CB 4.04Å; D147-A221 VanDerWaalsContact OD1-CB 3.24Å; D147-A221 WeakPolarHBondContact OD1-CB 3.49Å; D147-A221 PolarHBondContact OD1-N 3.01Å; R219-A221 VanDerWaalsContact C-N 3.28Å; R219-A221 PolarHBondContact O-N 3.31Å; A221-I224 WeakPolarHBondContact O-CG2 3.16Å
222	E	93.8	Very high	89.4	Confident	94 Å²	94	68.4 Å²	68.4	44%	0.439	35%	0.346	S	S	.	.	H	α-helix	trans	-87.1	-40.6	172.4	-66	165.7	171	0	0	110.9	L218 R219 A220 I224 A225	L218-E222 HydrophobicContact CB-CB 4.44Å; L218-E222 HydrophobicContact CD2-CB 4.12Å; R219-E222 HydrophobicContact CG-CB 4.21Å; R219-E222 HydrophobicContact CG-CG 3.67Å; R219-E222 WeakPolarHBondContact CG-OE2 3.44Å; R219-E222 PolarHBondContact N-OE2 3.23Å; R219-E222 VanDerWaalsContact N-OE2 3.17Å; R219-E222 WeakPolarHBondContact O-CB 3.36Å; R219-E222 PolarHBondContact O-N 2.87Å; A220-E222 VanDerWaalsContact C-N 3.27Å; A220-E222 PolarHBondContact O-N 2.97Å; E222-I224 PolarHBondContact O-N 3.35Å; E222-A225 VanDerWaalsContact O-CB 3.28Å; E222-A225 WeakPolarHBondContact O-CB 3.33Å; E222-A225 PolarHBondContact O-N 3Å
223	A	93.7	Very high	89.4	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-59.5	-36.9	177.9	0	0	0	0	0	111.7	W186 L218 R219 A220 A225 L226 G231 I235	W186-A223 HydrophobicContact CH2-CB 4.3Å; W186-A223 HydrophobicContact CZ2-CB 4.48Å; L218-A223 HydrophobicContact CB-CB 4.34Å; R219-A223 PolarHBondContact O-N 3.08Å; A220-A223 PolarHBondContact O-N 3.46Å; A223-A225 PolarHBondContact O-N 3.22Å; A223-L226 WeakPolarHBondContact O-CB 3.42Å; A223-L226 WeakPolarHBondContact O-CG 3.33Å; A223-L226 PolarHBondContact O-N 3.45Å; A223-G231 WeakPolarHBondContact O-CA 3.31Å; A223-I235 HydrophobicContact CB-CD1 4.08Å; A223-I235 HydrophobicContact CB-CG1 3.94Å
224	I	93.1	Very high	89.5	Confident	13 Å²	13	62.7 Å²	62.7	7%	0.067	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-18.8	177	-159.5	165.4	0	0	0	113.4	H56 A150 Q153 A154 A220 A221 E222 L226 I235	H56-I224 HydrophobicContact CB-CG2 3.96Å; A150-I224 HydrophobicContact CB-CB 4.19Å; A150-I224 HydrophobicContact CB-CD1 4.08Å; A150-I224 HydrophobicContact CB-CG2 3.9Å; Q153-I224 HydrophobicContact CB-CD1 3.92Å; Q153-I224 HydrophobicContact CG-CD1 3.98Å; Q153-I224 VanDerWaalsContact NE2-CD1 3.29Å; A154-I224 HydrophobicContact CB-CD1 4.41Å; A220-I224 PolarHBondContact O-N 2.88Å; A221-I224 WeakPolarHBondContact O-CG2 3.16Å; E222-I224 PolarHBondContact O-N 3.35Å; I224-L226 VanDerWaalsContact C-N 3.34Å; I224-I235 HydrophobicContact CB-CD1 3.83Å; I224-I235 HydrophobicContact CG1-CD1 4.38Å
225	A	90.6	Very high	89.8	Confident	45 Å²	45	58.1 Å²	58.1	37%	0.372	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-16.1	176.6	0	0	0	0	0	113.1	H56 E222 A223	H56-A225 WeakPolarHBondContact CD2-CB 3.41Å; H56-A225 WeakPolarHBondContact NE2-CB 3.22Å; E222-A225 VanDerWaalsContact O-CB 3.28Å; E222-A225 WeakPolarHBondContact O-CB 3.33Å; E222-A225 PolarHBondContact O-N 3Å; A223-A225 PolarHBondContact O-N 3.22Å
226	L	91.4	Very high	89.9	Confident	51 Å²	51	59.5 Å²	59.5	27%	0.267	32%	0.315	S	S	.	.	S	Bend	trans	-59.8	156.8	171.4	-64	175	0	0	0	110.4	L218 A223 I224 A228 M234	L218-L226 HydrophobicContact CD1-CD1 3.84Å; L218-L226 HydrophobicContact CD1-CG 4.48Å; A223-L226 WeakPolarHBondContact O-CB 3.42Å; A223-L226 WeakPolarHBondContact O-CG 3.33Å; A223-L226 PolarHBondContact O-N 3.45Å; I224-L226 VanDerWaalsContact C-N 3.34Å; L226-A228 PolarHBondContact O-N 3.49Å; L226-M234 HydrophobicContact CD1-SD 4.39Å
227	P	85	Confident	89.8	Confident	99 Å²	99	57.2 Å²	57.2	64%	0.643	31%	0.308	S	S	*	.			trans	-44.3	127.3	177.9	-30	35.2	0	0	0	111.7	A229 R230 G231	P227-A229 VanDerWaalsContact C-N 3.26Å; P227-A229 PolarHBondContact O-N 2.81Å; P227-R230 PolarHBondContact O-N 2.61Å; P227-G231 PolarHBondContact O-N 3Å
228	A	68.5	Low	89.8	Confident	68 Å²	68	53 Å²	53	56%	0.562	29%	0.286	S	S	*	.	H	α-helix	trans	-49.5	-39.1	-151.9	0	0	0	0	0	115.4	L226 R232	L226-A228 PolarHBondContact O-N 3.49Å; A228-R232 WeakPolarHBondContact O-CB 3.49Å; A228-R232 VanDerWaalsContact O-CG 3.24Å; A228-R232 WeakPolarHBondContact O-CG 3.39Å; A228-R232 PolarHBondContact O-N 3.48Å
229	A	80.1	Confident	89.6	Confident	85 Å²	85	51.2 Å²	51.2	70%	0.702	28%	0.276	S	S	*	.	H	α-helix	trans	-66.8	-43.8	177.6	0	0	0	0	0	112.5	P227 Q233	P227-A229 VanDerWaalsContact C-N 3.26Å; P227-A229 PolarHBondContact O-N 2.81Å; A229-Q233 WeakPolarHBondContact O-CB 3.48Å; A229-Q233 PolarHBondContact O-N 3.38Å
230	R	89.1	Confident	89.1	Confident	164 Å²	164	53.1 Å²	53.1	62%	0.619	29%	0.29	S	S	*	.	H	α-helix	trans	-71.1	-45.3	-175.7	-168.1	-179	-171.5	-175.2	4.5	112	P227 M234	P227-R230 PolarHBondContact O-N 2.61Å; R230-M234 WeakPolarHBondContact O-CB 3.47Å; R230-M234 PolarHBondContact O-N 3.36Å
231	G	89	Confident	87.9	Confident	0 Å²	0	57 Å²	57	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-63.9	-48.4	-179.9	0	0	0	0	0	112.5	A223 P227 M234 I235	A223-G231 WeakPolarHBondContact O-CA 3.31Å; P227-G231 PolarHBondContact O-N 3Å; G231-M234 PolarHBondContact O-N 3.19Å; G231-I235 WeakPolarHBondContact O-CG1 3.36Å; G231-I235 PolarHBondContact O-N 2.92Å; G231-I235 VanDerWaalsContact O-N 3.12Å
232	R	91	Very high	86.1	Confident	124 Å²	124	56.5 Å²	56.5	47%	0.468	32%	0.318	S	S	.	.	H	α-helix	trans	-63.3	-44.8	177.6	-68.8	-180	-178.1	-157	1.5	112	A154 A228 M234 I235 T236	A154-R232 HydrophobicContact CB-CB 4.28Å; A154-R232 HydrophobicContact CB-CG 4.13Å; A228-R232 WeakPolarHBondContact O-CB 3.49Å; A228-R232 VanDerWaalsContact O-CG 3.24Å; A228-R232 WeakPolarHBondContact O-CG 3.39Å; A228-R232 PolarHBondContact O-N 3.48Å; R232-M234 VanDerWaalsContact C-N 3.32Å; R232-M234 PolarHBondContact O-N 3.49Å; R232-I235 PolarHBondContact O-N 3.07Å; R232-T236 PolarHBondContact O-N 2.93Å; R232-T236 PolarHBondContact O-OG1 3.02Å; R232-T236 VanDerWaalsContact O-OG1 3.09Å
233	Q	90.2	Very high	84	Confident	109 Å²	109	59.8 Å²	59.8	51%	0.509	33%	0.334	S	S	.	.	H	α-helix	trans	-60.7	-42.4	177.6	-169.7	69.3	43.9	0	0	111.9	A229 T236 N237	A229-Q233 WeakPolarHBondContact O-CB 3.48Å; A229-Q233 PolarHBondContact O-N 3.38Å; Q233-T236 PolarHBondContact O-N 2.86Å; Q233-N237 PolarHBondContact NE2-OD1 2.96Å; Q233-N237 WeakPolarHBondContact O-CB 3.47Å; Q233-N237 PolarHBondContact O-N 2.84Å; Q233-N237 PolarHBondContact O-OD1 3.48Å
234	M	91.4	Very high	81.8	Confident	26 Å²	26	62.8 Å²	62.8	13%	0.128	35%	0.353	C	S	.	.	H	α-helix	trans	-60.6	-47.3	178.3	-179.9	170.2	178.5	0	0	111.6	C215 K216 L226 R230 G231 R232 N237 I238	C215-M234 HydrophobicContact CB-CE 4.44Å; C215-M234 WeakPolarHBondContact O-CE 3.39Å; K216-M234 HydrophobicContact CB-CE 4.01Å; K216-M234 HydrophobicContact CD-CE 4.12Å; K216-M234 HydrophobicContact CG-CE 3.87Å; L226-M234 HydrophobicContact CD1-SD 4.39Å; R230-M234 WeakPolarHBondContact O-CB 3.47Å; R230-M234 PolarHBondContact O-N 3.36Å; G231-M234 PolarHBondContact O-N 3.19Å; R232-M234 VanDerWaalsContact C-N 3.32Å; R232-M234 PolarHBondContact O-N 3.49Å; M234-N237 PolarHBondContact O-N 3.21Å; M234-I238 HydrophobicContact CE-CD1 4.02Å; M234-I238 HydrophobicContact CG-CD1 3.88Å; M234-I238 WeakPolarHBondContact O-CG1 3.35Å; M234-I238 PolarHBondContact O-N 2.74Å
235	I	92.4	Very high	79.6	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-61.7	-48.5	177.7	-66.9	166.4	0	0	0	110.6	I151 A154 W186 A223 I224 G231 R232 N237 I238 I239	I151-I235 HydrophobicContact CG1-CG2 4.44Å; A154-I235 HydrophobicContact CB-CB 3.76Å; A154-I235 HydrophobicContact CB-CD1 3.69Å; A154-I235 HydrophobicContact CB-CG1 4.33Å; A154-I235 HydrophobicContact CB-CG2 3.66Å; W186-I235 HydrophobicContact CH2-CB 4.45Å; W186-I235 HydrophobicContact CH2-CG1 3.8Å; W186-I235 HydrophobicContact CZ3-CB 4.18Å; W186-I235 HydrophobicContact CZ3-CG1 3.94Å; W186-I235 HydrophobicContact CZ3-CG2 4.05Å; A223-I235 HydrophobicContact CB-CD1 4.08Å; A223-I235 HydrophobicContact CB-CG1 3.94Å; I224-I235 HydrophobicContact CB-CD1 3.83Å; I224-I235 HydrophobicContact CG1-CD1 4.38Å; G231-I235 WeakPolarHBondContact O-CG1 3.36Å; G231-I235 PolarHBondContact O-N 2.92Å; G231-I235 VanDerWaalsContact O-N 3.12Å; R232-I235 PolarHBondContact O-N 3.07Å; I235-N237 VanDerWaalsContact C-N 3.32Å; I235-N237 PolarHBondContact O-N 3.45Å; I235-I238 PolarHBondContact O-N 3.37Å; I235-I239 HydrophobicContact CG2-CG1 4.32Å; I235-I239 VanDerWaalsContact O-CG1 3.29Å; I235-I239 WeakPolarHBondContact O-CG1 3.42Å; I235-I239 PolarHBondContact O-N 2.88Å
236	T	91	Very high	77.4	Confident	32 Å²	32	73.5 Å²	73.5	20%	0.196	41%	0.408	C	S	.	.	H	α-helix	trans	-60.5	-41	179.7	-61.5	0	0	0	0	112.1	A154 R232 Q233 N240	A154-T236 PolarHBondContact O-OG1 3.32Å; R232-T236 PolarHBondContact O-N 2.93Å; R232-T236 PolarHBondContact O-OG1 3.02Å; R232-T236 VanDerWaalsContact O-OG1 3.09Å; Q233-T236 PolarHBondContact O-N 2.86Å; T236-N240 WeakPolarHBondContact CG2-ND2 3.3Å; T236-N240 VanDerWaalsContact O-CB 3.25Å; T236-N240 WeakPolarHBondContact O-CB 3.49Å; T236-N240 PolarHBondContact O-N 3.46Å; T236-N240 PolarHBondContact O-ND2 3.44Å
237	N	89.5	Confident	75.5	Confident	84 Å²	84	74.8 Å²	74.8	45%	0.449	42%	0.415	S	S	.	.	H	α-helix	trans	-64.6	-47.1	177.5	-71.5	0.4	0	0	0	111.5	Q233 M234 I235 I239 N240 A241	Q233-N237 PolarHBondContact NE2-OD1 2.96Å; Q233-N237 WeakPolarHBondContact O-CB 3.47Å; Q233-N237 PolarHBondContact O-N 2.84Å; Q233-N237 PolarHBondContact O-OD1 3.48Å; M234-N237 PolarHBondContact O-N 3.21Å; I235-N237 VanDerWaalsContact C-N 3.32Å; I235-N237 PolarHBondContact O-N 3.45Å; N237-I239 VanDerWaalsContact C-N 3.34Å; N237-I239 PolarHBondContact O-N 3.35Å; N237-N240 PolarHBondContact O-N 2.91Å; N237-A241 WeakPolarHBondContact O-CB 3.3Å; N237-A241 PolarHBondContact O-N 3.12Å
238	I	90.7	Very high	74.2	Confident	19 Å²	19	80 Å²	80	10%	0.097	43%	0.428	C	S	.	.	H	α-helix	trans	-60.3	-44.8	179.8	-71.7	165.8	0	0	0	111	W186 V210 C215 M234 I235 N240 S242	W186-I238 HydrophobicContact CD2-CG2 4.28Å; W186-I238 HydrophobicContact CE3-CB 4.47Å; W186-I238 HydrophobicContact CE3-CG2 3.79Å; W186-I238 HydrophobicContact CH2-CD1 3.5Å; W186-I238 VanDerWaalsContact CH2-CD1 3.5Å; W186-I238 HydrophobicContact CH2-CG2 4.46Å; W186-I238 HydrophobicContact CZ2-CD1 3.89Å; W186-I238 HydrophobicContact CZ3-CB 4.06Å; W186-I238 HydrophobicContact CZ3-CD1 3.94Å; W186-I238 HydrophobicContact CZ3-CG2 3.87Å; V210-I238 HydrophobicContact CB-CG2 4.33Å; V210-I238 HydrophobicContact CG1-CG2 3.65Å; V210-I238 HydrophobicContact CG2-CG2 3.67Å; C215-I238 HydrophobicContact CB-CD1 3.88Å; M234-I238 HydrophobicContact CE-CD1 4.02Å; M234-I238 HydrophobicContact CG-CD1 3.88Å; M234-I238 WeakPolarHBondContact O-CG1 3.35Å; M234-I238 PolarHBondContact O-N 2.74Å; I235-I238 PolarHBondContact O-N 3.37Å; I238-N240 VanDerWaalsContact C-N 3.32Å; I238-N240 PolarHBondContact O-N 3.4Å; I238-S242 PolarHBondContact O-OG 2.85Å; I238-S242 VanDerWaalsContact O-OG 3.14Å
239	I	88.8	Confident	73.9	Confident	4 Å²	4	86.8 Å²	86.8	2%	0.021	44%	0.439	C	S	.	.	H	α-helix	trans	-73.9	-23.2	-177.7	-60.6	-60.7	0	0	0	112.3	A140 I151 K157 T184 W186 I235 N237	A140-I239 HydrophobicContact CB-CD1 3.96Å; I151-I239 HydrophobicContact CD1-CD1 4.34Å; I151-I239 HydrophobicContact CG1-CD1 4.41Å; I151-I239 HydrophobicContact CG2-CD1 4.05Å; I151-I239 HydrophobicContact CG2-CG1 3.99Å; K157-I239 HydrophobicContact CB-CG2 4.21Å; K157-I239 HydrophobicContact CD-CG2 3.35Å; K157-I239 HydrophobicContact CG-CG2 4.36Å; K157-I239 PolarHBondContact NZ-O 3.19Å; T184-I239 HydrophobicContact CG2-CD1 3.89Å; W186-I239 HydrophobicContact CE3-CD1 3.96Å; W186-I239 HydrophobicContact CE3-CG1 4.47Å; I235-I239 HydrophobicContact CG2-CG1 4.32Å; I235-I239 VanDerWaalsContact O-CG1 3.29Å; I235-I239 WeakPolarHBondContact O-CG1 3.42Å; I235-I239 PolarHBondContact O-N 2.88Å; N237-I239 VanDerWaalsContact C-N 3.34Å; N237-I239 PolarHBondContact O-N 3.35Å
240	N	83	Confident	72.6	Confident	88 Å²	88	87.6 Å²	87.6	47%	0.471	44%	0.435	S	S	.	.	H	α-helix	trans	-94	-30.2	178.6	-70.7	-16.7	0	0	0	113.9	K157 T236 N237 I238 S242	K157-N240 WeakPolarHBondContact CE-OD1 3.38Å; K157-N240 PolarHBondContact NZ-OD1 3.1Å; T236-N240 WeakPolarHBondContact CG2-ND2 3.3Å; T236-N240 VanDerWaalsContact O-CB 3.25Å; T236-N240 WeakPolarHBondContact O-CB 3.49Å; T236-N240 PolarHBondContact O-N 3.46Å; T236-N240 PolarHBondContact O-ND2 3.44Å; N237-N240 PolarHBondContact O-N 2.91Å; I238-N240 VanDerWaalsContact C-N 3.32Å; I238-N240 PolarHBondContact O-N 3.4Å; N240-S242 PolarHBondContact O-N 3.3Å
241	A	69.9	Low	71.5	Confident	81 Å²	81	85.6 Å²	85.6	67%	0.669	43%	0.432	S	S	*	.			trans	-77.2	-0.3	-172.9	0	0	0	0	0	114.6	N237 E243	N237-A241 WeakPolarHBondContact O-CB 3.3Å; N237-A241 PolarHBondContact O-N 3.12Å; A241-E243 VanDerWaalsContact C-N 3.34Å; A241-E243 PolarHBondContact O-N 2.9Å
242	S	56.7	Low	70.3	Confident	1 Å²	1	88.4 Å²	88.4	1%	0.007	45%	0.452	C	S	.	.			trans	-74.8	71.9	-173.9	-44.5	0	0	0	0	112.9	R182 T184 H208 I238 N240	R182-S242 PolarHBondContact NH1-O 3.43Å; T184-S242 WeakPolarHBondContact CG2-OG 3.49Å; T184-S242 WeakPolarHBondContact OG1-CB 3.37Å; T184-S242 PolarHBondContact OG1-OG 3.23Å; T184-S242 VanDerWaalsContact OG1-OG 3.08Å; H208-S242 VanDerWaalsContact CD2-CB 3.42Å; H208-S242 WeakPolarHBondContact CD2-CB 3.39Å; H208-S242 PolarHBondContact CD2-OG 3.28Å; H208-S242 VanDerWaalsContact CD2-OG 3.22Å; I238-S242 PolarHBondContact O-OG 2.85Å; I238-S242 VanDerWaalsContact O-OG 3.14Å; N240-S242 PolarHBondContact O-N 3.3Å
243	E	48.8	Very low	69.3	Low	162 Å²	162	89.9 Å²	89.9	76%	0.757	47%	0.468	S	S	*	.			trans	-78	131	163.4	-80.3	-165.5	163.6	0	0	110.8	A241	A241-E243 VanDerWaalsContact C-N 3.34Å; A241-E243 PolarHBondContact O-N 2.9Å
244	P	48.5	Very low	68.3	Low	64 Å²	64	88.5 Å²	88.5	42%	0.416	48%	0.476	S	S	.	.			trans	-71.9	133.4	166.4	0.6	14.6	0	0	0	109.4	A246	P244-A246 PolarHBondContact O-N 3.32Å; P244-A246 VanDerWaalsContact O-N 3.09Å
245	E	45.3	Very low	67.2	Low	208 Å²	208	93.1 Å²	93.1	97%	0.972	50%	0.497	S	S	*	.			trans	-74	95.6	171.1	-153.4	175.8	-161.1	0	0	108.6
246	A	45.4	Very low	66.6	Low	74 Å²	74	95.5 Å²	95.5	61%	0.612	51%	0.51	S	S	*	.			trans	-104.1	139.9	-179.6	0	0	0	0	0	112.5	P244 K248	P244-A246 PolarHBondContact O-N 3.32Å; P244-A246 VanDerWaalsContact O-N 3.09Å; A246-K248 PolarHBondContact O-N 3.02Å
247	D	51.6	Low	65.8	Low	78 Å²	78	99.9 Å²	99.9	42%	0.417	53%	0.526	S	S	.	.			trans	-66.2	117.4	173	-173.4	-25.5	0	0	0	109.9	R249 V250	D247-R249 PolarHBondContact O-N 2.81Å; D247-R249 WeakPolarHBondContact OD1-CB 3.43Å; D247-R249 IonicContact OD1-CZ 3.84Å; D247-R249 PolarHBondContact OD1-N 2.88Å; D247-R249 IonicContact OD1-NE 3.51Å; D247-R249 PolarHBondContact OD1-NE 2.92Å; D247-R249 VanDerWaalsContact OD1-NE 3.08Å; D247-R249 IonicContact OD1-NH2 3.95Å; D247-R249 IonicContact OD2-CZ 3.87Å; D247-R249 IonicContact OD2-NE 3.8Å; D247-R249 PolarHBondContact OD2-NE 3.47Å; D247-R249 IonicContact OD2-NH2 2.82Å; D247-R249 PolarHBondContact OD2-NH2 2.78Å; D247-V250 HydrophobicContact CB-CG2 4.31Å; D247-V250 PolarHBondContact O-N 2.84Å
248	K	56.3	Low	65.1	Low	209 Å²	209	101.8 Å²	101.8	91%	0.909	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-11.2	-178.4	-65.7	-174.6	179.7	-178.9	0	114.6	A246	A246-K248 PolarHBondContact O-N 3.02Å
249	R	63.2	Low	64.2	Low	210 Å²	210	106 Å²	106	79%	0.792	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-9.3	176.4	-60.8	172.6	-65.9	176.9	3.5	113.2	D247	D247-R249 PolarHBondContact O-N 2.81Å; D247-R249 WeakPolarHBondContact OD1-CB 3.43Å; D247-R249 IonicContact OD1-CZ 3.84Å; D247-R249 PolarHBondContact OD1-N 2.88Å; D247-R249 IonicContact OD1-NE 3.51Å; D247-R249 PolarHBondContact OD1-NE 2.92Å; D247-R249 VanDerWaalsContact OD1-NE 3.08Å; D247-R249 IonicContact OD1-NH2 3.95Å; D247-R249 IonicContact OD2-CZ 3.87Å; D247-R249 IonicContact OD2-NE 3.8Å; D247-R249 PolarHBondContact OD2-NE 3.47Å; D247-R249 IonicContact OD2-NH2 2.82Å; D247-R249 PolarHBondContact OD2-NH2 2.78Å
250	V	52.4	Low	63.4	Low	103 Å²	103	108.3 Å²	108.3	62%	0.624	57%	0.571	S	S	*	*			trans	-117.3	111.2	-174.8	-174.9	0	0	0	0	109.7	D247	D247-V250 HydrophobicContact CB-CG2 4.31Å; D247-V250 PolarHBondContact O-N 2.84Å
251	E	66.1	Low	63	Low	121 Å²	121	107.8 Å²	107.8	57%	0.565	57%	0.565	S	S	*	*			trans	-103.6	129.7	175	-63.4	179.3	129.1	0	0	110.2	L256	E251-L256 HydrophobicContact CB-CD2 4.07Å; E251-L256 HydrophobicContact CB-CG 4.16Å; E251-L256 WeakPolarHBondContact OE2-CD2 3.48Å
252	S	64.2	Low	62.9	Low	59 Å²	59	105.6 Å²	105.6	41%	0.413	55%	0.55	S	S	.	.			trans	-74.1	155.7	172.5	66.5	0	0	0	0	111.3	A254 Q255 L256	S252-A254 PolarHBondContact O-N 2.98Å; S252-Q255 WeakPolarHBondContact O-CB 3.26Å; S252-Q255 PolarHBondContact O-N 3.31Å; S252-Q255 WeakPolarHBondContact OG-CG 3.38Å; S252-Q255 PolarHBondContact OG-N 2.94Å; S252-Q255 PolarHBondContact OG-OE1 3.19Å; S252-L256 PolarHBondContact O-N 3.06Å; S252-L256 VanDerWaalsContact O-N 3.16Å
253	L	69.3	Low	63.3	Low	155 Å²	155	112.1 Å²	112.1	81%	0.812	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.6	-30	175.2	-174.3	64.2	0	0	0	112.8
254	A	69.6	Low	64	Low	80 Å²	80	111.5 Å²	111.5	66%	0.661	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-39.7	176.7	0	0	0	0	0	112.4	S252 L256 K257	S252-A254 PolarHBondContact O-N 2.98Å; A254-L256 VanDerWaalsContact C-N 3.33Å; A254-K257 WeakPolarHBondContact O-CB 3.41Å; A254-K257 PolarHBondContact O-N 3.44Å
255	Q	69.3	Low	64.8	Low	123 Å²	123	117 Å²	117	58%	0.575	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-36	176.5	-73.6	162.3	-50.9	0	0	111.5	S252 K257	S252-Q255 WeakPolarHBondContact O-CB 3.26Å; S252-Q255 PolarHBondContact O-N 3.31Å; S252-Q255 WeakPolarHBondContact OG-CG 3.38Å; S252-Q255 PolarHBondContact OG-N 2.94Å; S252-Q255 PolarHBondContact OG-OE1 3.19Å; Q255-K257 PolarHBondContact O-N 3.48Å
256	L	78.8	Confident	65.3	Low	51 Å²	51	111.8 Å²	111.8	27%	0.267	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.5	-8.3	-180	-65.9	174.8	0	0	0	114.2	E251 S252 A254 E258 Q259 A260	E251-L256 HydrophobicContact CB-CD2 4.07Å; E251-L256 HydrophobicContact CB-CG 4.16Å; E251-L256 WeakPolarHBondContact OE2-CD2 3.48Å; S252-L256 PolarHBondContact O-N 3.06Å; S252-L256 VanDerWaalsContact O-N 3.16Å; A254-L256 VanDerWaalsContact C-N 3.33Å; L256-E258 PolarHBondContact O-N 3.45Å; L256-Q259 PolarHBondContact O-N 3.4Å; L256-A260 WeakPolarHBondContact O-CB 3.29Å; L256-A260 PolarHBondContact O-N 3Å
257	K	75.4	Confident	65.7	Low	124 Å²	124	113.6 Å²	113.6	54%	0.539	57%	0.567	S	S	.	*	H	α-helix	trans	-56.4	-47.4	-169.6	-176.3	179.3	-179.1	-179.6	0	113.8	A254 Q255 K261	A254-K257 WeakPolarHBondContact O-CB 3.41Å; A254-K257 PolarHBondContact O-N 3.44Å; Q255-K257 PolarHBondContact O-N 3.48Å; K257-K261 WeakPolarHBondContact O-CB 3.32Å; K257-K261 WeakPolarHBondContact O-CG 3.31Å; K257-K261 PolarHBondContact O-N 2.9Å
258	E	73.8	Confident	65.3	Low	123 Å²	123	112.3 Å²	112.3	58%	0.575	57%	0.571	S	S	*	*	H	α-helix	trans	-74	-36.5	-177.5	-66.6	-53	129.7	0	0	112	L256 K261 G262	L256-E258 PolarHBondContact O-N 3.45Å; E258-K261 PolarHBondContact O-N 3.15Å; E258-K261 IonicContact OE1-NZ 3.26Å; E258-K261 PolarHBondContact OE1-NZ 3.32Å; E258-K261 WeakPolarHBondContact OE2-CD 3.46Å; E258-K261 IonicContact OE2-NZ 2.7Å; E258-G262 PolarHBondContact O-N 2.93Å
259	Q	71.9	Confident	65.1	Low	107 Å²	107	106.4 Å²	106.4	50%	0.5	56%	0.557	S	S	.	*	H	α-helix	trans	-64.6	-44.9	172.5	-169	-178.1	15.9	0	0	111.3	L256 K261 G262 Y263	L256-Q259 PolarHBondContact O-N 3.4Å; Q259-K261 PolarHBondContact O-N 2.92Å; Q259-G262 WeakPolarHBondContact O-CA 3.48Å; Q259-G262 PolarHBondContact O-N 2.99Å; Q259-G262 VanDerWaalsContact O-N 3.11Å; Q259-Y263 HydrophobicContact CG-CD2 4.19Å; Q259-Y263 HydrophobicContact CG-CE2 4.09Å; Q259-Y263 WeakPolarHBondContact O-CD2 3.43Å; Q259-Y263 PolarHBondContact O-N 3.29Å
260	A	73	Confident	64.9	Low	53 Å²	53	103 Å²	103	44%	0.438	55%	0.553	S	S	.	*	H	α-helix	trans	-63.3	-40.3	176.9	0	0	0	0	0	112.1	L256 G262 Y263 F264	L256-A260 WeakPolarHBondContact O-CB 3.29Å; L256-A260 PolarHBondContact O-N 3Å; A260-G262 VanDerWaalsContact C-N 3.34Å; A260-Y263 PolarHBondContact O-N 3.35Å; A260-F264 VanDerWaalsContact O-CB 3.29Å; A260-F264 WeakPolarHBondContact O-CB 3.5Å; A260-F264 PolarHBondContact O-N 2.67Å
261	K	74	Confident	65.4	Low	78 Å²	78	99 Å²	99	34%	0.339	53%	0.533	S	S	.	.	H	α-helix	trans	-60.2	-45.2	169.5	-81.9	175.6	172.1	175.7	0	111.2	K257 E258 Q259 Y263 F264 Y265	K257-K261 WeakPolarHBondContact O-CB 3.32Å; K257-K261 WeakPolarHBondContact O-CG 3.31Å; K257-K261 PolarHBondContact O-N 2.9Å; E258-K261 PolarHBondContact O-N 3.15Å; E258-K261 IonicContact OE1-NZ 3.26Å; E258-K261 PolarHBondContact OE1-NZ 3.32Å; E258-K261 WeakPolarHBondContact OE2-CD 3.46Å; E258-K261 IonicContact OE2-NZ 2.7Å; Q259-K261 PolarHBondContact O-N 2.92Å; K261-Y263 VanDerWaalsContact C-N 3.34Å; K261-Y263 PolarHBondContact O-N 3.36Å; K261-F264 PolarHBondContact O-N 3.42Å; K261-Y265 HydrophobicContact CB-CD2 4.07Å; K261-Y265 HydrophobicContact CB-CE2 4.21Å; K261-Y265 HydrophobicContact CG-CD2 4.47Å; K261-Y265 HydrophobicContact CG-CE2 4.1Å; K261-Y265 WeakPolarHBondContact O-CB 3.42Å; K261-Y265 WeakPolarHBondContact O-CD2 3.48Å; K261-Y265 PolarHBondContact O-N 2.85Å
262	G	67	Low	65.9	Low	35 Å²	35	94.2 Å²	94.2	36%	0.361	52%	0.516	S	S	.	.	H	α-helix	trans	-51.1	-54	174.4	0	0	0	0	0	111	E258 Q259 A260 S266	E258-G262 PolarHBondContact O-N 2.93Å; Q259-G262 WeakPolarHBondContact O-CA 3.48Å; Q259-G262 PolarHBondContact O-N 2.99Å; Q259-G262 VanDerWaalsContact O-N 3.11Å; A260-G262 VanDerWaalsContact C-N 3.34Å; G262-S266 WeakPolarHBondContact O-CA 3.41Å; G262-S266 WeakPolarHBondContact O-CB 3.43Å; G262-S266 PolarHBondContact O-N 3.49Å; G262-S266 PolarHBondContact O-OG 2.99Å
263	Y	65.1	Low	66.9	Low	138 Å²	138	95.5 Å²	95.5	54%	0.541	52%	0.517	S	S	.	.	H	α-helix	trans	-61.5	-45.3	176	-85	-79.8	0	0	0	113.1	Q259 A260 K261 Y265 Q267	Q259-Y263 HydrophobicContact CG-CD2 4.19Å; Q259-Y263 HydrophobicContact CG-CE2 4.09Å; Q259-Y263 WeakPolarHBondContact O-CD2 3.43Å; Q259-Y263 PolarHBondContact O-N 3.29Å; A260-Y263 PolarHBondContact O-N 3.35Å; K261-Y263 VanDerWaalsContact C-N 3.34Å; K261-Y263 PolarHBondContact O-N 3.36Å; Y263-Y265 PolarHBondContact O-N 2.96Å; Y263-Q267 HydrophobicContact CD1-CG 4.45Å; Y263-Q267 WeakPolarHBondContact O-CA 3.11Å; Y263-Q267 WeakPolarHBondContact O-CB 3.28Å; Y263-Q267 PolarHBondContact O-N 3.33Å
264	F	64	Low	67.8	Low	149 Å²	149	88.4 Å²	88.4	65%	0.654	48%	0.48	S	S	*	.	H	α-helix	trans	-66	-36.6	-177.1	-168.8	-90.4	0	0	0	113	A260 K261 G268	A260-F264 VanDerWaalsContact O-CB 3.29Å; A260-F264 WeakPolarHBondContact O-CB 3.5Å; A260-F264 PolarHBondContact O-N 2.67Å; K261-F264 PolarHBondContact O-N 3.42Å; F264-G268 WeakPolarHBondContact O-CA 3.31Å; F264-G268 PolarHBondContact O-N 3.1Å
265	Y	64.9	Low	68.8	Low	178 Å²	178	88.1 Å²	88.1	70%	0.698	46%	0.464	S	S	*	.	H	α-helix	trans	-91.4	-34.6	-179.7	-68.8	-65.4	0	0	0	113	K261 Y263	K261-Y265 HydrophobicContact CB-CD2 4.07Å; K261-Y265 HydrophobicContact CB-CE2 4.21Å; K261-Y265 HydrophobicContact CG-CD2 4.47Å; K261-Y265 HydrophobicContact CG-CE2 4.1Å; K261-Y265 WeakPolarHBondContact O-CB 3.42Å; K261-Y265 WeakPolarHBondContact O-CD2 3.48Å; K261-Y265 PolarHBondContact O-N 2.85Å; Y263-Y265 PolarHBondContact O-N 2.96Å
266	S	56.9	Low	69.8	Low	99 Å²	99	82.2 Å²	82.2	69%	0.692	44%	0.437	S	S	*	.	H	α-helix	trans	-84.5	-32.4	-179.5	71	0	0	0	0	113.5	G262	G262-S266 WeakPolarHBondContact O-CA 3.41Å; G262-S266 WeakPolarHBondContact O-CB 3.43Å; G262-S266 PolarHBondContact O-N 3.49Å; G262-S266 PolarHBondContact O-OG 2.99Å
267	Q	54.1	Low	70.2	Confident	113 Å²	113	85.9 Å²	85.9	53%	0.528	45%	0.451	S	S	.	.	S	Bend	trans	-105	15.1	172.1	-59.3	-154.3	-9.8	0	0	112.5	Y263 S269	Y263-Q267 HydrophobicContact CD1-CG 4.45Å; Y263-Q267 WeakPolarHBondContact O-CA 3.11Å; Y263-Q267 WeakPolarHBondContact O-CB 3.28Å; Y263-Q267 PolarHBondContact O-N 3.33Å; Q267-S269 CarbonylContact O-C 3.55Å; Q267-S269 PolarHBondContact O-N 3.46Å
268	G	42.8	Very low	70.8	Confident	50 Å²	50	82.6 Å²	82.6	52%	0.515	44%	0.435	S	S	.	.			trans	-62.8	15.6	-172.2	0	0	0	0	0	118.1	F264	F264-G268 WeakPolarHBondContact O-CA 3.31Å; F264-G268 PolarHBondContact O-N 3.1Å
269	S	50.9	Low	71.4	Confident	86 Å²	86	78.8 Å²	78.8	60%	0.601	42%	0.416	S	S	*	.			trans	-106	100.7	159.6	-62.5	0	0	0	0	107.8	Q267 G271 G272	Q267-S269 CarbonylContact O-C 3.55Å; Q267-S269 PolarHBondContact O-N 3.46Å; S269-G271 PolarHBondContact O-N 2.62Å; S269-G272 PolarHBondContact O-N 3.28Å
270	I	59.2	Low	72	Confident	138 Å²	138	75.7 Å²	75.7	71%	0.708	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.8	-19.9	161.7	-61.6	167.9	0	0	0	110.8	G272 R290	I270-G272 PolarHBondContact O-N 3.23Å; I270-R290 PolarHBondContact O-NE 2.85Å; I270-R290 PolarHBondContact O-NH2 2.84Å
271	G	63.6	Low	72.8	Confident	20 Å²	20	77.4 Å²	77.4	21%	0.206	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-1.7	176.9	0	0	0	0	0	119.8	S269 K275 K287 G288	S269-G271 PolarHBondContact O-N 2.62Å; G271-K275 VanDerWaalsContact CA-NZ 3.27Å; G271-K275 WeakPolarHBondContact O-CE 3.24Å; G271-K275 PolarHBondContact O-NZ 3Å; G271-K287 CarbonylContact C-O 3.53Å; G271-K287 WeakPolarHBondContact CA-O 3.2Å; G271-G288 WeakPolarHBondContact O-CA 3.38Å
272	G	75.9	Confident	73.5	Confident	20 Å²	20	74.7 Å²	74.7	21%	0.206	41%	0.407	C	S	.	.			trans	68.8	174.2	-174.5	0	0	0	0	0	113.2	S269 I270 F289	S269-G272 PolarHBondContact O-N 3.28Å; I270-G272 PolarHBondContact O-N 3.23Å; G272-F289 CarbonylContact C-O 3.57Å; G272-F289 WeakPolarHBondContact CA-O 3.39Å
273	I	86.2	Confident	74.6	Confident	86 Å²	86	74.5 Å²	74.5	44%	0.441	40%	0.397	S	S	.	.	S	Bend	trans	-82.3	-16.1	-178.3	66.1	164.7	0	0	0	113.4	F289 L291	I273-F289 HydrophobicContact CD1-CD1 4.08Å; I273-F289 HydrophobicContact CD1-CE1 4.12Å; I273-F289 HydrophobicContact CG1-CD1 3.72Å; I273-F289 HydrophobicContact CG1-CE1 4.26Å; I273-F289 PolarHBondContact N-O 3.19Å; I273-L291 HydrophobicContact CD1-CD1 4.25Å; I273-L291 HydrophobicContact CD1-CD2 3.76Å; I273-L291 HydrophobicContact CD1-CG 3.95Å
274	A	88.3	Confident	75.5	Confident	5 Å²	5	71 Å²	71	4%	0.041	39%	0.393	C	S	.	.	B	Isolated β-bridge	trans	-151	165	179	0	0	0	0	0	111.3	F289 L316 Q319 V321	A274-F289 HydrophobicContact CB-CB 4.21Å; A274-F289 PolarHBondContact O-N 3.15Å; A274-L316 HydrophobicContact CB-CD2 3.91Å; A274-Q319 HydrophobicContact CB-CB 4.29Å; A274-V321 HydrophobicContact CB-CG2 3.65Å
275	K	89.5	Confident	76.6	Confident	74 Å²	74	72.4 Å²	72.4	32%	0.322	40%	0.395	S	S	.	.			trans	-128.8	136.1	-178.3	-64.5	-62.1	-170.6	-178.8	0	111.3	G271 K277 N283 K287 Q319	G271-K275 VanDerWaalsContact CA-NZ 3.27Å; G271-K275 WeakPolarHBondContact O-CE 3.24Å; G271-K275 PolarHBondContact O-NZ 3Å; K275-K277 PolarHBondContact O-N 2.91Å; K275-K277 VanDerWaalsContact O-N 3.15Å; K275-N283 VanDerWaalsContact CA-OD1 3.31Å; K275-N283 WeakPolarHBondContact CA-OD1 3.49Å; K275-N283 HydrophobicContact CD-CB 4.21Å; K275-N283 WeakPolarHBondContact CD-OD1 3.07Å; K275-K287 PolarHBondContact NZ-O 2.64Å; K275-Q319 PolarHBondContact O-NE2 3.22Å; K275-Q319 PolarHBondContact O-OE1 3.34Å
276	W	91.1	Very high	77.7	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	37%	0.368	C	S	.	.			trans	-71.3	112.1	172.7	-58.9	-82.2	0	0	0	110.3	F279 G280 L282 N283 L286 F289 Y312 D315	W276-F279 HydrophobicContact CB-CB 4.07Å; W276-F279 CarbonylContact O-C 3.57Å; W276-G280 VanDerWaalsContact O-CA 3.31Å; W276-G280 WeakPolarHBondContact O-CA 3.4Å; W276-G280 PolarHBondContact O-N 3.06Å; W276-L282 HydrophobicContact CD2-CB 4.1Å; W276-L282 HydrophobicContact CD2-CD1 4.08Å; W276-L282 HydrophobicContact CE3-CB 3.59Å; W276-L282 HydrophobicContact CE3-CD1 4.38Å; W276-L282 HydrophobicContact CG-CD1 4.13Å; W276-L282 HydrophobicContact CZ3-CB 4.15Å; W276-N283 VanDerWaalsContact CE3-OD1 3.31Å; W276-N283 PolarHBondContact N-ND2 3.2Å; W276-N283 PolarHBondContact N-OD1 3.38Å; W276-N283 PolarHBondContact O-ND2 2.75Å; W276-L286 HydrophobicContact CH2-CB 4.28Å; W276-L286 HydrophobicContact CH2-CD1 3.73Å; W276-L286 HydrophobicContact CZ3-CB 3.96Å; W276-L286 HydrophobicContact CZ3-CD1 3.84Å; W276-L286 HydrophobicContact CZ3-CG 4.41Å; W276-F289 HydrophobicContact CH2-CB 4.05Å; W276-F289 HydrophobicContact CH2-CD2 4.5Å; W276-F289 HydrophobicContact CZ2-CB 3.96Å; W276-F289 AromaticContact CZ2-CD2 3.86Å; W276-F289 HydrophobicContact CZ2-CD2 3.86Å; W276-F289 HydrophobicContact CZ2-CG 4.42Å; W276-Y312 AromaticContact CD1-CD2 3.78Å; W276-Y312 AromaticContact CD1-CE2 3.97Å; W276-Y312 HydrophobicContact CD2-CE2 4.43Å; W276-Y312 AromaticContact CE2-CD2 3.99Å; W276-Y312 AromaticContact CE2-CE2 3.35Å; W276-Y312 AromaticContact CE2-CZ 3.71Å; W276-Y312 AromaticContact CZ2-CE2 3.51Å; W276-Y312 HydrophobicContact CZ2-CE2 3.51Å; W276-Y312 AromaticContact CZ2-CZ 3.57Å; W276-Y312 VanDerWaalsContact CZ2-OH 3.27Å; W276-Y312 WeakPolarHBondContact CZ2-OH 3.32Å; W276-Y312 AromaticContact NE1-CD2 3.23Å; W276-Y312 AromaticContact NE1-CE1 3.88Å; W276-Y312 AromaticContact NE1-CE2 3Å; W276-Y312 AromaticContact NE1-CG 3.79Å; W276-Y312 AromaticContact NE1-CZ 3.36Å; W276-D315 WeakPolarHBondContact CA-OD2 3.3Å
277	K	87.3	Confident	79.1	Confident	128 Å²	128	65.3 Å²	65.3	56%	0.557	36%	0.357	S	S	*	.	S	Bend	trans	-76.1	-43	175	-57.8	179.6	177.9	176	0	111.7	K275 D315	K275-K277 PolarHBondContact O-N 2.91Å; K275-K277 VanDerWaalsContact O-N 3.15Å; K277-D315 VanDerWaalsContact CB-OD1 3.28Å; K277-D315 WeakPolarHBondContact CB-OD1 3.11Å; K277-D315 VanDerWaalsContact N-CG 3.27Å; K277-D315 PolarHBondContact N-OD1 3.38Å; K277-D315 PolarHBondContact N-OD2 3.28Å
278	R	87.3	Confident	80.6	Confident	55 Å²	55	60 Å²	60	21%	0.208	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-39.8	178.6	-66.4	-175.5	-173.4	-179.5	7.4	111.2	D315 Y346	R278-D315 PolarHBondContact N-OD2 3.36Å; R278-Y346 HydrophobicContact CG-CD2 4.09Å; R278-Y346 HydrophobicContact CG-CE2 3.84Å
279	F	87.3	Confident	82.9	Confident	43 Å²	43	57.6 Å²	57.6	19%	0.189	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.2	55.5	179.2	-50.6	-68.6	0	0	0	110.9	W276 V281 L282 F308 E311	W276-F279 HydrophobicContact CB-CB 4.07Å; W276-F279 CarbonylContact O-C 3.57Å; F279-V281 PolarHBondContact O-N 2.7Å; F279-L282 HydrophobicContact CB-CB 4.49Å; F279-L282 HydrophobicContact CB-CD1 3.57Å; F279-L282 HydrophobicContact CB-CG 3.81Å; F279-L282 HydrophobicContact CD2-CD1 4.49Å; F279-L282 HydrophobicContact CG-CD1 4.23Å; F279-L282 WeakPolarHBondContact O-CB 3.34Å; F279-L282 PolarHBondContact O-N 2.85Å; F279-F308 AromaticContact CD1-CE2 3.86Å; F279-F308 HydrophobicContact CD1-CE2 3.86Å; F279-F308 AromaticContact CD2-CE2 3.98Å; F279-F308 HydrophobicContact CD2-CE2 3.98Å; F279-F308 HydrophobicContact CD2-CZ 4.46Å; F279-F308 AromaticContact CE1-CD2 3.88Å; F279-F308 HydrophobicContact CE1-CD2 3.88Å; F279-F308 AromaticContact CE1-CE2 3.64Å; F279-F308 HydrophobicContact CE1-CE2 3.64Å; F279-F308 HydrophobicContact CE2-CD2 4.1Å; F279-F308 AromaticContact CE2-CE2 3.76Å; F279-F308 HydrophobicContact CE2-CE2 3.76Å; F279-F308 HydrophobicContact CE2-CZ 4.48Å; F279-F308 HydrophobicContact CG-CE2 4.03Å; F279-F308 AromaticContact CZ-CD2 3.63Å; F279-F308 HydrophobicContact CZ-CD2 3.63Å; F279-F308 AromaticContact CZ-CE2 3.59Å; F279-F308 HydrophobicContact CZ-CE2 3.59Å; F279-E311 HydrophobicContact CE2-CB 3.88Å; F279-E311 HydrophobicContact CZ-CB 3.88Å
280	G	84.6	Confident	84.7	Confident	41 Å²	41	57.2 Å²	57.2	42%	0.423	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-30.7	-176.1	0	0	0	0	0	114.4	W276 L282 N283	W276-G280 VanDerWaalsContact O-CA 3.31Å; W276-G280 WeakPolarHBondContact O-CA 3.4Å; W276-G280 PolarHBondContact O-N 3.06Å; G280-L282 VanDerWaalsContact C-N 3.29Å; G280-L282 PolarHBondContact O-N 2.84Å; G280-N283 WeakPolarHBondContact O-CB 3.32Å; G280-N283 PolarHBondContact O-N 2.91Å; G280-N283 VanDerWaalsContact O-N 3.16Å; G280-N283 PolarHBondContact O-ND2 3.02Å
281	V	88.2	Confident	86.2	Confident	90 Å²	90	52.8 Å²	52.8	55%	0.545	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-34.4	175	74.1	0	0	0	0	112.9	F279 N283 S284 Y285	F279-V281 PolarHBondContact O-N 2.7Å; V281-N283 PolarHBondContact O-N 3.11Å; V281-S284 PolarHBondContact O-N 3.37Å; V281-S284 PolarHBondContact O-OG 3.16Å; V281-Y285 HydrophobicContact CG2-CD2 4.1Å; V281-Y285 HydrophobicContact CG2-CE2 3.7Å; V281-Y285 WeakPolarHBondContact O-CD2 3.37Å
282	L	89.4	Confident	87.5	Confident	20 Å²	20	52.2 Å²	52.2	11%	0.105	26%	0.264	C	S	.	.	H	α-helix	trans	-61.6	-31.9	177.8	-65.6	179.4	0	0	0	111.6	W276 F279 G280 S284 Y285 L286 F308 Y312 L481	W276-L282 HydrophobicContact CD2-CB 4.1Å; W276-L282 HydrophobicContact CD2-CD1 4.08Å; W276-L282 HydrophobicContact CE3-CB 3.59Å; W276-L282 HydrophobicContact CE3-CD1 4.38Å; W276-L282 HydrophobicContact CG-CD1 4.13Å; W276-L282 HydrophobicContact CZ3-CB 4.15Å; F279-L282 HydrophobicContact CB-CB 4.49Å; F279-L282 HydrophobicContact CB-CD1 3.57Å; F279-L282 HydrophobicContact CB-CG 3.81Å; F279-L282 HydrophobicContact CD2-CD1 4.49Å; F279-L282 HydrophobicContact CG-CD1 4.23Å; F279-L282 WeakPolarHBondContact O-CB 3.34Å; F279-L282 PolarHBondContact O-N 2.85Å; G280-L282 VanDerWaalsContact C-N 3.29Å; G280-L282 PolarHBondContact O-N 2.84Å; L282-S284 PolarHBondContact O-N 3.04Å; L282-Y285 PolarHBondContact O-N 3.11Å; L282-L286 HydrophobicContact CB-CD1 4.3Å; L282-L286 HydrophobicContact CD2-CD1 4.4Å; L282-L286 WeakPolarHBondContact O-CB 3.45Å; L282-L286 WeakPolarHBondContact O-CG 3.43Å; L282-L286 PolarHBondContact O-N 3.44Å; L282-F308 HydrophobicContact CD1-CZ 4.21Å; L282-Y312 HydrophobicContact CD1-CD2 4.45Å; L282-L481 HydrophobicContact CD2-CD2 3.86Å
283	N	89.2	Confident	88.3	Confident	31 Å²	31	52.3 Å²	52.3	17%	0.166	26%	0.26	C	S	.	.	H	α-helix	trans	-66.9	-25	178.4	-59.5	-52.1	0	0	0	112.9	K275 W276 G280 V281 K287	K275-N283 VanDerWaalsContact CA-OD1 3.31Å; K275-N283 WeakPolarHBondContact CA-OD1 3.49Å; K275-N283 HydrophobicContact CD-CB 4.21Å; K275-N283 WeakPolarHBondContact CD-OD1 3.07Å; W276-N283 VanDerWaalsContact CE3-OD1 3.31Å; W276-N283 PolarHBondContact N-ND2 3.2Å; W276-N283 PolarHBondContact N-OD1 3.38Å; W276-N283 PolarHBondContact O-ND2 2.75Å; G280-N283 WeakPolarHBondContact O-CB 3.32Å; G280-N283 PolarHBondContact O-N 2.91Å; G280-N283 VanDerWaalsContact O-N 3.16Å; G280-N283 PolarHBondContact O-ND2 3.02Å; V281-N283 PolarHBondContact O-N 3.11Å; N283-K287 VanDerWaalsContact O-CA 3.22Å; N283-K287 WeakPolarHBondContact O-CA 3.26Å; N283-K287 PolarHBondContact O-N 2.86Å
284	S	84.5	Confident	88.7	Confident	64 Å²	64	48.2 Å²	48.2	45%	0.448	24%	0.239	S	C	.	.	H	α-helix	trans	-75.9	-38.2	178.4	78.6	0	0	0	0	111.2	V281 L282 K287	V281-S284 PolarHBondContact O-N 3.37Å; V281-S284 PolarHBondContact O-OG 3.16Å; L282-S284 PolarHBondContact O-N 3.04Å; S284-K287 PolarHBondContact O-NZ 3.08Å
285	Y	87.3	Confident	88.9	Confident	180 Å²	180	48 Å²	48	71%	0.706	24%	0.237	S	C	*	.	H	α-helix	trans	-80.8	-55.3	179.1	-69.4	-71.1	0	0	0	112.6	V281 L282	V281-Y285 HydrophobicContact CG2-CD2 4.1Å; V281-Y285 HydrophobicContact CG2-CE2 3.7Å; V281-Y285 WeakPolarHBondContact O-CD2 3.37Å; L282-Y285 PolarHBondContact O-N 3.11Å
286	L	88	Confident	89	Confident	24 Å²	24	44.5 Å²	44.5	13%	0.126	22%	0.221	C	C	.	.	H	α-helix	trans	-87.1	-9.6	-172.4	-49.2	-175.1	0	0	0	113	W276 L282 G288 N479 L481	W276-L286 HydrophobicContact CH2-CB 4.28Å; W276-L286 HydrophobicContact CH2-CD1 3.73Å; W276-L286 HydrophobicContact CZ3-CB 3.96Å; W276-L286 HydrophobicContact CZ3-CD1 3.84Å; W276-L286 HydrophobicContact CZ3-CG 4.41Å; L282-L286 HydrophobicContact CB-CD1 4.3Å; L282-L286 HydrophobicContact CD2-CD1 4.4Å; L282-L286 WeakPolarHBondContact O-CB 3.45Å; L282-L286 WeakPolarHBondContact O-CG 3.43Å; L282-L286 PolarHBondContact O-N 3.44Å; L286-G288 PolarHBondContact O-N 3.27Å; L286-N479 HydrophobicContact CD2-CB 4.19Å; L286-L481 HydrophobicContact CD1-CD2 4.47Å
287	K	85.8	Confident	89	Confident	104 Å²	104	44.5 Å²	44.5	45%	0.452	22%	0.221	S	C	.	.			trans	60.5	17.2	-174.4	-54.2	-55.9	-176.9	-159.7	0	114.7	G271 K275 N283 S284 R290	G271-K287 CarbonylContact C-O 3.53Å; G271-K287 WeakPolarHBondContact CA-O 3.2Å; K275-K287 PolarHBondContact NZ-O 2.64Å; N283-K287 VanDerWaalsContact O-CA 3.22Å; N283-K287 WeakPolarHBondContact O-CA 3.26Å; N283-K287 PolarHBondContact O-N 2.86Å; S284-K287 PolarHBondContact O-NZ 3.08Å; K287-R290 VanDerWaalsContact CB-NH2 3.33Å
288	G	86.2	Confident	88.9	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.195	C	C	.	.	S	Bend	trans	106.2	176	175.6	0	0	0	0	0	112.5	G271 L286	G271-G288 WeakPolarHBondContact O-CA 3.38Å; L286-G288 PolarHBondContact O-N 3.27Å
289	F	90.6	Very high	88.5	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.185	C	C	.	.	B	Isolated β-bridge	trans	-81.7	117.7	-175.4	179.6	-95.9	0	0	0	111	G272 I273 A274 W276 L291 L316 V321 H413 H451	G272-F289 CarbonylContact C-O 3.57Å; G272-F289 WeakPolarHBondContact CA-O 3.39Å; I273-F289 HydrophobicContact CD1-CD1 4.08Å; I273-F289 HydrophobicContact CD1-CE1 4.12Å; I273-F289 HydrophobicContact CG1-CD1 3.72Å; I273-F289 HydrophobicContact CG1-CE1 4.26Å; I273-F289 PolarHBondContact N-O 3.19Å; A274-F289 HydrophobicContact CB-CB 4.21Å; A274-F289 PolarHBondContact O-N 3.15Å; W276-F289 HydrophobicContact CH2-CB 4.05Å; W276-F289 HydrophobicContact CH2-CD2 4.5Å; W276-F289 HydrophobicContact CZ2-CB 3.96Å; W276-F289 AromaticContact CZ2-CD2 3.86Å; W276-F289 HydrophobicContact CZ2-CD2 3.86Å; W276-F289 HydrophobicContact CZ2-CG 4.42Å; F289-L291 HydrophobicContact CE1-CD2 4.33Å; F289-L316 HydrophobicContact CB-CD2 3.83Å; F289-L316 HydrophobicContact CD1-CD2 4.38Å; F289-L316 HydrophobicContact CD2-CD1 3.57Å; F289-L316 HydrophobicContact CD2-CD2 3.96Å; F289-L316 HydrophobicContact CD2-CG 4.45Å; F289-L316 HydrophobicContact CE2-CD1 3.53Å; F289-L316 HydrophobicContact CG-CD1 4.19Å; F289-L316 HydrophobicContact CG-CD2 3.8Å; F289-L316 HydrophobicContact CZ-CD1 4.12Å; F289-V321 HydrophobicContact CD1-CG1 4.48Å; F289-V321 HydrophobicContact CE1-CG1 3.8Å; F289-V321 HydrophobicContact CZ-CG1 4.25Å; F289-H413 HydrophobicContact CE1-CB 4.44Å; F289-H413 HydrophobicContact CE2-CB 4.49Å; F289-H413 AromaticContact CE2-CD2 3.78Å; F289-H413 HydrophobicContact CZ-CB 3.67Å; F289-H413 AromaticContact CZ-CD2 3.75Å; F289-H413 AromaticContact CZ-CG 3.67Å; F289-H451 AromaticContact CD2-ND1 3.82Å; F289-H451 HydrophobicContact CE1-CB 4.03Å; F289-H451 HydrophobicContact CE2-CB 3.68Å; F289-H451 AromaticContact CE2-CD2 3.64Å; F289-H451 AromaticContact CE2-CE1 3.92Å; F289-H451 AromaticContact CE2-CG 3.33Å; F289-H451 AromaticContact CE2-ND1 3.51Å; F289-H451 AromaticContact CE2-NE2 4Å; F289-H451 HydrophobicContact CZ-CB 3.29Å; F289-H451 AromaticContact CZ-CG 3.55Å; F289-H451 AromaticContact CZ-ND1 3.96Å
290	R	90.2	Very high	88	Confident	79 Å²	79	35.5 Å²	35.5	30%	0.298	19%	0.189	S	C	.	.			trans	-117	143.6	-175.8	-69.7	163	177.1	175.1	0.3	111.9	I270 K287 E293 H451	I270-R290 PolarHBondContact O-NE 2.85Å; I270-R290 PolarHBondContact O-NH2 2.84Å; K287-R290 VanDerWaalsContact CB-NH2 3.33Å; R290-E293 HydrophobicContact CB-CG 4.09Å; R290-E293 WeakPolarHBondContact CD-OE1 3.48Å; R290-E293 IonicContact NH1-OE1 2.97Å; R290-E293 PolarHBondContact NH1-OE1 2.9Å; R290-H451 PolarHBondContact O-ND1 3.03Å
291	L	90.5	Very high	87.6	Confident	44 Å²	44	39.5 Å²	39.5	23%	0.23	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	151.7	175.8	-63.4	-179.5	0	0	0	110.7	I273 F289 E293 Q412 N449	I273-L291 HydrophobicContact CD1-CD1 4.25Å; I273-L291 HydrophobicContact CD1-CD2 3.76Å; I273-L291 HydrophobicContact CD1-CG 3.95Å; F289-L291 HydrophobicContact CE1-CD2 4.33Å; L291-E293 VanDerWaalsContact C-N 3.26Å; L291-E293 PolarHBondContact O-N 3.11Å; L291-Q412 HydrophobicContact CD2-CB 3.98Å; L291-Q412 HydrophobicContact CD2-CG 4.44Å; L291-Q412 WeakPolarHBondContact CD2-O 3.36Å; L291-N449 WeakPolarHBondContact CB-O 3.19Å; L291-N449 WeakPolarHBondContact CB-OD1 3.27Å
292	G	90.7	Very high	87.1	Confident	9 Å²	9	38.8 Å²	38.8	9%	0.093	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.7	23.2	-179	0	0	0	0	0	114.4	R442 A445 V450	G292-R442 PolarHBondContact O-NH1 3.32Å; G292-R442 PolarHBondContact O-NH2 3.49Å; G292-A445 VanDerWaalsContact CA-O 3.26Å; G292-A445 WeakPolarHBondContact CA-O 2.89Å; G292-V450 WeakPolarHBondContact CA-O 3.49Å; G292-V450 PolarHBondContact N-O 2.85Å
293	E	93	Very high	86.8	Confident	22 Å²	22	38 Å²	38	10%	0.103	21%	0.207	C	C	.	.			trans	-106.2	152.2	170.2	-70.4	-175.7	174.8	0	0	111.3	R290 L291 H451 I452 D478 N479	R290-E293 HydrophobicContact CB-CG 4.09Å; R290-E293 WeakPolarHBondContact CD-OE1 3.48Å; R290-E293 IonicContact NH1-OE1 2.97Å; R290-E293 PolarHBondContact NH1-OE1 2.9Å; L291-E293 VanDerWaalsContact C-N 3.26Å; L291-E293 PolarHBondContact O-N 3.11Å; E293-H451 WeakPolarHBondContact O-CA 3.46Å; E293-I452 PolarHBondContact O-N 3.22Å; E293-D478 WeakPolarHBondContact CA-OD2 3.43Å; E293-D478 HydrophobicContact CB-CB 4.07Å; E293-D478 HydrophobicContact CG-CB 4.08Å; E293-N479 PolarHBondContact OE2-ND2 3.13Å
294	L	93.5	Very high	86.7	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	115.8	170	173.9	59.8	0	0	0	109.6	L296 F438 I441 R442 I452 A477 D478 N479	L294-L296 HydrophobicContact CD1-CD2 4.09Å; L294-L296 HydrophobicContact CG-CD2 4.35Å; L294-F438 HydrophobicContact CD2-CD1 4.41Å; L294-I441 HydrophobicContact CD1-CG2 3.94Å; L294-I441 HydrophobicContact CD2-CG2 4.36Å; L294-R442 HydrophobicContact CD2-CB 4.25Å; L294-I452 CarbonylContact C-O 3.59Å; L294-I452 WeakPolarHBondContact CA-O 3.4Å; L294-I452 HydrophobicContact CD1-CB 4.06Å; L294-I452 HydrophobicContact CD1-CG2 3.9Å; L294-A477 HydrophobicContact CD2-CB 4.48Å; L294-A477 HydrophobicContact CG-CB 4.34Å; L294-D478 PolarHBondContact N-OD2 3.37Å; L294-D478 PolarHBondContact O-N 2.97Å; L294-N479 PolarHBondContact O-N 3.08Å
295	T	93	Very high	86.9	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	130.1	174.5	-61.1	0	0	0	0	110.5	H451 I452 T453 G454 N479 L481	T295-H451 WeakPolarHBondContact CB-NE2 3.25Å; T295-H451 PolarHBondContact OG1-CE1 2.68Å; T295-H451 PolarHBondContact OG1-NE2 3Å; T295-I452 PolarHBondContact N-O 3.45Å; T295-T453 CarbonylContact O-C 3.54Å; T295-T453 VanDerWaalsContact O-CA 3.32Å; T295-T453 WeakPolarHBondContact O-CA 3.38Å; T295-G454 PolarHBondContact O-N 3.42Å; T295-N479 CarbonylContact C-O 3.45Å; T295-N479 WeakPolarHBondContact CA-O 3.37Å; T295-N479 HydrophobicContact CG2-CB 4.01Å; T295-N479 PolarHBondContact OG1-ND2 3.49Å; T295-L481 HydrophobicContact CG2-CD1 4.16Å; T295-L481 HydrophobicContact CG2-CG 4.3Å
296	L	91.1	Very high	87.1	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	132.3	174	-60.1	-177.4	0	0	0	111.2	L294 L419 F438 G454 I461 A477 N479 V480 L481	L294-L296 HydrophobicContact CD1-CD2 4.09Å; L294-L296 HydrophobicContact CG-CD2 4.35Å; L296-L419 HydrophobicContact CD2-CD1 3.56Å; L296-F438 HydrophobicContact CD1-CE1 4.04Å; L296-F438 HydrophobicContact CD2-CE1 3.91Å; L296-G454 CarbonylContact C-O 3.54Å; L296-G454 WeakPolarHBondContact CA-O 3.45Å; L296-I461 HydrophobicContact CB-CD1 4.25Å; L296-A477 HydrophobicContact CD1-CB 3.67Å; L296-A477 HydrophobicContact CG-CB 3.72Å; L296-N479 PolarHBondContact N-O 3.46Å; L296-V480 WeakPolarHBondContact O-CA 3.36Å; L296-L481 PolarHBondContact O-N 3.02Å
297	I	90.9	Very high	87.3	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	114.6	173.5	-59.6	172.2	0	0	0	108.6	K305 F308 A309 T453 G454 A456 L481 L483	I297-K305 HydrophobicContact CG2-CB 4.29Å; I297-F308 HydrophobicContact CD1-CD1 4.06Å; I297-F308 HydrophobicContact CD1-CE1 4.1Å; I297-F308 HydrophobicContact CG2-CD1 4.28Å; I297-A309 HydrophobicContact CD1-CB 3.98Å; I297-T453 HydrophobicContact CD1-CG2 3.58Å; I297-T453 HydrophobicContact CG1-CG2 4.11Å; I297-G454 PolarHBondContact N-O 3.48Å; I297-A456 PolarHBondContact O-N 3.47Å; I297-L481 CarbonylContact C-O 3.54Å; I297-L481 WeakPolarHBondContact CA-O 3.47Å; I297-L481 HydrophobicContact CG1-CB 4.43Å; I297-L481 HydrophobicContact CG1-CD1 4.39Å; I297-L483 HydrophobicContact CG2-CD1 3.77Å
298	G	86.2	Confident	87.6	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	173.9	178.9	0	0	0	0	0	113.8	L481 L483	G298-L481 PolarHBondContact N-O 3.44Å; G298-L483 PolarHBondContact O-N 3.24Å
299	G	78.9	Confident	88	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	147.8	166.4	-179.4	0	0	0	0	0	110.8	K305 L483	G299-K305 PolarHBondContact O-NZ 3.46Å; G299-L483 VanDerWaalsContact CA-O 3.25Å; G299-L483 WeakPolarHBondContact CA-O 3.4Å
300	S	77	Confident	88.2	Confident	38 Å²	38	27.7 Å²	27.7	27%	0.266	17%	0.17	S	C	.	.	S	Bend	trans	-62.9	166.2	178.7	61.6	0	0	0	0	112.4	G302 S303 K305 E458	S300-G302 PolarHBondContact O-N 3.11Å; S300-S303 PolarHBondContact N-OG 2.86Å; S300-S303 VanDerWaalsContact O-CB 3.28Å; S300-S303 WeakPolarHBondContact O-CB 3.13Å; S300-S303 PolarHBondContact O-N 3.16Å; S300-S303 PolarHBondContact O-OG 3.4Å; S300-K305 PolarHBondContact O-NZ 3.49Å; S300-E458 VanDerWaalsContact CA-OE2 3.29Å; S300-E458 WeakPolarHBondContact CA-OE2 3.14Å; S300-E458 WeakPolarHBondContact CB-OE2 3.41Å
301	N	76.1	Confident	88.4	Confident	125 Å²	125	26.9 Å²	26.9	67%	0.668	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.5	130.4	173.6	-77.4	-32.3	0	0	0	110.7	S303 D457	N301-S303 VanDerWaalsContact C-N 3.35Å; N301-D457 PolarHBondContact ND2-OD2 3.16Å; N301-D457 PolarHBondContact OD1-OD1 3.47Å
302	G	76.8	Confident	88.5	Confident	74 Å²	74	24.8 Å²	24.8	76%	0.763	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.8	-0.8	-173.3	0	0	0	0	0	115.7	S300 G304	S300-G302 PolarHBondContact O-N 3.11Å; G302-G304 PolarHBondContact O-N 2.84Å
303	S	83	Confident	88.7	Confident	5 Å²	5	24.3 Å²	24.3	4%	0.035	15%	0.154	C	C	.	.	S	Bend	trans	-66.2	0.2	179.1	57	0	0	0	0	116	S300 N301 K305 L485	S300-S303 PolarHBondContact N-OG 2.86Å; S300-S303 VanDerWaalsContact O-CB 3.28Å; S300-S303 WeakPolarHBondContact O-CB 3.13Å; S300-S303 PolarHBondContact O-N 3.16Å; S300-S303 PolarHBondContact O-OG 3.4Å; N301-S303 VanDerWaalsContact C-N 3.35Å; S303-K305 WeakPolarHBondContact OG-CG 3.42Å; S303-L485 WeakPolarHBondContact O-CD1 3.29Å
304	G	87.2	Confident	88.8	Confident	26 Å²	26	23.3 Å²	23.3	27%	0.268	15%	0.149	S	C	.	.	S	Bend	trans	85.7	14.7	-179.3	0	0	0	0	0	115.5	G302 K306 S307 F308	G302-G304 PolarHBondContact O-N 2.84Å; G304-K306 PolarHBondContact O-N 2.92Å; G304-S307 WeakPolarHBondContact O-CB 3.11Å; G304-S307 PolarHBondContact O-N 3.26Å; G304-F308 PolarHBondContact O-N 3.12Å
305	K	89.7	Confident	88.7	Confident	23 Å²	23	23.3 Å²	23.3	10%	0.1	15%	0.149	C	C	.	.	H	α-helix	trans	-45.1	-53.1	-179.6	-55.9	-171.5	-76	-94	0	114.4	I297 G299 S300 S303 F308 A309 I455 D457 L483	I297-K305 HydrophobicContact CG2-CB 4.29Å; G299-K305 PolarHBondContact O-NZ 3.46Å; S300-K305 PolarHBondContact O-NZ 3.49Å; S303-K305 WeakPolarHBondContact OG-CG 3.42Å; K305-F308 PolarHBondContact O-N 3.35Å; K305-A309 WeakPolarHBondContact O-CB 3.44Å; K305-A309 PolarHBondContact O-N 2.82Å; K305-I455 HydrophobicContact CB-CG2 4.01Å; K305-I455 HydrophobicContact CD-CG2 4.33Å; K305-D457 IonicContact NZ-OD1 3.06Å; K305-L483 HydrophobicContact CB-CD1 4.3Å; K305-L483 HydrophobicContact CG-CD1 4.18Å
306	K	90.9	Very high	88.7	Confident	53 Å²	53	23.3 Å²	23.3	23%	0.23	15%	0.149	C	C	.	.	H	α-helix	trans	-66.9	-42.3	-179.4	-65.6	-179.9	-174.6	174.7	0	111.3	G304 F308 A309 T310 E329 T330 I455	G304-K306 PolarHBondContact O-N 2.92Å; K306-F308 VanDerWaalsContact C-N 3.33Å; K306-F308 PolarHBondContact O-N 3.12Å; K306-A309 PolarHBondContact O-N 3.25Å; K306-T310 WeakPolarHBondContact O-CG2 3.1Å; K306-T310 PolarHBondContact O-N 3.17Å; K306-T310 PolarHBondContact O-OG1 3.47Å; K306-E329 IonicContact NZ-OE1 3.76Å; K306-E329 PolarHBondContact NZ-OE1 3.11Å; K306-E329 IonicContact NZ-OE2 3.25Å; K306-T330 WeakPolarHBondContact CE-OG1 3.42Å; K306-T330 PolarHBondContact NZ-OG1 3.07Å; K306-I455 HydrophobicContact CG-CD1 4.1Å
307	S	91.3	Very high	88.8	Confident	53 Å²	53	23.3 Å²	23.3	37%	0.371	15%	0.149	S	C	.	.	H	α-helix	trans	-63.3	-36.8	177.2	-47.8	0	0	0	0	113	G304 T310 E311 Q342	G304-S307 WeakPolarHBondContact O-CB 3.11Å; G304-S307 PolarHBondContact O-N 3.26Å; S307-T310 WeakPolarHBondContact CA-OG1 3.2Å; S307-T310 PolarHBondContact O-OG1 3.01Å; S307-E311 PolarHBondContact O-N 3.39Å; S307-Q342 PolarHBondContact O-NE2 3.2Å
308	F	93.4	Very high	88.8	Confident	31 Å²	31	25 Å²	25	14%	0.136	16%	0.158	C	C	.	.	H	α-helix	trans	-68.5	-45.3	172.8	172.6	-97.8	0	0	0	111.2	F279 L282 I297 G304 K305 K306 T310 E311 Y312 L481 L483	F279-F308 AromaticContact CD1-CE2 3.86Å; F279-F308 HydrophobicContact CD1-CE2 3.86Å; F279-F308 AromaticContact CD2-CE2 3.98Å; F279-F308 HydrophobicContact CD2-CE2 3.98Å; F279-F308 HydrophobicContact CD2-CZ 4.46Å; F279-F308 AromaticContact CE1-CD2 3.88Å; F279-F308 HydrophobicContact CE1-CD2 3.88Å; F279-F308 AromaticContact CE1-CE2 3.64Å; F279-F308 HydrophobicContact CE1-CE2 3.64Å; F279-F308 HydrophobicContact CE2-CD2 4.1Å; F279-F308 AromaticContact CE2-CE2 3.76Å; F279-F308 HydrophobicContact CE2-CE2 3.76Å; F279-F308 HydrophobicContact CE2-CZ 4.48Å; F279-F308 HydrophobicContact CG-CE2 4.03Å; F279-F308 AromaticContact CZ-CD2 3.63Å; F279-F308 HydrophobicContact CZ-CD2 3.63Å; F279-F308 AromaticContact CZ-CE2 3.59Å; F279-F308 HydrophobicContact CZ-CE2 3.59Å; L282-F308 HydrophobicContact CD1-CZ 4.21Å; I297-F308 HydrophobicContact CD1-CD1 4.06Å; I297-F308 HydrophobicContact CD1-CE1 4.1Å; I297-F308 HydrophobicContact CG2-CD1 4.28Å; G304-F308 PolarHBondContact O-N 3.12Å; K305-F308 PolarHBondContact O-N 3.35Å; K306-F308 VanDerWaalsContact C-N 3.33Å; K306-F308 PolarHBondContact O-N 3.12Å; F308-T310 VanDerWaalsContact C-N 3.29Å; F308-T310 PolarHBondContact O-N 2.76Å; F308-E311 PolarHBondContact O-N 3.36Å; F308-Y312 HydrophobicContact CE1-CD2 4.24Å; F308-Y312 HydrophobicContact CZ-CD2 4.32Å; F308-Y312 VanDerWaalsContact O-CB 3.3Å; F308-Y312 WeakPolarHBondContact O-CB 3.44Å; F308-Y312 PolarHBondContact O-N 2.76Å; F308-L481 HydrophobicContact CE1-CD1 3.86Å; F308-L481 HydrophobicContact CZ-CD1 4.11Å; F308-L483 HydrophobicContact CB-CD1 3.82Å; F308-L483 HydrophobicContact CB-CD2 4.28Å; F308-L483 HydrophobicContact CD1-CD1 4.04Å; F308-L483 HydrophobicContact CD2-CD2 4.28Å; F308-L483 HydrophobicContact CG-CD1 4.02Å; F308-L483 HydrophobicContact CG-CD2 4.14Å
309	A	94.3	Very high	89	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61.2	-35.1	178.6	0	0	0	0	0	112.7	I297 K305 K306 A313 W325 I455	I297-A309 HydrophobicContact CD1-CB 3.98Å; K305-A309 WeakPolarHBondContact O-CB 3.44Å; K305-A309 PolarHBondContact O-N 2.82Å; K306-A309 PolarHBondContact O-N 3.25Å; A309-A313 VanDerWaalsContact O-CB 3.32Å; A309-A313 WeakPolarHBondContact O-CB 3.34Å; A309-A313 PolarHBondContact O-N 3.18Å; A309-W325 HydrophobicContact CB-CH2 3.84Å; A309-I455 HydrophobicContact CB-CD1 3.65Å; A309-I455 HydrophobicContact CB-CG1 4.3Å
310	T	95.2	Very high	89.5	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-66.6	-42.8	175.3	51.8	0	0	0	0	112.1	K306 S307 F308 A313 L314 W325 I335 M338 M339 Q342	K306-T310 WeakPolarHBondContact O-CG2 3.1Å; K306-T310 PolarHBondContact O-N 3.17Å; K306-T310 PolarHBondContact O-OG1 3.47Å; S307-T310 WeakPolarHBondContact CA-OG1 3.2Å; S307-T310 PolarHBondContact O-OG1 3.01Å; F308-T310 VanDerWaalsContact C-N 3.29Å; F308-T310 PolarHBondContact O-N 2.76Å; T310-A313 PolarHBondContact O-N 3.33Å; T310-L314 WeakPolarHBondContact O-CG 3.48Å; T310-L314 PolarHBondContact O-N 2.7Å; T310-W325 HydrophobicContact CG2-CH2 3.49Å; T310-W325 VanDerWaalsContact CG2-CH2 3.49Å; T310-W325 HydrophobicContact CG2-CZ2 4.21Å; T310-W325 HydrophobicContact CG2-CZ3 3.93Å; T310-I335 HydrophobicContact CG2-CG2 4.1Å; T310-M338 HydrophobicContact CG2-CE 4.18Å; T310-M339 HydrophobicContact CG2-CE 3.83Å; T310-M339 HydrophobicContact CG2-CG 3.84Å; T310-Q342 VanDerWaalsContact CB-OE1 3.23Å; T310-Q342 PolarHBondContact OG1-NE2 3.38Å; T310-Q342 PolarHBondContact OG1-OE1 3.37Å
311	E	93.2	Very high	90.2	Very high	61 Å²	61	32 Å²	32	29%	0.285	19%	0.187	S	C	.	.	H	α-helix	trans	-67.8	-40.2	175.1	-63.6	-170.9	-172.8	0	0	112.8	F279 S307 F308 A313 L314 D315 Q342	F279-E311 HydrophobicContact CE2-CB 3.88Å; F279-E311 HydrophobicContact CZ-CB 3.88Å; S307-E311 PolarHBondContact O-N 3.39Å; F308-E311 PolarHBondContact O-N 3.36Å; E311-A313 VanDerWaalsContact C-N 3.28Å; E311-A313 PolarHBondContact O-N 3.17Å; E311-L314 PolarHBondContact O-N 2.83Å; E311-D315 WeakPolarHBondContact O-CB 3.1Å; E311-D315 PolarHBondContact O-N 3.39Å; E311-D315 VanDerWaalsContact O-N 3.1Å; E311-Q342 HydrophobicContact CG-CB 4.39Å; E311-Q342 HydrophobicContact CG-CG 4.11Å; E311-Q342 VanDerWaalsContact CG-NE2 3.31Å; E311-Q342 PolarHBondContact OE1-NE2 2.95Å
312	Y	94	Very high	91.1	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-56.1	-45.4	173.9	174.2	-77.3	0	0	0	110.7	W276 L282 F308 L316 H413 L481	W276-Y312 AromaticContact CD1-CD2 3.78Å; W276-Y312 AromaticContact CD1-CE2 3.97Å; W276-Y312 HydrophobicContact CD2-CE2 4.43Å; W276-Y312 AromaticContact CE2-CD2 3.99Å; W276-Y312 AromaticContact CE2-CE2 3.35Å; W276-Y312 AromaticContact CE2-CZ 3.71Å; W276-Y312 AromaticContact CZ2-CE2 3.51Å; W276-Y312 HydrophobicContact CZ2-CE2 3.51Å; W276-Y312 AromaticContact CZ2-CZ 3.57Å; W276-Y312 VanDerWaalsContact CZ2-OH 3.27Å; W276-Y312 WeakPolarHBondContact CZ2-OH 3.32Å; W276-Y312 AromaticContact NE1-CD2 3.23Å; W276-Y312 AromaticContact NE1-CE1 3.88Å; W276-Y312 AromaticContact NE1-CE2 3Å; W276-Y312 AromaticContact NE1-CG 3.79Å; W276-Y312 AromaticContact NE1-CZ 3.36Å; L282-Y312 HydrophobicContact CD1-CD2 4.45Å; F308-Y312 HydrophobicContact CE1-CD2 4.24Å; F308-Y312 HydrophobicContact CZ-CD2 4.32Å; F308-Y312 VanDerWaalsContact O-CB 3.3Å; F308-Y312 WeakPolarHBondContact O-CB 3.44Å; F308-Y312 PolarHBondContact O-N 2.76Å; Y312-L316 HydrophobicContact CD1-CD1 3.96Å; Y312-L316 HydrophobicContact CE1-CD1 3.48Å; Y312-L316 VanDerWaalsContact CE1-CD1 3.48Å; Y312-L316 WeakPolarHBondContact O-CG 3.45Å; Y312-L316 PolarHBondContact O-N 3.22Å; Y312-H413 AromaticContact CE1-CE1 3.65Å; Y312-H413 AromaticContact CE1-NE2 3.78Å; Y312-L481 HydrophobicContact CE2-CD1 4.47Å
313	A	95	Very high	92.1	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-68.8	-44.3	179.8	0	0	0	0	0	112.2	A309 T310 E311 D315 L316 C317 W325 M339 M386 I415	A309-A313 VanDerWaalsContact O-CB 3.32Å; A309-A313 WeakPolarHBondContact O-CB 3.34Å; A309-A313 PolarHBondContact O-N 3.18Å; T310-A313 PolarHBondContact O-N 3.33Å; E311-A313 VanDerWaalsContact C-N 3.28Å; E311-A313 PolarHBondContact O-N 3.17Å; A313-D315 VanDerWaalsContact C-N 3.27Å; A313-D315 PolarHBondContact O-N 3.14Å; A313-L316 PolarHBondContact O-N 2.79Å; A313-C317 PolarHBondContact O-N 2.93Å; A313-C317 PolarHBondContact O-SG 3.04Å; A313-C317 VanDerWaalsContact O-SG 3.4Å; A313-W325 HydrophobicContact CB-CE3 4.39Å; A313-W325 HydrophobicContact CB-CZ3 4.01Å; A313-M339 HydrophobicContact CB-CE 4.28Å; A313-M386 HydrophobicContact CB-CE 3.78Å; A313-I415 HydrophobicContact CB-CD1 3.44Å; A313-I415 VanDerWaalsContact CB-CD1 3.44Å
314	L	93.7	Very high	92.8	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-57.3	-41.3	177.7	-77	170.2	0	0	0	112	T310 E311 L316 C317 L318 M339 Q342 F343 M381 L384	T310-L314 WeakPolarHBondContact O-CG 3.48Å; T310-L314 PolarHBondContact O-N 2.7Å; E311-L314 PolarHBondContact O-N 2.83Å; L314-L316 VanDerWaalsContact C-N 3.33Å; L314-L316 PolarHBondContact O-N 2.95Å; L314-C317 PolarHBondContact O-N 3.14Å; L314-L318 WeakPolarHBondContact O-CB 3.34Å; L314-L318 VanDerWaalsContact O-CG 3.29Å; L314-L318 WeakPolarHBondContact O-CG 3.42Å; L314-L318 PolarHBondContact O-N 3.32Å; L314-M339 HydrophobicContact CD1-CB 4.36Å; L314-M339 HydrophobicContact CD1-CG 4.48Å; L314-M339 HydrophobicContact CD2-CB 4.48Å; L314-Q342 HydrophobicContact CD1-CB 3.98Å; L314-F343 HydrophobicContact CD1-CB 4.33Å; L314-F343 HydrophobicContact CD2-CB 4.4Å; L314-F343 HydrophobicContact CD2-CD2 4.3Å; L314-M381 HydrophobicContact CD2-CG 4.45Å; L314-M381 HydrophobicContact CD2-SD 4.33Å; L314-L384 HydrophobicContact CD2-CD1 3.99Å
315	D	91.3	Very high	93.2	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-64.5	-36.8	179.9	-158.9	12.4	0	0	0	112.6	W276 K277 R278 E311 A313 Q319	W276-D315 WeakPolarHBondContact CA-OD2 3.3Å; K277-D315 VanDerWaalsContact CB-OD1 3.28Å; K277-D315 WeakPolarHBondContact CB-OD1 3.11Å; K277-D315 VanDerWaalsContact N-CG 3.27Å; K277-D315 PolarHBondContact N-OD1 3.38Å; K277-D315 PolarHBondContact N-OD2 3.28Å; R278-D315 PolarHBondContact N-OD2 3.36Å; E311-D315 WeakPolarHBondContact O-CB 3.1Å; E311-D315 PolarHBondContact O-N 3.39Å; E311-D315 VanDerWaalsContact O-N 3.1Å; A313-D315 VanDerWaalsContact C-N 3.27Å; A313-D315 PolarHBondContact O-N 3.14Å; D315-Q319 PolarHBondContact O-NE2 3.21Å
316	L	93.1	Very high	93.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-73.1	-42.8	174.4	-64.2	175.8	0	0	0	111.8	A274 F289 Y312 A313 L314 L318 Q319 Q320 V321	A274-L316 HydrophobicContact CB-CD2 3.91Å; F289-L316 HydrophobicContact CB-CD2 3.83Å; F289-L316 HydrophobicContact CD1-CD2 4.38Å; F289-L316 HydrophobicContact CD2-CD1 3.57Å; F289-L316 HydrophobicContact CD2-CD2 3.96Å; F289-L316 HydrophobicContact CD2-CG 4.45Å; F289-L316 HydrophobicContact CE2-CD1 3.53Å; F289-L316 HydrophobicContact CG-CD1 4.19Å; F289-L316 HydrophobicContact CG-CD2 3.8Å; F289-L316 HydrophobicContact CZ-CD1 4.12Å; Y312-L316 HydrophobicContact CD1-CD1 3.96Å; Y312-L316 HydrophobicContact CE1-CD1 3.48Å; Y312-L316 VanDerWaalsContact CE1-CD1 3.48Å; Y312-L316 WeakPolarHBondContact O-CG 3.45Å; Y312-L316 PolarHBondContact O-N 3.22Å; A313-L316 PolarHBondContact O-N 2.79Å; L314-L316 VanDerWaalsContact C-N 3.33Å; L314-L316 PolarHBondContact O-N 2.95Å; L316-L318 VanDerWaalsContact C-N 3.3Å; L316-L318 PolarHBondContact O-N 3.28Å; L316-Q319 CarbonylContact O-C 3.59Å; L316-Q319 WeakPolarHBondContact O-CA 3.28Å; L316-Q319 WeakPolarHBondContact O-CB 3.32Å; L316-Q319 PolarHBondContact O-N 2.99Å; L316-Q320 PolarHBondContact O-N 3.5Å; L316-V321 HydrophobicContact CB-CB 4.03Å; L316-V321 HydrophobicContact CB-CG1 4.46Å; L316-V321 HydrophobicContact CB-CG2 4.22Å; L316-V321 WeakPolarHBondContact O-CB 3.5Å; L316-V321 WeakPolarHBondContact O-CG2 3.46Å; L316-V321 PolarHBondContact O-N 2.63Å; L316-V321 VanDerWaalsContact O-N 3.16Å
317	C	93.4	Very high	93.5	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-63.2	-35.5	177	-71.1	0	0	0	0	112.5	A313 L314 Q319 Q320 T323 L384 M386	A313-C317 PolarHBondContact O-N 2.93Å; A313-C317 PolarHBondContact O-SG 3.04Å; A313-C317 VanDerWaalsContact O-SG 3.4Å; L314-C317 PolarHBondContact O-N 3.14Å; C317-Q319 PolarHBondContact O-N 2.81Å; C317-Q319 VanDerWaalsContact O-N 3.15Å; C317-Q320 WeakPolarHBondContact O-CA 3.33Å; C317-Q320 PolarHBondContact O-N 3.11Å; C317-T323 PolarHBondContact SG-OG1 3.43Å; C317-L384 HydrophobicContact CB-CB 4.15Å; C317-L384 HydrophobicContact CB-CD1 4.35Å; C317-M386 WeakPolarHBondContact SG-CE 3.23Å
318	L	90.4	Very high	93.3	Very high	36 Å²	36	21.5 Å²	21.5	19%	0.188	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-18.4	171.7	-80.2	167	0	0	0	113.4	L314 L316 F343 Y346 F354 L384	L314-L318 WeakPolarHBondContact O-CB 3.34Å; L314-L318 VanDerWaalsContact O-CG 3.29Å; L314-L318 WeakPolarHBondContact O-CG 3.42Å; L314-L318 PolarHBondContact O-N 3.32Å; L316-L318 VanDerWaalsContact C-N 3.3Å; L316-L318 PolarHBondContact O-N 3.28Å; L318-F343 HydrophobicContact CD2-CE2 4.16Å; L318-Y346 HydrophobicContact CD1-CD1 4.17Å; L318-Y346 HydrophobicContact CD1-CE1 3.74Å; L318-F354 HydrophobicContact CD2-CZ 4.12Å; L318-L384 HydrophobicContact CD2-CD2 4.07Å; L318-L384 HydrophobicContact CG-CD2 4.4Å
