X2JD28_DROME Loading...

Kelch-like protein diablo

Probable substrate-specific adapter of an E3 ubiquitin-protein ligase complex which mediates the ubiquitination and subsequent proteasomal degradation of target proteins. May have a role in synapse differentiation and growth.

AlphaFold DB , UniProt , Accession X2JD28, Species DROME (Drosophila melanogaster, Fruit fly), Gene BcDNA:LP02641, Length 550 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	59.2	Low	69.6	Low	101 Å²	101	113.6 Å²	113.6	50%	0.498	59%	0.588	S	S	.	*				0	-62.3	0	-163.4	176	-83.5	0	0	110.9	E8 V14 L16	M1-E8 HydrophobicContact CG-CB 4.09Å; M1-E8 HydrophobicContact CG-CG 4.23Å; M1-V14 HydrophobicContact SD-CG1 4.31Å; M1-L16 HydrophobicContact CE-CD2 4.08Å; M1-L16 HydrophobicContact SD-CD2 4.1Å
2	F	64.1	Low	70.1	Confident	137 Å²	137	120.8 Å²	120.8	60%	0.601	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-4.8	-171.6	-53.6	-69.7	0	0	0	116.7	V14	F2-V14 HydrophobicContact CE1-CG2 4.31Å
3	T	63.7	Low	70.7	Confident	148 Å²	148	124.6 Å²	124.6	91%	0.908	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.8	10.4	-175.7	52.9	0	0	0	0	113.6
4	G	69.1	Low	71.4	Confident	36 Å²	36	119.1 Å²	119.1	37%	0.371	61%	0.606	S	S	.	*	S	Bend	trans	-118.6	-167.3	-176.2	0	0	0	0	0	113.8	L6 T9	G4-L6 VanDerWaalsContact C-N 3.28Å; G4-L6 PolarHBondContact O-N 2.97Å; G4-T9 PolarHBondContact O-OG1 3.45Å
5	S	70.2	Confident	71.8	Confident	132 Å²	132	120.3 Å²	120.3	92%	0.923	62%	0.622	S	S	*	*	S	Bend	trans	-91.8	23.4	177.7	-27.5	0	0	0	0	113.1
6	L	75.1	Confident	72.1	Confident	95 Å²	95	116.9 Å²	116.9	50%	0.497	61%	0.605	S	S	.	*	S	Bend	trans	-81.9	156.3	-173.9	-65.7	170.6	0	0	0	110.7	G4 E8 T9	G4-L6 VanDerWaalsContact C-N 3.28Å; G4-L6 PolarHBondContact O-N 2.97Å; L6-E8 VanDerWaalsContact CB-OE2 3.23Å; L6-E8 WeakPolarHBondContact CB-OE2 3.16Å; L6-E8 PolarHBondContact O-N 2.77Å; L6-T9 WeakPolarHBondContact O-CB 3.23Å; L6-T9 PolarHBondContact O-N 2.75Å; L6-T9 PolarHBondContact O-OG1 3.01Å
7	R	70.9	Confident	72.1	Confident	192 Å²	192	114.7 Å²	114.7	73%	0.725	62%	0.617	S	S	*	*	G	3₁₀ helix	trans	-56.8	-36.7	-174.5	178.9	177.9	165.7	178.6	-5.6	112.2	T9 K10 E11	R7-T9 PolarHBondContact O-N 3.21Å; R7-K10 PolarHBondContact O-N 3.06Å; R7-E11 IonicContact CZ-OE1 3.29Å; R7-E11 VanDerWaalsContact CZ-OE1 3.29Å; R7-E11 IonicContact NE-OE1 2.77Å; R7-E11 PolarHBondContact NE-OE1 3.01Å; R7-E11 IonicContact NH2-OE1 2.97Å; R7-E11 PolarHBondContact NH2-OE1 2.95Å
8	E	73.7	Confident	72.3	Confident	60 Å²	60	117.4 Å²	117.4	28%	0.28	63%	0.625	S	S	.	*	G	3₁₀ helix	trans	-57.8	-17.7	176.2	-60.3	90.5	151.3	0	0	113	M1 L6 K10 V14	M1-E8 HydrophobicContact CG-CB 4.09Å; M1-E8 HydrophobicContact CG-CG 4.23Å; L6-E8 VanDerWaalsContact CB-OE2 3.23Å; L6-E8 WeakPolarHBondContact CB-OE2 3.16Å; L6-E8 PolarHBondContact O-N 2.77Å; E8-K10 VanDerWaalsContact C-N 3.31Å; E8-V14 HydrophobicContact CB-CG1 4.5Å; E8-V14 HydrophobicContact CB-CG2 3.97Å; E8-V14 HydrophobicContact CG-CG1 4.06Å; E8-V14 HydrophobicContact CG-CG2 4.31Å
9	T	70.8	Confident	72.7	Confident	68 Å²	68	112.4 Å²	112.4	42%	0.417	60%	0.599	S	S	.	*	G	3₁₀ helix	trans	-75.9	-21.5	177.4	-41.8	0	0	0	0	112.2	G4 L6 R7	G4-T9 PolarHBondContact O-OG1 3.45Å; L6-T9 WeakPolarHBondContact O-CB 3.23Å; L6-T9 PolarHBondContact O-N 2.75Å; L6-T9 PolarHBondContact O-OG1 3.01Å; R7-T9 PolarHBondContact O-N 3.21Å
10	K	71.5	Confident	73.1	Confident	199 Å²	199	112.4 Å²	112.4	87%	0.865	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.3	-8.2	-180	-64	-176.7	-178.9	179.2	0	113	R7 E8	R7-K10 PolarHBondContact O-N 3.06Å; E8-K10 VanDerWaalsContact C-N 3.31Å
11	E	77.5	Confident	73.5	Confident	82 Å²	82	109.6 Å²	109.6	38%	0.383	59%	0.593	S	S	.	*			trans	-90.4	136.3	178.4	-67.3	-172.7	170.7	0	0	109.9	R7 V14	R7-E11 IonicContact CZ-OE1 3.29Å; R7-E11 VanDerWaalsContact CZ-OE1 3.29Å; R7-E11 IonicContact NE-OE1 2.77Å; R7-E11 PolarHBondContact NE-OE1 3.01Å; R7-E11 IonicContact NH2-OE1 2.97Å; R7-E11 PolarHBondContact NH2-OE1 2.95Å; E11-V14 HydrophobicContact CB-CG2 4.46Å