319	Q	90.2	Very high	92.8	Very high	56 Å²	56	24.5 Å²	24.5	26%	0.262	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	19.6	173.3	-71.6	164.6	91.1	0	0	112.5	A274 K275 D315 L316 C317 V321	A274-Q319 HydrophobicContact CB-CB 4.29Å; K275-Q319 PolarHBondContact O-NE2 3.22Å; K275-Q319 PolarHBondContact O-OE1 3.34Å; D315-Q319 PolarHBondContact O-NE2 3.21Å; L316-Q319 CarbonylContact O-C 3.59Å; L316-Q319 WeakPolarHBondContact O-CA 3.28Å; L316-Q319 WeakPolarHBondContact O-CB 3.32Å; L316-Q319 PolarHBondContact O-N 2.99Å; C317-Q319 PolarHBondContact O-N 2.81Å; C317-Q319 VanDerWaalsContact O-N 3.15Å; Q319-V321 VanDerWaalsContact C-N 3.29Å; Q319-V321 PolarHBondContact O-N 3.13Å
320	Q	90.6	Very high	92.5	Very high	126 Å²	126	24.9 Å²	24.9	59%	0.589	11%	0.113	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.5	23.5	176.6	-55.5	-63	-44.6	0	0	114.7	L316 C317 R322	L316-Q320 PolarHBondContact O-N 3.5Å; C317-Q320 WeakPolarHBondContact O-CA 3.33Å; C317-Q320 PolarHBondContact O-N 3.11Å; Q320-R322 PolarHBondContact O-N 2.77Å
321	V	91.9	Very high	92.2	Very high	3 Å²	3	28.9 Å²	28.9	2%	0.018	14%	0.139	C	C	.	.			trans	-77.8	114.1	172.1	-178.3	0	0	0	0	109.5	A274 F289 L316 Q319 T323 Q412 H413	A274-V321 HydrophobicContact CB-CG2 3.65Å; F289-V321 HydrophobicContact CD1-CG1 4.48Å; F289-V321 HydrophobicContact CE1-CG1 3.8Å; F289-V321 HydrophobicContact CZ-CG1 4.25Å; L316-V321 HydrophobicContact CB-CB 4.03Å; L316-V321 HydrophobicContact CB-CG1 4.46Å; L316-V321 HydrophobicContact CB-CG2 4.22Å; L316-V321 WeakPolarHBondContact O-CB 3.5Å; L316-V321 WeakPolarHBondContact O-CG2 3.46Å; L316-V321 PolarHBondContact O-N 2.63Å; L316-V321 VanDerWaalsContact O-N 3.16Å; Q319-V321 VanDerWaalsContact C-N 3.29Å; Q319-V321 PolarHBondContact O-N 3.13Å; V321-T323 PolarHBondContact O-N 3.47Å; V321-T323 VanDerWaalsContact O-N 3.15Å; V321-T323 PolarHBondContact O-OG1 3.42Å; V321-T323 VanDerWaalsContact O-OG1 3.12Å; V321-Q412 HydrophobicContact CG1-CB 4.04Å; V321-H413 HydrophobicContact CG1-CB 3.93Å
322	R	95.1	Very high	92.2	Very high	124 Å²	124	28 Å²	28	47%	0.468	14%	0.138	S	C	.	.			trans	-64.8	113.1	177.8	-69	-178.1	-67.7	161.4	4.3	110.5	Q320 P385 S410 Q412 H413	Q320-R322 PolarHBondContact O-N 2.77Å; R322-P385 HydrophobicContact CG-CB 4.05Å; R322-S410 PolarHBondContact NH1-O 3.03Å; R322-S410 PolarHBondContact NH2-O 3.17Å; R322-Q412 PolarHBondContact O-N 2.92Å; R322-H413 PolarHBondContact O-N 3.17Å
323	T	96.9	Very high	92	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.006	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	129.3	-172.8	-59.5	0	0	0	0	111.4	C317 V321 P385 M386 Q387 H413 I415	C317-T323 PolarHBondContact SG-OG1 3.43Å; V321-T323 PolarHBondContact O-N 3.47Å; V321-T323 VanDerWaalsContact O-N 3.15Å; V321-T323 PolarHBondContact O-OG1 3.42Å; V321-T323 VanDerWaalsContact O-OG1 3.12Å; T323-P385 PolarHBondContact N-O 3.35Å; T323-M386 HydrophobicContact CG2-CE 4.26Å; T323-M386 HydrophobicContact CG2-SD 3.66Å; T323-M386 WeakPolarHBondContact O-CA 3.41Å; T323-Q387 PolarHBondContact O-N 3.3Å; T323-H413 CarbonylContact C-O 3.52Å; T323-H413 WeakPolarHBondContact CA-O 3.17Å; T323-H413 HydrophobicContact CG2-CB 4.24Å; T323-H413 VanDerWaalsContact CG2-ND1 3.3Å; T323-H413 WeakPolarHBondContact CG2-ND1 3.42Å; T323-H413 PolarHBondContact OG1-ND1 3.41Å; T323-I415 HydrophobicContact CG2-CD1 3.97Å; T323-I415 HydrophobicContact CG2-CG1 4.32Å
324	L	97.1	Very high	91.8	Very high	3 Å²	3	38.6 Å²	38.6	2%	0.016	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	128	169.5	-178.4	65.5	0	0	0	109.9	Q387 V389 I406 Q409 V411 H413 A414 I415	L324-Q387 CarbonylContact C-O 3.5Å; L324-Q387 WeakPolarHBondContact CA-O 3.06Å; L324-Q387 HydrophobicContact CD1-CB 3.81Å; L324-V389 HydrophobicContact CD1-CB 4.33Å; L324-V389 HydrophobicContact CD1-CG1 4.06Å; L324-V389 HydrophobicContact CD2-CG1 4.28Å; L324-V389 HydrophobicContact CG-CG1 4.21Å; L324-I406 HydrophobicContact CD2-CG1 4.12Å; L324-Q409 HydrophobicContact CD1-CG 4.27Å; L324-Q409 HydrophobicContact CD2-CB 4.17Å; L324-Q409 HydrophobicContact CD2-CG 3.88Å; L324-V411 HydrophobicContact CB-CB 4.34Å; L324-V411 HydrophobicContact CB-CG1 3.88Å; L324-V411 HydrophobicContact CB-CG2 3.93Å; L324-H413 PolarHBondContact N-O 3.46Å; L324-A414 CarbonylContact O-C 3.6Å; L324-A414 WeakPolarHBondContact O-CA 3.15Å; L324-I415 PolarHBondContact O-N 2.95Å
325	W	96.4	Very high	91.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	113	171.4	-163.4	-63.8	0	0	0	110.7	A309 T310 A313 C327 I335 M339 Q387 F388 V389 I415	A309-W325 HydrophobicContact CB-CH2 3.84Å; T310-W325 HydrophobicContact CG2-CH2 3.49Å; T310-W325 VanDerWaalsContact CG2-CH2 3.49Å; T310-W325 HydrophobicContact CG2-CZ2 4.21Å; T310-W325 HydrophobicContact CG2-CZ3 3.93Å; A313-W325 HydrophobicContact CB-CE3 4.39Å; A313-W325 HydrophobicContact CB-CZ3 4.01Å; W325-C327 PolarHBondContact O-N 2.73Å; W325-I335 HydrophobicContact CD2-CG2 3.98Å; W325-I335 HydrophobicContact CE3-CG2 4.36Å; W325-I335 HydrophobicContact CG-CG2 4.44Å; W325-I335 HydrophobicContact CH2-CG2 4.42Å; W325-I335 HydrophobicContact CZ2-CD1 4.01Å; W325-I335 HydrophobicContact CZ2-CG2 4.04Å; W325-M339 HydrophobicContact CD2-CE 4.14Å; W325-M339 HydrophobicContact CE3-CE 3.21Å; W325-M339 HydrophobicContact CH2-CE 4.11Å; W325-M339 HydrophobicContact CZ3-CE 3.2Å; W325-Q387 PolarHBondContact N-O 3.18Å; W325-F388 HydrophobicContact CB-CD1 3.65Å; W325-F388 HydrophobicContact CB-CE1 3.97Å; W325-F388 HydrophobicContact CB-CG 4.5Å; W325-F388 HydrophobicContact CG-CD1 4.12Å; W325-F388 HydrophobicContact CG-CE1 4.28Å; W325-F388 WeakPolarHBondContact O-CA 3.4Å; W325-V389 PolarHBondContact O-N 3.38Å; W325-I415 HydrophobicContact CD2-CB 4.18Å; W325-I415 HydrophobicContact CD2-CD1 4.29Å; W325-I415 HydrophobicContact CD2-CG2 4.01Å; W325-I415 HydrophobicContact CE3-CB 4.13Å; W325-I415 HydrophobicContact CE3-CD1 3.4Å; W325-I415 VanDerWaalsContact CE3-CD1 3.4Å; W325-I415 HydrophobicContact CE3-CG1 4.36Å; W325-I415 HydrophobicContact CE3-CG2 4.07Å; W325-I415 HydrophobicContact CH2-CD1 4.39Å; W325-I415 HydrophobicContact CH2-CG2 4.14Å; W325-I415 HydrophobicContact CZ2-CG2 4.08Å; W325-I415 HydrophobicContact CZ3-CD1 3.46Å; W325-I415 VanDerWaalsContact CZ3-CD1 3.46Å; W325-I415 HydrophobicContact CZ3-CG2 4.13Å
326	C	95	Very high	91.8	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	101.5	176.4	-60.5	0	0	0	0	110.1	L328 V389 F391 L402 I415 D417	C326-L328 PolarHBondContact O-N 2.96Å; C326-V389 HydrophobicContact CB-CG1 4.13Å; C326-F391 HydrophobicContact CB-CE2 3.95Å; C326-L402 HydrophobicContact CB-CD1 3.84Å; C326-I415 WeakPolarHBondContact CA-O 3.44Å; C326-I415 VanDerWaalsContact CB-O 3.29Å; C326-I415 WeakPolarHBondContact CB-O 3.36Å; C326-I415 PolarHBondContact N-O 3.02Å; C326-D417 PolarHBondContact O-N 2.89Å
327	C	91.9	Very high	91.7	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.007	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	99.5	177.4	-72	0	0	0	0	110.4	W325 T330 V332 V389 F391	W325-C327 PolarHBondContact O-N 2.73Å; C327-T330 WeakPolarHBondContact CB-O 3.28Å; C327-V332 HydrophobicContact CB-CG2 4.02Å; C327-V389 WeakPolarHBondContact CB-O 3.4Å; C327-V389 PolarHBondContact N-O 2.88Å; C327-F391 PolarHBondContact O-N 2.84Å
328	L	87.5	Confident	91.6	Very high	9 Å²	9	43.4 Å²	43.4	5%	0.047	23%	0.226	C	C	.	.	S	Bend	trans	-94.9	-30.2	175	-60.7	174	0	0	0	112.4	C326 F391 T393 T397 I416 D417 N418 A421 V422	C326-L328 PolarHBondContact O-N 2.96Å; L328-F391 HydrophobicContact CD2-CB 3.77Å; L328-F391 HydrophobicContact CD2-CD1 4.45Å; L328-F391 HydrophobicContact CD2-CD2 3.46Å; L328-F391 VanDerWaalsContact CD2-CD2 3.46Å; L328-F391 HydrophobicContact CD2-CE2 4.15Å; L328-F391 HydrophobicContact CD2-CG 3.63Å; L328-F391 HydrophobicContact CG-CD2 4.37Å; L328-T393 WeakPolarHBondContact O-CG2 3.29Å; L328-T397 HydrophobicContact CD2-CG2 4.25Å; L328-T397 WeakPolarHBondContact CD2-OG1 3.33Å; L328-I416 HydrophobicContact CD1-CG2 3.62Å; L328-D417 WeakPolarHBondContact CA-OD1 3.23Å; L328-D417 WeakPolarHBondContact CB-OD1 3.42Å; L328-D417 PolarHBondContact N-OD1 3.25Å; L328-N418 WeakPolarHBondContact CD1-O 3.42Å; L328-A421 HydrophobicContact CB-CB 3.64Å; L328-A421 HydrophobicContact CD1-CB 4.08Å; L328-A421 HydrophobicContact CG-CB 4.46Å; L328-V422 HydrophobicContact CD1-CG2 3.95Å
329	E	83.2	Confident	91.8	Very high	94 Å²	94	41.7 Å²	41.7	44%	0.439	22%	0.217	S	C	.	.	S	Bend	trans	-121.3	-43.6	-177.5	-174.2	-159.5	122.5	0	0	112.2	K306 D417 N418	K306-E329 IonicContact NZ-OE1 3.76Å; K306-E329 PolarHBondContact NZ-OE1 3.11Å; K306-E329 IonicContact NZ-OE2 3.25Å; E329-D417 PolarHBondContact N-OD1 3.16Å; E329-D417 PolarHBondContact N-OD2 3.19Å; E329-N418 HydrophobicContact CB-CB 4.22Å; E329-N418 PolarHBondContact OE2-ND2 2.56Å
330	T	87.3	Confident	91.8	Very high	7 Å²	7	39.2 Å²	39.2	4%	0.043	21%	0.205	C	C	.	.	S	Bend	trans	-91.1	127.7	-170.6	-38.7	0	0	0	0	110.7	K306 C327 V332 R334 I335 D417	K306-T330 WeakPolarHBondContact CE-OG1 3.42Å; K306-T330 PolarHBondContact NZ-OG1 3.07Å; C327-T330 WeakPolarHBondContact CB-O 3.28Å; T330-V332 PolarHBondContact O-N 2.94Å; T330-R334 HydrophobicContact CG2-CB 4.27Å; T330-R334 HydrophobicContact CG2-CG 4.35Å; T330-I335 HydrophobicContact CG2-CD1 3.66Å; T330-I335 HydrophobicContact CG2-CG1 3.91Å; T330-D417 WeakPolarHBondContact CB-OD2 3.14Å; T330-D417 PolarHBondContact N-OD2 3.47Å; T330-D417 PolarHBondContact OG1-OD2 3Å
331	P	89.8	Confident	91.6	Very high	84 Å²	84	37.7 Å²	37.7	55%	0.545	20%	0.198	S	C	.	.			trans	-55.7	135.1	175.1	-25.7	34.1	0	0	0	111.9	G333 R334 I335	P331-G333 PolarHBondContact O-N 3.5Å; P331-R334 WeakPolarHBondContact O-CB 3.46Å; P331-R334 PolarHBondContact O-N 3.11Å; P331-I335 PolarHBondContact O-N 3.21Å
332	V	91.8	Very high	91.5	Very high	42 Å²	42	38.8 Å²	38.8	26%	0.255	20%	0.203	S	C	.	.	H	α-helix	trans	-52	-43.7	-178	176.3	0	0	0	0	111.6	C327 T330 R334 I335 A336 F388	C327-V332 HydrophobicContact CB-CG2 4.02Å; T330-V332 PolarHBondContact O-N 2.94Å; V332-R334 PolarHBondContact O-N 2.98Å; V332-I335 PolarHBondContact O-N 3.07Å; V332-I335 VanDerWaalsContact O-N 3.12Å; V332-A336 WeakPolarHBondContact O-CB 3.47Å; V332-A336 PolarHBondContact O-N 3.15Å; V332-F388 HydrophobicContact CG1-CB 3.67Å; V332-F388 HydrophobicContact CG1-CD1 4.14Å; V332-F388 HydrophobicContact CG1-CG 3.86Å; V332-F388 HydrophobicContact CG2-CB 4.37Å
333	G	90.5	Very high	91.1	Very high	56 Å²	56	33 Å²	33	58%	0.577	18%	0.181	S	C	*	.	H	α-helix	trans	-58.8	-31.6	179.4	0	0	0	0	0	114.1	P331 S337	P331-G333 PolarHBondContact O-N 3.5Å; G333-S337 WeakPolarHBondContact O-CB 3.44Å; G333-S337 PolarHBondContact O-N 3.5Å; G333-S337 PolarHBondContact O-OG 3.23Å
334	R	91.3	Very high	90.6	Very high	167 Å²	167	33.3 Å²	33.3	63%	0.63	18%	0.184	S	C	*	.	H	α-helix	trans	-75.1	-37.6	177.2	-175.6	175.8	-177.9	168.8	2.8	112.2	T330 P331 V332 S337 M338	T330-R334 HydrophobicContact CG2-CB 4.27Å; T330-R334 HydrophobicContact CG2-CG 4.35Å; P331-R334 WeakPolarHBondContact O-CB 3.46Å; P331-R334 PolarHBondContact O-N 3.11Å; V332-R334 PolarHBondContact O-N 2.98Å; R334-S337 PolarHBondContact O-OG 2.98Å; R334-S337 VanDerWaalsContact O-OG 3.06Å; R334-M338 WeakPolarHBondContact O-CG 3.32Å; R334-M338 PolarHBondContact O-N 3.3Å
335	I	93.3	Very high	89.8	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-67.5	-45.7	174.3	-62.2	-60.8	0	0	0	109.9	T310 W325 T330 P331 V332 S337 M338 M339 F388	T310-I335 HydrophobicContact CG2-CG2 4.1Å; W325-I335 HydrophobicContact CD2-CG2 3.98Å; W325-I335 HydrophobicContact CE3-CG2 4.36Å; W325-I335 HydrophobicContact CG-CG2 4.44Å; W325-I335 HydrophobicContact CH2-CG2 4.42Å; W325-I335 HydrophobicContact CZ2-CD1 4.01Å; W325-I335 HydrophobicContact CZ2-CG2 4.04Å; T330-I335 HydrophobicContact CG2-CD1 3.66Å; T330-I335 HydrophobicContact CG2-CG1 3.91Å; P331-I335 PolarHBondContact O-N 3.21Å; V332-I335 PolarHBondContact O-N 3.07Å; V332-I335 VanDerWaalsContact O-N 3.12Å; I335-S337 PolarHBondContact O-N 2.82Å; I335-M338 PolarHBondContact O-N 3.09Å; I335-M339 HydrophobicContact CG2-CE 3.93Å; I335-M339 HydrophobicContact CG2-SD 4.26Å; I335-M339 WeakPolarHBondContact O-CG 3.42Å; I335-M339 PolarHBondContact O-N 3.19Å; I335-F388 HydrophobicContact CG2-CD1 4.49Å; I335-F388 HydrophobicContact CG2-CE1 3.83Å
336	A	91.9	Very high	89.1	Confident	10 Å²	10	41.1 Å²	41.1	8%	0.083	22%	0.217	C	C	.	.	H	α-helix	trans	-60.7	-45.1	178.8	0	0	0	0	0	111.9	V332 M338 M339 V340	V332-A336 WeakPolarHBondContact O-CB 3.47Å; V332-A336 PolarHBondContact O-N 3.15Å; A336-M338 PolarHBondContact O-N 3.44Å; A336-M339 PolarHBondContact O-N 3.49Å; A336-V340 VanDerWaalsContact O-CG2 3.29Å; A336-V340 WeakPolarHBondContact O-CG2 3.43Å; A336-V340 PolarHBondContact O-N 3.21Å
337	S	90.1	Very high	88.2	Confident	53 Å²	53	41.2 Å²	41.2	37%	0.371	22%	0.217	S	C	.	.	H	α-helix	trans	-62.3	-42	178.7	66.4	0	0	0	0	112.7	G333 R334 I335 M339 V340 E341	G333-S337 WeakPolarHBondContact O-CB 3.44Å; G333-S337 PolarHBondContact O-N 3.5Å; G333-S337 PolarHBondContact O-OG 3.23Å; R334-S337 PolarHBondContact O-OG 2.98Å; R334-S337 VanDerWaalsContact O-OG 3.06Å; I335-S337 PolarHBondContact O-N 2.82Å; S337-M339 PolarHBondContact O-N 3.04Å; S337-V340 PolarHBondContact O-N 2.99Å; S337-E341 PolarHBondContact O-N 2.92Å; S337-E341 VanDerWaalsContact O-N 3.08Å
338	M	91.5	Very high	87.2	Confident	39 Å²	39	44.5 Å²	44.5	19%	0.192	23%	0.229	C	C	.	.	H	α-helix	trans	-60.2	-44	173.6	-73.5	172.4	48.8	0	0	111.9	T310 R334 I335 A336 E341 Q342	T310-M338 HydrophobicContact CG2-CE 4.18Å; R334-M338 WeakPolarHBondContact O-CG 3.32Å; R334-M338 PolarHBondContact O-N 3.3Å; I335-M338 PolarHBondContact O-N 3.09Å; A336-M338 PolarHBondContact O-N 3.44Å; M338-E341 PolarHBondContact O-N 2.9Å; M338-Q342 WeakPolarHBondContact O-CB 3.39Å; M338-Q342 VanDerWaalsContact O-CG 3.31Å; M338-Q342 WeakPolarHBondContact O-CG 3.39Å; M338-Q342 PolarHBondContact O-N 2.87Å
339	M	93.7	Very high	86.3	Confident	1 Å²	1	47 Å²	47	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-64.6	-42.9	179.2	-75.2	-175.8	172.7	0	0	112.3	T310 A313 L314 W325 I335 A336 S337 E341 Q342 F343 M381 M386 F388	T310-M339 HydrophobicContact CG2-CE 3.83Å; T310-M339 HydrophobicContact CG2-CG 3.84Å; A313-M339 HydrophobicContact CB-CE 4.28Å; L314-M339 HydrophobicContact CD1-CB 4.36Å; L314-M339 HydrophobicContact CD1-CG 4.48Å; L314-M339 HydrophobicContact CD2-CB 4.48Å; W325-M339 HydrophobicContact CD2-CE 4.14Å; W325-M339 HydrophobicContact CE3-CE 3.21Å; W325-M339 HydrophobicContact CH2-CE 4.11Å; W325-M339 HydrophobicContact CZ3-CE 3.2Å; I335-M339 HydrophobicContact CG2-CE 3.93Å; I335-M339 HydrophobicContact CG2-SD 4.26Å; I335-M339 WeakPolarHBondContact O-CG 3.42Å; I335-M339 PolarHBondContact O-N 3.19Å; A336-M339 PolarHBondContact O-N 3.49Å; S337-M339 PolarHBondContact O-N 3.04Å; M339-E341 VanDerWaalsContact C-N 3.33Å; M339-E341 PolarHBondContact O-N 3.12Å; M339-Q342 PolarHBondContact O-N 3.15Å; M339-F343 WeakPolarHBondContact O-CB 3.46Å; M339-F343 PolarHBondContact O-N 3.12Å; M339-M381 HydrophobicContact CB-CE 4.43Å; M339-M381 HydrophobicContact CB-SD 3.71Å; M339-M386 HydrophobicContact CE-CE 3.81Å; M339-M386 HydrophobicContact SD-CE 4.09Å; M339-F388 HydrophobicContact CE-CE1 4.29Å; M339-F388 HydrophobicContact CE-CZ 4.49Å; M339-F388 HydrophobicContact SD-CE1 3.99Å; M339-F388 HydrophobicContact SD-CZ 3.7Å
340	V	90.3	Very high	85.3	Confident	3 Å²	3	45.5 Å²	45.5	2%	0.018	25%	0.252	C	S	.	.	H	α-helix	trans	-61.6	-44.2	177.4	174.3	0	0	0	0	110.5	A336 S337 F343 S344 F374 W377 Y378 M381	A336-V340 VanDerWaalsContact O-CG2 3.29Å; A336-V340 WeakPolarHBondContact O-CG2 3.43Å; A336-V340 PolarHBondContact O-N 3.21Å; S337-V340 PolarHBondContact O-N 2.99Å; V340-F343 PolarHBondContact O-N 3.16Å; V340-S344 WeakPolarHBondContact O-CB 3.3Å; V340-S344 PolarHBondContact O-N 3.4Å; V340-S344 PolarHBondContact O-OG 3.43Å; V340-F374 HydrophobicContact CB-CE2 4.02Å; V340-F374 HydrophobicContact CG1-CD2 3.82Å; V340-F374 HydrophobicContact CG1-CE2 3.76Å; V340-F374 HydrophobicContact CG1-CZ 4.48Å; V340-F374 HydrophobicContact CG2-CE2 4.3Å; V340-F374 HydrophobicContact CG2-CZ 4.42Å; V340-W377 HydrophobicContact CG1-CB 3.93Å; V340-Y378 HydrophobicContact CG2-CD2 3.75Å; V340-Y378 HydrophobicContact CG2-CE2 4.49Å; V340-Y378 HydrophobicContact CG2-CG 4.47Å; V340-M381 HydrophobicContact CG2-CE 3.51Å; V340-M381 HydrophobicContact CG2-SD 3.84Å
341	E	87	Confident	83.7	Confident	94 Å²	94	49.1 Å²	49.1	44%	0.439	27%	0.269	S	S	.	.	H	α-helix	trans	-60.7	-48.9	176.7	-169.1	-172.8	162.5	0	0	111.2	S337 M338 M339 F343 S344 K345	S337-E341 PolarHBondContact O-N 2.92Å; S337-E341 VanDerWaalsContact O-N 3.08Å; M338-E341 PolarHBondContact O-N 2.9Å; M339-E341 VanDerWaalsContact C-N 3.33Å; M339-E341 PolarHBondContact O-N 3.12Å; E341-F343 PolarHBondContact O-N 3.37Å; E341-S344 PolarHBondContact O-N 3.19Å; E341-S344 PolarHBondContact O-OG 3.39Å; E341-K345 WeakPolarHBondContact O-CG 3.33Å; E341-K345 PolarHBondContact O-N 3Å; E341-K345 VanDerWaalsContact O-N 3.14Å; E341-K345 WeakPolarHBondContact OE1-CE 3.5Å; E341-K345 IonicContact OE1-NZ 3.75Å; E341-K345 PolarHBondContact OE1-NZ 3.38Å
342	Q	89.2	Confident	81.9	Confident	26 Å²	26	55.5 Å²	55.5	12%	0.121	29%	0.288	C	S	.	.	H	α-helix	trans	-65.8	-37.3	178.8	-72.9	174.5	-22.6	0	0	113.1	S307 T310 E311 L314 M338 M339 Y346	S307-Q342 PolarHBondContact O-NE2 3.2Å; T310-Q342 VanDerWaalsContact CB-OE1 3.23Å; T310-Q342 PolarHBondContact OG1-NE2 3.38Å; T310-Q342 PolarHBondContact OG1-OE1 3.37Å; E311-Q342 HydrophobicContact CG-CB 4.39Å; E311-Q342 HydrophobicContact CG-CG 4.11Å; E311-Q342 VanDerWaalsContact CG-NE2 3.31Å; E311-Q342 PolarHBondContact OE1-NE2 2.95Å; L314-Q342 HydrophobicContact CD1-CB 3.98Å; M338-Q342 WeakPolarHBondContact O-CB 3.39Å; M338-Q342 VanDerWaalsContact O-CG 3.31Å; M338-Q342 WeakPolarHBondContact O-CG 3.39Å; M338-Q342 PolarHBondContact O-N 2.87Å; M339-Q342 PolarHBondContact O-N 3.15Å; Q342-Y346 WeakPolarHBondContact O-CB 3.49Å; Q342-Y346 PolarHBondContact O-N 2.96Å; Q342-Y346 VanDerWaalsContact O-N 3.13Å
343	F	88.5	Confident	80.1	Confident	3 Å²	3	58 Å²	58	1%	0.013	30%	0.304	C	S	.	.	H	α-helix	trans	-65.9	-47.3	177.1	-178.2	-106.7	0	0	0	110.9	L314 L318 M339 V340 E341 K345 Y346 A347 F354 W377 E380 M381 L384	L314-F343 HydrophobicContact CD1-CB 4.33Å; L314-F343 HydrophobicContact CD2-CB 4.4Å; L314-F343 HydrophobicContact CD2-CD2 4.3Å; L318-F343 HydrophobicContact CD2-CE2 4.16Å; M339-F343 WeakPolarHBondContact O-CB 3.46Å; M339-F343 PolarHBondContact O-N 3.12Å; V340-F343 PolarHBondContact O-N 3.16Å; E341-F343 PolarHBondContact O-N 3.37Å; F343-K345 PolarHBondContact O-N 3.44Å; F343-Y346 PolarHBondContact O-N 3.25Å; F343-A347 WeakPolarHBondContact O-CB 3.04Å; F343-A347 PolarHBondContact O-N 3.35Å; F343-F354 HydrophobicContact CE2-CE1 4.09Å; F343-F354 AromaticContact CE2-CZ 3.95Å; F343-F354 HydrophobicContact CE2-CZ 3.95Å; F343-F354 AromaticContact CZ-CE1 3.63Å; F343-F354 HydrophobicContact CZ-CE1 3.63Å; F343-F354 AromaticContact CZ-CZ 3.93Å; F343-F354 HydrophobicContact CZ-CZ 3.93Å; F343-W377 HydrophobicContact CD1-CE3 4.04Å; F343-W377 AromaticContact CE1-CE3 3.94Å; F343-W377 HydrophobicContact CE1-CE3 3.94Å; F343-W377 HydrophobicContact CE1-CZ3 4.34Å; F343-E380 HydrophobicContact CE1-CB 3.93Å; F343-M381 HydrophobicContact CD1-CB 3.93Å; F343-M381 HydrophobicContact CD1-CG 4.43Å; F343-M381 HydrophobicContact CE1-CB 4.14Å; F343-M381 HydrophobicContact CG-CB 4.35Å; F343-M381 HydrophobicContact CG-CG 4.36Å; F343-L384 HydrophobicContact CD2-CD1 4.22Å; F343-L384 HydrophobicContact CE2-CD1 3.93Å
344	S	84.6	Confident	78.5	Confident	8 Å²	8	56.7 Å²	56.7	6%	0.056	28%	0.282	C	S	.	.	H	α-helix	trans	-59.2	-43.7	177.7	74.6	0	0	0	0	112.4	V340 E341 A347 R348 W377	V340-S344 WeakPolarHBondContact O-CB 3.3Å; V340-S344 PolarHBondContact O-N 3.4Å; V340-S344 PolarHBondContact O-OG 3.43Å; E341-S344 PolarHBondContact O-N 3.19Å; E341-S344 PolarHBondContact O-OG 3.39Å; S344-A347 PolarHBondContact O-N 2.82Å; S344-R348 VanDerWaalsContact O-CG 3.24Å; S344-R348 WeakPolarHBondContact O-CG 3.5Å; S344-R348 PolarHBondContact O-N 2.79Å; S344-W377 VanDerWaalsContact CB-CD1 3.41Å; S344-W377 VanDerWaalsContact CB-CG 3.48Å
345	K	82	Confident	76.6	Confident	122 Å²	122	60.3 Å²	60.3	53%	0.53	30%	0.296	S	S	.	.	H	α-helix	trans	-63.8	-42.4	177.6	-72.5	178.5	-174	171.4	0	111.9	E341 F343 G349	E341-K345 WeakPolarHBondContact O-CG 3.33Å; E341-K345 PolarHBondContact O-N 3Å; E341-K345 VanDerWaalsContact O-N 3.14Å; E341-K345 WeakPolarHBondContact OE1-CE 3.5Å; E341-K345 IonicContact OE1-NZ 3.75Å; E341-K345 PolarHBondContact OE1-NZ 3.38Å; F343-K345 PolarHBondContact O-N 3.44Å; K345-G349 PolarHBondContact O-N 3.43Å
346	Y	81	Confident	74.6	Confident	45 Å²	45	62.9 Å²	62.9	18%	0.176	31%	0.309	C	S	.	.	H	α-helix	trans	-66.5	-41.4	178	177.3	-98.7	0	0	0	112.8	R278 L318 Q342 F343 G349 N350 F354	R278-Y346 HydrophobicContact CG-CD2 4.09Å; R278-Y346 HydrophobicContact CG-CE2 3.84Å; L318-Y346 HydrophobicContact CD1-CD1 4.17Å; L318-Y346 HydrophobicContact CD1-CE1 3.74Å; Q342-Y346 WeakPolarHBondContact O-CB 3.49Å; Q342-Y346 PolarHBondContact O-N 2.96Å; Q342-Y346 VanDerWaalsContact O-N 3.13Å; F343-Y346 PolarHBondContact O-N 3.25Å; Y346-G349 PolarHBondContact O-N 2.88Å; Y346-N350 VanDerWaalsContact CE2-ND2 3.34Å; Y346-N350 WeakPolarHBondContact CE2-ND2 3.31Å; Y346-N350 PolarHBondContact O-N 3.22Å; Y346-N350 PolarHBondContact O-ND2 3.42Å; Y346-F354 HydrophobicContact CD1-CE2 4.41Å; Y346-F354 HydrophobicContact CE1-CE2 4.47Å
347	A	76.4	Confident	72.5	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.008	33%	0.331	C	S	.	.	H	α-helix	trans	-65.1	-42.3	178.4	0	0	0	0	0	111.8	F343 S344 G349 N350 F354 W377	F343-A347 WeakPolarHBondContact O-CB 3.04Å; F343-A347 PolarHBondContact O-N 3.35Å; S344-A347 PolarHBondContact O-N 2.82Å; A347-G349 VanDerWaalsContact C-N 3.26Å; A347-G349 PolarHBondContact O-N 3.35Å; A347-N350 CarbonylContact O-C 3.56Å; A347-N350 PolarHBondContact O-N 2.95Å; A347-N350 VanDerWaalsContact O-N 3.08Å; A347-F354 HydrophobicContact CB-CD2 3.53Å; A347-F354 HydrophobicContact CB-CE2 3.6Å; A347-F354 HydrophobicContact CB-CG 4.07Å; A347-F354 HydrophobicContact CB-CZ 4.18Å; A347-W377 HydrophobicContact CB-CE3 4.28Å; A347-W377 HydrophobicContact CB-CH2 3.44Å; A347-W377 VanDerWaalsContact CB-CH2 3.44Å; A347-W377 HydrophobicContact CB-CZ2 4.43Å; A347-W377 HydrophobicContact CB-CZ3 3.35Å
348	R	70.9	Confident	70.3	Confident	70 Å²	70	74.7 Å²	74.7	26%	0.264	36%	0.361	S	S	.	.	H	α-helix	trans	-59.2	-35.1	173.1	-70.7	173	-166.9	-153.8	1	112.7	S344 N350 Y365 W377	S344-R348 VanDerWaalsContact O-CG 3.24Å; S344-R348 WeakPolarHBondContact O-CG 3.5Å; S344-R348 PolarHBondContact O-N 2.79Å; R348-N350 VanDerWaalsContact C-N 3.33Å; R348-Y365 HydrophobicContact CG-CD1 4.11Å; R348-Y365 HydrophobicContact CG-CE1 3.94Å; R348-Y365 PolarHBondContact NH1-O 2.98Å; R348-W377 HydrophobicContact CG-CZ2 4.36Å
349	G	67.1	Low	68.2	Low	62 Å²	62	77.8 Å²	77.8	64%	0.639	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-10.4	176.6	0	0	0	0	0	115.1	K345 Y346 A347	K345-G349 PolarHBondContact O-N 3.43Å; Y346-G349 PolarHBondContact O-N 2.88Å; A347-G349 VanDerWaalsContact C-N 3.26Å; A347-G349 PolarHBondContact O-N 3.35Å
350	N	62.8	Low	65.8	Low	62 Å²	62	82 Å²	82	33%	0.332	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134	55.3	-175.9	-67.5	-78	0	0	0	111	Y346 A347 R348 F352 V353	Y346-N350 VanDerWaalsContact CE2-ND2 3.34Å; Y346-N350 WeakPolarHBondContact CE2-ND2 3.31Å; Y346-N350 PolarHBondContact O-N 3.22Å; Y346-N350 PolarHBondContact O-ND2 3.42Å; A347-N350 CarbonylContact O-C 3.56Å; A347-N350 PolarHBondContact O-N 2.95Å; A347-N350 VanDerWaalsContact O-N 3.08Å; R348-N350 VanDerWaalsContact C-N 3.33Å; N350-F352 PolarHBondContact O-N 2.76Å; N350-V353 HydrophobicContact CB-CG2 4.14Å; N350-V353 PolarHBondContact O-N 2.73Å
351	E	53.8	Low	63.9	Low	83 Å²	83	89.4 Å²	89.4	39%	0.388	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-26.7	-176.7	-75.4	-167.4	168.8	0	0	114.2	V353 R361	E351-V353 PolarHBondContact O-N 3Å; E351-R361 IonicContact OE1-CZ 3.74Å; E351-R361 IonicContact OE1-NH1 3.25Å; E351-R361 PolarHBondContact OE1-NH1 3.24Å; E351-R361 IonicContact OE1-NH2 4Å; E351-R361 IonicContact OE2-CZ 3.31Å; E351-R361 VanDerWaalsContact OE2-CZ 3.31Å; E351-R361 IonicContact OE2-NH1 2.8Å; E351-R361 PolarHBondContact OE2-NH1 3.16Å; E351-R361 IonicContact OE2-NH2 3.04Å; E351-R361 PolarHBondContact OE2-NH2 2.84Å
352	F	52.3	Low	62	Low	218 Å²	218	92.3 Å²	92.3	96%	0.956	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-15.9	177.5	-76.2	-81.7	0	0	0	114.5	N350	N350-F352 PolarHBondContact O-N 2.76Å
353	V	54.3	Low	60	Low	95 Å²	95	96.1 Å²	96.1	58%	0.576	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-27.9	-175.4	-177.7	0	0	0	0	112	N350 E351	N350-V353 HydrophobicContact CB-CG2 4.14Å; N350-V353 PolarHBondContact O-N 2.73Å; E351-V353 PolarHBondContact O-N 3Å
354	F	57.1	Low	58.3	Low	29 Å²	29	98.3 Å²	98.3	13%	0.127	48%	0.476	C	S	.	.	S	Bend	trans	-117.3	121	-174.1	-61.9	-83.1	0	0	0	110.3	L318 F343 Y346 A347 I356	L318-F354 HydrophobicContact CD2-CZ 4.12Å; F343-F354 HydrophobicContact CE2-CE1 4.09Å; F343-F354 AromaticContact CE2-CZ 3.95Å; F343-F354 HydrophobicContact CE2-CZ 3.95Å; F343-F354 AromaticContact CZ-CE1 3.63Å; F343-F354 HydrophobicContact CZ-CE1 3.63Å; F343-F354 AromaticContact CZ-CZ 3.93Å; F343-F354 HydrophobicContact CZ-CZ 3.93Å; Y346-F354 HydrophobicContact CD1-CE2 4.41Å; Y346-F354 HydrophobicContact CE1-CE2 4.47Å; A347-F354 HydrophobicContact CB-CD2 3.53Å; A347-F354 HydrophobicContact CB-CE2 3.6Å; A347-F354 HydrophobicContact CB-CG 4.07Å; A347-F354 HydrophobicContact CB-CZ 4.18Å; F354-I356 PolarHBondContact O-N 3.47Å; F354-I356 VanDerWaalsContact O-N 3.1Å
355	R	51	Low	56.8	Low	242 Å²	242	100 Å²	100	91%	0.913	48%	0.481	S	S	*	.			trans	-72.3	101	172.8	-86.3	-175.1	178.3	-174	-0.1	109.1	P357	R355-P357 WeakPolarHBondContact O-CD 3.4Å
356	I	51.9	Low	55.2	Low	54 Å²	54	102.6 Å²	102.6	28%	0.277	50%	0.495	S	S	.	.			trans	-83.6	118.9	166.7	-59.6	151.3	0	0	0	107.5	F354 Y365	F354-I356 PolarHBondContact O-N 3.47Å; F354-I356 VanDerWaalsContact O-N 3.1Å; I356-Y365 WeakPolarHBondContact CD1-OH 3.09Å; I356-Y365 WeakPolarHBondContact CG2-OH 3.34Å
357	P	47.9	Very low	53.7	Low	83 Å²	83	102.6 Å²	102.6	54%	0.539	50%	0.501	S	S	.	.			trans	-61.6	148.2	174.5	-17.6	30.5	0	0	0	111	R355 I359	R355-P357 WeakPolarHBondContact O-CD 3.4Å; P357-I359 PolarHBondContact O-N 2.88Å
358	F	42.2	Very low	52.4	Low	228 Å²	228	106.7 Å²	106.7	100%	1	53%	0.53	S	S	*	.	S	Bend	trans	-44.2	86.9	176.6	-107.6	-98.4	0	0	0	112.8
359	I	47.2	Very low	51.6	Low	105 Å²	105	108.1 Å²	108.1	54%	0.538	55%	0.551	S	S	.	*			trans	-137.4	136	171.4	-60.3	179	0	0	0	106.1	P357 R361	P357-I359 PolarHBondContact O-N 2.88Å; I359-R361 PolarHBondContact O-N 3.39Å; I359-R361 VanDerWaalsContact O-N 3.15Å
360	D	45.2	Very low	51.4	Low	90 Å²	90	107.2 Å²	107.2	48%	0.481	54%	0.535	S	S	.	.			trans	-42.5	115.2	-178.6	177.9	21	0	0	0	112.3	E362 T363	D360-E362 PolarHBondContact O-N 3.37Å; D360-E362 PolarHBondContact OD1-N 2.86Å; D360-T363 PolarHBondContact OD2-OG1 2.8Å
361	R	48.9	Very low	51.7	Low	158 Å²	158	111.6 Å²	111.6	60%	0.596	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-18.7	-172.5	-76.8	-176.2	177.1	-143.9	-6.3	112.7	E351 I359 Y365	E351-R361 IonicContact OE1-CZ 3.74Å; E351-R361 IonicContact OE1-NH1 3.25Å; E351-R361 PolarHBondContact OE1-NH1 3.24Å; E351-R361 IonicContact OE1-NH2 4Å; E351-R361 IonicContact OE2-CZ 3.31Å; E351-R361 VanDerWaalsContact OE2-CZ 3.31Å; E351-R361 IonicContact OE2-NH1 2.8Å; E351-R361 PolarHBondContact OE2-NH1 3.16Å; E351-R361 IonicContact OE2-NH2 3.04Å; E351-R361 PolarHBondContact OE2-NH2 2.84Å; I359-R361 PolarHBondContact O-N 3.39Å; I359-R361 VanDerWaalsContact O-N 3.15Å; R361-Y365 VanDerWaalsContact O-CD2 3.31Å; R361-Y365 WeakPolarHBondContact O-CD2 3.34Å
362	E	47.5	Very low	52.4	Low	155 Å²	155	117.2 Å²	117.2	72%	0.724	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-29.9	-176.9	-72	-175.8	162.1	0	0	112.4	D360	D360-E362 PolarHBondContact O-N 3.37Å; D360-E362 PolarHBondContact OD1-N 2.86Å
363	T	48.1	Very low	53.3	Low	106 Å²	106	107 Å²	107	65%	0.65	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-22.5	-175.3	41	0	0	0	0	115	D360	D360-T363 PolarHBondContact OD2-OG1 2.8Å
364	F	52.6	Low	54.5	Low	49 Å²	49	106.6 Å²	106.6	22%	0.215	52%	0.517	C	S	.	.	S	Bend	trans	-84.6	-18.9	-177.2	-160.2	-100.4	0	0	0	114	Y376	F364-Y376 HydrophobicContact CZ-CG 4.36Å
365	Y	52.1	Low	55.7	Low	42 Å²	42	108.7 Å²	108.7	17%	0.165	53%	0.53	C	S	.	.	S	Bend	trans	-108.7	-11.4	-163.9	-73.7	-81.4	0	0	0	116.1	R348 I356 R361 S367 W377	R348-Y365 HydrophobicContact CG-CD1 4.11Å; R348-Y365 HydrophobicContact CG-CE1 3.94Å; R348-Y365 PolarHBondContact NH1-O 2.98Å; I356-Y365 WeakPolarHBondContact CD1-OH 3.09Å; I356-Y365 WeakPolarHBondContact CG2-OH 3.34Å; R361-Y365 VanDerWaalsContact O-CD2 3.31Å; R361-Y365 WeakPolarHBondContact O-CD2 3.34Å; Y365-S367 VanDerWaalsContact C-N 3.31Å; Y365-S367 PolarHBondContact O-N 3.06Å; Y365-W377 HydrophobicContact CE1-CZ2 4.42Å
366	E	49.1	Very low	57.1	Low	177 Å²	177	99.7 Å²	99.7	83%	0.827	50%	0.496	S	S	*	.	S	Bend	trans	-75.8	-6.9	-172.5	-76.3	-168	154.1	0	0	115.7
367	S	48.8	Very low	58.7	Low	45 Å²	45	97.3 Å²	97.3	32%	0.315	48%	0.484	S	S	.	.			trans	-144	117.8	168	89.2	0	0	0	0	112.7	Y365 S369 S370	Y365-S367 VanDerWaalsContact C-N 3.31Å; Y365-S367 PolarHBondContact O-N 3.06Å; S367-S369 VanDerWaalsContact CB-OG 3.23Å; S367-S369 WeakPolarHBondContact CB-OG 3.36Å; S367-S369 PolarHBondContact O-N 2.77Å; S367-S369 PolarHBondContact OG-OG 2.82Å; S367-S370 PolarHBondContact O-N 2.97Å; S367-S370 PolarHBondContact OG-N 3.38Å
368	S	49.9	Very low	60.6	Low	87 Å²	87	98.8 Å²	98.8	61%	0.608	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	5.5	162.4	51.2	0	0	0	0	112.8
369	S	54.4	Low	62.6	Low	100 Å²	100	93.1 Å²	93.1	70%	0.699	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	-3.4	-179.8	54.1	0	0	0	0	113.8	S367 Q371	S367-S369 VanDerWaalsContact CB-OG 3.23Å; S367-S369 WeakPolarHBondContact CB-OG 3.36Å; S367-S369 PolarHBondContact O-N 2.77Å; S367-S369 PolarHBondContact OG-OG 2.82Å; S369-Q371 PolarHBondContact O-N 3.22Å
370	S	63.1	Low	64.4	Low	43 Å²	43	91.2 Å²	91.2	30%	0.301	45%	0.448	S	S	.	.			trans	-74.7	129	173.3	72.7	0	0	0	0	110.8	S367 R372 S373 F374	S367-S370 PolarHBondContact O-N 2.97Å; S367-S370 PolarHBondContact OG-N 3.38Å; S370-R372 PolarHBondContact O-N 3.42Å; S370-S373 PolarHBondContact O-N 3.46Å; S370-S373 VanDerWaalsContact OG-CB 3.26Å; S370-S373 WeakPolarHBondContact OG-CB 3.34Å; S370-S373 PolarHBondContact OG-N 3.25Å; S370-F374 PolarHBondContact O-N 2.9Å; S370-F374 VanDerWaalsContact O-N 3.12Å
371	Q	68.4	Low	66.4	Low	154 Å²	154	87.9 Å²	87.9	72%	0.72	43%	0.43	S	S	*	.	H	α-helix	trans	-53.9	-38.9	177.5	-173.5	174.8	-1.8	0	0	111.6	S369 S373 F374 D375	S369-Q371 PolarHBondContact O-N 3.22Å; Q371-S373 PolarHBondContact O-N 3.18Å; Q371-F374 WeakPolarHBondContact O-CB 3.31Å; Q371-F374 PolarHBondContact O-N 2.98Å; Q371-F374 VanDerWaalsContact O-N 3.17Å; Q371-D375 VanDerWaalsContact O-CG 3.23Å; Q371-D375 PolarHBondContact O-N 3.37Å
372	R	68.7	Low	68.2	Low	202 Å²	202	83 Å²	83	76%	0.762	43%	0.429	S	S	*	.	H	α-helix	trans	-60.4	-41.6	175.1	-72.3	-175.3	179.5	173.9	-0.1	113.6	S370 F374 Y376	S370-R372 PolarHBondContact O-N 3.42Å; R372-F374 VanDerWaalsContact C-N 3.33Å; R372-Y376 WeakPolarHBondContact O-CB 3.45Å; R372-Y376 PolarHBondContact O-N 3.26Å; R372-Y376 VanDerWaalsContact O-N 3.13Å
373	S	70.8	Confident	70	Confident	3 Å²	3	81.5 Å²	81.5	2%	0.021	43%	0.426	C	S	.	.	H	α-helix	trans	-68.3	-36.9	176.4	-179.5	0	0	0	0	110.9	S370 Q371 W377	S370-S373 PolarHBondContact O-N 3.46Å; S370-S373 VanDerWaalsContact OG-CB 3.26Å; S370-S373 WeakPolarHBondContact OG-CB 3.34Å; S370-S373 PolarHBondContact OG-N 3.25Å; Q371-S373 PolarHBondContact O-N 3.18Å; S373-W377 PolarHBondContact O-N 3.21Å; S373-W377 VanDerWaalsContact O-N 3.15Å; S373-W377 PolarHBondContact OG-NE1 3.39Å
374	F	79.7	Confident	72	Confident	86 Å²	86	77.5 Å²	77.5	38%	0.377	40%	0.401	S	S	.	.	H	α-helix	trans	-63.8	-51.3	176.6	-179.8	-90	0	0	0	111.1	V340 S370 Q371 R372 Y376 W377 Y378	V340-F374 HydrophobicContact CB-CE2 4.02Å; V340-F374 HydrophobicContact CG1-CD2 3.82Å; V340-F374 HydrophobicContact CG1-CE2 3.76Å; V340-F374 HydrophobicContact CG1-CZ 4.48Å; V340-F374 HydrophobicContact CG2-CE2 4.3Å; V340-F374 HydrophobicContact CG2-CZ 4.42Å; S370-F374 PolarHBondContact O-N 2.9Å; S370-F374 VanDerWaalsContact O-N 3.12Å; Q371-F374 WeakPolarHBondContact O-CB 3.31Å; Q371-F374 PolarHBondContact O-N 2.98Å; Q371-F374 VanDerWaalsContact O-N 3.17Å; R372-F374 VanDerWaalsContact C-N 3.33Å; F374-Y376 VanDerWaalsContact C-N 3.32Å; F374-Y376 PolarHBondContact O-N 2.96Å; F374-W377 PolarHBondContact O-N 2.88Å; F374-Y378 AromaticContact CE1-CD2 3.84Å; F374-Y378 HydrophobicContact CE1-CD2 3.84Å; F374-Y378 HydrophobicContact CE1-CG 4.33Å; F374-Y378 AromaticContact CZ-CD2 3.85Å; F374-Y378 HydrophobicContact CZ-CD2 3.85Å; F374-Y378 VanDerWaalsContact O-CB 3.26Å; F374-Y378 WeakPolarHBondContact O-CB 3.48Å; F374-Y378 PolarHBondContact O-N 3.35Å
375	D	81.9	Confident	73.9	Confident	73 Å²	73	76.8 Å²	76.8	39%	0.39	40%	0.401	S	S	.	.	H	α-helix	trans	-57.4	-45.2	-179.5	-64.2	-21.2	0	0	0	111	Q371 W377 Y378 D379	Q371-D375 VanDerWaalsContact O-CG 3.23Å; Q371-D375 PolarHBondContact O-N 3.37Å; D375-W377 PolarHBondContact O-N 3.18Å; D375-Y378 WeakPolarHBondContact O-CB 3.43Å; D375-Y378 PolarHBondContact O-N 2.79Å; D375-D379 PolarHBondContact O-N 3.07Å
376	Y	81.7	Confident	75.8	Confident	54 Å²	54	76.4 Å²	76.4	21%	0.212	40%	0.401	C	S	.	.	H	α-helix	trans	-58	-51.3	175.5	176.8	-90.4	0	0	0	112.9	F364 R372 F374 Y378 D379 E380	F364-Y376 HydrophobicContact CZ-CG 4.36Å; R372-Y376 WeakPolarHBondContact O-CB 3.45Å; R372-Y376 PolarHBondContact O-N 3.26Å; R372-Y376 VanDerWaalsContact O-N 3.13Å; F374-Y376 VanDerWaalsContact C-N 3.32Å; F374-Y376 PolarHBondContact O-N 2.96Å; Y376-Y378 VanDerWaalsContact C-N 3.29Å; Y376-Y378 PolarHBondContact O-N 3.35Å; Y376-D379 PolarHBondContact O-N 2.86Å; Y376-E380 HydrophobicContact CD1-CG 4.27Å; Y376-E380 HydrophobicContact CE1-CG 3.78Å; Y376-E380 HydrophobicContact CE2-CG 4.4Å; Y376-E380 WeakPolarHBondContact O-CG 3.16Å; Y376-E380 PolarHBondContact O-N 2.93Å
377	W	84.8	Confident	77.9	Confident	4 Å²	4	72.1 Å²	72.1	2%	0.015	38%	0.381	C	S	.	.	H	α-helix	trans	-70.8	-28.2	-178.8	-71.4	119	0	0	0	112.5	V340 F343 S344 A347 R348 Y365 S373 F374 D375 E380 M381	V340-W377 HydrophobicContact CG1-CB 3.93Å; F343-W377 HydrophobicContact CD1-CE3 4.04Å; F343-W377 AromaticContact CE1-CE3 3.94Å; F343-W377 HydrophobicContact CE1-CE3 3.94Å; F343-W377 HydrophobicContact CE1-CZ3 4.34Å; S344-W377 VanDerWaalsContact CB-CD1 3.41Å; S344-W377 VanDerWaalsContact CB-CG 3.48Å; A347-W377 HydrophobicContact CB-CE3 4.28Å; A347-W377 HydrophobicContact CB-CH2 3.44Å; A347-W377 VanDerWaalsContact CB-CH2 3.44Å; A347-W377 HydrophobicContact CB-CZ2 4.43Å; A347-W377 HydrophobicContact CB-CZ3 3.35Å; R348-W377 HydrophobicContact CG-CZ2 4.36Å; Y365-W377 HydrophobicContact CE1-CZ2 4.42Å; S373-W377 PolarHBondContact O-N 3.21Å; S373-W377 VanDerWaalsContact O-N 3.15Å; S373-W377 PolarHBondContact OG-NE1 3.39Å; F374-W377 PolarHBondContact O-N 2.88Å; D375-W377 PolarHBondContact O-N 3.18Å; W377-E380 HydrophobicContact CE3-CB 4.37Å; W377-M381 WeakPolarHBondContact O-CB 3.19Å; W377-M381 PolarHBondContact O-N 3.31Å
378	Y	87.7	Confident	80.1	Confident	113 Å²	113	73.1 Å²	73.1	44%	0.443	38%	0.38	S	S	.	.	H	α-helix	trans	-64.7	-48.1	173	-169.7	-82.3	0	0	0	110.5	V340 F374 D375 Y376 M381 G382	V340-Y378 HydrophobicContact CG2-CD2 3.75Å; V340-Y378 HydrophobicContact CG2-CE2 4.49Å; V340-Y378 HydrophobicContact CG2-CG 4.47Å; F374-Y378 AromaticContact CE1-CD2 3.84Å; F374-Y378 HydrophobicContact CE1-CD2 3.84Å; F374-Y378 HydrophobicContact CE1-CG 4.33Å; F374-Y378 AromaticContact CZ-CD2 3.85Å; F374-Y378 HydrophobicContact CZ-CD2 3.85Å; F374-Y378 VanDerWaalsContact O-CB 3.26Å; F374-Y378 WeakPolarHBondContact O-CB 3.48Å; F374-Y378 PolarHBondContact O-N 3.35Å; D375-Y378 WeakPolarHBondContact O-CB 3.43Å; D375-Y378 PolarHBondContact O-N 2.79Å; Y376-Y378 VanDerWaalsContact C-N 3.29Å; Y376-Y378 PolarHBondContact O-N 3.35Å; Y378-M381 PolarHBondContact O-N 3.15Å; Y378-G382 PolarHBondContact O-N 2.84Å
379	D	85	Confident	82.2	Confident	110 Å²	110	70.5 Å²	70.5	59%	0.588	36%	0.36	S	S	*	.	H	α-helix	trans	-63	-44.2	177.1	-71.4	-17.5	0	0	0	111.6	D375 Y376 M381 G382	D375-D379 PolarHBondContact O-N 3.07Å; Y376-D379 PolarHBondContact O-N 2.86Å; D379-M381 PolarHBondContact O-N 2.97Å; D379-G382 WeakPolarHBondContact O-CA 3.03Å; D379-G382 PolarHBondContact O-N 3.32Å; D379-G382 VanDerWaalsContact O-N 3.08Å
380	E	83.5	Confident	83.9	Confident	64 Å²	64	69.6 Å²	69.6	30%	0.299	35%	0.354	S	S	.	.	H	α-helix	trans	-61.8	-43.2	175.7	-76.6	-63.9	125	0	0	112.2	F343 Y376 W377 G382 N383	F343-E380 HydrophobicContact CE1-CB 3.93Å; Y376-E380 HydrophobicContact CD1-CG 4.27Å; Y376-E380 HydrophobicContact CE1-CG 3.78Å; Y376-E380 HydrophobicContact CE2-CG 4.4Å; Y376-E380 WeakPolarHBondContact O-CG 3.16Å; Y376-E380 PolarHBondContact O-N 2.93Å; W377-E380 HydrophobicContact CE3-CB 4.37Å; E380-G382 PolarHBondContact O-N 3.35Å; E380-N383 PolarHBondContact O-N 3.28Å
381	M	88.5	Confident	85	Confident	20 Å²	20	68.1 Å²	68.1	10%	0.099	34%	0.342	C	S	.	.	H	α-helix	trans	-65.2	-30.3	174.6	-169.8	-173.8	73.5	0	0	111.5	L314 M339 V340 F343 W377 Y378 D379 N383 L384	L314-M381 HydrophobicContact CD2-CG 4.45Å; L314-M381 HydrophobicContact CD2-SD 4.33Å; M339-M381 HydrophobicContact CB-CE 4.43Å; M339-M381 HydrophobicContact CB-SD 3.71Å; V340-M381 HydrophobicContact CG2-CE 3.51Å; V340-M381 HydrophobicContact CG2-SD 3.84Å; F343-M381 HydrophobicContact CD1-CB 3.93Å; F343-M381 HydrophobicContact CD1-CG 4.43Å; F343-M381 HydrophobicContact CE1-CB 4.14Å; F343-M381 HydrophobicContact CG-CB 4.35Å; F343-M381 HydrophobicContact CG-CG 4.36Å; W377-M381 WeakPolarHBondContact O-CB 3.19Å; W377-M381 PolarHBondContact O-N 3.31Å; Y378-M381 PolarHBondContact O-N 3.15Å; D379-M381 PolarHBondContact O-N 2.97Å; M381-N383 PolarHBondContact O-N 2.76Å; M381-N383 VanDerWaalsContact O-N 3.15Å; M381-L384 HydrophobicContact CG-CD1 4.01Å; M381-L384 VanDerWaalsContact O-CB 3.26Å; M381-L384 WeakPolarHBondContact O-CB 3.41Å; M381-L384 WeakPolarHBondContact O-CG 3.35Å; M381-L384 PolarHBondContact O-N 2.94Å
382	G	85.9	Confident	85.1	Confident	57 Å²	57	65.3 Å²	65.3	59%	0.588	33%	0.332	S	S	*	.	H	α-helix	trans	-60.2	-18.9	176.8	0	0	0	0	0	114.4	Y378 D379 E380 L384	Y378-G382 PolarHBondContact O-N 2.84Å; D379-G382 WeakPolarHBondContact O-CA 3.03Å; D379-G382 PolarHBondContact O-N 3.32Å; D379-G382 VanDerWaalsContact O-N 3.08Å; E380-G382 PolarHBondContact O-N 3.35Å; G382-L384 VanDerWaalsContact C-N 3.27Å; G382-L384 PolarHBondContact O-N 2.87Å
383	N	85.3	Confident	85	Confident	122 Å²	122	60.2 Å²	60.2	65%	0.652	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-9.3	173.5	-65.5	-49.4	0	0	0	113.8	E380 M381	E380-N383 PolarHBondContact O-N 3.28Å; M381-N383 PolarHBondContact O-N 2.76Å; M381-N383 VanDerWaalsContact O-N 3.15Å
384	L	90.8	Very high	84.7	Confident	23 Å²	23	64.4 Å²	64.4	12%	0.12	36%	0.358	C	S	.	.	S	Bend	trans	-80	147.2	177.7	-61.5	179.1	0	0	0	111	L314 C317 L318 F343 M381 G382 M386	L314-L384 HydrophobicContact CD2-CD1 3.99Å; C317-L384 HydrophobicContact CB-CB 4.15Å; C317-L384 HydrophobicContact CB-CD1 4.35Å; L318-L384 HydrophobicContact CD2-CD2 4.07Å; L318-L384 HydrophobicContact CG-CD2 4.4Å; F343-L384 HydrophobicContact CD2-CD1 4.22Å; F343-L384 HydrophobicContact CE2-CD1 3.93Å; M381-L384 HydrophobicContact CG-CD1 4.01Å; M381-L384 VanDerWaalsContact O-CB 3.26Å; M381-L384 WeakPolarHBondContact O-CB 3.41Å; M381-L384 WeakPolarHBondContact O-CG 3.35Å; M381-L384 PolarHBondContact O-N 2.94Å; G382-L384 VanDerWaalsContact C-N 3.27Å; G382-L384 PolarHBondContact O-N 2.87Å; L384-M386 PolarHBondContact O-N 2.92Å
385	P	92	Very high	84.1	Confident	33 Å²	33	67.8 Å²	67.8	21%	0.214	37%	0.373	C	S	.	.	S	Bend	trans	-78	61.2	179.8	34.3	-37.8	0	0	0	112.1	R322 T323	R322-P385 HydrophobicContact CG-CB 4.05Å; T323-P385 PolarHBondContact N-O 3.35Å
386	M	92.6	Very high	83.5	Confident	34 Å²	34	69.3 Å²	69.3	17%	0.167	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	131.8	-178.2	-174.5	71.8	83.2	0	0	110.3	A313 C317 T323 M339 L384 F388	A313-M386 HydrophobicContact CB-CE 3.78Å; C317-M386 WeakPolarHBondContact SG-CE 3.23Å; T323-M386 HydrophobicContact CG2-CE 4.26Å; T323-M386 HydrophobicContact CG2-SD 3.66Å; T323-M386 WeakPolarHBondContact O-CA 3.41Å; M339-M386 HydrophobicContact CE-CE 3.81Å; M339-M386 HydrophobicContact SD-CE 4.09Å; L384-M386 PolarHBondContact O-N 2.92Å; M386-F388 HydrophobicContact CG-CE1 4.41Å; M386-F388 HydrophobicContact CG-CE2 3.73Å; M386-F388 HydrophobicContact CG-CZ 3.66Å
387	Q	93.3	Very high	83.5	Confident	87 Å²	87	67.1 Å²	67.1	41%	0.407	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	152.6	174	-67.1	178	-43.1	0	0	110.3	T323 L324 W325	T323-Q387 PolarHBondContact O-N 3.3Å; L324-Q387 CarbonylContact C-O 3.5Å; L324-Q387 WeakPolarHBondContact CA-O 3.06Å; L324-Q387 HydrophobicContact CD1-CB 3.81Å; W325-Q387 PolarHBondContact N-O 3.18Å
388	F	94.5	Very high	83.6	Confident	66 Å²	66	74.4 Å²	74.4	29%	0.289	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	138.9	177.7	-58.5	-91.9	0	0	0	109.4	W325 V332 I335 M339 M386	W325-F388 HydrophobicContact CB-CD1 3.65Å; W325-F388 HydrophobicContact CB-CE1 3.97Å; W325-F388 HydrophobicContact CB-CG 4.5Å; W325-F388 HydrophobicContact CG-CD1 4.12Å; W325-F388 HydrophobicContact CG-CE1 4.28Å; W325-F388 WeakPolarHBondContact O-CA 3.4Å; V332-F388 HydrophobicContact CG1-CB 3.67Å; V332-F388 HydrophobicContact CG1-CD1 4.14Å; V332-F388 HydrophobicContact CG1-CG 3.86Å; V332-F388 HydrophobicContact CG2-CB 4.37Å; I335-F388 HydrophobicContact CG2-CD1 4.49Å; I335-F388 HydrophobicContact CG2-CE1 3.83Å; M339-F388 HydrophobicContact CE-CE1 4.29Å; M339-F388 HydrophobicContact CE-CZ 4.49Å; M339-F388 HydrophobicContact SD-CE1 3.99Å; M339-F388 HydrophobicContact SD-CZ 3.7Å; M386-F388 HydrophobicContact CG-CE1 4.41Å; M386-F388 HydrophobicContact CG-CE2 3.73Å; M386-F388 HydrophobicContact CG-CZ 3.66Å
389	V	93.3	Very high	83.6	Confident	32 Å²	32	69.5 Å²	69.5	19%	0.194	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	125.9	169.1	60.2	0	0	0	0	109.1	L324 W325 C326 C327 F391 T405	L324-V389 HydrophobicContact CD1-CB 4.33Å; L324-V389 HydrophobicContact CD1-CG1 4.06Å; L324-V389 HydrophobicContact CD2-CG1 4.28Å; L324-V389 HydrophobicContact CG-CG1 4.21Å; W325-V389 PolarHBondContact O-N 3.38Å; C326-V389 HydrophobicContact CB-CG1 4.13Å; C327-V389 WeakPolarHBondContact CB-O 3.4Å; C327-V389 PolarHBondContact N-O 2.88Å; V389-F391 HydrophobicContact CB-CE2 4.46Å; V389-F391 HydrophobicContact CG1-CD2 4.37Å; V389-F391 HydrophobicContact CG1-CE2 3.6Å; V389-F391 HydrophobicContact CG1-CZ 4.18Å; V389-F391 HydrophobicContact CG2-CE2 4.08Å; V389-F391 HydrophobicContact CG2-CZ 4.2Å; V389-T405 HydrophobicContact CG1-CG2 4.31Å; V389-T405 HydrophobicContact CG2-CG2 4.03Å
390	S	90.2	Very high	83.9	Confident	81 Å²	81	71 Å²	71	57%	0.566	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	123.5	173.6	-167.9	0	0	0	0	108.8
391	F	85.8	Confident	84.2	Confident	12 Å²	12	72.5 Å²	72.5	5%	0.053	38%	0.382	C	S	.	.			trans	-92	156.5	164.3	-65.8	-87.5	0	0	0	109.5	C326 C327 L328 V389 T393 T397 E401 L402 T405	C326-F391 HydrophobicContact CB-CE2 3.95Å; C327-F391 PolarHBondContact O-N 2.84Å; L328-F391 HydrophobicContact CD2-CB 3.77Å; L328-F391 HydrophobicContact CD2-CD1 4.45Å; L328-F391 HydrophobicContact CD2-CD2 3.46Å; L328-F391 VanDerWaalsContact CD2-CD2 3.46Å; L328-F391 HydrophobicContact CD2-CE2 4.15Å; L328-F391 HydrophobicContact CD2-CG 3.63Å; L328-F391 HydrophobicContact CG-CD2 4.37Å; V389-F391 HydrophobicContact CB-CE2 4.46Å; V389-F391 HydrophobicContact CG1-CD2 4.37Å; V389-F391 HydrophobicContact CG1-CE2 3.6Å; V389-F391 HydrophobicContact CG1-CZ 4.18Å; V389-F391 HydrophobicContact CG2-CE2 4.08Å; V389-F391 HydrophobicContact CG2-CZ 4.2Å; F391-T393 PolarHBondContact O-N 2.96Å; F391-T397 WeakPolarHBondContact CB-OG1 3.35Å; F391-T397 HydrophobicContact CD1-CG2 3.41Å; F391-T397 VanDerWaalsContact CD1-CG2 3.41Å; F391-T397 HydrophobicContact CE1-CG2 3.63Å; F391-T397 HydrophobicContact CG-CG2 4.08Å; F391-T397 HydrophobicContact CZ-CG2 4.44Å; F391-E401 HydrophobicContact CE1-CG 4.48Å; F391-L402 HydrophobicContact CE2-CD1 3.68Å; F391-L402 HydrophobicContact CZ-CD1 3.68Å; F391-T405 HydrophobicContact CZ-CG2 4.11Å
392	N	72	Confident	84.4	Confident	95 Å²	95	71.6 Å²	71.6	51%	0.508	38%	0.378	S	S	.	.			trans	-70.1	105.6	179.3	-175.8	-19.4	0	0	0	109.3	A394 K395	N392-A394 PolarHBondContact O-N 3.3Å; N392-A394 VanDerWaalsContact OD1-CB 3.31Å; N392-A394 WeakPolarHBondContact OD1-CB 3.34Å; N392-A394 PolarHBondContact OD1-N 2.99Å; N392-K395 HydrophobicContact CB-CB 4.33Å; N392-K395 CarbonylContact O-C 3.32Å; N392-K395 PolarHBondContact O-N 2.9Å
393	T	65.7	Low	84.7	Confident	96 Å²	96	69.8 Å²	69.8	59%	0.589	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-22.5	-179.2	55.6	0	0	0	0	113.6	L328 F391	L328-T393 WeakPolarHBondContact O-CG2 3.29Å; F391-T393 PolarHBondContact O-N 2.96Å
394	A	65.6	Low	85.1	Confident	90 Å²	90	67.9 Å²	67.9	74%	0.744	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-20.5	175.8	0	0	0	0	0	113.6	N392	N392-A394 PolarHBondContact O-N 3.3Å; N392-A394 VanDerWaalsContact OD1-CB 3.31Å; N392-A394 WeakPolarHBondContact OD1-CB 3.34Å; N392-A394 PolarHBondContact OD1-N 2.99Å
395	K	66.9	Low	85.2	Confident	158 Å²	158	68 Å²	68	69%	0.687	34%	0.343	S	S	*	.	S	Bend	trans	-116.6	112.6	177	-70.3	-173.8	179.5	-179.6	0	109.6	N392 T397	N392-K395 HydrophobicContact CB-CB 4.33Å; N392-K395 CarbonylContact O-C 3.32Å; N392-K395 PolarHBondContact O-N 2.9Å; K395-T397 PolarHBondContact O-N 3.3Å
396	R	69.2	Low	85.3	Confident	105 Å²	105	66.5 Å²	66.5	40%	0.396	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-54	123.8	174.6	-66	-179.2	-179.3	-169.9	-8.5	110.3	Q423 N426	R396-Q423 HydrophobicContact CB-CB 4Å; R396-Q423 HydrophobicContact CB-CG 4.26Å; R396-N426 PolarHBondContact NE-ND2 3.34Å; R396-N426 VanDerWaalsContact NH1-CB 3.31Å; R396-N426 PolarHBondContact NH1-OD1 2.82Å; R396-N426 PolarHBondContact NH2-ND2 3.5Å; R396-N426 VanDerWaalsContact NH2-ND2 3.14Å; R396-N426 PolarHBondContact NH2-OD1 3.17Å
397	T	81.4	Confident	85.3	Confident	8 Å²	8	69 Å²	69	5%	0.049	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-74	134.1	-178.1	-52.4	0	0	0	0	110.6	L328 F391 K395 E401 L402 Q423	L328-T397 HydrophobicContact CD2-CG2 4.25Å; L328-T397 WeakPolarHBondContact CD2-OG1 3.33Å; F391-T397 WeakPolarHBondContact CB-OG1 3.35Å; F391-T397 HydrophobicContact CD1-CG2 3.41Å; F391-T397 VanDerWaalsContact CD1-CG2 3.41Å; F391-T397 HydrophobicContact CE1-CG2 3.63Å; F391-T397 HydrophobicContact CG-CG2 4.08Å; F391-T397 HydrophobicContact CZ-CG2 4.44Å; K395-T397 PolarHBondContact O-N 3.3Å; T397-E401 HydrophobicContact CG2-CB 4.27Å; T397-E401 HydrophobicContact CG2-CG 4.32Å; T397-L402 HydrophobicContact CG2-CB 4.2Å; T397-Q423 WeakPolarHBondContact O-CB 3.21Å; T397-Q423 PolarHBondContact O-N 3.11Å
398	R	86.5	Confident	85.3	Confident	156 Å²	156	71.7 Å²	71.7	59%	0.589	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-73.2	142.8	173	-68.6	-178.6	-175.7	-175.4	3.5	110.3	K400 E401 L402	R398-K400 PolarHBondContact O-N 2.83Å; R398-E401 HydrophobicContact CB-CB 4.37Å; R398-E401 WeakPolarHBondContact O-CB 3.29Å; R398-E401 PolarHBondContact O-N 2.98Å; R398-L402 PolarHBondContact O-N 3.22Å; R398-L402 VanDerWaalsContact O-N 3.08Å
399	L	88.6	Confident	85.1	Confident	11 Å²	11	72.2 Å²	72.2	6%	0.058	36%	0.361	C	S	.	.	H	α-helix	trans	-54	-41.3	178.1	178.9	60.8	0	0	0	111.7	E401 L402 L403 V422 E424 D440 I441	L399-E401 PolarHBondContact O-N 2.95Å; L399-L402 PolarHBondContact O-N 3.49Å; L399-L403 HydrophobicContact CD1-CD1 3.99Å; L399-L403 HydrophobicContact CD1-CD2 4.38Å; L399-L403 HydrophobicContact CD1-CG 3.94Å; L399-L403 HydrophobicContact CG-CD1 3.95Å; L399-L403 HydrophobicContact CG-CG 4.27Å; L399-L403 VanDerWaalsContact O-CG 3.32Å; L399-L403 WeakPolarHBondContact O-CG 3.3Å; L399-L403 PolarHBondContact O-N 3.01Å; L399-V422 HydrophobicContact CB-CG1 3.81Å; L399-V422 HydrophobicContact CD1-CG1 4.27Å; L399-E424 HydrophobicContact CB-CG 4.47Å; L399-E424 WeakPolarHBondContact CB-OE2 3.38Å; L399-E424 VanDerWaalsContact N-CD 3.35Å; L399-E424 PolarHBondContact N-OE1 2.64Å; L399-E424 PolarHBondContact N-OE2 3.5Å; L399-D440 HydrophobicContact CD2-CB 3.97Å; L399-I441 HydrophobicContact CD1-CD1 4.09Å; L399-I441 HydrophobicContact CD1-CG1 3.69Å
400	K	89.6	Confident	84.8	Confident	140 Å²	140	74.4 Å²	74.4	61%	0.609	38%	0.377	S	S	*	.	H	α-helix	trans	-58.7	-46.2	177.4	-177.5	175.8	172.6	179.4	0	112.4	R398 L403 E404	R398-K400 PolarHBondContact O-N 2.83Å; K400-L403 PolarHBondContact O-N 3.28Å; K400-E404 WeakPolarHBondContact CE-OE1 3.25Å; K400-E404 HydrophobicContact CG-CG 4.36Å; K400-E404 IonicContact NZ-OE1 3.13Å; K400-E404 WeakPolarHBondContact O-CB 3.36Å; K400-E404 VanDerWaalsContact O-CG 3.27Å; K400-E404 WeakPolarHBondContact O-CG 3.41Å; K400-E404 PolarHBondContact O-N 3.21Å
401	E	90.4	Very high	84.9	Confident	97 Å²	97	71 Å²	71	45%	0.453	35%	0.353	S	S	.	.	H	α-helix	trans	-63.7	-41.9	179.1	-177.5	-175.6	175.7	0	0	111.2	F391 T397 R398 L399 T405	F391-E401 HydrophobicContact CE1-CG 4.48Å; T397-E401 HydrophobicContact CG2-CB 4.27Å; T397-E401 HydrophobicContact CG2-CG 4.32Å; R398-E401 HydrophobicContact CB-CB 4.37Å; R398-E401 WeakPolarHBondContact O-CB 3.29Å; R398-E401 PolarHBondContact O-N 2.98Å; L399-E401 PolarHBondContact O-N 2.95Å; E401-T405 WeakPolarHBondContact O-CB 3.49Å; E401-T405 PolarHBondContact O-N 3.1Å; E401-T405 PolarHBondContact O-OG1 3.02Å
402	L	92.5	Very high	85.3	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-61.4	-49	175.5	176.5	63.3	0	0	0	111.9	C326 F391 T397 R398 L399 T405 I406 I416 V422	C326-L402 HydrophobicContact CB-CD1 3.84Å; F391-L402 HydrophobicContact CE2-CD1 3.68Å; F391-L402 HydrophobicContact CZ-CD1 3.68Å; T397-L402 HydrophobicContact CG2-CB 4.2Å; R398-L402 PolarHBondContact O-N 3.22Å; R398-L402 VanDerWaalsContact O-N 3.08Å; L399-L402 PolarHBondContact O-N 3.49Å; L402-T405 WeakPolarHBondContact O-CB 3.46Å; L402-T405 PolarHBondContact O-N 3.49Å; L402-I406 HydrophobicContact CD1-CD1 4.23Å; L402-I406 HydrophobicContact CG-CD1 4.19Å; L402-I406 WeakPolarHBondContact O-CG1 3.3Å; L402-I406 PolarHBondContact O-N 3.02Å; L402-I406 VanDerWaalsContact O-N 3.08Å; L402-I416 HydrophobicContact CD2-CD1 3.92Å; L402-I416 HydrophobicContact CD2-CG1 4.26Å; L402-I416 HydrophobicContact CD2-CG2 4.32Å; L402-V422 HydrophobicContact CD2-CG2 3.87Å
403	L	93.4	Very high	86.5	Confident	20 Å²	20	68.3 Å²	68.3	11%	0.105	34%	0.338	C	S	.	.	H	α-helix	trans	-68.9	-39.8	-178	-66.3	-178.9	0	0	0	112.4	L399 K400 T405 I406 E407 F444	L399-L403 HydrophobicContact CD1-CD1 3.99Å; L399-L403 HydrophobicContact CD1-CD2 4.38Å; L399-L403 HydrophobicContact CD1-CG 3.94Å; L399-L403 HydrophobicContact CG-CD1 3.95Å; L399-L403 HydrophobicContact CG-CG 4.27Å; L399-L403 VanDerWaalsContact O-CG 3.32Å; L399-L403 WeakPolarHBondContact O-CG 3.3Å; L399-L403 PolarHBondContact O-N 3.01Å; K400-L403 PolarHBondContact O-N 3.28Å; L403-T405 VanDerWaalsContact C-N 3.31Å; L403-T405 PolarHBondContact O-N 2.91Å; L403-I406 HydrophobicContact CD2-CD1 4.44Å; L403-I406 PolarHBondContact O-N 2.86Å; L403-E407 WeakPolarHBondContact O-CB 3.41Å; L403-E407 PolarHBondContact O-N 3.49Å; L403-F444 HydrophobicContact CB-CD2 3.93Å; L403-F444 HydrophobicContact CB-CE2 3.88Å; L403-F444 HydrophobicContact CB-CG 4.47Å; L403-F444 HydrophobicContact CB-CZ 4.38Å; L403-F444 HydrophobicContact CD1-CB 4.1Å; L403-F444 HydrophobicContact CD1-CD2 4.09Å; L403-F444 HydrophobicContact CD1-CG 4.2Å; L403-F444 HydrophobicContact CD2-CB 4.13Å; L403-F444 HydrophobicContact CD2-CD1 3.88Å; L403-F444 HydrophobicContact CD2-CD2 4.12Å; L403-F444 HydrophobicContact CD2-CE1 4.27Å; L403-F444 HydrophobicContact CD2-CE2 4.49Å; L403-F444 HydrophobicContact CD2-CG 3.78Å; L403-F444 HydrophobicContact CG-CD2 4.26Å; L403-F444 HydrophobicContact CG-CG 4.36Å; L403-F444 WeakPolarHBondContact O-CZ 3.18Å
404	E	93.1	Very high	88	Confident	82 Å²	82	63.8 Å²	63.8	38%	0.383	31%	0.31	S	S	.	.	H	α-helix	trans	-61.6	-40	173.9	-75.7	173.8	169.1	0	0	111.4	K400 E407 Q408	K400-E404 WeakPolarHBondContact CE-OE1 3.25Å; K400-E404 HydrophobicContact CG-CG 4.36Å; K400-E404 IonicContact NZ-OE1 3.13Å; K400-E404 WeakPolarHBondContact O-CB 3.36Å; K400-E404 VanDerWaalsContact O-CG 3.27Å; K400-E404 WeakPolarHBondContact O-CG 3.41Å; K400-E404 PolarHBondContact O-N 3.21Å; E404-E407 PolarHBondContact O-N 2.88Å; E404-Q408 VanDerWaalsContact O-CG 3.27Å; E404-Q408 WeakPolarHBondContact O-CG 3.41Å; E404-Q408 PolarHBondContact O-N 3.35Å
405	T	93.1	Very high	89.5	Confident	25 Å²	25	59.5 Å²	59.5	15%	0.153	27%	0.274	C	S	.	.	H	α-helix	trans	-61.9	-45.9	175.1	-58.3	0	0	0	0	111.2	V389 F391 E401 L402 L403 E407 Q408 Q409	V389-T405 HydrophobicContact CG1-CG2 4.31Å; V389-T405 HydrophobicContact CG2-CG2 4.03Å; F391-T405 HydrophobicContact CZ-CG2 4.11Å; E401-T405 WeakPolarHBondContact O-CB 3.49Å; E401-T405 PolarHBondContact O-N 3.1Å; E401-T405 PolarHBondContact O-OG1 3.02Å; L402-T405 WeakPolarHBondContact O-CB 3.46Å; L402-T405 PolarHBondContact O-N 3.49Å; L403-T405 VanDerWaalsContact C-N 3.31Å; L403-T405 PolarHBondContact O-N 2.91Å; T405-E407 VanDerWaalsContact C-N 3.34Å; T405-E407 PolarHBondContact O-N 3.23Å; T405-Q408 PolarHBondContact O-N 3.36Å; T405-Q409 WeakPolarHBondContact O-CG 3.22Å; T405-Q409 PolarHBondContact O-N 3.36Å
406	I	94.6	Very high	90.8	Very high	2 Å²	2	52 Å²	52	1%	0.01	24%	0.242	C	C	.	.	H	α-helix	trans	-61.8	-43.2	177.5	-66.9	164.4	0	0	0	110.9	L324 L402 L403 Q408 Q409 V411 A414 F444 V450	L324-I406 HydrophobicContact CD2-CG1 4.12Å; L402-I406 HydrophobicContact CD1-CD1 4.23Å; L402-I406 HydrophobicContact CG-CD1 4.19Å; L402-I406 WeakPolarHBondContact O-CG1 3.3Å; L402-I406 PolarHBondContact O-N 3.02Å; L402-I406 VanDerWaalsContact O-N 3.08Å; L403-I406 HydrophobicContact CD2-CD1 4.44Å; L403-I406 PolarHBondContact O-N 2.86Å; I406-Q408 PolarHBondContact O-N 3.37Å; I406-Q409 PolarHBondContact O-N 3.04Å; I406-V411 HydrophobicContact CG2-CG2 4.16Å; I406-A414 HydrophobicContact CD1-CB 3.93Å; I406-A414 HydrophobicContact CG1-CB 4.07Å; I406-A414 HydrophobicContact CG2-CB 3.86Å; I406-F444 HydrophobicContact CB-CE1 4.37Å; I406-F444 HydrophobicContact CB-CZ 4.34Å; I406-F444 HydrophobicContact CG2-CE1 3.88Å; I406-F444 HydrophobicContact CG2-CZ 4.19Å; I406-V450 HydrophobicContact CG2-CG1 4.44Å
407	E	92.4	Very high	91.7	Very high	87 Å²	87	47 Å²	47	41%	0.407	22%	0.223	S	C	.	.	H	α-helix	trans	-61.3	-43.1	179.4	-173.3	165.8	-163.4	0	0	112.1	L403 E404 T405 Q409 S410 F444 R448	L403-E407 WeakPolarHBondContact O-CB 3.41Å; L403-E407 PolarHBondContact O-N 3.49Å; E404-E407 PolarHBondContact O-N 2.88Å; T405-E407 VanDerWaalsContact C-N 3.34Å; T405-E407 PolarHBondContact O-N 3.23Å; E407-Q409 VanDerWaalsContact C-N 3.31Å; E407-Q409 PolarHBondContact O-N 3.08Å; E407-S410 PolarHBondContact O-N 3.42Å; E407-F444 HydrophobicContact CB-CE2 4.19Å; E407-F444 HydrophobicContact CB-CZ 3.97Å; E407-R448 IonicContact OE1-CZ 2.71Å; E407-R448 IonicContact OE1-NE 3.54Å; E407-R448 PolarHBondContact OE1-NE 3.36Å; E407-R448 IonicContact OE1-NH2 2.68Å; E407-R448 PolarHBondContact OE1-NH2 3.17Å; E407-R448 IonicContact OE2-NE 3.15Å; E407-R448 IonicContact OE2-NH2 2.79Å
408	Q	91.7	Very high	91.9	Very high	142 Å²	142	48.1 Å²	48.1	66%	0.664	23%	0.229	S	C	*	.	H	α-helix	trans	-64.2	-31.8	-179.8	-73.2	170.8	8.6	0	0	113.4	E404 T405 I406 S410	E404-Q408 VanDerWaalsContact O-CG 3.27Å; E404-Q408 WeakPolarHBondContact O-CG 3.41Å; E404-Q408 PolarHBondContact O-N 3.35Å; T405-Q408 PolarHBondContact O-N 3.36Å; I406-Q408 PolarHBondContact O-N 3.37Å; Q408-S410 VanDerWaalsContact C-N 3.28Å; Q408-S410 PolarHBondContact O-N 3.28Å
409	Q	90.2	Very high	91.6	Very high	78 Å²	78	40.9 Å²	40.9	36%	0.364	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-7.4	-178.8	-59.8	-50.6	-54.7	0	0	113.9	L324 T405 I406 E407 V411	L324-Q409 HydrophobicContact CD1-CG 4.27Å; L324-Q409 HydrophobicContact CD2-CB 4.17Å; L324-Q409 HydrophobicContact CD2-CG 3.88Å; T405-Q409 WeakPolarHBondContact O-CG 3.22Å; T405-Q409 PolarHBondContact O-N 3.36Å; I406-Q409 PolarHBondContact O-N 3.04Å; E407-Q409 VanDerWaalsContact C-N 3.31Å; E407-Q409 PolarHBondContact O-N 3.08Å; Q409-V411 HydrophobicContact CB-CG1 3.96Å; Q409-V411 PolarHBondContact O-N 3.2Å; Q409-V411 VanDerWaalsContact O-N 3.17Å
410	S	87.2	Confident	90.9	Very high	77 Å²	77	42.8 Å²	42.8	54%	0.538	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	39.3	177.5	-61.3	0	0	0	0	114	R322 E407 Q408	R322-S410 PolarHBondContact NH1-O 3.03Å; R322-S410 PolarHBondContact NH2-O 3.17Å; E407-S410 PolarHBondContact O-N 3.42Å; Q408-S410 VanDerWaalsContact C-N 3.28Å; Q408-S410 PolarHBondContact O-N 3.28Å
411	V	93.5	Very high	90.2	Very high	10 Å²	10	37 Å²	37	6%	0.061	19%	0.19	C	C	.	.			trans	-85.5	162.9	-178.2	-67.6	0	0	0	0	113.1	L324 I406 Q409 V450	L324-V411 HydrophobicContact CB-CB 4.34Å; L324-V411 HydrophobicContact CB-CG1 3.88Å; L324-V411 HydrophobicContact CB-CG2 3.93Å; I406-V411 HydrophobicContact CG2-CG2 4.16Å; Q409-V411 HydrophobicContact CB-CG1 3.96Å; Q409-V411 PolarHBondContact O-N 3.2Å; Q409-V411 VanDerWaalsContact O-N 3.17Å; V411-V450 WeakPolarHBondContact O-CG2 3.18Å
412	Q	94.3	Very high	89.5	Confident	51 Å²	51	32.3 Å²	32.3	24%	0.238	17%	0.168	C	C	.	.	S	Bend	trans	-95.7	-25.6	174.5	-72.6	170	-61.4	0	0	112.1	L291 V321 R322 H451	L291-Q412 HydrophobicContact CD2-CB 3.98Å; L291-Q412 HydrophobicContact CD2-CG 4.44Å; L291-Q412 WeakPolarHBondContact CD2-O 3.36Å; V321-Q412 HydrophobicContact CG1-CB 4.04Å; R322-Q412 PolarHBondContact O-N 2.92Å; Q412-H451 PolarHBondContact O-N 3.38Å
413	H	97.1	Very high	88.2	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	132.1	-177.1	-176.9	-148.7	0	0	0	109.8	F289 Y312 V321 R322 T323 L324 I415 H451 T453	F289-H413 HydrophobicContact CE1-CB 4.44Å; F289-H413 HydrophobicContact CE2-CB 4.49Å; F289-H413 AromaticContact CE2-CD2 3.78Å; F289-H413 HydrophobicContact CZ-CB 3.67Å; F289-H413 AromaticContact CZ-CD2 3.75Å; F289-H413 AromaticContact CZ-CG 3.67Å; Y312-H413 AromaticContact CE1-CE1 3.65Å; Y312-H413 AromaticContact CE1-NE2 3.78Å; V321-H413 HydrophobicContact CG1-CB 3.93Å; R322-H413 PolarHBondContact O-N 3.17Å; T323-H413 CarbonylContact C-O 3.52Å; T323-H413 WeakPolarHBondContact CA-O 3.17Å; T323-H413 HydrophobicContact CG2-CB 4.24Å; T323-H413 VanDerWaalsContact CG2-ND1 3.3Å; T323-H413 WeakPolarHBondContact CG2-ND1 3.42Å; T323-H413 PolarHBondContact OG1-ND1 3.41Å; L324-H413 PolarHBondContact N-O 3.46Å; H413-I415 VanDerWaalsContact CE1-CG1 3.43Å; H413-I415 WeakPolarHBondContact CE1-CG1 3.32Å; H413-H451 WeakPolarHBondContact CA-O 3.37Å; H413-T453 PolarHBondContact NE2-OG1 2.85Å