12	Q	75.4	Confident	74.8	Confident	200 Å²	200	111.4 Å²	111.4	94%	0.935	61%	0.605	S	S	*	*	S	Bend	trans	-76.2	-26.4	178.9	-73.4	-92.6	-30.1	0	0	112
13	E	78.5	Confident	75.8	Confident	170 Å²	170	105 Å²	105	79%	0.794	58%	0.577	S	S	*	*			trans	-131.2	133.1	178.8	-67.7	-177.1	174	0	0	108.9
14	V	79.3	Confident	77	Confident	47 Å²	47	100.4 Å²	100.4	29%	0.285	55%	0.547	S	S	.	.			trans	-126	120.3	178.2	179.5	0	0	0	0	108	M1 F2 E8 E11	M1-V14 HydrophobicContact SD-CG1 4.31Å; F2-V14 HydrophobicContact CE1-CG2 4.31Å; E8-V14 HydrophobicContact CB-CG1 4.5Å; E8-V14 HydrophobicContact CB-CG2 3.97Å; E8-V14 HydrophobicContact CG-CG1 4.06Å; E8-V14 HydrophobicContact CG-CG2 4.31Å; E11-V14 HydrophobicContact CB-CG2 4.46Å
15	T	78.1	Confident	77.8	Confident	137 Å²	137	104.8 Å²	104.8	84%	0.84	56%	0.558	S	S	*	*			trans	-84.4	115.9	178.4	-47.7	0	0	0	0	110.1
16	L	76.6	Confident	78.6	Confident	67 Å²	67	100.5 Å²	100.5	35%	0.351	52%	0.524	S	S	.	.			trans	-90.8	104.3	172.2	-62.2	174.6	0	0	0	109	M1 V19 L24	M1-L16 HydrophobicContact CE-CD2 4.08Å; M1-L16 HydrophobicContact SD-CD2 4.1Å; L16-V19 HydrophobicContact CB-CB 3.91Å; L16-V19 HydrophobicContact CB-CG2 4.04Å; L16-V19 HydrophobicContact CD1-CB 4.45Å; L16-V19 HydrophobicContact CD1-CG1 4.47Å; L16-V19 HydrophobicContact CD1-CG2 4.37Å; L16-L24 HydrophobicContact CD1-CD2 4.29Å
17	G	71.9	Confident	79.2	Confident	79 Å²	79	96.1 Å²	96.1	81%	0.814	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-33.1	-173	0	0	0	0	0	115.1
18	E	75.5	Confident	80	Confident	163 Å²	163	90.2 Å²	90.2	76%	0.762	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	11.3	-172.9	-61.8	-175.8	169	0	0	113.4	L52	E18-L52 HydrophobicContact CB-CD1 3.71Å; E18-L52 WeakPolarHBondContact OE2-CD1 3.45Å
19	V	79.4	Confident	80.6	Confident	22 Å²	22	91.8 Å²	91.8	13%	0.133	49%	0.494	C	S	.	.			trans	-118.4	118.7	-171.3	174.7	0	0	0	0	110.2	L16 L24 T49 L52	L16-V19 HydrophobicContact CB-CB 3.91Å; L16-V19 HydrophobicContact CB-CG2 4.04Å; L16-V19 HydrophobicContact CD1-CB 4.45Å; L16-V19 HydrophobicContact CD1-CG1 4.47Å; L16-V19 HydrophobicContact CD1-CG2 4.37Å; V19-L24 HydrophobicContact CG1-CB 3.75Å; V19-L24 HydrophobicContact CG1-CD1 4.05Å; V19-L24 HydrophobicContact CG1-CD2 3.99Å; V19-L24 HydrophobicContact CG1-CG 4.14Å; V19-T49 HydrophobicContact CG1-CG2 3.77Å; V19-L52 HydrophobicContact CG2-CD2 3.83Å
20	H	80.8	Confident	81.2	Confident	113 Å²	113	88.6 Å²	88.6	52%	0.523	47%	0.474	S	S	.	.			trans	-72.5	129.3	173.4	-80.8	-78.1	0	0	0	111	D22 A23 L24	H20-D22 PolarHBondContact O-N 2.91Å; H20-A23 HydrophobicContact CB-CB 4.05Å; H20-A23 PolarHBondContact O-N 3.26Å; H20-L24 PolarHBondContact O-N 3.26Å
21	G	82.9	Confident	81.9	Confident	54 Å²	54	80.8 Å²	80.8	56%	0.557	44%	0.444	S	S	*	.	H	α-helix	trans	-57.7	-42.8	-177.1	0	0	0	0	0	113.9	L24 H25	G21-L24 PolarHBondContact O-N 3.39Å; G21-H25 WeakPolarHBondContact O-CB 3.42Å; G21-H25 PolarHBondContact O-N 3.18Å
22	D	85.2	Confident	82.1	Confident	138 Å²	138	86.3 Å²	86.3	74%	0.738	46%	0.463	S	S	*	.	H	α-helix	trans	-66.5	-41.3	179	-62.4	-32	0	0	0	112	H20 H25 L26	H20-D22 PolarHBondContact O-N 2.91Å; D22-H25 PolarHBondContact O-N 3.29Å; D22-L26 WeakPolarHBondContact O-CG 3.17Å; D22-L26 PolarHBondContact O-N 3.38Å; D22-L26 VanDerWaalsContact O-N 3.08Å
23	A	85.8	Confident	82.5	Confident	3 Å²	3	80.3 Å²	80.3	3%	0.025	44%	0.44	C	S	.	.	H	α-helix	trans	-65.1	-43	176	0	0	0	0	0	111.1	H20 H25 L26 L27 L46 T49	H20-A23 HydrophobicContact CB-CB 4.05Å; H20-A23 PolarHBondContact O-N 3.26Å; A23-H25 VanDerWaalsContact C-N 3.33Å; A23-H25 PolarHBondContact O-N 3.5Å; A23-L26 PolarHBondContact O-N 3.17Å; A23-L27 VanDerWaalsContact O-CG 3.22Å; A23-L27 WeakPolarHBondContact O-CG 3.37Å; A23-L27 PolarHBondContact O-N 3.26Å; A23-L46 HydrophobicContact CB-CD1 4.42Å; A23-T49 HydrophobicContact CB-CG2 4.28Å; A23-T49 WeakPolarHBondContact CB-OG1 3.43Å