414	A	97.1	Very high	86.9	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	128.5	172.6	0	0	0	0	0	110.3	L324 I406 V450 H451 I452 T453	L324-A414 CarbonylContact O-C 3.6Å; L324-A414 WeakPolarHBondContact O-CA 3.15Å; I406-A414 HydrophobicContact CD1-CB 3.93Å; I406-A414 HydrophobicContact CG1-CB 4.07Å; I406-A414 HydrophobicContact CG2-CB 3.86Å; A414-V450 HydrophobicContact CB-CG1 4.47Å; A414-H451 PolarHBondContact N-O 2.89Å; A414-I452 WeakPolarHBondContact O-CA 3.39Å; A414-T453 PolarHBondContact O-N 2.81Å
415	I	96.6	Very high	85.2	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	127.9	176.6	-60.5	170.9	0	0	0	109	A313 T323 L324 W325 C326 H413 T453	A313-I415 HydrophobicContact CB-CD1 3.44Å; A313-I415 VanDerWaalsContact CB-CD1 3.44Å; T323-I415 HydrophobicContact CG2-CD1 3.97Å; T323-I415 HydrophobicContact CG2-CG1 4.32Å; L324-I415 PolarHBondContact O-N 2.95Å; W325-I415 HydrophobicContact CD2-CB 4.18Å; W325-I415 HydrophobicContact CD2-CD1 4.29Å; W325-I415 HydrophobicContact CD2-CG2 4.01Å; W325-I415 HydrophobicContact CE3-CB 4.13Å; W325-I415 HydrophobicContact CE3-CD1 3.4Å; W325-I415 VanDerWaalsContact CE3-CD1 3.4Å; W325-I415 HydrophobicContact CE3-CG1 4.36Å; W325-I415 HydrophobicContact CE3-CG2 4.07Å; W325-I415 HydrophobicContact CH2-CD1 4.39Å; W325-I415 HydrophobicContact CH2-CG2 4.14Å; W325-I415 HydrophobicContact CZ2-CG2 4.08Å; W325-I415 HydrophobicContact CZ3-CD1 3.46Å; W325-I415 VanDerWaalsContact CZ3-CD1 3.46Å; W325-I415 HydrophobicContact CZ3-CG2 4.13Å; C326-I415 WeakPolarHBondContact CA-O 3.44Å; C326-I415 VanDerWaalsContact CB-O 3.29Å; C326-I415 WeakPolarHBondContact CB-O 3.36Å; C326-I415 PolarHBondContact N-O 3.02Å; H413-I415 VanDerWaalsContact CE1-CG1 3.43Å; H413-I415 WeakPolarHBondContact CE1-CG1 3.32Å; I415-T453 CarbonylContact C-O 3.56Å; I415-T453 VanDerWaalsContact CA-O 3.32Å; I415-T453 WeakPolarHBondContact CA-O 3.44Å
416	I	93.6	Very high	83.7	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	110.8	176	-57.3	167.2	0	0	0	107.7	L328 L402 N418 L419 I452 T453 I455	L328-I416 HydrophobicContact CD1-CG2 3.62Å; L402-I416 HydrophobicContact CD2-CD1 3.92Å; L402-I416 HydrophobicContact CD2-CG1 4.26Å; L402-I416 HydrophobicContact CD2-CG2 4.32Å; I416-N418 VanDerWaalsContact C-N 3.33Å; I416-N418 PolarHBondContact O-N 3.05Å; I416-L419 HydrophobicContact CB-CD2 4.45Å; I416-L419 HydrophobicContact CD1-CD2 4.08Å; I416-L419 HydrophobicContact CG2-CD2 4.12Å; I416-L419 HydrophobicContact CG2-CG 4.25Å; I416-I452 HydrophobicContact CD1-CG2 3.75Å; I416-I452 HydrophobicContact CG1-CG2 4.46Å; I416-T453 PolarHBondContact N-O 3.48Å; I416-I455 PolarHBondContact O-N 2.95Å
417	D	89.2	Confident	81.7	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.005	21%	0.212	C	C	.	.	S	Bend	trans	-72.7	-20.5	-167	80.5	-33	0	0	0	115.2	C326 L328 E329 T330 I455	C326-D417 PolarHBondContact O-N 2.89Å; L328-D417 WeakPolarHBondContact CA-OD1 3.23Å; L328-D417 WeakPolarHBondContact CB-OD1 3.42Å; L328-D417 PolarHBondContact N-OD1 3.25Å; E329-D417 PolarHBondContact N-OD1 3.16Å; E329-D417 PolarHBondContact N-OD2 3.19Å; T330-D417 WeakPolarHBondContact CB-OD2 3.14Å; T330-D417 PolarHBondContact N-OD2 3.47Å; T330-D417 PolarHBondContact OG1-OD2 3Å; D417-I455 WeakPolarHBondContact O-CB 3.38Å
418	N	84.5	Confident	80	Confident	32 Å²	32	39.3 Å²	39.3	17%	0.171	20%	0.2	C	C	.	.			trans	-153.5	103	168.2	-177.1	-3.4	0	0	0	110.3	L328 E329 I416 L420 A421 I455	L328-N418 WeakPolarHBondContact CD1-O 3.42Å; E329-N418 HydrophobicContact CB-CB 4.22Å; E329-N418 PolarHBondContact OE2-ND2 2.56Å; I416-N418 VanDerWaalsContact C-N 3.33Å; I416-N418 PolarHBondContact O-N 3.05Å; N418-L420 PolarHBondContact O-N 2.93Å; N418-L420 WeakPolarHBondContact OD1-CB 3.41Å; N418-L420 PolarHBondContact OD1-N 2.89Å; N418-A421 HydrophobicContact CB-CB 4.19Å; N418-A421 WeakPolarHBondContact O-CB 3.41Å; N418-A421 PolarHBondContact O-N 2.82Å; N418-I455 WeakPolarHBondContact CA-O 3.19Å
419	L	80.1	Confident	78.2	Confident	4 Å²	4	42.3 Å²	42.3	2%	0.021	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-60.2	-27.5	178.5	-84.8	164.3	0	0	0	113.7	L296 I416 A421 V422 A425 F438 I441 I455 A456	L296-L419 HydrophobicContact CD2-CD1 3.56Å; I416-L419 HydrophobicContact CB-CD2 4.45Å; I416-L419 HydrophobicContact CD1-CD2 4.08Å; I416-L419 HydrophobicContact CG2-CD2 4.12Å; I416-L419 HydrophobicContact CG2-CG 4.25Å; L419-A421 PolarHBondContact O-N 3.07Å; L419-V422 WeakPolarHBondContact O-CB 3.46Å; L419-V422 WeakPolarHBondContact O-CG2 3.23Å; L419-V422 PolarHBondContact O-N 3.44Å; L419-A425 WeakPolarHBondContact O-CB 3.33Å; L419-F438 HydrophobicContact CD1-CE1 3.74Å; L419-F438 HydrophobicContact CD1-CZ 4.15Å; L419-I441 HydrophobicContact CD2-CD1 3.64Å; L419-I455 PolarHBondContact N-O 3.22Å; L419-A456 HydrophobicContact CD1-CB 4.33Å
420	L	73.6	Confident	76.8	Confident	51 Å²	51	42.3 Å²	42.3	27%	0.267	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-76	-9.8	177.1	-66.3	176.3	0	0	0	113.2	N418 V422 N426 D457 V460	N418-L420 PolarHBondContact O-N 2.93Å; N418-L420 WeakPolarHBondContact OD1-CB 3.41Å; N418-L420 PolarHBondContact OD1-N 2.89Å; L420-V422 VanDerWaalsContact C-N 3.26Å; L420-N426 VanDerWaalsContact O-CB 3.28Å; L420-N426 WeakPolarHBondContact O-CB 3.44Å; L420-N426 PolarHBondContact O-ND2 2.98Å; L420-D457 HydrophobicContact CD1-CB 4.28Å; L420-V460 HydrophobicContact CD1-CG2 3.8Å; L420-V460 HydrophobicContact CD2-CG2 3.78Å; L420-V460 HydrophobicContact CG-CG2 3.96Å
421	A	75	Confident	75.7	Confident	17 Å²	17	42.5 Å²	42.5	14%	0.14	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-77.8	-15.1	173	0	0	0	0	0	112.4	L328 N418 L419 Q423	L328-A421 HydrophobicContact CB-CB 3.64Å; L328-A421 HydrophobicContact CD1-CB 4.08Å; L328-A421 HydrophobicContact CG-CB 4.46Å; N418-A421 HydrophobicContact CB-CB 4.19Å; N418-A421 WeakPolarHBondContact O-CB 3.41Å; N418-A421 PolarHBondContact O-N 2.82Å; L419-A421 PolarHBondContact O-N 3.07Å; A421-Q423 PolarHBondContact O-N 2.84Å
422	V	76.1	Confident	74.5	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.231	C	C	.	.	S	Bend	trans	-65.4	128.7	172.2	-179.4	0	0	0	0	109.4	L328 L399 L402 L419 L420 E424 A425 N426	L328-V422 HydrophobicContact CD1-CG2 3.95Å; L399-V422 HydrophobicContact CB-CG1 3.81Å; L399-V422 HydrophobicContact CD1-CG1 4.27Å; L402-V422 HydrophobicContact CD2-CG2 3.87Å; L419-V422 WeakPolarHBondContact O-CB 3.46Å; L419-V422 WeakPolarHBondContact O-CG2 3.23Å; L419-V422 PolarHBondContact O-N 3.44Å; L420-V422 VanDerWaalsContact C-N 3.26Å; V422-E424 VanDerWaalsContact C-N 3.28Å; V422-E424 WeakPolarHBondContact CG1-OE2 3.43Å; V422-E424 PolarHBondContact O-N 3.3Å; V422-A425 HydrophobicContact CB-CB 4.22Å; V422-A425 WeakPolarHBondContact O-CB 3.02Å; V422-A425 PolarHBondContact O-N 3.25Å; V422-N426 PolarHBondContact O-N 3.45Å
423	Q	66.3	Low	73.3	Confident	56 Å²	56	48.1 Å²	48.1	26%	0.262	24%	0.237	S	C	.	.	H	α-helix	trans	-51	-49.2	-172.5	-174	169.4	4.4	0	0	111.5	R396 T397 A421 A425 N426 Y427	R396-Q423 HydrophobicContact CB-CB 4Å; R396-Q423 HydrophobicContact CB-CG 4.26Å; T397-Q423 WeakPolarHBondContact O-CB 3.21Å; T397-Q423 PolarHBondContact O-N 3.11Å; A421-Q423 PolarHBondContact O-N 2.84Å; Q423-A425 VanDerWaalsContact C-N 3.34Å; Q423-A425 PolarHBondContact O-N 3.45Å; Q423-N426 PolarHBondContact O-N 3.21Å; Q423-Y427 HydrophobicContact CB-CD2 4.47Å; Q423-Y427 HydrophobicContact CG-CD2 3.36Å; Q423-Y427 HydrophobicContact CG-CE2 3.51Å; Q423-Y427 VanDerWaalsContact O-CD2 3.23Å; Q423-Y427 WeakPolarHBondContact O-CD2 3.4Å; Q423-Y427 PolarHBondContact O-N 3.43Å
424	E	65.4	Low	72.1	Confident	70 Å²	70	50.3 Å²	50.3	33%	0.327	25%	0.248	S	C	.	.	H	α-helix	trans	-66.3	-32.3	-178.3	-65.1	82.4	171.6	0	0	112.7	L399 V422 A428	L399-E424 HydrophobicContact CB-CG 4.47Å; L399-E424 WeakPolarHBondContact CB-OE2 3.38Å; L399-E424 VanDerWaalsContact N-CD 3.35Å; L399-E424 PolarHBondContact N-OE1 2.64Å; L399-E424 PolarHBondContact N-OE2 3.5Å; V422-E424 VanDerWaalsContact C-N 3.28Å; V422-E424 WeakPolarHBondContact CG1-OE2 3.43Å; V422-E424 PolarHBondContact O-N 3.3Å; E424-A428 WeakPolarHBondContact O-CB 3.38Å; E424-A428 PolarHBondContact O-N 2.91Å
425	A	58	Low	70.9	Confident	8 Å²	8	54.2 Å²	54.2	7%	0.066	27%	0.265	C	S	.	.	H	α-helix	trans	-73.8	-31.5	175.2	0	0	0	0	0	112.1	L419 V422 Q423	L419-A425 WeakPolarHBondContact O-CB 3.33Å; V422-A425 HydrophobicContact CB-CB 4.22Å; V422-A425 WeakPolarHBondContact O-CB 3.02Å; V422-A425 PolarHBondContact O-N 3.25Å; Q423-A425 VanDerWaalsContact C-N 3.34Å; Q423-A425 PolarHBondContact O-N 3.45Å
426	N	60.6	Low	70.2	Confident	68 Å²	68	61.5 Å²	61.5	36%	0.364	29%	0.292	S	S	.	.	H	α-helix	trans	-89.1	-35.3	-174.8	-154.3	-37.9	0	0	0	113.4	R396 L420 V422 Q423 A428	R396-N426 PolarHBondContact NE-ND2 3.34Å; R396-N426 VanDerWaalsContact NH1-CB 3.31Å; R396-N426 PolarHBondContact NH1-OD1 2.82Å; R396-N426 PolarHBondContact NH2-ND2 3.5Å; R396-N426 VanDerWaalsContact NH2-ND2 3.14Å; R396-N426 PolarHBondContact NH2-OD1 3.17Å; L420-N426 VanDerWaalsContact O-CB 3.28Å; L420-N426 WeakPolarHBondContact O-CB 3.44Å; L420-N426 PolarHBondContact O-ND2 2.98Å; V422-N426 PolarHBondContact O-N 3.45Å; Q423-N426 PolarHBondContact O-N 3.21Å; N426-A428 VanDerWaalsContact C-N 3.25Å
427	Y	53.6	Low	69.6	Low	141 Å²	141	61.8 Å²	61.8	55%	0.553	29%	0.294	S	S	*	.	S	Bend	trans	-82.2	-5.2	174.9	-76.3	-71.6	0	0	0	113.3	Q423 K429	Q423-Y427 HydrophobicContact CB-CD2 4.47Å; Q423-Y427 HydrophobicContact CG-CD2 3.36Å; Q423-Y427 HydrophobicContact CG-CE2 3.51Å; Q423-Y427 VanDerWaalsContact O-CD2 3.23Å; Q423-Y427 WeakPolarHBondContact O-CD2 3.4Å; Q423-Y427 PolarHBondContact O-N 3.43Å; Y427-K429 PolarHBondContact O-N 2.79Å
428	A	56.9	Low	69.4	Low	19 Å²	19	62 Å²	62	16%	0.157	30%	0.295	C	S	.	.			trans	-59.3	103.2	177.6	0	0	0	0	0	110.4	E424 N426 E433 I434	E424-A428 WeakPolarHBondContact O-CB 3.38Å; E424-A428 PolarHBondContact O-N 2.91Å; N426-A428 VanDerWaalsContact C-N 3.25Å; A428-E433 WeakPolarHBondContact CA-OE2 3.44Å; A428-E433 HydrophobicContact CB-CB 3.53Å; A428-I434 HydrophobicContact CB-CB 4.47Å; A428-I434 HydrophobicContact CB-CD1 4.21Å; A428-I434 HydrophobicContact CB-CG1 3.34Å
429	K	53.7	Low	69.6	Low	205 Å²	205	61.5 Å²	61.5	89%	0.891	30%	0.295	S	S	*	.			trans	-77.3	-20.1	178	-70.6	-174.4	179.5	-179.4	0	111.2	Y427 E433	Y427-K429 PolarHBondContact O-N 2.79Å; K429-E433 PolarHBondContact N-OE2 3.21Å
430	N	60.8	Low	70.1	Confident	79 Å²	79	64.2 Å²	64.2	42%	0.422	31%	0.31	S	S	.	.	S	Bend	trans	-131.1	159.4	-179	67.6	51.1	0	0	0	110.8	Q432 E433	N430-Q432 PolarHBondContact O-N 3.41Å; N430-Q432 WeakPolarHBondContact OD1-CA 3.45Å; N430-Q432 VanDerWaalsContact OD1-CB 3.26Å; N430-Q432 WeakPolarHBondContact OD1-CB 3.48Å; N430-Q432 PolarHBondContact OD1-N 2.99Å; N430-Q432 VanDerWaalsContact OD1-N 3.07Å; N430-E433 PolarHBondContact O-N 3.18Å; N430-E433 PolarHBondContact OD1-N 2.89Å
431	V	64.4	Low	70.9	Confident	80 Å²	80	61.9 Å²	61.9	49%	0.485	30%	0.298	S	S	.	.	H	α-helix	trans	-62.9	-26.8	-177	-158.8	0	0	0	0	112.2	E433 I434 K435 Q472	V431-E433 PolarHBondContact O-N 3.46Å; V431-I434 PolarHBondContact O-N 2.78Å; V431-K435 PolarHBondContact O-N 3.32Å; V431-Q472 HydrophobicContact CG1-CB 4.33Å; V431-Q472 HydrophobicContact CG1-CG 3.64Å; V431-Q472 VanDerWaalsContact CG1-OE1 3.3Å; V431-Q472 PolarHBondContact O-OE1 3.18Å
432	Q	68	Low	71.7	Confident	103 Å²	103	63.3 Å²	63.3	48%	0.481	30%	0.299	S	S	.	.	H	α-helix	trans	-67.4	-35.4	-178	-161.5	73	-7.9	0	0	112.6	N430 K435 R436	N430-Q432 PolarHBondContact O-N 3.41Å; N430-Q432 WeakPolarHBondContact OD1-CA 3.45Å; N430-Q432 VanDerWaalsContact OD1-CB 3.26Å; N430-Q432 WeakPolarHBondContact OD1-CB 3.48Å; N430-Q432 PolarHBondContact OD1-N 2.99Å; N430-Q432 VanDerWaalsContact OD1-N 3.07Å; Q432-K435 PolarHBondContact O-N 3.29Å; Q432-R436 WeakPolarHBondContact O-CG 3.37Å; Q432-R436 PolarHBondContact O-N 2.86Å
433	E	68.7	Low	72.5	Confident	77 Å²	77	70.4 Å²	70.4	36%	0.36	33%	0.326	S	S	.	.	H	α-helix	trans	-69.5	-40.2	177	-74.2	167.7	169.6	0	0	111.3	A428 K429 N430 V431 R436 C437	A428-E433 WeakPolarHBondContact CA-OE2 3.44Å; A428-E433 HydrophobicContact CB-CB 3.53Å; K429-E433 PolarHBondContact N-OE2 3.21Å; N430-E433 PolarHBondContact O-N 3.18Å; N430-E433 PolarHBondContact OD1-N 2.89Å; V431-E433 PolarHBondContact O-N 3.46Å; E433-R436 PolarHBondContact O-N 3.17Å; E433-C437 PolarHBondContact O-N 3.26Å; E433-C437 VanDerWaalsContact O-N 3.12Å
434	I	71.1	Confident	73.9	Confident	46 Å²	46	68.9 Å²	68.9	24%	0.236	32%	0.319	C	S	.	.	H	α-helix	trans	-60.7	-46.7	172.6	-58.4	-177	0	0	0	110.1	A428 V431 R436 C437 F438	A428-I434 HydrophobicContact CB-CB 4.47Å; A428-I434 HydrophobicContact CB-CD1 4.21Å; A428-I434 HydrophobicContact CB-CG1 3.34Å; V431-I434 PolarHBondContact O-N 2.78Å; I434-R436 VanDerWaalsContact C-N 3.34Å; I434-R436 PolarHBondContact O-N 3.09Å; I434-C437 WeakPolarHBondContact O-CB 3.48Å; I434-C437 PolarHBondContact O-N 3.36Å; I434-F438 HydrophobicContact CG2-CD2 3.75Å; I434-F438 HydrophobicContact CG2-CE2 3.61Å; I434-F438 WeakPolarHBondContact O-CD2 3.35Å; I434-F438 PolarHBondContact O-N 2.76Å; I434-F438 VanDerWaalsContact O-N 3.11Å
435	K	73.6	Confident	75.2	Confident	81 Å²	81	65.5 Å²	65.5	35%	0.352	30%	0.303	S	S	.	.	H	α-helix	trans	-59.2	-43.4	178.7	-167.7	178.7	178.8	178	0	112.9	V431 Q432 C437 F438 A439 Q472 E476	V431-K435 PolarHBondContact O-N 3.32Å; Q432-K435 PolarHBondContact O-N 3.29Å; K435-C437 VanDerWaalsContact C-N 3.31Å; K435-C437 PolarHBondContact O-N 3.49Å; K435-F438 PolarHBondContact O-N 2.95Å; K435-A439 VanDerWaalsContact O-CB 3.32Å; K435-A439 WeakPolarHBondContact O-CB 3.36Å; K435-A439 PolarHBondContact O-N 2.81Å; K435-Q472 HydrophobicContact CB-CB 4.41Å; K435-Q472 VanDerWaalsContact CB-OE1 3.3Å; K435-Q472 HydrophobicContact CG-CB 4.48Å; K435-E476 WeakPolarHBondContact CE-OE1 3.42Å
436	R	80.4	Confident	76.9	Confident	154 Å²	154	69.2 Å²	69.2	58%	0.581	33%	0.325	S	S	*	.	H	α-helix	trans	-60	-43.2	176.6	-75.6	174.8	-178.2	169.9	0.7	111.3	Q432 E433 I434 A439 D440	Q432-R436 WeakPolarHBondContact O-CG 3.37Å; Q432-R436 PolarHBondContact O-N 2.86Å; E433-R436 PolarHBondContact O-N 3.17Å; I434-R436 VanDerWaalsContact C-N 3.34Å; I434-R436 PolarHBondContact O-N 3.09Å; R436-A439 PolarHBondContact O-N 3.25Å; R436-D440 WeakPolarHBondContact O-CB 3.41Å; R436-D440 VanDerWaalsContact O-CG 3.3Å; R436-D440 PolarHBondContact O-N 3.16Å
437	C	82.2	Confident	78.3	Confident	5 Å²	5	70.1 Å²	70.1	3%	0.034	33%	0.333	C	S	.	.	H	α-helix	trans	-57.3	-51.5	176.3	-174.1	0	0	0	0	111.9	E433 I434 K435 A439 D440 I441	E433-C437 PolarHBondContact O-N 3.26Å; E433-C437 VanDerWaalsContact O-N 3.12Å; I434-C437 WeakPolarHBondContact O-CB 3.48Å; I434-C437 PolarHBondContact O-N 3.36Å; K435-C437 VanDerWaalsContact C-N 3.31Å; K435-C437 PolarHBondContact O-N 3.49Å; C437-A439 PolarHBondContact O-N 3.08Å; C437-D440 PolarHBondContact O-N 2.92Å; C437-I441 WeakPolarHBondContact O-CG1 3.36Å; C437-I441 PolarHBondContact O-N 2.99Å
438	F	85.3	Confident	80.1	Confident	5 Å²	5	69.2 Å²	69.2	2%	0.022	33%	0.328	C	S	.	.	H	α-helix	trans	-64.2	-39.1	177.6	-78.9	-79.3	0	0	0	113.1	L294 L296 L419 I434 K435 D440 I441 R442 V460 E476	L294-F438 HydrophobicContact CD2-CD1 4.41Å; L296-F438 HydrophobicContact CD1-CE1 4.04Å; L296-F438 HydrophobicContact CD2-CE1 3.91Å; L419-F438 HydrophobicContact CD1-CE1 3.74Å; L419-F438 HydrophobicContact CD1-CZ 4.15Å; I434-F438 HydrophobicContact CG2-CD2 3.75Å; I434-F438 HydrophobicContact CG2-CE2 3.61Å; I434-F438 WeakPolarHBondContact O-CD2 3.35Å; I434-F438 PolarHBondContact O-N 2.76Å; I434-F438 VanDerWaalsContact O-N 3.11Å; K435-F438 PolarHBondContact O-N 2.95Å; F438-D440 VanDerWaalsContact C-N 3.32Å; F438-D440 PolarHBondContact O-N 2.72Å; F438-I441 PolarHBondContact O-N 2.75Å; F438-R442 WeakPolarHBondContact O-CB 3.3Å; F438-R442 PolarHBondContact O-N 3.48Å; F438-V460 HydrophobicContact CE2-CG1 3.99Å; F438-V460 HydrophobicContact CZ-CG1 3.69Å; F438-E476 HydrophobicContact CB-CB 4.04Å; F438-E476 HydrophobicContact CB-CG 3.97Å
439	A	87.4	Confident	81.7	Confident	22 Å²	22	71.6 Å²	71.6	18%	0.182	34%	0.339	C	S	.	.	H	α-helix	trans	-64.1	-37.1	176.8	0	0	0	0	0	112.1	K435 R436 C437 R442 R443 E476	K435-A439 VanDerWaalsContact O-CB 3.32Å; K435-A439 WeakPolarHBondContact O-CB 3.36Å; K435-A439 PolarHBondContact O-N 2.81Å; R436-A439 PolarHBondContact O-N 3.25Å; C437-A439 PolarHBondContact O-N 3.08Å; A439-R442 PolarHBondContact O-N 2.62Å; A439-R443 VanDerWaalsContact O-CB 3.26Å; A439-R443 WeakPolarHBondContact O-CB 3.12Å; A439-R443 PolarHBondContact O-N 3.37Å; A439-E476 HydrophobicContact CB-CG 4.44Å
440	D	90.5	Very high	83.6	Confident	62 Å²	62	62.5 Å²	62.5	33%	0.332	30%	0.3	S	S	.	.	H	α-helix	trans	-71.8	-38.8	177.2	-71.4	-24.1	0	0	0	111.7	L399 R436 C437 F438 R443 F444	L399-D440 HydrophobicContact CD2-CB 3.97Å; R436-D440 WeakPolarHBondContact O-CB 3.41Å; R436-D440 VanDerWaalsContact O-CG 3.3Å; R436-D440 PolarHBondContact O-N 3.16Å; C437-D440 PolarHBondContact O-N 2.92Å; F438-D440 VanDerWaalsContact C-N 3.32Å; F438-D440 PolarHBondContact O-N 2.72Å; D440-R443 PolarHBondContact O-N 2.86Å; D440-R443 IonicContact OD1-CZ 3.74Å; D440-R443 IonicContact OD1-NH1 3.74Å; D440-R443 PolarHBondContact OD1-NH1 3.27Å; D440-R443 IonicContact OD1-NH2 2.76Å; D440-F444 WeakPolarHBondContact O-CB 3.48Å; D440-F444 PolarHBondContact O-N 3.11Å
441	I	91.1	Very high	85.2	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-60.5	-48	170.8	-66.8	169.2	0	0	0	110.4	L294 L399 L419 C437 F438 R443 F444 A445 I452	L294-I441 HydrophobicContact CD1-CG2 3.94Å; L294-I441 HydrophobicContact CD2-CG2 4.36Å; L399-I441 HydrophobicContact CD1-CD1 4.09Å; L399-I441 HydrophobicContact CD1-CG1 3.69Å; L419-I441 HydrophobicContact CD2-CD1 3.64Å; C437-I441 WeakPolarHBondContact O-CG1 3.36Å; C437-I441 PolarHBondContact O-N 2.99Å; F438-I441 PolarHBondContact O-N 2.75Å; I441-R443 PolarHBondContact O-N 2.98Å; I441-F444 WeakPolarHBondContact O-CB 3.42Å; I441-F444 PolarHBondContact O-N 3.43Å; I441-A445 PolarHBondContact O-N 2.89Å; I441-I452 HydrophobicContact CG2-CB 4.37Å; I441-I452 HydrophobicContact CG2-CD1 3.71Å; I441-I452 HydrophobicContact CG2-CG2 3.89Å
442	R	91.9	Very high	86.7	Confident	47 Å²	47	54.9 Å²	54.9	18%	0.177	26%	0.257	C	S	.	.	H	α-helix	trans	-62	-44	179	180	63.3	-175.6	108.1	-11.3	111.5	G292 L294 F438 A439 F444 A445 V446 E476 D478	G292-R442 PolarHBondContact O-NH1 3.32Å; G292-R442 PolarHBondContact O-NH2 3.49Å; L294-R442 HydrophobicContact CD2-CB 4.25Å; F438-R442 WeakPolarHBondContact O-CB 3.3Å; F438-R442 PolarHBondContact O-N 3.48Å; A439-R442 PolarHBondContact O-N 2.62Å; R442-F444 VanDerWaalsContact C-N 3.33Å; R442-F444 PolarHBondContact O-N 3.46Å; R442-A445 WeakPolarHBondContact O-CB 3.45Å; R442-A445 PolarHBondContact O-N 3.08Å; R442-V446 PolarHBondContact O-N 3.3Å; R442-E476 HydrophobicContact CB-CB 4.4Å; R442-E476 WeakPolarHBondContact CD-O 3.43Å; R442-E476 WeakPolarHBondContact CG-O 3.33Å; R442-D478 IonicContact CZ-OD1 3.02Å; R442-D478 IonicContact CZ-OD2 3.94Å; R442-D478 IonicContact NE-OD1 2.67Å; R442-D478 PolarHBondContact NE-OD1 3.32Å; R442-D478 IonicContact NE-OD2 3.65Å; R442-D478 PolarHBondContact NE-OD2 3.38Å; R442-D478 IonicContact NH1-OD2 3.28Å; R442-D478 VanDerWaalsContact NH2-CG 3.28Å; R442-D478 IonicContact NH2-OD1 3.88Å; R442-D478 PolarHBondContact NH2-OD1 2.87Å; R442-D478 IonicContact NH2-OD2 3.69Å; R442-D478 PolarHBondContact NH2-OD2 2.83Å
443	R	93.3	Very high	88	Confident	150 Å²	150	50 Å²	50	57%	0.566	23%	0.234	S	C	*	.	H	α-helix	trans	-61.2	-42.8	176.1	-172.2	-174.5	-63.2	128.2	6.8	111.1	A439 D440 I441 V446 T447	A439-R443 VanDerWaalsContact O-CB 3.26Å; A439-R443 WeakPolarHBondContact O-CB 3.12Å; A439-R443 PolarHBondContact O-N 3.37Å; D440-R443 PolarHBondContact O-N 2.86Å; D440-R443 IonicContact OD1-CZ 3.74Å; D440-R443 IonicContact OD1-NH1 3.74Å; D440-R443 PolarHBondContact OD1-NH1 3.27Å; D440-R443 IonicContact OD1-NH2 2.76Å; I441-R443 PolarHBondContact O-N 2.98Å; R443-V446 PolarHBondContact O-N 3.46Å; R443-T447 VanDerWaalsContact O-CB 3.3Å; R443-T447 WeakPolarHBondContact O-CB 3.34Å; R443-T447 PolarHBondContact O-N 2.97Å; R443-T447 PolarHBondContact O-OG1 3.16Å
444	F	94.7	Very high	89.1	Confident	23 Å²	23	46.3 Å²	46.3	10%	0.101	22%	0.217	C	C	.	.	H	α-helix	trans	-60.9	-47.1	175.5	-178.4	-84.7	0	0	0	111.2	L403 I406 E407 D440 I441 R442 V446 T447 R448 I452	L403-F444 HydrophobicContact CB-CD2 3.93Å; L403-F444 HydrophobicContact CB-CE2 3.88Å; L403-F444 HydrophobicContact CB-CG 4.47Å; L403-F444 HydrophobicContact CB-CZ 4.38Å; L403-F444 HydrophobicContact CD1-CB 4.1Å; L403-F444 HydrophobicContact CD1-CD2 4.09Å; L403-F444 HydrophobicContact CD1-CG 4.2Å; L403-F444 HydrophobicContact CD2-CB 4.13Å; L403-F444 HydrophobicContact CD2-CD1 3.88Å; L403-F444 HydrophobicContact CD2-CD2 4.12Å; L403-F444 HydrophobicContact CD2-CE1 4.27Å; L403-F444 HydrophobicContact CD2-CE2 4.49Å; L403-F444 HydrophobicContact CD2-CG 3.78Å; L403-F444 HydrophobicContact CG-CD2 4.26Å; L403-F444 HydrophobicContact CG-CG 4.36Å; L403-F444 WeakPolarHBondContact O-CZ 3.18Å; I406-F444 HydrophobicContact CB-CE1 4.37Å; I406-F444 HydrophobicContact CB-CZ 4.34Å; I406-F444 HydrophobicContact CG2-CE1 3.88Å; I406-F444 HydrophobicContact CG2-CZ 4.19Å; E407-F444 HydrophobicContact CB-CE2 4.19Å; E407-F444 HydrophobicContact CB-CZ 3.97Å; D440-F444 WeakPolarHBondContact O-CB 3.48Å; D440-F444 PolarHBondContact O-N 3.11Å; I441-F444 WeakPolarHBondContact O-CB 3.42Å; I441-F444 PolarHBondContact O-N 3.43Å; R442-F444 VanDerWaalsContact C-N 3.33Å; R442-F444 PolarHBondContact O-N 3.46Å; F444-V446 PolarHBondContact O-N 3.24Å; F444-T447 PolarHBondContact O-N 3.48Å; F444-R448 HydrophobicContact CD1-CG 4.44Å; F444-R448 HydrophobicContact CD2-CG 4.1Å; F444-R448 HydrophobicContact CE1-CB 4.3Å; F444-R448 HydrophobicContact CE1-CG 4.23Å; F444-R448 HydrophobicContact CE2-CG 3.85Å; F444-R448 HydrophobicContact CG-CG 4.41Å; F444-R448 HydrophobicContact CZ-CB 4.41Å; F444-R448 HydrophobicContact CZ-CG 3.93Å; F444-R448 WeakPolarHBondContact O-CB 3.39Å; F444-R448 PolarHBondContact O-N 2.95Å; F444-I452 HydrophobicContact CD1-CD1 3.92Å
445	A	93.9	Very high	90.1	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-54.2	-50.2	176.3	0	0	0	0	0	111.9	G292 I441 R442 N449 V450 I452	G292-A445 VanDerWaalsContact CA-O 3.26Å; G292-A445 WeakPolarHBondContact CA-O 2.89Å; I441-A445 PolarHBondContact O-N 2.89Å; R442-A445 WeakPolarHBondContact O-CB 3.45Å; R442-A445 PolarHBondContact O-N 3.08Å; A445-N449 VanDerWaalsContact O-CA 3.28Å; A445-N449 WeakPolarHBondContact O-CA 3.01Å; A445-N449 PolarHBondContact O-N 2.91Å; A445-V450 WeakPolarHBondContact CA-O 3.22Å; A445-V450 WeakPolarHBondContact CB-O 3.35Å; A445-V450 PolarHBondContact O-N 3.1Å; A445-V450 VanDerWaalsContact O-N 3.14Å; A445-I452 HydrophobicContact CB-CD1 4.16Å; A445-I452 HydrophobicContact CB-CG1 4.22Å
446	V	91.9	Very high	90.4	Very high	85 Å²	85	40.6 Å²	40.6	52%	0.515	19%	0.19	S	C	.	.	H	α-helix	trans	-59.9	-52.6	176.3	-178	0	0	0	0	111.3	R442 R443 F444 R448 N449	R442-V446 PolarHBondContact O-N 3.3Å; R443-V446 PolarHBondContact O-N 3.46Å; F444-V446 PolarHBondContact O-N 3.24Å; V446-R448 VanDerWaalsContact C-N 3.31Å; V446-R448 PolarHBondContact O-N 2.95Å; V446-N449 PolarHBondContact O-N 3.47Å
447	T	90.8	Very high	90.1	Very high	87 Å²	87	35.4 Å²	35.4	53%	0.534	17%	0.174	S	C	.	.	H	α-helix	trans	-70.6	-31	-167	-50.2	0	0	0	0	111.7	R443 F444	R443-T447 VanDerWaalsContact O-CB 3.3Å; R443-T447 WeakPolarHBondContact O-CB 3.34Å; R443-T447 PolarHBondContact O-N 2.97Å; R443-T447 PolarHBondContact O-OG1 3.16Å; F444-T447 PolarHBondContact O-N 3.48Å
448	R	91.7	Very high	89.2	Confident	122 Å²	122	37.5 Å²	37.5	46%	0.46	18%	0.184	S	C	.	.	H	α-helix	trans	-99.5	-3.3	177.8	-60.2	-54.7	-172.9	-126.4	6.1	113.5	E407 F444 V446 V450	E407-R448 IonicContact OE1-CZ 2.71Å; E407-R448 IonicContact OE1-NE 3.54Å; E407-R448 PolarHBondContact OE1-NE 3.36Å; E407-R448 IonicContact OE1-NH2 2.68Å; E407-R448 PolarHBondContact OE1-NH2 3.17Å; E407-R448 IonicContact OE2-NE 3.15Å; E407-R448 IonicContact OE2-NH2 2.79Å; F444-R448 HydrophobicContact CD1-CG 4.44Å; F444-R448 HydrophobicContact CD2-CG 4.1Å; F444-R448 HydrophobicContact CE1-CB 4.3Å; F444-R448 HydrophobicContact CE1-CG 4.23Å; F444-R448 HydrophobicContact CE2-CG 3.85Å; F444-R448 HydrophobicContact CG-CG 4.41Å; F444-R448 HydrophobicContact CZ-CB 4.41Å; F444-R448 HydrophobicContact CZ-CG 3.93Å; F444-R448 WeakPolarHBondContact O-CB 3.39Å; F444-R448 PolarHBondContact O-N 2.95Å; V446-R448 VanDerWaalsContact C-N 3.31Å; V446-R448 PolarHBondContact O-N 2.95Å; R448-V450 VanDerWaalsContact C-N 3.28Å; R448-V450 HydrophobicContact CB-CG2 4.04Å; R448-V450 PolarHBondContact O-N 3.43Å
449	N	89.8	Confident	87.9	Confident	70 Å²	70	45.5 Å²	45.5	37%	0.374	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	46.4	-178.2	-163.3	39.8	0	0	0	112	L291 A445 V446	L291-N449 WeakPolarHBondContact CB-O 3.19Å; L291-N449 WeakPolarHBondContact CB-OD1 3.27Å; A445-N449 VanDerWaalsContact O-CA 3.28Å; A445-N449 WeakPolarHBondContact O-CA 3.01Å; A445-N449 PolarHBondContact O-N 2.91Å; V446-N449 PolarHBondContact O-N 3.47Å
450	V	93.3	Very high	86.7	Confident	13 Å²	13	45.3 Å²	45.3	8%	0.079	22%	0.22	C	C	.	.			trans	-115.8	138.3	178.3	178.7	0	0	0	0	108.3	G292 I406 V411 A414 A445 R448	G292-V450 WeakPolarHBondContact CA-O 3.49Å; G292-V450 PolarHBondContact N-O 2.85Å; I406-V450 HydrophobicContact CG2-CG1 4.44Å; V411-V450 WeakPolarHBondContact O-CG2 3.18Å; A414-V450 HydrophobicContact CB-CG1 4.47Å; A445-V450 WeakPolarHBondContact CA-O 3.22Å; A445-V450 WeakPolarHBondContact CB-O 3.35Å; A445-V450 PolarHBondContact O-N 3.1Å; A445-V450 VanDerWaalsContact O-N 3.14Å; R448-V450 VanDerWaalsContact C-N 3.28Å; R448-V450 HydrophobicContact CB-CG2 4.04Å; R448-V450 PolarHBondContact O-N 3.43Å
451	H	95.6	Very high	85.2	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	128.7	171.2	-168.4	114.7	0	0	0	109.9	F289 R290 E293 T295 Q412 H413 A414	F289-H451 AromaticContact CD2-ND1 3.82Å; F289-H451 HydrophobicContact CE1-CB 4.03Å; F289-H451 HydrophobicContact CE2-CB 3.68Å; F289-H451 AromaticContact CE2-CD2 3.64Å; F289-H451 AromaticContact CE2-CE1 3.92Å; F289-H451 AromaticContact CE2-CG 3.33Å; F289-H451 AromaticContact CE2-ND1 3.51Å; F289-H451 AromaticContact CE2-NE2 4Å; F289-H451 HydrophobicContact CZ-CB 3.29Å; F289-H451 AromaticContact CZ-CG 3.55Å; F289-H451 AromaticContact CZ-ND1 3.96Å; R290-H451 PolarHBondContact O-ND1 3.03Å; E293-H451 WeakPolarHBondContact O-CA 3.46Å; T295-H451 WeakPolarHBondContact CB-NE2 3.25Å; T295-H451 PolarHBondContact OG1-CE1 2.68Å; T295-H451 PolarHBondContact OG1-NE2 3Å; Q412-H451 PolarHBondContact O-N 3.38Å; H413-H451 WeakPolarHBondContact CA-O 3.37Å; A414-H451 PolarHBondContact N-O 2.89Å
452	I	95.9	Very high	83.4	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	124	176.8	-61.9	-176.6	0	0	0	109.4	E293 L294 T295 A414 I416 I441 F444 A445	E293-I452 PolarHBondContact O-N 3.22Å; L294-I452 CarbonylContact C-O 3.59Å; L294-I452 WeakPolarHBondContact CA-O 3.4Å; L294-I452 HydrophobicContact CD1-CB 4.06Å; L294-I452 HydrophobicContact CD1-CG2 3.9Å; T295-I452 PolarHBondContact N-O 3.45Å; A414-I452 WeakPolarHBondContact O-CA 3.39Å; I416-I452 HydrophobicContact CD1-CG2 3.75Å; I416-I452 HydrophobicContact CG1-CG2 4.46Å; I441-I452 HydrophobicContact CG2-CB 4.37Å; I441-I452 HydrophobicContact CG2-CD1 3.71Å; I441-I452 HydrophobicContact CG2-CG2 3.89Å; F444-I452 HydrophobicContact CD1-CD1 3.92Å; A445-I452 HydrophobicContact CB-CD1 4.16Å; A445-I452 HydrophobicContact CB-CG1 4.22Å
453	T	95.5	Very high	81.1	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	112.1	173	-61.8	0	0	0	0	109.2	T295 I297 H413 A414 I415 I416	T295-T453 CarbonylContact O-C 3.54Å; T295-T453 VanDerWaalsContact O-CA 3.32Å; T295-T453 WeakPolarHBondContact O-CA 3.38Å; I297-T453 HydrophobicContact CD1-CG2 3.58Å; I297-T453 HydrophobicContact CG1-CG2 4.11Å; H413-T453 PolarHBondContact NE2-OG1 2.85Å; A414-T453 PolarHBondContact O-N 2.81Å; I415-T453 CarbonylContact C-O 3.56Å; I415-T453 VanDerWaalsContact CA-O 3.32Å; I415-T453 WeakPolarHBondContact CA-O 3.44Å; I416-T453 PolarHBondContact N-O 3.48Å
454	G	92.3	Very high	78.7	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	126.9	179.5	0	0	0	0	0	112.2	T295 L296 I297	T295-G454 PolarHBondContact O-N 3.42Å; L296-G454 CarbonylContact C-O 3.54Å; L296-G454 WeakPolarHBondContact CA-O 3.45Å; I297-G454 PolarHBondContact N-O 3.48Å
455	I	90.8	Very high	76.2	Confident	4 Å²	4	52.9 Å²	52.9	2%	0.021	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	125.6	169.1	-54.8	-179.9	0	0	0	107.9	K305 K306 A309 I416 D417 N418 L419	K305-I455 HydrophobicContact CB-CG2 4.01Å; K305-I455 HydrophobicContact CD-CG2 4.33Å; K306-I455 HydrophobicContact CG-CD1 4.1Å; A309-I455 HydrophobicContact CB-CD1 3.65Å; A309-I455 HydrophobicContact CB-CG1 4.3Å; I416-I455 PolarHBondContact O-N 2.95Å; D417-I455 WeakPolarHBondContact O-CB 3.38Å; N418-I455 WeakPolarHBondContact CA-O 3.19Å; L419-I455 PolarHBondContact N-O 3.22Å
456	A	80.5	Confident	73.6	Confident	2 Å²	2	56.8 Å²	56.8	2%	0.017	32%	0.32	C	S	.	.			trans	-133.5	157.2	179.8	0	0	0	0	0	111.6	I297 L419 V460 I461	I297-A456 PolarHBondContact O-N 3.47Å; L419-A456 HydrophobicContact CD1-CB 4.33Å; A456-V460 HydrophobicContact CB-CB 4.01Å; A456-V460 HydrophobicContact CB-CG1 4.11Å; A456-V460 HydrophobicContact CB-CG2 4.47Å; A456-I461 HydrophobicContact CB-CD1 3.91Å; A456-I461 HydrophobicContact CB-CG1 4.44Å
457	D	73.1	Confident	70.9	Confident	45 Å²	45	58.5 Å²	58.5	24%	0.241	33%	0.325	C	S	.	.			trans	-80.1	161.5	177.4	-151.7	-6.3	0	0	0	111.5	N301 K305 L420 M459 V460	N301-D457 PolarHBondContact ND2-OD2 3.16Å; N301-D457 PolarHBondContact OD1-OD1 3.47Å; K305-D457 IonicContact NZ-OD1 3.06Å; L420-D457 HydrophobicContact CD1-CB 4.28Å; D457-M459 PolarHBondContact O-N 2.76Å; D457-M459 VanDerWaalsContact O-N 3.16Å; D457-V460 WeakPolarHBondContact O-CB 3.37Å; D457-V460 PolarHBondContact O-N 3.43Å
458	E	64.6	Low	68.2	Low	50 Å²	50	57.9 Å²	57.9	23%	0.234	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-55.4	-34.5	-174.7	-171.7	163.8	-157.6	0	0	113.1	S300 V460 I461 Q462 F482	S300-E458 VanDerWaalsContact CA-OE2 3.29Å; S300-E458 WeakPolarHBondContact CA-OE2 3.14Å; S300-E458 WeakPolarHBondContact CB-OE2 3.41Å; E458-V460 PolarHBondContact O-N 2.94Å; E458-V460 VanDerWaalsContact O-N 3.14Å; E458-I461 PolarHBondContact O-N 3.19Å; E458-Q462 VanDerWaalsContact CD-NE2 3.3Å; E458-Q462 HydrophobicContact CG-CG 3.6Å; E458-Q462 PolarHBondContact O-N 2.72Å; E458-Q462 PolarHBondContact OE1-NE2 3.23Å; E458-F482 HydrophobicContact CG-CE2 4.22Å; E458-F482 HydrophobicContact CG-CZ 3.92Å; E458-F482 WeakPolarHBondContact OE1-CZ 3.47Å
459	M	58.4	Low	65.6	Low	173 Å²	173	62.1 Å²	62.1	85%	0.852	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-60.8	-21	174.7	-72.5	-170.9	163.3	0	0	114	D457	D457-M459 PolarHBondContact O-N 2.76Å; D457-M459 VanDerWaalsContact O-N 3.16Å
460	V	61.1	Low	63.3	Low	17 Å²	17	64 Å²	64	10%	0.103	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-95	-6.4	179.4	-170.2	0	0	0	0	111.6	L420 F438 A456 D457 E458 V471	L420-V460 HydrophobicContact CD1-CG2 3.8Å; L420-V460 HydrophobicContact CD2-CG2 3.78Å; L420-V460 HydrophobicContact CG-CG2 3.96Å; F438-V460 HydrophobicContact CE2-CG1 3.99Å; F438-V460 HydrophobicContact CZ-CG1 3.69Å; A456-V460 HydrophobicContact CB-CB 4.01Å; A456-V460 HydrophobicContact CB-CG1 4.11Å; A456-V460 HydrophobicContact CB-CG2 4.47Å; D457-V460 WeakPolarHBondContact O-CB 3.37Å; D457-V460 PolarHBondContact O-N 3.43Å; E458-V460 PolarHBondContact O-N 2.94Å; E458-V460 VanDerWaalsContact O-N 3.14Å; V460-V471 WeakPolarHBondContact O-CG1 3.31Å
461	I	59.3	Low	61.4	Low	9 Å²	9	64.8 Å²	64.8	5%	0.046	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.4	-16.1	-171.5	-64.3	173.3	0	0	0	114	L296 A456 E458 L474 V480 F482	L296-I461 HydrophobicContact CB-CD1 4.25Å; A456-I461 HydrophobicContact CB-CD1 3.91Å; A456-I461 HydrophobicContact CB-CG1 4.44Å; E458-I461 PolarHBondContact O-N 3.19Å; I461-L474 HydrophobicContact CG2-CD2 4.14Å; I461-V480 HydrophobicContact CG2-CG1 3.77Å; I461-F482 HydrophobicContact CB-CD2 4.47Å; I461-F482 HydrophobicContact CB-CE2 4.43Å; I461-F482 HydrophobicContact CG2-CD2 3.63Å; I461-F482 HydrophobicContact CG2-CE2 4Å
462	Q	53.3	Low	59.6	Low	96 Å²	96	67.2 Å²	67.2	45%	0.449	38%	0.382	S	S	.	.			trans	-77.2	134.8	-177.1	-89.8	-169.1	-7.2	0	0	115.9	E458 V471	E458-Q462 VanDerWaalsContact CD-NE2 3.3Å; E458-Q462 HydrophobicContact CG-CG 3.6Å; E458-Q462 PolarHBondContact O-N 2.72Å; E458-Q462 PolarHBondContact OE1-NE2 3.23Å; Q462-V471 WeakPolarHBondContact O-CB 3.4Å; Q462-V471 WeakPolarHBondContact O-CG2 3.36Å
463	T	43.8	Very low	57.9	Low	116 Å²	116	67.3 Å²	67.3	71%	0.712	38%	0.382	S	S	*	.			trans	-88.5	103	163.1	48.2	0	0	0	0	110	S465 L474	T463-S465 PolarHBondContact O-N 3.15Å; T463-L474 HydrophobicContact CG2-CD1 4.02Å
464	D	43.5	Very low	56.5	Low	94 Å²	94	69.6 Å²	69.6	50%	0.503	40%	0.395	S	S	.	.			trans	-81.4	113	172	-165.7	-10.4	0	0	0	110.6	A466	D464-A466 PolarHBondContact O-N 2.73Å; D464-A466 PolarHBondContact OD1-N 3.44Å; D464-A466 VanDerWaalsContact OD1-N 3.17Å
465	S	40.4	Very low	55.6	Low	128 Å²	128	73 Å²	73	90%	0.895	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-8.3	-179.5	49.5	0	0	0	0	114.6	T463	T463-S465 PolarHBondContact O-N 3.15Å
466	A	40.7	Very low	55.1	Low	82 Å²	82	75.1 Å²	75.1	68%	0.678	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	-13.1	-174.1	0	0	0	0	0	115.5	D464	D464-A466 PolarHBondContact O-N 2.73Å; D464-A466 PolarHBondContact OD1-N 3.44Å; D464-A466 VanDerWaalsContact OD1-N 3.17Å
467	L	34.9	Very low	55.4	Low	121 Å²	121	75.8 Å²	75.8	63%	0.634	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.7	12.6	-166.3	-106.9	146.8	0	0	0	117.4	R469	L467-R469 PolarHBondContact O-N 2.58Å
468	G	33.3	Very low	56.3	Low	74 Å²	74	76.8 Å²	76.8	76%	0.763	44%	0.444	S	S	*	.			trans	61.9	9.3	164.4	0	0	0	0	0	116.9	V470	G468-V470 PolarHBondContact O-N 2.82Å
469	R	38.3	Very low	57.5	Low	211 Å²	211	75.3 Å²	75.3	80%	0.796	44%	0.437	S	S	*	.			trans	-88.3	92.3	175.8	-69.7	-175.1	-172.9	-179.3	3	109.2	L467 V471	L467-R469 PolarHBondContact O-N 2.58Å; R469-V471 PolarHBondContact O-N 3.28Å
470	V	41.8	Very low	59	Low	110 Å²	110	69.9 Å²	69.9	67%	0.667	41%	0.414	S	S	*	.			trans	-58.9	120.9	173	177.1	0	0	0	0	109.5	G468 Q472	G468-V470 PolarHBondContact O-N 2.82Å; V470-Q472 VanDerWaalsContact O-CG 3.27Å; V470-Q472 WeakPolarHBondContact O-CG 3.09Å; V470-Q472 PolarHBondContact O-N 3.11Å
471	V	52	Low	60.3	Low	29 Å²	29	70.1 Å²	70.1	18%	0.176	41%	0.414	C	S	.	.			trans	-74.7	108.4	174.5	163.1	0	0	0	0	109.3	V460 Q462 R469 G473 L474	V460-V471 WeakPolarHBondContact O-CG1 3.31Å; Q462-V471 WeakPolarHBondContact O-CB 3.4Å; Q462-V471 WeakPolarHBondContact O-CG2 3.36Å; R469-V471 PolarHBondContact O-N 3.28Å; V471-G473 PolarHBondContact O-N 3.43Å; V471-L474 HydrophobicContact CB-CD1 4.19Å; V471-L474 HydrophobicContact CG1-CD1 4.15Å; V471-L474 HydrophobicContact CG1-CG 4.24Å; V471-L474 WeakPolarHBondContact O-CB 3.48Å; V471-L474 PolarHBondContact O-N 3.08Å
472	Q	59.1	Low	61.6	Low	51 Å²	51	74.1 Å²	74.1	24%	0.238	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-15.7	-156.9	-62.1	-170.4	-7.6	0	0	114.9	V431 K435 V470 L474 A475	V431-Q472 HydrophobicContact CG1-CB 4.33Å; V431-Q472 HydrophobicContact CG1-CG 3.64Å; V431-Q472 VanDerWaalsContact CG1-OE1 3.3Å; V431-Q472 PolarHBondContact O-OE1 3.18Å; K435-Q472 HydrophobicContact CB-CB 4.41Å; K435-Q472 VanDerWaalsContact CB-OE1 3.3Å; K435-Q472 HydrophobicContact CG-CB 4.48Å; V470-Q472 VanDerWaalsContact O-CG 3.27Å; V470-Q472 WeakPolarHBondContact O-CG 3.09Å; V470-Q472 PolarHBondContact O-N 3.11Å; Q472-L474 PolarHBondContact O-N 3.25Å; Q472-A475 PolarHBondContact O-N 3.47Å
473	G	58.8	Low	63.2	Low	1 Å²	1	71.5 Å²	71.5	1%	0.01	42%	0.42	C	S	.	.	H	α-helix	trans	-63.8	-29.5	172.4	0	0	0	0	0	112.9	V471 A475 E476 A477	V471-G473 PolarHBondContact O-N 3.43Å; G473-A475 VanDerWaalsContact C-N 3.26Å; G473-A475 PolarHBondContact O-N 3.34Å; G473-E476 PolarHBondContact O-N 3.43Å; G473-A477 PolarHBondContact O-N 3.29Å
474	L	66.3	Low	64.9	Low	49 Å²	49	72 Å²	72	26%	0.257	42%	0.419	S	S	.	.	H	α-helix	trans	-64.2	-29.1	176.6	-66.1	170.2	0	0	0	113.1	I461 T463 V471 Q472 V480	I461-L474 HydrophobicContact CG2-CD2 4.14Å; T463-L474 HydrophobicContact CG2-CD1 4.02Å; V471-L474 HydrophobicContact CB-CD1 4.19Å; V471-L474 HydrophobicContact CG1-CD1 4.15Å; V471-L474 HydrophobicContact CG1-CG 4.24Å; V471-L474 WeakPolarHBondContact O-CB 3.48Å; V471-L474 PolarHBondContact O-N 3.08Å; Q472-L474 PolarHBondContact O-N 3.25Å; L474-V480 HydrophobicContact CD2-CB 4.22Å; L474-V480 HydrophobicContact CD2-CG1 3.74Å; L474-V480 HydrophobicContact CD2-CG2 3.65Å
475	A	73.5	Confident	66.2	Low	72 Å²	72	72.7 Å²	72.7	60%	0.595	42%	0.422	S	S	*	.	H	α-helix	trans	-76.4	-26.9	-175.3	0	0	0	0	0	112.9	Q472 G473	Q472-A475 PolarHBondContact O-N 3.47Å; G473-A475 VanDerWaalsContact C-N 3.26Å; G473-A475 PolarHBondContact O-N 3.34Å
476	E	81.1	Confident	67.3	Low	47 Å²	47	72.5 Å²	72.5	22%	0.22	41%	0.411	C	S	.	.	H	α-helix	trans	-96.6	-16.9	-179	-55	-63.6	156.1	0	0	112.1	K435 F438 A439 R442 G473	K435-E476 WeakPolarHBondContact CE-OE1 3.42Å; F438-E476 HydrophobicContact CB-CB 4.04Å; F438-E476 HydrophobicContact CB-CG 3.97Å; A439-E476 HydrophobicContact CB-CG 4.44Å; R442-E476 HydrophobicContact CB-CB 4.4Å; R442-E476 WeakPolarHBondContact CD-O 3.43Å; R442-E476 WeakPolarHBondContact CG-O 3.33Å; G473-E476 PolarHBondContact O-N 3.43Å
477	A	86.6	Confident	68	Low	17 Å²	17	74.6 Å²	74.6	14%	0.14	42%	0.417	C	S	.	.			trans	-80.9	138.3	179.7	0	0	0	0	0	112	L294 L296 G473 V480	L294-A477 HydrophobicContact CD2-CB 4.48Å; L294-A477 HydrophobicContact CG-CB 4.34Å; L296-A477 HydrophobicContact CD1-CB 3.67Å; L296-A477 HydrophobicContact CG-CB 3.72Å; G473-A477 PolarHBondContact O-N 3.29Å; A477-V480 HydrophobicContact CB-CG2 4.03Å
478	D	90.8	Very high	68.7	Low	65 Å²	65	77.1 Å²	77.1	35%	0.348	43%	0.426	S	S	.	.	S	Bend	trans	-79.5	-35.9	173.1	-56	-79.8	0	0	0	110.9	E293 L294 R442	E293-D478 WeakPolarHBondContact CA-OD2 3.43Å; E293-D478 HydrophobicContact CB-CB 4.07Å; E293-D478 HydrophobicContact CG-CB 4.08Å; L294-D478 PolarHBondContact N-OD2 3.37Å; L294-D478 PolarHBondContact O-N 2.97Å; R442-D478 IonicContact CZ-OD1 3.02Å; R442-D478 IonicContact CZ-OD2 3.94Å; R442-D478 IonicContact NE-OD1 2.67Å; R442-D478 PolarHBondContact NE-OD1 3.32Å; R442-D478 IonicContact NE-OD2 3.65Å; R442-D478 PolarHBondContact NE-OD2 3.38Å; R442-D478 IonicContact NH1-OD2 3.28Å; R442-D478 VanDerWaalsContact NH2-CG 3.28Å; R442-D478 IonicContact NH2-OD1 3.88Å; R442-D478 PolarHBondContact NH2-OD1 2.87Å; R442-D478 IonicContact NH2-OD2 3.69Å; R442-D478 PolarHBondContact NH2-OD2 2.83Å
479	N	90.4	Very high	69	Low	20 Å²	20	77.1 Å²	77.1	11%	0.107	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	140.7	-178.8	-51.7	-58.1	0	0	0	111.1	L286 E293 L294 T295 L296	L286-N479 HydrophobicContact CD2-CB 4.19Å; E293-N479 PolarHBondContact OE2-ND2 3.13Å; L294-N479 PolarHBondContact O-N 3.08Å; T295-N479 CarbonylContact C-O 3.45Å; T295-N479 WeakPolarHBondContact CA-O 3.37Å; T295-N479 HydrophobicContact CG2-CB 4.01Å; T295-N479 PolarHBondContact OG1-ND2 3.49Å; L296-N479 PolarHBondContact N-O 3.46Å
480	V	89.1	Confident	68.9	Low	58 Å²	58	72.3 Å²	72.3	35%	0.352	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	121.5	176.5	-176.4	0	0	0	0	109.3	L296 I461 L474 A477	L296-V480 WeakPolarHBondContact O-CA 3.36Å; I461-V480 HydrophobicContact CG2-CG1 3.77Å; L474-V480 HydrophobicContact CD2-CB 4.22Å; L474-V480 HydrophobicContact CD2-CG1 3.74Å; L474-V480 HydrophobicContact CD2-CG2 3.65Å; A477-V480 HydrophobicContact CB-CG2 4.03Å
481	L	89.5	Confident	68.4	Low	23 Å²	23	76.6 Å²	76.6	12%	0.12	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	120.5	178.9	-58	179.8	0	0	0	108.9	L282 L286 T295 L296 I297 G298 F308 Y312	L282-L481 HydrophobicContact CD2-CD2 3.86Å; L286-L481 HydrophobicContact CD1-CD2 4.47Å; T295-L481 HydrophobicContact CG2-CD1 4.16Å; T295-L481 HydrophobicContact CG2-CG 4.3Å; L296-L481 PolarHBondContact O-N 3.02Å; I297-L481 CarbonylContact C-O 3.54Å; I297-L481 WeakPolarHBondContact CA-O 3.47Å; I297-L481 HydrophobicContact CG1-CB 4.43Å; I297-L481 HydrophobicContact CG1-CD1 4.39Å; G298-L481 PolarHBondContact N-O 3.44Å; F308-L481 HydrophobicContact CE1-CD1 3.86Å; F308-L481 HydrophobicContact CZ-CD1 4.11Å; Y312-L481 HydrophobicContact CE2-CD1 4.47Å
482	F	87.1	Confident	67.3	Low	93 Å²	93	80.9 Å²	80.9	41%	0.408	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	119.9	-179.4	-160	-93.3	0	0	0	111	E458 I461	E458-F482 HydrophobicContact CG-CE2 4.22Å; E458-F482 HydrophobicContact CG-CZ 3.92Å; E458-F482 WeakPolarHBondContact OE1-CZ 3.47Å; I461-F482 HydrophobicContact CB-CD2 4.47Å; I461-F482 HydrophobicContact CB-CE2 4.43Å; I461-F482 HydrophobicContact CG2-CD2 3.63Å; I461-F482 HydrophobicContact CG2-CE2 4Å
483	L	85.9	Confident	66.1	Low	40 Å²	40	85.3 Å²	85.3	21%	0.209	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	118.9	-179.7	-70.4	154.6	0	0	0	109.9	I297 G298 G299 K305 F308	I297-L483 HydrophobicContact CG2-CD1 3.77Å; G298-L483 PolarHBondContact O-N 3.24Å; G299-L483 VanDerWaalsContact CA-O 3.25Å; G299-L483 WeakPolarHBondContact CA-O 3.4Å; K305-L483 HydrophobicContact CB-CD1 4.3Å; K305-L483 HydrophobicContact CG-CD1 4.18Å; F308-L483 HydrophobicContact CB-CD1 3.82Å; F308-L483 HydrophobicContact CB-CD2 4.28Å; F308-L483 HydrophobicContact CD1-CD1 4.04Å; F308-L483 HydrophobicContact CD2-CD2 4.28Å; F308-L483 HydrophobicContact CG-CD1 4.02Å; F308-L483 HydrophobicContact CG-CD2 4.14Å
484	N	79.5	Confident	64.7	Low	128 Å²	128	95.6 Å²	95.6	68%	0.684	52%	0.519	S	S	*	.			trans	-122.2	113.3	175.3	-166.4	1.3	0	0	0	109.2
485	L	72.2	Confident	63	Low	107 Å²	107	97.2 Å²	97.2	56%	0.56	54%	0.535	S	S	*	.			trans	-92.8	116.7	171.2	-71	177.1	0	0	0	107.5	S303 P487	S303-L485 WeakPolarHBondContact O-CD1 3.29Å; L485-P487 VanDerWaalsContact O-CD 3.25Å; L485-P487 WeakPolarHBondContact O-CD 3.46Å
486	N	62.8	Low	60.9	Low	125 Å²	125	101.8 Å²	101.8	67%	0.668	55%	0.548	S	S	*	.			trans	-85.8	105.9	172.2	-153.5	4.9	0	0	0	107.6	E488	N486-E488 PolarHBondContact O-N 2.77Å; N486-E488 VanDerWaalsContact O-N 3.09Å
487	P	54.9	Low	58.5	Low	125 Å²	125	108.2 Å²	108.2	81%	0.812	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-7.4	-170.6	-2.4	15.4	0	0	0	113.8	L485	L485-P487 VanDerWaalsContact O-CD 3.25Å; L485-P487 WeakPolarHBondContact O-CD 3.46Å
488	E	49.1	Very low	55.9	Low	174 Å²	174	112.4 Å²	112.4	81%	0.813	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.4	15.8	-172.7	-63.3	-168.3	164.5	0	0	115	N486 P490	N486-E488 PolarHBondContact O-N 2.77Å; N486-E488 VanDerWaalsContact O-N 3.09Å; E488-P490 WeakPolarHBondContact O-CD 3.22Å
489	A	40.9	Very low	53.2	Low	75 Å²	75	115 Å²	115	62%	0.62	62%	0.624	S	S	*	*			trans	-87	114.5	176.7	0	0	0	0	0	111.7
490	P	35.7	Very low	50.3	Low	109 Å²	109	120.5 Å²	120.5	71%	0.708	66%	0.658	S	S	*	*			trans	-71.4	140.6	178.2	-11.2	27.3	0	0	0	112.1	E488 T492	E488-P490 WeakPolarHBondContact O-CD 3.22Å; P490-T492 VanDerWaalsContact C-N 3.25Å; P490-T492 PolarHBondContact O-N 2.78Å
491	E	31.1	Very low	47.8	Very low	200 Å²	200	126.9 Å²	126.9	94%	0.935	68%	0.682	S	S	*	*	S	Bend	trans	-65.1	69.6	172.6	-68.8	-175.5	148.3	0	0	112.7
492	T	29.6	Very low	45	Very low	120 Å²	120	130.9 Å²	130.9	74%	0.736	71%	0.709	S	S	*	*			trans	-156.5	97.2	167.9	44.1	0	0	0	0	110.9	P490	P490-T492 VanDerWaalsContact C-N 3.25Å; P490-T492 PolarHBondContact O-N 2.78Å
493	E	32.4	Very low	42.4	Very low	143 Å²	143	132.5 Å²	132.5	67%	0.668	73%	0.729	S	S	*	*			trans	-148.5	61.2	161.6	-126.2	177.6	-157.8	0	0	113.3	S495	E493-S495 PolarHBondContact O-N 3.2Å
494	K	30.5	Very low	39.9	Very low	218 Å²	218	138.6 Å²	138.6	95%	0.948	76%	0.761	S	S	*	*	S	Bend	trans	-73.4	71	139.1	-82.4	-176.3	177.1	175.4	0	108.3
495	S	29.6	Very low	37.8	Very low	83 Å²	83	142.5 Å²	142.5	58%	0.58	77%	0.772	S	S	*	*	S	Bend	trans	163	101.6	153.5	60	0	0	0	0	110	E493 K497	E493-S495 PolarHBondContact O-N 3.2Å; S495-K497 VanDerWaalsContact C-N 3.34Å; S495-K497 PolarHBondContact O-N 3.31Å
496	L	30.1	Very low	36	Very low	167 Å²	167	142 Å²	142	87%	0.874	77%	0.773	S	S	*	*			trans	-67.8	95.3	164.7	-89.9	103.4	0	0	0	109.4
497	K	31	Very low	34.6	Very low	183 Å²	183	141.2 Å²	141.2	80%	0.796	78%	0.778	S	S	*	*			trans	-112	124.8	149.7	-80.7	-174	178.2	178	0	106.9	S495	S495-K497 VanDerWaalsContact C-N 3.34Å; S495-K497 PolarHBondContact O-N 3.31Å
498	S	31.4	Very low	33.7	Very low	104 Å²	104	143.3 Å²	143.3	73%	0.727	77%	0.774	S	S	*	*			trans	-35.6	140.6	-178.7	52.7	0	0	0	0	115.9	T500	S498-T500 PolarHBondContact O-N 3.46Å
499	P	33.8	Very low	33.1	Very low	121 Å²	121	145.2 Å²	145.2	79%	0.786	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-72.9	122.5	-179.1	29.6	-32	0	0	0	111.4
500	T	30.7	Very low	32.8	Very low	134 Å²	134	149.1 Å²	149.1	82%	0.822	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-83.6	120.3	163.9	44.5	0	0	0	0	109.6	S498	S498-T500 PolarHBondContact O-N 3.46Å
501	F	35.9	Very low	32.8	Very low	193 Å²	193	154 Å²	154	85%	0.846	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-69	147.2	171.1	-82.4	-90.8	0	0	0	111.8
502	P	31.1	Very low	33.4	Very low	107 Å²	107	155.3 Å²	155.3	70%	0.695	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-74.6	153.4	-179.3	31.8	-33.4	0	0	0	111.7	L504	P502-L504 PolarHBondContact O-N 3.24Å
503	P	31.6	Very low	34.4	Very low	126 Å²	126	154 Å²	154	82%	0.818	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-79.7	123	-179.2	31.7	-30.1	0	0	0	110.6	K505	P503-K505 PolarHBondContact O-N 2.93Å
504	L	34.9	Very low	35.1	Very low	169 Å²	169	156.6 Å²	156.6	89%	0.885	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-64.5	126.4	167.4	-89.8	150.4	0	0	0	110.4	P502	P502-L504 PolarHBondContact O-N 3.24Å
505	K	35.3	Very low	36.3	Very low	209 Å²	209	147.7 Å²	147.7	91%	0.909	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-57.1	138.9	173.4	-81.7	178.4	176.6	174.7	0	111	P503	P503-K505 PolarHBondContact O-N 2.93Å
506	T	33.3	Very low	37.6	Very low	96 Å²	96	147.9 Å²	147.9	59%	0.589	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-79.8	130.9	-164.6	46.3	0	0	0	0	114.7	K508	T506-K508 HydrophobicContact CG2-CD 3.75Å; T506-K508 HydrophobicContact CG2-CG 3.77Å
507	S	34.5	Very low	39.3	Very low	110 Å²	110	144.6 Å²	144.6	77%	0.769	74%	0.74	S	S	*	*			trans	-95.2	74.3	143.4	75.1	0	0	0	0	109.1	K509	S507-K509 PolarHBondContact O-N 3.11Å
508	K	35.9	Very low	41.2	Very low	169 Å²	169	142.7 Å²	142.7	74%	0.735	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	84.5	176.7	-91.8	165.6	174.2	172.4	0	109.4	T506	T506-K508 HydrophobicContact CG2-CD 3.75Å; T506-K508 HydrophobicContact CG2-CG 3.77Å
509	K	36.9	Very low	43.2	Very low	213 Å²	213	144.8 Å²	144.8	93%	0.926	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-166.8	-5	151.1	-111.4	167.5	-175.5	-176	0	117.8	S507	S507-K509 PolarHBondContact O-N 3.11Å
510	M	34.3	Very low	45.1	Very low	158 Å²	158	144.1 Å²	144.1	78%	0.778	72%	0.718	S	S	*	*	S	Bend	trans	-129.7	15.7	-173.6	-151.2	171.1	68.3	0	0	116
511	W	36.1	Very low	47.4	Very low	210 Å²	210	142.8 Å²	142.8	80%	0.795	70%	0.704	S	S	*	*	S	Bend	trans	-122.4	-7.3	-176.3	-94.1	57.3	0	0	0	115.4	S513 G515	W511-S513 PolarHBondContact O-N 2.89Å; W511-G515 PolarHBondContact O-N 3.23Å
512	R	42.6	Very low	49.3	Very low	228 Å²	228	135.5 Å²	135.5	86%	0.86	68%	0.677	S	S	*	*	H	α-helix	trans	-74.6	-22.3	-177.9	-87	-177.8	159.9	-179.1	-7.5	114.6	C516	R512-C516 PolarHBondContact O-SG 3.44Å
513	S	50.8	Low	51.6	Low	92 Å²	92	134 Å²	134	64%	0.643	67%	0.666	S	S	*	*	H	α-helix	trans	-89.8	-39.2	177	66.7	0	0	0	0	113.2	W511 L517	W511-S513 PolarHBondContact O-N 2.89Å; S513-L517 WeakPolarHBondContact O-CB 3.24Å; S513-L517 PolarHBondContact O-N 2.91Å; S513-L517 VanDerWaalsContact O-N 3.15Å
514	R	47.3	Very low	53.8	Low	199 Å²	199	131.4 Å²	131.4	75%	0.751	65%	0.648	S	S	*	*	H	α-helix	trans	-74.9	-36.6	-178.8	-75.6	-176.5	162.4	178.7	-4.7	113.6	F518	R514-F518 PolarHBondContact O-N 3.07Å
515	G	54.6	Low	55.9	Low	30 Å²	30	125.1 Å²	125.1	31%	0.309	62%	0.624	S	S	.	*	H	α-helix	trans	-68.6	-41.6	175.9	0	0	0	0	0	113.1	W511 F518 F519	W511-G515 PolarHBondContact O-N 3.23Å; G515-F518 PolarHBondContact O-N 3.23Å; G515-F519 WeakPolarHBondContact O-CB 3.11Å; G515-F519 PolarHBondContact O-N 3.49Å
516	C	57.7	Low	58	Low	87 Å²	87	119.8 Å²	119.8	59%	0.588	61%	0.605	S	S	*	*	H	α-helix	trans	-65.8	-38.7	174.8	-69.7	0	0	0	0	111.9	R512 L520	R512-C516 PolarHBondContact O-SG 3.44Å; C516-L520 VanDerWaalsContact O-CB 3.29Å; C516-L520 WeakPolarHBondContact O-CB 3.25Å; C516-L520 PolarHBondContact O-N 2.94Å
517	L	66.6	Low	60	Low	99 Å²	99	117.9 Å²	117.9	52%	0.518	60%	0.599	S	S	.	*	H	α-helix	trans	-66.7	-42.4	176.2	-172.2	65.4	0	0	0	111.9	S513 L520 I521	S513-L517 WeakPolarHBondContact O-CB 3.24Å; S513-L517 PolarHBondContact O-N 2.91Å; S513-L517 VanDerWaalsContact O-N 3.15Å; L517-L520 PolarHBondContact O-N 3.38Å; L517-I521 HydrophobicContact CD1-CD1 4.19Å; L517-I521 HydrophobicContact CD1-CG1 4.42Å; L517-I521 HydrophobicContact CD2-CD1 4.45Å; L517-I521 HydrophobicContact CG-CD1 3.82Å; L517-I521 HydrophobicContact CG-CG1 4.43Å; L517-I521 WeakPolarHBondContact O-CB 3.37Å; L517-I521 WeakPolarHBondContact O-CG1 3.44Å; L517-I521 PolarHBondContact O-N 2.94Å
518	F	70.7	Confident	62.1	Low	142 Å²	142	117 Å²	117	62%	0.623	58%	0.584	S	S	*	*	H	α-helix	trans	-64.4	-42.2	175.5	-177.3	-94.6	0	0	0	112.3	R514 G515 I521 S522	R514-F518 PolarHBondContact O-N 3.07Å; G515-F518 PolarHBondContact O-N 3.23Å; F518-I521 PolarHBondContact O-N 2.94Å; F518-S522 VanDerWaalsContact O-CB 3.25Å; F518-S522 WeakPolarHBondContact O-CB 3.4Å; F518-S522 PolarHBondContact O-N 3.23Å; F518-S522 PolarHBondContact O-OG 3.37Å
519	F	72.4	Confident	64.1	Low	148 Å²	148	113.6 Å²	113.6	65%	0.649	57%	0.574	S	S	*	*	H	α-helix	trans	-62.2	-44.5	174.2	-106.3	-85.6	0	0	0	111.6	G515 S522 T523	G515-F519 WeakPolarHBondContact O-CB 3.11Å; G515-F519 PolarHBondContact O-N 3.49Å; F519-S522 PolarHBondContact O-N 3.48Å; F519-T523 WeakPolarHBondContact O-CB 3.43Å; F519-T523 WeakPolarHBondContact O-CG2 3.25Å; F519-T523 PolarHBondContact O-N 3.16Å; F519-T523 PolarHBondContact O-OG1 3.39Å
520	L	75	Confident	66	Low	107 Å²	107	107.3 Å²	107.3	56%	0.56	55%	0.549	S	S	*	.	H	α-helix	trans	-64.2	-44.7	177.7	-165.9	84.8	0	0	0	111.8	C516 L517 S522 T523 V524	C516-L520 VanDerWaalsContact O-CB 3.29Å; C516-L520 WeakPolarHBondContact O-CB 3.25Å; C516-L520 PolarHBondContact O-N 2.94Å; L517-L520 PolarHBondContact O-N 3.38Å; L520-S522 VanDerWaalsContact C-N 3.31Å; L520-S522 PolarHBondContact O-N 3.26Å; L520-T523 WeakPolarHBondContact CA-OG1 3.48Å; L520-T523 PolarHBondContact O-N 2.87Å; L520-T523 PolarHBondContact O-OG1 2.78Å; L520-T523 VanDerWaalsContact O-OG1 3.06Å; L520-V524 HydrophobicContact CG-CG2 4.43Å; L520-V524 VanDerWaalsContact O-CB 3.27Å; L520-V524 WeakPolarHBondContact O-CB 3.36Å; L520-V524 WeakPolarHBondContact O-CG2 3.41Å; L520-V524 PolarHBondContact O-N 3.02Å
521	I	78.3	Confident	68	Low	106 Å²	106	106.6 Å²	106.6	54%	0.544	54%	0.544	S	S	.	.	H	α-helix	trans	-63.1	-41	176.2	-69.3	167.7	0	0	0	110.3	L517 F518 G525	L517-I521 HydrophobicContact CD1-CD1 4.19Å; L517-I521 HydrophobicContact CD1-CG1 4.42Å; L517-I521 HydrophobicContact CD2-CD1 4.45Å; L517-I521 HydrophobicContact CG-CD1 3.82Å; L517-I521 HydrophobicContact CG-CG1 4.43Å; L517-I521 WeakPolarHBondContact O-CB 3.37Å; L517-I521 WeakPolarHBondContact O-CG1 3.44Å; L517-I521 PolarHBondContact O-N 2.94Å; F518-I521 PolarHBondContact O-N 2.94Å; I521-G525 WeakPolarHBondContact O-CA 3.22Å; I521-G525 PolarHBondContact O-N 2.85Å
522	S	76.1	Confident	69.9	Low	40 Å²	40	103.4 Å²	103.4	28%	0.28	54%	0.538	S	S	.	.	H	α-helix	trans	-68.1	-42.8	178.4	-59.3	0	0	0	0	111.8	F518 F519 L520 G525 I526	F518-S522 VanDerWaalsContact O-CB 3.25Å; F518-S522 WeakPolarHBondContact O-CB 3.4Å; F518-S522 PolarHBondContact O-N 3.23Å; F518-S522 PolarHBondContact O-OG 3.37Å; F519-S522 PolarHBondContact O-N 3.48Å; L520-S522 VanDerWaalsContact C-N 3.31Å; L520-S522 PolarHBondContact O-N 3.26Å; S522-G525 PolarHBondContact O-N 3.41Å; S522-I526 WeakPolarHBondContact O-CB 3.16Å; S522-I526 WeakPolarHBondContact O-CD1 3.44Å; S522-I526 WeakPolarHBondContact O-CG1 3.3Å; S522-I526 PolarHBondContact O-N 3.37Å
523	T	78.1	Confident	71.5	Confident	75 Å²	75	93.4 Å²	93.4	46%	0.46	50%	0.501	S	S	.	.	H	α-helix	trans	-69.7	-41.2	177.8	49.9	0	0	0	0	112	F519 L520 I526 A527	F519-T523 WeakPolarHBondContact O-CB 3.43Å; F519-T523 WeakPolarHBondContact O-CG2 3.25Å; F519-T523 PolarHBondContact O-N 3.16Å; F519-T523 PolarHBondContact O-OG1 3.39Å; L520-T523 WeakPolarHBondContact CA-OG1 3.48Å; L520-T523 PolarHBondContact O-N 2.87Å; L520-T523 PolarHBondContact O-OG1 2.78Å; L520-T523 VanDerWaalsContact O-OG1 3.06Å; T523-I526 PolarHBondContact O-N 2.97Å; T523-A527 VanDerWaalsContact O-CB 3.27Å; T523-A527 WeakPolarHBondContact O-CB 3.08Å; T523-A527 PolarHBondContact O-N 3.4Å
524	V	79.1	Confident	72.8	Confident	73 Å²	73	93 Å²	93	44%	0.442	49%	0.488	S	S	.	.	H	α-helix	trans	-63.8	-42.6	172.8	172	0	0	0	0	110.4	L520 A527 I528	L520-V524 HydrophobicContact CG-CG2 4.43Å; L520-V524 VanDerWaalsContact O-CB 3.27Å; L520-V524 WeakPolarHBondContact O-CB 3.36Å; L520-V524 WeakPolarHBondContact O-CG2 3.41Å; L520-V524 PolarHBondContact O-N 3.02Å; V524-A527 PolarHBondContact O-N 3.06Å; V524-I528 HydrophobicContact CG1-CD1 3.65Å; V524-I528 HydrophobicContact CG1-CG1 4.26Å; V524-I528 WeakPolarHBondContact O-CB 3.23Å; V524-I528 VanDerWaalsContact O-CG1 3.23Å; V524-I528 WeakPolarHBondContact O-CG1 3.38Å; V524-I528 PolarHBondContact O-N 2.81Å
525	G	79.4	Confident	74.2	Confident	37 Å²	37	85 Å²	85	38%	0.381	46%	0.461	S	S	.	.	H	α-helix	trans	-61.8	-44	175.6	0	0	0	0	0	112.9	I521 S522 L529	I521-G525 WeakPolarHBondContact O-CA 3.22Å; I521-G525 PolarHBondContact O-N 2.85Å; S522-G525 PolarHBondContact O-N 3.41Å; G525-L529 VanDerWaalsContact O-CB 3.29Å; G525-L529 WeakPolarHBondContact O-CB 3.41Å; G525-L529 PolarHBondContact O-N 3.36Å
526	I	78.6	Confident	75.4	Confident	97 Å²	97	88 Å²	88	50%	0.497	47%	0.474	S	S	.	.	H	α-helix	trans	-64.8	-41	173.6	-70	163.8	0	0	0	110.7	S522 T523 L529 I530	S522-I526 WeakPolarHBondContact O-CB 3.16Å; S522-I526 WeakPolarHBondContact O-CD1 3.44Å; S522-I526 WeakPolarHBondContact O-CG1 3.3Å; S522-I526 PolarHBondContact O-N 3.37Å; T523-I526 PolarHBondContact O-N 2.97Å; I526-L529 PolarHBondContact O-N 3.11Å; I526-I530 HydrophobicContact CG2-CD1 3.69Å; I526-I530 HydrophobicContact CG2-CG1 4.29Å; I526-I530 WeakPolarHBondContact O-CB 3.44Å; I526-I530 VanDerWaalsContact O-CG1 3.25Å; I526-I530 WeakPolarHBondContact O-CG1 3.1Å; I526-I530 PolarHBondContact O-N 3.4Å
527	A	76.2	Confident	76.6	Confident	56 Å²	56	84 Å²	84	46%	0.463	45%	0.448	S	S	.	.	H	α-helix	trans	-66.7	-42.2	178.7	0	0	0	0	0	112.2	T523 V524 L529 I530 H531	T523-A527 VanDerWaalsContact O-CB 3.27Å; T523-A527 WeakPolarHBondContact O-CB 3.08Å; T523-A527 PolarHBondContact O-N 3.4Å; V524-A527 PolarHBondContact O-N 3.06Å; A527-L529 VanDerWaalsContact C-N 3.35Å; A527-I530 PolarHBondContact O-N 3.04Å; A527-H531 VanDerWaalsContact O-CB 3.31Å; A527-H531 WeakPolarHBondContact O-CB 3.46Å; A527-H531 PolarHBondContact O-N 3.48Å
528	I	78.2	Confident	77.4	Confident	90 Å²	90	79.9 Å²	79.9	46%	0.462	43%	0.426	S	S	.	.	H	α-helix	trans	-62	-44.5	172.9	-70.8	168.4	0	0	0	110	V524 H531 H532	V524-I528 HydrophobicContact CG1-CD1 3.65Å; V524-I528 HydrophobicContact CG1-CG1 4.26Å; V524-I528 WeakPolarHBondContact O-CB 3.23Å; V524-I528 VanDerWaalsContact O-CG1 3.23Å; V524-I528 WeakPolarHBondContact O-CG1 3.38Å; V524-I528 PolarHBondContact O-N 2.81Å; I528-H531 PolarHBondContact O-N 2.62Å; I528-H532 PolarHBondContact O-CD2 3.08Å; I528-H532 PolarHBondContact O-N 3.48Å
529	L	76.3	Confident	78	Confident	98 Å²	98	76 Å²	76	51%	0.513	42%	0.421	S	S	.	.	H	α-helix	trans	-60	-51.1	175.6	-177.2	66.4	0	0	0	110.7	G525 I526 A527 H531 H532 L533	G525-L529 VanDerWaalsContact O-CB 3.29Å; G525-L529 WeakPolarHBondContact O-CB 3.41Å; G525-L529 PolarHBondContact O-N 3.36Å; I526-L529 PolarHBondContact O-N 3.11Å; A527-L529 VanDerWaalsContact C-N 3.35Å; L529-H531 VanDerWaalsContact C-N 3.28Å; L529-H531 PolarHBondContact O-N 3.38Å; L529-H532 PolarHBondContact O-N 3.36Å; L529-L533 HydrophobicContact CD1-CD1 4.03Å; L529-L533 HydrophobicContact CD1-CG 4.2Å; L529-L533 HydrophobicContact CD2-CD1 4.49Å; L529-L533 HydrophobicContact CG-CD1 3.84Å; L529-L533 HydrophobicContact CG-CG 4.3Å; L529-L533 WeakPolarHBondContact O-CB 3.29Å; L529-L533 WeakPolarHBondContact O-CG 3.37Å; L529-L533 PolarHBondContact O-N 3.27Å
530	I	76.8	Confident	78.6	Confident	81 Å²	81	74.4 Å²	74.4	42%	0.415	42%	0.415	S	S	.	.	H	α-helix	trans	-57.1	-42.8	176.5	-71.8	168.9	0	0	0	110.8	I526 A527 L533 H534 I552	I526-I530 HydrophobicContact CG2-CD1 3.69Å; I526-I530 HydrophobicContact CG2-CG1 4.29Å; I526-I530 WeakPolarHBondContact O-CB 3.44Å; I526-I530 VanDerWaalsContact O-CG1 3.25Å; I526-I530 WeakPolarHBondContact O-CG1 3.1Å; I526-I530 PolarHBondContact O-N 3.4Å; A527-I530 PolarHBondContact O-N 3.04Å; I530-L533 CarbonylContact O-C 3.42Å; I530-L533 PolarHBondContact O-N 2.87Å; I530-H534 VanDerWaalsContact O-CB 3.27Å; I530-H534 WeakPolarHBondContact O-CB 3.47Å; I530-H534 PolarHBondContact O-N 2.94Å; I530-I552 HydrophobicContact CG2-CD1 4.14Å
531	H	78.2	Confident	79.2	Confident	143 Å²	143	69.4 Å²	69.4	66%	0.662	39%	0.389	S	S	*	.	H	α-helix	trans	-62.5	-44.9	178.1	-177.3	74.4	0	0	0	112.1	A527 I528 L529 L533 H534	A527-H531 VanDerWaalsContact O-CB 3.31Å; A527-H531 WeakPolarHBondContact O-CB 3.46Å; A527-H531 PolarHBondContact O-N 3.48Å; I528-H531 PolarHBondContact O-N 2.62Å; L529-H531 VanDerWaalsContact C-N 3.28Å; L529-H531 PolarHBondContact O-N 3.38Å; H531-L533 VanDerWaalsContact C-N 3.28Å; H531-L533 PolarHBondContact O-N 3.05Å; H531-H534 PolarHBondContact O-N 3.24Å
532	H	75.6	Confident	79.7	Confident	144 Å²	144	64.9 Å²	64.9	67%	0.667	37%	0.367	S	S	*	.	H	α-helix	trans	-68.2	-27.3	175.3	-76.4	-56.1	0	0	0	113.4	I528 L529	I528-H532 PolarHBondContact O-CD2 3.08Å; I528-H532 PolarHBondContact O-N 3.48Å; L529-H532 PolarHBondContact O-N 3.36Å
533	L	75.4	Confident	80.1	Confident	17 Å²	17	63.8 Å²	63.8	9%	0.089	36%	0.358	C	S	.	.	H	α-helix	trans	-86.3	-10.8	176.9	-66.5	-175.8	0	0	0	113.4	L529 I530 H531 I535 I552 R555 V556 Y560	L529-L533 HydrophobicContact CD1-CD1 4.03Å; L529-L533 HydrophobicContact CD1-CG 4.2Å; L529-L533 HydrophobicContact CD2-CD1 4.49Å; L529-L533 HydrophobicContact CG-CD1 3.84Å; L529-L533 HydrophobicContact CG-CG 4.3Å; L529-L533 WeakPolarHBondContact O-CB 3.29Å; L529-L533 WeakPolarHBondContact O-CG 3.37Å; L529-L533 PolarHBondContact O-N 3.27Å; I530-L533 CarbonylContact O-C 3.42Å; I530-L533 PolarHBondContact O-N 2.87Å; H531-L533 VanDerWaalsContact C-N 3.28Å; H531-L533 PolarHBondContact O-N 3.05Å; L533-I535 PolarHBondContact O-N 2.94Å; L533-I552 HydrophobicContact CB-CG2 4.3Å; L533-I552 HydrophobicContact CD1-CG2 4.08Å; L533-R555 PolarHBondContact O-NH1 2.8Å; L533-V556 HydrophobicContact CD1-CG2 3.68Å; L533-Y560 HydrophobicContact CD2-CE2 3.37Å; L533-Y560 WeakPolarHBondContact CD2-OH 3.46Å