24	L	87.9	Confident	82.7	Confident	51 Å²	51	72.3 Å²	72.3	27%	0.267	40%	0.403	S	S	.	.	H	α-helix	trans	-62.1	-42	175.8	-174	66	0	0	0	111.5	L16 V19 H20 G21 L26 L27 V28 L53	L16-L24 HydrophobicContact CD1-CD2 4.29Å; V19-L24 HydrophobicContact CG1-CB 3.75Å; V19-L24 HydrophobicContact CG1-CD1 4.05Å; V19-L24 HydrophobicContact CG1-CD2 3.99Å; V19-L24 HydrophobicContact CG1-CG 4.14Å; H20-L24 PolarHBondContact O-N 3.26Å; G21-L24 PolarHBondContact O-N 3.39Å; L24-L26 PolarHBondContact O-N 3.34Å; L24-L27 PolarHBondContact O-N 3.28Å; L24-V28 HydrophobicContact CD1-CG2 4.48Å; L24-V28 HydrophobicContact CG-CG2 4.43Å; L24-V28 VanDerWaalsContact O-CG2 3.29Å; L24-V28 WeakPolarHBondContact O-CG2 3.41Å; L24-V28 PolarHBondContact O-N 3.22Å; L24-L53 HydrophobicContact CD1-CD1 3.7Å
25	H	87.4	Confident	82.7	Confident	128 Å²	128	74 Å²	74	59%	0.593	41%	0.407	S	S	*	.	H	α-helix	trans	-59.6	-46.4	177	-173.8	75.8	0	0	0	111.7	G21 D22 A23 L27 V28 Q29	G21-H25 WeakPolarHBondContact O-CB 3.42Å; G21-H25 PolarHBondContact O-N 3.18Å; D22-H25 PolarHBondContact O-N 3.29Å; A23-H25 VanDerWaalsContact C-N 3.33Å; A23-H25 PolarHBondContact O-N 3.5Å; H25-L27 VanDerWaalsContact C-N 3.34Å; H25-L27 PolarHBondContact O-N 3.23Å; H25-V28 PolarHBondContact O-N 3.09Å; H25-Q29 WeakPolarHBondContact O-CB 3.45Å; H25-Q29 PolarHBondContact O-N 3.44Å
26	L	85.8	Confident	83	Confident	43 Å²	43	67.6 Å²	67.6	23%	0.225	37%	0.368	C	S	.	.	H	α-helix	trans	-61.7	-40.5	175.9	-73.2	168	0	0	0	112.4	D22 A23 L24 Q29 Y30 L46	D22-L26 WeakPolarHBondContact O-CG 3.17Å; D22-L26 PolarHBondContact O-N 3.38Å; D22-L26 VanDerWaalsContact O-N 3.08Å; A23-L26 PolarHBondContact O-N 3.17Å; L24-L26 PolarHBondContact O-N 3.34Å; L26-Q29 PolarHBondContact O-N 3.18Å; L26-Y30 WeakPolarHBondContact O-CB 3.2Å; L26-Y30 PolarHBondContact O-N 3.38Å; L26-L46 HydrophobicContact CB-CD1 4.31Å
27	L	87.9	Confident	83.2	Confident	2 Å²	2	68.2 Å²	68.2	1%	0.01	37%	0.369	C	S	.	.	H	α-helix	trans	-68.9	-40.5	178.9	-69	169.1	0	0	0	112	A23 L24 H25 Y30 C31 I36 L46 T49 A50 L53 L55 V58	A23-L27 VanDerWaalsContact O-CG 3.22Å; A23-L27 WeakPolarHBondContact O-CG 3.37Å; A23-L27 PolarHBondContact O-N 3.26Å; L24-L27 PolarHBondContact O-N 3.28Å; H25-L27 VanDerWaalsContact C-N 3.34Å; H25-L27 PolarHBondContact O-N 3.23Å; L27-Y30 WeakPolarHBondContact O-CB 3.17Å; L27-Y30 PolarHBondContact O-N 3.23Å; L27-C31 PolarHBondContact O-N 3.03Å; L27-C31 PolarHBondContact O-SG 2.8Å; L27-I36 HydrophobicContact CD2-CD1 4.18Å; L27-L46 HydrophobicContact CD1-CD1 4.25Å; L27-L46 HydrophobicContact CD2-CD1 3.76Å; L27-L46 HydrophobicContact CG-CD1 3.75Å; L27-T49 HydrophobicContact CD1-CG2 3.55Å; L27-A50 HydrophobicContact CD1-CB 4.39Å; L27-A50 HydrophobicContact CD2-CB 4.13Å; L27-L53 HydrophobicContact CD1-CD1 4.08Å; L27-L55 HydrophobicContact CB-CD1 4.13Å; L27-L55 HydrophobicContact CD1-CD1 4.31Å; L27-L55 HydrophobicContact CD2-CD1 3.81Å; L27-L55 HydrophobicContact CG-CD1 4.3Å; L27-V58 HydrophobicContact CD2-CB 4.22Å; L27-V58 HydrophobicContact CD2-CG1 3.77Å; L27-V58 HydrophobicContact CD2-CG2 4.07Å
28	V	87.5	Confident	83.7	Confident	69 Å²	69	65.2 Å²	65.2	42%	0.418	33%	0.334	S	S	.	.	H	α-helix	trans	-63.8	-46.1	173.7	172.3	0	0	0	0	110.1	L24 H25 Y30 C31 Y32	L24-V28 HydrophobicContact CD1-CG2 4.48Å; L24-V28 HydrophobicContact CG-CG2 4.43Å; L24-V28 VanDerWaalsContact O-CG2 3.29Å; L24-V28 WeakPolarHBondContact O-CG2 3.41Å; L24-V28 PolarHBondContact O-N 3.22Å; H25-V28 PolarHBondContact O-N 3.09Å; V28-Y30 VanDerWaalsContact C-N 3.26Å; V28-Y30 PolarHBondContact O-N 3.5Å; V28-C31 WeakPolarHBondContact O-CB 3.42Å; V28-C31 PolarHBondContact O-N 3.4Å; V28-C31 VanDerWaalsContact O-N 3.13Å; V28-Y32 HydrophobicContact CG1-CD2 4.08Å; V28-Y32 HydrophobicContact CG1-CE2 3.91Å; V28-Y32 VanDerWaalsContact O-CD2 3.26Å; V28-Y32 WeakPolarHBondContact O-CD2 3.34Å; V28-Y32 PolarHBondContact O-N 3.4Å