534	H	78.2	Confident	80.4	Confident	83 Å²	83	64.9 Å²	64.9	38%	0.384	35%	0.353	S	S	.	.			trans	-81.5	115.4	-173.4	177.8	-86.8	0	0	0	111.6	I530 H531 H548	I530-H534 VanDerWaalsContact O-CB 3.27Å; I530-H534 WeakPolarHBondContact O-CB 3.47Å; I530-H534 PolarHBondContact O-N 2.94Å; H531-H534 PolarHBondContact O-N 3.24Å; H534-H548 AromaticContact CD2-ND1 3.75Å; H534-H548 AromaticContact CE1-CE1 3.9Å; H534-H548 AromaticContact NE2-CE1 3.26Å; H534-H548 PolarHBondContact NE2-CE1 2.73Å; H534-H548 VanDerWaalsContact NE2-CE1 3.26Å; H534-H548 AromaticContact NE2-ND1 3.37Å; H534-H548 PolarHBondContact NE2-ND1 2.75Å; H534-H548 AromaticContact NE2-NE2 3.91Å
535	I	77.4	Confident	80.6	Confident	33 Å²	33	69.1 Å²	69.1	17%	0.169	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-100.7	126.9	166.6	-62.9	171.3	0	0	0	108.4	L533 L537 H548 R555 G758 T759	L533-I535 PolarHBondContact O-N 2.94Å; I535-L537 PolarHBondContact O-N 3.43Å; I535-H548 PolarHBondContact O-CE1 2.84Å; I535-R555 VanDerWaalsContact CD1-CZ 3.49Å; I535-G758 WeakPolarHBondContact CD1-O 3.43Å; I535-T759 HydrophobicContact CB-CG2 4.42Å; I535-T759 HydrophobicContact CD1-CG2 4.39Å; I535-T759 HydrophobicContact CG2-CG2 3.82Å
536	P	79.6	Confident	80.8	Confident	92 Å²	92	71.5 Å²	71.5	60%	0.597	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-66	120.2	177.2	26.7	-32.6	0	0	0	110.6
537	L	83.4	Confident	81.1	Confident	4 Å²	4	66.9 Å²	66.9	2%	0.021	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-86.5	155.1	173.5	-64.6	175	0	0	0	110.4	I535 M541 R544 M547 H548 E551 T759 L761	I535-L537 PolarHBondContact O-N 3.43Å; L537-M541 HydrophobicContact CD1-SD 4.46Å; L537-R544 VanDerWaalsContact O-CZ 3.26Å; L537-R544 PolarHBondContact O-NE 2.78Å; L537-R544 PolarHBondContact O-NH2 3.33Å; L537-M547 HydrophobicContact CD1-CB 3.55Å; L537-H548 PolarHBondContact N-CE1 2.83Å; L537-E551 HydrophobicContact CD2-CG 4.41Å; L537-T759 HydrophobicContact CD2-CG2 4.06Å; L537-L761 HydrophobicContact CD2-CD1 4.47Å
538	P	83	Confident	81.5	Confident	11 Å²	11	65.6 Å²	65.6	7%	0.071	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-52.5	140.9	178.4	-27.3	35.9	0	0	0	113.1	E540 M541 R544 L755 F868	P538-E540 VanDerWaalsContact C-N 3.27Å; P538-E540 PolarHBondContact O-N 2.77Å; P538-M541 HydrophobicContact CB-CB 4.48Å; P538-M541 HydrophobicContact CG-CE 4.23Å; P538-M541 WeakPolarHBondContact O-CB 3.3Å; P538-M541 PolarHBondContact O-N 2.89Å; P538-R544 WeakPolarHBondContact O-CD 3.48Å; P538-R544 PolarHBondContact O-NE 3.37Å; P538-L755 HydrophobicContact CB-CD1 4.46Å; P538-L755 HydrophobicContact CG-CB 4.06Å; P538-L755 HydrophobicContact CG-CD1 3.87Å; P538-L755 HydrophobicContact CG-CG 4.41Å; P538-F868 HydrophobicContact CB-CD1 4.07Å; P538-F868 HydrophobicContact CB-CE1 3.5Å; P538-F868 HydrophobicContact CB-CE2 4.43Å; P538-F868 HydrophobicContact CB-CZ 3.71Å; P538-F868 HydrophobicContact CG-CD1 3.86Å; P538-F868 HydrophobicContact CG-CE1 3.77Å; P538-F868 HydrophobicContact CG-CZ 4.41Å
539	A	82.9	Confident	81.7	Confident	61 Å²	61	65.9 Å²	65.9	50%	0.504	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-30.3	-173.6	0	0	0	0	0	112.6	M541	A539-M541 VanDerWaalsContact C-N 3.34Å
540	E	86	Confident	82.1	Confident	115 Å²	115	63.5 Å²	63.5	54%	0.537	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-14.4	-175.2	-53.1	71.2	-157	0	0	112.1	P538 S542 F868 R896	P538-E540 VanDerWaalsContact C-N 3.27Å; P538-E540 PolarHBondContact O-N 2.77Å; E540-S542 PolarHBondContact O-N 3.38Å; E540-F868 HydrophobicContact CB-CE2 4.26Å; E540-F868 HydrophobicContact CB-CZ 4.01Å; E540-R896 WeakPolarHBondContact O-CB 3.49Å; E540-R896 VanDerWaalsContact O-CG 3.28Å; E540-R896 WeakPolarHBondContact O-CG 3.36Å; E540-R896 PolarHBondContact O-NE 3.33Å
541	M	86.9	Confident	82.4	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.005	29%	0.287	C	S	.	.	S	Bend	trans	-59.7	136.8	179.3	-170.3	177.5	-75.9	0	0	111.2	L537 P538 A539 M547 L756 L761 F868 F898	L537-M541 HydrophobicContact CD1-SD 4.46Å; P538-M541 HydrophobicContact CB-CB 4.48Å; P538-M541 HydrophobicContact CG-CE 4.23Å; P538-M541 WeakPolarHBondContact O-CB 3.3Å; P538-M541 PolarHBondContact O-N 2.89Å; A539-M541 VanDerWaalsContact C-N 3.34Å; M541-M547 HydrophobicContact SD-CE 4.05Å; M541-M547 HydrophobicContact SD-CG 4.25Å; M541-L756 HydrophobicContact CE-CD2 4.13Å; M541-L761 HydrophobicContact CE-CD1 4.38Å; M541-F868 HydrophobicContact CB-CD2 4.23Å; M541-F868 HydrophobicContact CB-CE2 4.19Å; M541-F868 HydrophobicContact CE-CB 3.8Å; M541-F868 HydrophobicContact CE-CD2 4.17Å; M541-F868 HydrophobicContact CE-CG 3.94Å; M541-F868 HydrophobicContact CG-CD2 4.4Å; M541-F898 HydrophobicContact CE-CB 4.08Å; M541-F898 HydrophobicContact CG-CD1 3.96Å; M541-F898 HydrophobicContact SD-CD1 4.14Å; M541-F898 HydrophobicContact SD-CG 4.42Å
542	S	87.6	Confident	82.6	Confident	11 Å²	11	54.1 Å²	54.1	8%	0.077	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	152.5	177.3	-168.5	0	0	0	0	111.8	E540 R544 R896	E540-S542 PolarHBondContact O-N 3.38Å; S542-R544 PolarHBondContact O-N 3.14Å; S542-R896 PolarHBondContact N-O 2.84Å
543	D	86	Confident	82.8	Confident	18 Å²	18	50.4 Å²	50.4	10%	0.096	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	28.8	174.5	-62.7	-92.8	0	0	0	113.5	W545 R546 M547 M908 T909	D543-W545 VanDerWaalsContact C-N 3.31Å; D543-W545 PolarHBondContact O-N 3.26Å; D543-W545 VanDerWaalsContact O-N 3.08Å; D543-R546 HydrophobicContact CB-CB 4.46Å; D543-R546 WeakPolarHBondContact O-CA 3.44Å; D543-R546 WeakPolarHBondContact O-CB 3.25Å; D543-R546 PolarHBondContact O-N 2.92Å; D543-R546 IonicContact OD1-CZ 3.74Å; D543-R546 IonicContact OD1-NH1 3.77Å; D543-R546 PolarHBondContact OD1-NH1 2.86Å; D543-M547 PolarHBondContact O-N 2.9Å; D543-M908 HydrophobicContact CB-CB 4.19Å; D543-M908 HydrophobicContact CB-CG 3.98Å; D543-M908 HydrophobicContact CB-SD 4.35Å; D543-T909 PolarHBondContact OD1-N 3.33Å; D543-T909 PolarHBondContact OD2-N 2.78Å; D543-T909 VanDerWaalsContact OD2-N 3.12Å; D543-T909 PolarHBondContact OD2-OG1 2.92Å
544	R	84.4	Confident	83.1	Confident	97 Å²	97	50 Å²	50	37%	0.366	25%	0.25	S	S	.	.	H	α-helix	trans	-47.6	-42.6	-169.4	-170.5	-179.9	179.9	-150.3	1.8	115	L537 P538 S542 R546 M547 H548	L537-R544 VanDerWaalsContact O-CZ 3.26Å; L537-R544 PolarHBondContact O-NE 2.78Å; L537-R544 PolarHBondContact O-NH2 3.33Å; P538-R544 WeakPolarHBondContact O-CD 3.48Å; P538-R544 PolarHBondContact O-NE 3.37Å; S542-R544 PolarHBondContact O-N 3.14Å; R544-R546 PolarHBondContact O-N 3.31Å; R544-M547 WeakPolarHBondContact O-CB 3.34Å; R544-M547 PolarHBondContact O-N 2.82Å; R544-H548 PolarHBondContact O-CD2 2.96Å; R544-H548 PolarHBondContact O-N 2.82Å
545	W	82.2	Confident	83.1	Confident	163 Å²	163	47.3 Å²	47.3	62%	0.617	24%	0.237	S	C	*	.	H	α-helix	trans	-67.6	-35	179.1	74.9	-96.1	0	0	0	112.7	D543 I549	D543-W545 VanDerWaalsContact C-N 3.31Å; D543-W545 PolarHBondContact O-N 3.26Å; D543-W545 VanDerWaalsContact O-N 3.08Å; W545-I549 HydrophobicContact CE3-CD1 3.81Å; W545-I549 HydrophobicContact CZ3-CD1 3.72Å; W545-I549 PolarHBondContact O-N 2.85Å
546	R	85.1	Confident	83.1	Confident	87 Å²	87	49.3 Å²	49.3	33%	0.328	25%	0.25	S	S	.	.	H	α-helix	trans	-71.1	-38.5	173.2	-62.1	-176.1	178.2	149.7	-3.6	110.6	D543 R544 H548 I549 F550 E907 M908	D543-R546 HydrophobicContact CB-CB 4.46Å; D543-R546 WeakPolarHBondContact O-CA 3.44Å; D543-R546 WeakPolarHBondContact O-CB 3.25Å; D543-R546 PolarHBondContact O-N 2.92Å; D543-R546 IonicContact OD1-CZ 3.74Å; D543-R546 IonicContact OD1-NH1 3.77Å; D543-R546 PolarHBondContact OD1-NH1 2.86Å; R544-R546 PolarHBondContact O-N 3.31Å; R546-H548 VanDerWaalsContact C-N 3.34Å; R546-H548 PolarHBondContact O-N 2.84Å; R546-I549 PolarHBondContact O-N 2.92Å; R546-F550 PolarHBondContact O-N 3.35Å; R546-E907 VanDerWaalsContact CD-O 3.23Å; R546-E907 WeakPolarHBondContact CD-O 3.27Å; R546-E907 VanDerWaalsContact CZ-O 3.29Å; R546-E907 PolarHBondContact NH1-O 3.16Å; R546-M908 HydrophobicContact CB-CE 4.14Å
547	M	84.6	Confident	83	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-59.5	-44.2	174.8	-72	-63.7	-66.5	0	0	111.3	L537 M541 D543 R544 I549 F550 E551 L761 F898 L904 M908	L537-M547 HydrophobicContact CD1-CB 3.55Å; M541-M547 HydrophobicContact SD-CE 4.05Å; M541-M547 HydrophobicContact SD-CG 4.25Å; D543-M547 PolarHBondContact O-N 2.9Å; R544-M547 WeakPolarHBondContact O-CB 3.34Å; R544-M547 PolarHBondContact O-N 2.82Å; M547-I549 VanDerWaalsContact C-N 3.29Å; M547-I549 PolarHBondContact O-N 2.75Å; M547-F550 PolarHBondContact O-N 3.38Å; M547-E551 WeakPolarHBondContact O-CB 3.2Å; M547-E551 PolarHBondContact O-N 3.5Å; M547-L761 HydrophobicContact CE-CD1 3.61Å; M547-L761 HydrophobicContact CE-CD2 3.51Å; M547-L761 HydrophobicContact CE-CG 4.11Å; M547-F898 HydrophobicContact CE-CD1 4.3Å; M547-F898 HydrophobicContact CE-CD2 3.88Å; M547-F898 HydrophobicContact CE-CE1 4.11Å; M547-F898 HydrophobicContact CE-CE2 3.68Å; M547-F898 HydrophobicContact CE-CG 4.22Å; M547-F898 HydrophobicContact CE-CZ 3.82Å; M547-F898 HydrophobicContact CG-CE1 4.29Å; M547-F898 HydrophobicContact CG-CZ 4.49Å; M547-F898 HydrophobicContact SD-CD1 4.46Å; M547-F898 HydrophobicContact SD-CE1 3.72Å; M547-F898 HydrophobicContact SD-CE2 3.8Å; M547-F898 HydrophobicContact SD-CZ 3.37Å; M547-F898 WeakPolarHBondContact SD-CZ 3.47Å; M547-L904 HydrophobicContact SD-CD1 4.4Å; M547-M908 HydrophobicContact CG-CE 3.88Å; M547-M908 HydrophobicContact CG-SD 4.18Å; M547-M908 HydrophobicContact SD-CE 3.17Å; M547-M908 WeakPolarHBondContact SD-CE 3.45Å; M547-M908 HydrophobicContact SD-SD 3.43Å
548	H	84.4	Confident	82.6	Confident	29 Å²	29	50.5 Å²	50.5	13%	0.134	25%	0.251	C	S	.	.	H	α-helix	trans	-57.7	-39.6	175.5	-80	-61.7	0	0	0	113.4	H534 I535 L537 R544 R546 I552	H534-H548 AromaticContact CD2-ND1 3.75Å; H534-H548 AromaticContact CE1-CE1 3.9Å; H534-H548 AromaticContact NE2-CE1 3.26Å; H534-H548 PolarHBondContact NE2-CE1 2.73Å; H534-H548 VanDerWaalsContact NE2-CE1 3.26Å; H534-H548 AromaticContact NE2-ND1 3.37Å; H534-H548 PolarHBondContact NE2-ND1 2.75Å; H534-H548 AromaticContact NE2-NE2 3.91Å; I535-H548 PolarHBondContact O-CE1 2.84Å; L537-H548 PolarHBondContact N-CE1 2.83Å; R544-H548 PolarHBondContact O-CD2 2.96Å; R544-H548 PolarHBondContact O-N 2.82Å; R546-H548 VanDerWaalsContact C-N 3.34Å; R546-H548 PolarHBondContact O-N 2.84Å; H548-I552 WeakPolarHBondContact O-CD1 3.47Å; H548-I552 VanDerWaalsContact O-CG1 3.29Å; H548-I552 WeakPolarHBondContact O-CG1 3.41Å; H548-I552 PolarHBondContact O-N 3.41Å
549	I	82.8	Confident	82.1	Confident	95 Å²	95	52.3 Å²	52.3	49%	0.487	26%	0.258	S	S	.	.	H	α-helix	trans	-67.1	-49.4	176.2	-62.1	169.8	0	0	0	110.2	W545 R546 M547 E551 I552 C553	W545-I549 HydrophobicContact CE3-CD1 3.81Å; W545-I549 HydrophobicContact CZ3-CD1 3.72Å; W545-I549 PolarHBondContact O-N 2.85Å; R546-I549 PolarHBondContact O-N 2.92Å; M547-I549 VanDerWaalsContact C-N 3.29Å; M547-I549 PolarHBondContact O-N 2.75Å; I549-E551 VanDerWaalsContact C-N 3.33Å; I549-E551 PolarHBondContact O-N 2.88Å; I549-I552 PolarHBondContact O-N 3.44Å; I549-C553 PolarHBondContact O-N 2.9Å; I549-C553 VanDerWaalsContact O-N 3.11Å; I549-C553 PolarHBondContact O-SG 2.84Å; I549-C553 VanDerWaalsContact O-SG 3.34Å
550	F	83.1	Confident	81.7	Confident	48 Å²	48	53 Å²	53	21%	0.211	25%	0.248	C	C	.	.	H	α-helix	trans	-59.1	-45	179.8	174.2	-98.3	0	0	0	111.8	R546 M547 C553 A554 F586 L761 L904	R546-F550 PolarHBondContact O-N 3.35Å; M547-F550 PolarHBondContact O-N 3.38Å; F550-C553 PolarHBondContact O-N 2.93Å; F550-A554 HydrophobicContact CE1-CB 4.35Å; F550-A554 HydrophobicContact CZ-CB 4.44Å; F550-A554 WeakPolarHBondContact O-CB 3.39Å; F550-A554 PolarHBondContact O-N 3.11Å; F550-F586 HydrophobicContact CD2-CE1 4.44Å; F550-F586 HydrophobicContact CD2-CZ 4.46Å; F550-F586 AromaticContact CE2-CE1 3.85Å; F550-F586 HydrophobicContact CE2-CE1 3.85Å; F550-F586 HydrophobicContact CE2-CZ 4.29Å; F550-L761 HydrophobicContact CE1-CD2 4.31Å; F550-L904 HydrophobicContact CD1-CD1 4.13Å; F550-L904 HydrophobicContact CD2-CD1 4.31Å; F550-L904 HydrophobicContact CD2-CD2 4.16Å; F550-L904 HydrophobicContact CE1-CD1 4.1Å; F550-L904 HydrophobicContact CE2-CD1 4.28Å; F550-L904 HydrophobicContact CE2-CD2 3.88Å; F550-L904 HydrophobicContact CG-CD1 4.23Å; F550-L904 HydrophobicContact CZ-CD1 4.18Å; F550-L904 HydrophobicContact CZ-CD2 4.34Å
551	E	83.4	Confident	81.1	Confident	0 Å²	0	49 Å²	49	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59.5	-49.5	-178.1	-163.3	-60.6	124.9	0	0	110.9	L537 M547 I549 C553 A554 R555 T759 S760	L537-E551 HydrophobicContact CD2-CG 4.41Å; M547-E551 WeakPolarHBondContact O-CB 3.2Å; M547-E551 PolarHBondContact O-N 3.5Å; I549-E551 VanDerWaalsContact C-N 3.33Å; I549-E551 PolarHBondContact O-N 2.88Å; E551-C553 PolarHBondContact O-N 3.46Å; E551-A554 PolarHBondContact O-N 3.17Å; E551-R555 WeakPolarHBondContact O-CG 3.36Å; E551-R555 PolarHBondContact O-N 2.81Å; E551-R555 WeakPolarHBondContact OE1-CD 3.48Å; E551-R555 WeakPolarHBondContact OE1-CG 3.29Å; E551-R555 WeakPolarHBondContact OE2-CD 3.48Å; E551-T759 WeakPolarHBondContact OE1-CA 2.89Å; E551-S760 WeakPolarHBondContact CA-OG 3.41Å; E551-S760 PolarHBondContact O-OG 3.49Å; E551-S760 PolarHBondContact OE1-N 3.48Å; E551-S760 PolarHBondContact OE1-OG 3.19Å
552	I	82.4	Confident	80.2	Confident	28 Å²	28	49.4 Å²	49.4	14%	0.144	24%	0.235	C	C	.	.	H	α-helix	trans	-61.4	-46.1	177.2	-67.7	168.1	0	0	0	110.8	I530 L533 H548 I549 A554 R555 V556	I530-I552 HydrophobicContact CG2-CD1 4.14Å; L533-I552 HydrophobicContact CB-CG2 4.3Å; L533-I552 HydrophobicContact CD1-CG2 4.08Å; H548-I552 WeakPolarHBondContact O-CD1 3.47Å; H548-I552 VanDerWaalsContact O-CG1 3.29Å; H548-I552 WeakPolarHBondContact O-CG1 3.41Å; H548-I552 PolarHBondContact O-N 3.41Å; I549-I552 PolarHBondContact O-N 3.44Å; I552-A554 PolarHBondContact O-N 2.86Å; I552-R555 PolarHBondContact O-N 2.85Å; I552-V556 WeakPolarHBondContact O-CG2 3.27Å; I552-V556 PolarHBondContact O-N 2.93Å; I552-V556 VanDerWaalsContact O-N 3.07Å
553	C	80.7	Confident	79.1	Confident	66 Å²	66	51.4 Å²	51.4	45%	0.446	25%	0.248	S	C	.	.	H	α-helix	trans	-60.7	-46.7	177.9	-70.7	0	0	0	0	111.7	I549 F550 E551 R555 V556 V557	I549-C553 PolarHBondContact O-N 2.9Å; I549-C553 VanDerWaalsContact O-N 3.11Å; I549-C553 PolarHBondContact O-SG 2.84Å; I549-C553 VanDerWaalsContact O-SG 3.34Å; F550-C553 PolarHBondContact O-N 2.93Å; E551-C553 PolarHBondContact O-N 3.46Å; C553-R555 VanDerWaalsContact C-N 3.33Å; C553-R555 PolarHBondContact O-N 2.94Å; C553-V556 PolarHBondContact O-N 3.22Å; C553-V557 WeakPolarHBondContact O-CB 3.45Å; C553-V557 VanDerWaalsContact O-CG2 3.22Å; C553-V557 WeakPolarHBondContact O-CG2 3.28Å; C553-V557 PolarHBondContact O-N 2.73Å
554	A	80	Confident	78.1	Confident	7 Å²	7	59.1 Å²	59.1	6%	0.058	28%	0.281	C	S	.	.	H	α-helix	trans	-61.3	-40.7	178.2	0	0	0	0	0	111.6	F550 E551 I552 Y558 F559 S760	F550-A554 HydrophobicContact CE1-CB 4.35Å; F550-A554 HydrophobicContact CZ-CB 4.44Å; F550-A554 WeakPolarHBondContact O-CB 3.39Å; F550-A554 PolarHBondContact O-N 3.11Å; E551-A554 PolarHBondContact O-N 3.17Å; I552-A554 PolarHBondContact O-N 2.86Å; A554-Y558 HydrophobicContact CB-CD1 4.25Å; A554-Y558 HydrophobicContact CB-CE1 3.5Å; A554-Y558 WeakPolarHBondContact O-CD1 3.41Å; A554-Y558 WeakPolarHBondContact O-CE1 3.34Å; A554-Y558 PolarHBondContact O-N 3.46Å; A554-Y558 VanDerWaalsContact O-N 3.07Å; A554-F559 PolarHBondContact O-N 3.4Å; A554-S760 VanDerWaalsContact CB-CB 3.48Å; A554-S760 WeakPolarHBondContact CB-OG 3.47Å
555	R	79.6	Confident	76.8	Confident	27 Å²	27	56.1 Å²	56.1	10%	0.102	28%	0.275	C	S	.	.	I	π-helix	trans	-61.9	-47.8	176.2	-75.4	-176.9	75.7	-170.4	16.9	112.9	L533 I535 E551 I552 C553 F559 Y560	L533-R555 PolarHBondContact O-NH1 2.8Å; I535-R555 VanDerWaalsContact CD1-CZ 3.49Å; E551-R555 WeakPolarHBondContact O-CG 3.36Å; E551-R555 PolarHBondContact O-N 2.81Å; E551-R555 WeakPolarHBondContact OE1-CD 3.48Å; E551-R555 WeakPolarHBondContact OE1-CG 3.29Å; E551-R555 WeakPolarHBondContact OE2-CD 3.48Å; I552-R555 PolarHBondContact O-N 2.85Å; C553-R555 VanDerWaalsContact C-N 3.33Å; C553-R555 PolarHBondContact O-N 2.94Å; R555-F559 HydrophobicContact CB-CB 4.35Å; R555-F559 HydrophobicContact CG-CB 4.37Å; R555-F559 WeakPolarHBondContact O-CB 3.42Å; R555-F559 PolarHBondContact O-N 3.1Å; R555-Y560 HydrophobicContact CB-CD2 4.34Å; R555-Y560 HydrophobicContact CB-CE2 3.93Å; R555-Y560 PolarHBondContact NE-OH 2.88Å; R555-Y560 PolarHBondContact NH1-OH 2.71Å; R555-Y560 PolarHBondContact NH2-OH 2.99Å; R555-Y560 VanDerWaalsContact O-CD2 3.25Å; R555-Y560 WeakPolarHBondContact O-CD2 3.47Å; R555-Y560 PolarHBondContact O-N 3.11Å
556	V	77.9	Confident	75.5	Confident	75 Å²	75	52 Å²	52	46%	0.455	26%	0.264	S	S	.	.	I	π-helix	trans	-65.8	-43.1	-179.5	174	0	0	0	0	111.6	L533 I552 C553 P561	L533-V556 HydrophobicContact CD1-CG2 3.68Å; I552-V556 WeakPolarHBondContact O-CG2 3.27Å; I552-V556 PolarHBondContact O-N 2.93Å; I552-V556 VanDerWaalsContact O-N 3.07Å; C553-V556 PolarHBondContact O-N 3.22Å; V556-P561 WeakPolarHBondContact O-CD 3.32Å
557	V	76.9	Confident	73.7	Confident	72 Å²	72	53.5 Å²	53.5	44%	0.436	29%	0.287	S	S	.	.	I	π-helix	trans	-77.9	-42.9	-171.1	172	0	0	0	0	112.6	C553 W578 T582	C553-V557 WeakPolarHBondContact O-CB 3.45Å; C553-V557 VanDerWaalsContact O-CG2 3.22Å; C553-V557 WeakPolarHBondContact O-CG2 3.28Å; C553-V557 PolarHBondContact O-N 2.73Å; V557-W578 PolarHBondContact O-NE1 2.62Å; V557-T582 HydrophobicContact CG1-CG2 3.92Å
558	Y	74.6	Confident	72.2	Confident	49 Å²	49	60.9 Å²	60.9	19%	0.192	32%	0.319	C	S	.	.	I	π-helix	trans	-126.8	-34.2	-176.2	77.3	-99.2	0	0	0	115.2	A554 V562 T579 T582 V583 S760	A554-Y558 HydrophobicContact CB-CD1 4.25Å; A554-Y558 HydrophobicContact CB-CE1 3.5Å; A554-Y558 WeakPolarHBondContact O-CD1 3.41Å; A554-Y558 WeakPolarHBondContact O-CE1 3.34Å; A554-Y558 PolarHBondContact O-N 3.46Å; A554-Y558 VanDerWaalsContact O-N 3.07Å; Y558-V562 VanDerWaalsContact O-CB 3.28Å; Y558-V562 WeakPolarHBondContact O-CB 3.36Å; Y558-V562 WeakPolarHBondContact O-CG2 3.37Å; Y558-V562 PolarHBondContact O-N 3.11Å; Y558-T579 HydrophobicContact CD2-CG2 4.49Å; Y558-T582 VanDerWaalsContact CB-OG1 3.31Å; Y558-T582 WeakPolarHBondContact CB-OG1 3.34Å; Y558-V583 HydrophobicContact CD1-CG2 4.22Å; Y558-V583 HydrophobicContact CE1-CG2 4.46Å; Y558-V583 HydrophobicContact CG-CG2 4.43Å; Y558-S760 PolarHBondContact OH-O 3.4Å
559	F	72.7	Confident	70.6	Confident	49 Å²	49	68 Å²	68	22%	0.215	35%	0.349	C	S	.	.	I	π-helix	trans	-68.1	-53.8	-174.1	-170.9	-95.3	0	0	0	111.9	A554 R555 V562 S563	A554-F559 PolarHBondContact O-N 3.4Å; R555-F559 HydrophobicContact CB-CB 4.35Å; R555-F559 HydrophobicContact CG-CB 4.37Å; R555-F559 WeakPolarHBondContact O-CB 3.42Å; R555-F559 PolarHBondContact O-N 3.1Å; F559-V562 PolarHBondContact O-N 3.33Å; F559-S563 WeakPolarHBondContact O-CB 3.44Å; F559-S563 PolarHBondContact O-N 2.79Å; F559-S563 PolarHBondContact O-OG 3.49Å; F559-S563 VanDerWaalsContact O-OG 3.1Å
560	Y	74.5	Confident	69	Low	75 Å²	75	70.9 Å²	70.9	29%	0.294	37%	0.366	S	S	.	.	H	α-helix	trans	-67	-43.5	-177.7	-64.7	-51.8	0	0	0	114.5	L533 R555 V562 S563 F564	L533-Y560 HydrophobicContact CD2-CE2 3.37Å; L533-Y560 WeakPolarHBondContact CD2-OH 3.46Å; R555-Y560 HydrophobicContact CB-CD2 4.34Å; R555-Y560 HydrophobicContact CB-CE2 3.93Å; R555-Y560 PolarHBondContact NE-OH 2.88Å; R555-Y560 PolarHBondContact NH1-OH 2.71Å; R555-Y560 PolarHBondContact NH2-OH 2.99Å; R555-Y560 VanDerWaalsContact O-CD2 3.25Å; R555-Y560 WeakPolarHBondContact O-CD2 3.47Å; R555-Y560 PolarHBondContact O-N 3.11Å; Y560-V562 PolarHBondContact O-N 3.5Å; Y560-S563 PolarHBondContact O-N 3.38Å; Y560-F564 WeakPolarHBondContact O-CB 3.39Å; Y560-F564 PolarHBondContact O-N 3.35Å
561	P	72.9	Confident	67.6	Low	33 Å²	33	70.2 Å²	70.2	21%	0.214	37%	0.366	C	S	.	.	H	α-helix	trans	-58.4	-37.5	175.7	-26.2	36.3	0	0	0	111.9	V556 C565 W578	V556-P561 WeakPolarHBondContact O-CD 3.32Å; P561-C565 VanDerWaalsContact O-CB 3.31Å; P561-C565 WeakPolarHBondContact O-CB 3.19Å; P561-C565 PolarHBondContact O-SG 3.46Å; P561-C565 VanDerWaalsContact O-SG 3.39Å; P561-W578 HydrophobicContact CB-CZ2 4.28Å; P561-W578 HydrophobicContact CG-CZ2 4.37Å
562	V	68.3	Low	66.6	Low	9 Å²	9	74 Å²	74	6%	0.055	38%	0.38	C	S	.	.	H	α-helix	trans	-65.5	-52.7	174.2	164.8	0	0	0	0	110.9	Y558 F559 Y560 F564 C565 I566 Q575 T579	Y558-V562 VanDerWaalsContact O-CB 3.28Å; Y558-V562 WeakPolarHBondContact O-CB 3.36Å; Y558-V562 WeakPolarHBondContact O-CG2 3.37Å; Y558-V562 PolarHBondContact O-N 3.11Å; F559-V562 PolarHBondContact O-N 3.33Å; Y560-V562 PolarHBondContact O-N 3.5Å; V562-F564 VanDerWaalsContact C-N 3.32Å; V562-F564 PolarHBondContact O-N 3.46Å; V562-C565 PolarHBondContact O-N 3.15Å; V562-I566 HydrophobicContact CG1-CD1 4.04Å; V562-I566 HydrophobicContact CG1-CG1 4.47Å; V562-I566 WeakPolarHBondContact O-CG1 3.41Å; V562-I566 PolarHBondContact O-N 2.86Å; V562-Q575 HydrophobicContact CB-CG 4.44Å; V562-Q575 HydrophobicContact CG1-CB 4.33Å; V562-Q575 VanDerWaalsContact CG1-CD 3.49Å; V562-Q575 HydrophobicContact CG1-CG 3.51Å; V562-Q575 HydrophobicContact CG2-CG 4.15Å; V562-T579 WeakPolarHBondContact CG2-OG1 3.47Å
563	S	65.5	Low	65.8	Low	52 Å²	52	83 Å²	83	36%	0.364	41%	0.412	S	S	.	.	H	α-helix	trans	-60.6	-37.7	-176.9	-64.5	0	0	0	0	113.3	F559 Y560 C565	F559-S563 WeakPolarHBondContact O-CB 3.44Å; F559-S563 PolarHBondContact O-N 2.79Å; F559-S563 PolarHBondContact O-OG 3.49Å; F559-S563 VanDerWaalsContact O-OG 3.1Å; Y560-S563 PolarHBondContact O-N 3.38Å; S563-C565 PolarHBondContact O-N 3.5Å
564	F	63.7	Low	65.6	Low	181 Å²	181	84.8 Å²	84.8	79%	0.794	41%	0.41	S	S	*	.	H	α-helix	trans	-65.4	-23.8	177.1	-169	-101.9	0	0	0	113	Y560 V562	Y560-F564 WeakPolarHBondContact O-CB 3.39Å; Y560-F564 PolarHBondContact O-N 3.35Å; V562-F564 VanDerWaalsContact C-N 3.32Å; V562-F564 PolarHBondContact O-N 3.46Å
565	C	57	Low	65.4	Low	34 Å²	34	85.1 Å²	85.1	23%	0.23	41%	0.41	C	S	.	.	H	α-helix	trans	-98.8	-12.5	-170.6	-83.9	0	0	0	0	113.7	P561 V562 S563 C567 V571 W574	P561-C565 VanDerWaalsContact O-CB 3.31Å; P561-C565 WeakPolarHBondContact O-CB 3.19Å; P561-C565 PolarHBondContact O-SG 3.46Å; P561-C565 VanDerWaalsContact O-SG 3.39Å; V562-C565 PolarHBondContact O-N 3.15Å; S563-C565 PolarHBondContact O-N 3.5Å; C565-C567 PolarHBondContact O-N 2.93Å; C565-V571 HydrophobicContact CB-CG1 3.43Å; C565-V571 VanDerWaalsContact CB-CG1 3.43Å; C565-V571 WeakPolarHBondContact O-CB 3.39Å; C565-V571 WeakPolarHBondContact O-CG1 3.38Å; C565-W574 HydrophobicContact CB-CE3 3.81Å; C565-W574 HydrophobicContact CB-CZ3 3.71Å; C565-W574 WeakPolarHBondContact SG-CZ3 3.34Å
566	I	54.7	Low	65.6	Low	75 Å²	75	84.1 Å²	84.1	39%	0.385	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-14.5	-174.4	-72.9	167.2	0	0	0	114	V562 K568	V562-I566 HydrophobicContact CG1-CD1 4.04Å; V562-I566 HydrophobicContact CG1-CG1 4.47Å; V562-I566 WeakPolarHBondContact O-CG1 3.41Å; V562-I566 PolarHBondContact O-N 2.86Å; I566-K568 VanDerWaalsContact C-N 3.31Å; I566-K568 PolarHBondContact O-N 2.99Å; I566-K568 VanDerWaalsContact O-N 3.15Å
567	C	48.7	Very low	66	Low	119 Å²	119	84.6 Å²	84.6	80%	0.804	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	2.3	-173.7	-60.7	0	0	0	0	116.7	C565	C565-C567 PolarHBondContact O-N 2.93Å
568	K	52	Low	66.4	Low	156 Å²	156	84.8 Å²	84.8	68%	0.678	40%	0.403	S	S	*	.	S	Bend	trans	-135.4	133.8	-179.2	-69.3	-174.7	-179.6	-177.8	0	112.8	I566 N570 V571	I566-K568 VanDerWaalsContact C-N 3.31Å; I566-K568 PolarHBondContact O-N 2.99Å; I566-K568 VanDerWaalsContact O-N 3.15Å; K568-N570 VanDerWaalsContact C-N 3.26Å; K568-N570 PolarHBondContact O-N 3.12Å; K568-N570 VanDerWaalsContact O-N 3.09Å; K568-V571 HydrophobicContact CB-CB 4.48Å; K568-V571 HydrophobicContact CB-CG2 3.62Å; K568-V571 WeakPolarHBondContact O-CB 3.2Å; K568-V571 PolarHBondContact O-N 2.99Å
569	K	50.7	Low	66.9	Low	177 Å²	177	82.8 Å²	82.8	77%	0.77	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-50.2	-37.2	-176.1	-84.1	-178	175.3	176.9	0	114.6	V571	K569-V571 VanDerWaalsContact C-N 3.29Å; K569-V571 PolarHBondContact O-N 3.49Å
570	N	49.3	Very low	67.7	Low	157 Å²	157	82.3 Å²	82.3	84%	0.84	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-77.6	-8.2	179.1	-76.6	-13	0	0	0	114.5	K568	K568-N570 VanDerWaalsContact C-N 3.26Å; K568-N570 PolarHBondContact O-N 3.12Å; K568-N570 VanDerWaalsContact O-N 3.09Å
571	V	55	Low	68.3	Low	34 Å²	34	83.3 Å²	83.3	21%	0.206	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-92.9	-6.8	-172.8	-169.2	0	0	0	0	112.4	C565 K568 K569 R573 W574 Q575	C565-V571 HydrophobicContact CB-CG1 3.43Å; C565-V571 VanDerWaalsContact CB-CG1 3.43Å; C565-V571 WeakPolarHBondContact O-CB 3.39Å; C565-V571 WeakPolarHBondContact O-CG1 3.38Å; K568-V571 HydrophobicContact CB-CB 4.48Å; K568-V571 HydrophobicContact CB-CG2 3.62Å; K568-V571 WeakPolarHBondContact O-CB 3.2Å; K568-V571 PolarHBondContact O-N 2.99Å; K569-V571 VanDerWaalsContact C-N 3.29Å; K569-V571 PolarHBondContact O-N 3.49Å; V571-R573 PolarHBondContact O-N 2.72Å; V571-W574 HydrophobicContact CG1-CB 4.07Å; V571-W574 HydrophobicContact CG1-CE3 4.21Å; V571-W574 WeakPolarHBondContact O-CA 3.32Å; V571-W574 VanDerWaalsContact O-CB 3.27Å; V571-W574 WeakPolarHBondContact O-CB 3.42Å; V571-W574 PolarHBondContact O-N 3.43Å; V571-Q575 PolarHBondContact O-N 2.93Å
572	R	61.1	Low	69	Low	78 Å²	78	82.5 Å²	82.5	29%	0.294	40%	0.397	S	S	.	.	H	α-helix	trans	-65.8	-37.1	-180	-62.1	-178.2	-175.1	168.6	-1.6	113.7	W574 D778	R572-W574 VanDerWaalsContact C-N 3.28Å; R572-D778 IonicContact CZ-OD1 3.48Å; R572-D778 VanDerWaalsContact CZ-OD1 3.31Å; R572-D778 IonicContact CZ-OD2 3.36Å; R572-D778 IonicContact NH1-OD1 3.57Å; R572-D778 PolarHBondContact NH1-OD1 2.97Å; R572-D778 IonicContact NH1-OD2 3.18Å; R572-D778 PolarHBondContact NH1-OD2 2.63Å; R572-D778 IonicContact NH2-OD1 3.5Å; R572-D778 IonicContact NH2-OD2 2.91Å
573	R	67	Low	69.7	Low	218 Å²	218	83.4 Å²	83.4	82%	0.823	40%	0.402	S	S	*	.	H	α-helix	trans	-65.2	-35.7	170.7	-85.2	-174.8	174.7	168.3	-1.3	111.4	V571 V576 V577	V571-R573 PolarHBondContact O-N 2.72Å; R573-V576 PolarHBondContact O-N 3.22Å; R573-V577 WeakPolarHBondContact O-CG2 3.29Å; R573-V577 PolarHBondContact O-N 3.31Å; R573-V577 VanDerWaalsContact O-N 3.15Å
574	W	74.8	Confident	70.7	Confident	104 Å²	104	82.3 Å²	82.3	39%	0.394	39%	0.391	S	S	.	.	H	α-helix	trans	-66.5	-36.8	-179.7	-167.3	82.9	0	0	0	112	C565 V571 R572 V576 V577 W578	C565-W574 HydrophobicContact CB-CE3 3.81Å; C565-W574 HydrophobicContact CB-CZ3 3.71Å; C565-W574 WeakPolarHBondContact SG-CZ3 3.34Å; V571-W574 HydrophobicContact CG1-CB 4.07Å; V571-W574 HydrophobicContact CG1-CE3 4.21Å; V571-W574 WeakPolarHBondContact O-CA 3.32Å; V571-W574 VanDerWaalsContact O-CB 3.27Å; V571-W574 WeakPolarHBondContact O-CB 3.42Å; V571-W574 PolarHBondContact O-N 3.43Å; R572-W574 VanDerWaalsContact C-N 3.28Å; W574-V576 PolarHBondContact O-N 2.95Å; W574-V577 PolarHBondContact O-N 2.92Å; W574-W578 HydrophobicContact CD2-CB 4.44Å; W574-W578 HydrophobicContact CE3-CB 4.3Å; W574-W578 HydrophobicContact CH2-CB 4.42Å; W574-W578 AromaticContact CH2-CD2 3.93Å; W574-W578 HydrophobicContact CH2-CD2 3.93Å; W574-W578 HydrophobicContact CH2-CE3 4.06Å; W574-W578 HydrophobicContact CH2-CG 4.09Å; W574-W578 HydrophobicContact CZ2-CD2 4.06Å; W574-W578 AromaticContact CZ2-CE3 3.71Å; W574-W578 HydrophobicContact CZ2-CE3 3.71Å; W574-W578 HydrophobicContact CZ2-CG 4.43Å; W574-W578 HydrophobicContact CZ2-CZ3 4.28Å; W574-W578 HydrophobicContact CZ3-CB 4.28Å; W574-W578 HydrophobicContact CZ3-CG 4.25Å; W574-W578 VanDerWaalsContact O-CB 3.23Å; W574-W578 WeakPolarHBondContact O-CB 3.48Å; W574-W578 PolarHBondContact O-N 3.12Å
575	Q	76.3	Confident	71.7	Confident	14 Å²	14	76.5 Å²	76.5	7%	0.065	37%	0.373	C	S	.	.	H	α-helix	trans	-54.7	-53.2	173.2	169.9	172.5	20.3	0	0	112.1	V562 V571 V577 W578 T579	V562-Q575 HydrophobicContact CB-CG 4.44Å; V562-Q575 HydrophobicContact CG1-CB 4.33Å; V562-Q575 VanDerWaalsContact CG1-CD 3.49Å; V562-Q575 HydrophobicContact CG1-CG 3.51Å; V562-Q575 HydrophobicContact CG2-CG 4.15Å; V571-Q575 PolarHBondContact O-N 2.93Å; Q575-V577 PolarHBondContact O-N 3.5Å; Q575-W578 PolarHBondContact O-N 2.9Å; Q575-T579 WeakPolarHBondContact O-CB 3.37Å; Q575-T579 PolarHBondContact O-N 3.45Å; Q575-T579 PolarHBondContact O-OG1 2.92Å
576	V	85	Confident	72.9	Confident	6 Å²	6	78.9 Å²	78.9	4%	0.036	38%	0.38	C	S	.	.	H	α-helix	trans	-61.1	-46.6	-179.7	178.3	0	0	0	0	110.8	R573 W574 W578 T579 R580 V637 W770 L773	R573-V576 PolarHBondContact O-N 3.22Å; W574-V576 PolarHBondContact O-N 2.95Å; V576-W578 PolarHBondContact O-N 3.41Å; V576-T579 PolarHBondContact O-N 2.84Å; V576-R580 HydrophobicContact CG1-CG 4.49Å; V576-R580 WeakPolarHBondContact O-CB 3.33Å; V576-R580 WeakPolarHBondContact O-CG 3.29Å; V576-R580 PolarHBondContact O-N 3.47Å; V576-V637 HydrophobicContact CG1-CG1 3.82Å; V576-V637 HydrophobicContact CG2-CG1 4.47Å; V576-W770 HydrophobicContact CG2-CZ3 4.37Å; V576-L773 HydrophobicContact CG2-CD1 3.84Å
577	V	85.5	Confident	74.2	Confident	85 Å²	85	76.4 Å²	76.4	52%	0.515	37%	0.369	S	S	.	.	H	α-helix	trans	-62.5	-44.4	-179.9	173.2	0	0	0	0	111.4	R573 W574 Q575 R580 L581	R573-V577 WeakPolarHBondContact O-CG2 3.29Å; R573-V577 PolarHBondContact O-N 3.31Å; R573-V577 VanDerWaalsContact O-N 3.15Å; W574-V577 PolarHBondContact O-N 2.92Å; Q575-V577 PolarHBondContact O-N 3.5Å; V577-R580 PolarHBondContact O-N 3.21Å; V577-L581 VanDerWaalsContact O-CB 3.29Å; V577-L581 WeakPolarHBondContact O-CB 3.43Å; V577-L581 PolarHBondContact O-N 3.36Å
578	W	85.3	Confident	75.8	Confident	76 Å²	76	78 Å²	78	29%	0.288	36%	0.358	S	S	.	.	H	α-helix	trans	-66.2	-46.8	179.4	-175.5	-97	0	0	0	111.8	V557 P561 W574 Q575 V576 R580 L581 T582	V557-W578 PolarHBondContact O-NE1 2.62Å; P561-W578 HydrophobicContact CB-CZ2 4.28Å; P561-W578 HydrophobicContact CG-CZ2 4.37Å; W574-W578 HydrophobicContact CD2-CB 4.44Å; W574-W578 HydrophobicContact CE3-CB 4.3Å; W574-W578 HydrophobicContact CH2-CB 4.42Å; W574-W578 AromaticContact CH2-CD2 3.93Å; W574-W578 HydrophobicContact CH2-CD2 3.93Å; W574-W578 HydrophobicContact CH2-CE3 4.06Å; W574-W578 HydrophobicContact CH2-CG 4.09Å; W574-W578 HydrophobicContact CZ2-CD2 4.06Å; W574-W578 AromaticContact CZ2-CE3 3.71Å; W574-W578 HydrophobicContact CZ2-CE3 3.71Å; W574-W578 HydrophobicContact CZ2-CG 4.43Å; W574-W578 HydrophobicContact CZ2-CZ3 4.28Å; W574-W578 HydrophobicContact CZ3-CB 4.28Å; W574-W578 HydrophobicContact CZ3-CG 4.25Å; W574-W578 VanDerWaalsContact O-CB 3.23Å; W574-W578 WeakPolarHBondContact O-CB 3.48Å; W574-W578 PolarHBondContact O-N 3.12Å; Q575-W578 PolarHBondContact O-N 2.9Å; V576-W578 PolarHBondContact O-N 3.41Å; W578-R580 PolarHBondContact O-N 3.44Å; W578-L581 HydrophobicContact CZ3-CD2 4.5Å; W578-L581 PolarHBondContact O-N 3.45Å; W578-T582 HydrophobicContact CD2-CG2 4.12Å; W578-T582 HydrophobicContact CG-CG2 4.41Å; W578-T582 HydrophobicContact CZ2-CG2 3.86Å; W578-T582 WeakPolarHBondContact O-CB 3.27Å; W578-T582 WeakPolarHBondContact O-CG2 3.25Å; W578-T582 PolarHBondContact O-N 3.45Å; W578-T582 PolarHBondContact O-OG1 3.09Å
579	T	85.1	Confident	77.3	Confident	6 Å²	6	75.7 Å²	75.7	4%	0.037	35%	0.348	C	S	.	.	H	α-helix	trans	-61.9	-43.6	177	-54.7	0	0	0	0	111	Y558 V562 Q575 V576 T582 V583 L638 W770	Y558-T579 HydrophobicContact CD2-CG2 4.49Å; V562-T579 WeakPolarHBondContact CG2-OG1 3.47Å; Q575-T579 WeakPolarHBondContact O-CB 3.37Å; Q575-T579 PolarHBondContact O-N 3.45Å; Q575-T579 PolarHBondContact O-OG1 2.92Å; V576-T579 PolarHBondContact O-N 2.84Å; T579-T582 PolarHBondContact O-OG1 2.92Å; T579-V583 HydrophobicContact CG2-CG2 3.98Å; T579-V583 VanDerWaalsContact O-CB 3.24Å; T579-V583 WeakPolarHBondContact O-CB 3.33Å; T579-V583 VanDerWaalsContact O-CG2 3.22Å; T579-V583 WeakPolarHBondContact O-CG2 3.43Å; T579-V583 PolarHBondContact O-N 3.23Å; T579-L638 HydrophobicContact CG2-CD1 3.74Å; T579-L638 HydrophobicContact CG2-CD2 3.8Å; T579-L638 HydrophobicContact CG2-CG 4.45Å; T579-W770 HydrophobicContact CG2-CH2 4.4Å; T579-W770 HydrophobicContact CG2-CZ2 4.37Å
580	R	89.6	Confident	78.6	Confident	39 Å²	39	68.7 Å²	68.7	15%	0.147	32%	0.319	C	S	.	.	H	α-helix	trans	-59.6	-52.5	173.6	-76.6	-178.2	177.5	160.7	12.4	111.2	V576 V577 W578 T582 H584 V637 L638 A667 E669	V576-R580 HydrophobicContact CG1-CG 4.49Å; V576-R580 WeakPolarHBondContact O-CB 3.33Å; V576-R580 WeakPolarHBondContact O-CG 3.29Å; V576-R580 PolarHBondContact O-N 3.47Å; V577-R580 PolarHBondContact O-N 3.21Å; W578-R580 PolarHBondContact O-N 3.44Å; R580-T582 PolarHBondContact O-N 3.3Å; R580-H584 WeakPolarHBondContact O-CA 3.28Å; R580-H584 WeakPolarHBondContact O-CB 3.25Å; R580-H584 PolarHBondContact O-N 3.23Å; R580-H584 PolarHBondContact O-ND1 3.14Å; R580-V637 VanDerWaalsContact CZ-O 3.27Å; R580-V637 PolarHBondContact NE-O 3.07Å; R580-V637 PolarHBondContact NH2-O 2.95Å; R580-L638 HydrophobicContact CG-CD2 3.74Å; R580-A667 PolarHBondContact NH2-O 2.78Å; R580-E669 IonicContact CZ-OE1 2.96Å; R580-E669 IonicContact CZ-OE2 3.72Å; R580-E669 VanDerWaalsContact NH1-CD 3.25Å; R580-E669 IonicContact NH1-OE1 3.05Å; R580-E669 PolarHBondContact NH1-OE1 3Å; R580-E669 IonicContact NH1-OE2 3.81Å; R580-E669 PolarHBondContact NH1-OE2 3.46Å; R580-E669 VanDerWaalsContact NH1-OE2 3.16Å; R580-E669 IonicContact NH2-OE1 2.94Å; R580-E669 IonicContact NH2-OE2 2.83Å; R580-E669 PolarHBondContact NH2-OE2 3.42Å
581	L	87.8	Confident	80	Confident	96 Å²	96	61.4 Å²	61.4	50%	0.503	28%	0.28	S	S	.	.	H	α-helix	trans	-55.5	-50.5	-178.6	178.6	65	0	0	0	111.6	V577 W578 S585	V577-L581 VanDerWaalsContact O-CB 3.29Å; V577-L581 WeakPolarHBondContact O-CB 3.43Å; V577-L581 PolarHBondContact O-N 3.36Å; W578-L581 HydrophobicContact CZ3-CD2 4.5Å; W578-L581 PolarHBondContact O-N 3.45Å; L581-S585 WeakPolarHBondContact O-CB 3.45Å; L581-S585 PolarHBondContact O-N 3.32Å; L581-S585 PolarHBondContact O-OG 3.38Å
582	T	86	Confident	81.3	Confident	17 Å²	17	66.5 Å²	66.5	10%	0.104	30%	0.296	C	S	.	.	H	α-helix	trans	-68.8	-51.2	-176.4	48.8	0	0	0	0	112.4	V557 Y558 W578 T579 R580 S585 F586	V557-T582 HydrophobicContact CG1-CG2 3.92Å; Y558-T582 VanDerWaalsContact CB-OG1 3.31Å; Y558-T582 WeakPolarHBondContact CB-OG1 3.34Å; W578-T582 HydrophobicContact CD2-CG2 4.12Å; W578-T582 HydrophobicContact CG-CG2 4.41Å; W578-T582 HydrophobicContact CZ2-CG2 3.86Å; W578-T582 WeakPolarHBondContact O-CB 3.27Å; W578-T582 WeakPolarHBondContact O-CG2 3.25Å; W578-T582 PolarHBondContact O-N 3.45Å; W578-T582 PolarHBondContact O-OG1 3.09Å; T579-T582 PolarHBondContact O-OG1 2.92Å; R580-T582 PolarHBondContact O-N 3.3Å; T582-S585 PolarHBondContact O-N 2.88Å; T582-F586 WeakPolarHBondContact O-CB 3.25Å; T582-F586 PolarHBondContact O-N 3.48Å
583	V	82.9	Confident	82.2	Confident	27 Å²	27	65.2 Å²	65.2	16%	0.164	29%	0.294	C	S	.	.	H	α-helix	trans	-67	-45.1	-178.6	178.4	0	0	0	0	110.9	Y558 T579 S585 F586 C587 L639	Y558-V583 HydrophobicContact CD1-CG2 4.22Å; Y558-V583 HydrophobicContact CE1-CG2 4.46Å; Y558-V583 HydrophobicContact CG-CG2 4.43Å; T579-V583 HydrophobicContact CG2-CG2 3.98Å; T579-V583 VanDerWaalsContact O-CB 3.24Å; T579-V583 WeakPolarHBondContact O-CB 3.33Å; T579-V583 VanDerWaalsContact O-CG2 3.22Å; T579-V583 WeakPolarHBondContact O-CG2 3.43Å; T579-V583 PolarHBondContact O-N 3.23Å; V583-S585 PolarHBondContact O-N 3.07Å; V583-F586 PolarHBondContact O-N 3.4Å; V583-C587 PolarHBondContact O-N 3.49Å; V583-C587 PolarHBondContact O-SG 3.22Å; V583-L639 HydrophobicContact CG1-CD2 3.49Å; V583-L639 VanDerWaalsContact CG1-CD2 3.49Å
584	H	86.7	Confident	82.7	Confident	29 Å²	29	57.1 Å²	57.1	13%	0.134	27%	0.266	C	S	.	.	H	α-helix	trans	-63.8	-41.7	177.4	-62.1	174.5	0	0	0	111.5	R580 C587 R588 L639 N640	R580-H584 WeakPolarHBondContact O-CA 3.28Å; R580-H584 WeakPolarHBondContact O-CB 3.25Å; R580-H584 PolarHBondContact O-N 3.23Å; R580-H584 PolarHBondContact O-ND1 3.14Å; H584-C587 PolarHBondContact O-N 2.9Å; H584-R588 WeakPolarHBondContact O-CB 3.21Å; H584-R588 WeakPolarHBondContact O-CG 3.29Å; H584-R588 PolarHBondContact O-N 3Å; H584-L639 WeakPolarHBondContact NE2-CA 3.27Å; H584-L639 PolarHBondContact NE2-N 2.85Å; H584-L639 PolarHBondContact NE2-O 2.96Å; H584-N640 PolarHBondContact CE1-ND2 2.72Å; H584-N640 PolarHBondContact ND1-ND2 3.2Å
585	S	85.2	Confident	82.8	Confident	60 Å²	60	56.3 Å²	56.3	42%	0.42	26%	0.263	S	S	.	.	H	α-helix	trans	-64.4	-41.9	177.7	-61.9	0	0	0	0	111.5	L581 T582 V583 R588 F589	L581-S585 WeakPolarHBondContact O-CB 3.45Å; L581-S585 PolarHBondContact O-N 3.32Å; L581-S585 PolarHBondContact O-OG 3.38Å; T582-S585 PolarHBondContact O-N 2.88Å; V583-S585 PolarHBondContact O-N 3.07Å; S585-R588 PolarHBondContact O-N 3.08Å; S585-F589 WeakPolarHBondContact O-CB 3.15Å; S585-F589 PolarHBondContact O-N 3.18Å
586	F	82.1	Confident	82.7	Confident	84 Å²	84	61.3 Å²	61.3	37%	0.368	29%	0.289	S	S	.	.	H	α-helix	trans	-61.8	-49.3	176	-178.5	-104.9	0	0	0	111.8	F550 T582 V583 R588 F589 L590	F550-F586 HydrophobicContact CD2-CE1 4.44Å; F550-F586 HydrophobicContact CD2-CZ 4.46Å; F550-F586 AromaticContact CE2-CE1 3.85Å; F550-F586 HydrophobicContact CE2-CE1 3.85Å; F550-F586 HydrophobicContact CE2-CZ 4.29Å; T582-F586 WeakPolarHBondContact O-CB 3.25Å; T582-F586 PolarHBondContact O-N 3.48Å; V583-F586 PolarHBondContact O-N 3.4Å; F586-R588 VanDerWaalsContact C-N 3.33Å; F586-R588 PolarHBondContact O-N 2.79Å; F586-F589 PolarHBondContact O-N 2.77Å; F586-L590 HydrophobicContact CD1-CD1 4.02Å; F586-L590 HydrophobicContact CD1-CG 4.47Å; F586-L590 HydrophobicContact CE1-CD1 3.36Å; F586-L590 HydrophobicContact CE1-CG 4.05Å; F586-L590 HydrophobicContact CE2-CD1 4.41Å; F586-L590 HydrophobicContact CE2-CD2 4.45Å; F586-L590 HydrophobicContact CE2-CG 4.32Å; F586-L590 HydrophobicContact CZ-CD1 3.6Å; F586-L590 HydrophobicContact CZ-CD2 4.22Å; F586-L590 HydrophobicContact CZ-CG 3.98Å; F586-L590 PolarHBondContact O-N 3.46Å
587	C	82.8	Confident	81.9	Confident	23 Å²	23	69.5 Å²	69.5	16%	0.155	32%	0.324	C	S	.	.	H	α-helix	trans	-60.4	-41.5	176.1	-64.4	0	0	0	0	112	V583 H584 F589 L590 S591 S643	V583-C587 PolarHBondContact O-N 3.49Å; V583-C587 PolarHBondContact O-SG 3.22Å; H584-C587 PolarHBondContact O-N 2.9Å; C587-F589 VanDerWaalsContact C-N 3.34Å; C587-F589 PolarHBondContact O-N 3.32Å; C587-L590 PolarHBondContact O-N 3.46Å; C587-S591 WeakPolarHBondContact O-CB 3.43Å; C587-S591 PolarHBondContact O-N 2.73Å; C587-S643 WeakPolarHBondContact CB-OG 3.31Å
588	R	81.9	Confident	81	Confident	151 Å²	151	68.3 Å²	68.3	57%	0.57	31%	0.313	S	S	*	.	H	α-helix	trans	-65.1	-37.8	177.5	-73.4	174.2	90.2	141.2	7.1	112	H584 S585 F586 W592 A642	H584-R588 WeakPolarHBondContact O-CB 3.21Å; H584-R588 WeakPolarHBondContact O-CG 3.29Å; H584-R588 PolarHBondContact O-N 3Å; S585-R588 PolarHBondContact O-N 3.08Å; F586-R588 VanDerWaalsContact C-N 3.33Å; F586-R588 PolarHBondContact O-N 2.79Å; R588-W592 VanDerWaalsContact O-CB 3.32Å; R588-W592 WeakPolarHBondContact O-CB 3.32Å; R588-W592 PolarHBondContact O-N 2.72Å; R588-A642 HydrophobicContact CG-CB 4.5Å
589	F	82.7	Confident	80	Confident	109 Å²	109	75.2 Å²	75.2	48%	0.478	34%	0.339	S	S	.	.	H	α-helix	trans	-66.1	-49	175.5	176.8	-108.1	0	0	0	111.8	S585 F586 C587 S591 W592 I593	S585-F589 WeakPolarHBondContact O-CB 3.15Å; S585-F589 PolarHBondContact O-N 3.18Å; F586-F589 PolarHBondContact O-N 2.77Å; C587-F589 VanDerWaalsContact C-N 3.34Å; C587-F589 PolarHBondContact O-N 3.32Å; F589-S591 VanDerWaalsContact C-N 3.3Å; F589-S591 PolarHBondContact O-N 3.03Å; F589-W592 HydrophobicContact CD2-CE3 4.34Å; F589-W592 HydrophobicContact CE2-CE3 4.37Å; F589-W592 HydrophobicContact CE2-CZ3 4.38Å; F589-W592 PolarHBondContact O-N 2.85Å; F589-W592 VanDerWaalsContact O-N 3.16Å; F589-I593 HydrophobicContact CD1-CD1 3.92Å; F589-I593 HydrophobicContact CD2-CD1 4.48Å; F589-I593 HydrophobicContact CE1-CD1 3.35Å; F589-I593 HydrophobicContact CE1-CG1 4.43Å; F589-I593 HydrophobicContact CE2-CD1 3.98Å; F589-I593 HydrophobicContact CE2-CG1 4.35Å; F589-I593 HydrophobicContact CG-CD1 4.47Å; F589-I593 HydrophobicContact CZ-CD1 3.4Å; F589-I593 VanDerWaalsContact CZ-CD1 3.4Å; F589-I593 HydrophobicContact CZ-CG1 4.25Å; F589-I593 PolarHBondContact O-N 3.42Å
590	L	79.1	Confident	79	Confident	29 Å²	29	82.9 Å²	82.9	15%	0.152	37%	0.374	C	S	.	.	H	α-helix	trans	-58.9	-43.8	174.2	-70.7	-175.7	0	0	0	111.6	F586 C587 W592 I593 H594	F586-L590 HydrophobicContact CD1-CD1 4.02Å; F586-L590 HydrophobicContact CD1-CG 4.47Å; F586-L590 HydrophobicContact CE1-CD1 3.36Å; F586-L590 HydrophobicContact CE1-CG 4.05Å; F586-L590 HydrophobicContact CE2-CD1 4.41Å; F586-L590 HydrophobicContact CE2-CD2 4.45Å; F586-L590 HydrophobicContact CE2-CG 4.32Å; F586-L590 HydrophobicContact CZ-CD1 3.6Å; F586-L590 HydrophobicContact CZ-CD2 4.22Å; F586-L590 HydrophobicContact CZ-CG 3.98Å; F586-L590 PolarHBondContact O-N 3.46Å; C587-L590 PolarHBondContact O-N 3.46Å; L590-W592 VanDerWaalsContact C-N 3.33Å; L590-W592 PolarHBondContact O-N 3.46Å; L590-I593 PolarHBondContact O-N 2.89Å; L590-H594 PolarHBondContact O-N 3.09Å; L590-H594 PolarHBondContact O-ND1 3.18Å
591	S	79.3	Confident	78.6	Confident	4 Å²	4	83.8 Å²	83.8	3%	0.028	38%	0.384	C	S	.	.	H	α-helix	trans	-61.7	-40.2	176.1	-173.8	0	0	0	0	112.1	C587 F589 H594 R595	C587-S591 WeakPolarHBondContact O-CB 3.43Å; C587-S591 PolarHBondContact O-N 2.73Å; F589-S591 VanDerWaalsContact C-N 3.3Å; F589-S591 PolarHBondContact O-N 3.03Å; S591-H594 PolarHBondContact O-N 3.35Å; S591-R595 WeakPolarHBondContact O-CB 3.45Å; S591-R595 VanDerWaalsContact O-CG 3.29Å; S591-R595 WeakPolarHBondContact O-CG 3.46Å; S591-R595 PolarHBondContact O-N 3.26Å; S591-R595 PolarHBondContact OG-NH1 3.42Å
592	W	81.7	Confident	78.6	Confident	141 Å²	141	80.3 Å²	80.3	53%	0.534	37%	0.366	S	S	.	.	H	α-helix	trans	-64.9	-47.1	174.6	177.7	77.2	0	0	0	112.2	R588 F589 L590 H594 R595 L596	R588-W592 VanDerWaalsContact O-CB 3.32Å; R588-W592 WeakPolarHBondContact O-CB 3.32Å; R588-W592 PolarHBondContact O-N 2.72Å; F589-W592 HydrophobicContact CD2-CE3 4.34Å; F589-W592 HydrophobicContact CE2-CE3 4.37Å; F589-W592 HydrophobicContact CE2-CZ3 4.38Å; F589-W592 PolarHBondContact O-N 2.85Å; F589-W592 VanDerWaalsContact O-N 3.16Å; L590-W592 VanDerWaalsContact C-N 3.33Å; L590-W592 PolarHBondContact O-N 3.46Å; W592-H594 VanDerWaalsContact C-N 3.31Å; W592-H594 PolarHBondContact O-N 3.41Å; W592-R595 PolarHBondContact O-N 2.77Å; W592-L596 HydrophobicContact CD2-CD1 4.41Å; W592-L596 HydrophobicContact CE3-CD1 4.43Å; W592-L596 HydrophobicContact CH2-CD1 4.02Å; W592-L596 HydrophobicContact CZ2-CD1 4Å; W592-L596 HydrophobicContact CZ3-CD1 4.24Å; W592-L596 WeakPolarHBondContact O-CG 3.31Å; W592-L596 PolarHBondContact O-N 3.08Å
593	I	80.6	Confident	78.9	Confident	52 Å²	52	85.6 Å²	85.6	27%	0.267	39%	0.387	S	S	.	.	H	α-helix	trans	-57.4	-45.1	176.1	-71.2	174.7	0	0	0	111.2	F589 L590 L596	F589-I593 HydrophobicContact CD1-CD1 3.92Å; F589-I593 HydrophobicContact CD2-CD1 4.48Å; F589-I593 HydrophobicContact CE1-CD1 3.35Å; F589-I593 HydrophobicContact CE1-CG1 4.43Å; F589-I593 HydrophobicContact CE2-CD1 3.98Å; F589-I593 HydrophobicContact CE2-CG1 4.35Å; F589-I593 HydrophobicContact CG-CD1 4.47Å; F589-I593 HydrophobicContact CZ-CD1 3.4Å; F589-I593 VanDerWaalsContact CZ-CD1 3.4Å; F589-I593 HydrophobicContact CZ-CG1 4.25Å; F589-I593 PolarHBondContact O-N 3.42Å; L590-I593 PolarHBondContact O-N 2.89Å; I593-L596 WeakPolarHBondContact O-CB 3.48Å; I593-L596 PolarHBondContact O-N 3.46Å
594	H	76.1	Confident	79.4	Confident	47 Å²	47	86.6 Å²	86.6	22%	0.218	39%	0.393	C	S	.	.	H	α-helix	trans	-70	-38.7	-178.4	-77	93.3	0	0	0	112.4	L590 S591 W592 L596 K597 E598 L646 T906 E907	L590-H594 PolarHBondContact O-N 3.09Å; L590-H594 PolarHBondContact O-ND1 3.18Å; S591-H594 PolarHBondContact O-N 3.35Å; W592-H594 VanDerWaalsContact C-N 3.31Å; W592-H594 PolarHBondContact O-N 3.41Å; H594-L596 PolarHBondContact O-N 3.29Å; H594-K597 PolarHBondContact O-N 3.41Å; H594-E598 PolarHBondContact O-N 3.39Å; H594-L646 HydrophobicContact CB-CD1 3.88Å; H594-L646 HydrophobicContact CB-CD2 3.86Å; H594-T906 VanDerWaalsContact CD2-CG2 3.42Å; H594-T906 WeakPolarHBondContact CD2-CG2 3.26Å; H594-T906 VanDerWaalsContact NE2-CB 3.33Å; H594-T906 WeakPolarHBondContact NE2-CB 3.48Å; H594-T906 WeakPolarHBondContact NE2-CG2 3.11Å; H594-E907 IonicContact CE1-OE1 3.68Å; H594-E907 PolarHBondContact CE1-OE1 3.35Å; H594-E907 VanDerWaalsContact CE1-OE1 3.28Å
595	R	77.1	Confident	79.8	Confident	88 Å²	88	87.1 Å²	87.1	33%	0.332	40%	0.396	S	S	.	.	H	α-helix	trans	-60.5	-27.6	174.7	-79.1	-169.7	-62.2	-100.5	-10	113.2	S591 W592 K597 D645	S591-R595 WeakPolarHBondContact O-CB 3.45Å; S591-R595 VanDerWaalsContact O-CG 3.29Å; S591-R595 WeakPolarHBondContact O-CG 3.46Å; S591-R595 PolarHBondContact O-N 3.26Å; S591-R595 PolarHBondContact OG-NH1 3.42Å; W592-R595 PolarHBondContact O-N 2.77Å; R595-K597 PolarHBondContact O-N 3.25Å; R595-D645 IonicContact NH1-OD2 3.39Å; R595-D645 PolarHBondContact NH1-OD2 3.07Å
596	L	74.2	Confident	80.4	Confident	119 Å²	119	89.5 Å²	89.5	62%	0.623	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-21.6	173.7	-66.2	172.5	0	0	0	113.3	W592 I593 H594	W592-L596 HydrophobicContact CD2-CD1 4.41Å; W592-L596 HydrophobicContact CE3-CD1 4.43Å; W592-L596 HydrophobicContact CH2-CD1 4.02Å; W592-L596 HydrophobicContact CZ2-CD1 4Å; W592-L596 HydrophobicContact CZ3-CD1 4.24Å; W592-L596 WeakPolarHBondContact O-CG 3.31Å; W592-L596 PolarHBondContact O-N 3.08Å; I593-L596 WeakPolarHBondContact O-CB 3.48Å; I593-L596 PolarHBondContact O-N 3.46Å; H594-L596 PolarHBondContact O-N 3.29Å
597	K	68.3	Low	81	Confident	177 Å²	177	86.7 Å²	86.7	77%	0.77	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	-14	-177.9	-63.6	-177.7	-179.4	178.6	0	113.4	H594 R595	H594-K597 PolarHBondContact O-N 3.41Å; R595-K597 PolarHBondContact O-N 3.25Å
598	E	67.4	Low	81.7	Confident	60 Å²	60	90.2 Å²	90.2	28%	0.28	41%	0.414	S	S	.	.	S	Bend	trans	-93.4	128.2	-169.4	-165.6	174.5	-159.3	0	0	111.5	H594 K653	H594-E598 PolarHBondContact O-N 3.39Å; E598-K653 WeakPolarHBondContact OE1-CE 3.45Å; E598-K653 IonicContact OE1-NZ 3.04Å; E598-K653 PolarHBondContact OE1-NZ 3.37Å
599	R	62.7	Low	82.3	Confident	221 Å²	221	83.4 Å²	83.4	83%	0.834	39%	0.389	S	S	*	.			trans	-68.4	133.8	170.9	-68.8	-177.6	-178.6	169.6	-0.2	109.8	T601	R599-T601 HydrophobicContact CB-CG2 4.43Å; R599-T601 PolarHBondContact O-N 3Å
600	H	64.9	Low	82.8	Confident	168 Å²	168	79.6 Å²	79.6	78%	0.778	38%	0.381	S	S	*	.			trans	-70.4	91.8	178.5	-62.9	-66.1	0	0	0	110.9
601	T	80.6	Confident	83.6	Confident	58 Å²	58	81.4 Å²	81.4	36%	0.356	41%	0.407	S	S	.	.			trans	-111.8	6.5	177.5	67.1	0	0	0	0	113.4	R599 K653	R599-T601 HydrophobicContact CB-CG2 4.43Å; R599-T601 PolarHBondContact O-N 3Å; T601-K653 WeakPolarHBondContact OG1-CE 3.17Å; T601-K653 PolarHBondContact OG1-NZ 2.96Å
602	L	89	Confident	84.4	Confident	22 Å²	22	81.4 Å²	81.4	12%	0.115	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	132.5	-179.9	-64.3	177.4	0	0	0	108.7	V604 Y617 I618 P619 R649 A652 K653	L602-V604 HydrophobicContact CB-CG2 4.3Å; L602-Y617 HydrophobicContact CD1-CD1 4.44Å; L602-I618 WeakPolarHBondContact CA-O 3.25Å; L602-P619 HydrophobicContact CD2-CB 4.06Å; L602-P619 HydrophobicContact CD2-CG 4Å; L602-R649 HydrophobicContact CD1-CB 4.06Å; L602-R649 HydrophobicContact CD1-CG 4.09Å; L602-A652 HydrophobicContact CD1-CB 4.05Å; L602-A652 HydrophobicContact CD2-CB 4.37Å; L602-K653 HydrophobicContact CD1-CG 3.92Å; L602-K653 HydrophobicContact CD2-CG 4.17Å; L602-K653 HydrophobicContact CG-CG 4.07Å
603	K	92.1	Very high	85.2	Confident	129 Å²	129	78 Å²	78	56%	0.561	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.3	130.3	162.9	177.6	-179.2	176	-172.2	0	108.3	E605 I618	K603-E605 IonicContact NZ-OE2 3.72Å; K603-I618 HydrophobicContact CB-CB 4.24Å; K603-I618 HydrophobicContact CD-CD1 4.38Å; K603-I618 PolarHBondContact N-O 2.92Å; K603-I618 PolarHBondContact O-N 3.35Å
604	V	93.2	Very high	86	Confident	48 Å²	48	75.8 Å²	75.8	29%	0.291	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	127.3	-179.9	-177.3	0	0	0	0	109.7	L602 R615 V616 Y617	L602-V604 HydrophobicContact CB-CG2 4.3Å; V604-R615 HydrophobicContact CG1-CG 3.52Å; V604-V616 VanDerWaalsContact CA-O 3.32Å; V604-V616 WeakPolarHBondContact CA-O 3.42Å; V604-Y617 HydrophobicContact CB-CD1 4.38Å; V604-Y617 HydrophobicContact CG1-CD1 4.03Å; V604-Y617 HydrophobicContact CG1-CE1 3.83Å; V604-Y617 HydrophobicContact CG2-CD1 3.46Å; V604-Y617 VanDerWaalsContact CG2-CD1 3.46Å; V604-Y617 HydrophobicContact CG2-CE1 3.88Å; V604-Y617 HydrophobicContact CG2-CG 4.38Å
605	E	94.8	Very high	87.1	Confident	39 Å²	39	75.6 Å²	75.6	18%	0.182	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	136.4	179	58.5	179.3	-129.8	0	0	111.4	K603 V607 R615 V616 I618 K693 Y694	K603-E605 IonicContact NZ-OE2 3.72Å; E605-V607 HydrophobicContact CB-CG1 4.34Å; E605-V607 HydrophobicContact CG-CG1 3.95Å; E605-V607 WeakPolarHBondContact OE1-CG1 3.41Å; E605-R615 WeakPolarHBondContact O-CA 3.43Å; E605-V616 HydrophobicContact CG-CB 4.02Å; E605-V616 PolarHBondContact N-O 3.36Å; E605-V616 PolarHBondContact O-N 3.35Å; E605-I618 HydrophobicContact CG-CD1 4.41Å; E605-K693 WeakPolarHBondContact OE1-CE 3.34Å; E605-K693 IonicContact OE1-NZ 3.45Å; E605-K693 PolarHBondContact OE1-NZ 3.28Å; E605-Y694 VanDerWaalsContact OE1-CE1 3.23Å; E605-Y694 WeakPolarHBondContact OE1-CE1 3.3Å; E605-Y694 PolarHBondContact OE1-OH 2.95Å
606	D	97.1	Very high	88	Confident	111 Å²	111	71.4 Å²	71.4	59%	0.594	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	127.2	169	-72.1	-29.5	0	0	0	108.5	C614 R615	D606-C614 WeakPolarHBondContact CA-O 3.35Å; D606-R615 WeakPolarHBondContact OD1-CB 3.44Å; D606-R615 WeakPolarHBondContact OD1-CG 3.47Å; D606-R615 IonicContact OD1-CZ 3.17Å; D606-R615 IonicContact OD1-NE 3.88Å; D606-R615 PolarHBondContact OD1-NE 3.29Å; D606-R615 IonicContact OD1-NH2 3.89Å; D606-R615 PolarHBondContact OD1-NH2 3.13Å; D606-R615 VanDerWaalsContact OD1-NH2 3.14Å; D606-R615 IonicContact OD2-CZ 3.12Å; D606-R615 IonicContact OD2-NE 2.77Å; D606-R615 IonicContact OD2-NH2 3.97Å; D606-R615 PolarHBondContact OD2-NH2 2.98Å
607	V	96.1	Very high	89	Confident	25 Å²	25	65.7 Å²	65.7	15%	0.152	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	169.6	-173.3	-61.9	0	0	0	0	110.7	E605 L609 C614 V616	E605-V607 HydrophobicContact CB-CG1 4.34Å; E605-V607 HydrophobicContact CG-CG1 3.95Å; E605-V607 WeakPolarHBondContact OE1-CG1 3.41Å; V607-L609 HydrophobicContact CG2-CD1 4.31Å; V607-L609 HydrophobicContact CG2-CD2 4.13Å; V607-L609 HydrophobicContact CG2-CG 3.94Å; V607-C614 HydrophobicContact CG2-CB 4.14Å; V607-C614 PolarHBondContact N-O 3.01Å; V607-C614 PolarHBondContact O-N 3.4Å; V607-C614 VanDerWaalsContact O-O 3.06Å; V607-V616 HydrophobicContact CG2-CG2 3.59Å
608	V	96.7	Very high	90.2	Very high	97 Å²	97	58.9 Å²	58.9	59%	0.588	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.7	120.8	171.5	-179.9	0	0	0	0	108	V612	V608-V612 WeakPolarHBondContact CA-O 3.26Å
609	L	94.6	Very high	91.4	Very high	7 Å²	7	56.3 Å²	56.3	4%	0.037	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	123.8	179.4	-59.2	-179.7	0	0	0	108.5	V607 G611 V612 C614 I660 V682 Y694	V607-L609 HydrophobicContact CG2-CD1 4.31Å; V607-L609 HydrophobicContact CG2-CD2 4.13Å; V607-L609 HydrophobicContact CG2-CG 3.94Å; L609-G611 PolarHBondContact O-N 3.01Å; L609-G611 VanDerWaalsContact O-N 3.17Å; L609-V612 PolarHBondContact N-O 2.92Å; L609-V612 PolarHBondContact O-N 3.17Å; L609-C614 HydrophobicContact CD1-CB 4.23Å; L609-C614 HydrophobicContact CG-CB 4.37Å; L609-I660 HydrophobicContact CD1-CD1 4.04Å; L609-I660 HydrophobicContact CD1-CG2 3.82Å; L609-V682 HydrophobicContact CB-CG1 4.31Å; L609-V682 HydrophobicContact CD1-CG1 4.36Å; L609-Y694 HydrophobicContact CD2-CE2 4.4Å
610	G	92.7	Very high	92.4	Very high	30 Å²	30	53 Å²	53	31%	0.309	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.2	27	-177.8	0	0	0	0	0	114.3	V612	G610-V612 VanDerWaalsContact C-N 3.32Å
611	G	95.5	Very high	93.3	Very high	67 Å²	67	49.2 Å²	49.2	69%	0.691	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.8	2.6	-175.6	0	0	0	0	0	115.2	L609	L609-G611 PolarHBondContact O-N 3.01Å; L609-G611 VanDerWaalsContact O-N 3.17Å
612	V	97.7	Very high	93.1	Very high	4 Å²	4	49.2 Å²	49.2	2%	0.024	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	131	-177.9	-176.3	0	0	0	0	110	V608 L609 G610 V662 D678 N681 V682	V608-V612 WeakPolarHBondContact CA-O 3.26Å; L609-V612 PolarHBondContact N-O 2.92Å; L609-V612 PolarHBondContact O-N 3.17Å; G610-V612 VanDerWaalsContact C-N 3.32Å; V612-V662 HydrophobicContact CG1-CG1 4.06Å; V612-D678 HydrophobicContact CG1-CB 4.1Å; V612-D678 HydrophobicContact CG2-CB 3.73Å; V612-N681 HydrophobicContact CG2-CB 4.31Å; V612-V682 HydrophobicContact CB-CG2 3.65Å; V612-V682 HydrophobicContact CG1-CG2 3.96Å; V612-V682 HydrophobicContact CG2-CG2 4.15Å
613	P	98.1	Very high	92.2	Very high	69 Å²	69	53.4 Å²	53.4	45%	0.448	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	139.1	174.3	-16.1	29	0	0	0	111.1	E663	P613-E663 HydrophobicContact CB-CB 4.03Å; P613-E663 HydrophobicContact CB-CG 4.47Å; P613-E663 WeakPolarHBondContact O-CB 3.11Å; P613-E663 PolarHBondContact O-N 2.86Å
614	C	98.1	Very high	91.3	Very high	5 Å²	5	49.2 Å²	49.2	3%	0.034	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	157.3	-179.6	-68.5	0	0	0	0	109.7	D606 V607 L609 I660 S661	D606-C614 WeakPolarHBondContact CA-O 3.35Å; V607-C614 HydrophobicContact CG2-CB 4.14Å; V607-C614 PolarHBondContact N-O 3.01Å; V607-C614 PolarHBondContact O-N 3.4Å; V607-C614 VanDerWaalsContact O-O 3.06Å; L609-C614 HydrophobicContact CD1-CB 4.23Å; L609-C614 HydrophobicContact CG-CB 4.37Å; C614-I660 HydrophobicContact CB-CG2 3.96Å; C614-S661 CarbonylContact C-O 3.58Å; C614-S661 WeakPolarHBondContact CA-O 3.22Å
615	R	97.3	Very high	91.1	Very high	43 Å²	43	48.1 Å²	48.1	16%	0.162	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	127.8	166	-179.3	170.6	-77.1	176.7	5	110.1	V604 E605 D606 Y617 V641 D645 S661	V604-R615 HydrophobicContact CG1-CG 3.52Å; E605-R615 WeakPolarHBondContact O-CA 3.43Å; D606-R615 WeakPolarHBondContact OD1-CB 3.44Å; D606-R615 WeakPolarHBondContact OD1-CG 3.47Å; D606-R615 IonicContact OD1-CZ 3.17Å; D606-R615 IonicContact OD1-NE 3.88Å; D606-R615 PolarHBondContact OD1-NE 3.29Å; D606-R615 IonicContact OD1-NH2 3.89Å; D606-R615 PolarHBondContact OD1-NH2 3.13Å; D606-R615 VanDerWaalsContact OD1-NH2 3.14Å; D606-R615 IonicContact OD2-CZ 3.12Å; D606-R615 IonicContact OD2-NE 2.77Å; D606-R615 IonicContact OD2-NH2 3.97Å; D606-R615 PolarHBondContact OD2-NH2 2.98Å; R615-Y617 HydrophobicContact CB-CE2 4.23Å; R615-Y617 VanDerWaalsContact CD-CZ 3.43Å; R615-Y617 WeakPolarHBondContact CD-OH 3.43Å; R615-Y617 HydrophobicContact CG-CD2 4.45Å; R615-Y617 HydrophobicContact CG-CE1 4.29Å; R615-Y617 HydrophobicContact CG-CE2 3.76Å; R615-V641 HydrophobicContact CB-CG1 3.33Å; R615-V641 HydrophobicContact CG-CG1 4.27Å; R615-D645 IonicContact NH1-OD1 3.07Å; R615-D645 PolarHBondContact NH1-OD1 3.32Å; R615-D645 VanDerWaalsContact NH1-OD1 3.15Å; R615-S661 PolarHBondContact N-O 3.46Å; R615-S661 PolarHBondContact O-N 2.7Å
616	V	96.4	Very high	91	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	128.4	-178.8	-171.6	0	0	0	0	109.6	V604 E605 V607 I618 V658 T659 I660 Y694	V604-V616 VanDerWaalsContact CA-O 3.32Å; V604-V616 WeakPolarHBondContact CA-O 3.42Å; E605-V616 HydrophobicContact CG-CB 4.02Å; E605-V616 PolarHBondContact N-O 3.36Å; E605-V616 PolarHBondContact O-N 3.35Å; V607-V616 HydrophobicContact CG2-CG2 3.59Å; V616-I618 HydrophobicContact CG1-CD1 4.25Å; V616-I618 HydrophobicContact CG1-CG1 3.76Å; V616-V658 HydrophobicContact CG1-CG1 3.66Å; V616-T659 CarbonylContact C-O 3.53Å; V616-T659 WeakPolarHBondContact CA-O 3.14Å; V616-I660 HydrophobicContact CG1-CG1 4.16Å; V616-I660 HydrophobicContact CG2-CG1 4.11Å; V616-I660 HydrophobicContact CG2-CG2 4.29Å; V616-Y694 HydrophobicContact CB-CE1 4.33Å; V616-Y694 HydrophobicContact CG1-CD1 4.12Å; V616-Y694 HydrophobicContact CG1-CE1 3.83Å; V616-Y694 HydrophobicContact CG2-CE1 4.37Å; V616-Y694 HydrophobicContact CG2-CE2 4.33Å
617	Y	95.2	Very high	91	Very high	0 Å²	0	41 Å²	41	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	116.3	175.8	-57.5	-91.8	0	0	0	108.5	L602 V604 R615 D645 T648 R649 V658 T659	L602-Y617 HydrophobicContact CD1-CD1 4.44Å; V604-Y617 HydrophobicContact CB-CD1 4.38Å; V604-Y617 HydrophobicContact CG1-CD1 4.03Å; V604-Y617 HydrophobicContact CG1-CE1 3.83Å; V604-Y617 HydrophobicContact CG2-CD1 3.46Å; V604-Y617 VanDerWaalsContact CG2-CD1 3.46Å; V604-Y617 HydrophobicContact CG2-CE1 3.88Å; V604-Y617 HydrophobicContact CG2-CG 4.38Å; R615-Y617 HydrophobicContact CB-CE2 4.23Å; R615-Y617 VanDerWaalsContact CD-CZ 3.43Å; R615-Y617 WeakPolarHBondContact CD-OH 3.43Å; R615-Y617 HydrophobicContact CG-CD2 4.45Å; R615-Y617 HydrophobicContact CG-CE1 4.29Å; R615-Y617 HydrophobicContact CG-CE2 3.76Å; Y617-D645 WeakPolarHBondContact CE1-OD1 3.37Å; Y617-D645 WeakPolarHBondContact OH-CA 3.06Å; Y617-D645 PolarHBondContact OH-OD1 3.27Å; Y617-T648 HydrophobicContact CE2-CG2 4.46Å; Y617-T648 WeakPolarHBondContact CE2-OG1 3.27Å; Y617-T648 PolarHBondContact OH-OG1 2.74Å; Y617-T648 VanDerWaalsContact OH-OG1 3.13Å; Y617-R649 HydrophobicContact CD1-CG 3.61Å; Y617-R649 HydrophobicContact CE1-CG 3.43Å; Y617-R649 VanDerWaalsContact CE1-CG 3.43Å; Y617-V658 WeakPolarHBondContact O-CA 3.33Å; Y617-T659 WeakPolarHBondContact CD2-O 3.44Å; Y617-T659 PolarHBondContact N-O 3.35Å; Y617-T659 PolarHBondContact O-N 2.77Å
618	I	94.1	Very high	91	Very high	33 Å²	33	39.8 Å²	39.8	17%	0.169	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	112.1	-172.7	-50.4	172.2	0	0	0	107.9	L602 K603 E605 V616 V658 Y694	L602-I618 WeakPolarHBondContact CA-O 3.25Å; K603-I618 HydrophobicContact CB-CB 4.24Å; K603-I618 HydrophobicContact CD-CD1 4.38Å; K603-I618 PolarHBondContact N-O 2.92Å; K603-I618 PolarHBondContact O-N 3.35Å; E605-I618 HydrophobicContact CG-CD1 4.41Å; V616-I618 HydrophobicContact CG1-CD1 4.25Å; V616-I618 HydrophobicContact CG1-CG1 3.76Å; I618-V658 HydrophobicContact CG2-CG2 4.5Å; I618-Y694 HydrophobicContact CD1-CD1 4.03Å; I618-Y694 HydrophobicContact CD1-CE1 3.98Å
619	P	91.8	Very high	91.1	Very high	6 Å²	6	35.2 Å²	35.2	4%	0.039	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	153.3	169.3	-19.2	30.8	0	0	0	112.3	L602 S621 P622 N656	L602-P619 HydrophobicContact CD2-CB 4.06Å; L602-P619 HydrophobicContact CD2-CG 4Å; P619-S621 PolarHBondContact O-N 2.72Å; P619-P622 HydrophobicContact CB-CG 4.43Å; P619-P622 WeakPolarHBondContact O-CD 3.14Å; P619-N656 WeakPolarHBondContact CB-OD1 3.39Å
620	E	85.3	Confident	91.3	Very high	153 Å²	153	35 Å²	35	72%	0.715	22%	0.223	S	C	*	.	S	Bend	trans	-61.6	-30.6	179.3	-70.8	176.2	-174.8	0	0	113
621	S	82.1	Confident	91.5	Very high	88 Å²	88	33.6 Å²	33.6	62%	0.615	21%	0.209	S	C	*	.	S	Bend	trans	-144.1	84.2	177.6	-62.3	0	0	0	0	109.7	P619 D623 N656	P619-S621 PolarHBondContact O-N 2.72Å; S621-D623 PolarHBondContact O-N 3.46Å; S621-N656 PolarHBondContact O-ND2 3.04Å; S621-N656 PolarHBondContact O-OD1 3.37Å
622	P	78	Confident	91.7	Very high	57 Å²	57	30.4 Å²	30.4	37%	0.37	18%	0.176	S	C	.	.			trans	-65.5	127	-179	-19.4	32.3	0	0	0	111.7	P619 T624 N656 V658	P619-P622 HydrophobicContact CB-CG 4.43Å; P619-P622 WeakPolarHBondContact O-CD 3.14Å; P622-T624 PolarHBondContact O-N 2.9Å; P622-N656 WeakPolarHBondContact CA-O 3.36Å; P622-V658 HydrophobicContact CG-CG2 4.4Å
623	D	70.3	Confident	91.6	Very high	111 Å²	111	30.2 Å²	30.2	59%	0.594	18%	0.175	S	C	*	.	S	Bend	trans	-71.7	-28	-166.5	-73.8	-28	0	0	0	114.9	S621 N656	S621-D623 PolarHBondContact O-N 3.46Å; D623-N656 PolarHBondContact N-O 3.31Å; D623-N656 PolarHBondContact OD1-ND2 2.7Å; D623-N656 WeakPolarHBondContact OD2-CB 3.38Å; D623-N656 PolarHBondContact OD2-ND2 3.08Å