29	Q	85.8	Confident	84	Confident	92 Å²	92	63.5 Å²	63.5	43%	0.43	32%	0.32	S	S	.	.	H	α-helix	trans	-58.7	-41.2	175.7	-174.2	178.6	-1.9	0	0	111.3	H25 L26 Y32 T33	H25-Q29 WeakPolarHBondContact O-CB 3.45Å; H25-Q29 PolarHBondContact O-N 3.44Å; L26-Q29 PolarHBondContact O-N 3.18Å; Q29-Y32 PolarHBondContact O-N 3.05Å; Q29-T33 HydrophobicContact CG-CG2 4.1Å; Q29-T33 WeakPolarHBondContact O-CB 3.08Å; Q29-T33 WeakPolarHBondContact O-CG2 3.43Å; Q29-T33 PolarHBondContact O-N 3.4Å; Q29-T33 PolarHBondContact O-OG1 3.42Å
30	Y	84.9	Confident	83.9	Confident	1 Å²	1	68.1 Å²	68.1	0%	0.004	34%	0.34	C	S	.	.	H	α-helix	trans	-59.8	-45.6	174.2	164.7	-111	0	0	0	112.2	L26 L27 V28 Y32 T33 G34 I36 V58 L530 D531 I533	L26-Y30 WeakPolarHBondContact O-CB 3.2Å; L26-Y30 PolarHBondContact O-N 3.38Å; L27-Y30 WeakPolarHBondContact O-CB 3.17Å; L27-Y30 PolarHBondContact O-N 3.23Å; V28-Y30 VanDerWaalsContact C-N 3.26Å; V28-Y30 PolarHBondContact O-N 3.5Å; Y30-Y32 PolarHBondContact O-N 3.36Å; Y30-Y32 VanDerWaalsContact O-N 3.15Å; Y30-T33 PolarHBondContact O-N 3.35Å; Y30-G34 WeakPolarHBondContact O-CA 3.42Å; Y30-G34 PolarHBondContact O-N 3.32Å; Y30-I36 HydrophobicContact CD2-CB 4.22Å; Y30-I36 HydrophobicContact CG-CB 4.41Å; Y30-I36 HydrophobicContact CG-CD1 4.43Å; Y30-V58 HydrophobicContact CD1-CG2 3.49Å; Y30-V58 VanDerWaalsContact CD1-CG2 3.49Å; Y30-V58 HydrophobicContact CE1-CG2 3.36Å; Y30-V58 HydrophobicContact CG-CG2 4.22Å; Y30-L530 HydrophobicContact CE2-CB 3.7Å; Y30-L530 HydrophobicContact CE2-CD1 4.25Å; Y30-D531 PolarHBondContact OH-O 2.82Å; Y30-I533 HydrophobicContact CE1-CD1 3.76Å; Y30-I533 HydrophobicContact CE1-CG1 4.22Å
31	C	85	Confident	83.9	Confident	35 Å²	35	68.8 Å²	68.8	24%	0.236	35%	0.348	C	S	.	.	H	α-helix	trans	-56.2	-32.6	177.9	-72	0	0	0	0	113.2	L27 V28	L27-C31 PolarHBondContact O-N 3.03Å; L27-C31 PolarHBondContact O-SG 2.8Å; V28-C31 WeakPolarHBondContact O-CB 3.42Å; V28-C31 PolarHBondContact O-N 3.4Å; V28-C31 VanDerWaalsContact O-N 3.13Å
32	Y	82.9	Confident	83.9	Confident	198 Å²	198	68 Å²	68	78%	0.776	33%	0.332	S	S	*	.	H	α-helix	trans	-90.2	-31.7	178.3	-73.4	-75.2	0	0	0	114.3	V28 Q29 Y30	V28-Y32 HydrophobicContact CG1-CD2 4.08Å; V28-Y32 HydrophobicContact CG1-CE2 3.91Å; V28-Y32 VanDerWaalsContact O-CD2 3.26Å; V28-Y32 WeakPolarHBondContact O-CD2 3.34Å; V28-Y32 PolarHBondContact O-N 3.4Å; Q29-Y32 PolarHBondContact O-N 3.05Å; Y30-Y32 PolarHBondContact O-N 3.36Å; Y30-Y32 VanDerWaalsContact O-N 3.15Å
33	T	84	Confident	83.9	Confident	75 Å²	75	61.4 Å²	61.4	46%	0.46	30%	0.297	S	S	.	.	H	α-helix	trans	-105.1	-19.6	-170.2	62.2	0	0	0	0	114.4	Q29 Y30 F35	Q29-T33 HydrophobicContact CG-CG2 4.1Å; Q29-T33 WeakPolarHBondContact O-CB 3.08Å; Q29-T33 WeakPolarHBondContact O-CG2 3.43Å; Q29-T33 PolarHBondContact O-N 3.4Å; Q29-T33 PolarHBondContact O-OG1 3.42Å; Y30-T33 PolarHBondContact O-N 3.35Å; T33-F35 PolarHBondContact O-N 3.2Å; T33-F35 PolarHBondContact OG1-N 3.38Å; T33-F35 PolarHBondContact OG1-O 3.45Å
34	G	81.4	Confident	83.9	Confident	2 Å²	2	65.6 Å²	65.6	2%	0.021	32%	0.316	C	S	.	.	S	Bend	trans	66.9	21.1	-169.2	0	0	0	0	0	112.9	Y30 L530	Y30-G34 WeakPolarHBondContact O-CA 3.42Å; Y30-G34 PolarHBondContact O-N 3.32Å; G34-L530 CarbonylContact C-O 3.23Å; G34-L530 WeakPolarHBondContact CA-O 3.45Å; G34-L530 CarbonylContact O-C 3.6Å; G34-L530 PolarHBondContact O-N 3.23Å
35	F	78.9	Confident	83.9	Confident	83 Å²	83	65.5 Å²	65.5	36%	0.364	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	135.5	-174.6	-171.1	-101.3	0	0	0	110.9	T33 P527 R529	T33-F35 PolarHBondContact O-N 3.2Å; T33-F35 PolarHBondContact OG1-N 3.38Å; T33-F35 PolarHBondContact OG1-O 3.45Å; F35-P527 HydrophobicContact CD1-CB 4.08Å; F35-P527 HydrophobicContact CD2-CB 4.38Å; F35-P527 HydrophobicContact CE1-CB 3.23Å; F35-P527 HydrophobicContact CE1-CG 3.51Å; F35-P527 HydrophobicContact CE2-CB 3.58Å; F35-P527 HydrophobicContact CE2-CG 3.6Å; F35-P527 HydrophobicContact CZ-CB 3.05Å; F35-P527 HydrophobicContact CZ-CG 2.91Å; F35-R529 HydrophobicContact CD2-CB 4.29Å