624	T	72.7	Confident	91.3	Very high	41 Å²	41	27.6 Å²	27.6	25%	0.252	16%	0.16	S	C	.	.	S	Bend	trans	-135.6	-1.5	-157.8	53.5	0	0	0	0	115.6	P622 A626	P622-T624 PolarHBondContact O-N 2.9Å; T624-A626 PolarHBondContact O-N 3.04Å; T624-A626 VanDerWaalsContact OG1-CB 3.23Å; T624-A626 WeakPolarHBondContact OG1-CB 3.37Å; T624-A626 PolarHBondContact OG1-N 2.94Å
625	G	87.8	Confident	91.1	Very high	24 Å²	24	27.9 Å²	27.9	25%	0.247	16%	0.164	C	C	.	.	S	Bend	trans	59.3	9.3	-165.7	0	0	0	0	0	113.3	V696 N697	G625-V696 CarbonylContact O-C 3.58Å; G625-V696 VanDerWaalsContact O-CA 3.23Å; G625-V696 WeakPolarHBondContact O-CA 3.28Å; G625-N697 PolarHBondContact O-N 2.95Å
626	A	94.3	Very high	91.1	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.008	16%	0.156	C	C	.	.			trans	-77.4	153	177.6	0	0	0	0	0	110.8	T624 M657 V658 K700 M926	T624-A626 PolarHBondContact O-N 3.04Å; T624-A626 VanDerWaalsContact OG1-CB 3.23Å; T624-A626 WeakPolarHBondContact OG1-CB 3.37Å; T624-A626 PolarHBondContact OG1-N 2.94Å; A626-M657 HydrophobicContact CB-CE 4.09Å; A626-M657 HydrophobicContact CB-CG 4.02Å; A626-M657 HydrophobicContact CB-SD 3.73Å; A626-V658 PolarHBondContact O-N 3.38Å; A626-K700 VanDerWaalsContact CA-O 3.26Å; A626-K700 WeakPolarHBondContact CA-O 3.25Å; A626-K700 HydrophobicContact CB-CB 3.86Å; A626-K700 WeakPolarHBondContact CB-O 3.46Å; A626-M926 HydrophobicContact CB-CB 4.09Å; A626-M926 HydrophobicContact CB-CG 4.21Å; A626-M926 HydrophobicContact CB-SD 4.23Å
627	A	95.8	Very high	91	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	150.6	175.9	0	0	0	0	0	112.3	V658 V696 K700 I701 T702	A627-V658 CarbonylContact C-O 3.59Å; A627-V658 WeakPolarHBondContact CA-O 3.4Å; A627-V696 HydrophobicContact CB-CB 4.3Å; A627-V696 HydrophobicContact CB-CG1 3.51Å; A627-V696 HydrophobicContact CB-CG2 3.73Å; A627-K700 PolarHBondContact N-O 3.3Å; A627-I701 CarbonylContact O-C 3.59Å; A627-I701 WeakPolarHBondContact O-CA 3.45Å; A627-T702 PolarHBondContact O-N 2.91Å
628	I	97.3	Very high	90.8	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	124.5	173.9	-59.6	175.3	0	0	0	107.5	L651 T655 M657 V658 T659 I660 T702 I704 I922	I628-L651 HydrophobicContact CD1-CD2 4.29Å; I628-L651 HydrophobicContact CD1-CG 4.12Å; I628-L651 HydrophobicContact CG2-CD2 4.01Å; I628-T655 HydrophobicContact CD1-CG2 3.77Å; I628-T655 WeakPolarHBondContact CD1-OG1 3.2Å; I628-M657 HydrophobicContact CD1-CB 4.23Å; I628-M657 HydrophobicContact CD1-SD 4.06Å; I628-M657 HydrophobicContact CG1-CB 4.28Å; I628-M657 HydrophobicContact CG1-SD 4.06Å; I628-V658 PolarHBondContact N-O 2.8Å; I628-T659 HydrophobicContact CB-CG2 4.12Å; I628-T659 HydrophobicContact CG2-CG2 4.15Å; I628-T659 CarbonylContact O-C 3.34Å; I628-T659 VanDerWaalsContact O-CA 3.31Å; I628-T659 WeakPolarHBondContact O-CA 3.39Å; I628-I660 PolarHBondContact O-N 3.17Å; I628-T702 CarbonylContact C-O 3.46Å; I628-T702 WeakPolarHBondContact CA-O 3.49Å; I628-I704 HydrophobicContact CG2-CB 4.45Å; I628-I704 HydrophobicContact CG2-CG2 3.32Å; I628-I922 HydrophobicContact CD1-CD1 4.43Å; I628-I922 HydrophobicContact CD1-CG2 4.08Å; I628-I922 HydrophobicContact CG1-CG2 4.39Å
629	V	98	Very high	90.8	Very high	0 Å²	0	26 Å²	26	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	113.8	168.6	-178.3	0	0	0	0	108	I660 V662 V682 I683 L686 I701 T702 L703 I704	V629-I660 CarbonylContact C-O 3.58Å; V629-I660 WeakPolarHBondContact CA-O 3.46Å; V629-I660 HydrophobicContact CG2-CB 4.43Å; V629-V662 HydrophobicContact CG1-CG2 3.63Å; V629-V682 HydrophobicContact CG1-CG1 4.43Å; V629-I683 HydrophobicContact CB-CD1 3.71Å; V629-I683 HydrophobicContact CG1-CD1 3.83Å; V629-I683 HydrophobicContact CG1-CG1 4.46Å; V629-I683 HydrophobicContact CG2-CD1 3.58Å; V629-L686 HydrophobicContact CG2-CD2 3.63Å; V629-I701 HydrophobicContact CG2-CG2 4.32Å; V629-T702 PolarHBondContact N-O 3.13Å; V629-L703 HydrophobicContact CB-CD1 4Å; V629-L703 HydrophobicContact CG1-CD1 4.04Å; V629-I704 WeakPolarHBondContact O-CG2 3.45Å; V629-I704 PolarHBondContact O-N 3.25Å
630	F	98.4	Very high	90.8	Very high	2 Å²	2	26.7 Å²	26.7	1%	0.009	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	122.2	-175.4	-166.3	-74.7	0	0	0	110.7	H632 Y644 I647 T648 L651 T659 I660 S661 V662 I704	F630-H632 HydrophobicContact CE1-CB 4.4Å; F630-Y644 HydrophobicContact CD1-CD1 4.35Å; F630-Y644 AromaticContact CE1-CD1 3.32Å; F630-Y644 HydrophobicContact CE1-CD1 3.32Å; F630-Y644 AromaticContact CE1-CE1 3.68Å; F630-Y644 HydrophobicContact CE1-CE1 3.68Å; F630-Y644 HydrophobicContact CE1-CG 4.22Å; F630-Y644 AromaticContact CZ-CD1 3.73Å; F630-Y644 HydrophobicContact CZ-CD1 3.73Å; F630-Y644 AromaticContact CZ-CE1 3.89Å; F630-Y644 HydrophobicContact CZ-CE1 3.89Å; F630-I647 HydrophobicContact CE2-CG2 4.13Å; F630-I647 HydrophobicContact CZ-CG2 4.08Å; F630-T648 HydrophobicContact CB-CG2 4.13Å; F630-T648 HydrophobicContact CD1-CG2 3.85Å; F630-T648 HydrophobicContact CD2-CG2 4.18Å; F630-T648 HydrophobicContact CE1-CG2 4.37Å; F630-T648 HydrophobicContact CG-CG2 3.78Å; F630-L651 HydrophobicContact CD2-CD2 3.79Å; F630-L651 HydrophobicContact CE2-CD2 4.19Å; F630-T659 HydrophobicContact CB-CG2 4.46Å; F630-I660 PolarHBondContact N-O 2.85Å; F630-S661 WeakPolarHBondContact O-CA 3.42Å; F630-V662 PolarHBondContact O-N 3.22Å; F630-I704 CarbonylContact C-O 3.55Å; F630-I704 WeakPolarHBondContact CA-O 3.45Å; F630-I704 HydrophobicContact CB-CG2 3.92Å; F630-I704 HydrophobicContact CD2-CD1 4.38Å; F630-I704 HydrophobicContact CD2-CG1 4.3Å; F630-I704 HydrophobicContact CD2-CG2 3.49Å; F630-I704 VanDerWaalsContact CD2-CG2 3.49Å; F630-I704 HydrophobicContact CE2-CD1 4.29Å; F630-I704 HydrophobicContact CE2-CG1 4.29Å; F630-I704 HydrophobicContact CE2-CG2 4.29Å; F630-I704 HydrophobicContact CG-CG2 4.01Å
631	I	98.6	Very high	91.3	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.005	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	118.1	175.1	-53.6	171.7	0	0	0	108.3	V662 Y664 C679 L703 I704 G705 D706 G709 L712 A713	I631-V662 HydrophobicContact CG1-CG2 4.48Å; I631-Y664 HydrophobicContact CG2-CD1 3.84Å; I631-Y664 HydrophobicContact CG2-CE1 3.66Å; I631-C679 HydrophobicContact CD1-CB 3.82Å; I631-L703 HydrophobicContact CD1-CD1 3.69Å; I631-L703 HydrophobicContact CD1-CG 4.43Å; I631-L703 HydrophobicContact CG1-CD1 4.13Å; I631-I704 PolarHBondContact N-O 2.93Å; I631-G705 WeakPolarHBondContact O-CA 3.38Å; I631-D706 PolarHBondContact O-N 2.69Å; I631-G709 WeakPolarHBondContact O-CA 3.42Å; I631-L712 HydrophobicContact CD1-CB 4.11Å; I631-L712 HydrophobicContact CG2-CB 3.96Å; I631-L712 HydrophobicContact CG2-CD1 3.65Å; I631-L712 HydrophobicContact CG2-CG 4.42Å; I631-A713 HydrophobicContact CD1-CB 4.31Å
632	H	97.8	Very high	91.7	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	11%	0.107	C	C	.	.			trans	-74.6	152.2	-175.9	70.1	77.1	0	0	0	113.4	F630 Y644 V662 E663 Y664 G709	F630-H632 HydrophobicContact CE1-CB 4.4Å; H632-Y644 HydrophobicContact CB-CD1 4.07Å; H632-Y644 HydrophobicContact CB-CD2 3.44Å; H632-Y644 VanDerWaalsContact CB-CD2 3.44Å; H632-Y644 HydrophobicContact CB-CE1 4.15Å; H632-Y644 HydrophobicContact CB-CE2 3.52Å; H632-Y644 HydrophobicContact CB-CG 3.72Å; H632-V662 PolarHBondContact CD2-O 2.9Å; H632-V662 VanDerWaalsContact CD2-O 3.24Å; H632-E663 IonicContact NE2-OE1 2.7Å; H632-Y664 AromaticContact CD2-CE1 3.77Å; H632-Y664 AromaticContact CE1-CE1 3.48Å; H632-Y664 VanDerWaalsContact CE1-CE1 3.48Å; H632-Y664 WeakPolarHBondContact CE1-CE1 3.43Å; H632-Y664 AromaticContact CE1-CZ 3.48Å; H632-Y664 VanDerWaalsContact CE1-CZ 3.48Å; H632-Y664 PolarHBondContact CE1-OH 2.8Å; H632-Y664 AromaticContact CG-CE1 3.91Å; H632-Y664 AromaticContact ND1-CE1 3.75Å; H632-Y664 AromaticContact ND1-CZ 3.85Å; H632-Y664 PolarHBondContact ND1-OH 3.11Å; H632-Y664 AromaticContact NE2-CD1 3.92Å; H632-Y664 AromaticContact NE2-CE1 3.51Å; H632-Y664 AromaticContact NE2-CZ 3.93Å; H632-Y664 WeakPolarHBondContact O-CE1 3.49Å; H632-Y664 PolarHBondContact O-OH 2.77Å; H632-G709 WeakPolarHBondContact O-CA 3.2Å; H632-G709 PolarHBondContact O-N 3.4Å
633	G	96	Very high	92.3	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	9%	0.094	C	C	.	.			trans	-76.4	-161.5	169.2	0	0	0	0	0	113.9	Y644 D706	G633-Y644 WeakPolarHBondContact CA-OH 3.38Å; G633-Y644 PolarHBondContact N-OH 2.94Å; G633-Y644 VanDerWaalsContact N-OH 3.14Å; G633-D706 WeakPolarHBondContact CA-O 3.49Å; G633-D706 PolarHBondContact N-O 3.31Å; G633-D706 PolarHBondContact N-OD1 2.9Å
634	G	92.2	Very high	93.4	Very high	14 Å²	14	9.2 Å²	9.2	14%	0.144	7%	0.066	C	C	.	.	S	Bend	trans	111.8	24	-177.1	0	0	0	0	0	114.2	F636 V637 L638	G634-F636 PolarHBondContact O-N 3.48Å; G634-V637 PolarHBondContact O-N 3.27Å; G634-V637 VanDerWaalsContact O-N 3.07Å; G634-L638 WeakPolarHBondContact O-CB 3.37Å; G634-L638 PolarHBondContact O-N 3.26Å
635	G	93.6	Very high	94.3	Very high	11 Å²	11	7.3 Å²	7.3	11%	0.113	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	61	29.7	174.1	0	0	0	0	0	113.9	V637 W770	G635-V637 WeakPolarHBondContact O-CG2 3.34Å; G635-V637 PolarHBondContact O-N 2.99Å; G635-W770 WeakPolarHBondContact O-CB 3.44Å
636	F	96.8	Very high	94.4	Very high	1 Å²	1	7.1 Å²	7.1	0%	0.004	5%	0.048	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	0.5	-174.2	-39.3	-82	0	0	0	115.3	G634 L666 A667 A708 N711 L712 L738 F741 Y774	G634-F636 PolarHBondContact O-N 3.48Å; F636-L666 WeakPolarHBondContact O-CA 3.15Å; F636-A667 PolarHBondContact O-N 3.37Å; F636-A708 HydrophobicContact CD1-CB 3.8Å; F636-A708 HydrophobicContact CD2-CB 4.02Å; F636-A708 HydrophobicContact CE1-CB 3.68Å; F636-A708 WeakPolarHBondContact CE1-O 3.47Å; F636-A708 HydrophobicContact CE2-CB 3.9Å; F636-A708 HydrophobicContact CG-CB 3.97Å; F636-A708 HydrophobicContact CZ-CB 3.72Å; F636-N711 HydrophobicContact CE1-CB 4.03Å; F636-N711 HydrophobicContact CZ-CB 3.78Å; F636-L712 HydrophobicContact CD1-CD1 4.35Å; F636-L712 HydrophobicContact CD1-CD2 4.31Å; F636-L712 HydrophobicContact CD1-CG 4.32Å; F636-L712 HydrophobicContact CE1-CD1 4.47Å; F636-L712 HydrophobicContact CE1-CD2 4.05Å; F636-L712 HydrophobicContact CE1-CG 4Å; F636-L738 HydrophobicContact CE2-CD2 3.96Å; F636-L738 HydrophobicContact CZ-CD2 4.49Å; F636-F741 HydrophobicContact CE2-CZ 4.15Å; F636-F741 HydrophobicContact CZ-CZ 4.45Å; F636-Y774 HydrophobicContact CB-CD1 4.49Å; F636-Y774 HydrophobicContact CB-CD2 3.41Å; F636-Y774 VanDerWaalsContact CB-CD2 3.41Å; F636-Y774 HydrophobicContact CB-CE2 3.82Å; F636-Y774 HydrophobicContact CB-CG 3.77Å; F636-Y774 HydrophobicContact CD1-CD1 4.37Å; F636-Y774 HydrophobicContact CD1-CD2 4.19Å; F636-Y774 HydrophobicContact CD1-CE1 4.01Å; F636-Y774 AromaticContact CD1-CE2 3.85Å; F636-Y774 HydrophobicContact CD1-CE2 3.85Å; F636-Y774 HydrophobicContact CD1-CG 4.42Å; F636-Y774 AromaticContact CD1-CZ 3.7Å; F636-Y774 AromaticContact CD2-CD1 3.59Å; F636-Y774 HydrophobicContact CD2-CD1 3.59Å; F636-Y774 HydrophobicContact CD2-CD2 4.09Å; F636-Y774 HydrophobicContact CD2-CE1 4.01Å; F636-Y774 HydrophobicContact CD2-CE2 4.48Å; F636-Y774 AromaticContact CD2-CG 3.6Å; F636-Y774 HydrophobicContact CD2-CG 3.6Å; F636-Y774 AromaticContact CE1-CE1 3.99Å; F636-Y774 HydrophobicContact CE1-CE1 3.99Å; F636-Y774 AromaticContact CE1-CZ 3.97Å; F636-Y774 AromaticContact CE2-CD1 3.81Å; F636-Y774 HydrophobicContact CE2-CD1 3.81Å; F636-Y774 AromaticContact CE2-CE1 3.99Å; F636-Y774 HydrophobicContact CE2-CE1 3.99Å; F636-Y774 HydrophobicContact CE2-CG 4.3Å; F636-Y774 AromaticContact CG-CD1 3.91Å; F636-Y774 HydrophobicContact CG-CD1 3.91Å; F636-Y774 AromaticContact CG-CD2 3.65Å; F636-Y774 HydrophobicContact CG-CD2 3.65Å; F636-Y774 HydrophobicContact CG-CE1 4.02Å; F636-Y774 AromaticContact CG-CE2 3.8Å; F636-Y774 HydrophobicContact CG-CE2 3.8Å; F636-Y774 AromaticContact CG-CG 3.68Å; F636-Y774 HydrophobicContact CG-CG 3.68Å; F636-Y774 AromaticContact CG-CZ 3.95Å; F636-Y774 HydrophobicContact CZ-CD1 4.29Å; F636-Y774 AromaticContact CZ-CE1 3.98Å; F636-Y774 HydrophobicContact CZ-CE1 3.98Å
637	V	95.1	Very high	94.3	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	5%	0.049	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.6	-29.8	-170	174.3	0	0	0	0	112.1	V576 R580 G634 G635 A667 W770 L773	V576-V637 HydrophobicContact CG1-CG1 3.82Å; V576-V637 HydrophobicContact CG2-CG1 4.47Å; R580-V637 VanDerWaalsContact CZ-O 3.27Å; R580-V637 PolarHBondContact NE-O 3.07Å; R580-V637 PolarHBondContact NH2-O 2.95Å; G634-V637 PolarHBondContact O-N 3.27Å; G634-V637 VanDerWaalsContact O-N 3.07Å; G635-V637 WeakPolarHBondContact O-CG2 3.34Å; G635-V637 PolarHBondContact O-N 2.99Å; V637-A667 VanDerWaalsContact CA-O 3.31Å; V637-A667 WeakPolarHBondContact CA-O 3.43Å; V637-A667 WeakPolarHBondContact CG1-O 3.36Å; V637-A667 HydrophobicContact CG2-CB 3.96Å; V637-A667 WeakPolarHBondContact CG2-O 3.41Å; V637-W770 HydrophobicContact CB-CD2 4.44Å; V637-W770 HydrophobicContact CB-CE3 3.86Å; V637-W770 HydrophobicContact CB-CZ3 4.49Å; V637-W770 HydrophobicContact CG1-CE3 3.61Å; V637-W770 HydrophobicContact CG1-CZ3 3.76Å; V637-W770 HydrophobicContact CG2-CB 4.38Å; V637-W770 HydrophobicContact CG2-CE3 4.1Å; V637-L773 HydrophobicContact CG2-CB 4Å
638	L	91.7	Very high	94.2	Very high	18 Å²	18	7.4 Å²	7.4	9%	0.094	5%	0.049	C	C	.	.	S	Bend	trans	-118.7	175.1	-171.7	-55.9	178.4	0	0	0	111.9	T579 R580 G634 W770	T579-L638 HydrophobicContact CG2-CD1 3.74Å; T579-L638 HydrophobicContact CG2-CD2 3.8Å; T579-L638 HydrophobicContact CG2-CG 4.45Å; R580-L638 HydrophobicContact CG-CD2 3.74Å; G634-L638 WeakPolarHBondContact O-CB 3.37Å; G634-L638 PolarHBondContact O-N 3.26Å; L638-W770 HydrophobicContact CD1-CD2 4.48Å; L638-W770 HydrophobicContact CD1-CH2 4.23Å; L638-W770 HydrophobicContact CD1-CZ2 3.69Å; L638-W770 HydrophobicContact CD2-CH2 4.36Å; L638-W770 HydrophobicContact CG-CZ2 4.4Å
639	L	92.6	Very high	94	Very high	18 Å²	18	8.8 Å²	8.8	9%	0.094	5%	0.054	C	C	.	.			trans	60.5	-179.3	-179.8	-52.7	176.1	0	0	0	112.6	V583 H584 Y644 L666	V583-L639 HydrophobicContact CG1-CD2 3.49Å; V583-L639 VanDerWaalsContact CG1-CD2 3.49Å; H584-L639 WeakPolarHBondContact NE2-CA 3.27Å; H584-L639 PolarHBondContact NE2-N 2.85Å; H584-L639 PolarHBondContact NE2-O 2.96Å; L639-Y644 HydrophobicContact CB-CD2 4.33Å; L639-Y644 HydrophobicContact CB-CE2 3.91Å; L639-Y644 HydrophobicContact CD1-CE2 3.53Å; L639-Y644 HydrophobicContact CG-CE2 4.28Å; L639-L666 WeakPolarHBondContact O-CD1 3.27Å
640	N	93.6	Very high	93.7	Very high	21 Å²	21	10.4 Å²	10.4	11%	0.112	6%	0.063	C	C	.	.			trans	-172.4	178.1	-176.5	52.7	47	0	0	0	108.8	H584 A642 S643 Y644 E663	H584-N640 PolarHBondContact CE1-ND2 2.72Å; H584-N640 PolarHBondContact ND1-ND2 3.2Å; N640-A642 PolarHBondContact O-N 2.77Å; N640-A642 WeakPolarHBondContact OD1-CA 2.99Å; N640-A642 WeakPolarHBondContact OD1-CB 3.43Å; N640-A642 PolarHBondContact OD1-N 2.96Å; N640-A642 VanDerWaalsContact OD1-N 3.08Å; N640-S643 WeakPolarHBondContact O-CB 3.28Å; N640-S643 PolarHBondContact O-N 3.01Å; N640-S643 VanDerWaalsContact O-N 3.11Å; N640-S643 PolarHBondContact OD1-N 3.06Å; N640-Y644 PolarHBondContact O-N 3.45Å; N640-E663 WeakPolarHBondContact CA-OE1 3.29Å; N640-E663 WeakPolarHBondContact CB-OE1 3.28Å; N640-E663 WeakPolarHBondContact CB-OE2 3.42Å
641	V	94.5	Very high	93.5	Very high	5 Å²	5	10.4 Å²	10.4	3%	0.03	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-35.1	178.1	171.2	0	0	0	0	112.1	R615 Y644 D645 E663	R615-V641 HydrophobicContact CB-CG1 3.33Å; R615-V641 HydrophobicContact CG-CG1 4.27Å; V641-Y644 PolarHBondContact O-N 2.64Å; V641-D645 PolarHBondContact O-N 3.31Å; V641-D645 VanDerWaalsContact O-N 3.15Å; V641-E663 VanDerWaalsContact CB-OE2 3.25Å; V641-E663 WeakPolarHBondContact CB-OE2 3.36Å; V641-E663 HydrophobicContact CG2-CB 3.62Å; V641-E663 HydrophobicContact CG2-CG 4.39Å; V641-E663 WeakPolarHBondContact CG2-OE2 3.3Å; V641-E663 PolarHBondContact N-OE2 3.34Å
642	A	91.4	Very high	93.3	Very high	21 Å²	21	10.4 Å²	10.4	17%	0.174	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-34.2	177.7	0	0	0	0	0	112.8	R588 N640 Y644 D645	R588-A642 HydrophobicContact CG-CB 4.5Å; N640-A642 PolarHBondContact O-N 2.77Å; N640-A642 WeakPolarHBondContact OD1-CA 2.99Å; N640-A642 WeakPolarHBondContact OD1-CB 3.43Å; N640-A642 PolarHBondContact OD1-N 2.96Å; N640-A642 VanDerWaalsContact OD1-N 3.08Å; A642-Y644 VanDerWaalsContact C-N 3.32Å; A642-D645 WeakPolarHBondContact O-CB 3.48Å; A642-D645 PolarHBondContact O-N 3.29Å
643	S	90.1	Very high	93	Very high	14 Å²	14	13.6 Å²	13.6	10%	0.098	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-28.8	174.1	-76.3	0	0	0	0	112.9	C587 N640	C587-S643 WeakPolarHBondContact CB-OG 3.31Å; N640-S643 WeakPolarHBondContact O-CB 3.28Å; N640-S643 PolarHBondContact O-N 3.01Å; N640-S643 VanDerWaalsContact O-N 3.11Å; N640-S643 PolarHBondContact OD1-N 3.06Å
644	Y	93.3	Very high	92.8	Very high	2 Å²	2	14.4 Å²	14.4	1%	0.008	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	5.7	178.9	-85.6	-103.5	0	0	0	114	F630 H632 G633 L639 N640 V641 A642 L646 I647 T648 D706	F630-Y644 HydrophobicContact CD1-CD1 4.35Å; F630-Y644 AromaticContact CE1-CD1 3.32Å; F630-Y644 HydrophobicContact CE1-CD1 3.32Å; F630-Y644 AromaticContact CE1-CE1 3.68Å; F630-Y644 HydrophobicContact CE1-CE1 3.68Å; F630-Y644 HydrophobicContact CE1-CG 4.22Å; F630-Y644 AromaticContact CZ-CD1 3.73Å; F630-Y644 HydrophobicContact CZ-CD1 3.73Å; F630-Y644 AromaticContact CZ-CE1 3.89Å; F630-Y644 HydrophobicContact CZ-CE1 3.89Å; H632-Y644 HydrophobicContact CB-CD1 4.07Å; H632-Y644 HydrophobicContact CB-CD2 3.44Å; H632-Y644 VanDerWaalsContact CB-CD2 3.44Å; H632-Y644 HydrophobicContact CB-CE1 4.15Å; H632-Y644 HydrophobicContact CB-CE2 3.52Å; H632-Y644 HydrophobicContact CB-CG 3.72Å; G633-Y644 WeakPolarHBondContact CA-OH 3.38Å; G633-Y644 PolarHBondContact N-OH 2.94Å; G633-Y644 VanDerWaalsContact N-OH 3.14Å; L639-Y644 HydrophobicContact CB-CD2 4.33Å; L639-Y644 HydrophobicContact CB-CE2 3.91Å; L639-Y644 HydrophobicContact CD1-CE2 3.53Å; L639-Y644 HydrophobicContact CG-CE2 4.28Å; N640-Y644 PolarHBondContact O-N 3.45Å; V641-Y644 PolarHBondContact O-N 2.64Å; A642-Y644 VanDerWaalsContact C-N 3.32Å; Y644-L646 VanDerWaalsContact C-N 3.31Å; Y644-L646 PolarHBondContact O-N 3.4Å; Y644-I647 HydrophobicContact CD1-CB 4.36Å; Y644-I647 HydrophobicContact CD1-CD1 3.47Å; Y644-I647 VanDerWaalsContact CD1-CD1 3.47Å; Y644-I647 HydrophobicContact CE1-CD1 3.65Å; Y644-I647 HydrophobicContact CG-CD1 4.24Å; Y644-I647 PolarHBondContact O-N 3.25Å; Y644-T648 WeakPolarHBondContact O-CG2 3.33Å; Y644-T648 PolarHBondContact O-N 3.42Å; Y644-T648 PolarHBondContact O-OG1 2.87Å; Y644-D706 WeakPolarHBondContact CE1-OD1 3.46Å; Y644-D706 VanDerWaalsContact CZ-OD1 3.28Å; Y644-D706 PolarHBondContact OH-OD1 3.4Å; Y644-D706 PolarHBondContact OH-OD2 3.43Å
645	D	91.4	Very high	92.9	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-56.8	-40.7	-173.6	-174.8	69.9	0	0	0	112.9	R595 R615 Y617 V641 A642 T648 R649	R595-D645 IonicContact NH1-OD2 3.39Å; R595-D645 PolarHBondContact NH1-OD2 3.07Å; R615-D645 IonicContact NH1-OD1 3.07Å; R615-D645 PolarHBondContact NH1-OD1 3.32Å; R615-D645 VanDerWaalsContact NH1-OD1 3.15Å; Y617-D645 WeakPolarHBondContact CE1-OD1 3.37Å; Y617-D645 WeakPolarHBondContact OH-CA 3.06Å; Y617-D645 PolarHBondContact OH-OD1 3.27Å; V641-D645 PolarHBondContact O-N 3.31Å; V641-D645 VanDerWaalsContact O-N 3.15Å; A642-D645 WeakPolarHBondContact O-CB 3.48Å; A642-D645 PolarHBondContact O-N 3.29Å; D645-T648 WeakPolarHBondContact CA-OG1 3.42Å; D645-T648 PolarHBondContact O-OG1 3.2Å; D645-T648 VanDerWaalsContact O-OG1 3.13Å; D645-R649 VanDerWaalsContact CG-NE 3.25Å; D645-R649 WeakPolarHBondContact O-CB 3.41Å; D645-R649 WeakPolarHBondContact O-CD 3.33Å; D645-R649 WeakPolarHBondContact O-CG 3.35Å; D645-R649 PolarHBondContact O-N 2.87Å; D645-R649 IonicContact OD1-CZ 3.03Å; D645-R649 IonicContact OD1-NE 2.74Å; D645-R649 PolarHBondContact OD1-NE 2.78Å; D645-R649 IonicContact OD1-NH2 2.64Å; D645-R649 PolarHBondContact OD1-NH2 3.16Å; D645-R649 IonicContact OD2-CZ 3.37Å; D645-R649 IonicContact OD2-NE 3.02Å; D645-R649 PolarHBondContact OD2-NE 2.74Å; D645-R649 IonicContact OD2-NH2 2.87Å; D645-R649 PolarHBondContact OD2-NH2 3.03Å
646	L	90	Very high	92.9	Very high	21 Å²	21	15.1 Å²	15.1	11%	0.11	8%	0.08	C	C	.	.	H	α-helix	trans	-71.6	-42.2	179.5	-65.3	-178.7	0	0	0	112.8	H594 Y644 L650 T906	H594-L646 HydrophobicContact CB-CD1 3.88Å; H594-L646 HydrophobicContact CB-CD2 3.86Å; Y644-L646 VanDerWaalsContact C-N 3.31Å; Y644-L646 PolarHBondContact O-N 3.4Å; L646-L650 WeakPolarHBondContact O-CB 3.41Å; L646-L650 PolarHBondContact O-N 2.93Å; L646-T906 HydrophobicContact CD1-CG2 4.08Å
647	I	92.2	Very high	92.8	Very high	6 Å²	6	15.1 Å²	15.1	3%	0.031	8%	0.08	C	C	.	.	H	α-helix	trans	-61.7	-48.4	178.8	-66.1	161.5	0	0	0	109.8	F630 Y644 L650 L651 L902 N903 H905 I915	F630-I647 HydrophobicContact CE2-CG2 4.13Å; F630-I647 HydrophobicContact CZ-CG2 4.08Å; Y644-I647 HydrophobicContact CD1-CB 4.36Å; Y644-I647 HydrophobicContact CD1-CD1 3.47Å; Y644-I647 VanDerWaalsContact CD1-CD1 3.47Å; Y644-I647 HydrophobicContact CE1-CD1 3.65Å; Y644-I647 HydrophobicContact CG-CD1 4.24Å; Y644-I647 PolarHBondContact O-N 3.25Å; I647-L650 PolarHBondContact O-N 2.82Å; I647-L651 WeakPolarHBondContact O-CB 3.39Å; I647-L651 PolarHBondContact O-N 2.67Å; I647-L902 HydrophobicContact CD1-CB 4.28Å; I647-L902 WeakPolarHBondContact CG1-O 3.35Å; I647-N903 HydrophobicContact CD1-CB 4.48Å; I647-H905 PolarHBondContact N-CE1 3.39Å; I647-I915 HydrophobicContact CB-CD1 4.44Å; I647-I915 HydrophobicContact CG1-CD1 4.3Å; I647-I915 HydrophobicContact CG2-CD1 4Å
648	T	94.5	Very high	92.8	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-68.9	-37.9	-176.6	49.1	0	0	0	0	111.9	Y617 F630 Y644 D645 L651 A652	Y617-T648 HydrophobicContact CE2-CG2 4.46Å; Y617-T648 WeakPolarHBondContact CE2-OG1 3.27Å; Y617-T648 PolarHBondContact OH-OG1 2.74Å; Y617-T648 VanDerWaalsContact OH-OG1 3.13Å; F630-T648 HydrophobicContact CB-CG2 4.13Å; F630-T648 HydrophobicContact CD1-CG2 3.85Å; F630-T648 HydrophobicContact CD2-CG2 4.18Å; F630-T648 HydrophobicContact CE1-CG2 4.37Å; F630-T648 HydrophobicContact CG-CG2 3.78Å; Y644-T648 WeakPolarHBondContact O-CG2 3.33Å; Y644-T648 PolarHBondContact O-N 3.42Å; Y644-T648 PolarHBondContact O-OG1 2.87Å; D645-T648 WeakPolarHBondContact CA-OG1 3.42Å; D645-T648 PolarHBondContact O-OG1 3.2Å; D645-T648 VanDerWaalsContact O-OG1 3.13Å; T648-L651 PolarHBondContact O-N 2.98Å; T648-A652 WeakPolarHBondContact O-CB 3.39Å; T648-A652 PolarHBondContact O-N 3.41Å
649	R	92.6	Very high	93.1	Very high	30 Å²	30	14.5 Å²	14.5	11%	0.113	8%	0.077	C	C	.	.	H	α-helix	trans	-58.6	-50.2	168.4	-76.8	172.7	-168.4	-72.5	-14.5	112	L602 Y617 D645 L651 A652 K653	L602-R649 HydrophobicContact CD1-CB 4.06Å; L602-R649 HydrophobicContact CD1-CG 4.09Å; Y617-R649 HydrophobicContact CD1-CG 3.61Å; Y617-R649 HydrophobicContact CE1-CG 3.43Å; Y617-R649 VanDerWaalsContact CE1-CG 3.43Å; D645-R649 VanDerWaalsContact CG-NE 3.25Å; D645-R649 WeakPolarHBondContact O-CB 3.41Å; D645-R649 WeakPolarHBondContact O-CD 3.33Å; D645-R649 WeakPolarHBondContact O-CG 3.35Å; D645-R649 PolarHBondContact O-N 2.87Å; D645-R649 IonicContact OD1-CZ 3.03Å; D645-R649 IonicContact OD1-NE 2.74Å; D645-R649 PolarHBondContact OD1-NE 2.78Å; D645-R649 IonicContact OD1-NH2 2.64Å; D645-R649 PolarHBondContact OD1-NH2 3.16Å; D645-R649 IonicContact OD2-CZ 3.37Å; D645-R649 IonicContact OD2-NE 3.02Å; D645-R649 PolarHBondContact OD2-NE 2.74Å; D645-R649 IonicContact OD2-NH2 2.87Å; D645-R649 PolarHBondContact OD2-NH2 3.03Å; R649-L651 VanDerWaalsContact C-N 3.32Å; R649-L651 PolarHBondContact O-N 2.99Å; R649-A652 PolarHBondContact O-N 2.93Å; R649-K653 WeakPolarHBondContact O-CG 3.49Å; R649-K653 PolarHBondContact O-N 3.2Å
650	L	91.4	Very high	93.3	Very high	33 Å²	33	13.7 Å²	13.7	17%	0.173	7%	0.072	C	C	.	.	H	α-helix	trans	-62.6	-42.7	-178.8	-179.3	59.2	0	0	0	110.8	L646 I647 K653 V654 H905 I915	L646-L650 WeakPolarHBondContact O-CB 3.41Å; L646-L650 PolarHBondContact O-N 2.93Å; I647-L650 PolarHBondContact O-N 2.82Å; L650-K653 PolarHBondContact O-N 2.85Å; L650-V654 HydrophobicContact CD1-CG2 3.91Å; L650-V654 HydrophobicContact CG-CG2 4.24Å; L650-V654 WeakPolarHBondContact O-CB 3.38Å; L650-V654 VanDerWaalsContact O-CG2 3.29Å; L650-V654 WeakPolarHBondContact O-CG2 3.26Å; L650-V654 PolarHBondContact O-N 3.16Å; L650-H905 VanDerWaalsContact CD2-CD2 3.46Å; L650-H905 WeakPolarHBondContact CD2-CD2 3.49Å; L650-I915 HydrophobicContact CB-CG2 4.36Å; L650-I915 HydrophobicContact CD2-CB 4.12Å; L650-I915 HydrophobicContact CD2-CD1 3.95Å; L650-I915 HydrophobicContact CD2-CG2 3.81Å; L650-I915 HydrophobicContact CG-CG2 3.8Å
651	L	94.4	Very high	93.5	Very high	3 Å²	3	12.7 Å²	12.7	2%	0.016	7%	0.067	C	C	.	.	H	α-helix	trans	-61.4	-46	176.5	-172.3	64.3	0	0	0	111.7	I628 F630 I647 T648 R649 K653 V654 T655 I704 I922	I628-L651 HydrophobicContact CD1-CD2 4.29Å; I628-L651 HydrophobicContact CD1-CG 4.12Å; I628-L651 HydrophobicContact CG2-CD2 4.01Å; F630-L651 HydrophobicContact CD2-CD2 3.79Å; F630-L651 HydrophobicContact CE2-CD2 4.19Å; I647-L651 WeakPolarHBondContact O-CB 3.39Å; I647-L651 PolarHBondContact O-N 2.67Å; T648-L651 PolarHBondContact O-N 2.98Å; R649-L651 VanDerWaalsContact C-N 3.32Å; R649-L651 PolarHBondContact O-N 2.99Å; L651-K653 VanDerWaalsContact C-N 3.29Å; L651-K653 PolarHBondContact O-N 3.22Å; L651-V654 PolarHBondContact O-N 3.28Å; L651-T655 HydrophobicContact CD1-CG2 4.04Å; L651-T655 HydrophobicContact CG-CG2 4.48Å; L651-T655 WeakPolarHBondContact O-CB 3.4Å; L651-T655 WeakPolarHBondContact O-CG2 3.41Å; L651-T655 PolarHBondContact O-N 3.12Å; L651-T655 PolarHBondContact O-OG1 2.7Å; L651-I704 HydrophobicContact CD2-CD1 3.95Å; L651-I704 HydrophobicContact CD2-CG2 4.38Å; L651-I922 HydrophobicContact CD1-CD1 4.27Å
652	A	94.5	Very high	93.7	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-59.3	-39.5	175.7	0	0	0	0	0	112	L602 T648 R649 N656 M657 T659	L602-A652 HydrophobicContact CD1-CB 4.05Å; L602-A652 HydrophobicContact CD2-CB 4.37Å; T648-A652 WeakPolarHBondContact O-CB 3.39Å; T648-A652 PolarHBondContact O-N 3.41Å; R649-A652 PolarHBondContact O-N 2.93Å; A652-N656 WeakPolarHBondContact O-CA 3.19Å; A652-N656 PolarHBondContact O-N 2.97Å; A652-M657 PolarHBondContact O-N 3.39Å; A652-T659 WeakPolarHBondContact CA-OG1 3.42Å; A652-T659 WeakPolarHBondContact CB-OG1 3.46Å
653	K	91.6	Very high	94	Very high	67 Å²	67	14 Å²	14	29%	0.291	7%	0.069	S	C	.	.	H	α-helix	trans	-68.7	-46.4	176.1	-71.8	179.8	-177.9	-162.6	0	113	E598 T601 L602 R649 L650 L651 T655	E598-K653 WeakPolarHBondContact OE1-CE 3.45Å; E598-K653 IonicContact OE1-NZ 3.04Å; E598-K653 PolarHBondContact OE1-NZ 3.37Å; T601-K653 WeakPolarHBondContact OG1-CE 3.17Å; T601-K653 PolarHBondContact OG1-NZ 2.96Å; L602-K653 HydrophobicContact CD1-CG 3.92Å; L602-K653 HydrophobicContact CD2-CG 4.17Å; L602-K653 HydrophobicContact CG-CG 4.07Å; R649-K653 WeakPolarHBondContact O-CG 3.49Å; R649-K653 PolarHBondContact O-N 3.2Å; L650-K653 PolarHBondContact O-N 2.85Å; L651-K653 VanDerWaalsContact C-N 3.29Å; L651-K653 PolarHBondContact O-N 3.22Å; K653-T655 VanDerWaalsContact C-N 3.31Å; K653-T655 PolarHBondContact O-N 3.34Å
654	V	92.3	Very high	94.4	Very high	18 Å²	18	13.5 Å²	13.5	11%	0.109	7%	0.065	C	C	.	.	H	α-helix	trans	-67	-36.5	-177.2	171.2	0	0	0	0	111.3	L650 L651 R923	L650-V654 HydrophobicContact CD1-CG2 3.91Å; L650-V654 HydrophobicContact CG-CG2 4.24Å; L650-V654 WeakPolarHBondContact O-CB 3.38Å; L650-V654 VanDerWaalsContact O-CG2 3.29Å; L650-V654 WeakPolarHBondContact O-CG2 3.26Å; L650-V654 PolarHBondContact O-N 3.16Å; L651-V654 PolarHBondContact O-N 3.28Å; V654-R923 PolarHBondContact O-NH1 2.93Å
655	T	94.3	Very high	94.7	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.006	8%	0.083	C	C	.	.	H	α-helix	trans	-89.8	-21	-178.7	59.2	0	0	0	0	113.3	I628 L651 K653 M657 I922	I628-T655 HydrophobicContact CD1-CG2 3.77Å; I628-T655 WeakPolarHBondContact CD1-OG1 3.2Å; L651-T655 HydrophobicContact CD1-CG2 4.04Å; L651-T655 HydrophobicContact CG-CG2 4.48Å; L651-T655 WeakPolarHBondContact O-CB 3.4Å; L651-T655 WeakPolarHBondContact O-CG2 3.41Å; L651-T655 PolarHBondContact O-N 3.12Å; L651-T655 PolarHBondContact O-OG1 2.7Å; K653-T655 VanDerWaalsContact C-N 3.31Å; K653-T655 PolarHBondContact O-N 3.34Å; T655-M657 VanDerWaalsContact C-N 3.26Å; T655-M657 PolarHBondContact O-N 2.93Å; T655-I922 HydrophobicContact CG2-CB 4.26Å; T655-I922 HydrophobicContact CG2-CG2 4.22Å
656	N	93.3	Very high	95	Very high	39 Å²	39	19.2 Å²	19.2	21%	0.209	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	42.1	-170.3	-159.6	27.6	0	0	0	113	P619 S621 P622 D623 A652	P619-N656 WeakPolarHBondContact CB-OD1 3.39Å; S621-N656 PolarHBondContact O-ND2 3.04Å; S621-N656 PolarHBondContact O-OD1 3.37Å; P622-N656 WeakPolarHBondContact CA-O 3.36Å; D623-N656 PolarHBondContact N-O 3.31Å; D623-N656 PolarHBondContact OD1-ND2 2.7Å; D623-N656 WeakPolarHBondContact OD2-CB 3.38Å; D623-N656 PolarHBondContact OD2-ND2 3.08Å; A652-N656 WeakPolarHBondContact O-CA 3.19Å; A652-N656 PolarHBondContact O-N 2.97Å
657	M	95	Very high	95.2	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.005	8%	0.083	C	C	.	.	S	Bend	trans	-121.4	153.3	-178	-66	173.9	-168.2	0	0	111.9	A626 I628 A652 T655 T659 I922 R923 M926	A626-M657 HydrophobicContact CB-CE 4.09Å; A626-M657 HydrophobicContact CB-CG 4.02Å; A626-M657 HydrophobicContact CB-SD 3.73Å; I628-M657 HydrophobicContact CD1-CB 4.23Å; I628-M657 HydrophobicContact CD1-SD 4.06Å; I628-M657 HydrophobicContact CG1-CB 4.28Å; I628-M657 HydrophobicContact CG1-SD 4.06Å; A652-M657 PolarHBondContact O-N 3.39Å; T655-M657 VanDerWaalsContact C-N 3.26Å; T655-M657 PolarHBondContact O-N 2.93Å; M657-T659 PolarHBondContact O-N 2.93Å; M657-T659 PolarHBondContact O-OG1 2.98Å; M657-I922 HydrophobicContact CE-CG2 4.26Å; M657-I922 HydrophobicContact SD-CG2 3.98Å; M657-R923 HydrophobicContact CE-CB 4.49Å; M657-M926 HydrophobicContact CE-CB 3.39Å; M657-M926 HydrophobicContact CE-CG 3.71Å; M657-M926 HydrophobicContact SD-CB 4.37Å; M657-M926 HydrophobicContact SD-CG 4.13Å
658	V	95.2	Very high	95.3	Very high	5 Å²	5	19.9 Å²	19.9	3%	0.03	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	120	170.2	178.3	0	0	0	0	108.5	V616 Y617 I618 P622 A626 A627 I628 I660 Y694 V696	V616-V658 HydrophobicContact CG1-CG1 3.66Å; Y617-V658 WeakPolarHBondContact O-CA 3.33Å; I618-V658 HydrophobicContact CG2-CG2 4.5Å; P622-V658 HydrophobicContact CG-CG2 4.4Å; A626-V658 PolarHBondContact O-N 3.38Å; A627-V658 CarbonylContact C-O 3.59Å; A627-V658 WeakPolarHBondContact CA-O 3.4Å; I628-V658 PolarHBondContact N-O 2.8Å; V658-I660 HydrophobicContact CG1-CG1 4.44Å; V658-Y694 HydrophobicContact CG1-CG 4.43Å; V658-V696 HydrophobicContact CB-CG2 4.41Å
659	T	96.9	Very high	95.2	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	126	-177.9	-55.9	0	0	0	0	110.1	V616 Y617 I628 F630 A652 M657	V616-T659 CarbonylContact C-O 3.53Å; V616-T659 WeakPolarHBondContact CA-O 3.14Å; Y617-T659 WeakPolarHBondContact CD2-O 3.44Å; Y617-T659 PolarHBondContact N-O 3.35Å; Y617-T659 PolarHBondContact O-N 2.77Å; I628-T659 HydrophobicContact CB-CG2 4.12Å; I628-T659 HydrophobicContact CG2-CG2 4.15Å; I628-T659 CarbonylContact O-C 3.34Å; I628-T659 VanDerWaalsContact O-CA 3.31Å; I628-T659 WeakPolarHBondContact O-CA 3.39Å; F630-T659 HydrophobicContact CB-CG2 4.46Å; A652-T659 WeakPolarHBondContact CA-OG1 3.42Å; A652-T659 WeakPolarHBondContact CB-OG1 3.46Å; M657-T659 PolarHBondContact O-N 2.93Å; M657-T659 PolarHBondContact O-OG1 2.98Å
660	I	97.5	Very high	95.4	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	113.8	-177.4	-54.6	-179.5	0	0	0	108	L609 C614 V616 I628 V629 F630 V658 V682 L686	L609-I660 HydrophobicContact CD1-CD1 4.04Å; L609-I660 HydrophobicContact CD1-CG2 3.82Å; C614-I660 HydrophobicContact CB-CG2 3.96Å; V616-I660 HydrophobicContact CG1-CG1 4.16Å; V616-I660 HydrophobicContact CG2-CG1 4.11Å; V616-I660 HydrophobicContact CG2-CG2 4.29Å; I628-I660 PolarHBondContact O-N 3.17Å; V629-I660 CarbonylContact C-O 3.58Å; V629-I660 WeakPolarHBondContact CA-O 3.46Å; V629-I660 HydrophobicContact CG2-CB 4.43Å; F630-I660 PolarHBondContact N-O 2.85Å; V658-I660 HydrophobicContact CG1-CG1 4.44Å; I660-V682 HydrophobicContact CG2-CG1 4.42Å; I660-L686 HydrophobicContact CD1-CD1 3.78Å; I660-L686 HydrophobicContact CD1-CD2 3.95Å; I660-L686 HydrophobicContact CD1-CG 4.44Å
661	S	98.2	Very high	95.6	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	125.8	175.9	-167.1	0	0	0	0	110.2	C614 R615 F630	C614-S661 CarbonylContact C-O 3.58Å; C614-S661 WeakPolarHBondContact CA-O 3.22Å; R615-S661 PolarHBondContact N-O 3.46Å; R615-S661 PolarHBondContact O-N 2.7Å; F630-S661 WeakPolarHBondContact O-CA 3.42Å
662	V	98.5	Very high	95.7	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	124.8	-172.8	-177.6	0	0	0	0	111.4	V612 V629 F630 I631 H632 Y664 V682	V612-V662 HydrophobicContact CG1-CG1 4.06Å; V629-V662 HydrophobicContact CG1-CG2 3.63Å; F630-V662 PolarHBondContact O-N 3.22Å; I631-V662 HydrophobicContact CG1-CG2 4.48Å; H632-V662 PolarHBondContact CD2-O 2.9Å; H632-V662 VanDerWaalsContact CD2-O 3.24Å; V662-Y664 PolarHBondContact O-N 2.61Å; V662-V682 HydrophobicContact CG1-CG2 3.99Å; V662-V682 HydrophobicContact CG2-CB 4.34Å; V662-V682 HydrophobicContact CG2-CG1 4.03Å; V662-V682 HydrophobicContact CG2-CG2 4.33Å
663	E	97.9	Very high	95.8	Very high	55 Å²	55	35.4 Å²	35.4	26%	0.257	17%	0.165	S	C	.	.			trans	-95.6	74.1	172.2	-169.8	71	-114.5	0	0	109.7	P613 H632 N640 V641	P613-E663 HydrophobicContact CB-CB 4.03Å; P613-E663 HydrophobicContact CB-CG 4.47Å; P613-E663 WeakPolarHBondContact O-CB 3.11Å; P613-E663 PolarHBondContact O-N 2.86Å; H632-E663 IonicContact NE2-OE1 2.7Å; N640-E663 WeakPolarHBondContact CA-OE1 3.29Å; N640-E663 WeakPolarHBondContact CB-OE1 3.28Å; N640-E663 WeakPolarHBondContact CB-OE2 3.42Å; V641-E663 VanDerWaalsContact CB-OE2 3.25Å; V641-E663 WeakPolarHBondContact CB-OE2 3.36Å; V641-E663 HydrophobicContact CG2-CB 3.62Å; V641-E663 HydrophobicContact CG2-CG 4.39Å; V641-E663 WeakPolarHBondContact CG2-OE2 3.3Å; V641-E663 PolarHBondContact N-OE2 3.34Å
664	Y	98.3	Very high	96.1	Very high	3 Å²	3	33.2 Å²	33.2	1%	0.012	16%	0.158	C	C	.	.	P	Polyproline II helix	trans	-73.6	154.4	-180	63.4	-95.7	0	0	0	111.4	I631 H632 V662 L666 A675 L712	I631-Y664 HydrophobicContact CG2-CD1 3.84Å; I631-Y664 HydrophobicContact CG2-CE1 3.66Å; H632-Y664 AromaticContact CD2-CE1 3.77Å; H632-Y664 AromaticContact CE1-CE1 3.48Å; H632-Y664 VanDerWaalsContact CE1-CE1 3.48Å; H632-Y664 WeakPolarHBondContact CE1-CE1 3.43Å; H632-Y664 AromaticContact CE1-CZ 3.48Å; H632-Y664 VanDerWaalsContact CE1-CZ 3.48Å; H632-Y664 PolarHBondContact CE1-OH 2.8Å; H632-Y664 AromaticContact CG-CE1 3.91Å; H632-Y664 AromaticContact ND1-CE1 3.75Å; H632-Y664 AromaticContact ND1-CZ 3.85Å; H632-Y664 PolarHBondContact ND1-OH 3.11Å; H632-Y664 AromaticContact NE2-CD1 3.92Å; H632-Y664 AromaticContact NE2-CE1 3.51Å; H632-Y664 AromaticContact NE2-CZ 3.93Å; H632-Y664 WeakPolarHBondContact O-CE1 3.49Å; H632-Y664 PolarHBondContact O-OH 2.77Å; V662-Y664 PolarHBondContact O-N 2.61Å; Y664-L666 HydrophobicContact CD2-CD2 4.12Å; Y664-L666 HydrophobicContact CE2-CD2 3.54Å; Y664-L666 PolarHBondContact O-N 3.09Å; Y664-A675 HydrophobicContact CD2-CB 3.46Å; Y664-A675 VanDerWaalsContact CD2-CB 3.46Å; Y664-A675 HydrophobicContact CE2-CB 3.95Å; Y664-A675 HydrophobicContact CG-CB 4.19Å; Y664-L712 HydrophobicContact CD1-CD1 4.04Å; Y664-L712 HydrophobicContact CD2-CD1 4.22Å; Y664-L712 HydrophobicContact CE1-CD1 3.78Å; Y664-L712 HydrophobicContact CE2-CD1 3.98Å; Y664-L712 HydrophobicContact CG-CD1 4.26Å
665	R	98.2	Very high	96.4	Very high	100 Å²	100	32.4 Å²	32.4	38%	0.377	15%	0.153	S	C	.	.	P	Polyproline II helix	trans	-65	131.5	178.8	-73.7	173.7	-68.6	163.8	1.2	112	H670 D678	R665-H670 HydrophobicContact CB-CB 3.64Å; R665-D678 VanDerWaalsContact CB-OD2 3.24Å; R665-D678 WeakPolarHBondContact CB-OD2 3.41Å; R665-D678 WeakPolarHBondContact CG-OD2 3.15Å; R665-D678 IonicContact CZ-OD1 2.98Å; R665-D678 VanDerWaalsContact CZ-OD1 3.26Å; R665-D678 IonicContact CZ-OD2 2.67Å; R665-D678 PolarHBondContact N-OD2 2.78Å; R665-D678 IonicContact NE-OD1 3.71Å; R665-D678 PolarHBondContact NE-OD1 3.5Å; R665-D678 IonicContact NE-OD2 2.67Å; R665-D678 PolarHBondContact NE-OD2 3.01Å; R665-D678 IonicContact NH2-OD1 3.41Å; R665-D678 PolarHBondContact NH2-OD1 3.33Å; R665-D678 IonicContact NH2-OD2 3.34Å
666	L	97.6	Very high	96.6	Very high	22 Å²	22	32.4 Å²	32.4	12%	0.115	15%	0.153	C	C	.	.	P	Polyproline II helix	trans	-92.8	147.7	-176.3	-58.5	175.8	0	0	0	113.1	F636 L639 Y664 H670	F636-L666 WeakPolarHBondContact O-CA 3.15Å; L639-L666 WeakPolarHBondContact O-CD1 3.27Å; Y664-L666 HydrophobicContact CD2-CD2 4.12Å; Y664-L666 HydrophobicContact CE2-CD2 3.54Å; Y664-L666 PolarHBondContact O-N 3.09Å; L666-H670 CarbonylContact C-O 3.54Å; L666-H670 PolarHBondContact O-N 3.38Å
667	A	95.7	Very high	96.8	Very high	1 Å²	1	33 Å²	33	1%	0.008	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	154.5	166.6	0	0	0	0	0	110.8	R580 F636 V637 H670 Y774	R580-A667 PolarHBondContact NH2-O 2.78Å; F636-A667 PolarHBondContact O-N 3.37Å; V637-A667 VanDerWaalsContact CA-O 3.31Å; V637-A667 WeakPolarHBondContact CA-O 3.43Å; V637-A667 WeakPolarHBondContact CG1-O 3.36Å; V637-A667 HydrophobicContact CG2-CB 3.96Å; V637-A667 WeakPolarHBondContact CG2-O 3.41Å; A667-H670 WeakPolarHBondContact CA-O 3.17Å; A667-H670 PolarHBondContact N-O 2.84Å; A667-Y774 HydrophobicContact CB-CD2 4.13Å
668	P	93	Very high	97	Very high	39 Å²	39	33.4 Å²	33.4	25%	0.253	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	cis	-85	-3.3	6.4	35.1	-37.4	0	0	0	114.6	H670 L773	P668-H670 VanDerWaalsContact C-N 3.33Å; P668-L773 HydrophobicContact CB-CD2 4.36Å
669	E	93.5	Very high	97.1	Very high	102 Å²	102	33.2 Å²	33.2	48%	0.477	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-41.8	178.9	-61.8	83.6	175.1	0	0	111.3	R580	R580-E669 IonicContact CZ-OE1 2.96Å; R580-E669 IonicContact CZ-OE2 3.72Å; R580-E669 VanDerWaalsContact NH1-CD 3.25Å; R580-E669 IonicContact NH1-OE1 3.05Å; R580-E669 PolarHBondContact NH1-OE1 3Å; R580-E669 IonicContact NH1-OE2 3.81Å; R580-E669 PolarHBondContact NH1-OE2 3.46Å; R580-E669 VanDerWaalsContact NH1-OE2 3.16Å; R580-E669 IonicContact NH2-OE1 2.94Å; R580-E669 IonicContact NH2-OE2 2.83Å; R580-E669 PolarHBondContact NH2-OE2 3.42Å
670	H	96.2	Very high	97.1	Very high	79 Å²	79	33.8 Å²	33.8	37%	0.366	16%	0.16	S	C	.	.	S	Bend	trans	-127.1	98.4	177.1	-57.3	-76.3	0	0	0	109.7	R665 L666 A667 P668	R665-H670 HydrophobicContact CB-CB 3.64Å; L666-H670 CarbonylContact C-O 3.54Å; L666-H670 PolarHBondContact O-N 3.38Å; A667-H670 WeakPolarHBondContact CA-O 3.17Å; A667-H670 PolarHBondContact N-O 2.84Å; P668-H670 VanDerWaalsContact C-N 3.33Å
671	R	95.8	Very high	97.1	Very high	136 Å²	136	37.1 Å²	37.1	51%	0.513	18%	0.178	S	C	.	.			trans	-73.7	168.5	-177.5	-61.4	167.3	-173.5	-161	1.3	111.2	S674 Y774 G776	R671-S674 VanDerWaalsContact O-CB 3.31Å; R671-S674 WeakPolarHBondContact O-CB 3.44Å; R671-S674 PolarHBondContact O-N 3.44Å; R671-S674 PolarHBondContact O-OG 3.07Å; R671-Y774 WeakPolarHBondContact CA-O 3.47Å; R671-Y774 WeakPolarHBondContact CB-O 3.46Å; R671-G776 PolarHBondContact NH1-O 3.34Å
672	F	97.1	Very high	97.1	Very high	27 Å²	27	37.1 Å²	37.1	12%	0.118	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.2	133.6	166.7	175	-94.4	0	0	0	110.7	V676 Y774 F775 F841 D844 Q846 A847	F672-V676 HydrophobicContact CD2-CG2 4.37Å; F672-V676 HydrophobicContact CE2-CG2 4.15Å; F672-Y774 HydrophobicContact CB-CD1 4.25Å; F672-Y774 HydrophobicContact CB-CD2 4.24Å; F672-Y774 HydrophobicContact CB-CE1 3.9Å; F672-Y774 HydrophobicContact CB-CE2 3.87Å; F672-Y774 HydrophobicContact CB-CG 4.44Å; F672-Y774 AromaticContact CD2-CE1 3.82Å; F672-Y774 HydrophobicContact CD2-CE1 3.82Å; F672-Y774 AromaticContact CD2-CZ 3.68Å; F672-Y774 WeakPolarHBondContact CD2-OH 3.36Å; F672-Y774 HydrophobicContact CG-CE1 4.27Å; F672-Y774 PolarHBondContact N-O 3.47Å; F672-F775 HydrophobicContact CB-CD1 4.1Å; F672-F775 HydrophobicContact CB-CE1 4.36Å; F672-F775 HydrophobicContact CG-CD1 4.48Å; F672-F775 HydrophobicContact CG-CE1 4.4Å; F672-F841 AromaticContact CD1-CD1 3.91Å; F672-F841 HydrophobicContact CD1-CD1 3.91Å; F672-F841 AromaticContact CD1-CE1 3.92Å; F672-F841 HydrophobicContact CD1-CE1 3.92Å; F672-F841 HydrophobicContact CE1-CD1 4.27Å; F672-D844 WeakPolarHBondContact CZ-OD2 3.26Å; F672-Q846 HydrophobicContact CE2-CB 4.03Å; F672-Q846 HydrophobicContact CZ-CB 3.93Å; F672-A847 HydrophobicContact CD2-CB 4.13Å; F672-A847 HydrophobicContact CE1-CB 4.48Å; F672-A847 HydrophobicContact CE2-CB 3.72Å; F672-A847 HydrophobicContact CZ-CB 3.9Å
673	P	96.8	Very high	96.9	Very high	49 Å²	49	37.2 Å²	37.2	32%	0.318	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	cis	-98.4	18.2	8	38.3	-35.8	0	0	0	115.7	A675 V676 D677	P673-A675 VanDerWaalsContact C-N 3.31Å; P673-A675 PolarHBondContact O-N 2.83Å; P673-A675 VanDerWaalsContact O-N 3.11Å; P673-V676 WeakPolarHBondContact O-CA 3.39Å; P673-V676 WeakPolarHBondContact O-CB 3.46Å; P673-V676 PolarHBondContact O-N 3.03Å; P673-D677 PolarHBondContact O-N 3.41Å; P673-D677 VanDerWaalsContact O-N 3.11Å
674	S	98	Very high	96.8	Very high	21 Å²	21	38 Å²	38	15%	0.147	18%	0.183	C	C	.	.	H	α-helix	trans	-51.7	-42.3	-169.1	-51	0	0	0	0	114.9	R671 D677 D678	R671-S674 VanDerWaalsContact O-CB 3.31Å; R671-S674 WeakPolarHBondContact O-CB 3.44Å; R671-S674 PolarHBondContact O-N 3.44Å; R671-S674 PolarHBondContact O-OG 3.07Å; S674-D677 PolarHBondContact O-N 3.15Å; S674-D678 PolarHBondContact O-N 2.76Å
675	A	97.9	Very high	96.6	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.008	19%	0.191	C	C	.	.	H	α-helix	trans	-66.6	-35.9	178.6	0	0	0	0	0	112.8	Y664 P673 C679 L712 Y774	Y664-A675 HydrophobicContact CD2-CB 3.46Å; Y664-A675 VanDerWaalsContact CD2-CB 3.46Å; Y664-A675 HydrophobicContact CE2-CB 3.95Å; Y664-A675 HydrophobicContact CG-CB 4.19Å; P673-A675 VanDerWaalsContact C-N 3.31Å; P673-A675 PolarHBondContact O-N 2.83Å; P673-A675 VanDerWaalsContact O-N 3.11Å; A675-C679 PolarHBondContact O-N 3.45Å; A675-C679 VanDerWaalsContact O-N 3.13Å; A675-C679 PolarHBondContact O-SG 3.48Å; A675-L712 HydrophobicContact CB-CD1 4Å; A675-L712 HydrophobicContact CB-CD2 3.85Å; A675-Y774 HydrophobicContact CB-CE2 4.41Å
676	V	97.9	Very high	96.4	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-65.9	-43.7	176	-170.6	0	0	0	0	109.7	F672 P673 C679 E680 L712 A715 V716 R719	F672-V676 HydrophobicContact CD2-CG2 4.37Å; F672-V676 HydrophobicContact CE2-CG2 4.15Å; P673-V676 WeakPolarHBondContact O-CA 3.39Å; P673-V676 WeakPolarHBondContact O-CB 3.46Å; P673-V676 PolarHBondContact O-N 3.03Å; V676-C679 PolarHBondContact O-N 3.47Å; V676-E680 WeakPolarHBondContact O-CB 3.44Å; V676-E680 PolarHBondContact O-N 2.84Å; V676-L712 HydrophobicContact CB-CD2 4.44Å; V676-L712 HydrophobicContact CG2-CD2 3.75Å; V676-A715 HydrophobicContact CG1-CB 4.15Å; V676-V716 HydrophobicContact CG1-CG2 4.2Å; V676-R719 VanDerWaalsContact CG1-CZ 3.48Å
677	D	98.2	Very high	96.1	Very high	52 Å²	52	35 Å²	35	28%	0.278	17%	0.173	S	C	.	.	H	α-helix	trans	-64.6	-42.1	-180	-59.4	-19.4	0	0	0	111.6	P673 S674 E680 N681 R719	P673-D677 PolarHBondContact O-N 3.41Å; P673-D677 VanDerWaalsContact O-N 3.11Å; S674-D677 PolarHBondContact O-N 3.15Å; D677-E680 PolarHBondContact O-N 3.28Å; D677-N681 WeakPolarHBondContact O-CB 3.24Å; D677-N681 PolarHBondContact O-N 2.87Å; D677-N681 PolarHBondContact O-ND2 2.96Å; D677-R719 IonicContact OD1-CZ 3.14Å; D677-R719 IonicContact OD1-NH1 3.78Å; D677-R719 PolarHBondContact OD1-NH1 2.91Å; D677-R719 IonicContact OD1-NH2 2.84Å; D677-R719 PolarHBondContact OD1-NH2 3.44Å
678	D	98.5	Very high	95.9	Very high	9 Å²	9	38.3 Å²	38.3	5%	0.048	20%	0.196	C	C	.	.	H	α-helix	trans	-63.4	-45.9	176.8	-72.3	-9.6	0	0	0	111.9	V612 R665 S674 E680 N681 V682	V612-D678 HydrophobicContact CG1-CB 4.1Å; V612-D678 HydrophobicContact CG2-CB 3.73Å; R665-D678 VanDerWaalsContact CB-OD2 3.24Å; R665-D678 WeakPolarHBondContact CB-OD2 3.41Å; R665-D678 WeakPolarHBondContact CG-OD2 3.15Å; R665-D678 IonicContact CZ-OD1 2.98Å; R665-D678 VanDerWaalsContact CZ-OD1 3.26Å; R665-D678 IonicContact CZ-OD2 2.67Å; R665-D678 PolarHBondContact N-OD2 2.78Å; R665-D678 IonicContact NE-OD1 3.71Å; R665-D678 PolarHBondContact NE-OD1 3.5Å; R665-D678 IonicContact NE-OD2 2.67Å; R665-D678 PolarHBondContact NE-OD2 3.01Å; R665-D678 IonicContact NH2-OD1 3.41Å; R665-D678 PolarHBondContact NH2-OD1 3.33Å; R665-D678 IonicContact NH2-OD2 3.34Å; S674-D678 PolarHBondContact O-N 2.76Å; D678-E680 VanDerWaalsContact C-N 3.34Å; D678-E680 PolarHBondContact O-N 2.92Å; D678-N681 PolarHBondContact O-N 2.69Å; D678-V682 WeakPolarHBondContact O-CG2 3.24Å; D678-V682 PolarHBondContact O-N 2.94Å; D678-V682 VanDerWaalsContact O-N 3.12Å
679	C	98.3	Very high	95.7	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.007	21%	0.211	C	C	.	.	H	α-helix	trans	-64.9	-38.6	179.2	-65.6	0	0	0	0	112	I631 A675 V676 I683 V716	I631-C679 HydrophobicContact CD1-CB 3.82Å; A675-C679 PolarHBondContact O-N 3.45Å; A675-C679 VanDerWaalsContact O-N 3.13Å; A675-C679 PolarHBondContact O-SG 3.48Å; V676-C679 PolarHBondContact O-N 3.47Å; C679-I683 WeakPolarHBondContact O-CG1 3.36Å; C679-I683 PolarHBondContact O-N 3.12Å; C679-V716 HydrophobicContact CB-CG2 3.68Å
680	E	97	Very high	95	Very high	12 Å²	12	37.6 Å²	37.6	6%	0.056	19%	0.19	C	C	.	.	H	α-helix	trans	-63	-46.2	172.8	179.5	174.4	-139.9	0	0	111.5	V676 D677 D678 V682 I683 M684 V716 R719 K723	V676-E680 WeakPolarHBondContact O-CB 3.44Å; V676-E680 PolarHBondContact O-N 2.84Å; D677-E680 PolarHBondContact O-N 3.28Å; D678-E680 VanDerWaalsContact C-N 3.34Å; D678-E680 PolarHBondContact O-N 2.92Å; E680-V682 VanDerWaalsContact C-N 3.29Å; E680-V682 PolarHBondContact O-N 3.05Å; E680-I683 PolarHBondContact O-N 2.99Å; E680-I683 VanDerWaalsContact O-N 3.14Å; E680-M684 HydrophobicContact CG-CG 3.95Å; E680-M684 WeakPolarHBondContact O-CB 3.27Å; E680-M684 VanDerWaalsContact O-CG 3.28Å; E680-M684 WeakPolarHBondContact O-CG 3.45Å; E680-M684 PolarHBondContact O-N 2.83Å; E680-V716 HydrophobicContact CB-CG1 4.4Å; E680-V716 HydrophobicContact CB-CG2 4.4Å; E680-R719 WeakPolarHBondContact OE1-CD 3.49Å; E680-R719 WeakPolarHBondContact OE2-CD 3.31Å; E680-R719 IonicContact OE2-CZ 2.74Å; E680-R719 IonicContact OE2-NE 3.75Å; E680-R719 IonicContact OE2-NH1 2.68Å; E680-R719 PolarHBondContact OE2-NH1 3.49Å; E680-K723 WeakPolarHBondContact OE1-CD 3.43Å; E680-K723 WeakPolarHBondContact OE1-CE 3.32Å; E680-K723 IonicContact OE1-NZ 3.9Å; E680-K723 PolarHBondContact OE1-NZ 2.87Å; E680-K723 IonicContact OE2-NZ 2.75Å; E680-K723 PolarHBondContact OE2-NZ 3.36Å
681	N	97.3	Very high	94.5	Very high	71 Å²	71	37.6 Å²	37.6	38%	0.38	19%	0.188	S	C	.	.	H	α-helix	trans	-57.8	-40.8	-180	-74.2	-20.5	0	0	0	112.3	V612 D677 D678 H685	V612-N681 HydrophobicContact CG2-CB 4.31Å; D677-N681 WeakPolarHBondContact O-CB 3.24Å; D677-N681 PolarHBondContact O-N 2.87Å; D677-N681 PolarHBondContact O-ND2 2.96Å; D678-N681 PolarHBondContact O-N 2.69Å; N681-H685 VanDerWaalsContact O-CB 3.25Å; N681-H685 WeakPolarHBondContact O-CB 3.23Å; N681-H685 PolarHBondContact O-N 2.98Å
682	V	97.3	Very high	94.2	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-63.3	-46.6	176.2	175.1	0	0	0	0	111.4	L609 V612 V629 I660 V662 D678 E680 H685 L686	L609-V682 HydrophobicContact CB-CG1 4.31Å; L609-V682 HydrophobicContact CD1-CG1 4.36Å; V612-V682 HydrophobicContact CB-CG2 3.65Å; V612-V682 HydrophobicContact CG1-CG2 3.96Å; V612-V682 HydrophobicContact CG2-CG2 4.15Å; V629-V682 HydrophobicContact CG1-CG1 4.43Å; I660-V682 HydrophobicContact CG2-CG1 4.42Å; V662-V682 HydrophobicContact CG1-CG2 3.99Å; V662-V682 HydrophobicContact CG2-CB 4.34Å; V662-V682 HydrophobicContact CG2-CG1 4.03Å; V662-V682 HydrophobicContact CG2-CG2 4.33Å; D678-V682 WeakPolarHBondContact O-CG2 3.24Å; D678-V682 PolarHBondContact O-N 2.94Å; D678-V682 VanDerWaalsContact O-N 3.12Å; E680-V682 VanDerWaalsContact C-N 3.29Å; E680-V682 PolarHBondContact O-N 3.05Å; V682-H685 PolarHBondContact O-N 2.9Å; V682-L686 WeakPolarHBondContact O-CB 3.04Å; V682-L686 PolarHBondContact O-N 2.8Å
683	I	95.3	Very high	93.8	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-64.5	-45.1	179.8	-67.6	-74.1	0	0	0	111	V629 C679 E680 H685 L686 L687 L703 V716 M720	V629-I683 HydrophobicContact CB-CD1 3.71Å; V629-I683 HydrophobicContact CG1-CD1 3.83Å; V629-I683 HydrophobicContact CG1-CG1 4.46Å; V629-I683 HydrophobicContact CG2-CD1 3.58Å; C679-I683 WeakPolarHBondContact O-CG1 3.36Å; C679-I683 PolarHBondContact O-N 3.12Å; E680-I683 PolarHBondContact O-N 2.99Å; E680-I683 VanDerWaalsContact O-N 3.14Å; I683-H685 VanDerWaalsContact C-N 3.31Å; I683-H685 PolarHBondContact O-N 3.43Å; I683-L686 PolarHBondContact O-N 2.84Å; I683-L687 HydrophobicContact CG2-CD1 4.04Å; I683-L687 HydrophobicContact CG2-CG 4.47Å; I683-L687 WeakPolarHBondContact O-CG 3.48Å; I683-L687 PolarHBondContact O-N 3.18Å; I683-L703 HydrophobicContact CD1-CD1 3.99Å; I683-L703 HydrophobicContact CG1-CD1 4.4Å; I683-V716 HydrophobicContact CG1-CG1 4.39Å; I683-M720 HydrophobicContact CG2-CE 3.64Å; I683-M720 HydrophobicContact CG2-SD 3.59Å; I683-M720 VanDerWaalsContact CG2-SD 3.59Å
684	M	94.9	Very high	93.4	Very high	70 Å²	70	40.5 Å²	40.5	35%	0.345	20%	0.199	S	C	.	.	H	α-helix	trans	-63.3	-38.6	178.4	-65.9	-56.1	-68.1	0	0	111.7	E680 L687 S688 V725	E680-M684 HydrophobicContact CG-CG 3.95Å; E680-M684 WeakPolarHBondContact O-CB 3.27Å; E680-M684 VanDerWaalsContact O-CG 3.28Å; E680-M684 WeakPolarHBondContact O-CG 3.45Å; E680-M684 PolarHBondContact O-N 2.83Å; M684-L687 PolarHBondContact O-N 2.79Å; M684-S688 WeakPolarHBondContact O-CB 3.23Å; M684-S688 PolarHBondContact O-N 3.32Å; M684-S688 VanDerWaalsContact O-N 3.07Å; M684-S688 PolarHBondContact O-OG 3.13Å; M684-V725 HydrophobicContact CE-CG1 4.07Å; M684-V725 HydrophobicContact CE-CG2 3.96Å; M684-V725 HydrophobicContact SD-CG1 3.83Å; M684-V725 HydrophobicContact SD-CG2 3.94Å
685	H	94.6	Very high	92.9	Very high	40 Å²	40	47.2 Å²	47.2	19%	0.185	23%	0.228	C	C	.	.	H	α-helix	trans	-68.4	-40.5	174.9	-177.5	81.8	0	0	0	112.3	N681 V682 I683 L687 S688 E689 G690	N681-H685 VanDerWaalsContact O-CB 3.25Å; N681-H685 WeakPolarHBondContact O-CB 3.23Å; N681-H685 PolarHBondContact O-N 2.98Å; V682-H685 PolarHBondContact O-N 2.9Å; I683-H685 VanDerWaalsContact C-N 3.31Å; I683-H685 PolarHBondContact O-N 3.43Å; H685-L687 VanDerWaalsContact C-N 3.31Å; H685-L687 PolarHBondContact O-N 3.44Å; H685-S688 WeakPolarHBondContact CA-OG 3.23Å; H685-S688 PolarHBondContact O-N 3.12Å; H685-S688 PolarHBondContact O-OG 3.24Å; H685-E689 IonicContact CE1-OE2 3.58Å; H685-E689 PolarHBondContact CE1-OE2 2.67Å; H685-E689 IonicContact ND1-OE2 3.61Å; H685-E689 PolarHBondContact ND1-OE2 2.59Å; H685-E689 PolarHBondContact O-N 3.01Å; H685-G690 PolarHBondContact O-N 3.47Å
686	L	93.4	Very high	92.6	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.23	C	C	.	.	I	π-helix	trans	-60.3	-42.7	174.8	-178.3	62.1	0	0	0	111.3	V629 I660 V682 I683 Y691 I701	V629-L686 HydrophobicContact CG2-CD2 3.63Å; I660-L686 HydrophobicContact CD1-CD1 3.78Å; I660-L686 HydrophobicContact CD1-CD2 3.95Å; I660-L686 HydrophobicContact CD1-CG 4.44Å; V682-L686 WeakPolarHBondContact O-CB 3.04Å; V682-L686 PolarHBondContact O-N 2.8Å; I683-L686 PolarHBondContact O-N 2.84Å; L686-Y691 WeakPolarHBondContact O-CB 3.31Å; L686-Y691 PolarHBondContact O-N 3.2Å; L686-I701 HydrophobicContact CD2-CD1 3.85Å; L686-I701 HydrophobicContact CD2-CG1 4.4Å; L686-I701 HydrophobicContact CD2-CG2 4.4Å; L686-I701 HydrophobicContact CG-CD1 4.14Å
687	L	92.3	Very high	92.3	Very high	24 Å²	24	51.1 Å²	51.1	13%	0.126	25%	0.249	C	C	.	.	I	π-helix	trans	-68.4	-32.4	178.9	-72.6	175.4	0	0	0	113.9	I683 M684 H685 Y691 T698 I701 M720 V725 P727	I683-L687 HydrophobicContact CG2-CD1 4.04Å; I683-L687 HydrophobicContact CG2-CG 4.47Å; I683-L687 WeakPolarHBondContact O-CG 3.48Å; I683-L687 PolarHBondContact O-N 3.18Å; M684-L687 PolarHBondContact O-N 2.79Å; H685-L687 VanDerWaalsContact C-N 3.31Å; H685-L687 PolarHBondContact O-N 3.44Å; L687-Y691 WeakPolarHBondContact O-CD1 3.36Å; L687-T698 HydrophobicContact CD2-CG2 4.14Å; L687-I701 HydrophobicContact CD2-CD1 3.56Å; L687-I701 HydrophobicContact CG-CD1 4.3Å; L687-M720 HydrophobicContact CD1-CE 3.63Å; L687-V725 HydrophobicContact CD1-CG1 3.97Å; L687-P727 HydrophobicContact CD2-CG 3.96Å
688	S	91.3	Very high	92	Very high	69 Å²	69	50 Å²	50	48%	0.483	24%	0.244	S	C	.	.	I	π-helix	trans	-92.6	-41.9	-175.2	50.5	0	0	0	0	113.7	M684 H685 Y691	M684-S688 WeakPolarHBondContact O-CB 3.23Å; M684-S688 PolarHBondContact O-N 3.32Å; M684-S688 VanDerWaalsContact O-N 3.07Å; M684-S688 PolarHBondContact O-OG 3.13Å; H685-S688 WeakPolarHBondContact CA-OG 3.23Å; H685-S688 PolarHBondContact O-N 3.12Å; H685-S688 PolarHBondContact O-OG 3.24Å; S688-Y691 WeakPolarHBondContact O-CE1 3.36Å
689	E	87.9	Confident	91.7	Very high	122 Å²	122	52.7 Å²	52.7	57%	0.57	26%	0.263	S	S	*	.	I	π-helix	trans	-131	-47.1	-170.3	-64.3	-177.8	172.6	0	0	112.5	H685 Y691 K692	H685-E689 IonicContact CE1-OE2 3.58Å; H685-E689 PolarHBondContact CE1-OE2 2.67Å; H685-E689 IonicContact ND1-OE2 3.61Å; H685-E689 PolarHBondContact ND1-OE2 2.59Å; H685-E689 PolarHBondContact O-N 3.01Å; E689-Y691 PolarHBondContact O-N 3.33Å; E689-Y691 VanDerWaalsContact O-N 3.16Å; E689-K692 PolarHBondContact O-N 2.9Å
690	G	78.4	Confident	91.6	Very high	4 Å²	4	55.2 Å²	55.2	4%	0.041	27%	0.274	C	S	.	.	I	π-helix	trans	-61.6	-28.7	-170.9	0	0	0	0	0	114.1	H685 K692 K693 Y694	H685-G690 PolarHBondContact O-N 3.47Å; G690-K692 PolarHBondContact O-N 2.89Å; G690-K693 PolarHBondContact O-N 3.1Å; G690-Y694 WeakPolarHBondContact O-CD2 3.43Å; G690-Y694 PolarHBondContact O-N 2.9Å
691	Y	87.1	Confident	91.5	Very high	80 Å²	80	54.7 Å²	54.7	31%	0.314	27%	0.272	S	S	.	.	H	α-helix	trans	-59.3	-32.3	180	80	-90.7	0	0	0	113.1	L686 L687 S688 E689 H695 V696 T698	L686-Y691 WeakPolarHBondContact O-CB 3.31Å; L686-Y691 PolarHBondContact O-N 3.2Å; L687-Y691 WeakPolarHBondContact O-CD1 3.36Å; S688-Y691 WeakPolarHBondContact O-CE1 3.36Å; E689-Y691 PolarHBondContact O-N 3.33Å; E689-Y691 VanDerWaalsContact O-N 3.16Å; Y691-H695 WeakPolarHBondContact O-CA 3.11Å; Y691-H695 PolarHBondContact O-N 3.29Å; Y691-V696 WeakPolarHBondContact CB-O 3.49Å; Y691-V696 PolarHBondContact O-N 3.29Å; Y691-T698 VanDerWaalsContact CB-CG2 3.47Å; Y691-T698 HydrophobicContact CD1-CG2 3.8Å; Y691-T698 HydrophobicContact CD2-CG2 4.14Å; Y691-T698 HydrophobicContact CG-CG2 3.53Å
692	K	89	Confident	91.5	Very high	138 Å²	138	51.3 Å²	51.3	60%	0.6	25%	0.254	S	S	*	.	H	α-helix	trans	-67.7	-44.3	179.5	-63.9	-179.5	-177.2	174.5	0	111.3	E689 G690 Y694	E689-K692 PolarHBondContact O-N 2.9Å; G690-K692 PolarHBondContact O-N 2.89Å; K692-Y694 VanDerWaalsContact C-N 3.31Å; K692-Y694 PolarHBondContact O-N 3.14Å
693	K	89	Confident	91.6	Very high	120 Å²	120	51.4 Å²	51.4	52%	0.522	25%	0.254	S	S	.	.	H	α-helix	trans	-65.2	-36.2	-177.5	-176.6	-178.8	172	-160.7	0	112	E605 G690	E605-K693 WeakPolarHBondContact OE1-CE 3.34Å; E605-K693 IonicContact OE1-NZ 3.45Å; E605-K693 PolarHBondContact OE1-NZ 3.28Å; G690-K693 PolarHBondContact O-N 3.1Å
694	Y	87.1	Confident	91.7	Very high	15 Å²	15	51.3 Å²	51.3	6%	0.059	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	7.6	-174.5	-60.1	-61.5	0	0	0	113.9	E605 L609 V616 I618 V658 G690 K692 V696	E605-Y694 VanDerWaalsContact OE1-CE1 3.23Å; E605-Y694 WeakPolarHBondContact OE1-CE1 3.3Å; E605-Y694 PolarHBondContact OE1-OH 2.95Å; L609-Y694 HydrophobicContact CD2-CE2 4.4Å; V616-Y694 HydrophobicContact CB-CE1 4.33Å; V616-Y694 HydrophobicContact CG1-CD1 4.12Å; V616-Y694 HydrophobicContact CG1-CE1 3.83Å; V616-Y694 HydrophobicContact CG2-CE1 4.37Å; V616-Y694 HydrophobicContact CG2-CE2 4.33Å; I618-Y694 HydrophobicContact CD1-CD1 4.03Å; I618-Y694 HydrophobicContact CD1-CE1 3.98Å; V658-Y694 HydrophobicContact CG1-CG 4.43Å; G690-Y694 WeakPolarHBondContact O-CD2 3.43Å; G690-Y694 PolarHBondContact O-N 2.9Å; K692-Y694 VanDerWaalsContact C-N 3.31Å; K692-Y694 PolarHBondContact O-N 3.14Å; Y694-V696 PolarHBondContact O-N 3.33Å
695	H	88.6	Confident	91.9	Very high	162 Å²	162	48 Å²	48	75%	0.75	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.3	40	-175.6	-56.6	-70.6	0	0	0	113.3	Y691	Y691-H695 WeakPolarHBondContact O-CA 3.11Å; Y691-H695 PolarHBondContact O-N 3.29Å
696	V	91	Very high	92	Very high	8 Å²	8	46.2 Å²	46.2	5%	0.048	23%	0.229	C	C	.	.			trans	-87.7	134	-178	172	0	0	0	0	109.8	G625 A627 V658 Y691 Y694 T698 I701	G625-V696 CarbonylContact O-C 3.58Å; G625-V696 VanDerWaalsContact O-CA 3.23Å; G625-V696 WeakPolarHBondContact O-CA 3.28Å; A627-V696 HydrophobicContact CB-CB 4.3Å; A627-V696 HydrophobicContact CB-CG1 3.51Å; A627-V696 HydrophobicContact CB-CG2 3.73Å; V658-V696 HydrophobicContact CB-CG2 4.41Å; Y691-V696 WeakPolarHBondContact CB-O 3.49Å; Y691-V696 PolarHBondContact O-N 3.29Å; Y694-V696 PolarHBondContact O-N 3.33Å; V696-T698 PolarHBondContact O-N 2.93Å; V696-I701 HydrophobicContact CG1-CG1 4.18Å
697	N	92	Very high	92.2	Very high	75 Å²	75	46.8 Å²	46.8	40%	0.401	23%	0.233	S	C	.	.			trans	-78.1	113.1	165.4	-177	-23.4	0	0	0	108.6	G625 S699 K700	G625-N697 PolarHBondContact O-N 2.95Å; N697-S699 PolarHBondContact O-N 2.83Å; N697-S699 WeakPolarHBondContact OD1-CB 3.5Å; N697-S699 PolarHBondContact OD1-N 3.22Å; N697-K700 HydrophobicContact CB-CB 4.34Å; N697-K700 HydrophobicContact CB-CG 4.44Å; N697-K700 PolarHBondContact O-N 3.32Å
698	T	92.3	Very high	92.5	Very high	28 Å²	28	45.7 Å²	45.7	17%	0.172	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-16.9	-177.7	52.1	0	0	0	0	114.1	L687 Y691 V696 P727	L687-T698 HydrophobicContact CD2-CG2 4.14Å; Y691-T698 VanDerWaalsContact CB-CG2 3.47Å; Y691-T698 HydrophobicContact CD1-CG2 3.8Å; Y691-T698 HydrophobicContact CD2-CG2 4.14Å; Y691-T698 HydrophobicContact CG-CG2 3.53Å; V696-T698 PolarHBondContact O-N 2.93Å; T698-P727 WeakPolarHBondContact O-CG 3.42Å
699	S	92.7	Very high	92.8	Very high	66 Å²	66	42.4 Å²	42.4	46%	0.462	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-1.8	173.8	-56.9	0	0	0	0	114.1	N697 K730	N697-S699 PolarHBondContact O-N 2.83Å; N697-S699 WeakPolarHBondContact OD1-CB 3.5Å; N697-S699 PolarHBondContact OD1-N 3.22Å; S699-K730 WeakPolarHBondContact O-CB 3.3Å
700	K	94.5	Very high	93.3	Very high	53 Å²	53	36.6 Å²	36.6	23%	0.23	18%	0.177	C	C	.	.	S	Bend	trans	-122.8	50.7	179.7	-65.8	-166.2	170.5	-159.9	0	111.4	A626 A627 N697 M926 A927	A626-K700 VanDerWaalsContact CA-O 3.26Å; A626-K700 WeakPolarHBondContact CA-O 3.25Å; A626-K700 HydrophobicContact CB-CB 3.86Å; A626-K700 WeakPolarHBondContact CB-O 3.46Å; A627-K700 PolarHBondContact N-O 3.3Å; N697-K700 HydrophobicContact CB-CB 4.34Å; N697-K700 HydrophobicContact CB-CG 4.44Å; N697-K700 PolarHBondContact O-N 3.32Å; K700-M926 HydrophobicContact CB-SD 4.14Å; K700-M926 WeakPolarHBondContact CE-O 3.4Å; K700-M926 PolarHBondContact NZ-O 2.84Å; K700-A927 PolarHBondContact NZ-O 3.43Å