36	I	84.7	Confident	83.9	Confident	2 Å²	2	59.5 Å²	59.5	1%	0.01	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	129.1	178.3	-161	162.5	0	0	0	110.4	L27 Y30 L46 V58 V528 L530	L27-I36 HydrophobicContact CD2-CD1 4.18Å; Y30-I36 HydrophobicContact CD2-CB 4.22Å; Y30-I36 HydrophobicContact CG-CB 4.41Å; Y30-I36 HydrophobicContact CG-CD1 4.43Å; I36-L46 HydrophobicContact CD1-CD1 4.17Å; I36-L46 HydrophobicContact CD1-CD2 3.88Å; I36-L46 HydrophobicContact CD1-CG 4.49Å; I36-L46 HydrophobicContact CG1-CD2 4.29Å; I36-V58 HydrophobicContact CD1-CG1 3.64Å; I36-V58 HydrophobicContact CD1-CG2 4.07Å; I36-V528 PolarHBondContact N-O 3.12Å; I36-V528 VanDerWaalsContact N-O 3.16Å; I36-V528 PolarHBondContact O-N 3.03Å; I36-V528 VanDerWaalsContact O-N 3.07Å; I36-L530 HydrophobicContact CG2-CD1 3.9Å
37	E	81.4	Confident	84	Confident	80 Å²	80	57.4 Å²	57.4	37%	0.374	28%	0.279	S	S	.	.			trans	-93	122.2	173.5	-169.2	-175.9	153.7	0	0	108.4	R39 P527	E37-R39 IonicContact OE1-CZ 3.51Å; E37-R39 VanDerWaalsContact OE1-CZ 3.28Å; E37-R39 IonicContact OE1-NE 3.83Å; E37-R39 PolarHBondContact OE1-NE 3.38Å; E37-R39 IonicContact OE1-NH2 2.81Å; E37-R39 PolarHBondContact OE1-NH2 3.04Å; E37-R39 IonicContact OE2-NH2 3.33Å; E37-P527 HydrophobicContact CB-CB 4.27Å; E37-P527 HydrophobicContact CG-CB 4.36Å
38	M	82	Confident	83.9	Confident	16 Å²	16	58.4 Å²	58.4	8%	0.079	29%	0.288	C	S	.	.			trans	-104.8	130.1	176.8	-67.5	-179.4	-78.5	0	0	109.2	L46 A61 F65 V528	M38-L46 HydrophobicContact CG-CD2 4.36Å; M38-A61 HydrophobicContact CE-CB 4.07Å; M38-A61 HydrophobicContact SD-CB 4.12Å; M38-F65 HydrophobicContact CB-CD2 4.26Å; M38-F65 HydrophobicContact CB-CE2 4.37Å; M38-F65 HydrophobicContact CB-CG 4.44Å; M38-F65 HydrophobicContact SD-CB 4.04Å; M38-F65 HydrophobicContact SD-CG 4.44Å; M38-V528 HydrophobicContact CE-CB 3.87Å; M38-V528 HydrophobicContact CE-CG1 4.4Å; M38-V528 HydrophobicContact CE-CG2 3.39Å
39	R	82	Confident	84	Confident	126 Å²	126	55.2 Å²	55.2	48%	0.475	27%	0.268	S	S	.	.			trans	-124.8	154	177.4	-55.3	-177.5	175.3	174.2	4.2	110.4	E37 D41 T42 V43	E37-R39 IonicContact OE1-CZ 3.51Å; E37-R39 VanDerWaalsContact OE1-CZ 3.28Å; E37-R39 IonicContact OE1-NE 3.83Å; E37-R39 PolarHBondContact OE1-NE 3.38Å; E37-R39 IonicContact OE1-NH2 2.81Å; E37-R39 PolarHBondContact OE1-NH2 3.04Å; E37-R39 IonicContact OE2-NH2 3.33Å; R39-D41 VanDerWaalsContact C-N 3.27Å; R39-D41 WeakPolarHBondContact CB-OD1 3.17Å; R39-D41 PolarHBondContact O-N 3.11Å; R39-T42 PolarHBondContact O-N 3.06Å; R39-V43 VanDerWaalsContact O-CB 3.26Å; R39-V43 WeakPolarHBondContact O-CB 3.38Å; R39-V43 PolarHBondContact O-N 3.5Å
40	E	78.1	Confident	84.1	Confident	119 Å²	119	50.8 Å²	50.8	56%	0.556	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-34.7	-177.9	-79.2	166.8	-157.3	0	0	112.9	F65 Q69 W525	E40-F65 HydrophobicContact CG-CE1 4.3Å; E40-F65 HydrophobicContact CG-CZ 4.17Å; E40-Q69 PolarHBondContact OE1-NE2 3.44Å; E40-W525 PolarHBondContact OE1-NE1 3.35Å
41	D	80.3	Confident	84.1	Confident	127 Å²	127	52.2 Å²	52.2	68%	0.679	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-21.9	-178.8	56.7	-26.5	0	0	0	114.1	R39	R39-D41 VanDerWaalsContact C-N 3.27Å; R39-D41 WeakPolarHBondContact CB-OD1 3.17Å; R39-D41 PolarHBondContact O-N 3.11Å
42	T	82.8	Confident	84.2	Confident	37 Å²	37	54.3 Å²	54.3	23%	0.227	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.6	-8.8	-174.6	64	0	0	0	0	114.5	R39 E44 T45 L46	R39-T42 PolarHBondContact O-N 3.06Å; T42-E44 VanDerWaalsContact C-N 3.32Å; T42-E44 PolarHBondContact O-N 3.4Å; T42-T45 PolarHBondContact O-N 3.23Å; T42-T45 PolarHBondContact O-OG1 3.37Å; T42-L46 WeakPolarHBondContact O-CB 3.44Å; T42-L46 PolarHBondContact O-N 3.32Å
43	V	84.8	Confident	84.4	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.006	25%	0.246	C	C	.	.	H	α-helix	trans	-66	-32.1	-173.9	64.3	0	0	0	0	113.2	R39 L47 C62 F65 L66	R39-V43 VanDerWaalsContact O-CB 3.26Å; R39-V43 WeakPolarHBondContact O-CB 3.38Å; R39-V43 PolarHBondContact O-N 3.5Å; V43-L47 VanDerWaalsContact O-CB 3.29Å; V43-L47 WeakPolarHBondContact O-CB 3.35Å; V43-L47 PolarHBondContact O-N 3.21Å; V43-C62 HydrophobicContact CG2-CB 3.96Å; V43-F65 HydrophobicContact CB-CD1 4.13Å; V43-F65 HydrophobicContact CB-CE1 4.21Å; V43-F65 HydrophobicContact CG1-CD1 4.1Å; V43-F65 HydrophobicContact CG1-CE1 4.03Å; V43-F65 HydrophobicContact CG2-CD1 3.81Å; V43-F65 HydrophobicContact CG2-CE1 4.39Å; V43-L66 HydrophobicContact CG1-CD2 3.63Å; V43-L66 HydrophobicContact CG1-CG 4.24Å; V43-L66 HydrophobicContact CG2-CD1 4.49Å; V43-L66 HydrophobicContact CG2-CD2 4.46Å; V43-L66 HydrophobicContact CG2-CG 4.15Å
44	E	86	Confident	84.6	Confident	90 Å²	90	52.2 Å²	52.2	42%	0.421	26%	0.26	S	S	.	.	H	α-helix	trans	-68.2	-49.4	178.4	-65.7	-179.5	179.8	0	0	111.1	T42 L46 L47 A48 F81	T42-E44 VanDerWaalsContact C-N 3.32Å; T42-E44 PolarHBondContact O-N 3.4Å; E44-L46 VanDerWaalsContact C-N 3.3Å; E44-L46 PolarHBondContact O-N 2.9Å; E44-L47 PolarHBondContact O-N 3.11Å; E44-A48 PolarHBondContact O-N 3.33Å; E44-F81 HydrophobicContact CB-CE1 4.19Å; E44-F81 HydrophobicContact CB-CE2 4.31Å; E44-F81 HydrophobicContact CB-CZ 3.86Å; E44-F81 HydrophobicContact CG-CE1 4.22Å; E44-F81 HydrophobicContact CG-CZ 4.37Å; E44-F81 WeakPolarHBondContact O-CZ 3.42Å
45	T	87.7	Confident	84.9	Confident	50 Å²	50	53.4 Å²	53.4	31%	0.307	27%	0.265	S	S	.	.	H	α-helix	trans	-65.7	-36	177.4	56	0	0	0	0	111.8	T42 T49	T42-T45 PolarHBondContact O-N 3.23Å; T42-T45 PolarHBondContact O-OG1 3.37Å; T45-T49 WeakPolarHBondContact O-CB 3.47Å; T45-T49 PolarHBondContact O-N 3.36Å; T45-T49 PolarHBondContact O-OG1 2.91Å
46	L	88.3	Confident	85.2	Confident	1 Å²	1	55 Å²	55	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-64	-45	173.3	-176.7	64.6	0	0	0	111.9	A23 L26 L27 I36 M38 T42 E44 T49 A50 V58	A23-L46 HydrophobicContact CB-CD1 4.42Å; L26-L46 HydrophobicContact CB-CD1 4.31Å; L27-L46 HydrophobicContact CD1-CD1 4.25Å; L27-L46 HydrophobicContact CD2-CD1 3.76Å; L27-L46 HydrophobicContact CG-CD1 3.75Å; I36-L46 HydrophobicContact CD1-CD1 4.17Å; I36-L46 HydrophobicContact CD1-CD2 3.88Å; I36-L46 HydrophobicContact CD1-CG 4.49Å; I36-L46 HydrophobicContact CG1-CD2 4.29Å; M38-L46 HydrophobicContact CG-CD2 4.36Å; T42-L46 WeakPolarHBondContact O-CB 3.44Å; T42-L46 PolarHBondContact O-N 3.32Å; E44-L46 VanDerWaalsContact C-N 3.3Å; E44-L46 PolarHBondContact O-N 2.9Å; L46-T49 PolarHBondContact O-N 3.45Å; L46-A50 VanDerWaalsContact O-CB 3.23Å; L46-A50 WeakPolarHBondContact O-CB 3.43Å; L46-A50 PolarHBondContact O-N 3.12Å; L46-V58 HydrophobicContact CG-CG1 4.44Å
47	L	87.6	Confident	85.2	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-62.8	-49.1	178.1	179.7	64.3	0	0	0	110.8	V43 E44 T49 A50 C51 V59 C62 L66 F81 L90	V43-L47 VanDerWaalsContact O-CB 3.29Å; V43-L47 WeakPolarHBondContact O-CB 3.35Å; V43-L47 PolarHBondContact O-N 3.21Å; E44-L47 PolarHBondContact O-N 3.11Å; L47-T49 VanDerWaalsContact C-N 3.3Å; L47-T49 PolarHBondContact O-N 3.4Å; L47-A50 PolarHBondContact O-N 2.92Å; L47-C51 WeakPolarHBondContact O-CB 3.46Å; L47-C51 PolarHBondContact O-N 3.18Å; L47-C51 PolarHBondContact O-SG 3.45Å; L47-V59 HydrophobicContact CD1-CB 4.21Å; L47-V59 HydrophobicContact CD1-CG1 3.93Å; L47-V59 HydrophobicContact CD1-CG2 4.33Å; L47-C62 HydrophobicContact CB-CB 4.07Å; L47-C62 HydrophobicContact CD1-CB 3.78Å; L47-C62 HydrophobicContact CG-CB 4.41Å; L47-L66 HydrophobicContact CD2-CD1 3.9Å; L47-F81 HydrophobicContact CB-CE1 4.41Å; L47-F81 HydrophobicContact CB-CZ 4.47Å; L47-F81 HydrophobicContact CD2-CD1 4.45Å; L47-F81 HydrophobicContact CD2-CE1 3.62Å; L47-F81 HydrophobicContact CD2-CZ 4.32Å; L47-F81 HydrophobicContact CG-CE1 4.4Å; L47-L90 HydrophobicContact CD2-CD2 4.25Å