701	I	96	Very high	94.3	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.01	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	126.6	177.3	-61.7	173.3	0	0	0	110.3	A627 V629 L686 L687 V696 V729 K730	A627-I701 CarbonylContact O-C 3.59Å; A627-I701 WeakPolarHBondContact O-CA 3.45Å; V629-I701 HydrophobicContact CG2-CG2 4.32Å; L686-I701 HydrophobicContact CD2-CD1 3.85Å; L686-I701 HydrophobicContact CD2-CG1 4.4Å; L686-I701 HydrophobicContact CD2-CG2 4.4Å; L686-I701 HydrophobicContact CG-CD1 4.14Å; L687-I701 HydrophobicContact CD2-CD1 3.56Å; L687-I701 HydrophobicContact CG-CD1 4.3Å; V696-I701 HydrophobicContact CG1-CG1 4.18Å; I701-V729 HydrophobicContact CG2-CG1 4.26Å; I701-K730 PolarHBondContact O-N 2.78Å
702	T	97.7	Very high	94.8	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	129.3	169.1	-56.6	0	0	0	0	109.9	A627 I628 V629 L731 V733 I922 M926	A627-T702 PolarHBondContact O-N 2.91Å; I628-T702 CarbonylContact C-O 3.46Å; I628-T702 WeakPolarHBondContact CA-O 3.49Å; V629-T702 PolarHBondContact N-O 3.13Å; T702-L731 WeakPolarHBondContact CA-O 3.26Å; T702-L731 HydrophobicContact CG2-CB 4.2Å; T702-L731 HydrophobicContact CG2-CD2 4.03Å; T702-L731 HydrophobicContact CG2-CG 4.22Å; T702-V733 HydrophobicContact CG2-CG2 3.74Å; T702-I922 HydrophobicContact CG2-CD1 4.3Å; T702-I922 HydrophobicContact CG2-CG1 4.33Å; T702-I922 HydrophobicContact CG2-CG2 4.49Å; T702-M926 WeakPolarHBondContact OG1-CE 3.47Å
703	L	98.2	Very high	95.3	Very high	1 Å²	1	26 Å²	26	1%	0.005	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	116.3	168.6	-174.9	55.1	0	0	0	109.1	V629 I631 I683 A713 V716 V729 L731 Q732 V733	V629-L703 HydrophobicContact CB-CD1 4Å; V629-L703 HydrophobicContact CG1-CD1 4.04Å; I631-L703 HydrophobicContact CD1-CD1 3.69Å; I631-L703 HydrophobicContact CD1-CG 4.43Å; I631-L703 HydrophobicContact CG1-CD1 4.13Å; I683-L703 HydrophobicContact CD1-CD1 3.99Å; I683-L703 HydrophobicContact CG1-CD1 4.4Å; L703-A713 HydrophobicContact CD2-CB 4.31Å; L703-A713 WeakPolarHBondContact CD2-O 3.01Å; L703-A713 HydrophobicContact CG-CB 3.92Å; L703-V716 HydrophobicContact CD2-CB 4.11Å; L703-V716 HydrophobicContact CD2-CG1 4Å; L703-V729 HydrophobicContact CB-CG1 4.07Å; L703-L731 PolarHBondContact N-O 2.86Å; L703-Q732 CarbonylContact O-C 3.57Å; L703-Q732 WeakPolarHBondContact O-CA 3.41Å; L703-V733 PolarHBondContact O-N 2.99Å
704	I	98.4	Very high	95.7	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.005	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	141.7	-176.4	-177.7	167.2	0	0	0	110.3	I628 V629 F630 I631 L651 V733 I735 I918 I922	I628-I704 HydrophobicContact CG2-CB 4.45Å; I628-I704 HydrophobicContact CG2-CG2 3.32Å; V629-I704 WeakPolarHBondContact O-CG2 3.45Å; V629-I704 PolarHBondContact O-N 3.25Å; F630-I704 CarbonylContact C-O 3.55Å; F630-I704 WeakPolarHBondContact CA-O 3.45Å; F630-I704 HydrophobicContact CB-CG2 3.92Å; F630-I704 HydrophobicContact CD2-CD1 4.38Å; F630-I704 HydrophobicContact CD2-CG1 4.3Å; F630-I704 HydrophobicContact CD2-CG2 3.49Å; F630-I704 VanDerWaalsContact CD2-CG2 3.49Å; F630-I704 HydrophobicContact CE2-CD1 4.29Å; F630-I704 HydrophobicContact CE2-CG1 4.29Å; F630-I704 HydrophobicContact CE2-CG2 4.29Å; F630-I704 HydrophobicContact CG-CG2 4.01Å; I631-I704 PolarHBondContact N-O 2.93Å; L651-I704 HydrophobicContact CD2-CD1 3.95Å; L651-I704 HydrophobicContact CD2-CG2 4.38Å; I704-V733 VanDerWaalsContact CA-O 3.31Å; I704-V733 WeakPolarHBondContact CA-O 3.18Å; I704-V733 HydrophobicContact CB-CB 3.91Å; I704-V733 HydrophobicContact CD1-CB 3.99Å; I704-V733 HydrophobicContact CD1-CG1 3.72Å; I704-V733 HydrophobicContact CG1-CB 3.71Å; I704-V733 HydrophobicContact CG1-CG1 3.78Å; I704-I735 HydrophobicContact CD1-CD1 4Å; I704-I735 HydrophobicContact CG1-CD1 4.05Å; I704-I918 HydrophobicContact CD1-CG2 3.98Å; I704-I922 HydrophobicContact CD1-CD1 4.09Å
705	G	98.3	Very high	96.2	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	154	169.6	0	0	0	0	0	113.1	I631 G710 V733 I735	I631-G705 WeakPolarHBondContact O-CA 3.38Å; G705-G710 VanDerWaalsContact O-CA 3.32Å; G705-G710 WeakPolarHBondContact O-CA 3.32Å; G705-V733 PolarHBondContact N-O 3.22Å; G705-I735 PolarHBondContact O-N 3.22Å
706	D	97.6	Very high	96.7	Very high	2 Å²	2	11.9 Å²	11.9	1%	0.011	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	142.2	-177.7	80.7	-59.9	0	0	0	112	I631 G633 Y644 A708 G709 G710 I735 Y736	I631-D706 PolarHBondContact O-N 2.69Å; G633-D706 WeakPolarHBondContact CA-O 3.49Å; G633-D706 PolarHBondContact N-O 3.31Å; G633-D706 PolarHBondContact N-OD1 2.9Å; Y644-D706 WeakPolarHBondContact CE1-OD1 3.46Å; Y644-D706 VanDerWaalsContact CZ-OD1 3.28Å; Y644-D706 PolarHBondContact OH-OD1 3.4Å; Y644-D706 PolarHBondContact OH-OD2 3.43Å; D706-A708 PolarHBondContact O-N 3.4Å; D706-G709 WeakPolarHBondContact O-CA 3.23Å; D706-G709 PolarHBondContact O-N 2.8Å; D706-G710 PolarHBondContact O-N 3.24Å; D706-I735 CarbonylContact C-O 3.49Å; D706-I735 VanDerWaalsContact CA-O 3.3Å; D706-I735 WeakPolarHBondContact CA-O 3.44Å; D706-I735 HydrophobicContact CB-CB 3.85Å; D706-I735 HydrophobicContact CB-CD1 4.22Å; D706-I735 HydrophobicContact CB-CG1 4.47Å; D706-I735 HydrophobicContact CB-CG2 4.41Å; D706-Y736 HydrophobicContact CB-CD2 4.43Å; D706-Y736 HydrophobicContact CB-CE2 3.57Å; D706-Y736 PolarHBondContact OD2-OH 3.22Å
707	S	97.5	Very high	97	Very high	13 Å²	13	11.6 Å²	11.6	9%	0.091	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	-121.2	-179.8	-173.6	0	0	0	0	111.3	G709 G710 N711 I735 Y736 L738 H899	S707-G709 VanDerWaalsContact C-N 3.26Å; S707-G709 PolarHBondContact O-N 3.21Å; S707-G710 WeakPolarHBondContact O-CA 3.38Å; S707-G710 PolarHBondContact O-N 2.83Å; S707-N711 PolarHBondContact O-N 3.06Å; S707-I735 PolarHBondContact N-O 2.79Å; S707-Y736 WeakPolarHBondContact CA-O 3.49Å; S707-L738 PolarHBondContact O-N 2.88Å; S707-H899 VanDerWaalsContact CB-NE2 3.28Å; S707-H899 WeakPolarHBondContact CB-NE2 3.48Å; S707-H899 PolarHBondContact OG-CE1 2.92Å; S707-H899 VanDerWaalsContact OG-CE1 3.28Å; S707-H899 PolarHBondContact OG-NE2 2.97Å
708	A	97.8	Very high	97.2	Very high	0 Å²	0	8 Å²	8	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-57.6	-32.1	170.1	0	0	0	0	0	113.7	F636 D706 G710 N711 L712	F636-A708 HydrophobicContact CD1-CB 3.8Å; F636-A708 HydrophobicContact CD2-CB 4.02Å; F636-A708 HydrophobicContact CE1-CB 3.68Å; F636-A708 WeakPolarHBondContact CE1-O 3.47Å; F636-A708 HydrophobicContact CE2-CB 3.9Å; F636-A708 HydrophobicContact CG-CB 3.97Å; F636-A708 HydrophobicContact CZ-CB 3.72Å; D706-A708 PolarHBondContact O-N 3.4Å; A708-G710 VanDerWaalsContact C-N 3.28Å; A708-G710 PolarHBondContact O-N 3.34Å; A708-N711 WeakPolarHBondContact O-CB 3.16Å; A708-N711 PolarHBondContact O-N 2.94Å; A708-L712 WeakPolarHBondContact O-CG 3.15Å; A708-L712 PolarHBondContact O-N 2.83Å; A708-L712 VanDerWaalsContact O-N 3.12Å
709	G	98	Very high	97.4	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-67.3	-31.2	172.2	0	0	0	0	0	112.5	I631 H632 D706 S707 L712 A713	I631-G709 WeakPolarHBondContact O-CA 3.42Å; H632-G709 WeakPolarHBondContact O-CA 3.2Å; H632-G709 PolarHBondContact O-N 3.4Å; D706-G709 WeakPolarHBondContact O-CA 3.23Å; D706-G709 PolarHBondContact O-N 2.8Å; S707-G709 VanDerWaalsContact C-N 3.26Å; S707-G709 PolarHBondContact O-N 3.21Å; G709-L712 PolarHBondContact O-N 3.34Å; G709-A713 WeakPolarHBondContact O-CB 3.14Å; G709-A713 PolarHBondContact O-N 2.84Å
710	G	98.2	Very high	97.5	Very high	0 Å²	0	4.5 Å²	4.5	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-67.9	-35.5	172	0	0	0	0	0	112.4	G705 D706 S707 A708 A714	G705-G710 VanDerWaalsContact O-CA 3.32Å; G705-G710 WeakPolarHBondContact O-CA 3.32Å; D706-G710 PolarHBondContact O-N 3.24Å; S707-G710 WeakPolarHBondContact O-CA 3.38Å; S707-G710 PolarHBondContact O-N 2.83Å; A708-G710 VanDerWaalsContact C-N 3.28Å; A708-G710 PolarHBondContact O-N 3.34Å; G710-A714 WeakPolarHBondContact O-CB 3.33Å; G710-A714 PolarHBondContact O-N 3.09Å; G710-A714 VanDerWaalsContact O-N 3.08Å
711	N	98.5	Very high	97.5	Very high	0 Å²	0	4.2 Å²	4.2	0%	0	2%	0.019	C	C	.	.	H	α-helix	trans	-57.2	-53.3	168.6	-176.8	-86.5	0	0	0	111.1	F636 S707 A708 A713 A714 A715 L738 A847 P849	F636-N711 HydrophobicContact CE1-CB 4.03Å; F636-N711 HydrophobicContact CZ-CB 3.78Å; S707-N711 PolarHBondContact O-N 3.06Å; A708-N711 WeakPolarHBondContact O-CB 3.16Å; A708-N711 PolarHBondContact O-N 2.94Å; N711-A713 PolarHBondContact O-N 3Å; N711-A714 PolarHBondContact O-N 3.46Å; N711-A715 WeakPolarHBondContact O-CB 3.25Å; N711-A715 PolarHBondContact O-N 3.04Å; N711-L738 WeakPolarHBondContact CB-O 3.44Å; N711-L738 PolarHBondContact ND2-O 3.43Å; N711-A847 PolarHBondContact ND2-O 3.43Å; N711-P849 VanDerWaalsContact ND2-CD 3.29Å; N711-P849 WeakPolarHBondContact ND2-CD 3.42Å
712	L	98.6	Very high	97.4	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-62.7	-42.1	-178	-64	173.5	0	0	0	111.6	I631 F636 Y664 A675 V676 A708 G709 A714 A715 V716	I631-L712 HydrophobicContact CD1-CB 4.11Å; I631-L712 HydrophobicContact CG2-CB 3.96Å; I631-L712 HydrophobicContact CG2-CD1 3.65Å; I631-L712 HydrophobicContact CG2-CG 4.42Å; F636-L712 HydrophobicContact CD1-CD1 4.35Å; F636-L712 HydrophobicContact CD1-CD2 4.31Å; F636-L712 HydrophobicContact CD1-CG 4.32Å; F636-L712 HydrophobicContact CE1-CD1 4.47Å; F636-L712 HydrophobicContact CE1-CD2 4.05Å; F636-L712 HydrophobicContact CE1-CG 4Å; Y664-L712 HydrophobicContact CD1-CD1 4.04Å; Y664-L712 HydrophobicContact CD2-CD1 4.22Å; Y664-L712 HydrophobicContact CE1-CD1 3.78Å; Y664-L712 HydrophobicContact CE2-CD1 3.98Å; Y664-L712 HydrophobicContact CG-CD1 4.26Å; A675-L712 HydrophobicContact CB-CD1 4Å; A675-L712 HydrophobicContact CB-CD2 3.85Å; V676-L712 HydrophobicContact CB-CD2 4.44Å; V676-L712 HydrophobicContact CG2-CD2 3.75Å; A708-L712 WeakPolarHBondContact O-CG 3.15Å; A708-L712 PolarHBondContact O-N 2.83Å; A708-L712 VanDerWaalsContact O-N 3.12Å; G709-L712 PolarHBondContact O-N 3.34Å; L712-A714 VanDerWaalsContact C-N 3.34Å; L712-A714 PolarHBondContact O-N 3.26Å; L712-A715 PolarHBondContact O-N 3.13Å; L712-V716 WeakPolarHBondContact O-CB 3.27Å; L712-V716 VanDerWaalsContact O-CG2 3.26Å; L712-V716 WeakPolarHBondContact O-CG2 3.41Å; L712-V716 PolarHBondContact O-N 3.19Å
713	A	98.5	Very high	97.2	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-59	-44.3	175.4	0	0	0	0	0	112.1	I631 L703 G709 N711 T717 L734	I631-A713 HydrophobicContact CD1-CB 4.31Å; L703-A713 HydrophobicContact CD2-CB 4.31Å; L703-A713 WeakPolarHBondContact CD2-O 3.01Å; L703-A713 HydrophobicContact CG-CB 3.92Å; G709-A713 WeakPolarHBondContact O-CB 3.14Å; G709-A713 PolarHBondContact O-N 2.84Å; N711-A713 PolarHBondContact O-N 3Å; A713-T717 WeakPolarHBondContact O-CB 3.41Å; A713-T717 PolarHBondContact O-N 3.27Å; A713-T717 VanDerWaalsContact O-N 3.11Å; A713-T717 PolarHBondContact O-OG1 3.43Å; A713-L734 HydrophobicContact CB-CD2 3.71Å
714	A	98.5	Very high	97	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-65.2	-47.8	175.4	0	0	0	0	0	111.8	G710 N711 L712 T717 Q718 L734 L739 P849 Y878	G710-A714 WeakPolarHBondContact O-CB 3.33Å; G710-A714 PolarHBondContact O-N 3.09Å; G710-A714 VanDerWaalsContact O-N 3.08Å; N711-A714 PolarHBondContact O-N 3.46Å; L712-A714 VanDerWaalsContact C-N 3.34Å; L712-A714 PolarHBondContact O-N 3.26Å; A714-T717 PolarHBondContact O-N 2.83Å; A714-Q718 WeakPolarHBondContact O-CG 3.4Å; A714-Q718 PolarHBondContact O-N 3.35Å; A714-L734 HydrophobicContact CB-CD1 4.02Å; A714-L734 HydrophobicContact CB-CD2 4.25Å; A714-L739 HydrophobicContact CB-CD2 3.97Å; A714-P849 HydrophobicContact CB-CB 3.81Å; A714-P849 HydrophobicContact CB-CG 3.9Å; A714-Y878 HydrophobicContact CB-CE1 4.4Å
715	A	98.1	Very high	96.7	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-61.2	-47	-179.9	0	0	0	0	0	112.4	V676 N711 L712 Q718 R719 Q846 P849	V676-A715 HydrophobicContact CG1-CB 4.15Å; N711-A715 WeakPolarHBondContact O-CB 3.25Å; N711-A715 PolarHBondContact O-N 3.04Å; L712-A715 PolarHBondContact O-N 3.13Å; A715-Q718 PolarHBondContact O-N 3.38Å; A715-R719 WeakPolarHBondContact O-CB 3.27Å; A715-R719 PolarHBondContact O-N 3.43Å; A715-Q846 WeakPolarHBondContact CB-O 3.41Å; A715-P849 HydrophobicContact CB-CG 4.28Å
716	V	97.8	Very high	96.3	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-63.6	-43.3	178.2	171.1	0	0	0	0	110.9	V676 C679 E680 I683 L703 L712 Q718 R719 M720	V676-V716 HydrophobicContact CG1-CG2 4.2Å; C679-V716 HydrophobicContact CB-CG2 3.68Å; E680-V716 HydrophobicContact CB-CG1 4.4Å; E680-V716 HydrophobicContact CB-CG2 4.4Å; I683-V716 HydrophobicContact CG1-CG1 4.39Å; L703-V716 HydrophobicContact CD2-CB 4.11Å; L703-V716 HydrophobicContact CD2-CG1 4Å; L712-V716 WeakPolarHBondContact O-CB 3.27Å; L712-V716 VanDerWaalsContact O-CG2 3.26Å; L712-V716 WeakPolarHBondContact O-CG2 3.41Å; L712-V716 PolarHBondContact O-N 3.19Å; V716-Q718 VanDerWaalsContact C-N 3.34Å; V716-Q718 PolarHBondContact O-N 3.17Å; V716-R719 PolarHBondContact O-N 2.8Å; V716-R719 VanDerWaalsContact O-N 3.17Å; V716-M720 HydrophobicContact CG1-CG 4.38Å; V716-M720 HydrophobicContact CG1-SD 4.26Å; V716-M720 WeakPolarHBondContact O-CG 3.44Å; V716-M720 PolarHBondContact O-N 3.04Å
717	T	97.2	Very high	95.8	Very high	2 Å²	2	26.7 Å²	26.7	1%	0.012	14%	0.14	C	C	.	.	H	α-helix	trans	-59.5	-44.8	177	-60	0	0	0	0	111.7	A713 A714 M720 R721 V729 L858 P859	A713-T717 WeakPolarHBondContact O-CB 3.41Å; A713-T717 PolarHBondContact O-N 3.27Å; A713-T717 VanDerWaalsContact O-N 3.11Å; A713-T717 PolarHBondContact O-OG1 3.43Å; A714-T717 PolarHBondContact O-N 2.83Å; T717-M720 PolarHBondContact O-N 3.36Å; T717-R721 PolarHBondContact O-N 3.47Å; T717-R721 VanDerWaalsContact O-N 3.08Å; T717-V729 HydrophobicContact CG2-CG2 3.95Å; T717-L858 HydrophobicContact CG2-CD2 4.06Å; T717-P859 HydrophobicContact CG2-CG 3.38Å
718	Q	97.1	Very high	95.3	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-64.8	-40	175.6	-69.7	-175.5	25.1	0	0	112.2	A714 A715 V716 R721 N722 W845 P849 Q852 L858 Y878	A714-Q718 WeakPolarHBondContact O-CG 3.4Å; A714-Q718 PolarHBondContact O-N 3.35Å; A715-Q718 PolarHBondContact O-N 3.38Å; V716-Q718 VanDerWaalsContact C-N 3.34Å; V716-Q718 PolarHBondContact O-N 3.17Å; Q718-R721 PolarHBondContact O-N 3.29Å; Q718-N722 WeakPolarHBondContact O-CB 3.27Å; Q718-N722 PolarHBondContact O-N 2.99Å; Q718-N722 PolarHBondContact O-ND2 3.46Å; Q718-N722 PolarHBondContact O-OD1 2.9Å; Q718-W845 HydrophobicContact CB-CE3 3.86Å; Q718-W845 HydrophobicContact CB-CH2 4.43Å; Q718-W845 HydrophobicContact CB-CZ3 3.53Å; Q718-P849 PolarHBondContact NE2-O 2.67Å; Q718-P849 VanDerWaalsContact NE2-O 3.07Å; Q718-Q852 VanDerWaalsContact OE1-CG 3.23Å; Q718-L858 HydrophobicContact CB-CD2 4.4Å; Q718-L858 HydrophobicContact CG-CD1 4.08Å; Q718-L858 HydrophobicContact CG-CD2 3.87Å; Q718-Y878 PolarHBondContact NE2-OH 3.27Å
719	R	95.8	Very high	95.1	Very high	17 Å²	17	28.5 Å²	28.5	6%	0.064	15%	0.151	C	C	.	.	H	α-helix	trans	-63.8	-43.2	177.3	-164.3	-174.9	-84.9	179.5	-5.2	111.8	V676 D677 E680 A715 V716 R721 N722 K723 W845	V676-R719 VanDerWaalsContact CG1-CZ 3.48Å; D677-R719 IonicContact OD1-CZ 3.14Å; D677-R719 IonicContact OD1-NH1 3.78Å; D677-R719 PolarHBondContact OD1-NH1 2.91Å; D677-R719 IonicContact OD1-NH2 2.84Å; D677-R719 PolarHBondContact OD1-NH2 3.44Å; E680-R719 WeakPolarHBondContact OE1-CD 3.49Å; E680-R719 WeakPolarHBondContact OE2-CD 3.31Å; E680-R719 IonicContact OE2-CZ 2.74Å; E680-R719 IonicContact OE2-NE 3.75Å; E680-R719 IonicContact OE2-NH1 2.68Å; E680-R719 PolarHBondContact OE2-NH1 3.49Å; A715-R719 WeakPolarHBondContact O-CB 3.27Å; A715-R719 PolarHBondContact O-N 3.43Å; V716-R719 PolarHBondContact O-N 2.8Å; V716-R719 VanDerWaalsContact O-N 3.17Å; R719-R721 PolarHBondContact O-N 3.05Å; R719-N722 PolarHBondContact O-N 3.2Å; R719-K723 HydrophobicContact CG-CD 4.26Å; R719-K723 WeakPolarHBondContact O-CB 2.77Å; R719-K723 WeakPolarHBondContact O-CG 3.27Å; R719-K723 PolarHBondContact O-N 3.33Å; R719-W845 HydrophobicContact CB-CH2 3.88Å; R719-W845 HydrophobicContact CB-CZ3 4.25Å; R719-W845 HydrophobicContact CG-CH2 4.23Å
720	M	94.9	Very high	95	Very high	3 Å²	3	33.7 Å²	33.7	2%	0.015	17%	0.173	C	C	.	.	H	α-helix	trans	-59	-45.2	173.5	-71.3	177.6	77.2	0	0	111.9	I683 L687 V716 T717 K723 G724 V725 V729	I683-M720 HydrophobicContact CG2-CE 3.64Å; I683-M720 HydrophobicContact CG2-SD 3.59Å; I683-M720 VanDerWaalsContact CG2-SD 3.59Å; L687-M720 HydrophobicContact CD1-CE 3.63Å; V716-M720 HydrophobicContact CG1-CG 4.38Å; V716-M720 HydrophobicContact CG1-SD 4.26Å; V716-M720 WeakPolarHBondContact O-CG 3.44Å; V716-M720 PolarHBondContact O-N 3.04Å; T717-M720 PolarHBondContact O-N 3.36Å; M720-K723 PolarHBondContact O-N 2.97Å; M720-G724 PolarHBondContact O-N 3.11Å; M720-G724 VanDerWaalsContact O-N 3.13Å; M720-V725 HydrophobicContact CB-CB 4.23Å; M720-V725 HydrophobicContact CB-CG2 4.44Å; M720-V725 HydrophobicContact CE-CB 4.37Å; M720-V725 HydrophobicContact CE-CG1 3.87Å; M720-V725 PolarHBondContact O-N 3.02Å; M720-V729 HydrophobicContact CE-CG1 4.33Å; M720-V729 HydrophobicContact SD-CG1 4.14Å
721	R	94.9	Very high	95	Very high	48 Å²	48	33.8 Å²	33.8	18%	0.181	17%	0.174	C	C	.	.	H	α-helix	trans	-60.3	-49.2	176.2	-173	-78.6	-58	-127.2	10.9	111	T717 Q718 R719 K723 G724 D854 S856 L858	T717-R721 PolarHBondContact O-N 3.47Å; T717-R721 VanDerWaalsContact O-N 3.08Å; Q718-R721 PolarHBondContact O-N 3.29Å; R719-R721 PolarHBondContact O-N 3.05Å; R721-K723 VanDerWaalsContact C-N 3.28Å; R721-K723 PolarHBondContact O-N 2.86Å; R721-G724 PolarHBondContact O-N 3.24Å; R721-D854 IonicContact CZ-OD2 3.52Å; R721-D854 PolarHBondContact NH1-O 3Å; R721-D854 IonicContact NH1-OD1 3.89Å; R721-D854 IonicContact NH1-OD2 3.94Å; R721-D854 PolarHBondContact NH1-OD2 3.29Å; R721-D854 PolarHBondContact NH2-O 3.4Å; R721-D854 IonicContact NH2-OD2 3.55Å; R721-S856 PolarHBondContact NH1-O 3.35Å; R721-L858 HydrophobicContact CB-CD2 3.97Å; R721-L858 HydrophobicContact CG-CD2 4.2Å
722	N	93.5	Very high	95	Very high	72 Å²	72	33.8 Å²	33.8	39%	0.385	17%	0.174	S	C	.	.	H	α-helix	trans	-64	-32.4	-179.2	-66	-8.1	0	0	0	112.5	Q718 R719 G724 W845 Q852	Q718-N722 WeakPolarHBondContact O-CB 3.27Å; Q718-N722 PolarHBondContact O-N 2.99Å; Q718-N722 PolarHBondContact O-ND2 3.46Å; Q718-N722 PolarHBondContact O-OD1 2.9Å; R719-N722 PolarHBondContact O-N 3.2Å; N722-G724 VanDerWaalsContact C-N 3.32Å; N722-W845 WeakPolarHBondContact ND2-CH2 3.29Å; N722-W845 WeakPolarHBondContact ND2-CZ2 3.4Å; N722-Q852 PolarHBondContact ND2-NE2 3.4Å
723	K	94.6	Very high	95	Very high	129 Å²	129	33.8 Å²	33.8	56%	0.561	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-5.3	174.7	-72	178.4	178.2	178.6	0	113.9	E680 R719 M720 R721 V725	E680-K723 WeakPolarHBondContact OE1-CD 3.43Å; E680-K723 WeakPolarHBondContact OE1-CE 3.32Å; E680-K723 IonicContact OE1-NZ 3.9Å; E680-K723 PolarHBondContact OE1-NZ 2.87Å; E680-K723 IonicContact OE2-NZ 2.75Å; E680-K723 PolarHBondContact OE2-NZ 3.36Å; R719-K723 HydrophobicContact CG-CD 4.26Å; R719-K723 WeakPolarHBondContact O-CB 2.77Å; R719-K723 WeakPolarHBondContact O-CG 3.27Å; R719-K723 PolarHBondContact O-N 3.33Å; M720-K723 PolarHBondContact O-N 2.97Å; R721-K723 VanDerWaalsContact C-N 3.28Å; R721-K723 PolarHBondContact O-N 2.86Å; K723-V725 VanDerWaalsContact C-N 3.32Å; K723-V725 HydrophobicContact CB-CG2 3.93Å; K723-V725 PolarHBondContact O-N 3.49Å
724	G	93.5	Very high	95	Very high	52 Å²	52	33.8 Å²	33.8	54%	0.536	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.6	25	-177.9	0	0	0	0	0	114.5	M720 R721 N722 K726	M720-G724 PolarHBondContact O-N 3.11Å; M720-G724 VanDerWaalsContact O-N 3.13Å; R721-G724 PolarHBondContact O-N 3.24Å; N722-G724 VanDerWaalsContact C-N 3.32Å; G724-K726 PolarHBondContact O-N 2.98Å
725	V	92.3	Very high	95	Very high	19 Å²	19	33.9 Å²	33.9	12%	0.115	17%	0.174	C	C	.	.			trans	-64	130.8	-177.1	178.9	0	0	0	0	110.8	M684 L687 M720 K723 T728	M684-V725 HydrophobicContact CE-CG1 4.07Å; M684-V725 HydrophobicContact CE-CG2 3.96Å; M684-V725 HydrophobicContact SD-CG1 3.83Å; M684-V725 HydrophobicContact SD-CG2 3.94Å; L687-V725 HydrophobicContact CD1-CG1 3.97Å; M720-V725 HydrophobicContact CB-CB 4.23Å; M720-V725 HydrophobicContact CB-CG2 4.44Å; M720-V725 HydrophobicContact CE-CB 4.37Å; M720-V725 HydrophobicContact CE-CG1 3.87Å; M720-V725 PolarHBondContact O-N 3.02Å; K723-V725 VanDerWaalsContact C-N 3.32Å; K723-V725 HydrophobicContact CB-CG2 3.93Å; K723-V725 PolarHBondContact O-N 3.49Å; V725-T728 WeakPolarHBondContact O-CG2 3.49Å
726	K	88.8	Confident	95	Very high	164 Å²	164	33.9 Å²	33.9	71%	0.713	17%	0.174	S	C	*	.	S	Bend	trans	-131.1	140.8	175.7	-64.3	-65	179.5	-174.6	0	110.9	G724 T728	G724-K726 PolarHBondContact O-N 2.98Å; K726-T728 HydrophobicContact CD-CG2 4.2Å
727	P	87.7	Confident	95	Very high	41 Å²	41	33.9 Å²	33.9	27%	0.266	17%	0.174	S	C	.	.	S	Bend	cis	-65.7	151.1	-9.1	29.3	-33.3	0	0	0	111.4	L687 T698	L687-P727 HydrophobicContact CD2-CG 3.96Å; T698-P727 WeakPolarHBondContact O-CG 3.42Å
728	T	88	Confident	95	Very high	47 Å²	47	34 Å²	34	29%	0.288	18%	0.175	S	C	.	.	P	Polyproline II helix	trans	-78.6	163.9	172.6	54	0	0	0	0	109.9	V725 K726	V725-T728 WeakPolarHBondContact O-CG2 3.49Å; K726-T728 HydrophobicContact CD-CG2 4.2Å
729	V	93.8	Very high	95	Very high	5 Å²	5	34 Å²	34	3%	0.03	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-55.1	142	163.8	-69.4	0	0	0	0	110	I701 L703 T717 M720 P859	I701-V729 HydrophobicContact CG2-CG1 4.26Å; L703-V729 HydrophobicContact CB-CG1 4.07Å; T717-V729 HydrophobicContact CG2-CG2 3.95Å; M720-V729 HydrophobicContact CE-CG1 4.33Å; M720-V729 HydrophobicContact SD-CG1 4.14Å; V729-P859 HydrophobicContact CG2-CB 4.2Å; V729-P859 HydrophobicContact CG2-CG 3.72Å; V729-P859 WeakPolarHBondContact O-CB 3.39Å
730	K	96.1	Very high	95	Very high	109 Å²	109	33.2 Å²	33.2	47%	0.474	17%	0.172	S	C	.	.	S	Bend	trans	-81.2	-32.1	-177.3	179.7	65	176.4	-174.4	0	112	S699 I701 M926	S699-K730 WeakPolarHBondContact O-CB 3.3Å; I701-K730 PolarHBondContact O-N 2.78Å; K730-M926 HydrophobicContact CB-CE 3.78Å; K730-M926 HydrophobicContact CB-SD 4.34Å; K730-M926 HydrophobicContact CG-CE 3.6Å; K730-M926 HydrophobicContact CG-SD 4.07Å
731	L	97.9	Very high	95	Very high	2 Å²	2	33 Å²	33	1%	0.01	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	135.6	-177.7	179.4	69.3	0	0	0	109.5	T702 L703 V733 P860 F921 I922 C925 M926	T702-L731 WeakPolarHBondContact CA-O 3.26Å; T702-L731 HydrophobicContact CG2-CB 4.2Å; T702-L731 HydrophobicContact CG2-CD2 4.03Å; T702-L731 HydrophobicContact CG2-CG 4.22Å; L703-L731 PolarHBondContact N-O 2.86Å; L731-V733 HydrophobicContact CD2-CG2 3.72Å; L731-V733 HydrophobicContact CG-CG2 3.87Å; L731-P860 HydrophobicContact CD1-CB 4.26Å; L731-P860 WeakPolarHBondContact CD1-O 3.46Å; L731-F921 HydrophobicContact CD1-CE1 3.96Å; L731-F921 HydrophobicContact CD2-CD1 4.28Å; L731-F921 HydrophobicContact CD2-CE1 4.12Å; L731-I922 HydrophobicContact CD2-CG1 3.99Å; L731-C925 HydrophobicContact CD2-CB 4.14Å; L731-M926 HydrophobicContact CB-CE 3.57Å; L731-M926 HydrophobicContact CD2-CE 4.27Å
732	Q	98.2	Very high	95	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	132.8	165	68.9	-174.3	-61.5	0	0	109.7	L703 L734 P859 P860 A861 L862	L703-Q732 CarbonylContact O-C 3.57Å; L703-Q732 WeakPolarHBondContact O-CA 3.41Å; Q732-L734 HydrophobicContact CB-CD2 4.49Å; Q732-P859 HydrophobicContact CB-CG 4.12Å; Q732-P859 HydrophobicContact CG-CG 4.1Å; Q732-P859 PolarHBondContact NE2-O 3.3Å; Q732-P859 VanDerWaalsContact NE2-O 3.09Å; Q732-P860 PolarHBondContact N-O 3.04Å; Q732-A861 HydrophobicContact CG-CB 3.56Å; Q732-A861 CarbonylContact O-C 3.55Å; Q732-A861 VanDerWaalsContact O-CA 3.28Å; Q732-A861 WeakPolarHBondContact O-CA 3.12Å; Q732-L862 PolarHBondContact O-N 3.39Å
733	V	98.7	Very high	95	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	110.6	178.6	-178.8	0	0	0	0	108.9	T702 L703 I704 G705 L731 I735 L862 I918 I922	T702-V733 HydrophobicContact CG2-CG2 3.74Å; L703-V733 PolarHBondContact O-N 2.99Å; I704-V733 VanDerWaalsContact CA-O 3.31Å; I704-V733 WeakPolarHBondContact CA-O 3.18Å; I704-V733 HydrophobicContact CB-CB 3.91Å; I704-V733 HydrophobicContact CD1-CB 3.99Å; I704-V733 HydrophobicContact CD1-CG1 3.72Å; I704-V733 HydrophobicContact CG1-CB 3.71Å; I704-V733 HydrophobicContact CG1-CG1 3.78Å; G705-V733 PolarHBondContact N-O 3.22Å; L731-V733 HydrophobicContact CD2-CG2 3.72Å; L731-V733 HydrophobicContact CG-CG2 3.87Å; V733-I735 HydrophobicContact CG1-CG1 4.17Å; V733-L862 CarbonylContact C-O 3.59Å; V733-L862 WeakPolarHBondContact CA-O 3.35Å; V733-L862 HydrophobicContact CB-CB 4.49Å; V733-L862 HydrophobicContact CG1-CB 4.2Å; V733-L862 HydrophobicContact CG1-CD2 3.96Å; V733-L862 HydrophobicContact CG1-CG 4.23Å; V733-L862 HydrophobicContact CG2-CB 4.15Å; V733-I918 HydrophobicContact CG1-CG2 4.02Å; V733-I922 HydrophobicContact CG2-CD1 4.17Å; V733-I922 HydrophobicContact CG2-CG1 4.03Å
734	L	98.6	Very high	95	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	110.2	-172.8	-47.9	-177.4	0	0	0	109.1	A713 A714 Q732 P737 L862 I863 V864 Y878	A713-L734 HydrophobicContact CB-CD2 3.71Å; A714-L734 HydrophobicContact CB-CD1 4.02Å; A714-L734 HydrophobicContact CB-CD2 4.25Å; Q732-L734 HydrophobicContact CB-CD2 4.49Å; L734-P737 HydrophobicContact CB-CB 4.1Å; L734-P737 HydrophobicContact CB-CG 3.94Å; L734-L862 PolarHBondContact N-O 2.86Å; L734-I863 HydrophobicContact CB-CG1 4.41Å; L734-I863 HydrophobicContact CD1-CG1 4.47Å; L734-I863 WeakPolarHBondContact O-CA 3.49Å; L734-V864 PolarHBondContact O-N 3.42Å; L734-Y878 HydrophobicContact CD1-CD1 3.75Å; L734-Y878 HydrophobicContact CD1-CE1 3.44Å; L734-Y878 VanDerWaalsContact CD1-CE1 3.44Å
735	I	98.4	Very high	95	Very high	2 Å²	2	21.9 Å²	21.9	1%	0.01	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	119	-173.7	-42.7	173.9	0	0	0	109.4	I704 G705 D706 S707 V733 P737 V864 L902 I918	I704-I735 HydrophobicContact CD1-CD1 4Å; I704-I735 HydrophobicContact CG1-CD1 4.05Å; G705-I735 PolarHBondContact O-N 3.22Å; D706-I735 CarbonylContact C-O 3.49Å; D706-I735 VanDerWaalsContact CA-O 3.3Å; D706-I735 WeakPolarHBondContact CA-O 3.44Å; D706-I735 HydrophobicContact CB-CB 3.85Å; D706-I735 HydrophobicContact CB-CD1 4.22Å; D706-I735 HydrophobicContact CB-CG1 4.47Å; D706-I735 HydrophobicContact CB-CG2 4.41Å; S707-I735 PolarHBondContact N-O 2.79Å; V733-I735 HydrophobicContact CG1-CG1 4.17Å; I735-P737 VanDerWaalsContact C-CD 3.48Å; I735-P737 VanDerWaalsContact C-N 3.25Å; I735-P737 VanDerWaalsContact O-N 3.12Å; I735-V864 HydrophobicContact CB-CB 4.38Å; I735-V864 HydrophobicContact CG2-CB 3.9Å; I735-V864 HydrophobicContact CG2-CG1 4.09Å; I735-L902 HydrophobicContact CB-CD1 4.47Å; I735-L902 HydrophobicContact CD1-CD1 3.48Å; I735-L902 VanDerWaalsContact CD1-CD1 3.48Å; I735-L902 HydrophobicContact CG2-CD1 3.73Å; I735-I918 HydrophobicContact CD1-CD1 3.88Å; I735-I918 HydrophobicContact CG1-CD1 4.3Å
736	Y	97.1	Very high	95.1	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.103	C	C	.	.	S	Bend	trans	34.6	54.4	-173.8	37.8	-112	0	0	0	112.9	D706 S707 V864 T866 D869 H899 M901 L902	D706-Y736 HydrophobicContact CB-CD2 4.43Å; D706-Y736 HydrophobicContact CB-CE2 3.57Å; D706-Y736 PolarHBondContact OD2-OH 3.22Å; S707-Y736 WeakPolarHBondContact CA-O 3.49Å; Y736-V864 WeakPolarHBondContact CA-O 2.84Å; Y736-V864 PolarHBondContact N-O 2.83Å; Y736-T866 HydrophobicContact CD1-CG2 4.16Å; Y736-D869 WeakPolarHBondContact CB-OD2 3.44Å; Y736-H899 AromaticContact CD2-CE1 3.64Å; Y736-M901 HydrophobicContact CE1-CE 4.42Å; Y736-M901 HydrophobicContact CE1-CG 4.22Å; Y736-L902 HydrophobicContact CE1-CD1 4.42Å; Y736-L902 HydrophobicContact CE1-CG 4.17Å; Y736-L902 WeakPolarHBondContact OH-CD1 3.38Å; Y736-L902 VanDerWaalsContact OH-CG 3.31Å; Y736-L902 WeakPolarHBondContact OH-CG 3.43Å
737	P	98.2	Very high	95.3	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.069	C	C	.	.			trans	-76.3	141.3	-163.4	33.5	-38.5	0	0	0	112.4	L734 I735 L739	L734-P737 HydrophobicContact CB-CB 4.1Å; L734-P737 HydrophobicContact CB-CG 3.94Å; I735-P737 VanDerWaalsContact C-CD 3.48Å; I735-P737 VanDerWaalsContact C-N 3.25Å; I735-P737 VanDerWaalsContact O-N 3.12Å; P737-L739 HydrophobicContact CB-CD1 4Å; P737-L739 HydrophobicContact CB-CD2 3.99Å; P737-L739 HydrophobicContact CB-CG 3.83Å; P737-L739 HydrophobicContact CG-CD1 3.56Å; P737-L739 HydrophobicContact CG-CD2 4.45Å; P737-L739 HydrophobicContact CG-CG 3.94Å
738	L	97.7	Very high	95.6	Very high	4 Å²	4	11.2 Å²	11.2	2%	0.021	6%	0.057	C	C	.	.			trans	-81.2	115.4	168.9	178	53	0	0	0	108.9	F636 S707 N711 F741 I767 L871	F636-L738 HydrophobicContact CE2-CD2 3.96Å; F636-L738 HydrophobicContact CZ-CD2 4.49Å; S707-L738 PolarHBondContact O-N 2.88Å; N711-L738 WeakPolarHBondContact CB-O 3.44Å; N711-L738 PolarHBondContact ND2-O 3.43Å; L738-F741 HydrophobicContact CD1-CD1 4.43Å; L738-F741 HydrophobicContact CD1-CE1 4.13Å; L738-F741 HydrophobicContact CD2-CE1 3.64Å; L738-F741 HydrophobicContact CD2-CZ 4.11Å; L738-F741 HydrophobicContact CG-CE1 3.88Å; L738-F741 HydrophobicContact CG-CZ 4.11Å; L738-I767 HydrophobicContact CD1-CG2 4.27Å; L738-I767 HydrophobicContact CD2-CG2 4.24Å; L738-L871 HydrophobicContact CB-CD1 3.74Å; L738-L871 HydrophobicContact CB-CD2 4.46Å; L738-L871 HydrophobicContact CD1-CD1 4.42Å; L738-L871 HydrophobicContact CD1-CD2 3.62Å
739	L	97.3	Very high	95.9	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	4%	0.044	C	C	.	.			trans	-128.8	-7.1	-168.6	-62.1	173.3	0	0	0	114.6	A714 P737 S848 P849 L850 D874 Y878	A714-L739 HydrophobicContact CB-CD2 3.97Å; P737-L739 HydrophobicContact CB-CD1 4Å; P737-L739 HydrophobicContact CB-CD2 3.99Å; P737-L739 HydrophobicContact CB-CG 3.83Å; P737-L739 HydrophobicContact CG-CD1 3.56Å; P737-L739 HydrophobicContact CG-CD2 4.45Å; P737-L739 HydrophobicContact CG-CG 3.94Å; L739-S848 CarbonylContact O-C 3.39Å; L739-S848 VanDerWaalsContact O-C 3.23Å; L739-S848 VanDerWaalsContact O-CA 3.29Å; L739-S848 WeakPolarHBondContact O-CA 3.29Å; L739-P849 HydrophobicContact CD2-CB 3.91Å; L739-P849 HydrophobicContact CD2-CG 3.9Å; L739-L850 HydrophobicContact CB-CB 4.15Å; L739-L850 VanDerWaalsContact O-CB 3.3Å; L739-L850 WeakPolarHBondContact O-CB 3.42Å; L739-L850 PolarHBondContact O-N 2.94Å; L739-L850 VanDerWaalsContact O-N 3.14Å; L739-D874 HydrophobicContact CB-CB 4.22Å; L739-D874 PolarHBondContact N-OD2 3.23Å; L739-Y878 HydrophobicContact CD1-CD1 3.98Å; L739-Y878 HydrophobicContact CD1-CD2 3.84Å; L739-Y878 HydrophobicContact CD1-CG 3.48Å; L739-Y878 VanDerWaalsContact CD1-CG 3.48Å
740	Q	95.3	Very high	95.8	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	4%	0.044	C	C	.	.			trans	-147.7	158	173.8	62.5	79.6	28.4	0	0	111.8	S742 D743 L850 M851 D874	Q740-S742 PolarHBondContact OE1-OG 3.06Å; Q740-S742 VanDerWaalsContact OE1-OG 3.13Å; Q740-D743 PolarHBondContact NE2-O 3.41Å; Q740-L850 HydrophobicContact CB-CB 4.35Å; Q740-L850 HydrophobicContact CB-CD2 4.14Å; Q740-L850 HydrophobicContact CG-CD2 4.02Å; Q740-M851 HydrophobicContact CB-CE 4.13Å; Q740-D874 WeakPolarHBondContact CG-OD1 3.28Å; Q740-D874 PolarHBondContact N-OD2 2.9Å; Q740-D874 VanDerWaalsContact N-OD2 3.15Å; Q740-D874 PolarHBondContact NE2-OD1 3.25Å
741	F	95.7	Very high	95.6	Very high	0 Å²	0	4.6 Å²	4.6	0%	0	2%	0.024	C	C	.	.	S	Bend	trans	-128.7	19.9	176.7	-53.8	-84.6	0	0	0	112.6	F636 L738 F744 S771 F775 H790 M838 L842 A847 S848	F636-F741 HydrophobicContact CE2-CZ 4.15Å; F636-F741 HydrophobicContact CZ-CZ 4.45Å; L738-F741 HydrophobicContact CD1-CD1 4.43Å; L738-F741 HydrophobicContact CD1-CE1 4.13Å; L738-F741 HydrophobicContact CD2-CE1 3.64Å; L738-F741 HydrophobicContact CD2-CZ 4.11Å; L738-F741 HydrophobicContact CG-CE1 3.88Å; L738-F741 HydrophobicContact CG-CZ 4.11Å; F741-F744 HydrophobicContact CB-CE2 4.47Å; F741-F744 HydrophobicContact CB-CZ 4.14Å; F741-F744 HydrophobicContact CD1-CZ 4.31Å; F741-F744 VanDerWaalsContact O-CE2 3.25Å; F741-F744 WeakPolarHBondContact O-CE2 2.98Å; F741-S771 VanDerWaalsContact CE1-OG 3.25Å; F741-S771 WeakPolarHBondContact CE1-OG 3.3Å; F741-F775 HydrophobicContact CB-CE2 4.39Å; F741-F775 HydrophobicContact CD1-CE2 4.03Å; F741-F775 HydrophobicContact CD1-CZ 4.31Å; F741-F775 AromaticContact CD2-CE2 3.93Å; F741-F775 HydrophobicContact CD2-CE2 3.93Å; F741-F775 AromaticContact CD2-CZ 3.56Å; F741-F775 HydrophobicContact CD2-CZ 3.56Å; F741-F775 HydrophobicContact CE1-CE2 4.22Å; F741-F775 HydrophobicContact CE1-CZ 4.21Å; F741-F775 HydrophobicContact CE2-CE1 4.47Å; F741-F775 HydrophobicContact CE2-CE2 4.15Å; F741-F775 AromaticContact CE2-CZ 3.47Å; F741-F775 HydrophobicContact CE2-CZ 3.47Å; F741-F775 VanDerWaalsContact CE2-CZ 3.47Å; F741-F775 AromaticContact CG-CE2 3.87Å; F741-F775 HydrophobicContact CG-CE2 3.87Å; F741-F775 AromaticContact CG-CZ 4Å; F741-F775 HydrophobicContact CG-CZ 4Å; F741-F775 HydrophobicContact CZ-CE2 4.3Å; F741-F775 AromaticContact CZ-CZ 3.83Å; F741-F775 HydrophobicContact CZ-CZ 3.83Å; F741-H790 PolarHBondContact O-NE2 3.16Å; F741-M838 HydrophobicContact CB-CE 4.21Å; F741-L842 VanDerWaalsContact C-CD2 3.45Å; F741-L842 HydrophobicContact CB-CD2 3.93Å; F741-L842 WeakPolarHBondContact O-CD2 3.25Å; F741-A847 HydrophobicContact CE2-CB 4.36Å; F741-A847 WeakPolarHBondContact CE2-O 3.38Å; F741-S848 WeakPolarHBondContact CD2-OG 3.35Å
742	S	93.9	Very high	95.3	Very high	5 Å²	5	4.7 Å²	4.7	4%	0.035	3%	0.025	C	C	.	.	S	Bend	trans	-99.6	-27.5	-173.8	61.8	0	0	0	0	113.6	Q740 N788 V791 F799 Q803	Q740-S742 PolarHBondContact OE1-OG 3.06Å; Q740-S742 VanDerWaalsContact OE1-OG 3.13Å; S742-N788 PolarHBondContact O-OD1 2.96Å; S742-V791 VanDerWaalsContact O-CG2 3.23Å; S742-V791 WeakPolarHBondContact O-CG2 3.44Å; S742-F799 VanDerWaalsContact CB-CD2 3.45Å; S742-F799 VanDerWaalsContact CB-CE2 3.45Å; S742-Q803 PolarHBondContact OG-NE2 2.97Å; S742-Q803 PolarHBondContact OG-OE1 3.31Å
743	D	93.8	Very high	94.7	Very high	26 Å²	26	10.6 Å²	10.6	14%	0.139	5%	0.052	C	C	.	.			trans	-134.9	107.7	-176.2	-162.6	-16.7	0	0	0	111.6	Q740 L745 T746 N788 Q803 H805	Q740-D743 PolarHBondContact NE2-O 3.41Å; D743-L745 WeakPolarHBondContact OD1-CA 3.23Å; D743-L745 PolarHBondContact OD1-N 3.32Å; D743-T746 HydrophobicContact CB-CG2 4.28Å; D743-T746 WeakPolarHBondContact O-CG2 3.33Å; D743-N788 WeakPolarHBondContact CA-OD1 3.37Å; D743-N788 PolarHBondContact OD1-ND2 2.82Å; D743-Q803 VanDerWaalsContact CB-NE2 3.31Å; D743-H805 IonicContact OD2-CE1 2.67Å; D743-H805 IonicContact OD2-NE2 3.15Å; D743-H805 PolarHBondContact OD2-NE2 3.46Å; D743-H805 VanDerWaalsContact OD2-NE2 3.11Å
744	F	93.9	Very high	94	Very high	6 Å²	6	15.4 Å²	15.4	3%	0.026	7%	0.071	C	C	.	.	S	Bend	trans	-105.9	17.3	174.9	-62.4	-78.4	0	0	0	111.8	F741 Y749 V768 V785 N788 H790	F741-F744 HydrophobicContact CB-CE2 4.47Å; F741-F744 HydrophobicContact CB-CZ 4.14Å; F741-F744 HydrophobicContact CD1-CZ 4.31Å; F741-F744 VanDerWaalsContact O-CE2 3.25Å; F741-F744 WeakPolarHBondContact O-CE2 2.98Å; F744-Y749 HydrophobicContact CB-CD1 4.23Å; F744-Y749 HydrophobicContact CB-CE1 4.33Å; F744-Y749 HydrophobicContact CD1-CD1 4.25Å; F744-Y749 AromaticContact CD1-CE1 3.53Å; F744-Y749 HydrophobicContact CD1-CE1 3.53Å; F744-Y749 HydrophobicContact CD1-CE2 4.16Å; F744-Y749 AromaticContact CD1-CZ 3.47Å; F744-Y749 VanDerWaalsContact CD1-CZ 3.47Å; F744-Y749 WeakPolarHBondContact CD1-OH 3.43Å; F744-Y749 HydrophobicContact CE1-CE1 4.36Å; F744-Y749 WeakPolarHBondContact CE1-OH 3.32Å; F744-Y749 HydrophobicContact CG-CE1 4.42Å; F744-Y749 WeakPolarHBondContact O-CB 3.46Å; F744-V768 HydrophobicContact CD1-CG2 3.48Å; F744-V768 VanDerWaalsContact CD1-CG2 3.48Å; F744-V768 HydrophobicContact CD2-CG2 4.17Å; F744-V768 HydrophobicContact CE1-CG2 3.53Å; F744-V768 HydrophobicContact CE2-CG2 4.19Å; F744-V768 HydrophobicContact CG-CG2 3.82Å; F744-V768 HydrophobicContact CZ-CG2 3.89Å; F744-V785 HydrophobicContact CD2-CG1 3.56Å; F744-V785 WeakPolarHBondContact CD2-O 3.01Å; F744-V785 HydrophobicContact CE2-CG1 3.28Å; F744-V785 HydrophobicContact CZ-CG1 4.11Å; F744-N788 PolarHBondContact N-OD1 3.46Å; F744-H790 AromaticContact CD2-CE1 3.82Å; F744-H790 AromaticContact CE2-CE1 3.92Å; F744-H790 AromaticContact CE2-NE2 3.9Å
745	L	93	Very high	93.3	Very high	29 Å²	29	18.6 Å²	18.6	15%	0.152	9%	0.087	C	C	.	.			trans	-119.9	20.7	178.1	-63.2	171.8	0	0	0	111.8	D743 Q750 L786 N788 E822 A823 V825	D743-L745 WeakPolarHBondContact OD1-CA 3.23Å; D743-L745 PolarHBondContact OD1-N 3.32Å; L745-Q750 PolarHBondContact O-NE2 3.35Å; L745-L786 WeakPolarHBondContact CD2-O 3.33Å; L745-N788 HydrophobicContact CD1-CB 4.13Å; L745-E822 WeakPolarHBondContact CD1-O 3.47Å; L745-A823 HydrophobicContact CB-CB 4.12Å; L745-V825 HydrophobicContact CD1-CG2 4.43Å
746	T	94.1	Very high	92.3	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.088	C	C	.	.	S	Bend	trans	-60.3	159.5	172.3	80	0	0	0	0	110.9	D743 S748 Y749 Q750 D873 W877	D743-T746 HydrophobicContact CB-CG2 4.28Å; D743-T746 WeakPolarHBondContact O-CG2 3.33Å; T746-S748 PolarHBondContact O-N 3.42Å; T746-S748 PolarHBondContact OG1-N 3.01Å; T746-S748 PolarHBondContact OG1-OG 2.68Å; T746-Y749 HydrophobicContact CG2-CD2 4.28Å; T746-Y749 PolarHBondContact O-N 3.38Å; T746-Y749 WeakPolarHBondContact OG1-CD2 3.3Å; T746-Y749 PolarHBondContact OG1-N 3.14Å; T746-Q750 PolarHBondContact O-N 3.43Å; T746-D873 WeakPolarHBondContact CB-OD2 3.33Å; T746-D873 PolarHBondContact OG1-OD2 3Å; T746-W877 HydrophobicContact CG2-CH2 3.51Å; T746-W877 HydrophobicContact CG2-CZ3 3.84Å
747	P	94.6	Very high	91	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-51.5	-39.7	174.2	-24.6	29.1	0	0	0	114.6	Q750 L751 L808 Y812 R813 Y818 D873	P747-Q750 PolarHBondContact O-N 3.07Å; P747-L751 WeakPolarHBondContact O-CB 3.47Å; P747-L751 PolarHBondContact O-N 3.38Å; P747-L808 HydrophobicContact CG-CD1 3.71Å; P747-Y812 WeakPolarHBondContact CB-O 3.19Å; P747-R813 HydrophobicContact CB-CG 4.5Å; P747-R813 HydrophobicContact CG-CG 3.86Å; P747-Y818 HydrophobicContact CB-CD2 3.76Å; P747-Y818 HydrophobicContact CB-CE2 4.3Å; P747-Y818 HydrophobicContact CB-CG 3.95Å; P747-Y818 HydrophobicContact CG-CD1 4.34Å; P747-Y818 HydrophobicContact CG-CD2 3.6Å; P747-Y818 HydrophobicContact CG-CE1 4.36Å; P747-Y818 HydrophobicContact CG-CE2 3.63Å; P747-Y818 HydrophobicContact CG-CG 3.96Å; P747-D873 WeakPolarHBondContact CD-OD2 3.29Å
748	S	94.4	Very high	89.5	Confident	1 Å²	1	22.1 Å²	22.1	1%	0.007	12%	0.123	C	C	.	.	H	α-helix	trans	-66.9	-38.6	175.8	56.3	0	0	0	0	113.2	T746 A752 D869 P870 D873	T746-S748 PolarHBondContact O-N 3.42Å; T746-S748 PolarHBondContact OG1-N 3.01Å; T746-S748 PolarHBondContact OG1-OG 2.68Å; S748-A752 VanDerWaalsContact O-CB 3.3Å; S748-A752 WeakPolarHBondContact O-CB 2.8Å; S748-A752 PolarHBondContact O-N 2.71Å; S748-D869 WeakPolarHBondContact CB-O 3.38Å; S748-P870 WeakPolarHBondContact CB-O 3.17Å; S748-P870 PolarHBondContact OG-O 2.96Å; S748-D873 PolarHBondContact N-OD2 3.3Å; S748-D873 WeakPolarHBondContact OG-CB 3.46Å; S748-D873 PolarHBondContact OG-N 3Å; S748-D873 PolarHBondContact OG-OD2 3.32Å; S748-D873 VanDerWaalsContact OG-OD2 3.1Å
749	Y	93.5	Very high	88.4	Confident	3 Å²	3	21.9 Å²	21.9	1%	0.012	12%	0.122	C	C	.	.	H	α-helix	trans	-66.8	-42	174.4	-92	-87	0	0	0	112.5	F744 T746 A752 H753 P764 I767 P870 L871	F744-Y749 HydrophobicContact CB-CD1 4.23Å; F744-Y749 HydrophobicContact CB-CE1 4.33Å; F744-Y749 HydrophobicContact CD1-CD1 4.25Å; F744-Y749 AromaticContact CD1-CE1 3.53Å; F744-Y749 HydrophobicContact CD1-CE1 3.53Å; F744-Y749 HydrophobicContact CD1-CE2 4.16Å; F744-Y749 AromaticContact CD1-CZ 3.47Å; F744-Y749 VanDerWaalsContact CD1-CZ 3.47Å; F744-Y749 WeakPolarHBondContact CD1-OH 3.43Å; F744-Y749 HydrophobicContact CE1-CE1 4.36Å; F744-Y749 WeakPolarHBondContact CE1-OH 3.32Å; F744-Y749 HydrophobicContact CG-CE1 4.42Å; F744-Y749 WeakPolarHBondContact O-CB 3.46Å; T746-Y749 HydrophobicContact CG2-CD2 4.28Å; T746-Y749 PolarHBondContact O-N 3.38Å; T746-Y749 WeakPolarHBondContact OG1-CD2 3.3Å; T746-Y749 PolarHBondContact OG1-N 3.14Å; Y749-A752 PolarHBondContact O-N 3.04Å; Y749-H753 WeakPolarHBondContact O-CB 3.25Å; Y749-H753 PolarHBondContact O-N 3.21Å; Y749-P764 HydrophobicContact CD1-CB 3.73Å; Y749-P764 HydrophobicContact CD1-CG 3.89Å; Y749-P764 HydrophobicContact CE1-CB 3.94Å; Y749-P764 HydrophobicContact CE1-CG 4.34Å; Y749-I767 WeakPolarHBondContact OH-CG2 3.26Å; Y749-P870 HydrophobicContact CD1-CB 3.89Å; Y749-P870 HydrophobicContact CD2-CB 4.16Å; Y749-P870 WeakPolarHBondContact CD2-O 3.35Å; Y749-P870 HydrophobicContact CE1-CB 3.66Å; Y749-P870 HydrophobicContact CE2-CB 3.98Å; Y749-P870 VanDerWaalsContact CE2-O 3.22Å; Y749-P870 WeakPolarHBondContact CE2-O 3.36Å; Y749-P870 HydrophobicContact CG-CB 4.12Å; Y749-L871 HydrophobicContact CE2-CD2 4.17Å; Y749-L871 VanDerWaalsContact OH-CD2 3.3Å; Y749-L871 WeakPolarHBondContact OH-CD2 3.04Å
750	Q	92.5	Very high	87.2	Confident	8 Å²	8	22.2 Å²	22.2	4%	0.037	12%	0.124	C	C	.	.	H	α-helix	trans	-65.1	-42.4	176.2	-67.2	-173.6	27.6	0	0	111.7	L745 T746 P747 H753 R754 N819	L745-Q750 PolarHBondContact O-NE2 3.35Å; T746-Q750 PolarHBondContact O-N 3.43Å; P747-Q750 PolarHBondContact O-N 3.07Å; Q750-H753 PolarHBondContact O-N 2.97Å; Q750-R754 VanDerWaalsContact O-CG 3.28Å; Q750-R754 WeakPolarHBondContact O-CG 3.48Å; Q750-R754 PolarHBondContact O-N 3.07Å; Q750-R754 VanDerWaalsContact O-N 3.09Å; Q750-N819 PolarHBondContact NE2-O 3.11Å; Q750-N819 PolarHBondContact OE1-O 3.16Å
751	L	91.6	Very high	86.3	Confident	11 Å²	11	22.7 Å²	22.7	6%	0.058	13%	0.126	C	C	.	.	H	α-helix	trans	-58.1	-50.4	173.1	179	62.8	0	0	0	111.2	P747 H753 R754 L755 F817	P747-L751 WeakPolarHBondContact O-CB 3.47Å; P747-L751 PolarHBondContact O-N 3.38Å; L751-H753 PolarHBondContact O-N 3.1Å; L751-R754 PolarHBondContact O-N 3.33Å; L751-L755 HydrophobicContact CD1-CD1 3.32Å; L751-L755 HydrophobicContact CD1-CG 3.95Å; L751-L755 HydrophobicContact CG-CD1 3.97Å; L751-L755 WeakPolarHBondContact O-CB 3.49Å; L751-L755 PolarHBondContact O-N 2.86Å; L751-F817 HydrophobicContact CB-CD2 3.71Å; L751-F817 HydrophobicContact CB-CE2 4.06Å; L751-F817 HydrophobicContact CB-CG 4.18Å; L751-F817 HydrophobicContact CD1-CB 3.82Å; L751-F817 HydrophobicContact CD1-CD1 3.64Å; L751-F817 HydrophobicContact CD1-CD2 3.95Å; L751-F817 HydrophobicContact CD1-CE1 4.07Å; L751-F817 HydrophobicContact CD1-CE2 4.41Å; L751-F817 HydrophobicContact CD1-CG 3.55Å; L751-F817 HydrophobicContact CD1-CZ 4.46Å; L751-F817 HydrophobicContact CD2-CE1 4.5Å; L751-F817 HydrophobicContact CD2-CE2 4.38Å; L751-F817 HydrophobicContact CD2-CZ 4.31Å; L751-F817 HydrophobicContact CG-CD2 4.31Å; L751-F817 HydrophobicContact CG-CG 4.39Å
752	A	90	Very high	85.5	Confident	3 Å²	3	24.5 Å²	24.5	3%	0.025	14%	0.138	C	C	.	.	H	α-helix	trans	-64.6	-38.6	-179.7	0	0	0	0	0	112.4	S748 Y749 R754 L755 L756 G757 P764 P870	S748-A752 VanDerWaalsContact O-CB 3.3Å; S748-A752 WeakPolarHBondContact O-CB 2.8Å; S748-A752 PolarHBondContact O-N 2.71Å; Y749-A752 PolarHBondContact O-N 3.04Å; A752-R754 VanDerWaalsContact C-N 3.3Å; A752-R754 PolarHBondContact O-N 3.14Å; A752-L755 PolarHBondContact O-N 3.44Å; A752-L756 HydrophobicContact CB-CD1 4.12Å; A752-L756 VanDerWaalsContact O-CA 3.3Å; A752-L756 WeakPolarHBondContact O-CA 3.4Å; A752-L756 VanDerWaalsContact O-CB 3.25Å; A752-L756 WeakPolarHBondContact O-CB 3.45Å; A752-L756 PolarHBondContact O-N 3.19Å; A752-G757 PolarHBondContact O-N 3.38Å; A752-P764 HydrophobicContact CB-CG 4.04Å; A752-P870 HydrophobicContact CB-CB 4.23Å; A752-P870 HydrophobicContact CB-CG 3.61Å
753	H	85.6	Confident	84.9	Confident	125 Å²	125	25 Å²	25	58%	0.579	14%	0.141	S	C	*	.	H	α-helix	trans	-61.2	-40.2	174.9	-175.5	-85	0	0	0	111.7	Y749 Q750 L751 P764	Y749-H753 WeakPolarHBondContact O-CB 3.25Å; Y749-H753 PolarHBondContact O-N 3.21Å; Q750-H753 PolarHBondContact O-N 2.97Å; L751-H753 PolarHBondContact O-N 3.1Å; H753-P764 HydrophobicContact CB-CG 4.42Å
754	R	85.7	Confident	84.6	Confident	101 Å²	101	24 Å²	24	38%	0.381	14%	0.135	S	C	.	.	H	α-helix	trans	-73.7	-37.4	179.8	-67.6	170.8	-164	-161.3	6.9	113	Q750 L751 A752 S816 F817 E822	Q750-R754 VanDerWaalsContact O-CG 3.28Å; Q750-R754 WeakPolarHBondContact O-CG 3.48Å; Q750-R754 PolarHBondContact O-N 3.07Å; Q750-R754 VanDerWaalsContact O-N 3.09Å; L751-R754 PolarHBondContact O-N 3.33Å; A752-R754 VanDerWaalsContact C-N 3.3Å; A752-R754 PolarHBondContact O-N 3.14Å; R754-S816 PolarHBondContact NH1-O 2.85Å; R754-F817 PolarHBondContact NE-O 3.26Å; R754-F817 VanDerWaalsContact NE-O 3.13Å; R754-F817 PolarHBondContact NH1-O 3.35Å; R754-F817 PolarHBondContact NH2-O 2.7Å; R754-E822 IonicContact NH2-OE1 3.98Å; R754-E822 PolarHBondContact NH2-OE1 2.95Å; R754-E822 IonicContact NH2-OE2 3.04Å; R754-E822 PolarHBondContact NH2-OE2 3.42Å
755	L	82.9	Confident	84.4	Confident	66 Å²	66	26.7 Å²	26.7	35%	0.346	15%	0.148	S	C	.	.	H	α-helix	trans	-100.5	-30.1	-172.4	-65.6	-176	0	0	0	114.9	P538 L751 A752 F868	P538-L755 HydrophobicContact CB-CD1 4.46Å; P538-L755 HydrophobicContact CG-CB 4.06Å; P538-L755 HydrophobicContact CG-CD1 3.87Å; P538-L755 HydrophobicContact CG-CG 4.41Å; L751-L755 HydrophobicContact CD1-CD1 3.32Å; L751-L755 HydrophobicContact CD1-CG 3.95Å; L751-L755 HydrophobicContact CG-CD1 3.97Å; L751-L755 WeakPolarHBondContact O-CB 3.49Å; L751-L755 PolarHBondContact O-N 2.86Å; A752-L755 PolarHBondContact O-N 3.44Å; L755-F868 HydrophobicContact CD1-CD1 4.19Å; L755-F868 HydrophobicContact CD1-CE1 3.99Å
756	L	76.6	Confident	84	Confident	4 Å²	4	26 Å²	26	2%	0.021	15%	0.146	C	C	.	.	H	α-helix	trans	-115	-1.8	-171.4	-52.1	178.5	0	0	0	112.7	M541 A752 G758 T759 L761	M541-L756 HydrophobicContact CE-CD2 4.13Å; A752-L756 HydrophobicContact CB-CD1 4.12Å; A752-L756 VanDerWaalsContact O-CA 3.3Å; A752-L756 WeakPolarHBondContact O-CA 3.4Å; A752-L756 VanDerWaalsContact O-CB 3.25Å; A752-L756 WeakPolarHBondContact O-CB 3.45Å; A752-L756 PolarHBondContact O-N 3.19Å; L756-G758 PolarHBondContact O-N 3.27Å; L756-T759 WeakPolarHBondContact O-CB 3Å; L756-T759 WeakPolarHBondContact O-CG2 3.39Å; L756-T759 PolarHBondContact O-N 3.33Å; L756-T759 PolarHBondContact O-OG1 3.46Å; L756-L761 HydrophobicContact CD2-CD1 4.33Å
757	G	71.4	Confident	83.8	Confident	41 Å²	41	26.6 Å²	26.6	42%	0.423	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	124.4	177.1	0	0	0	0	0	111.9	A752 T759	A752-G757 PolarHBondContact O-N 3.38Å; G757-T759 VanDerWaalsContact C-N 3.25Å; G757-T759 PolarHBondContact O-N 2.9Å
758	G	66.4	Low	83.8	Confident	31 Å²	31	26.6 Å²	26.6	32%	0.32	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.4	-1	-179.7	0	0	0	0	0	115.7	I535 L756	I535-G758 WeakPolarHBondContact CD1-O 3.43Å; L756-G758 PolarHBondContact O-N 3.27Å
759	T	74.7	Confident	83.6	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.155	C	C	.	.	S	Bend	trans	-74.1	163.2	169.7	70.5	0	0	0	0	110.8	I535 L537 E551 L756 G757 L761	I535-T759 HydrophobicContact CB-CG2 4.42Å; I535-T759 HydrophobicContact CD1-CG2 4.39Å; I535-T759 HydrophobicContact CG2-CG2 3.82Å; L537-T759 HydrophobicContact CD2-CG2 4.06Å; E551-T759 WeakPolarHBondContact OE1-CA 2.89Å; L756-T759 WeakPolarHBondContact O-CB 3Å; L756-T759 WeakPolarHBondContact O-CG2 3.39Å; L756-T759 PolarHBondContact O-N 3.33Å; L756-T759 PolarHBondContact O-OG1 3.46Å; G757-T759 VanDerWaalsContact C-N 3.25Å; G757-T759 PolarHBondContact O-N 2.9Å; T759-L761 VanDerWaalsContact C-N 3.29Å; T759-L761 PolarHBondContact OG1-N 3.37Å
760	S	71.1	Confident	83.5	Confident	6 Å²	6	29.3 Å²	29.3	4%	0.042	16%	0.159	C	C	.	.	S	Bend	trans	-74.9	-15.1	171.1	49.8	0	0	0	0	114	E551 A554 Y558	E551-S760 WeakPolarHBondContact CA-OG 3.41Å; E551-S760 PolarHBondContact O-OG 3.49Å; E551-S760 PolarHBondContact OE1-N 3.48Å; E551-S760 PolarHBondContact OE1-OG 3.19Å; A554-S760 VanDerWaalsContact CB-CB 3.48Å; A554-S760 WeakPolarHBondContact CB-OG 3.47Å; Y558-S760 PolarHBondContact OH-O 3.4Å
761	L	77.6	Confident	83.6	Confident	10 Å²	10	29.1 Å²	29.1	5%	0.052	16%	0.158	C	C	.	.	S	Bend	trans	-64.2	159	178.3	-62.9	174.6	0	0	0	111.1	L537 M541 M547 F550 L756 T759 D763 F898	L537-L761 HydrophobicContact CD2-CD1 4.47Å; M541-L761 HydrophobicContact CE-CD1 4.38Å; M547-L761 HydrophobicContact CE-CD1 3.61Å; M547-L761 HydrophobicContact CE-CD2 3.51Å; M547-L761 HydrophobicContact CE-CG 4.11Å; F550-L761 HydrophobicContact CE1-CD2 4.31Å; L756-L761 HydrophobicContact CD2-CD1 4.33Å; T759-L761 VanDerWaalsContact C-N 3.29Å; T759-L761 PolarHBondContact OG1-N 3.37Å; L761-D763 VanDerWaalsContact C-N 3.3Å; L761-D763 PolarHBondContact O-N 3.36Å; L761-F898 HydrophobicContact CD2-CD2 4.43Å
762	P	77.4	Confident	83.8	Confident	38 Å²	38	28.6 Å²	28.6	25%	0.247	16%	0.156	C	C	.	.			trans	-56.6	95.2	174.1	-28.7	40.2	0	0	0	111	H899	P762-H899 HydrophobicContact CB-CB 4.18Å; P762-H899 HydrophobicContact CG-CB 4.32Å
763	D	81.9	Confident	83.9	Confident	16 Å²	16	29.6 Å²	29.6	9%	0.086	16%	0.16	C	C	.	.			trans	-90.6	165	179.5	76.9	-42.4	0	0	0	109.9	L761 E765 S766 I767	L761-D763 VanDerWaalsContact C-N 3.3Å; L761-D763 PolarHBondContact O-N 3.36Å; D763-E765 PolarHBondContact O-N 3.41Å; D763-E765 VanDerWaalsContact O-N 3.15Å; D763-E765 VanDerWaalsContact OD2-CB 3.25Å; D763-E765 WeakPolarHBondContact OD2-CB 3.38Å; D763-E765 PolarHBondContact OD2-N 3.06Å; D763-S766 PolarHBondContact N-OG 2.92Å; D763-S766 PolarHBondContact O-N 2.75Å; D763-S766 PolarHBondContact O-OG 3.39Å; D763-S766 WeakPolarHBondContact OD1-CB 3.35Å; D763-S766 PolarHBondContact OD1-N 3.34Å; D763-S766 PolarHBondContact OD1-OG 3.05Å; D763-I767 PolarHBondContact O-N 2.97Å; D763-I767 VanDerWaalsContact O-N 3.16Å
764	P	88.6	Confident	84.4	Confident	5 Å²	5	23.7 Å²	23.7	3%	0.032	13%	0.133	C	C	.	.	H	α-helix	trans	-48.8	-41.5	175.7	-33.8	40	0	0	0	114.1	Y749 A752 H753 I767 V768 L786 P870	Y749-P764 HydrophobicContact CD1-CB 3.73Å; Y749-P764 HydrophobicContact CD1-CG 3.89Å; Y749-P764 HydrophobicContact CE1-CB 3.94Å; Y749-P764 HydrophobicContact CE1-CG 4.34Å; A752-P764 HydrophobicContact CB-CG 4.04Å; H753-P764 HydrophobicContact CB-CG 4.42Å; P764-I767 PolarHBondContact O-N 3.45Å; P764-V768 WeakPolarHBondContact O-CG2 3.28Å; P764-V768 PolarHBondContact O-N 3.3Å; P764-V768 VanDerWaalsContact O-N 3.09Å; P764-L786 HydrophobicContact CB-CD2 3.55Å; P764-P870 HydrophobicContact CG-CG 4.26Å
765	E	88.3	Confident	84.9	Confident	62 Å²	62	19.2 Å²	19.2	29%	0.29	12%	0.117	S	C	.	.	H	α-helix	trans	-65.9	-45.2	-176.5	-164.3	-178	160.4	0	0	112	D763 V768 R769 T782 L786	D763-E765 PolarHBondContact O-N 3.41Å; D763-E765 VanDerWaalsContact O-N 3.15Å; D763-E765 VanDerWaalsContact OD2-CB 3.25Å; D763-E765 WeakPolarHBondContact OD2-CB 3.38Å; D763-E765 PolarHBondContact OD2-N 3.06Å; E765-V768 PolarHBondContact O-N 2.84Å; E765-R769 VanDerWaalsContact O-CB 3.26Å; E765-R769 WeakPolarHBondContact O-CB 3.47Å; E765-R769 PolarHBondContact O-N 2.94Å; E765-R769 IonicContact OE1-CZ 3.08Å; E765-R769 IonicContact OE1-NH2 3.72Å; E765-R769 PolarHBondContact OE1-NH2 2.77Å; E765-T782 HydrophobicContact CB-CG2 4.44Å; E765-T782 HydrophobicContact CG-CG2 3.41Å; E765-T782 VanDerWaalsContact CG-CG2 3.41Å; E765-L786 HydrophobicContact CB-CD1 4.13Å; E765-L786 HydrophobicContact CG-CD1 4.13Å
766	S	85.2	Confident	85.4	Confident	15 Å²	15	17.3 Å²	17.3	11%	0.105	11%	0.112	C	C	.	.	H	α-helix	trans	-63.7	-42.9	177	63.4	0	0	0	0	112.1	D763 V768 R769 W770	D763-S766 PolarHBondContact N-OG 2.92Å; D763-S766 PolarHBondContact O-N 2.75Å; D763-S766 PolarHBondContact O-OG 3.39Å; D763-S766 WeakPolarHBondContact OD1-CB 3.35Å; D763-S766 PolarHBondContact OD1-N 3.34Å; D763-S766 PolarHBondContact OD1-OG 3.05Å; S766-V768 PolarHBondContact O-N 2.98Å; S766-R769 PolarHBondContact O-N 2.84Å; S766-W770 PolarHBondContact O-N 3.28Å; S766-W770 PolarHBondContact O-NE1 2.88Å
767	I	91.1	Very high	86.1	Confident	13 Å²	13	17.6 Å²	17.6	7%	0.067	11%	0.114	C	C	.	.	H	α-helix	trans	-58.4	-49	177.9	-65.3	170.2	0	0	0	110.8	L738 Y749 D763 P764 R769 W770 S771 P870 L871	L738-I767 HydrophobicContact CD1-CG2 4.27Å; L738-I767 HydrophobicContact CD2-CG2 4.24Å; Y749-I767 WeakPolarHBondContact OH-CG2 3.26Å; D763-I767 PolarHBondContact O-N 2.97Å; D763-I767 VanDerWaalsContact O-N 3.16Å; P764-I767 PolarHBondContact O-N 3.45Å; I767-R769 PolarHBondContact O-N 3.09Å; I767-W770 PolarHBondContact O-N 3.16Å; I767-S771 WeakPolarHBondContact O-CB 3.24Å; I767-S771 PolarHBondContact O-N 3.09Å; I767-S771 PolarHBondContact O-OG 3.47Å; I767-P870 HydrophobicContact CD1-CB 3.67Å; I767-P870 HydrophobicContact CD1-CG 3.64Å; I767-L871 HydrophobicContact CD1-CD2 3.99Å; I767-L871 HydrophobicContact CD1-CG 4.08Å; I767-L871 HydrophobicContact CG2-CD2 4.28Å
768	V	93.3	Very high	86.9	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-62	-44.4	177.8	168.8	0	0	0	0	111.1	F744 P764 E765 S766 W770 S771 L772 T782 V785 L786	F744-V768 HydrophobicContact CD1-CG2 3.48Å; F744-V768 VanDerWaalsContact CD1-CG2 3.48Å; F744-V768 HydrophobicContact CD2-CG2 4.17Å; F744-V768 HydrophobicContact CE1-CG2 3.53Å; F744-V768 HydrophobicContact CE2-CG2 4.19Å; F744-V768 HydrophobicContact CG-CG2 3.82Å; F744-V768 HydrophobicContact CZ-CG2 3.89Å; P764-V768 WeakPolarHBondContact O-CG2 3.28Å; P764-V768 PolarHBondContact O-N 3.3Å; P764-V768 VanDerWaalsContact O-N 3.09Å; E765-V768 PolarHBondContact O-N 2.84Å; S766-V768 PolarHBondContact O-N 2.98Å; V768-W770 PolarHBondContact O-N 3.2Å; V768-S771 WeakPolarHBondContact O-CB 3.35Å; V768-S771 PolarHBondContact O-N 2.88Å; V768-L772 HydrophobicContact CG1-CD1 4.08Å; V768-L772 HydrophobicContact CG1-CG 4.42Å; V768-L772 WeakPolarHBondContact O-CG 3.46Å; V768-L772 PolarHBondContact O-N 2.67Å; V768-T782 HydrophobicContact CB-CG2 4.08Å; V768-T782 HydrophobicContact CG1-CG2 3.78Å; V768-V785 HydrophobicContact CB-CG1 4.45Å; V768-V785 HydrophobicContact CG1-CB 3.58Å; V768-V785 HydrophobicContact CG1-CG1 3.5Å; V768-V785 VanDerWaalsContact CG1-CG1 3.5Å; V768-V785 HydrophobicContact CG1-CG2 4.42Å; V768-V785 HydrophobicContact CG2-CG1 4.09Å; V768-L786 HydrophobicContact CB-CD2 4.42Å; V768-L786 HydrophobicContact CB-CG 4.4Å; V768-L786 HydrophobicContact CG2-CD2 3.67Å; V768-L786 HydrophobicContact CG2-CG 3.99Å
769	R	90.7	Very high	88	Confident	33 Å²	33	18 Å²	18	13%	0.125	10%	0.1	C	C	.	.	H	α-helix	trans	-60.6	-45.5	-179.9	-170.1	-175.7	-60.5	134.2	-4	112.1	E765 S766 I767 S771 L772 L773 P779 T782	E765-R769 VanDerWaalsContact O-CB 3.26Å; E765-R769 WeakPolarHBondContact O-CB 3.47Å; E765-R769 PolarHBondContact O-N 2.94Å; E765-R769 IonicContact OE1-CZ 3.08Å; E765-R769 IonicContact OE1-NH2 3.72Å; E765-R769 PolarHBondContact OE1-NH2 2.77Å; S766-R769 PolarHBondContact O-N 2.84Å; I767-R769 PolarHBondContact O-N 3.09Å; R769-S771 VanDerWaalsContact C-N 3.34Å; R769-L772 PolarHBondContact O-N 3.15Å; R769-L773 WeakPolarHBondContact O-CG 3.4Å; R769-L773 PolarHBondContact O-N 3.35Å; R769-L773 VanDerWaalsContact O-N 3.12Å; R769-P779 HydrophobicContact CG-CB 3.77Å; R769-T782 HydrophobicContact CB-CG2 4.47Å
770	W	91.7	Very high	88.6	Confident	27 Å²	27	21.8 Å²	21.8	10%	0.102	12%	0.124	C	C	.	.	H	α-helix	trans	-66.3	-37.9	177.1	-56.9	133.9	0	0	0	111.8	V576 T579 G635 V637 L638 S766 I767 V768 L773 Y774	V576-W770 HydrophobicContact CG2-CZ3 4.37Å; T579-W770 HydrophobicContact CG2-CH2 4.4Å; T579-W770 HydrophobicContact CG2-CZ2 4.37Å; G635-W770 WeakPolarHBondContact O-CB 3.44Å; V637-W770 HydrophobicContact CB-CD2 4.44Å; V637-W770 HydrophobicContact CB-CE3 3.86Å; V637-W770 HydrophobicContact CB-CZ3 4.49Å; V637-W770 HydrophobicContact CG1-CE3 3.61Å; V637-W770 HydrophobicContact CG1-CZ3 3.76Å; V637-W770 HydrophobicContact CG2-CB 4.38Å; V637-W770 HydrophobicContact CG2-CE3 4.1Å; L638-W770 HydrophobicContact CD1-CD2 4.48Å; L638-W770 HydrophobicContact CD1-CH2 4.23Å; L638-W770 HydrophobicContact CD1-CZ2 3.69Å; L638-W770 HydrophobicContact CD2-CH2 4.36Å; L638-W770 HydrophobicContact CG-CZ2 4.4Å; S766-W770 PolarHBondContact O-N 3.28Å; S766-W770 PolarHBondContact O-NE1 2.88Å; I767-W770 PolarHBondContact O-N 3.16Å; V768-W770 PolarHBondContact O-N 3.2Å; W770-L773 HydrophobicContact CE3-CD1 3.75Å; W770-L773 HydrophobicContact CZ3-CD1 3.82Å; W770-L773 PolarHBondContact O-N 3.41Å; W770-Y774 WeakPolarHBondContact O-CB 3.45Å; W770-Y774 PolarHBondContact O-N 3.26Å
771	S	94.7	Very high	89.6	Confident	4 Å²	4	24 Å²	24	3%	0.028	13%	0.132	C	C	.	.	H	α-helix	trans	-61.6	-43.8	174.6	-54.2	0	0	0	0	112.2	F741 I767 V768 R769 L773 Y774 F775	F741-S771 VanDerWaalsContact CE1-OG 3.25Å; F741-S771 WeakPolarHBondContact CE1-OG 3.3Å; I767-S771 WeakPolarHBondContact O-CB 3.24Å; I767-S771 PolarHBondContact O-N 3.09Å; I767-S771 PolarHBondContact O-OG 3.47Å; V768-S771 WeakPolarHBondContact O-CB 3.35Å; V768-S771 PolarHBondContact O-N 2.88Å; R769-S771 VanDerWaalsContact C-N 3.34Å; S771-L773 PolarHBondContact O-N 3.39Å; S771-Y774 WeakPolarHBondContact O-CB 3.39Å; S771-Y774 PolarHBondContact O-N 3.04Å; S771-F775 WeakPolarHBondContact O-CD2 3.32Å; S771-F775 PolarHBondContact O-N 3.09Å; S771-F775 VanDerWaalsContact O-N 3.11Å
772	L	94.8	Very high	90.2	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-62	-43.8	175.6	-72.8	173.3	0	0	0	111.8	V768 R769 Y774 F775 G776 I777 V785 M838	V768-L772 HydrophobicContact CG1-CD1 4.08Å; V768-L772 HydrophobicContact CG1-CG 4.42Å; V768-L772 WeakPolarHBondContact O-CG 3.46Å; V768-L772 PolarHBondContact O-N 2.67Å; R769-L772 PolarHBondContact O-N 3.15Å; L772-Y774 VanDerWaalsContact C-N 3.32Å; L772-Y774 PolarHBondContact O-N 2.86Å; L772-F775 CarbonylContact O-C 3.46Å; L772-F775 PolarHBondContact O-N 3.49Å; L772-G776 PolarHBondContact O-N 3.3Å; L772-I777 CarbonylContact C-O 3.56Å; L772-I777 HydrophobicContact CD2-CB 3.86Å; L772-I777 HydrophobicContact CD2-CD1 4.48Å; L772-I777 HydrophobicContact CD2-CG2 3.7Å; L772-I777 PolarHBondContact O-N 2.9Å; L772-V785 HydrophobicContact CD1-CG2 4.32Å; L772-V785 HydrophobicContact CD2-CG2 4.08Å; L772-M838 HydrophobicContact CD2-SD 4.17Å
773	L	93.4	Very high	90.9	Very high	23 Å²	23	26.6 Å²	26.6	12%	0.12	14%	0.14	C	C	.	.	H	α-helix	trans	-63.8	-36.8	175.3	-71.2	174.6	0	0	0	112.5	V576 V637 P668 R769 W770 S771 F775 G776 P779	V576-L773 HydrophobicContact CG2-CD1 3.84Å; V637-L773 HydrophobicContact CG2-CB 4Å; P668-L773 HydrophobicContact CB-CD2 4.36Å; R769-L773 WeakPolarHBondContact O-CG 3.4Å; R769-L773 PolarHBondContact O-N 3.35Å; R769-L773 VanDerWaalsContact O-N 3.12Å; W770-L773 HydrophobicContact CE3-CD1 3.75Å; W770-L773 HydrophobicContact CZ3-CD1 3.82Å; W770-L773 PolarHBondContact O-N 3.41Å; S771-L773 PolarHBondContact O-N 3.39Å; L773-F775 VanDerWaalsContact C-N 3.32Å; L773-F775 PolarHBondContact O-N 3.22Å; L773-G776 PolarHBondContact O-N 3.07Å; L773-G776 VanDerWaalsContact O-N 3.08Å; L773-P779 HydrophobicContact CD2-CG 4.14Å
774	Y	96.1	Very high	91.5	Very high	1 Å²	1	29.8 Å²	29.8	0%	0.004	15%	0.153	C	C	.	.	H	α-helix	trans	-59.8	-41.1	174.5	-179.5	-132.1	0	0	0	112.5	F636 A667 R671 F672 A675 W770 S771 L772 G776	F636-Y774 HydrophobicContact CB-CD1 4.49Å; F636-Y774 HydrophobicContact CB-CD2 3.41Å; F636-Y774 VanDerWaalsContact CB-CD2 3.41Å; F636-Y774 HydrophobicContact CB-CE2 3.82Å; F636-Y774 HydrophobicContact CB-CG 3.77Å; F636-Y774 HydrophobicContact CD1-CD1 4.37Å; F636-Y774 HydrophobicContact CD1-CD2 4.19Å; F636-Y774 HydrophobicContact CD1-CE1 4.01Å; F636-Y774 AromaticContact CD1-CE2 3.85Å; F636-Y774 HydrophobicContact CD1-CE2 3.85Å; F636-Y774 HydrophobicContact CD1-CG 4.42Å; F636-Y774 AromaticContact CD1-CZ 3.7Å; F636-Y774 AromaticContact CD2-CD1 3.59Å; F636-Y774 HydrophobicContact CD2-CD1 3.59Å; F636-Y774 HydrophobicContact CD2-CD2 4.09Å; F636-Y774 HydrophobicContact CD2-CE1 4.01Å; F636-Y774 HydrophobicContact CD2-CE2 4.48Å; F636-Y774 AromaticContact CD2-CG 3.6Å; F636-Y774 HydrophobicContact CD2-CG 3.6Å; F636-Y774 AromaticContact CE1-CE1 3.99Å; F636-Y774 HydrophobicContact CE1-CE1 3.99Å; F636-Y774 AromaticContact CE1-CZ 3.97Å; F636-Y774 AromaticContact CE2-CD1 3.81Å; F636-Y774 HydrophobicContact CE2-CD1 3.81Å; F636-Y774 AromaticContact CE2-CE1 3.99Å; F636-Y774 HydrophobicContact CE2-CE1 3.99Å; F636-Y774 HydrophobicContact CE2-CG 4.3Å; F636-Y774 AromaticContact CG-CD1 3.91Å; F636-Y774 HydrophobicContact CG-CD1 3.91Å; F636-Y774 AromaticContact CG-CD2 3.65Å; F636-Y774 HydrophobicContact CG-CD2 3.65Å; F636-Y774 HydrophobicContact CG-CE1 4.02Å; F636-Y774 AromaticContact CG-CE2 3.8Å; F636-Y774 HydrophobicContact CG-CE2 3.8Å; F636-Y774 AromaticContact CG-CG 3.68Å; F636-Y774 HydrophobicContact CG-CG 3.68Å; F636-Y774 AromaticContact CG-CZ 3.95Å; F636-Y774 HydrophobicContact CZ-CD1 4.29Å; F636-Y774 AromaticContact CZ-CE1 3.98Å; F636-Y774 HydrophobicContact CZ-CE1 3.98Å; A667-Y774 HydrophobicContact CB-CD2 4.13Å; R671-Y774 WeakPolarHBondContact CA-O 3.47Å; R671-Y774 WeakPolarHBondContact CB-O 3.46Å; F672-Y774 HydrophobicContact CB-CD1 4.25Å; F672-Y774 HydrophobicContact CB-CD2 4.24Å; F672-Y774 HydrophobicContact CB-CE1 3.9Å; F672-Y774 HydrophobicContact CB-CE2 3.87Å; F672-Y774 HydrophobicContact CB-CG 4.44Å; F672-Y774 AromaticContact CD2-CE1 3.82Å; F672-Y774 HydrophobicContact CD2-CE1 3.82Å; F672-Y774 AromaticContact CD2-CZ 3.68Å; F672-Y774 WeakPolarHBondContact CD2-OH 3.36Å; F672-Y774 HydrophobicContact CG-CE1 4.27Å; F672-Y774 PolarHBondContact N-O 3.47Å; A675-Y774 HydrophobicContact CB-CE2 4.41Å; W770-Y774 WeakPolarHBondContact O-CB 3.45Å; W770-Y774 PolarHBondContact O-N 3.26Å; S771-Y774 WeakPolarHBondContact O-CB 3.39Å; S771-Y774 PolarHBondContact O-N 3.04Å; L772-Y774 VanDerWaalsContact C-N 3.32Å; L772-Y774 PolarHBondContact O-N 2.86Å; Y774-G776 VanDerWaalsContact C-N 3.3Å
775	F	96.3	Very high	91.8	Very high	8 Å²	8	29.6 Å²	29.6	4%	0.035	15%	0.152	C	C	.	.	H	α-helix	trans	-81.4	-7.9	174.9	-60.4	-44	0	0	0	114.1	F672 F741 S771 L772 L773 I777 M838 F841 A847	F672-F775 HydrophobicContact CB-CD1 4.1Å; F672-F775 HydrophobicContact CB-CE1 4.36Å; F672-F775 HydrophobicContact CG-CD1 4.48Å; F672-F775 HydrophobicContact CG-CE1 4.4Å; F741-F775 HydrophobicContact CB-CE2 4.39Å; F741-F775 HydrophobicContact CD1-CE2 4.03Å; F741-F775 HydrophobicContact CD1-CZ 4.31Å; F741-F775 AromaticContact CD2-CE2 3.93Å; F741-F775 HydrophobicContact CD2-CE2 3.93Å; F741-F775 AromaticContact CD2-CZ 3.56Å; F741-F775 HydrophobicContact CD2-CZ 3.56Å; F741-F775 HydrophobicContact CE1-CE2 4.22Å; F741-F775 HydrophobicContact CE1-CZ 4.21Å; F741-F775 HydrophobicContact CE2-CE1 4.47Å; F741-F775 HydrophobicContact CE2-CE2 4.15Å; F741-F775 AromaticContact CE2-CZ 3.47Å; F741-F775 HydrophobicContact CE2-CZ 3.47Å; F741-F775 VanDerWaalsContact CE2-CZ 3.47Å; F741-F775 AromaticContact CG-CE2 3.87Å; F741-F775 HydrophobicContact CG-CE2 3.87Å; F741-F775 AromaticContact CG-CZ 4Å; F741-F775 HydrophobicContact CG-CZ 4Å; F741-F775 HydrophobicContact CZ-CE2 4.3Å; F741-F775 AromaticContact CZ-CZ 3.83Å; F741-F775 HydrophobicContact CZ-CZ 3.83Å; S771-F775 WeakPolarHBondContact O-CD2 3.32Å; S771-F775 PolarHBondContact O-N 3.09Å; S771-F775 VanDerWaalsContact O-N 3.11Å; L772-F775 CarbonylContact O-C 3.46Å; L772-F775 PolarHBondContact O-N 3.49Å; L773-F775 VanDerWaalsContact C-N 3.32Å; L773-F775 PolarHBondContact O-N 3.22Å; F775-I777 VanDerWaalsContact C-N 3.3Å; F775-I777 HydrophobicContact CB-CD1 4Å; F775-I777 HydrophobicContact CB-CG1 4.12Å; F775-M838 HydrophobicContact CD2-CE 4.32Å; F775-M838 HydrophobicContact CD2-SD 4.08Å; F775-M838 HydrophobicContact CE2-CE 4.24Å; F775-F841 HydrophobicContact CB-CD2 3.82Å; F775-F841 HydrophobicContact CB-CE1 4.46Å; F775-F841 HydrophobicContact CB-CE2 3.67Å; F775-F841 HydrophobicContact CB-CG 4.28Å; F775-F841 HydrophobicContact CB-CZ 4Å; F775-F841 HydrophobicContact CD1-CB 3.81Å; F775-F841 AromaticContact CD1-CD1 3.43Å; F775-F841 HydrophobicContact CD1-CD1 3.43Å; F775-F841 VanDerWaalsContact CD1-CD1 3.43Å; F775-F841 AromaticContact CD1-CD2 3.85Å; F775-F841 HydrophobicContact CD1-CD2 3.85Å; F775-F841 AromaticContact CD1-CE1 3.88Å; F775-F841 HydrophobicContact CD1-CE1 3.88Å; F775-F841 HydrophobicContact CD1-CE2 4.27Å; F775-F841 AromaticContact CD1-CG 3.41Å; F775-F841 HydrophobicContact CD1-CG 3.41Å; F775-F841 VanDerWaalsContact CD1-CG 3.41Å; F775-F841 HydrophobicContact CD1-CZ 4.26Å; F775-F841 HydrophobicContact CD2-CB 4.3Å; F775-F841 HydrophobicContact CD2-CD2 4.21Å; F775-F841 HydrophobicContact CD2-CG 4.29Å; F775-F841 HydrophobicContact CE1-CB 3.6Å; F775-F841 AromaticContact CE1-CD1 3.82Å; F775-F841 HydrophobicContact CE1-CD1 3.82Å; F775-F841 AromaticContact CE1-CG 3.74Å; F775-F841 HydrophobicContact CE1-CG 3.74Å; F775-F841 HydrophobicContact CE2-CB 4.1Å; F775-F841 HydrophobicContact CG-CB 4.17Å; F775-F841 HydrophobicContact CG-CD1 4.14Å; F775-F841 AromaticContact CG-CD2 3.69Å; F775-F841 HydrophobicContact CG-CD2 3.69Å; F775-F841 HydrophobicContact CG-CE1 4.46Å; F775-F841 HydrophobicContact CG-CE2 4.05Å; F775-F841 AromaticContact CG-CG 3.73Å; F775-F841 HydrophobicContact CG-CG 3.73Å; F775-F841 HydrophobicContact CG-CZ 4.41Å; F775-F841 HydrophobicContact CZ-CB 3.75Å; F775-F841 HydrophobicContact CZ-CG 4.28Å; F775-A847 HydrophobicContact CE1-CB 3.87Å; F775-A847 HydrophobicContact CZ-CB 4.14Å
776	G	92.6	Very high	92	Very high	25 Å²	25	27.6 Å²	27.6	26%	0.258	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	26.6	-175.1	0	0	0	0	0	114.1	R671 L772 L773 Y774	R671-G776 PolarHBondContact NH1-O 3.34Å; L772-G776 PolarHBondContact O-N 3.3Å; L773-G776 PolarHBondContact O-N 3.07Å; L773-G776 VanDerWaalsContact O-N 3.08Å; Y774-G776 VanDerWaalsContact C-N 3.3Å
777	I	92	Very high	92.4	Very high	11 Å²	11	33 Å²	33	6%	0.056	17%	0.165	C	C	.	.			trans	-93.9	148.7	173.5	-61	170.5	0	0	0	108.8	L772 F775 P779 Y781 L834 M837 M838 F841	L772-I777 CarbonylContact C-O 3.56Å; L772-I777 HydrophobicContact CD2-CB 3.86Å; L772-I777 HydrophobicContact CD2-CD1 4.48Å; L772-I777 HydrophobicContact CD2-CG2 3.7Å; L772-I777 PolarHBondContact O-N 2.9Å; F775-I777 VanDerWaalsContact C-N 3.3Å; F775-I777 HydrophobicContact CB-CD1 4Å; F775-I777 HydrophobicContact CB-CG1 4.12Å; I777-P779 WeakPolarHBondContact O-CD 3.27Å; I777-Y781 HydrophobicContact CG2-CD2 4.04Å; I777-L834 HydrophobicContact CG2-CD1 4.3Å; I777-M837 HydrophobicContact CD1-CB 4.03Å; I777-M837 HydrophobicContact CG1-CB 4.45Å; I777-M837 HydrophobicContact CG2-CE 4.17Å; I777-M837 HydrophobicContact CG2-SD 4.4Å; I777-M838 HydrophobicContact CD1-CG 3.98Å; I777-M838 HydrophobicContact CD1-SD 3.43Å; I777-M838 WeakPolarHBondContact CD1-SD 3.29Å; I777-F841 HydrophobicContact CD1-CD2 4.23Å; I777-F841 HydrophobicContact CD1-CE2 4.02Å
778	D	88.2	Confident	92.5	Very high	55 Å²	55	32.4 Å²	32.4	29%	0.294	16%	0.162	S	C	.	.			trans	-61.5	123.3	-177.8	-166.6	-25.6	0	0	0	111.6	R572 T780 Y781	R572-D778 IonicContact CZ-OD1 3.48Å; R572-D778 VanDerWaalsContact CZ-OD1 3.31Å; R572-D778 IonicContact CZ-OD2 3.36Å; R572-D778 IonicContact NH1-OD1 3.57Å; R572-D778 PolarHBondContact NH1-OD1 2.97Å; R572-D778 IonicContact NH1-OD2 3.18Å; R572-D778 PolarHBondContact NH1-OD2 2.63Å; R572-D778 IonicContact NH2-OD1 3.5Å; R572-D778 IonicContact NH2-OD2 2.91Å; D778-T780 PolarHBondContact O-N 3.47Å; D778-T780 PolarHBondContact OD1-N 3.34Å; D778-T780 PolarHBondContact OD1-OG1 3.44Å; D778-T780 VanDerWaalsContact OD1-OG1 3.12Å; D778-T780 PolarHBondContact OD2-OG1 2.75Å; D778-Y781 HydrophobicContact CB-CD2 3.96Å; D778-Y781 HydrophobicContact CB-CE2 4.07Å; D778-Y781 WeakPolarHBondContact O-CD2 3.16Å; D778-Y781 PolarHBondContact O-N 3.34Å; D778-Y781 VanDerWaalsContact O-N 3.13Å
779	P	88	Confident	92.6	Very high	24 Å²	24	34.2 Å²	34.2	16%	0.156	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-62.4	-8.2	176.8	25.5	-35.4	0	0	0	114.2	R769 L773 I777 Y781 T782	R769-P779 HydrophobicContact CG-CB 3.77Å; L773-P779 HydrophobicContact CD2-CG 4.14Å; I777-P779 WeakPolarHBondContact O-CD 3.27Å; P779-Y781 PolarHBondContact O-N 2.87Å; P779-T782 VanDerWaalsContact O-CB 3.3Å; P779-T782 WeakPolarHBondContact O-CB 3.42Å; P779-T782 PolarHBondContact O-N 2.98Å; P779-T782 VanDerWaalsContact O-N 3.12Å; P779-T782 PolarHBondContact O-OG1 3Å
780	T	87.1	Confident	92.8	Very high	81 Å²	81	32.6 Å²	32.6	50%	0.497	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-63.5	-20	170.4	51.3	0	0	0	0	114	D778 T782	D778-T780 PolarHBondContact O-N 3.47Å; D778-T780 PolarHBondContact OD1-N 3.34Å; D778-T780 PolarHBondContact OD1-OG1 3.44Å; D778-T780 VanDerWaalsContact OD1-OG1 3.12Å; D778-T780 PolarHBondContact OD2-OG1 2.75Å; T780-T782 PolarHBondContact O-N 3.49Å
781	Y	91.8	Very high	92.9	Very high	52 Å²	52	31.4 Å²	31.4	20%	0.204	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-75.5	-3	175	-69.7	-77.1	0	0	0	113.4	I777 D778 P779 Q783 K784 V785 L834 M837	I777-Y781 HydrophobicContact CG2-CD2 4.04Å; D778-Y781 HydrophobicContact CB-CD2 3.96Å; D778-Y781 HydrophobicContact CB-CE2 4.07Å; D778-Y781 WeakPolarHBondContact O-CD2 3.16Å; D778-Y781 PolarHBondContact O-N 3.34Å; D778-Y781 VanDerWaalsContact O-N 3.13Å; P779-Y781 PolarHBondContact O-N 2.87Å; Y781-Q783 VanDerWaalsContact C-N 3.33Å; Y781-Q783 PolarHBondContact O-N 3.28Å; Y781-K784 HydrophobicContact CD1-CD 4.08Å; Y781-K784 WeakPolarHBondContact O-CA 3.19Å; Y781-K784 WeakPolarHBondContact O-CB 3.21Å; Y781-K784 PolarHBondContact O-N 3.49Å; Y781-V785 PolarHBondContact O-N 2.93Å; Y781-L834 HydrophobicContact CD1-CB 4Å; Y781-L834 HydrophobicContact CD1-CD1 3.88Å; Y781-L834 HydrophobicContact CD1-CD2 3.88Å; Y781-L834 HydrophobicContact CD1-CG 4.12Å; Y781-L834 HydrophobicContact CD2-CD1 4.27Å; Y781-L834 HydrophobicContact CE1-CB 4.15Å; Y781-L834 HydrophobicContact CG-CD1 3.71Å; Y781-L834 HydrophobicContact CG-CD2 4.28Å; Y781-L834 HydrophobicContact CG-CG 4.42Å; Y781-M837 HydrophobicContact CD2-CE 4.23Å; Y781-M837 HydrophobicContact CE1-CE 4.4Å; Y781-M837 HydrophobicContact CE2-CE 3.67Å
782	T	91.4	Very high	92.7	Very high	4 Å²	4	32.7 Å²	32.7	3%	0.025	17%	0.168	C	C	.	.	H	α-helix	trans	-49.9	-49.4	-174.9	-62.7	0	0	0	0	113	E765 V768 R769 P779 T780 K784 V785 L786	E765-T782 HydrophobicContact CB-CG2 4.44Å; E765-T782 HydrophobicContact CG-CG2 3.41Å; E765-T782 VanDerWaalsContact CG-CG2 3.41Å; V768-T782 HydrophobicContact CB-CG2 4.08Å; V768-T782 HydrophobicContact CG1-CG2 3.78Å; R769-T782 HydrophobicContact CB-CG2 4.47Å; P779-T782 VanDerWaalsContact O-CB 3.3Å; P779-T782 WeakPolarHBondContact O-CB 3.42Å; P779-T782 PolarHBondContact O-N 2.98Å; P779-T782 VanDerWaalsContact O-N 3.12Å; P779-T782 PolarHBondContact O-OG1 3Å; T780-T782 PolarHBondContact O-N 3.49Å; T782-K784 VanDerWaalsContact C-N 3.27Å; T782-K784 PolarHBondContact O-N 3.36Å; T782-V785 PolarHBondContact O-N 3.21Å; T782-L786 HydrophobicContact CG2-CD1 4.17Å; T782-L786 WeakPolarHBondContact O-CG 3.4Å; T782-L786 PolarHBondContact O-N 3.45Å
783	Q	91.7	Very high	92.3	Very high	98 Å²	98	37.2 Å²	37.2	46%	0.458	19%	0.19	S	C	.	.	H	α-helix	trans	-66	-29.7	-178.8	-66.9	-61.5	-32.5	0	0	113.1	Y781 K787	Y781-Q783 VanDerWaalsContact C-N 3.33Å; Y781-Q783 PolarHBondContact O-N 3.28Å; Q783-K787 WeakPolarHBondContact O-CG 2.98Å
784	K	94	Very high	92	Very high	83 Å²	83	41 Å²	41	36%	0.361	22%	0.215	S	C	.	.	H	α-helix	trans	-75.5	-41.5	176.1	-65	-175.1	171.8	-178.6	0	111.3	Y781 T782 K787 N788 M789 D831 L834	Y781-K784 HydrophobicContact CD1-CD 4.08Å; Y781-K784 WeakPolarHBondContact O-CA 3.19Å; Y781-K784 WeakPolarHBondContact O-CB 3.21Å; Y781-K784 PolarHBondContact O-N 3.49Å; T782-K784 VanDerWaalsContact C-N 3.27Å; T782-K784 PolarHBondContact O-N 3.36Å; K784-K787 CarbonylContact O-C 3.47Å; K784-K787 PolarHBondContact O-N 3.42Å; K784-N788 PolarHBondContact O-N 2.9Å; K784-M789 HydrophobicContact CB-CB 4.21Å; K784-M789 HydrophobicContact CB-SD 3.88Å; K784-M789 HydrophobicContact CG-CE 4.37Å; K784-M789 HydrophobicContact CG-SD 3.91Å; K784-M789 WeakPolarHBondContact O-CB 3.37Å; K784-M789 WeakPolarHBondContact O-CG 3.38Å; K784-M789 PolarHBondContact O-N 2.8Å; K784-D831 HydrophobicContact CD-CB 4.19Å; K784-D831 WeakPolarHBondContact CD-OD2 3.41Å; K784-D831 WeakPolarHBondContact CE-OD2 3.25Å; K784-D831 IonicContact NZ-OD2 3.1Å; K784-D831 PolarHBondContact NZ-OD2 3.47Å; K784-L834 HydrophobicContact CB-CD2 3.8Å
785	V	94.8	Very high	91.7	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.012	22%	0.218	C	C	.	.	H	α-helix	trans	-65.6	-40.3	176.4	174.3	0	0	0	0	111.8	F744 V768 L772 Y781 T782 K787 N788 H790 L834	F744-V785 HydrophobicContact CD2-CG1 3.56Å; F744-V785 WeakPolarHBondContact CD2-O 3.01Å; F744-V785 HydrophobicContact CE2-CG1 3.28Å; F744-V785 HydrophobicContact CZ-CG1 4.11Å; V768-V785 HydrophobicContact CB-CG1 4.45Å; V768-V785 HydrophobicContact CG1-CB 3.58Å; V768-V785 HydrophobicContact CG1-CG1 3.5Å; V768-V785 VanDerWaalsContact CG1-CG1 3.5Å; V768-V785 HydrophobicContact CG1-CG2 4.42Å; V768-V785 HydrophobicContact CG2-CG1 4.09Å; L772-V785 HydrophobicContact CD1-CG2 4.32Å; L772-V785 HydrophobicContact CD2-CG2 4.08Å; Y781-V785 PolarHBondContact O-N 2.93Å; T782-V785 PolarHBondContact O-N 3.21Å; V785-K787 PolarHBondContact O-N 2.92Å; V785-N788 WeakPolarHBondContact O-CA 3.17Å; V785-N788 PolarHBondContact O-N 3.29Å; V785-H790 HydrophobicContact CG2-CB 4.4Å; V785-H790 PolarHBondContact O-CE1 2.9Å; V785-L834 HydrophobicContact CG2-CD1 4.18Å; V785-L834 HydrophobicContact CG2-CD2 3.74Å; V785-L834 HydrophobicContact CG2-CG 4.38Å
786	L	92.8	Very high	91.3	Very high	20 Å²	20	42.7 Å²	42.7	11%	0.105	22%	0.222	C	C	.	.	H	α-helix	trans	-57.4	-29.5	174.2	-80.6	171.7	0	0	0	113.2	L745 P764 E765 V768 T782 N788	L745-L786 WeakPolarHBondContact CD2-O 3.33Å; P764-L786 HydrophobicContact CB-CD2 3.55Å; E765-L786 HydrophobicContact CB-CD1 4.13Å; E765-L786 HydrophobicContact CG-CD1 4.13Å; V768-L786 HydrophobicContact CB-CD2 4.42Å; V768-L786 HydrophobicContact CB-CG 4.4Å; V768-L786 HydrophobicContact CG2-CD2 3.67Å; V768-L786 HydrophobicContact CG2-CG 3.99Å; T782-L786 HydrophobicContact CG2-CD1 4.17Å; T782-L786 WeakPolarHBondContact O-CG 3.4Å; T782-L786 PolarHBondContact O-N 3.45Å; L786-N788 VanDerWaalsContact C-N 3.3Å
787	K	93	Very high	90.9	Very high	128 Å²	128	44.3 Å²	44.3	56%	0.557	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.5	12.4	176.3	-65.4	179.1	-178.6	-174.3	0	112.8	Q783 K784 V785 M789 V825	Q783-K787 WeakPolarHBondContact O-CG 2.98Å; K784-K787 CarbonylContact O-C 3.47Å; K784-K787 PolarHBondContact O-N 3.42Å; V785-K787 PolarHBondContact O-N 2.92Å; K787-M789 HydrophobicContact CB-CG 3.88Å; K787-M789 HydrophobicContact CB-SD 4.09Å; K787-M789 HydrophobicContact CD-SD 4.24Å; K787-M789 PolarHBondContact O-N 2.86Å; K787-M789 VanDerWaalsContact O-N 3.13Å; K787-V825 WeakPolarHBondContact O-CG2 3.18Å
788	N	94.7	Very high	90.7	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	25.7	-175	-67.8	-18.5	0	0	0	114.4	S742 D743 F744 L745 K784 V785 L786 H790 V791 R796 V825	S742-N788 PolarHBondContact O-OD1 2.96Å; D743-N788 WeakPolarHBondContact CA-OD1 3.37Å; D743-N788 PolarHBondContact OD1-ND2 2.82Å; F744-N788 PolarHBondContact N-OD1 3.46Å; L745-N788 HydrophobicContact CD1-CB 4.13Å; K784-N788 PolarHBondContact O-N 2.9Å; V785-N788 WeakPolarHBondContact O-CA 3.17Å; V785-N788 PolarHBondContact O-N 3.29Å; L786-N788 VanDerWaalsContact C-N 3.3Å; N788-H790 PolarHBondContact O-N 3.36Å; N788-H790 VanDerWaalsContact O-N 3.14Å; N788-V791 PolarHBondContact O-N 3.15Å; N788-R796 PolarHBondContact O-NH2 2.75Å; N788-V825 HydrophobicContact CB-CG2 3.82Å
789	M	95.1	Very high	90.8	Very high	37 Å²	37	44.4 Å²	44.4	18%	0.182	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-5.7	-178.3	-61.3	169.4	74.5	0	0	112.8	K784 K787 D829 D831	K784-M789 HydrophobicContact CB-CB 4.21Å; K784-M789 HydrophobicContact CB-SD 3.88Å; K784-M789 HydrophobicContact CG-CE 4.37Å; K784-M789 HydrophobicContact CG-SD 3.91Å; K784-M789 WeakPolarHBondContact O-CB 3.37Å; K784-M789 WeakPolarHBondContact O-CG 3.38Å; K784-M789 PolarHBondContact O-N 2.8Å; K787-M789 HydrophobicContact CB-CG 3.88Å; K787-M789 HydrophobicContact CB-SD 4.09Å; K787-M789 HydrophobicContact CD-SD 4.24Å; K787-M789 PolarHBondContact O-N 2.86Å; K787-M789 VanDerWaalsContact O-N 3.13Å; M789-D829 WeakPolarHBondContact CB-O 3.31Å; M789-D829 WeakPolarHBondContact CE-O 3.45Å; M789-D829 VanDerWaalsContact CG-O 3.23Å; M789-D829 WeakPolarHBondContact CG-O 3.35Å; M789-D831 HydrophobicContact CB-CB 4.5Å; M789-D831 PolarHBondContact O-N 2.85Å
790	H	94.7	Very high	90.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	4.8	179.3	64.2	-64.1	0	0	0	114	F741 F744 V785 N788 L834 A835 M838	F741-H790 PolarHBondContact O-NE2 3.16Å; F744-H790 AromaticContact CD2-CE1 3.82Å; F744-H790 AromaticContact CE2-CE1 3.92Å; F744-H790 AromaticContact CE2-NE2 3.9Å; V785-H790 HydrophobicContact CG2-CB 4.4Å; V785-H790 PolarHBondContact O-CE1 2.9Å; N788-H790 PolarHBondContact O-N 3.36Å; N788-H790 VanDerWaalsContact O-N 3.14Å; H790-L834 HydrophobicContact CB-CD2 3.72Å; H790-L834 HydrophobicContact CB-CG 3.61Å; H790-A835 VanDerWaalsContact O-CA 3.27Å; H790-A835 WeakPolarHBondContact O-CA 3.45Å; H790-A835 WeakPolarHBondContact O-CB 3.38Å; H790-M838 HydrophobicContact CB-CB 4.36Å; H790-M838 HydrophobicContact CB-CG 4.11Å
791	V	93.2	Very high	90.4	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.012	26%	0.262	C	S	.	.			trans	-121.4	114.3	-178	-172.6	0	0	0	0	111.4	S742 N788 L795 R796 F799 I830 L842	S742-V791 VanDerWaalsContact O-CG2 3.23Å; S742-V791 WeakPolarHBondContact O-CG2 3.44Å; N788-V791 PolarHBondContact O-N 3.15Å; V791-L795 HydrophobicContact CG1-CB 3.8Å; V791-R796 HydrophobicContact CB-CG 4.33Å; V791-R796 HydrophobicContact CG1-CG 3.58Å; V791-R796 PolarHBondContact O-NE 3.21Å; V791-R796 PolarHBondContact O-NH2 3.46Å; V791-F799 HydrophobicContact CG1-CD2 3.91Å; V791-F799 HydrophobicContact CG1-CE2 3.69Å; V791-I830 WeakPolarHBondContact O-CD1 3.39Å; V791-L842 HydrophobicContact CG2-CD1 3.93Å
792	T	91.4	Very high	90	Very high	31 Å²	31	54.7 Å²	54.7	19%	0.19	26%	0.261	C	S	.	.			trans	-72.9	158.3	176.3	61	0	0	0	0	111.9	L795 R796 I830 Y832 A835	T792-L795 PolarHBondContact O-N 2.96Å; T792-L795 VanDerWaalsContact O-N 3.08Å; T792-R796 PolarHBondContact O-N 3.3Å; T792-I830 HydrophobicContact CG2-CG2 4.23Å; T792-Y832 HydrophobicContact CG2-CD1 4.25Å; T792-Y832 HydrophobicContact CG2-CE1 4.1Å; T792-A835 HydrophobicContact CG2-CB 4.03Å
793	E	86.3	Confident	89.8	Confident	96 Å²	96	55 Å²	55	45%	0.449	26%	0.262	S	S	.	.	H	α-helix	trans	-57.9	-40.2	-178.1	-168.3	58.6	-153.7	0	0	114.4	L795 R796 S797	E793-L795 VanDerWaalsContact C-N 3.31Å; E793-L795 PolarHBondContact O-N 3.14Å; E793-R796 PolarHBondContact O-N 2.91Å; E793-S797 PolarHBondContact O-N 2.89Å; E793-S797 VanDerWaalsContact O-N 3.08Å; E793-S797 PolarHBondContact O-OG 3.2Å
794	P	86.8	Confident	89.7	Confident	101 Å²	101	52.4 Å²	52.4	66%	0.656	26%	0.255	S	S	*	.	H	α-helix	trans	-58.9	-40.7	173.4	-26	35.8	0	0	0	113	S797 L798	P794-S797 PolarHBondContact O-N 3.43Å; P794-L798 PolarHBondContact O-N 2.91Å
795	L	89.1	Confident	89.6	Confident	13 Å²	13	49.6 Å²	49.6	7%	0.068	24%	0.243	C	C	.	.	H	α-helix	trans	-69.9	-40.9	177.6	-69.3	176.9	0	0	0	111.8	V791 T792 E793 S797 L798 F799 R839 L842 L843	V791-L795 HydrophobicContact CG1-CB 3.8Å; T792-L795 PolarHBondContact O-N 2.96Å; T792-L795 VanDerWaalsContact O-N 3.08Å; E793-L795 VanDerWaalsContact C-N 3.31Å; E793-L795 PolarHBondContact O-N 3.14Å; L795-S797 VanDerWaalsContact C-N 3.25Å; L795-S797 PolarHBondContact O-N 2.94Å; L795-L798 WeakPolarHBondContact O-CB 2.87Å; L795-L798 PolarHBondContact O-N 3.46Å; L795-L798 VanDerWaalsContact O-N 3.08Å; L795-F799 HydrophobicContact CB-CD2 4.39Å; L795-F799 HydrophobicContact CB-CE2 3.78Å; L795-F799 HydrophobicContact CB-CZ 4.21Å; L795-F799 HydrophobicContact CD2-CZ 4.46Å; L795-F799 WeakPolarHBondContact O-CD2 3.16Å; L795-F799 VanDerWaalsContact O-CG 3.3Å; L795-F799 WeakPolarHBondContact O-CG 3.43Å; L795-F799 PolarHBondContact O-N 3.37Å; L795-R839 HydrophobicContact CD1-CG 4.16Å; L795-L842 HydrophobicContact CD1-CD1 4.49Å; L795-L843 HydrophobicContact CD2-CD1 3.91Å; L795-L843 HydrophobicContact CD2-CD2 3.96Å; L795-L843 HydrophobicContact CD2-CG 4.15Å
796	R	87.8	Confident	89.4	Confident	32 Å²	32	51.7 Å²	51.7	12%	0.121	27%	0.265	C	S	.	.	H	α-helix	trans	-56.2	-43.1	174.6	-66.3	-172.7	-163.3	-95.2	-14.7	111.5	N788 V791 T792 E793 L798 F799 K800 V825	N788-R796 PolarHBondContact O-NH2 2.75Å; V791-R796 HydrophobicContact CB-CG 4.33Å; V791-R796 HydrophobicContact CG1-CG 3.58Å; V791-R796 PolarHBondContact O-NE 3.21Å; V791-R796 PolarHBondContact O-NH2 3.46Å; T792-R796 PolarHBondContact O-N 3.3Å; E793-R796 PolarHBondContact O-N 2.91Å; R796-L798 VanDerWaalsContact C-N 3.29Å; R796-L798 PolarHBondContact O-N 3.17Å; R796-F799 PolarHBondContact O-N 3.45Å; R796-K800 WeakPolarHBondContact O-CG 3.25Å; R796-K800 PolarHBondContact O-N 2.97Å; R796-V825 VanDerWaalsContact NH1-CG2 3.34Å; R796-V825 VanDerWaalsContact NH2-CB 3.29Å
797	S	85.8	Confident	89.2	Confident	59 Å²	59	54.9 Å²	54.9	41%	0.413	28%	0.281	S	S	.	.	H	α-helix	trans	-63	-36.1	178.1	-65.8	0	0	0	0	112.6	E793 P794 L795	E793-S797 PolarHBondContact O-N 2.89Å; E793-S797 VanDerWaalsContact O-N 3.08Å; E793-S797 PolarHBondContact O-OG 3.2Å; P794-S797 PolarHBondContact O-N 3.43Å; L795-S797 VanDerWaalsContact C-N 3.25Å; L795-S797 PolarHBondContact O-N 2.94Å
798	L	87.3	Confident	89.2	Confident	62 Å²	62	48.9 Å²	48.9	33%	0.325	26%	0.255	S	S	.	.	H	α-helix	trans	-68.6	-46.2	173.8	-172.6	69.7	0	0	0	111.6	P794 L795 R796 K800 R801 L843	P794-L798 PolarHBondContact O-N 2.91Å; L795-L798 WeakPolarHBondContact O-CB 2.87Å; L795-L798 PolarHBondContact O-N 3.46Å; L795-L798 VanDerWaalsContact O-N 3.08Å; R796-L798 VanDerWaalsContact C-N 3.29Å; R796-L798 PolarHBondContact O-N 3.17Å; L798-K800 VanDerWaalsContact C-N 3.32Å; L798-K800 PolarHBondContact O-N 3.12Å; L798-R801 WeakPolarHBondContact O-CB 3.49Å; L798-R801 PolarHBondContact O-N 3.32Å; L798-L843 HydrophobicContact CD2-CD2 3.47Å; L798-L843 VanDerWaalsContact CD2-CD2 3.47Å
799	F	89.2	Confident	89.2	Confident	7 Å²	7	50.5 Å²	50.5	3%	0.031	27%	0.266	C	S	.	.	H	α-helix	trans	-64.9	-32.7	-178.7	-60.5	-38.5	0	0	0	113.4	S742 V791 L795 R796 R801 H802 Q803 L842 L843 M851	S742-F799 VanDerWaalsContact CB-CD2 3.45Å; S742-F799 VanDerWaalsContact CB-CE2 3.45Å; V791-F799 HydrophobicContact CG1-CD2 3.91Å; V791-F799 HydrophobicContact CG1-CE2 3.69Å; L795-F799 HydrophobicContact CB-CD2 4.39Å; L795-F799 HydrophobicContact CB-CE2 3.78Å; L795-F799 HydrophobicContact CB-CZ 4.21Å; L795-F799 HydrophobicContact CD2-CZ 4.46Å; L795-F799 WeakPolarHBondContact O-CD2 3.16Å; L795-F799 VanDerWaalsContact O-CG 3.3Å; L795-F799 WeakPolarHBondContact O-CG 3.43Å; L795-F799 PolarHBondContact O-N 3.37Å; R796-F799 PolarHBondContact O-N 3.45Å; F799-R801 PolarHBondContact O-N 3.09Å; F799-H802 PolarHBondContact O-N 3.31Å; F799-Q803 HydrophobicContact CB-CG 4.1Å; F799-Q803 VanDerWaalsContact O-CG 3.25Å; F799-Q803 WeakPolarHBondContact O-CG 3.4Å; F799-Q803 PolarHBondContact O-N 3.33Å; F799-L842 HydrophobicContact CE1-CB 4.47Å; F799-L842 HydrophobicContact CE2-CB 4.39Å; F799-L842 HydrophobicContact CE2-CD1 4.31Å; F799-L842 HydrophobicContact CZ-CB 3.67Å; F799-L842 HydrophobicContact CZ-CD1 4.34Å; F799-L843 HydrophobicContact CE1-CD2 3.79Å; F799-L843 HydrophobicContact CZ-CD2 4.08Å; F799-M851 HydrophobicContact CD1-CE 4.1Å; F799-M851 HydrophobicContact CD1-SD 3.35Å; F799-M851 WeakPolarHBondContact CD1-SD 3.35Å; F799-M851 HydrophobicContact CE1-CG 4.35Å; F799-M851 HydrophobicContact CE1-SD 3.73Å; F799-M851 HydrophobicContact CG-SD 4.4Å
800	K	85.9	Confident	89	Confident	130 Å²	130	53.6 Å²	53.6	57%	0.565	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-22.6	174.1	-79.6	173.7	-176.1	167.8	0	114	R796 L798 Q803	R796-K800 WeakPolarHBondContact O-CG 3.25Å; R796-K800 PolarHBondContact O-N 2.97Å; L798-K800 VanDerWaalsContact C-N 3.32Å; L798-K800 PolarHBondContact O-N 3.12Å; K800-Q803 VanDerWaalsContact CA-O 3.32Å; K800-Q803 WeakPolarHBondContact CA-O 3.29Å
801	R	82.3	Confident	88.8	Confident	201 Å²	201	57 Å²	57	76%	0.758	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-23.4	175.7	-58.2	-179.8	-177.4	177.5	-0.2	113.6	L798 F799	L798-R801 WeakPolarHBondContact O-CB 3.49Å; L798-R801 PolarHBondContact O-N 3.32Å; F799-R801 PolarHBondContact O-N 3.09Å
802	H	82.6	Confident	88.8	Confident	41 Å²	41	57.5 Å²	57.5	19%	0.19	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	-29	-176.3	-61	-52.3	0	0	0	112.8	F799 M851 K881	F799-H802 PolarHBondContact O-N 3.31Å; H802-M851 HydrophobicContact CB-CE 4.14Å; H802-M851 HydrophobicContact CB-SD 4.14Å; H802-K881 PolarHBondContact ND1-NZ 3.47Å; H802-K881 VanDerWaalsContact ND1-NZ 3.13Å
803	Q	87.7	Confident	88.9	Confident	11 Å²	11	60.1 Å²	60.1	5%	0.051	32%	0.323	C	S	.	.			trans	-139.4	122.3	-179.1	51.7	-178.1	67.2	0	0	109.5	S742 D743 F799 K800 L850 M851 W877	S742-Q803 PolarHBondContact OG-NE2 2.97Å; S742-Q803 PolarHBondContact OG-OE1 3.31Å; D743-Q803 VanDerWaalsContact CB-NE2 3.31Å; F799-Q803 HydrophobicContact CB-CG 4.1Å; F799-Q803 VanDerWaalsContact O-CG 3.25Å; F799-Q803 WeakPolarHBondContact O-CG 3.4Å; F799-Q803 PolarHBondContact O-N 3.33Å; K800-Q803 VanDerWaalsContact CA-O 3.32Å; K800-Q803 WeakPolarHBondContact CA-O 3.29Å; Q803-L850 HydrophobicContact CB-CD2 4.04Å; Q803-M851 HydrophobicContact CG-CE 4.14Å; Q803-W877 HydrophobicContact CB-CD2 3.75Å; Q803-W877 HydrophobicContact CB-CE3 3.59Å; Q803-W877 HydrophobicContact CB-CG 4.4Å; Q803-W877 HydrophobicContact CB-CH2 4.05Å; Q803-W877 HydrophobicContact CB-CZ2 4.22Å; Q803-W877 HydrophobicContact CB-CZ3 3.74Å
804	S	89.8	Confident	89	Confident	43 Å²	43	58.8 Å²	58.8	30%	0.301	32%	0.319	S	S	.	.			trans	-141.1	131.4	175.7	173.9	0	0	0	0	109.2	G806 I807 W877	S804-G806 PolarHBondContact O-N 3.26Å; S804-G806 PolarHBondContact OG-N 3.03Å; S804-I807 PolarHBondContact O-N 2.9Å; S804-I807 VanDerWaalsContact O-N 3.15Å; S804-W877 PolarHBondContact O-NE1 3.45Å
805	H	92.2	Very high	89.2	Confident	25 Å²	25	59.5 Å²	59.5	12%	0.116	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-58.5	-31.1	177.9	-64.8	-168	0	0	0	110.9	D743 I807 L808 R813 Y818 W877	D743-H805 IonicContact OD2-CE1 2.67Å; D743-H805 IonicContact OD2-NE2 3.15Å; D743-H805 PolarHBondContact OD2-NE2 3.46Å; D743-H805 VanDerWaalsContact OD2-NE2 3.11Å; H805-I807 PolarHBondContact O-N 3.06Å; H805-L808 WeakPolarHBondContact O-CB 3.48Å; H805-L808 PolarHBondContact O-N 3.4Å; H805-L808 VanDerWaalsContact O-N 3.11Å; H805-R813 VanDerWaalsContact O-CD 3.23Å; H805-R813 WeakPolarHBondContact O-CD 3.23Å; H805-R813 PolarHBondContact O-NE 3.24Å; H805-Y818 AromaticContact ND1-CE2 3.69Å; H805-Y818 AromaticContact ND1-CZ 3.62Å; H805-Y818 PolarHBondContact ND1-OH 3.45Å; H805-W877 AromaticContact CD2-CH2 3.9Å; H805-W877 AromaticContact CD2-CZ2 3.69Å
806	G	89.3	Confident	89.1	Confident	46 Å²	46	63 Å²	63	47%	0.474	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-64.3	-21.9	-179.2	0	0	0	0	0	115	S804 L808 R813	S804-G806 PolarHBondContact O-N 3.26Å; S804-G806 PolarHBondContact OG-N 3.03Å; G806-L808 VanDerWaalsContact C-N 3.35Å; G806-R813 PolarHBondContact O-NH2 2.7Å
807	I	89.7	Confident	89	Confident	86 Å²	86	62.6 Å²	62.6	44%	0.441	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-80.5	-20.1	178.5	-63	171.7	0	0	0	111.3	S804 H805 V880	S804-I807 PolarHBondContact O-N 2.9Å; S804-I807 VanDerWaalsContact O-N 3.15Å; H805-I807 PolarHBondContact O-N 3.06Å; I807-V880 HydrophobicContact CG2-CB 4.43Å; I807-V880 HydrophobicContact CG2-CG1 3.99Å; I807-V880 HydrophobicContact CG2-CG2 4.14Å
808	L	93.4	Very high	89.3	Confident	2 Å²	2	61.3 Å²	61.3	1%	0.01	34%	0.335	C	S	.	.	S	Bend	trans	-68.4	145.6	179	-61.1	169.6	0	0	0	110.5	P747 H805 G806 Y812 R813 D873 Y876 W877	P747-L808 HydrophobicContact CG-CD1 3.71Å; H805-L808 WeakPolarHBondContact O-CB 3.48Å; H805-L808 PolarHBondContact O-N 3.4Å; H805-L808 VanDerWaalsContact O-N 3.11Å; G806-L808 VanDerWaalsContact C-N 3.35Å; L808-Y812 HydrophobicContact CD2-CD2 4.49Å; L808-R813 HydrophobicContact CB-CG 4.42Å; L808-R813 PolarHBondContact O-NE 3.02Å; L808-R813 VanDerWaalsContact O-NE 3.09Å; L808-R813 PolarHBondContact O-NH2 3.47Å; L808-D873 HydrophobicContact CD1-CB 4.02Å; L808-D873 WeakPolarHBondContact CD1-OD2 3.1Å; L808-D873 HydrophobicContact CD2-CB 3.96Å; L808-Y876 HydrophobicContact CD2-CD1 3.86Å; L808-Y876 HydrophobicContact CD2-CG 4.24Å; L808-W877 HydrophobicContact CD1-CZ2 3.98Å; L808-W877 HydrophobicContact CG-CZ2 4.35Å
809	P	92.9	Very high	89.5	Confident	35 Å²	35	61.1 Å²	61.1	23%	0.227	33%	0.334	C	S	.	.			trans	-49.1	148	173.6	-27.3	34.9	0	0	0	112	S811 Y812 Y876	P809-S811 PolarHBondContact O-N 3.36Å; P809-Y812 HydrophobicContact CB-CD1 4.39Å; P809-Y812 HydrophobicContact CB-CD2 4.48Å; P809-Y812 HydrophobicContact CB-CG 4.21Å; P809-Y812 HydrophobicContact CG-CD2 4.01Å; P809-Y812 HydrophobicContact CG-CE2 4.09Å; P809-Y812 HydrophobicContact CG-CG 4.23Å; P809-Y812 WeakPolarHBondContact O-CB 3.27Å; P809-Y812 PolarHBondContact O-N 2.82Å; P809-Y876 HydrophobicContact CG-CD2 4.35Å; P809-Y876 HydrophobicContact CG-CE1 4.23Å; P809-Y876 HydrophobicContact CG-CE2 3.63Å
810	S	91.6	Very high	89.4	Confident	102 Å²	102	63.3 Å²	63.3	71%	0.713	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-59	-36.6	177.6	48.9	0	0	0	0	112.1	Y812 R813	S810-Y812 PolarHBondContact O-N 3.44Å; S810-R813 CarbonylContact O-C 3.59Å; S810-R813 PolarHBondContact O-N 3.03Å
811	S	90.6	Very high	89.3	Confident	73 Å²	73	60.6 Å²	60.6	51%	0.51	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-61.1	-22.7	174.5	56.1	0	0	0	0	113.8	P809	P809-S811 PolarHBondContact O-N 3.36Å
812	Y	93.3	Very high	89.2	Confident	11 Å²	11	55.4 Å²	55.4	4%	0.043	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-84.8	-15.8	177.9	-73.4	9	0	0	0	112.3	P747 L808 P809 S810 F817 R872 Y876 H893	P747-Y812 WeakPolarHBondContact CB-O 3.19Å; L808-Y812 HydrophobicContact CD2-CD2 4.49Å; P809-Y812 HydrophobicContact CB-CD1 4.39Å; P809-Y812 HydrophobicContact CB-CD2 4.48Å; P809-Y812 HydrophobicContact CB-CG 4.21Å; P809-Y812 HydrophobicContact CG-CD2 4.01Å; P809-Y812 HydrophobicContact CG-CE2 4.09Å; P809-Y812 HydrophobicContact CG-CG 4.23Å; P809-Y812 WeakPolarHBondContact O-CB 3.27Å; P809-Y812 PolarHBondContact O-N 2.82Å; S810-Y812 PolarHBondContact O-N 3.44Å; Y812-F817 WeakPolarHBondContact O-CE2 3.29Å; Y812-R872 HydrophobicContact CE2-CG 4.08Å; Y812-R872 PolarHBondContact O-NH2 3.24Å; Y812-Y876 AromaticContact CE2-CD2 4Å; Y812-Y876 HydrophobicContact CE2-CD2 4Å; Y812-Y876 HydrophobicContact CE2-CG 4.39Å; Y812-H893 AromaticContact CZ-CE1 3.98Å; Y812-H893 PolarHBondContact OH-CD2 3.02Å; Y812-H893 PolarHBondContact OH-CE1 2.84Å; Y812-H893 VanDerWaalsContact OH-CG 3.3Å; Y812-H893 PolarHBondContact OH-ND1 2.91Å; Y812-H893 VanDerWaalsContact OH-ND1 3.11Å; Y812-H893 PolarHBondContact OH-NE2 3.5Å
813	R	92.7	Very high	88.9	Confident	87 Å²	87	54.4 Å²	54.4	33%	0.328	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-112	38.5	-177.1	-67.7	-176.4	-80.3	152.4	-7.4	111.7	P747 H805 G806 L808 S810 P815 Y818	P747-R813 HydrophobicContact CB-CG 4.5Å; P747-R813 HydrophobicContact CG-CG 3.86Å; H805-R813 VanDerWaalsContact O-CD 3.23Å; H805-R813 WeakPolarHBondContact O-CD 3.23Å; H805-R813 PolarHBondContact O-NE 3.24Å; G806-R813 PolarHBondContact O-NH2 2.7Å; L808-R813 HydrophobicContact CB-CG 4.42Å; L808-R813 PolarHBondContact O-NE 3.02Å; L808-R813 VanDerWaalsContact O-NE 3.09Å; L808-R813 PolarHBondContact O-NH2 3.47Å; S810-R813 CarbonylContact O-C 3.59Å; S810-R813 PolarHBondContact O-N 3.03Å; R813-P815 WeakPolarHBondContact O-CD 3.21Å; R813-Y818 HydrophobicContact CB-CD1 3.74Å; R813-Y818 HydrophobicContact CB-CE1 4.1Å; R813-Y818 HydrophobicContact CG-CD1 4.06Å; R813-Y818 HydrophobicContact CG-CE1 4.05Å
814	D	89.7	Confident	88.6	Confident	68 Å²	68	61.8 Å²	61.8	36%	0.364	37%	0.366	S	S	.	.			trans	-62.7	124.8	-179.7	-169.3	-50.3	0	0	0	110.6	S816 F817 Y818	D814-S816 PolarHBondContact O-N 3.5Å; D814-S816 WeakPolarHBondContact OD1-CB 3.39Å; D814-S816 PolarHBondContact OD1-N 2.7Å; D814-S816 PolarHBondContact OD1-OG 2.9Å; D814-F817 HydrophobicContact CB-CD1 3.78Å; D814-F817 HydrophobicContact CB-CE1 3.28Å; D814-F817 HydrophobicContact CB-CE2 4.39Å; D814-F817 HydrophobicContact CB-CZ 3.6Å; D814-F817 PolarHBondContact O-N 3.39Å; D814-F817 VanDerWaalsContact O-N 3.11Å; D814-Y818 WeakPolarHBondContact O-CB 3.5Å; D814-Y818 PolarHBondContact O-N 2.63Å
815	P	89.8	Confident	88.2	Confident	115 Å²	115	60.7 Å²	60.7	75%	0.747	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-19.8	179.7	-25.4	35.1	0	0	0	115.1	R813 F817	R813-P815 WeakPolarHBondContact O-CD 3.21Å; P815-F817 VanDerWaalsContact C-N 3.26Å; P815-F817 PolarHBondContact O-N 3.08Å
816	S	87.1	Confident	87.8	Confident	87 Å²	87	63.8 Å²	63.8	61%	0.608	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-29.6	176.2	62.4	0	0	0	0	113.1	R754 D814	R754-S816 PolarHBondContact NH1-O 2.85Å; D814-S816 PolarHBondContact O-N 3.5Å; D814-S816 WeakPolarHBondContact OD1-CB 3.39Å; D814-S816 PolarHBondContact OD1-N 2.7Å; D814-S816 PolarHBondContact OD1-OG 2.9Å
817	F	86.9	Confident	87.5	Confident	23 Å²	23	65.4 Å²	65.4	10%	0.101	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.8	-11.2	-178.7	64.8	-109.1	0	0	0	114.6	L751 R754 Y812 D814 P815	L751-F817 HydrophobicContact CB-CD2 3.71Å; L751-F817 HydrophobicContact CB-CE2 4.06Å; L751-F817 HydrophobicContact CB-CG 4.18Å; L751-F817 HydrophobicContact CD1-CB 3.82Å; L751-F817 HydrophobicContact CD1-CD1 3.64Å; L751-F817 HydrophobicContact CD1-CD2 3.95Å; L751-F817 HydrophobicContact CD1-CE1 4.07Å; L751-F817 HydrophobicContact CD1-CE2 4.41Å; L751-F817 HydrophobicContact CD1-CG 3.55Å; L751-F817 HydrophobicContact CD1-CZ 4.46Å; L751-F817 HydrophobicContact CD2-CE1 4.5Å; L751-F817 HydrophobicContact CD2-CE2 4.38Å; L751-F817 HydrophobicContact CD2-CZ 4.31Å; L751-F817 HydrophobicContact CG-CD2 4.31Å; L751-F817 HydrophobicContact CG-CG 4.39Å; R754-F817 PolarHBondContact NE-O 3.26Å; R754-F817 VanDerWaalsContact NE-O 3.13Å; R754-F817 PolarHBondContact NH1-O 3.35Å; R754-F817 PolarHBondContact NH2-O 2.7Å; Y812-F817 WeakPolarHBondContact O-CE2 3.29Å; D814-F817 HydrophobicContact CB-CD1 3.78Å; D814-F817 HydrophobicContact CB-CE1 3.28Å; D814-F817 HydrophobicContact CB-CE2 4.39Å; D814-F817 HydrophobicContact CB-CZ 3.6Å; D814-F817 PolarHBondContact O-N 3.39Å; D814-F817 VanDerWaalsContact O-N 3.11Å; P815-F817 VanDerWaalsContact C-N 3.26Å; P815-F817 PolarHBondContact O-N 3.08Å
818	Y	92	Very high	87.3	Confident	32 Å²	32	67.9 Å²	67.9	13%	0.125	39%	0.386	C	S	.	.			trans	-117.1	125.8	-178.5	171.9	-114.3	0	0	0	111.5	P747 H805 R813 D814 A820	P747-Y818 HydrophobicContact CB-CD2 3.76Å; P747-Y818 HydrophobicContact CB-CE2 4.3Å; P747-Y818 HydrophobicContact CB-CG 3.95Å; P747-Y818 HydrophobicContact CG-CD1 4.34Å; P747-Y818 HydrophobicContact CG-CD2 3.6Å; P747-Y818 HydrophobicContact CG-CE1 4.36Å; P747-Y818 HydrophobicContact CG-CE2 3.63Å; P747-Y818 HydrophobicContact CG-CG 3.96Å; H805-Y818 AromaticContact ND1-CE2 3.69Å; H805-Y818 AromaticContact ND1-CZ 3.62Å; H805-Y818 PolarHBondContact ND1-OH 3.45Å; R813-Y818 HydrophobicContact CB-CD1 3.74Å; R813-Y818 HydrophobicContact CB-CE1 4.1Å; R813-Y818 HydrophobicContact CG-CD1 4.06Å; R813-Y818 HydrophobicContact CG-CE1 4.05Å; D814-Y818 WeakPolarHBondContact O-CB 3.5Å; D814-Y818 PolarHBondContact O-N 2.63Å; Y818-A820 HydrophobicContact CE1-CB 4.22Å
819	N	91.2	Very high	87.1	Confident	58 Å²	58	71.3 Å²	71.3	31%	0.31	41%	0.405	S	S	.	.			trans	-124.4	116.9	173.7	-176.6	3	0	0	0	110.1	Q750 S821 E822	Q750-N819 PolarHBondContact NE2-O 3.11Å; Q750-N819 PolarHBondContact OE1-O 3.16Å; N819-S821 VanDerWaalsContact CG-OG 3.3Å; N819-S821 PolarHBondContact ND2-OG 3.05Å; N819-S821 VanDerWaalsContact ND2-OG 3.09Å; N819-S821 PolarHBondContact O-N 2.94Å; N819-S821 PolarHBondContact OD1-N 3.45Å; N819-S821 PolarHBondContact OD1-OG 3.49Å; N819-E822 HydrophobicContact CB-CB 4.32Å; N819-E822 HydrophobicContact CB-CG 4.09Å; N819-E822 VanDerWaalsContact CB-OE1 3.27Å; N819-E822 WeakPolarHBondContact CB-OE1 3.23Å; N819-E822 PolarHBondContact ND2-OE1 2.83Å; N819-E822 PolarHBondContact O-N 3.23Å
820	A	86.5	Confident	87.1	Confident	54 Å²	54	70.4 Å²	70.4	45%	0.446	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-22.7	179	0	0	0	0	0	113.1	Y818 A823	Y818-A820 HydrophobicContact CE1-CB 4.22Å; A820-A823 PolarHBondContact O-N 3.07Å
821	S	83.9	Confident	87.2	Confident	72 Å²	72	66.6 Å²	66.6	50%	0.503	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-32.1	177.2	70.1	0	0	0	0	112.2	N819 A823 K824	N819-S821 VanDerWaalsContact CG-OG 3.3Å; N819-S821 PolarHBondContact ND2-OG 3.05Å; N819-S821 VanDerWaalsContact ND2-OG 3.09Å; N819-S821 PolarHBondContact O-N 2.94Å; N819-S821 PolarHBondContact OD1-N 3.45Å; N819-S821 PolarHBondContact OD1-OG 3.49Å; S821-A823 PolarHBondContact O-N 2.78Å; S821-K824 WeakPolarHBondContact O-CB 3.24Å; S821-K824 PolarHBondContact O-N 2.92Å; S821-K824 VanDerWaalsContact O-N 3.08Å
822	E	81	Confident	87.2	Confident	92 Å²	92	69.5 Å²	69.5	43%	0.43	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-28.6	173.9	-78.6	165.2	-136.2	0	0	112	L745 R754 N819 K824	L745-E822 WeakPolarHBondContact CD1-O 3.47Å; R754-E822 IonicContact NH2-OE1 3.98Å; R754-E822 PolarHBondContact NH2-OE1 2.95Å; R754-E822 IonicContact NH2-OE2 3.04Å; R754-E822 PolarHBondContact NH2-OE2 3.42Å; N819-E822 HydrophobicContact CB-CB 4.32Å; N819-E822 HydrophobicContact CB-CG 4.09Å; N819-E822 VanDerWaalsContact CB-OE1 3.27Å; N819-E822 WeakPolarHBondContact CB-OE1 3.23Å; N819-E822 PolarHBondContact ND2-OE1 2.83Å; N819-E822 PolarHBondContact O-N 3.23Å; E822-K824 VanDerWaalsContact C-N 3.27Å; E822-K824 PolarHBondContact O-N 2.87Å
823	A	76.1	Confident	87	Confident	20 Å²	20	72 Å²	72	17%	0.165	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-8.7	177.5	0	0	0	0	0	114	L745 A820 S821	L745-A823 HydrophobicContact CB-CB 4.12Å; A820-A823 PolarHBondContact O-N 3.07Å; S821-A823 PolarHBondContact O-N 2.78Å
824	K	80.4	Confident	87	Confident	166 Å²	166	67.9 Å²	67.9	72%	0.722	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-85	119.2	175.9	-67.3	-175.4	178.4	-178.8	0	109.6	S821 E822	S821-K824 WeakPolarHBondContact O-CB 3.24Å; S821-K824 PolarHBondContact O-N 2.92Å; S821-K824 VanDerWaalsContact O-N 3.08Å; E822-K824 VanDerWaalsContact C-N 3.27Å; E822-K824 PolarHBondContact O-N 2.87Å
825	V	82.1	Confident	87.2	Confident	20 Å²	20	64.9 Å²	64.9	12%	0.121	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-103	130	172.2	-175.4	0	0	0	0	107.9	L745 K787 N788 R796 D829 I830	L745-V825 HydrophobicContact CD1-CG2 4.43Å; K787-V825 WeakPolarHBondContact O-CG2 3.18Å; N788-V825 HydrophobicContact CB-CG2 3.82Å; R796-V825 VanDerWaalsContact NH1-CG2 3.34Å; R796-V825 VanDerWaalsContact NH2-CB 3.29Å; V825-D829 HydrophobicContact CG1-CB 3.94Å; V825-I830 HydrophobicContact CB-CD1 4.46Å; V825-I830 HydrophobicContact CG1-CD1 3.64Å
826	L	84	Confident	87.2	Confident	90 Å²	90	65.9 Å²	65.9	47%	0.471	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-79.9	149.1	-179.8	-55.4	172.1	0	0	0	109.8	Q828 D829	L826-Q828 VanDerWaalsContact CB-CD 3.4Å; L826-Q828 HydrophobicContact CB-CG 4.37Å; L826-Q828 VanDerWaalsContact CD1-NE2 3.27Å; L826-Q828 PolarHBondContact O-N 3.26Å; L826-Q828 VanDerWaalsContact O-N 3.13Å; L826-D829 WeakPolarHBondContact CB-OD2 3.34Å; L826-D829 WeakPolarHBondContact O-CB 3.34Å; L826-D829 PolarHBondContact O-N 3.42Å
827	P	82	Confident	87.5	Confident	80 Å²	80	64.3 Å²	64.3	52%	0.519	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-53.7	-34.3	-178.5	-28.5	36.1	0	0	0	114.4	D829 I830	P827-D829 VanDerWaalsContact C-N 3.28Å; P827-D829 PolarHBondContact O-N 3.28Å; P827-I830 WeakPolarHBondContact O-CB 3.43Å; P827-I830 WeakPolarHBondContact O-CG1 3.37Å; P827-I830 PolarHBondContact O-N 2.85Å
828	Q	85.5	Confident	87.8	Confident	139 Å²	139	63.4 Å²	63.4	65%	0.65	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-71.1	-18.9	177.6	68	-88.3	24.3	0	0	114.4	L826 I830	L826-Q828 VanDerWaalsContact CB-CD 3.4Å; L826-Q828 HydrophobicContact CB-CG 4.37Å; L826-Q828 VanDerWaalsContact CD1-NE2 3.27Å; L826-Q828 PolarHBondContact O-N 3.26Å; L826-Q828 VanDerWaalsContact O-N 3.13Å; Q828-I830 VanDerWaalsContact C-N 3.31Å
829	D	90.5	Very high	87.9	Confident	73 Å²	73	67.5 Å²	67.5	39%	0.39	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-87.5	-3.5	178.5	-61.4	-42.3	0	0	0	111.7	M789 V825 L826 P827 D831	M789-D829 WeakPolarHBondContact CB-O 3.31Å; M789-D829 WeakPolarHBondContact CE-O 3.45Å; M789-D829 VanDerWaalsContact CG-O 3.23Å; M789-D829 WeakPolarHBondContact CG-O 3.35Å; V825-D829 HydrophobicContact CG1-CB 3.94Å; L826-D829 WeakPolarHBondContact CB-OD2 3.34Å; L826-D829 WeakPolarHBondContact O-CB 3.34Å; L826-D829 PolarHBondContact O-N 3.42Å; P827-D829 VanDerWaalsContact C-N 3.28Å; P827-D829 PolarHBondContact O-N 3.28Å; D829-D831 PolarHBondContact O-N 3.47Å
830	I	91.9	Very high	87.7	Confident	16 Å²	16	73 Å²	73	8%	0.082	36%	0.356	C	S	.	.			trans	-72.7	127.8	180	-60	-56.8	0	0	0	110.3	V791 T792 V825 P827 Q828 Y832 A835	V791-I830 WeakPolarHBondContact O-CD1 3.39Å; T792-I830 HydrophobicContact CG2-CG2 4.23Å; V825-I830 HydrophobicContact CB-CD1 4.46Å; V825-I830 HydrophobicContact CG1-CD1 3.64Å; P827-I830 WeakPolarHBondContact O-CB 3.43Å; P827-I830 WeakPolarHBondContact O-CG1 3.37Å; P827-I830 PolarHBondContact O-N 2.85Å; Q828-I830 VanDerWaalsContact C-N 3.31Å; I830-Y832 HydrophobicContact CB-CD2 4.48Å; I830-Y832 HydrophobicContact CB-CE2 4.09Å; I830-Y832 HydrophobicContact CG2-CD1 4.05Å; I830-Y832 HydrophobicContact CG2-CD2 4.25Å; I830-Y832 HydrophobicContact CG2-CE1 3.98Å; I830-Y832 HydrophobicContact CG2-CE2 4.18Å; I830-Y832 HydrophobicContact CG2-CG 4.18Å; I830-Y832 PolarHBondContact O-N 3Å; I830-A835 HydrophobicContact CG2-CB 4.38Å
831	D	93.3	Very high	88.1	Confident	23 Å²	23	71.2 Å²	71.2	12%	0.123	34%	0.338	C	S	.	.			trans	-87.3	94.3	167.6	-175.4	-40.6	0	0	0	108.1	K784 M789 D829 T833 L834 A835	K784-D831 HydrophobicContact CD-CB 4.19Å; K784-D831 WeakPolarHBondContact CD-OD2 3.41Å; K784-D831 WeakPolarHBondContact CE-OD2 3.25Å; K784-D831 IonicContact NZ-OD2 3.1Å; K784-D831 PolarHBondContact NZ-OD2 3.47Å; M789-D831 HydrophobicContact CB-CB 4.5Å; M789-D831 PolarHBondContact O-N 2.85Å; D829-D831 PolarHBondContact O-N 3.47Å; D831-T833 VanDerWaalsContact C-N 3.26Å; D831-T833 PolarHBondContact O-N 3.33Å; D831-T833 WeakPolarHBondContact OD1-CB 3.45Å; D831-T833 PolarHBondContact OD1-N 3.39Å; D831-L834 HydrophobicContact CB-CB 3.89Å; D831-L834 HydrophobicContact CB-CD2 4.42Å; D831-L834 PolarHBondContact O-N 3.31Å; D831-L834 WeakPolarHBondContact OD1-CB 3.32Å; D831-L834 PolarHBondContact OD1-N 3.22Å; D831-A835 WeakPolarHBondContact O-CB 3.21Å; D831-A835 PolarHBondContact O-N 2.85Å
832	Y	90.6	Very high	88.6	Confident	133 Å²	133	67.9 Å²	67.9	52%	0.522	32%	0.315	S	S	.	.	H	α-helix	trans	-62.4	-30.9	-176.3	-72	-81.1	0	0	0	113.4	T792 I830 A835 R836	T792-Y832 HydrophobicContact CG2-CD1 4.25Å; T792-Y832 HydrophobicContact CG2-CE1 4.1Å; I830-Y832 HydrophobicContact CB-CD2 4.48Å; I830-Y832 HydrophobicContact CB-CE2 4.09Å; I830-Y832 HydrophobicContact CG2-CD1 4.05Å; I830-Y832 HydrophobicContact CG2-CD2 4.25Å; I830-Y832 HydrophobicContact CG2-CE1 3.98Å; I830-Y832 HydrophobicContact CG2-CE2 4.18Å; I830-Y832 HydrophobicContact CG2-CG 4.18Å; I830-Y832 PolarHBondContact O-N 3Å; Y832-A835 PolarHBondContact O-N 3.07Å; Y832-R836 WeakPolarHBondContact O-CB 3.43Å; Y832-R836 PolarHBondContact O-N 2.86Å
833	T	90.6	Very high	89	Confident	65 Å²	65	66.9 Å²	66.9	40%	0.399	31%	0.312	S	S	.	.	H	α-helix	trans	-64.2	-48.2	174.7	-63.7	0	0	0	0	110.5	D831 R836 M837	D831-T833 VanDerWaalsContact C-N 3.26Å; D831-T833 PolarHBondContact O-N 3.33Å; D831-T833 WeakPolarHBondContact OD1-CB 3.45Å; D831-T833 PolarHBondContact OD1-N 3.39Å; T833-R836 PolarHBondContact O-N 3.39Å; T833-M837 HydrophobicContact CG2-CE 4.2Å; T833-M837 WeakPolarHBondContact O-CG 3.5Å; T833-M837 PolarHBondContact O-N 3.35Å; T833-M837 VanDerWaalsContact O-N 3.12Å
834	L	92.5	Very high	89.9	Confident	0 Å²	0	68 Å²	68	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-64.9	-42.6	175.8	177.2	61.7	0	0	0	111.8	I777 Y781 K784 V785 H790 D831 R836 M837 M838	I777-L834 HydrophobicContact CG2-CD1 4.3Å; Y781-L834 HydrophobicContact CD1-CB 4Å; Y781-L834 HydrophobicContact CD1-CD1 3.88Å; Y781-L834 HydrophobicContact CD1-CD2 3.88Å; Y781-L834 HydrophobicContact CD1-CG 4.12Å; Y781-L834 HydrophobicContact CD2-CD1 4.27Å; Y781-L834 HydrophobicContact CE1-CB 4.15Å; Y781-L834 HydrophobicContact CG-CD1 3.71Å; Y781-L834 HydrophobicContact CG-CD2 4.28Å; Y781-L834 HydrophobicContact CG-CG 4.42Å; K784-L834 HydrophobicContact CB-CD2 3.8Å; V785-L834 HydrophobicContact CG2-CD1 4.18Å; V785-L834 HydrophobicContact CG2-CD2 3.74Å; V785-L834 HydrophobicContact CG2-CG 4.38Å; H790-L834 HydrophobicContact CB-CD2 3.72Å; H790-L834 HydrophobicContact CB-CG 3.61Å; D831-L834 HydrophobicContact CB-CB 3.89Å; D831-L834 HydrophobicContact CB-CD2 4.42Å; D831-L834 PolarHBondContact O-N 3.31Å; D831-L834 WeakPolarHBondContact OD1-CB 3.32Å; D831-L834 PolarHBondContact OD1-N 3.22Å; L834-R836 VanDerWaalsContact C-N 3.33Å; L834-R836 PolarHBondContact O-N 3.2Å; L834-M837 HydrophobicContact CB-CE 4.44Å; L834-M837 HydrophobicContact CD1-CE 4.17Å; L834-M837 PolarHBondContact O-N 3Å; L834-M838 HydrophobicContact CD1-CG 3.99Å; L834-M838 HydrophobicContact CG-CG 4.46Å; L834-M838 WeakPolarHBondContact O-CB 3.27Å; L834-M838 WeakPolarHBondContact O-CG 3.47Å; L834-M838 PolarHBondContact O-N 2.53Å
835	A	92.6	Very high	90.5	Very high	4 Å²	4	62.4 Å²	62.4	3%	0.033	29%	0.29	C	S	.	.	H	α-helix	trans	-59.7	-43.8	177.5	0	0	0	0	0	111.4	H790 T792 I830 D831 Y832 M837 M838 R839	H790-A835 VanDerWaalsContact O-CA 3.27Å; H790-A835 WeakPolarHBondContact O-CA 3.45Å; H790-A835 WeakPolarHBondContact O-CB 3.38Å; T792-A835 HydrophobicContact CG2-CB 4.03Å; I830-A835 HydrophobicContact CG2-CB 4.38Å; D831-A835 WeakPolarHBondContact O-CB 3.21Å; D831-A835 PolarHBondContact O-N 2.85Å; Y832-A835 PolarHBondContact O-N 3.07Å; A835-M837 PolarHBondContact O-N 3.18Å; A835-M838 PolarHBondContact O-N 2.86Å; A835-R839 WeakPolarHBondContact O-CB 3.37Å; A835-R839 PolarHBondContact O-N 2.92Å
836	R	90.4	Very high	91.2	Very high	137 Å²	137	63.4 Å²	63.4	52%	0.517	29%	0.293	S	S	.	.	H	α-helix	trans	-61.1	-44.2	174.6	-172	178.6	63.9	160.8	-13.8	112.1	E20 Y832 T833 L834 M838	E20-R836 IonicContact OE1-CZ 3.97Å; E20-R836 IonicContact OE1-NH1 3.73Å; E20-R836 PolarHBondContact OE1-NH1 3.17Å; E20-R836 IonicContact OE1-NH2 2.94Å; E20-R836 PolarHBondContact OE1-NH2 2.8Å; E20-R836 IonicContact OE2-CZ 3.78Å; E20-R836 IonicContact OE2-NE 3.8Å; E20-R836 PolarHBondContact OE2-NE 3.22Å; E20-R836 IonicContact OE2-NH1 3.46Å; E20-R836 PolarHBondContact OE2-NH1 2.89Å; E20-R836 IonicContact OE2-NH2 2.76Å; E20-R836 PolarHBondContact OE2-NH2 3.44Å; Y832-R836 WeakPolarHBondContact O-CB 3.43Å; Y832-R836 PolarHBondContact O-N 2.86Å; T833-R836 PolarHBondContact O-N 3.39Å; L834-R836 VanDerWaalsContact C-N 3.33Å; L834-R836 PolarHBondContact O-N 3.2Å; R836-M838 VanDerWaalsContact C-N 3.35Å; R836-M838 PolarHBondContact O-N 2.79Å
837	M	93.5	Very high	91.8	Very high	54 Å²	54	59.1 Å²	59.1	27%	0.266	27%	0.27	S	S	.	.	H	α-helix	trans	-63.2	-39.2	177.3	-71.8	-172	-66.7	0	0	112.8	I777 Y781 T833 L834 A835 F841	I777-M837 HydrophobicContact CD1-CB 4.03Å; I777-M837 HydrophobicContact CG1-CB 4.45Å; I777-M837 HydrophobicContact CG2-CE 4.17Å; I777-M837 HydrophobicContact CG2-SD 4.4Å; Y781-M837 HydrophobicContact CD2-CE 4.23Å; Y781-M837 HydrophobicContact CE1-CE 4.4Å; Y781-M837 HydrophobicContact CE2-CE 3.67Å; T833-M837 HydrophobicContact CG2-CE 4.2Å; T833-M837 WeakPolarHBondContact O-CG 3.5Å; T833-M837 PolarHBondContact O-N 3.35Å; T833-M837 VanDerWaalsContact O-N 3.12Å; L834-M837 HydrophobicContact CB-CE 4.44Å; L834-M837 HydrophobicContact CD1-CE 4.17Å; L834-M837 PolarHBondContact O-N 3Å; A835-M837 PolarHBondContact O-N 3.18Å; M837-F841 WeakPolarHBondContact O-CE2 3.27Å
838	M	94	Very high	92.4	Very high	3 Å²	3	55.3 Å²	55.3	2%	0.015	25%	0.246	C	C	.	.	H	α-helix	trans	-81.2	-31.1	-177.2	-74.7	-69.9	-70.4	0	0	113.4	F741 L772 F775 I777 H790 L834 A835 R836 R840 F841 L842	F741-M838 HydrophobicContact CB-CE 4.21Å; L772-M838 HydrophobicContact CD2-SD 4.17Å; F775-M838 HydrophobicContact CD2-CE 4.32Å; F775-M838 HydrophobicContact CD2-SD 4.08Å; F775-M838 HydrophobicContact CE2-CE 4.24Å; I777-M838 HydrophobicContact CD1-CG 3.98Å; I777-M838 HydrophobicContact CD1-SD 3.43Å; I777-M838 WeakPolarHBondContact CD1-SD 3.29Å; H790-M838 HydrophobicContact CB-CB 4.36Å; H790-M838 HydrophobicContact CB-CG 4.11Å; L834-M838 HydrophobicContact CD1-CG 3.99Å; L834-M838 HydrophobicContact CG-CG 4.46Å; L834-M838 WeakPolarHBondContact O-CB 3.27Å; L834-M838 WeakPolarHBondContact O-CG 3.47Å; L834-M838 PolarHBondContact O-N 2.53Å; A835-M838 PolarHBondContact O-N 2.86Å; R836-M838 VanDerWaalsContact C-N 3.35Å; R836-M838 PolarHBondContact O-N 2.79Å; M838-R840 VanDerWaalsContact C-N 3.26Å; M838-R840 PolarHBondContact O-N 2.82Å; M838-F841 PolarHBondContact O-N 3.01Å; M838-L842 HydrophobicContact CB-CD1 4.15Å; M838-L842 HydrophobicContact CB-CG 4.18Å; M838-L842 HydrophobicContact CE-CD2 3.89Å; M838-L842 WeakPolarHBondContact O-CG 3.42Å; M838-L842 PolarHBondContact O-N 2.89Å; M838-L842 VanDerWaalsContact O-N 3.1Å
839	R	92.4	Very high	92.9	Very high	119 Å²	119	48.7 Å²	48.7	45%	0.449	22%	0.215	S	C	.	.	H	α-helix	trans	-44	-46	-171.5	-179	172.9	179.9	-174.8	-1.6	113.8	E21 L795 A835 F841 L842 L843	E21-R839 IonicContact OE1-CZ 3.77Å; E21-R839 IonicContact OE1-NH1 3.36Å; E21-R839 PolarHBondContact OE1-NH1 2.79Å; E21-R839 IonicContact OE1-NH2 2.99Å; E21-R839 IonicContact OE2-NH1 2.85Å; L795-R839 HydrophobicContact CD1-CG 4.16Å; A835-R839 WeakPolarHBondContact O-CB 3.37Å; A835-R839 PolarHBondContact O-N 2.92Å; R839-F841 VanDerWaalsContact C-N 3.35Å; R839-F841 PolarHBondContact O-N 3.2Å; R839-L842 PolarHBondContact O-N 3Å; R839-L843 HydrophobicContact CG-CD1 4.46Å; R839-L843 PolarHBondContact O-N 3.29Å
840	R	88.8	Confident	93.2	Very high	173 Å²	173	45.2 Å²	45.2	65%	0.653	20%	0.196	S	C	*	.	H	α-helix	trans	-64.9	-32.5	-179.8	62.8	178.8	161.5	-169.9	-6	114.2	M838 D844	M838-R840 VanDerWaalsContact C-N 3.26Å; M838-R840 PolarHBondContact O-N 2.82Å; R840-D844 VanDerWaalsContact O-CB 3.29Å; R840-D844 WeakPolarHBondContact O-CB 3.41Å; R840-D844 PolarHBondContact O-N 3.39Å
841	F	94	Very high	93.3	Very high	17 Å²	17	45 Å²	45	8%	0.075	20%	0.195	C	C	.	.	H	α-helix	trans	-86.6	-28.8	-178.9	-52.7	-62.7	0	0	0	112.2	F672 F775 I777 M837 M838 R839 L843 S848	F672-F841 AromaticContact CD1-CD1 3.91Å; F672-F841 HydrophobicContact CD1-CD1 3.91Å; F672-F841 AromaticContact CD1-CE1 3.92Å; F672-F841 HydrophobicContact CD1-CE1 3.92Å; F672-F841 HydrophobicContact CE1-CD1 4.27Å; F775-F841 HydrophobicContact CB-CD2 3.82Å; F775-F841 HydrophobicContact CB-CE1 4.46Å; F775-F841 HydrophobicContact CB-CE2 3.67Å; F775-F841 HydrophobicContact CB-CG 4.28Å; F775-F841 HydrophobicContact CB-CZ 4Å; F775-F841 HydrophobicContact CD1-CB 3.81Å; F775-F841 AromaticContact CD1-CD1 3.43Å; F775-F841 HydrophobicContact CD1-CD1 3.43Å; F775-F841 VanDerWaalsContact CD1-CD1 3.43Å; F775-F841 AromaticContact CD1-CD2 3.85Å; F775-F841 HydrophobicContact CD1-CD2 3.85Å; F775-F841 AromaticContact CD1-CE1 3.88Å; F775-F841 HydrophobicContact CD1-CE1 3.88Å; F775-F841 HydrophobicContact CD1-CE2 4.27Å; F775-F841 AromaticContact CD1-CG 3.41Å; F775-F841 HydrophobicContact CD1-CG 3.41Å; F775-F841 VanDerWaalsContact CD1-CG 3.41Å; F775-F841 HydrophobicContact CD1-CZ 4.26Å; F775-F841 HydrophobicContact CD2-CB 4.3Å; F775-F841 HydrophobicContact CD2-CD2 4.21Å; F775-F841 HydrophobicContact CD2-CG 4.29Å; F775-F841 HydrophobicContact CE1-CB 3.6Å; F775-F841 AromaticContact CE1-CD1 3.82Å; F775-F841 HydrophobicContact CE1-CD1 3.82Å; F775-F841 AromaticContact CE1-CG 3.74Å; F775-F841 HydrophobicContact CE1-CG 3.74Å; F775-F841 HydrophobicContact CE2-CB 4.1Å; F775-F841 HydrophobicContact CG-CB 4.17Å; F775-F841 HydrophobicContact CG-CD1 4.14Å; F775-F841 AromaticContact CG-CD2 3.69Å; F775-F841 HydrophobicContact CG-CD2 3.69Å; F775-F841 HydrophobicContact CG-CE1 4.46Å; F775-F841 HydrophobicContact CG-CE2 4.05Å; F775-F841 AromaticContact CG-CG 3.73Å; F775-F841 HydrophobicContact CG-CG 3.73Å; F775-F841 HydrophobicContact CG-CZ 4.41Å; F775-F841 HydrophobicContact CZ-CB 3.75Å; F775-F841 HydrophobicContact CZ-CG 4.28Å; I777-F841 HydrophobicContact CD1-CD2 4.23Å; I777-F841 HydrophobicContact CD1-CE2 4.02Å; M837-F841 WeakPolarHBondContact O-CE2 3.27Å; M838-F841 PolarHBondContact O-N 3.01Å; R839-F841 VanDerWaalsContact C-N 3.35Å; R839-F841 PolarHBondContact O-N 3.2Å; F841-L843 VanDerWaalsContact C-N 3.33Å; F841-S848 PolarHBondContact O-OG 3.23Å
842	L	93.7	Very high	93.3	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-67.1	-35.5	176.2	-60.6	179.2	0	0	0	111.9	F741 V791 L795 F799 M838 R839 M851	F741-L842 VanDerWaalsContact C-CD2 3.45Å; F741-L842 HydrophobicContact CB-CD2 3.93Å; F741-L842 WeakPolarHBondContact O-CD2 3.25Å; V791-L842 HydrophobicContact CG2-CD1 3.93Å; L795-L842 HydrophobicContact CD1-CD1 4.49Å; F799-L842 HydrophobicContact CE1-CB 4.47Å; F799-L842 HydrophobicContact CE2-CB 4.39Å; F799-L842 HydrophobicContact CE2-CD1 4.31Å; F799-L842 HydrophobicContact CZ-CB 3.67Å; F799-L842 HydrophobicContact CZ-CD1 4.34Å; M838-L842 HydrophobicContact CB-CD1 4.15Å; M838-L842 HydrophobicContact CB-CG 4.18Å; M838-L842 HydrophobicContact CE-CD2 3.89Å; M838-L842 WeakPolarHBondContact O-CG 3.42Å; M838-L842 PolarHBondContact O-N 2.89Å; M838-L842 VanDerWaalsContact O-N 3.1Å; R839-L842 PolarHBondContact O-N 3Å; L842-M851 WeakPolarHBondContact O-CG 3.2Å
843	L	90	Very high	93.2	Very high	72 Å²	72	43.1 Å²	43.1	38%	0.377	20%	0.199	S	C	.	.	H	α-helix	trans	-93	-17.9	-179.1	-63.3	176.6	0	0	0	113.8	L795 L798 F799 R839 F841 W845	L795-L843 HydrophobicContact CD2-CD1 3.91Å; L795-L843 HydrophobicContact CD2-CD2 3.96Å; L795-L843 HydrophobicContact CD2-CG 4.15Å; L798-L843 HydrophobicContact CD2-CD2 3.47Å; L798-L843 VanDerWaalsContact CD2-CD2 3.47Å; F799-L843 HydrophobicContact CE1-CD2 3.79Å; F799-L843 HydrophobicContact CZ-CD2 4.08Å; R839-L843 HydrophobicContact CG-CD1 4.46Å; R839-L843 PolarHBondContact O-N 3.29Å; F841-L843 VanDerWaalsContact C-N 3.33Å; L843-W845 PolarHBondContact O-N 3.19Å
844	D	94.5	Very high	93.3	Very high	42 Å²	42	43.6 Å²	43.6	23%	0.225	20%	0.199	C	C	.	.			trans	-76.2	110.2	177.1	-169.3	-21.2	0	0	0	109.9	F672 R840 Q846 A847 S848	F672-D844 WeakPolarHBondContact CZ-OD2 3.26Å; R840-D844 VanDerWaalsContact O-CB 3.29Å; R840-D844 WeakPolarHBondContact O-CB 3.41Å; R840-D844 PolarHBondContact O-N 3.39Å; D844-Q846 PolarHBondContact O-N 3.22Å; D844-Q846 VanDerWaalsContact O-N 3.12Å; D844-Q846 VanDerWaalsContact OD1-CB 3.26Å; D844-Q846 WeakPolarHBondContact OD1-CB 3.02Å; D844-Q846 WeakPolarHBondContact OD1-CG 3.4Å; D844-Q846 PolarHBondContact OD1-N 3.05Å; D844-Q846 PolarHBondContact OD1-NE2 2.8Å; D844-Q846 VanDerWaalsContact OD1-NE2 3.11Å; D844-Q846 PolarHBondContact OD2-NE2 3.05Å; D844-A847 PolarHBondContact O-N 2.76Å; D844-S848 PolarHBondContact O-N 3.13Å
845	W	94.5	Very high	93.5	Very high	50 Å²	50	43.8 Å²	43.8	19%	0.189	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-18.6	179.2	61.5	-95.8	0	0	0	113.3	Q718 R719 N722 L843 A847 S848 P849 Q852	Q718-W845 HydrophobicContact CB-CE3 3.86Å; Q718-W845 HydrophobicContact CB-CH2 4.43Å; Q718-W845 HydrophobicContact CB-CZ3 3.53Å; R719-W845 HydrophobicContact CB-CH2 3.88Å; R719-W845 HydrophobicContact CB-CZ3 4.25Å; R719-W845 HydrophobicContact CG-CH2 4.23Å; N722-W845 WeakPolarHBondContact ND2-CH2 3.29Å; N722-W845 WeakPolarHBondContact ND2-CZ2 3.4Å; L843-W845 PolarHBondContact O-N 3.19Å; W845-A847 VanDerWaalsContact C-N 3.31Å; W845-S848 WeakPolarHBondContact CA-O 3.28Å; W845-S848 CarbonylContact O-C 3.6Å; W845-S848 VanDerWaalsContact O-C 3.32Å; W845-P849 WeakPolarHBondContact O-CA 3.42Å; W845-P849 VanDerWaalsContact O-N 3.09Å; W845-Q852 HydrophobicContact CB-CB 3.9Å; W845-Q852 HydrophobicContact CG-CB 4.46Å
846	Q	95.8	Very high	93.6	Very high	40 Å²	40	46 Å²	46	19%	0.187	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-26.1	175	-60.3	168.5	103	0	0	111.8	F672 A715 D844	F672-Q846 HydrophobicContact CE2-CB 4.03Å; F672-Q846 HydrophobicContact CZ-CB 3.93Å; A715-Q846 WeakPolarHBondContact CB-O 3.41Å; D844-Q846 PolarHBondContact O-N 3.22Å; D844-Q846 VanDerWaalsContact O-N 3.12Å; D844-Q846 VanDerWaalsContact OD1-CB 3.26Å; D844-Q846 WeakPolarHBondContact OD1-CB 3.02Å; D844-Q846 WeakPolarHBondContact OD1-CG 3.4Å; D844-Q846 PolarHBondContact OD1-N 3.05Å; D844-Q846 PolarHBondContact OD1-NE2 2.8Å; D844-Q846 VanDerWaalsContact OD1-NE2 3.11Å; D844-Q846 PolarHBondContact OD2-NE2 3.05Å
847	A	95.7	Very high	93.7	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-50.7	169.7	0	0	0	0	0	110	F672 N711 F741 F775 D844 W845 P849	F672-A847 HydrophobicContact CD2-CB 4.13Å; F672-A847 HydrophobicContact CE1-CB 4.48Å; F672-A847 HydrophobicContact CE2-CB 3.72Å; F672-A847 HydrophobicContact CZ-CB 3.9Å; N711-A847 PolarHBondContact ND2-O 3.43Å; F741-A847 HydrophobicContact CE2-CB 4.36Å; F741-A847 WeakPolarHBondContact CE2-O 3.38Å; F775-A847 HydrophobicContact CE1-CB 3.87Å; F775-A847 HydrophobicContact CZ-CB 4.14Å; D844-A847 PolarHBondContact O-N 2.76Å; W845-A847 VanDerWaalsContact C-N 3.31Å; A847-P849 VanDerWaalsContact C-CD 3.47Å; A847-P849 WeakPolarHBondContact O-CD 3.49Å
848	S	95.5	Very high	93.9	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.007	21%	0.212	C	C	.	.			trans	-110.3	80	-179.3	-55	0	0	0	0	110.8	L739 F741 F841 D844 W845 L850 M851	L739-S848 CarbonylContact O-C 3.39Å; L739-S848 VanDerWaalsContact O-C 3.23Å; L739-S848 VanDerWaalsContact O-CA 3.29Å; L739-S848 WeakPolarHBondContact O-CA 3.29Å; F741-S848 WeakPolarHBondContact CD2-OG 3.35Å; F841-S848 PolarHBondContact O-OG 3.23Å; D844-S848 PolarHBondContact O-N 3.13Å; W845-S848 WeakPolarHBondContact CA-O 3.28Å; W845-S848 CarbonylContact O-C 3.6Å; W845-S848 VanDerWaalsContact O-C 3.32Å; S848-L850 PolarHBondContact O-N 3Å; S848-M851 WeakPolarHBondContact O-CB 3.42Å; S848-M851 PolarHBondContact O-N 3.35Å
849	P	96.9	Very high	94	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-51.6	-26.5	-177.2	-28.7	32.4	0	0	0	115	N711 A714 A715 Q718 L739 W845 A847 M851 Q852 Y878	N711-P849 VanDerWaalsContact ND2-CD 3.29Å; N711-P849 WeakPolarHBondContact ND2-CD 3.42Å; A714-P849 HydrophobicContact CB-CB 3.81Å; A714-P849 HydrophobicContact CB-CG 3.9Å; A715-P849 HydrophobicContact CB-CG 4.28Å; Q718-P849 PolarHBondContact NE2-O 2.67Å; Q718-P849 VanDerWaalsContact NE2-O 3.07Å; L739-P849 HydrophobicContact CD2-CB 3.91Å; L739-P849 HydrophobicContact CD2-CG 3.9Å; W845-P849 WeakPolarHBondContact O-CA 3.42Å; W845-P849 VanDerWaalsContact O-N 3.09Å; A847-P849 VanDerWaalsContact C-CD 3.47Å; A847-P849 WeakPolarHBondContact O-CD 3.49Å; P849-M851 PolarHBondContact O-N 3.42Å; P849-Q852 PolarHBondContact O-N 3.29Å; P849-Y878 HydrophobicContact CB-CE2 3.99Å