48	A	86.6	Confident	85.5	Confident	23 Å²	23	53.3 Å²	53.3	19%	0.19	28%	0.277	C	S	.	.	H	α-helix	trans	-56.9	-45.5	179.1	0	0	0	0	0	111.5	E44 C51 L52 Q85	E44-A48 PolarHBondContact O-N 3.33Å; A48-C51 PolarHBondContact O-N 3.1Å; A48-L52 PolarHBondContact O-N 2.82Å; A48-L52 VanDerWaalsContact O-N 3.11Å; A48-Q85 HydrophobicContact CB-CG 4.5Å
49	T	87.9	Confident	85.7	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.006	28%	0.28	C	S	.	.	H	α-helix	trans	-67.3	-40.3	178.1	-51.1	0	0	0	0	112.2	V19 A23 L27 T45 L46 L47 C51 L52 L53	V19-T49 HydrophobicContact CG1-CG2 3.77Å; A23-T49 HydrophobicContact CB-CG2 4.28Å; A23-T49 WeakPolarHBondContact CB-OG1 3.43Å; L27-T49 HydrophobicContact CD1-CG2 3.55Å; T45-T49 WeakPolarHBondContact O-CB 3.47Å; T45-T49 PolarHBondContact O-N 3.36Å; T45-T49 PolarHBondContact O-OG1 2.91Å; L46-T49 PolarHBondContact O-N 3.45Å; L47-T49 VanDerWaalsContact C-N 3.3Å; L47-T49 PolarHBondContact O-N 3.4Å; T49-C51 VanDerWaalsContact C-N 3.34Å; T49-C51 PolarHBondContact O-N 3.42Å; T49-L52 PolarHBondContact O-N 3.38Å; T49-L53 HydrophobicContact CG2-CD1 4.2Å; T49-L53 WeakPolarHBondContact O-CG 3.49Å; T49-L53 PolarHBondContact O-N 3.31Å
50	A	88.1	Confident	85.9	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-66.2	-36	177.9	0	0	0	0	0	112.3	L27 L46 L47 Q54 L55 V58 V59	L27-A50 HydrophobicContact CD1-CB 4.39Å; L27-A50 HydrophobicContact CD2-CB 4.13Å; L46-A50 VanDerWaalsContact O-CB 3.23Å; L46-A50 WeakPolarHBondContact O-CB 3.43Å; L46-A50 PolarHBondContact O-N 3.12Å; L47-A50 PolarHBondContact O-N 2.92Å; A50-Q54 PolarHBondContact O-N 2.98Å; A50-L55 HydrophobicContact CB-CB 4.44Å; A50-L55 PolarHBondContact O-N 3.27Å; A50-V58 HydrophobicContact CB-CB 4.13Å; A50-V58 HydrophobicContact CB-CG1 3.9Å; A50-V59 HydrophobicContact CB-CG2 3.87Å
51	C	86.3	Confident	86.3	Confident	31 Å²	31	46.2 Å²	46.2	21%	0.209	26%	0.259	C	S	.	.	H	α-helix	trans	-63	-47.5	173	-72.2	0	0	0	0	111.2	L47 A48 T49 L53 Q54	L47-C51 WeakPolarHBondContact O-CB 3.46Å; L47-C51 PolarHBondContact O-N 3.18Å; L47-C51 PolarHBondContact O-SG 3.45Å; A48-C51 PolarHBondContact O-N 3.1Å; T49-C51 VanDerWaalsContact C-N 3.34Å; T49-C51 PolarHBondContact O-N 3.42Å; C51-L53 VanDerWaalsContact C-N 3.3Å; C51-L53 PolarHBondContact O-N 3.14Å; C51-Q54 PolarHBondContact O-N 2.93Å
52	L	87.4	Confident	86.6	Confident	79 Å²	79	40.2 Å²	40.2	41%	0.414	23%	0.226	S	C	.	.	H	α-helix	trans	-61.7	-38.1	179	-169.9	143.7	0	0	0	112.3	E18 V19 A48 T49 Q54	E18-L52 HydrophobicContact CB-CD1 3.71Å; E18-L52 WeakPolarHBondContact OE2-CD1 3.45Å; V19-L52 HydrophobicContact CG2-CD2 3.83Å; A48-L52 PolarHBondContact O-N 2.82Å; A48-L52 VanDerWaalsContact O-N 3.11Å; T49-L52 PolarHBondContact O-N 3.38Å; L52-Q54 VanDerWaalsContact C-N 3.32Å
53	L	86.9	Confident	86.8	Confident	71 Å²	71	38.7 Å²	38.7	37%	0.372	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	2.2	176.5	-61.3	180	0	0	0	114.2	L24 L27 T49 C51 L55	L24-L53 HydrophobicContact CD1-CD1 3.7Å; L27-L53 HydrophobicContact CD1-CD1 4.08Å; T49-L53 HydrophobicContact CG2-CD1 4.2Å; T49-L53 WeakPolarHBondContact O-CG 3.49Å; T49-L53 PolarHBondContact O-N 3.31Å; C51-L53 VanDerWaalsContact C-N 3.3Å; C51-L53 PolarHBondContact O-N 3.14Å; L53-L55 VanDerWaalsContact C-N 3.28Å; L53-L55 HydrophobicContact CB-CD1 4.14Å; L53-L55 HydrophobicContact CB-CG 4.1Å; L53-L55 HydrophobicContact CD1-CD1 4.46Å; L53-L55 PolarHBondContact O-N 3.17Å
54	Q	87.2	Confident	86.8	Confident	158 Å²	158	42.5 Å²	42.5	74%	0.738	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.4	34.9	179.2	-55.7	-178.5	-2.6	0	0	114.4	A50 C51 L52 N56	A50-Q54 PolarHBondContact O-N 2.98Å; C51-Q54 PolarHBondContact O-N 2.93Å; L52-Q54 VanDerWaalsContact C-N 3.32Å; Q54-N56 PolarHBondContact O-N 2.87Å; Q54-N56 VanDerWaalsContact O-N 3.1Å