850	L	95.2	Very high	94.3	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-64.3	-16.7	174.7	-168.6	61.9	0	0	0	113.4	L739 Q740 Q803 S848 W877 Y878 K881	L739-L850 HydrophobicContact CB-CB 4.15Å; L739-L850 VanDerWaalsContact O-CB 3.3Å; L739-L850 WeakPolarHBondContact O-CB 3.42Å; L739-L850 PolarHBondContact O-N 2.94Å; L739-L850 VanDerWaalsContact O-N 3.14Å; Q740-L850 HydrophobicContact CB-CB 4.35Å; Q740-L850 HydrophobicContact CB-CD2 4.14Å; Q740-L850 HydrophobicContact CG-CD2 4.02Å; Q803-L850 HydrophobicContact CB-CD2 4.04Å; S848-L850 PolarHBondContact O-N 3Å; L850-W877 HydrophobicContact CD1-CB 3.94Å; L850-W877 HydrophobicContact CD2-CB 3.95Å; L850-W877 HydrophobicContact CD2-CD2 4.46Å; L850-W877 HydrophobicContact CD2-CE3 3.86Å; L850-Y878 HydrophobicContact CD1-CD2 3.97Å; L850-K881 HydrophobicContact CD1-CD 4.17Å; L850-K881 PolarHBondContact O-NZ 3.29Å
851	M	93.8	Very high	94.7	Very high	11 Å²	11	29.8 Å²	29.8	5%	0.054	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-91.1	-1.9	-178.8	-60.8	-57.1	134.2	0	0	114.6	Q740 F799 H802 Q803 L842 S848 P849 P853	Q740-M851 HydrophobicContact CB-CE 4.13Å; F799-M851 HydrophobicContact CD1-CE 4.1Å; F799-M851 HydrophobicContact CD1-SD 3.35Å; F799-M851 WeakPolarHBondContact CD1-SD 3.35Å; F799-M851 HydrophobicContact CE1-CG 4.35Å; F799-M851 HydrophobicContact CE1-SD 3.73Å; F799-M851 HydrophobicContact CG-SD 4.4Å; H802-M851 HydrophobicContact CB-CE 4.14Å; H802-M851 HydrophobicContact CB-SD 4.14Å; Q803-M851 HydrophobicContact CG-CE 4.14Å; L842-M851 WeakPolarHBondContact O-CG 3.2Å; S848-M851 WeakPolarHBondContact O-CB 3.42Å; S848-M851 PolarHBondContact O-N 3.35Å; P849-M851 PolarHBondContact O-N 3.42Å; M851-P853 VanDerWaalsContact O-CD 3.23Å; M851-P853 WeakPolarHBondContact O-CD 3.37Å
852	Q	93.4	Very high	94.9	Very high	14 Å²	14	29 Å²	29	7%	0.065	18%	0.177	C	C	.	.			trans	-60.6	118.8	174.8	177.3	61.3	-94.9	0	0	111.6	Q718 N722 W845 P849 D854 M855 K881	Q718-Q852 VanDerWaalsContact OE1-CG 3.23Å; N722-Q852 PolarHBondContact ND2-NE2 3.4Å; W845-Q852 HydrophobicContact CB-CB 3.9Å; W845-Q852 HydrophobicContact CG-CB 4.46Å; P849-Q852 PolarHBondContact O-N 3.29Å; Q852-D854 VanDerWaalsContact C-N 3.35Å; Q852-D854 WeakPolarHBondContact CG-O 3.29Å; Q852-D854 PolarHBondContact O-N 2.98Å; Q852-M855 HydrophobicContact CB-SD 3.65Å; Q852-M855 HydrophobicContact CG-SD 3.73Å; Q852-K881 WeakPolarHBondContact O-CE 2.99Å; Q852-K881 PolarHBondContact O-NZ 2.89Å
853	P	90	Very high	95.2	Very high	102 Å²	102	28.9 Å²	28.9	66%	0.662	18%	0.177	S	C	*	.	S	Bend	trans	-61.1	-40.5	-177.5	-29	38.2	0	0	0	113.9	M851	M851-P853 VanDerWaalsContact O-CD 3.23Å; M851-P853 WeakPolarHBondContact O-CD 3.37Å
854	D	92.8	Very high	95.6	Very high	76 Å²	76	25.5 Å²	25.5	41%	0.406	16%	0.159	S	C	.	.			trans	-115.9	119.5	-177.9	171.4	31.8	0	0	0	111.9	R721 Q852 S856	R721-D854 IonicContact CZ-OD2 3.52Å; R721-D854 PolarHBondContact NH1-O 3Å; R721-D854 IonicContact NH1-OD1 3.89Å; R721-D854 IonicContact NH1-OD2 3.94Å; R721-D854 PolarHBondContact NH1-OD2 3.29Å; R721-D854 PolarHBondContact NH2-O 3.4Å; R721-D854 IonicContact NH2-OD2 3.55Å; Q852-D854 VanDerWaalsContact C-N 3.35Å; Q852-D854 WeakPolarHBondContact CG-O 3.29Å; Q852-D854 PolarHBondContact O-N 2.98Å; D854-S856 VanDerWaalsContact CG-OG 3.31Å; D854-S856 VanDerWaalsContact OD1-CB 3.25Å; D854-S856 WeakPolarHBondContact OD1-CB 3.47Å; D854-S856 PolarHBondContact OD1-N 2.9Å; D854-S856 PolarHBondContact OD1-OG 3.12Å; D854-S856 PolarHBondContact OD2-OG 3.04Å
855	M	95.3	Very high	95.7	Very high	4 Å²	4	23.5 Å²	23.5	2%	0.02	15%	0.148	C	C	.	.			trans	-104.2	3.8	-178	-60.7	-63.4	-74.2	0	0	113.2	Q852 L858 Y878 K881 L882 A885	Q852-M855 HydrophobicContact CB-SD 3.65Å; Q852-M855 HydrophobicContact CG-SD 3.73Å; M855-L858 HydrophobicContact CB-CD1 4.29Å; M855-L858 HydrophobicContact CE-CD1 3.7Å; M855-L858 WeakPolarHBondContact O-CD1 3.44Å; M855-L858 WeakPolarHBondContact O-CG 3.47Å; M855-L858 HydrophobicContact SD-CD1 4.13Å; M855-Y878 HydrophobicContact CE-CD2 3.97Å; M855-Y878 HydrophobicContact CE-CE1 4.22Å; M855-Y878 HydrophobicContact CE-CE2 3.24Å; M855-Y878 WeakPolarHBondContact CE-OH 3.48Å; M855-Y878 HydrophobicContact SD-CE2 4.47Å; M855-K881 HydrophobicContact CG-CD 3.84Å; M855-K881 HydrophobicContact CG-CG 3.89Å; M855-K881 HydrophobicContact SD-CD 4.33Å; M855-L882 HydrophobicContact CB-CD2 4.47Å; M855-L882 HydrophobicContact CE-CD2 3.64Å; M855-L882 HydrophobicContact CE-CG 4Å; M855-A885 HydrophobicContact CB-CB 3.57Å
856	S	94.4	Very high	95.8	Very high	50 Å²	50	21.1 Å²	21.1	35%	0.35	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	149.8	-177.5	68.2	0	0	0	0	112.6	R721 D854 L858	R721-S856 PolarHBondContact NH1-O 3.35Å; D854-S856 VanDerWaalsContact CG-OG 3.31Å; D854-S856 VanDerWaalsContact OD1-CB 3.25Å; D854-S856 WeakPolarHBondContact OD1-CB 3.47Å; D854-S856 PolarHBondContact OD1-N 2.9Å; D854-S856 PolarHBondContact OD1-OG 3.12Å; D854-S856 PolarHBondContact OD2-OG 3.04Å; S856-L858 PolarHBondContact O-N 3.43Å
857	G	93.5	Very high	95.6	Very high	63 Å²	63	20.5 Å²	20.5	65%	0.649	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.9	6.5	177.6	0	0	0	0	0	115.5
858	L	96.9	Very high	95.4	Very high	13 Å²	13	21.2 Å²	21.2	7%	0.068	14%	0.139	C	C	.	.			trans	-71.1	152.4	169.2	-65.9	175.8	0	0	0	110.8	T717 Q718 R721 M855 S856 L882 V887	T717-L858 HydrophobicContact CG2-CD2 4.06Å; Q718-L858 HydrophobicContact CB-CD2 4.4Å; Q718-L858 HydrophobicContact CG-CD1 4.08Å; Q718-L858 HydrophobicContact CG-CD2 3.87Å; R721-L858 HydrophobicContact CB-CD2 3.97Å; R721-L858 HydrophobicContact CG-CD2 4.2Å; M855-L858 HydrophobicContact CB-CD1 4.29Å; M855-L858 HydrophobicContact CE-CD1 3.7Å; M855-L858 WeakPolarHBondContact O-CD1 3.44Å; M855-L858 WeakPolarHBondContact O-CG 3.47Å; M855-L858 HydrophobicContact SD-CD1 4.13Å; S856-L858 PolarHBondContact O-N 3.43Å; L858-L882 HydrophobicContact CB-CD2 4.2Å; L858-L882 HydrophobicContact CD1-CD2 3.62Å; L858-V887 HydrophobicContact CB-CG2 4.15Å
859	P	96.6	Very high	95.3	Very high	12 Å²	12	21.2 Å²	21.2	8%	0.078	14%	0.139	C	C	.	.			trans	-66.1	158.8	179	33.5	-41.8	0	0	0	111.4	T717 V729 Q732 V887	T717-P859 HydrophobicContact CG2-CG 3.38Å; V729-P859 HydrophobicContact CG2-CB 4.2Å; V729-P859 HydrophobicContact CG2-CG 3.72Å; V729-P859 WeakPolarHBondContact O-CB 3.39Å; Q732-P859 HydrophobicContact CB-CG 4.12Å; Q732-P859 HydrophobicContact CG-CG 4.1Å; Q732-P859 PolarHBondContact NE2-O 3.3Å; Q732-P859 VanDerWaalsContact NE2-O 3.09Å; P859-V887 VanDerWaalsContact O-CG1 3.24Å; P859-V887 WeakPolarHBondContact O-CG1 3.48Å
860	P	98	Very high	95.2	Very high	56 Å²	56	21.2 Å²	21.2	36%	0.364	14%	0.139	S	C	.	.			trans	-45.4	144.4	166.7	-27.3	34.6	0	0	0	111.8	L731 Q732 N888	L731-P860 HydrophobicContact CD1-CB 4.26Å; L731-P860 WeakPolarHBondContact CD1-O 3.46Å; Q732-P860 PolarHBondContact N-O 3.04Å; P860-N888 CarbonylContact C-O 3.53Å; P860-N888 VanDerWaalsContact CA-O 3.29Å; P860-N888 WeakPolarHBondContact CA-O 3.3Å; P860-N888 HydrophobicContact CB-CB 4.31Å
861	A	98.4	Very high	95.2	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.008	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	135	-174.1	0	0	0	0	0	112.4	Q732 I863 L882 N888 V889 T890	Q732-A861 HydrophobicContact CG-CB 3.56Å; Q732-A861 CarbonylContact O-C 3.55Å; Q732-A861 VanDerWaalsContact O-CA 3.28Å; Q732-A861 WeakPolarHBondContact O-CA 3.12Å; A861-I863 HydrophobicContact CB-CG1 4.47Å; A861-L882 HydrophobicContact CB-CD1 3.74Å; A861-N888 PolarHBondContact N-O 3.34Å; A861-V889 HydrophobicContact CB-CG2 4.39Å; A861-V889 WeakPolarHBondContact O-CA 3.24Å; A861-T890 PolarHBondContact O-N 2.86Å
862	L	98.7	Very high	95.3	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	120.7	158	175.4	61.4	0	0	0	108.3	Q732 V733 L734 V864 T890 M892 I918 F921	Q732-L862 PolarHBondContact O-N 3.39Å; V733-L862 CarbonylContact C-O 3.59Å; V733-L862 WeakPolarHBondContact CA-O 3.35Å; V733-L862 HydrophobicContact CB-CB 4.49Å; V733-L862 HydrophobicContact CG1-CB 4.2Å; V733-L862 HydrophobicContact CG1-CD2 3.96Å; V733-L862 HydrophobicContact CG1-CG 4.23Å; V733-L862 HydrophobicContact CG2-CB 4.15Å; L734-L862 PolarHBondContact N-O 2.86Å; L862-V864 HydrophobicContact CD2-CG2 4.37Å; L862-V864 HydrophobicContact CG-CG2 4.17Å; L862-T890 CarbonylContact C-O 3.48Å; L862-T890 WeakPolarHBondContact CA-O 3.42Å; L862-T890 HydrophobicContact CD1-CG2 3.86Å; L862-M892 HydrophobicContact CD1-CB 4.45Å; L862-M892 HydrophobicContact CD1-CE 3.9Å; L862-M892 HydrophobicContact CD1-CG 3.79Å; L862-M892 HydrophobicContact CD1-SD 3.82Å; L862-M892 HydrophobicContact CD2-SD 4.39Å; L862-I918 HydrophobicContact CD2-CB 4.5Å; L862-I918 HydrophobicContact CD2-CG1 4.22Å; L862-I918 HydrophobicContact CD2-CG2 4.3Å; L862-F921 HydrophobicContact CB-CD1 3.98Å; L862-F921 HydrophobicContact CB-CE1 3.7Å; L862-F921 HydrophobicContact CB-CZ 4.35Å; L862-F921 HydrophobicContact CD1-CD1 4.45Å; L862-F921 HydrophobicContact CD1-CE1 4.47Å; L862-F921 HydrophobicContact CD2-CB 4.21Å; L862-F921 HydrophobicContact CD2-CD1 3.65Å; L862-F921 HydrophobicContact CD2-CE1 4.25Å; L862-F921 HydrophobicContact CD2-CG 3.99Å; L862-F921 HydrophobicContact CG-CD1 4.23Å; L862-F921 HydrophobicContact CG-CE1 4.35Å
863	I	98.6	Very high	95.5	Very high	0 Å²	0	20 Å²	20	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	121.6	175	-62.6	169.9	0	0	0	108.5	L734 A861 T865 Y878 A879 L882 V889 T890 H891 M892	L734-I863 HydrophobicContact CB-CG1 4.41Å; L734-I863 HydrophobicContact CD1-CG1 4.47Å; L734-I863 WeakPolarHBondContact O-CA 3.49Å; A861-I863 HydrophobicContact CB-CG1 4.47Å; I863-T865 HydrophobicContact CG2-CG2 4.23Å; I863-Y878 HydrophobicContact CD1-CD1 3.96Å; I863-A879 VanDerWaalsContact CD1-CA 3.42Å; I863-A879 HydrophobicContact CD1-CB 3.55Å; I863-L882 HydrophobicContact CD1-CD1 4.05Å; I863-V889 HydrophobicContact CD1-CG1 4.07Å; I863-T890 PolarHBondContact N-O 3.03Å; I863-H891 CarbonylContact O-C 3.51Å; I863-H891 VanDerWaalsContact O-CA 3.3Å; I863-H891 WeakPolarHBondContact O-CA 3.31Å; I863-H891 PolarHBondContact O-CD2 3.38Å; I863-M892 PolarHBondContact O-N 3.41Å
864	V	98.4	Very high	95.8	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	134.1	176.9	-176.5	0	0	0	0	108.9	L734 I735 Y736 L862 M892 Y894 I918	L734-V864 PolarHBondContact O-N 3.42Å; I735-V864 HydrophobicContact CB-CB 4.38Å; I735-V864 HydrophobicContact CG2-CB 3.9Å; I735-V864 HydrophobicContact CG2-CG1 4.09Å; Y736-V864 WeakPolarHBondContact CA-O 2.84Å; Y736-V864 PolarHBondContact N-O 2.83Å; L862-V864 HydrophobicContact CD2-CG2 4.37Å; L862-V864 HydrophobicContact CG-CG2 4.17Å; V864-M892 CarbonylContact C-O 3.59Å; V864-M892 VanDerWaalsContact CA-O 3.3Å; V864-M892 WeakPolarHBondContact CA-O 3.48Å; V864-M892 HydrophobicContact CG2-CB 4.39Å; V864-Y894 HydrophobicContact CG1-CD2 3.77Å; V864-Y894 HydrophobicContact CG1-CE2 3.62Å; V864-I918 HydrophobicContact CG2-CD1 3.97Å; V864-I918 HydrophobicContact CG2-CG1 4.01Å
865	T	97.7	Very high	96	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	161.5	175.1	56.5	0	0	0	0	110	I863 H891 M892 H893 Y894	I863-T865 HydrophobicContact CG2-CG2 4.23Å; T865-H891 WeakPolarHBondContact CG2-NE2 3.38Å; T865-H891 PolarHBondContact OG1-NE2 2.81Å; T865-M892 PolarHBondContact N-O 3.14Å; T865-H893 WeakPolarHBondContact O-CA 3.48Å; T865-H893 PolarHBondContact OG1-ND1 2.89Å; T865-Y894 PolarHBondContact O-N 3.04Å
866	T	95.3	Very high	96.1	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	145.9	-174.3	38.1	0	0	0	0	108.6	Y736 D869 R872 M901	Y736-T866 HydrophobicContact CD1-CG2 4.16Å; T866-D869 WeakPolarHBondContact OG1-CB 3.43Å; T866-D869 PolarHBondContact OG1-OD2 3.09Å; T866-R872 WeakPolarHBondContact O-CB 3.44Å; T866-R872 WeakPolarHBondContact O-CG 3.35Å; T866-M901 HydrophobicContact CG2-CE 3.45Å; T866-M901 VanDerWaalsContact CG2-CE 3.45Å; T866-M901 HydrophobicContact CG2-CG 4.41Å; T866-M901 HydrophobicContact CG2-SD 3.61Å
867	Q	93.2	Very high	96.2	Very high	27 Å²	27	11.4 Å²	11.4	13%	0.126	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	-42.3	-175.2	178.8	60.3	-0.1	0	0	112.7	D869 H893 Y894 E895 G897	Q867-D869 VanDerWaalsContact C-N 3.32Å; Q867-D869 PolarHBondContact O-N 2.98Å; Q867-H893 PolarHBondContact OE1-NE2 3.01Å; Q867-Y894 PolarHBondContact N-O 3.31Å; Q867-E895 WeakPolarHBondContact CB-O 3.3Å; Q867-G897 PolarHBondContact N-O 3.08Å
868	F	91.3	Very high	96.3	Very high	15 Å²	15	8.4 Å²	8.4	7%	0.066	4%	0.044	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	60.9	-179.1	-58.2	-70.4	0	0	0	111.1	P538 E540 M541 L755 G897 F898 H899	P538-F868 HydrophobicContact CB-CD1 4.07Å; P538-F868 HydrophobicContact CB-CE1 3.5Å; P538-F868 HydrophobicContact CB-CE2 4.43Å; P538-F868 HydrophobicContact CB-CZ 3.71Å; P538-F868 HydrophobicContact CG-CD1 3.86Å; P538-F868 HydrophobicContact CG-CE1 3.77Å; P538-F868 HydrophobicContact CG-CZ 4.41Å; E540-F868 HydrophobicContact CB-CE2 4.26Å; E540-F868 HydrophobicContact CB-CZ 4.01Å; M541-F868 HydrophobicContact CB-CD2 4.23Å; M541-F868 HydrophobicContact CB-CE2 4.19Å; M541-F868 HydrophobicContact CE-CB 3.8Å; M541-F868 HydrophobicContact CE-CD2 4.17Å; M541-F868 HydrophobicContact CE-CG 3.94Å; M541-F868 HydrophobicContact CG-CD2 4.4Å; L755-F868 HydrophobicContact CD1-CD1 4.19Å; L755-F868 HydrophobicContact CD1-CE1 3.99Å; F868-G897 PolarHBondContact N-O 2.97Å; F868-F898 HydrophobicContact CB-CB 4.13Å; F868-F898 WeakPolarHBondContact O-CA 3.45Å; F868-H899 PolarHBondContact O-N 3.3Å
869	D	93.4	Very high	96.4	Very high	2 Å²	2	7.8 Å²	7.8	1%	0.011	4%	0.041	C	C	.	.			trans	-146.5	124.3	-176	-171.4	-24	0	0	0	111	Y736 S748 T866 Q867 L871 R872 H899	Y736-D869 WeakPolarHBondContact CB-OD2 3.44Å; S748-D869 WeakPolarHBondContact CB-O 3.38Å; T866-D869 WeakPolarHBondContact OG1-CB 3.43Å; T866-D869 PolarHBondContact OG1-OD2 3.09Å; Q867-D869 VanDerWaalsContact C-N 3.32Å; Q867-D869 PolarHBondContact O-N 2.98Å; D869-L871 PolarHBondContact O-N 3.46Å; D869-L871 VanDerWaalsContact O-N 3.11Å; D869-L871 WeakPolarHBondContact OD1-CB 3.2Å; D869-L871 PolarHBondContact OD1-N 3.01Å; D869-R872 WeakPolarHBondContact O-CB 3.47Å; D869-R872 PolarHBondContact O-N 3.07Å; D869-R872 VanDerWaalsContact O-N 3.17Å; D869-H899 HydrophobicContact CB-CB 4.35Å; D869-H899 IonicContact OD1-CE1 2.67Å; D869-H899 IonicContact OD1-CG 3.78Å; D869-H899 IonicContact OD1-ND1 2.74Å; D869-H899 PolarHBondContact OD1-ND1 2.77Å; D869-H899 IonicContact OD2-CE1 2.97Å; D869-H899 IonicContact OD2-CG 3.69Å; D869-H899 IonicContact OD2-ND1 2.85Å; D869-H899 PolarHBondContact OD2-ND1 3.39Å
870	P	93.3	Very high	96.3	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	4%	0.044	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-30.1	174.8	-22.4	30.2	0	0	0	113.7	S748 Y749 A752 P764 I767 R872	S748-P870 WeakPolarHBondContact CB-O 3.17Å; S748-P870 PolarHBondContact OG-O 2.96Å; Y749-P870 HydrophobicContact CD1-CB 3.89Å; Y749-P870 HydrophobicContact CD2-CB 4.16Å; Y749-P870 WeakPolarHBondContact CD2-O 3.35Å; Y749-P870 HydrophobicContact CE1-CB 3.66Å; Y749-P870 HydrophobicContact CE2-CB 3.98Å; Y749-P870 VanDerWaalsContact CE2-O 3.22Å; Y749-P870 WeakPolarHBondContact CE2-O 3.36Å; Y749-P870 HydrophobicContact CG-CB 4.12Å; A752-P870 HydrophobicContact CB-CB 4.23Å; A752-P870 HydrophobicContact CB-CG 3.61Å; P764-P870 HydrophobicContact CG-CG 4.26Å; I767-P870 HydrophobicContact CD1-CB 3.67Å; I767-P870 HydrophobicContact CD1-CG 3.64Å; P870-R872 PolarHBondContact O-N 3.2Å
871	L	95.7	Very high	96.2	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	3%	0.033	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	5.3	-175	-51.6	-173.7	0	0	0	114.4	L738 Y749 I767 D869 D873 D874 G875	L738-L871 HydrophobicContact CB-CD1 3.74Å; L738-L871 HydrophobicContact CB-CD2 4.46Å; L738-L871 HydrophobicContact CD1-CD1 4.42Å; L738-L871 HydrophobicContact CD1-CD2 3.62Å; Y749-L871 HydrophobicContact CE2-CD2 4.17Å; Y749-L871 VanDerWaalsContact OH-CD2 3.3Å; Y749-L871 WeakPolarHBondContact OH-CD2 3.04Å; I767-L871 HydrophobicContact CD1-CD2 3.99Å; I767-L871 HydrophobicContact CD1-CG 4.08Å; I767-L871 HydrophobicContact CG2-CD2 4.28Å; D869-L871 PolarHBondContact O-N 3.46Å; D869-L871 VanDerWaalsContact O-N 3.11Å; D869-L871 WeakPolarHBondContact OD1-CB 3.2Å; D869-L871 PolarHBondContact OD1-N 3.01Å; L871-D873 VanDerWaalsContact C-N 3.26Å; L871-D873 PolarHBondContact O-N 3.32Å; L871-D874 WeakPolarHBondContact O-CB 3.37Å; L871-D874 PolarHBondContact O-N 3.36Å; L871-G875 PolarHBondContact O-N 2.78Å
872	R	96.4	Very high	96.1	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-53.6	-46.1	179.4	-177.8	-163.8	68.3	-168.1	-6.9	111.8	Y812 T866 D869 P870 G875 Y876	Y812-R872 HydrophobicContact CE2-CG 4.08Å; Y812-R872 PolarHBondContact O-NH2 3.24Å; T866-R872 WeakPolarHBondContact O-CB 3.44Å; T866-R872 WeakPolarHBondContact O-CG 3.35Å; D869-R872 WeakPolarHBondContact O-CB 3.47Å; D869-R872 PolarHBondContact O-N 3.07Å; D869-R872 VanDerWaalsContact O-N 3.17Å; P870-R872 PolarHBondContact O-N 3.2Å; R872-G875 PolarHBondContact O-N 2.93Å; R872-Y876 PolarHBondContact O-N 2.86Å; R872-Y876 VanDerWaalsContact O-N 3.16Å
873	D	96.8	Very high	96.1	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-71	-35.2	-173.5	-64.3	-8.7	0	0	0	111.7	T746 P747 S748 L808 L871 G875 Y876 W877	T746-D873 WeakPolarHBondContact CB-OD2 3.33Å; T746-D873 PolarHBondContact OG1-OD2 3Å; P747-D873 WeakPolarHBondContact CD-OD2 3.29Å; S748-D873 PolarHBondContact N-OD2 3.3Å; S748-D873 WeakPolarHBondContact OG-CB 3.46Å; S748-D873 PolarHBondContact OG-N 3Å; S748-D873 PolarHBondContact OG-OD2 3.32Å; S748-D873 VanDerWaalsContact OG-OD2 3.1Å; L808-D873 HydrophobicContact CD1-CB 4.02Å; L808-D873 WeakPolarHBondContact CD1-OD2 3.1Å; L808-D873 HydrophobicContact CD2-CB 3.96Å; L871-D873 VanDerWaalsContact C-N 3.26Å; L871-D873 PolarHBondContact O-N 3.32Å; D873-G875 PolarHBondContact O-N 3.28Å; D873-Y876 PolarHBondContact O-N 2.91Å; D873-W877 PolarHBondContact O-N 2.97Å
874	D	96.7	Very high	95.9	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-54.3	-52	172.1	-77.9	31.4	0	0	0	111.6	L739 Q740 L871 Y876 W877 Y878	L739-D874 HydrophobicContact CB-CB 4.22Å; L739-D874 PolarHBondContact N-OD2 3.23Å; Q740-D874 WeakPolarHBondContact CG-OD1 3.28Å; Q740-D874 PolarHBondContact N-OD2 2.9Å; Q740-D874 VanDerWaalsContact N-OD2 3.15Å; Q740-D874 PolarHBondContact NE2-OD1 3.25Å; L871-D874 WeakPolarHBondContact O-CB 3.37Å; L871-D874 PolarHBondContact O-N 3.36Å; D874-Y876 VanDerWaalsContact C-N 3.34Å; D874-Y876 PolarHBondContact O-N 3.22Å; D874-W877 PolarHBondContact O-N 3.34Å; D874-Y878 WeakPolarHBondContact O-CB 3.26Å; D874-Y878 PolarHBondContact O-N 2.9Å
875	G	97.2	Very high	95.8	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-62.1	-41.1	178.8	0	0	0	0	0	112.3	L871 R872 D873 Y878 A879	L871-G875 PolarHBondContact O-N 2.78Å; R872-G875 PolarHBondContact O-N 2.93Å; D873-G875 PolarHBondContact O-N 3.28Å; G875-Y878 PolarHBondContact O-N 3.43Å; G875-A879 WeakPolarHBondContact O-CB 3.38Å; G875-A879 PolarHBondContact O-N 3.06Å
876	Y	97.1	Very high	95.8	Very high	46 Å²	46	23.3 Å²	23.3	18%	0.18	13%	0.133	C	C	.	.	H	α-helix	trans	-65.2	-46.3	177.7	-167.4	-84.1	0	0	0	112	L808 P809 Y812 R872 D873 D874 Y878 A879 V880 H891	L808-Y876 HydrophobicContact CD2-CD1 3.86Å; L808-Y876 HydrophobicContact CD2-CG 4.24Å; P809-Y876 HydrophobicContact CG-CD2 4.35Å; P809-Y876 HydrophobicContact CG-CE1 4.23Å; P809-Y876 HydrophobicContact CG-CE2 3.63Å; Y812-Y876 AromaticContact CE2-CD2 4Å; Y812-Y876 HydrophobicContact CE2-CD2 4Å; Y812-Y876 HydrophobicContact CE2-CG 4.39Å; R872-Y876 PolarHBondContact O-N 2.86Å; R872-Y876 VanDerWaalsContact O-N 3.16Å; D873-Y876 PolarHBondContact O-N 2.91Å; D874-Y876 VanDerWaalsContact C-N 3.34Å; D874-Y876 PolarHBondContact O-N 3.22Å; Y876-Y878 VanDerWaalsContact C-N 3.32Å; Y876-Y878 PolarHBondContact O-N 2.77Å; Y876-A879 WeakPolarHBondContact O-CB 3.45Å; Y876-A879 PolarHBondContact O-N 3Å; Y876-V880 HydrophobicContact CD1-CG2 3.92Å; Y876-V880 HydrophobicContact CE1-CG2 3.54Å; Y876-V880 WeakPolarHBondContact O-CG2 3.34Å; Y876-V880 PolarHBondContact O-N 3.41Å; Y876-H891 AromaticContact CD2-CE1 3.67Å
877	W	96.6	Very high	95.9	Very high	5 Å²	5	23.9 Å²	23.9	2%	0.019	14%	0.137	C	C	.	.	H	α-helix	trans	-59.7	-43.2	176.9	-74.2	-34.3	0	0	0	112.1	T746 Q803 S804 H805 L808 L850 D873 D874 A879 V880 K881	T746-W877 HydrophobicContact CG2-CH2 3.51Å; T746-W877 HydrophobicContact CG2-CZ3 3.84Å; Q803-W877 HydrophobicContact CB-CD2 3.75Å; Q803-W877 HydrophobicContact CB-CE3 3.59Å; Q803-W877 HydrophobicContact CB-CG 4.4Å; Q803-W877 HydrophobicContact CB-CH2 4.05Å; Q803-W877 HydrophobicContact CB-CZ2 4.22Å; Q803-W877 HydrophobicContact CB-CZ3 3.74Å; S804-W877 PolarHBondContact O-NE1 3.45Å; H805-W877 AromaticContact CD2-CH2 3.9Å; H805-W877 AromaticContact CD2-CZ2 3.69Å; L808-W877 HydrophobicContact CD1-CZ2 3.98Å; L808-W877 HydrophobicContact CG-CZ2 4.35Å; L850-W877 HydrophobicContact CD1-CB 3.94Å; L850-W877 HydrophobicContact CD2-CB 3.95Å; L850-W877 HydrophobicContact CD2-CD2 4.46Å; L850-W877 HydrophobicContact CD2-CE3 3.86Å; D873-W877 PolarHBondContact O-N 2.97Å; D874-W877 PolarHBondContact O-N 3.34Å; W877-A879 VanDerWaalsContact C-N 3.33Å; W877-A879 PolarHBondContact O-N 3.22Å; W877-V880 PolarHBondContact O-N 3.23Å; W877-K881 WeakPolarHBondContact O-CB 3.34Å; W877-K881 PolarHBondContact O-N 3.03Å
878	Y	97.3	Very high	96.1	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-64.9	-38	177.7	-160.8	-105.6	0	0	0	112.2	A714 Q718 L734 L739 P849 L850 M855 I863 D874 G875 Y876 K881 L882	A714-Y878 HydrophobicContact CB-CE1 4.4Å; Q718-Y878 PolarHBondContact NE2-OH 3.27Å; L734-Y878 HydrophobicContact CD1-CD1 3.75Å; L734-Y878 HydrophobicContact CD1-CE1 3.44Å; L734-Y878 VanDerWaalsContact CD1-CE1 3.44Å; L739-Y878 HydrophobicContact CD1-CD1 3.98Å; L739-Y878 HydrophobicContact CD1-CD2 3.84Å; L739-Y878 HydrophobicContact CD1-CG 3.48Å; L739-Y878 VanDerWaalsContact CD1-CG 3.48Å; P849-Y878 HydrophobicContact CB-CE2 3.99Å; L850-Y878 HydrophobicContact CD1-CD2 3.97Å; M855-Y878 HydrophobicContact CE-CD2 3.97Å; M855-Y878 HydrophobicContact CE-CE1 4.22Å; M855-Y878 HydrophobicContact CE-CE2 3.24Å; M855-Y878 WeakPolarHBondContact CE-OH 3.48Å; M855-Y878 HydrophobicContact SD-CE2 4.47Å; I863-Y878 HydrophobicContact CD1-CD1 3.96Å; D874-Y878 WeakPolarHBondContact O-CB 3.26Å; D874-Y878 PolarHBondContact O-N 2.9Å; G875-Y878 PolarHBondContact O-N 3.43Å; Y876-Y878 VanDerWaalsContact C-N 3.32Å; Y876-Y878 PolarHBondContact O-N 2.77Å; Y878-K881 PolarHBondContact O-N 2.78Å; Y878-L882 HydrophobicContact CD1-CD1 3.67Å; Y878-L882 HydrophobicContact CD1-CG 4.15Å; Y878-L882 HydrophobicContact CE1-CD1 3.56Å; Y878-L882 HydrophobicContact CE1-CD2 4.46Å; Y878-L882 HydrophobicContact CE1-CG 4.03Å; Y878-L882 WeakPolarHBondContact O-CB 3.45Å; Y878-L882 WeakPolarHBondContact O-CG 3.35Å; Y878-L882 PolarHBondContact O-N 2.95Å
879	A	97.2	Very high	96.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61	-46.6	174.4	0	0	0	0	0	112.1	I863 G875 Y876 W877 K881 R883 V889	I863-A879 VanDerWaalsContact CD1-CA 3.42Å; I863-A879 HydrophobicContact CD1-CB 3.55Å; G875-A879 WeakPolarHBondContact O-CB 3.38Å; G875-A879 PolarHBondContact O-N 3.06Å; Y876-A879 WeakPolarHBondContact O-CB 3.45Å; Y876-A879 PolarHBondContact O-N 3Å; W877-A879 VanDerWaalsContact C-N 3.33Å; W877-A879 PolarHBondContact O-N 3.22Å; A879-K881 VanDerWaalsContact C-N 3.35Å; A879-R883 WeakPolarHBondContact O-CG 3.31Å; A879-R883 PolarHBondContact O-N 3.31Å; A879-R883 VanDerWaalsContact O-N 3.07Å; A879-V889 HydrophobicContact CB-CG1 3.98Å
880	V	95.6	Very high	96.7	Very high	26 Å²	26	30.3 Å²	30.3	16%	0.158	18%	0.175	C	C	.	.	H	α-helix	trans	-61.7	-45.2	175.6	173.6	0	0	0	0	110.7	I807 Y876 W877 L882 R883 N884	I807-V880 HydrophobicContact CG2-CB 4.43Å; I807-V880 HydrophobicContact CG2-CG1 3.99Å; I807-V880 HydrophobicContact CG2-CG2 4.14Å; Y876-V880 HydrophobicContact CD1-CG2 3.92Å; Y876-V880 HydrophobicContact CE1-CG2 3.54Å; Y876-V880 WeakPolarHBondContact O-CG2 3.34Å; Y876-V880 PolarHBondContact O-N 3.41Å; W877-V880 PolarHBondContact O-N 3.23Å; V880-L882 PolarHBondContact O-N 2.94Å; V880-R883 PolarHBondContact O-N 3.25Å; V880-N884 WeakPolarHBondContact O-CB 3.41Å; V880-N884 VanDerWaalsContact O-CG 3.22Å; V880-N884 PolarHBondContact O-N 3.43Å; V880-N884 PolarHBondContact O-OD1 2.67Å
881	K	95.4	Very high	96.9	Very high	28 Å²	28	32.4 Å²	32.4	12%	0.122	19%	0.185	C	C	.	.	H	α-helix	trans	-63.3	-42.2	-178.1	-159.4	-176.3	-179.2	-179.4	0	112.6	H802 L850 Q852 M855 W877 Y878 A879 N884 A885	H802-K881 PolarHBondContact ND1-NZ 3.47Å; H802-K881 VanDerWaalsContact ND1-NZ 3.13Å; L850-K881 HydrophobicContact CD1-CD 4.17Å; L850-K881 PolarHBondContact O-NZ 3.29Å; Q852-K881 WeakPolarHBondContact O-CE 2.99Å; Q852-K881 PolarHBondContact O-NZ 2.89Å; M855-K881 HydrophobicContact CG-CD 3.84Å; M855-K881 HydrophobicContact CG-CG 3.89Å; M855-K881 HydrophobicContact SD-CD 4.33Å; W877-K881 WeakPolarHBondContact O-CB 3.34Å; W877-K881 PolarHBondContact O-N 3.03Å; Y878-K881 PolarHBondContact O-N 2.78Å; A879-K881 VanDerWaalsContact C-N 3.35Å; K881-N884 PolarHBondContact O-N 3.45Å; K881-A885 PolarHBondContact O-N 3.2Å
882	L	97.3	Very high	97	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.7	-45.1	174.3	-79.3	174.9	0	0	0	112.1	M855 L858 A861 I863 Y878 V880 N884 A885 G886 V887 V889	M855-L882 HydrophobicContact CB-CD2 4.47Å; M855-L882 HydrophobicContact CE-CD2 3.64Å; M855-L882 HydrophobicContact CE-CG 4Å; L858-L882 HydrophobicContact CB-CD2 4.2Å; L858-L882 HydrophobicContact CD1-CD2 3.62Å; A861-L882 HydrophobicContact CB-CD1 3.74Å; I863-L882 HydrophobicContact CD1-CD1 4.05Å; Y878-L882 HydrophobicContact CD1-CD1 3.67Å; Y878-L882 HydrophobicContact CD1-CG 4.15Å; Y878-L882 HydrophobicContact CE1-CD1 3.56Å; Y878-L882 HydrophobicContact CE1-CD2 4.46Å; Y878-L882 HydrophobicContact CE1-CG 4.03Å; Y878-L882 WeakPolarHBondContact O-CB 3.45Å; Y878-L882 WeakPolarHBondContact O-CG 3.35Å; Y878-L882 PolarHBondContact O-N 2.95Å; V880-L882 PolarHBondContact O-N 2.94Å; L882-N884 VanDerWaalsContact C-N 3.34Å; L882-N884 PolarHBondContact O-N 3.12Å; L882-A885 CarbonylContact O-C 3.53Å; L882-A885 PolarHBondContact O-N 2.92Å; L882-A885 VanDerWaalsContact O-N 3.11Å; L882-G886 PolarHBondContact O-N 2.89Å; L882-V887 HydrophobicContact CB-CB 4.1Å; L882-V887 HydrophobicContact CD2-CB 4.12Å; L882-V887 HydrophobicContact CD2-CG1 4.19Å; L882-V887 HydrophobicContact CD2-CG2 3.92Å; L882-V887 WeakPolarHBondContact O-CB 3.42Å; L882-V887 PolarHBondContact O-N 3.1Å; L882-V889 HydrophobicContact CB-CG2 3.45Å; L882-V889 VanDerWaalsContact CB-CG2 3.45Å; L882-V889 HydrophobicContact CD1-CG2 4.06Å; L882-V889 HydrophobicContact CG-CG2 4.42Å
883	R	96.9	Very high	97	Very high	99 Å²	99	36.6 Å²	36.6	37%	0.374	21%	0.205	S	C	.	.	H	α-helix	trans	-59.9	-44.2	176.5	-73	-180	-167.5	126	-1.1	111.9	A879 V880 A885 G886 V889 H891	A879-R883 WeakPolarHBondContact O-CG 3.31Å; A879-R883 PolarHBondContact O-N 3.31Å; A879-R883 VanDerWaalsContact O-N 3.07Å; V880-R883 PolarHBondContact O-N 3.25Å; R883-A885 PolarHBondContact O-N 3.48Å; R883-G886 PolarHBondContact O-N 3.18Å; R883-V889 HydrophobicContact CG-CB 3.77Å; R883-V889 HydrophobicContact CG-CG2 3.93Å; R883-H891 VanDerWaalsContact NH2-CB 3.29Å
884	N	95.1	Very high	97	Very high	134 Å²	134	37.5 Å²	37.5	72%	0.717	21%	0.209	S	C	*	.	H	α-helix	trans	-63.1	-24.9	177.9	-69.9	-7.9	0	0	0	112.6	V880 K881 L882 G886	V880-N884 WeakPolarHBondContact O-CB 3.41Å; V880-N884 VanDerWaalsContact O-CG 3.22Å; V880-N884 PolarHBondContact O-N 3.43Å; V880-N884 PolarHBondContact O-OD1 2.67Å; K881-N884 PolarHBondContact O-N 3.45Å; L882-N884 VanDerWaalsContact C-N 3.34Å; L882-N884 PolarHBondContact O-N 3.12Å; N884-G886 VanDerWaalsContact C-N 3.33Å
885	A	96.4	Very high	96.8	Very high	35 Å²	35	42.9 Å²	42.9	29%	0.289	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	9.1	173.9	0	0	0	0	0	113.9	M855 K881 L882 R883	M855-A885 HydrophobicContact CB-CB 3.57Å; K881-A885 PolarHBondContact O-N 3.2Å; L882-A885 CarbonylContact O-C 3.53Å; L882-A885 PolarHBondContact O-N 2.92Å; L882-A885 VanDerWaalsContact O-N 3.11Å; R883-A885 PolarHBondContact O-N 3.48Å
886	G	97.2	Very high	96.6	Very high	72 Å²	72	49.1 Å²	49.1	74%	0.742	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.2	13	177	0	0	0	0	0	115.1	L882 R883 N884	L882-G886 PolarHBondContact O-N 2.89Å; R883-G886 PolarHBondContact O-N 3.18Å; N884-G886 VanDerWaalsContact C-N 3.33Å
887	V	97.6	Very high	96.4	Very high	13 Å²	13	47 Å²	47	8%	0.079	25%	0.249	C	C	.	.			trans	-80.5	137.9	176.5	-179	0	0	0	0	109.8	L858 P859 L882 V889	L858-V887 HydrophobicContact CB-CG2 4.15Å; P859-V887 VanDerWaalsContact O-CG1 3.24Å; P859-V887 WeakPolarHBondContact O-CG1 3.48Å; L882-V887 HydrophobicContact CB-CB 4.1Å; L882-V887 HydrophobicContact CD2-CB 4.12Å; L882-V887 HydrophobicContact CD2-CG1 4.19Å; L882-V887 HydrophobicContact CD2-CG2 3.92Å; L882-V887 WeakPolarHBondContact O-CB 3.42Å; L882-V887 PolarHBondContact O-N 3.1Å; V887-V889 HydrophobicContact CB-CG2 4.46Å; V887-V889 HydrophobicContact CG1-CG2 4.33Å; V887-V889 PolarHBondContact O-N 2.97Å
888	N	97.6	Very high	96.1	Very high	116 Å²	116	46.8 Å²	46.8	62%	0.62	25%	0.248	S	C	*	.			trans	-70.5	118.6	173.4	-173.9	14.5	0	0	0	110.2	P860 A861	P860-N888 CarbonylContact C-O 3.53Å; P860-N888 VanDerWaalsContact CA-O 3.29Å; P860-N888 WeakPolarHBondContact CA-O 3.3Å; P860-N888 HydrophobicContact CB-CB 4.31Å; A861-N888 PolarHBondContact N-O 3.34Å
889	V	98.4	Very high	95.9	Very high	15 Å²	15	47.3 Å²	47.3	9%	0.091	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	118.9	-174.1	-179.9	0	0	0	0	111.1	A861 I863 A879 L882 R883 V887	A861-V889 HydrophobicContact CB-CG2 4.39Å; A861-V889 WeakPolarHBondContact O-CA 3.24Å; I863-V889 HydrophobicContact CD1-CG1 4.07Å; A879-V889 HydrophobicContact CB-CG1 3.98Å; L882-V889 HydrophobicContact CB-CG2 3.45Å; L882-V889 VanDerWaalsContact CB-CG2 3.45Å; L882-V889 HydrophobicContact CD1-CG2 4.06Å; L882-V889 HydrophobicContact CG-CG2 4.42Å; R883-V889 HydrophobicContact CG-CB 3.77Å; R883-V889 HydrophobicContact CG-CG2 3.93Å; V887-V889 HydrophobicContact CB-CG2 4.46Å; V887-V889 HydrophobicContact CG1-CG2 4.33Å; V887-V889 PolarHBondContact O-N 2.97Å
890	T	98.3	Very high	95.5	Very high	48 Å²	48	48.6 Å²	48.6	29%	0.294	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	128.6	162.9	-57	0	0	0	0	109	A861 L862 I863 M892 F921	A861-T890 PolarHBondContact O-N 2.86Å; L862-T890 CarbonylContact C-O 3.48Å; L862-T890 WeakPolarHBondContact CA-O 3.42Å; L862-T890 HydrophobicContact CD1-CG2 3.86Å; I863-T890 PolarHBondContact N-O 3.03Å; T890-M892 HydrophobicContact CG2-CE 4.31Å; T890-M892 HydrophobicContact CG2-CG 4.43Å; T890-F921 HydrophobicContact CG2-CD2 4.39Å; T890-F921 HydrophobicContact CG2-CE2 3.8Å; T890-F921 HydrophobicContact CG2-CZ 4.34Å; T890-F921 VanDerWaalsContact OG1-CE2 3.32Å; T890-F921 WeakPolarHBondContact OG1-CE2 3.39Å; T890-F921 WeakPolarHBondContact OG1-CZ 3.43Å
891	H	97.8	Very high	95.3	Very high	44 Å²	44	47.3 Å²	47.3	20%	0.204	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	120	176	174.3	-125.5	0	0	0	108.9	I863 T865 Y876 R883	I863-H891 CarbonylContact O-C 3.51Å; I863-H891 VanDerWaalsContact O-CA 3.3Å; I863-H891 WeakPolarHBondContact O-CA 3.31Å; I863-H891 PolarHBondContact O-CD2 3.38Å; T865-H891 WeakPolarHBondContact CG2-NE2 3.38Å; T865-H891 PolarHBondContact OG1-NE2 2.81Å; Y876-H891 AromaticContact CD2-CE1 3.67Å; R883-H891 VanDerWaalsContact NH2-CB 3.29Å
892	M	97.5	Very high	95.1	Very high	45 Å²	45	46.1 Å²	46.1	22%	0.222	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	118	177.1	-69.3	-178	-177.3	0	0	109	L862 I863 V864 T865 T890 Y894 D917 F921	L862-M892 HydrophobicContact CD1-CB 4.45Å; L862-M892 HydrophobicContact CD1-CE 3.9Å; L862-M892 HydrophobicContact CD1-CG 3.79Å; L862-M892 HydrophobicContact CD1-SD 3.82Å; L862-M892 HydrophobicContact CD2-SD 4.39Å; I863-M892 PolarHBondContact O-N 3.41Å; V864-M892 CarbonylContact C-O 3.59Å; V864-M892 VanDerWaalsContact CA-O 3.3Å; V864-M892 WeakPolarHBondContact CA-O 3.48Å; V864-M892 HydrophobicContact CG2-CB 4.39Å; T865-M892 PolarHBondContact N-O 3.14Å; T890-M892 HydrophobicContact CG2-CE 4.31Å; T890-M892 HydrophobicContact CG2-CG 4.43Å; M892-Y894 HydrophobicContact CB-CE2 4.39Å; M892-D917 HydrophobicContact SD-CB 4.49Å; M892-F921 HydrophobicContact CE-CB 4.12Å; M892-F921 HydrophobicContact CE-CD2 3.97Å; M892-F921 HydrophobicContact CE-CG 4.23Å
893	H	97	Very high	94.6	Very high	42 Å²	42	47.7 Å²	47.7	19%	0.194	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	128.4	178.3	-173.2	71	0	0	0	111.1	Y812 T865 Q867 E895	Y812-H893 AromaticContact CZ-CE1 3.98Å; Y812-H893 PolarHBondContact OH-CD2 3.02Å; Y812-H893 PolarHBondContact OH-CE1 2.84Å; Y812-H893 VanDerWaalsContact OH-CG 3.3Å; Y812-H893 PolarHBondContact OH-ND1 2.91Å; Y812-H893 VanDerWaalsContact OH-ND1 3.11Å; Y812-H893 PolarHBondContact OH-NE2 3.5Å; T865-H893 WeakPolarHBondContact O-CA 3.48Å; T865-H893 PolarHBondContact OG1-ND1 2.89Å; Q867-H893 PolarHBondContact OE1-NE2 3.01Å; H893-E895 VanDerWaalsContact CD2-CD 3.46Å; H893-E895 IonicContact CD2-OE1 2.69Å; H893-E895 PolarHBondContact CD2-OE1 3.09Å; H893-E895 IonicContact CD2-OE2 2.98Å; H893-E895 IonicContact NE2-OE1 3.17Å; H893-E895 IonicContact NE2-OE2 3.86Å
894	Y	96.2	Very high	94.1	Very high	19 Å²	19	43.6 Å²	43.6	8%	0.075	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	97.2	176.6	-70.3	-94.9	0	0	0	110	V864 T865 Q867 M892 R896 G897 M901 I910 A914 D917	V864-Y894 HydrophobicContact CG1-CD2 3.77Å; V864-Y894 HydrophobicContact CG1-CE2 3.62Å; T865-Y894 PolarHBondContact O-N 3.04Å; Q867-Y894 PolarHBondContact N-O 3.31Å; M892-Y894 HydrophobicContact CB-CE2 4.39Å; Y894-R896 PolarHBondContact O-N 3.46Å; Y894-G897 PolarHBondContact O-N 3.36Å; Y894-M901 HydrophobicContact CD2-CE 3.79Å; Y894-M901 HydrophobicContact CE2-CE 4.22Å; Y894-M901 HydrophobicContact CG-CE 3.98Å; Y894-I910 HydrophobicContact CD1-CD1 4.39Å; Y894-I910 HydrophobicContact CD1-CG1 4.13Å; Y894-A914 HydrophobicContact CE1-CB 4.04Å; Y894-A914 HydrophobicContact CE2-CB 4.15Å; Y894-A914 WeakPolarHBondContact OH-CA 3.35Å; Y894-D917 WeakPolarHBondContact OH-CB 3.35Å; Y894-D917 PolarHBondContact OH-OD2 3.37Å
895	E	93.6	Very high	93.8	Very high	114 Å²	114	37.6 Å²	37.6	53%	0.533	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	-25.6	-178.7	-66.5	-65.3	165.9	0	0	114.2	Q867 H893	Q867-E895 WeakPolarHBondContact CB-O 3.3Å; H893-E895 VanDerWaalsContact CD2-CD 3.46Å; H893-E895 IonicContact CD2-OE1 2.69Å; H893-E895 PolarHBondContact CD2-OE1 3.09Å; H893-E895 IonicContact CD2-OE2 2.98Å; H893-E895 IonicContact NE2-OE1 3.17Å; H893-E895 IonicContact NE2-OE2 3.86Å
896	R	92	Very high	93.2	Very high	131 Å²	131	37.2 Å²	37.2	49%	0.494	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	3.6	179.7	-56.6	-174.6	64.7	-170.5	-0.8	113.3	E540 S542 Y894 I910	E540-R896 WeakPolarHBondContact O-CB 3.49Å; E540-R896 VanDerWaalsContact O-CG 3.28Å; E540-R896 WeakPolarHBondContact O-CG 3.36Å; E540-R896 PolarHBondContact O-NE 3.33Å; S542-R896 PolarHBondContact N-O 2.84Å; Y894-R896 PolarHBondContact O-N 3.46Å; R896-I910 VanDerWaalsContact C-CD1 3.45Å; R896-I910 HydrophobicContact CB-CD1 3.98Å
897	G	92.7	Very high	92.5	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	161.6	-176.4	0	0	0	0	0	112.4	Q867 F868 Y894	Q867-G897 PolarHBondContact N-O 3.08Å; F868-G897 PolarHBondContact N-O 2.97Å; Y894-G897 PolarHBondContact O-N 3.36Å
898	F	91.7	Very high	91.9	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.009	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	164.2	-179.7	57.7	-89.7	0	0	0	110	M541 M547 L761 F868 M901 L904 M908 I910	M541-F898 HydrophobicContact CE-CB 4.08Å; M541-F898 HydrophobicContact CG-CD1 3.96Å; M541-F898 HydrophobicContact SD-CD1 4.14Å; M541-F898 HydrophobicContact SD-CG 4.42Å; M547-F898 HydrophobicContact CE-CD1 4.3Å; M547-F898 HydrophobicContact CE-CD2 3.88Å; M547-F898 HydrophobicContact CE-CE1 4.11Å; M547-F898 HydrophobicContact CE-CE2 3.68Å; M547-F898 HydrophobicContact CE-CG 4.22Å; M547-F898 HydrophobicContact CE-CZ 3.82Å; M547-F898 HydrophobicContact CG-CE1 4.29Å; M547-F898 HydrophobicContact CG-CZ 4.49Å; M547-F898 HydrophobicContact SD-CD1 4.46Å; M547-F898 HydrophobicContact SD-CE1 3.72Å; M547-F898 HydrophobicContact SD-CE2 3.8Å; M547-F898 HydrophobicContact SD-CZ 3.37Å; M547-F898 WeakPolarHBondContact SD-CZ 3.47Å; L761-F898 HydrophobicContact CD2-CD2 4.43Å; F868-F898 HydrophobicContact CB-CB 4.13Å; F868-F898 WeakPolarHBondContact O-CA 3.45Å; F898-M901 HydrophobicContact CD1-CB 4.46Å; F898-M901 HydrophobicContact CD2-CB 4.27Å; F898-M901 HydrophobicContact CE1-CB 4.14Å; F898-M901 HydrophobicContact CE2-CB 3.92Å; F898-M901 HydrophobicContact CG-CB 4.5Å; F898-M901 HydrophobicContact CZ-CB 3.82Å; F898-M901 WeakPolarHBondContact O-CB 3.13Å; F898-M901 WeakPolarHBondContact O-CG 3.48Å; F898-M901 PolarHBondContact O-N 3.21Å; F898-L904 HydrophobicContact CE2-CD1 4.35Å; F898-L904 HydrophobicContact CZ-CD1 4.44Å; F898-M908 HydrophobicContact CE1-SD 4.1Å; F898-M908 HydrophobicContact CZ-SD 3.52Å; F898-M908 VanDerWaalsContact CZ-SD 3.52Å; F898-I910 HydrophobicContact CE1-CG2 4.19Å
899	H	92.1	Very high	91.6	Very high	11 Å²	11	34.4 Å²	34.4	5%	0.051	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	139.6	-179.3	-159.2	87.8	0	0	0	111.9	S707 Y736 P762 F868 D869 M901	S707-H899 VanDerWaalsContact CB-NE2 3.28Å; S707-H899 WeakPolarHBondContact CB-NE2 3.48Å; S707-H899 PolarHBondContact OG-CE1 2.92Å; S707-H899 VanDerWaalsContact OG-CE1 3.28Å; S707-H899 PolarHBondContact OG-NE2 2.97Å; Y736-H899 AromaticContact CD2-CE1 3.64Å; P762-H899 HydrophobicContact CB-CB 4.18Å; P762-H899 HydrophobicContact CG-CB 4.32Å; F868-H899 PolarHBondContact O-N 3.3Å; D869-H899 HydrophobicContact CB-CB 4.35Å; D869-H899 IonicContact OD1-CE1 2.67Å; D869-H899 IonicContact OD1-CG 3.78Å; D869-H899 IonicContact OD1-ND1 2.74Å; D869-H899 PolarHBondContact OD1-ND1 2.77Å; D869-H899 IonicContact OD2-CE1 2.97Å; D869-H899 IonicContact OD2-CG 3.69Å; D869-H899 IonicContact OD2-ND1 2.85Å; D869-H899 PolarHBondContact OD2-ND1 3.39Å; H899-M901 PolarHBondContact O-N 3.17Å
900	A	89.8	Confident	91.3	Very high	26 Å²	26	34.4 Å²	34.4	22%	0.215	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.6	18.3	-177.4	0	0	0	0	0	115.8	L902 N903	A900-L902 PolarHBondContact O-N 3.34Å; A900-N903 WeakPolarHBondContact O-CB 3.37Å; A900-N903 PolarHBondContact O-N 3.45Å; A900-N903 PolarHBondContact O-OD1 2.76Å
901	M	91.2	Very high	91	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-55.2	-25.5	176.1	63.7	175	-175.8	0	0	114.1	Y736 T866 Y894 F898 H899 N903 L904 I910 G911 A914	Y736-M901 HydrophobicContact CE1-CE 4.42Å; Y736-M901 HydrophobicContact CE1-CG 4.22Å; T866-M901 HydrophobicContact CG2-CE 3.45Å; T866-M901 VanDerWaalsContact CG2-CE 3.45Å; T866-M901 HydrophobicContact CG2-CG 4.41Å; T866-M901 HydrophobicContact CG2-SD 3.61Å; Y894-M901 HydrophobicContact CD2-CE 3.79Å; Y894-M901 HydrophobicContact CE2-CE 4.22Å; Y894-M901 HydrophobicContact CG-CE 3.98Å; F898-M901 HydrophobicContact CD1-CB 4.46Å; F898-M901 HydrophobicContact CD2-CB 4.27Å; F898-M901 HydrophobicContact CE1-CB 4.14Å; F898-M901 HydrophobicContact CE2-CB 3.92Å; F898-M901 HydrophobicContact CG-CB 4.5Å; F898-M901 HydrophobicContact CZ-CB 3.82Å; F898-M901 WeakPolarHBondContact O-CB 3.13Å; F898-M901 WeakPolarHBondContact O-CG 3.48Å; F898-M901 PolarHBondContact O-N 3.21Å; H899-M901 PolarHBondContact O-N 3.17Å; M901-N903 VanDerWaalsContact C-N 3.33Å; M901-N903 PolarHBondContact O-N 3.25Å; M901-L904 PolarHBondContact O-N 2.76Å; M901-I910 HydrophobicContact CB-CG2 4.38Å; M901-I910 HydrophobicContact SD-CG1 4.04Å; M901-I910 HydrophobicContact SD-CG2 4.47Å; M901-G911 VanDerWaalsContact O-CA 3.32Å; M901-G911 WeakPolarHBondContact O-CA 3.35Å; M901-A914 HydrophobicContact CE-CB 3.74Å
902	L	91.7	Very high	90.7	Very high	3 Å²	3	36 Å²	36	2%	0.016	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-68.4	-30.9	177.3	-58.8	-175.3	0	0	0	112.5	I647 I735 Y736 A900 L904 H905 A914 I915	I647-L902 HydrophobicContact CD1-CB 4.28Å; I647-L902 WeakPolarHBondContact CG1-O 3.35Å; I735-L902 HydrophobicContact CB-CD1 4.47Å; I735-L902 HydrophobicContact CD1-CD1 3.48Å; I735-L902 VanDerWaalsContact CD1-CD1 3.48Å; I735-L902 HydrophobicContact CG2-CD1 3.73Å; Y736-L902 HydrophobicContact CE1-CD1 4.42Å; Y736-L902 HydrophobicContact CE1-CG 4.17Å; Y736-L902 WeakPolarHBondContact OH-CD1 3.38Å; Y736-L902 VanDerWaalsContact OH-CG 3.31Å; Y736-L902 WeakPolarHBondContact OH-CG 3.43Å; A900-L902 PolarHBondContact O-N 3.34Å; L902-L904 PolarHBondContact O-N 3.35Å; L902-H905 WeakPolarHBondContact O-CB 3.25Å; L902-H905 PolarHBondContact O-N 3.05Å; L902-H905 PolarHBondContact O-ND1 2.77Å; L902-A914 HydrophobicContact CD2-CB 3.62Å; L902-I915 HydrophobicContact CD2-CG1 3.73Å
903	N	87.1	Confident	90.6	Very high	32 Å²	32	39.3 Å²	39.3	17%	0.171	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-66.7	-18.6	178.3	-61.8	86.1	0	0	0	112.7	I647 A900 M901	I647-N903 HydrophobicContact CD1-CB 4.48Å; A900-N903 WeakPolarHBondContact O-CB 3.37Å; A900-N903 PolarHBondContact O-N 3.45Å; A900-N903 PolarHBondContact O-OD1 2.76Å; M901-N903 VanDerWaalsContact C-N 3.33Å; M901-N903 PolarHBondContact O-N 3.25Å
904	L	85.5	Confident	90.5	Very high	13 Å²	13	37.3 Å²	37.3	7%	0.068	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-111.1	22.1	179.5	-56.6	176.1	0	0	0	112	M547 F550 F898 M901 L902 T906 E907 M908	M547-L904 HydrophobicContact SD-CD1 4.4Å; F550-L904 HydrophobicContact CD1-CD1 4.13Å; F550-L904 HydrophobicContact CD2-CD1 4.31Å; F550-L904 HydrophobicContact CD2-CD2 4.16Å; F550-L904 HydrophobicContact CE1-CD1 4.1Å; F550-L904 HydrophobicContact CE2-CD1 4.28Å; F550-L904 HydrophobicContact CE2-CD2 3.88Å; F550-L904 HydrophobicContact CG-CD1 4.23Å; F550-L904 HydrophobicContact CZ-CD1 4.18Å; F550-L904 HydrophobicContact CZ-CD2 4.34Å; F898-L904 HydrophobicContact CE2-CD1 4.35Å; F898-L904 HydrophobicContact CZ-CD1 4.44Å; M901-L904 PolarHBondContact O-N 2.76Å; L902-L904 PolarHBondContact O-N 3.35Å; L904-T906 PolarHBondContact O-N 3Å; L904-E907 PolarHBondContact O-N 2.98Å; L904-E907 VanDerWaalsContact O-N 3.11Å; L904-M908 HydrophobicContact CB-CB 4.45Å; L904-M908 HydrophobicContact CB-CE 4.28Å; L904-M908 HydrophobicContact CB-CG 4.04Å; L904-M908 HydrophobicContact CB-SD 3.75Å; L904-M908 HydrophobicContact CD1-CE 3.56Å; L904-M908 HydrophobicContact CD1-SD 3.71Å; L904-M908 HydrophobicContact CG-CE 4.48Å; L904-M908 HydrophobicContact CG-SD 4.38Å; L904-M908 WeakPolarHBondContact O-CA 3.01Å; L904-M908 WeakPolarHBondContact O-CB 3.27Å; L904-M908 PolarHBondContact O-N 2.85Å
905	H	87.7	Confident	90.5	Very high	8 Å²	8	36.6 Å²	36.6	4%	0.037	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-23.9	-178.7	69.2	-82.1	0	0	0	114.2	I647 L650 L902 R912 I915	I647-H905 PolarHBondContact N-CE1 3.39Å; L650-H905 VanDerWaalsContact CD2-CD2 3.46Å; L650-H905 WeakPolarHBondContact CD2-CD2 3.49Å; L902-H905 WeakPolarHBondContact O-CB 3.25Å; L902-H905 PolarHBondContact O-N 3.05Å; L902-H905 PolarHBondContact O-ND1 2.77Å; H905-R912 WeakPolarHBondContact O-CB 3.02Å; H905-R912 PolarHBondContact O-NE 3.41Å; H905-I915 HydrophobicContact CB-CD1 3.5Å; H905-I915 HydrophobicContact CB-CG1 4.45Å; H905-I915 VanDerWaalsContact CG-CD1 3.42Å
906	T	85.1	Confident	90.6	Very high	27 Å²	27	35 Å²	35	17%	0.166	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-41.9	175.1	25.4	0	0	0	0	111.2	H594 L646 L904 R912	H594-T906 VanDerWaalsContact CD2-CG2 3.42Å; H594-T906 WeakPolarHBondContact CD2-CG2 3.26Å; H594-T906 VanDerWaalsContact NE2-CB 3.33Å; H594-T906 WeakPolarHBondContact NE2-CB 3.48Å; H594-T906 WeakPolarHBondContact NE2-CG2 3.11Å; L646-T906 HydrophobicContact CD1-CG2 4.08Å; L904-T906 PolarHBondContact O-N 3Å; T906-R912 PolarHBondContact O-NH2 3.1Å
907	E	82.2	Confident	90.9	Very high	53 Å²	53	31.2 Å²	31.2	25%	0.248	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-26.7	-174.4	-62.1	72.4	-159.4	0	0	113	R546 H594 L904	R546-E907 VanDerWaalsContact CD-O 3.23Å; R546-E907 WeakPolarHBondContact CD-O 3.27Å; R546-E907 VanDerWaalsContact CZ-O 3.29Å; R546-E907 PolarHBondContact NH1-O 3.16Å; H594-E907 IonicContact CE1-OE1 3.68Å; H594-E907 PolarHBondContact CE1-OE1 3.35Å; H594-E907 VanDerWaalsContact CE1-OE1 3.28Å; L904-E907 PolarHBondContact O-N 2.98Å; L904-E907 VanDerWaalsContact O-N 3.11Å
908	M	85.3	Confident	91.1	Very high	4 Å²	4	31.3 Å²	31.3	2%	0.02	16%	0.155	C	C	.	.			trans	-123	135.2	-169.1	-60.5	-177.1	-178.9	0	0	112	D543 R546 M547 F898 L904 I910 R912	D543-M908 HydrophobicContact CB-CB 4.19Å; D543-M908 HydrophobicContact CB-CG 3.98Å; D543-M908 HydrophobicContact CB-SD 4.35Å; R546-M908 HydrophobicContact CB-CE 4.14Å; M547-M908 HydrophobicContact CG-CE 3.88Å; M547-M908 HydrophobicContact CG-SD 4.18Å; M547-M908 HydrophobicContact SD-CE 3.17Å; M547-M908 WeakPolarHBondContact SD-CE 3.45Å; M547-M908 HydrophobicContact SD-SD 3.43Å; F898-M908 HydrophobicContact CE1-SD 4.1Å; F898-M908 HydrophobicContact CZ-SD 3.52Å; F898-M908 VanDerWaalsContact CZ-SD 3.52Å; L904-M908 HydrophobicContact CB-CB 4.45Å; L904-M908 HydrophobicContact CB-CE 4.28Å; L904-M908 HydrophobicContact CB-CG 4.04Å; L904-M908 HydrophobicContact CB-SD 3.75Å; L904-M908 HydrophobicContact CD1-CE 3.56Å; L904-M908 HydrophobicContact CD1-SD 3.71Å; L904-M908 HydrophobicContact CG-CE 4.48Å; L904-M908 HydrophobicContact CG-SD 4.38Å; L904-M908 WeakPolarHBondContact O-CA 3.01Å; L904-M908 WeakPolarHBondContact O-CB 3.27Å; L904-M908 PolarHBondContact O-N 2.85Å; M908-I910 VanDerWaalsContact C-N 3.33Å; M908-I910 PolarHBondContact O-N 3.49Å; M908-R912 PolarHBondContact O-N 3.49Å
909	T	90.3	Very high	91.4	Very high	86 Å²	86	31.2 Å²	31.2	53%	0.528	16%	0.155	S	C	.	.	H	α-helix	trans	-66.3	-37.5	-175.3	60.3	0	0	0	0	112.1	D543 R912 K913	D543-T909 PolarHBondContact OD1-N 3.33Å; D543-T909 PolarHBondContact OD2-N 2.78Å; D543-T909 VanDerWaalsContact OD2-N 3.12Å; D543-T909 PolarHBondContact OD2-OG1 2.92Å; T909-R912 PolarHBondContact O-N 3.37Å; T909-K913 WeakPolarHBondContact O-CB 3.28Å; T909-K913 PolarHBondContact O-N 2.93Å
910	I	92	Very high	91.6	Very high	15 Å²	15	34 Å²	34	8%	0.077	17%	0.172	C	C	.	.	H	α-helix	trans	-67.1	-41.7	-178.2	-165.7	155	0	0	0	112.8	Y894 R896 F898 M901 M908 K913 A914	Y894-I910 HydrophobicContact CD1-CD1 4.39Å; Y894-I910 HydrophobicContact CD1-CG1 4.13Å; R896-I910 VanDerWaalsContact C-CD1 3.45Å; R896-I910 HydrophobicContact CB-CD1 3.98Å; F898-I910 HydrophobicContact CE1-CG2 4.19Å; M901-I910 HydrophobicContact CB-CG2 4.38Å; M901-I910 HydrophobicContact SD-CG1 4.04Å; M901-I910 HydrophobicContact SD-CG2 4.47Å; M908-I910 VanDerWaalsContact C-N 3.33Å; M908-I910 PolarHBondContact O-N 3.49Å; I910-K913 PolarHBondContact O-N 3Å; I910-A914 WeakPolarHBondContact O-CB 3.49Å; I910-A914 PolarHBondContact O-N 3.19Å
911	G	91.8	Very high	91.9	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64.1	-42.4	176.7	0	0	0	0	0	111.5	M901 A914 I915	M901-G911 VanDerWaalsContact O-CA 3.32Å; M901-G911 WeakPolarHBondContact O-CA 3.35Å; G911-A914 PolarHBondContact O-N 2.86Å; G911-I915 WeakPolarHBondContact O-CG1 3.37Å; G911-I915 PolarHBondContact O-N 3.14Å; G911-I915 VanDerWaalsContact O-N 3.1Å
912	R	92.7	Very high	92.2	Very high	125 Å²	125	34.4 Å²	34.4	47%	0.472	17%	0.169	S	C	.	.	H	α-helix	trans	-61.1	-49.8	174.9	-165.9	178.4	-60.9	-158.1	2.6	111.9	H905 T906 M908 T909 A914 I915 H916	H905-R912 WeakPolarHBondContact O-CB 3.02Å; H905-R912 PolarHBondContact O-NE 3.41Å; T906-R912 PolarHBondContact O-NH2 3.1Å; M908-R912 PolarHBondContact O-N 3.49Å; T909-R912 PolarHBondContact O-N 3.37Å; R912-A914 VanDerWaalsContact C-N 3.28Å; R912-A914 PolarHBondContact O-N 2.85Å; R912-I915 PolarHBondContact O-N 3.22Å; R912-H916 PolarHBondContact O-CD2 3.06Å; R912-H916 VanDerWaalsContact O-CD2 3.27Å; R912-H916 PolarHBondContact O-N 2.73Å; R912-H916 VanDerWaalsContact O-N 3.1Å
913	K	94.7	Very high	92.3	Very high	114 Å²	114	39.3 Å²	39.3	50%	0.496	19%	0.188	S	C	.	.	H	α-helix	trans	-55.6	-46.3	177	-177.5	-177.1	-178.8	-64.5	0	110.4	T909 I910 I915 H916 D917	T909-K913 WeakPolarHBondContact O-CB 3.28Å; T909-K913 PolarHBondContact O-N 2.93Å; I910-K913 PolarHBondContact O-N 3Å; K913-I915 PolarHBondContact O-N 3.16Å; K913-H916 PolarHBondContact O-N 3.38Å; K913-D917 IonicContact NZ-OD1 2.92Å; K913-D917 IonicContact NZ-OD2 2.95Å; K913-D917 PolarHBondContact NZ-OD2 3.2Å; K913-D917 PolarHBondContact O-N 3.29Å
914	A	96.2	Very high	92.6	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-60.7	-44.7	180	0	0	0	0	0	113.2	Y894 M901 L902 I910 G911 R912 H916 D917 I918	Y894-A914 HydrophobicContact CE1-CB 4.04Å; Y894-A914 HydrophobicContact CE2-CB 4.15Å; Y894-A914 WeakPolarHBondContact OH-CA 3.35Å; M901-A914 HydrophobicContact CE-CB 3.74Å; L902-A914 HydrophobicContact CD2-CB 3.62Å; I910-A914 WeakPolarHBondContact O-CB 3.49Å; I910-A914 PolarHBondContact O-N 3.19Å; G911-A914 PolarHBondContact O-N 2.86Å; R912-A914 VanDerWaalsContact C-N 3.28Å; R912-A914 PolarHBondContact O-N 2.85Å; A914-H916 VanDerWaalsContact C-N 3.32Å; A914-H916 PolarHBondContact O-N 3.17Å; A914-D917 PolarHBondContact O-N 2.95Å; A914-I918 WeakPolarHBondContact O-CB 3.26Å; A914-I918 WeakPolarHBondContact O-CD1 3.13Å; A914-I918 WeakPolarHBondContact O-CG1 3.42Å; A914-I918 PolarHBondContact O-N 3.2Å
915	I	95.6	Very high	93	Very high	5 Å²	5	42.9 Å²	42.9	3%	0.026	22%	0.216	C	C	.	.	H	α-helix	trans	-62.4	-40	176	-62.5	175.6	0	0	0	111.3	I647 L650 L902 H905 G911 R912 K913 G919	I647-I915 HydrophobicContact CB-CD1 4.44Å; I647-I915 HydrophobicContact CG1-CD1 4.3Å; I647-I915 HydrophobicContact CG2-CD1 4Å; L650-I915 HydrophobicContact CB-CG2 4.36Å; L650-I915 HydrophobicContact CD2-CB 4.12Å; L650-I915 HydrophobicContact CD2-CD1 3.95Å; L650-I915 HydrophobicContact CD2-CG2 3.81Å; L650-I915 HydrophobicContact CG-CG2 3.8Å; L902-I915 HydrophobicContact CD2-CG1 3.73Å; H905-I915 HydrophobicContact CB-CD1 3.5Å; H905-I915 HydrophobicContact CB-CG1 4.45Å; H905-I915 VanDerWaalsContact CG-CD1 3.42Å; G911-I915 WeakPolarHBondContact O-CG1 3.37Å; G911-I915 PolarHBondContact O-N 3.14Å; G911-I915 VanDerWaalsContact O-N 3.1Å; R912-I915 PolarHBondContact O-N 3.22Å; K913-I915 PolarHBondContact O-N 3.16Å; I915-G919 PolarHBondContact O-N 3.12Å
916	H	96.3	Very high	93.2	Very high	81 Å²	81	42.6 Å²	42.6	38%	0.375	21%	0.214	S	C	.	.	H	α-helix	trans	-66.7	-43.8	177.2	-82.9	-75	0	0	0	113.2	R912 K913 A914 G919 T920	R912-H916 PolarHBondContact O-CD2 3.06Å; R912-H916 VanDerWaalsContact O-CD2 3.27Å; R912-H916 PolarHBondContact O-N 2.73Å; R912-H916 VanDerWaalsContact O-N 3.1Å; K913-H916 PolarHBondContact O-N 3.38Å; A914-H916 VanDerWaalsContact C-N 3.32Å; A914-H916 PolarHBondContact O-N 3.17Å; H916-G919 PolarHBondContact O-N 2.76Å; H916-T920 VanDerWaalsContact O-CB 3.31Å; H916-T920 WeakPolarHBondContact O-CB 3.48Å; H916-T920 PolarHBondContact O-N 3.33Å; H916-T920 PolarHBondContact O-OG1 3.19Å
917	D	97.3	Very high	93.1	Very high	50 Å²	50	46.7 Å²	46.7	27%	0.267	25%	0.251	S	S	.	.	H	α-helix	trans	-61.7	-47.8	177.5	-65.4	-20.2	0	0	0	110.2	M892 Y894 K913 A914 T920 F921	M892-D917 HydrophobicContact SD-CB 4.49Å; Y894-D917 WeakPolarHBondContact OH-CB 3.35Å; Y894-D917 PolarHBondContact OH-OD2 3.37Å; K913-D917 IonicContact NZ-OD1 2.92Å; K913-D917 IonicContact NZ-OD2 2.95Å; K913-D917 PolarHBondContact NZ-OD2 3.2Å; K913-D917 PolarHBondContact O-N 3.29Å; A914-D917 PolarHBondContact O-N 2.95Å; D917-T920 PolarHBondContact O-N 3.1Å; D917-F921 PolarHBondContact O-N 3.36Å
918	I	97.8	Very high	93.6	Very high	3 Å²	3	46.4 Å²	46.4	2%	0.015	25%	0.251	C	S	.	.	H	α-helix	trans	-61.5	-48.7	177.3	-67.4	165.2	0	0	0	110.7	I704 V733 I735 L862 V864 A914 T920 F921 I922	I704-I918 HydrophobicContact CD1-CG2 3.98Å; V733-I918 HydrophobicContact CG1-CG2 4.02Å; I735-I918 HydrophobicContact CD1-CD1 3.88Å; I735-I918 HydrophobicContact CG1-CD1 4.3Å; L862-I918 HydrophobicContact CD2-CB 4.5Å; L862-I918 HydrophobicContact CD2-CG1 4.22Å; L862-I918 HydrophobicContact CD2-CG2 4.3Å; V864-I918 HydrophobicContact CG2-CD1 3.97Å; V864-I918 HydrophobicContact CG2-CG1 4.01Å; A914-I918 WeakPolarHBondContact O-CB 3.26Å; A914-I918 WeakPolarHBondContact O-CD1 3.13Å; A914-I918 WeakPolarHBondContact O-CG1 3.42Å; A914-I918 PolarHBondContact O-N 3.2Å; I918-T920 VanDerWaalsContact C-N 3.32Å; I918-T920 PolarHBondContact O-N 3.1Å; I918-F921 PolarHBondContact O-N 3.29Å; I918-I922 HydrophobicContact CG2-CD1 3.75Å; I918-I922 HydrophobicContact CG2-CG1 4.39Å; I918-I922 WeakPolarHBondContact O-CG1 3.4Å; I918-I922 PolarHBondContact O-N 2.93Å
919	G	96.7	Very high	94.1	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.7	-38.4	179.4	0	0	0	0	0	112.6	I915 H916 I922 R923	I915-G919 PolarHBondContact O-N 3.12Å; H916-G919 PolarHBondContact O-N 2.76Å; G919-I922 PolarHBondContact O-N 2.97Å; G919-R923 WeakPolarHBondContact O-CB 3.34Å; G919-R923 PolarHBondContact O-N 3.08Å
920	T	96	Very high	94.3	Very high	68 Å²	68	46.5 Å²	46.5	42%	0.417	25%	0.248	S	C	.	.	H	α-helix	trans	-64.5	-42.3	175.6	-59.4	0	0	0	0	111.5	H916 D917 I918 R923 S924	H916-T920 VanDerWaalsContact O-CB 3.31Å; H916-T920 WeakPolarHBondContact O-CB 3.48Å; H916-T920 PolarHBondContact O-N 3.33Å; H916-T920 PolarHBondContact O-OG1 3.19Å; D917-T920 PolarHBondContact O-N 3.1Å; I918-T920 VanDerWaalsContact C-N 3.32Å; I918-T920 PolarHBondContact O-N 3.1Å; T920-R923 PolarHBondContact O-N 3.24Å; T920-S924 PolarHBondContact O-N 3.38Å
921	F	97.2	Very high	94.4	Very high	36 Å²	36	48.4 Å²	48.4	16%	0.158	26%	0.258	C	S	.	.	H	α-helix	trans	-65.3	-42.9	175.8	-177.8	-86.6	0	0	0	112.6	L731 L862 T890 M892 D917 I918 R923 S924 C925	L731-F921 HydrophobicContact CD1-CE1 3.96Å; L731-F921 HydrophobicContact CD2-CD1 4.28Å; L731-F921 HydrophobicContact CD2-CE1 4.12Å; L862-F921 HydrophobicContact CB-CD1 3.98Å; L862-F921 HydrophobicContact CB-CE1 3.7Å; L862-F921 HydrophobicContact CB-CZ 4.35Å; L862-F921 HydrophobicContact CD1-CD1 4.45Å; L862-F921 HydrophobicContact CD1-CE1 4.47Å; L862-F921 HydrophobicContact CD2-CB 4.21Å; L862-F921 HydrophobicContact CD2-CD1 3.65Å; L862-F921 HydrophobicContact CD2-CE1 4.25Å; L862-F921 HydrophobicContact CD2-CG 3.99Å; L862-F921 HydrophobicContact CG-CD1 4.23Å; L862-F921 HydrophobicContact CG-CE1 4.35Å; T890-F921 HydrophobicContact CG2-CD2 4.39Å; T890-F921 HydrophobicContact CG2-CE2 3.8Å; T890-F921 HydrophobicContact CG2-CZ 4.34Å; T890-F921 VanDerWaalsContact OG1-CE2 3.32Å; T890-F921 WeakPolarHBondContact OG1-CE2 3.39Å; T890-F921 WeakPolarHBondContact OG1-CZ 3.43Å; M892-F921 HydrophobicContact CE-CB 4.12Å; M892-F921 HydrophobicContact CE-CD2 3.97Å; M892-F921 HydrophobicContact CE-CG 4.23Å; D917-F921 PolarHBondContact O-N 3.36Å; I918-F921 PolarHBondContact O-N 3.29Å; F921-R923 VanDerWaalsContact C-N 3.32Å; F921-R923 PolarHBondContact O-N 3.41Å; F921-S924 PolarHBondContact O-N 3.31Å; F921-S924 PolarHBondContact O-OG 3.42Å; F921-C925 WeakPolarHBondContact CE1-SG 3.38Å; F921-C925 PolarHBondContact O-N 3.2Å; F921-C925 VanDerWaalsContact O-N 3.1Å; F921-C925 PolarHBondContact O-SG 3.28Å
922	I	96.9	Very high	94.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-60.3	-46.8	176	-69.2	167.5	0	0	0	109.7	I628 L651 T655 M657 T702 I704 L731 V733 I918 G919 S924 C925 M926	I628-I922 HydrophobicContact CD1-CD1 4.43Å; I628-I922 HydrophobicContact CD1-CG2 4.08Å; I628-I922 HydrophobicContact CG1-CG2 4.39Å; L651-I922 HydrophobicContact CD1-CD1 4.27Å; T655-I922 HydrophobicContact CG2-CB 4.26Å; T655-I922 HydrophobicContact CG2-CG2 4.22Å; M657-I922 HydrophobicContact CE-CG2 4.26Å; M657-I922 HydrophobicContact SD-CG2 3.98Å; T702-I922 HydrophobicContact CG2-CD1 4.3Å; T702-I922 HydrophobicContact CG2-CG1 4.33Å; T702-I922 HydrophobicContact CG2-CG2 4.49Å; I704-I922 HydrophobicContact CD1-CD1 4.09Å; L731-I922 HydrophobicContact CD2-CG1 3.99Å; V733-I922 HydrophobicContact CG2-CD1 4.17Å; V733-I922 HydrophobicContact CG2-CG1 4.03Å; I918-I922 HydrophobicContact CG2-CD1 3.75Å; I918-I922 HydrophobicContact CG2-CG1 4.39Å; I918-I922 WeakPolarHBondContact O-CG1 3.4Å; I918-I922 PolarHBondContact O-N 2.93Å; G919-I922 PolarHBondContact O-N 2.97Å; I922-S924 VanDerWaalsContact C-N 3.34Å; I922-S924 PolarHBondContact O-N 3.47Å; I922-C925 PolarHBondContact O-N 3.13Å; I922-C925 VanDerWaalsContact O-N 3.16Å; I922-M926 HydrophobicContact CG2-CG 4.13Å; I922-M926 WeakPolarHBondContact O-CB 3.16Å; I922-M926 WeakPolarHBondContact O-CG 3.39Å; I922-M926 PolarHBondContact O-N 3.45Å
923	R	94.4	Very high	94.7	Very high	106 Å²	106	46.5 Å²	46.5	40%	0.4	26%	0.261	S	S	.	.	H	α-helix	trans	-60	-42.3	178.7	-174	175.3	56.8	-149.6	-5.9	112.2	V654 M657 G919 T920 F921 C925 M926 A927	V654-R923 PolarHBondContact O-NH1 2.93Å; M657-R923 HydrophobicContact CE-CB 4.49Å; G919-R923 WeakPolarHBondContact O-CB 3.34Å; G919-R923 PolarHBondContact O-N 3.08Å; T920-R923 PolarHBondContact O-N 3.24Å; F921-R923 VanDerWaalsContact C-N 3.32Å; F921-R923 PolarHBondContact O-N 3.41Å; R923-C925 VanDerWaalsContact C-N 3.3Å; R923-C925 PolarHBondContact O-N 2.93Å; R923-M926 PolarHBondContact O-N 3.48Å; R923-A927 PolarHBondContact O-N 2.72Å
924	S	93.6	Very high	94.7	Very high	78 Å²	78	41.6 Å²	41.6	55%	0.545	25%	0.245	S	C	.	.	H	α-helix	trans	-66.6	-30.5	177.4	67.9	0	0	0	0	113.2	T920 F921 I922	T920-S924 PolarHBondContact O-N 3.38Å; F921-S924 PolarHBondContact O-N 3.31Å; F921-S924 PolarHBondContact O-OG 3.42Å; I922-S924 VanDerWaalsContact C-N 3.34Å; I922-S924 PolarHBondContact O-N 3.47Å
925	C	93.8	Very high	94.6	Very high	42 Å²	42	44.8 Å²	44.8	28%	0.284	26%	0.263	S	S	.	.	H	α-helix	trans	-78.7	-20.8	176.1	-66.1	0	0	0	0	113.9	L731 F921 I922 R923	L731-C925 HydrophobicContact CD2-CB 4.14Å; F921-C925 WeakPolarHBondContact CE1-SG 3.38Å; F921-C925 PolarHBondContact O-N 3.2Å; F921-C925 VanDerWaalsContact O-N 3.1Å; F921-C925 PolarHBondContact O-SG 3.28Å; I922-C925 PolarHBondContact O-N 3.13Å; I922-C925 VanDerWaalsContact O-N 3.16Å; R923-C925 VanDerWaalsContact C-N 3.3Å; R923-C925 PolarHBondContact O-N 2.93Å
926	M	91.6	Very high	94.5	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-103.4	-17.2	-175.6	-64.6	-66.1	141.8	0	0	113.9	A626 M657 K700 T702 K730 L731 I922 R923	A626-M926 HydrophobicContact CB-CB 4.09Å; A626-M926 HydrophobicContact CB-CG 4.21Å; A626-M926 HydrophobicContact CB-SD 4.23Å; M657-M926 HydrophobicContact CE-CB 3.39Å; M657-M926 HydrophobicContact CE-CG 3.71Å; M657-M926 HydrophobicContact SD-CB 4.37Å; M657-M926 HydrophobicContact SD-CG 4.13Å; K700-M926 HydrophobicContact CB-SD 4.14Å; K700-M926 WeakPolarHBondContact CE-O 3.4Å; K700-M926 PolarHBondContact NZ-O 2.84Å; T702-M926 WeakPolarHBondContact OG1-CE 3.47Å; K730-M926 HydrophobicContact CB-CE 3.78Å; K730-M926 HydrophobicContact CB-SD 4.34Å; K730-M926 HydrophobicContact CG-CE 3.6Å; K730-M926 HydrophobicContact CG-SD 4.07Å; L731-M926 HydrophobicContact CB-CE 3.57Å; L731-M926 HydrophobicContact CD2-CE 4.27Å; I922-M926 HydrophobicContact CG2-CG 4.13Å; I922-M926 WeakPolarHBondContact O-CB 3.16Å; I922-M926 WeakPolarHBondContact O-CG 3.39Å; I922-M926 PolarHBondContact O-N 3.45Å; R923-M926 PolarHBondContact O-N 3.48Å
927	A	82.2	Confident	94.3	Very high	112 Å²	112	45.2 Å²	45.2	93%	0.926	28%	0.275	S	S	*	.			trans	-54.7	0	164.1	0	0	0	0	0	108.4	K700 R923	K700-A927 PolarHBondContact NZ-O 3.43Å; R923-A927 PolarHBondContact O-N 2.72Å

Retrieved 927 of 927 residues in 2025.7 ms (Link to these results)

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