55	L	87.2	Confident	86.8	Confident	27 Å²	27	38.6 Å²	38.6	14%	0.141	22%	0.219	C	C	.	.			trans	-86.3	73.8	178.7	-64.7	173.8	0	0	0	111.1	L27 A50 L53 A57 V58 V59 I533	L27-L55 HydrophobicContact CB-CD1 4.13Å; L27-L55 HydrophobicContact CD1-CD1 4.31Å; L27-L55 HydrophobicContact CD2-CD1 3.81Å; L27-L55 HydrophobicContact CG-CD1 4.3Å; A50-L55 HydrophobicContact CB-CB 4.44Å; A50-L55 PolarHBondContact O-N 3.27Å; L53-L55 VanDerWaalsContact C-N 3.28Å; L53-L55 HydrophobicContact CB-CD1 4.14Å; L53-L55 HydrophobicContact CB-CG 4.1Å; L53-L55 HydrophobicContact CD1-CD1 4.46Å; L53-L55 PolarHBondContact O-N 3.17Å; L55-A57 VanDerWaalsContact C-N 3.27Å; L55-A57 PolarHBondContact O-N 3.4Å; L55-A57 VanDerWaalsContact O-N 3.1Å; L55-V58 HydrophobicContact CB-CB 4.4Å; L55-V58 HydrophobicContact CB-CG2 4.42Å; L55-V58 PolarHBondContact O-N 2.8Å; L55-V59 WeakPolarHBondContact O-CG2 3.5Å; L55-V59 PolarHBondContact O-N 3.27Å; L55-I533 HydrophobicContact CD2-CD1 3.62Å
56	N	85.9	Confident	86.7	Confident	117 Å²	117	36.3 Å²	36.3	63%	0.626	21%	0.205	S	C	*	.	H	α-helix	trans	-54.3	-34.1	-171.1	-68.6	-28.8	0	0	0	115.3	Q54 V59 T60	Q54-N56 PolarHBondContact O-N 2.87Å; Q54-N56 VanDerWaalsContact O-N 3.1Å; N56-V59 PolarHBondContact O-N 3.4Å; N56-T60 WeakPolarHBondContact O-CB 3.04Å; N56-T60 PolarHBondContact O-N 3.22Å; N56-T60 PolarHBondContact O-OG1 2.74Å
57	A	85.6	Confident	86.5	Confident	45 Å²	45	37.5 Å²	37.5	37%	0.372	22%	0.215	S	C	.	.	H	α-helix	trans	-65.1	-41.9	177.8	0	0	0	0	0	111.9	L55 A61	L55-A57 VanDerWaalsContact C-N 3.27Å; L55-A57 PolarHBondContact O-N 3.4Å; L55-A57 VanDerWaalsContact O-N 3.1Å; A57-A61 PolarHBondContact O-N 2.88Å
58	V	86.8	Confident	86.5	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-72.1	-41.5	177.3	-179.6	0	0	0	0	110.6	L27 Y30 I36 L46 A50 L55 T60 A61 C62	L27-V58 HydrophobicContact CD2-CB 4.22Å; L27-V58 HydrophobicContact CD2-CG1 3.77Å; L27-V58 HydrophobicContact CD2-CG2 4.07Å; Y30-V58 HydrophobicContact CD1-CG2 3.49Å; Y30-V58 VanDerWaalsContact CD1-CG2 3.49Å; Y30-V58 HydrophobicContact CE1-CG2 3.36Å; Y30-V58 HydrophobicContact CG-CG2 4.22Å; I36-V58 HydrophobicContact CD1-CG1 3.64Å; I36-V58 HydrophobicContact CD1-CG2 4.07Å; L46-V58 HydrophobicContact CG-CG1 4.44Å; A50-V58 HydrophobicContact CB-CB 4.13Å; A50-V58 HydrophobicContact CB-CG1 3.9Å; L55-V58 HydrophobicContact CB-CB 4.4Å; L55-V58 HydrophobicContact CB-CG2 4.42Å; L55-V58 PolarHBondContact O-N 2.8Å; V58-T60 VanDerWaalsContact C-N 3.29Å; V58-T60 PolarHBondContact O-N 3.04Å; V58-A61 PolarHBondContact O-N 3.29Å; V58-C62 WeakPolarHBondContact O-CB 3.4Å; V58-C62 PolarHBondContact O-N 3.11Å; V58-C62 PolarHBondContact O-SG 2.99Å
59	V	86.4	Confident	86.5	Confident	21 Å²	21	47.6 Å²	47.6	13%	0.127	25%	0.25	C	S	.	.	H	α-helix	trans	-54.8	-47.8	173.8	171.4	0	0	0	0	110.5	L47 A50 L55 N56 A61 C62 C63	L47-V59 HydrophobicContact CD1-CB 4.21Å; L47-V59 HydrophobicContact CD1-CG1 3.93Å; L47-V59 HydrophobicContact CD1-CG2 4.33Å; A50-V59 HydrophobicContact CB-CG2 3.87Å; L55-V59 WeakPolarHBondContact O-CG2 3.5Å; L55-V59 PolarHBondContact O-N 3.27Å; N56-V59 PolarHBondContact O-N 3.4Å; V59-A61 PolarHBondContact O-N 3.15Å; V59-C62 PolarHBondContact O-N 2.96Å; V59-C63 WeakPolarHBondContact O-CB 3.32Å; V59-C63 PolarHBondContact O-N 3.23Å; V59-C63 PolarHBondContact O-SG 3.22Å
60	T	85.7	Confident	86.5	Confident	80 Å²	80	48.6 Å²	48.6	49%	0.491	26%	0.256	S	S	.	.	H	α-helix	trans	-63.6	-42.5	178.8	-56	0	0	0	0	111.8	N56 V58 C63 N64	N56-T60 WeakPolarHBondContact O-CB 3.04Å; N56-T60 PolarHBondContact O-N 3.22Å; N56-T60 PolarHBondContact O-OG1 2.74Å; V58-T60 VanDerWaalsContact C-N 3.29Å; V58-T60 PolarHBondContact O-N 3.04Å; T60-C63 PolarHBondContact O-N 3.24Å; T60-N64 WeakPolarHBondContact O-CB 3.3Å; T60-N64 VanDerWaalsContact O-CG 3.29Å; T60-N64 PolarHBondContact O-N 2.8Å; T60-N64 PolarHBondContact O-ND2 3.12Å
61	A	86.1	Confident	86.6	Confident	12 Å²	12	52.7 Å²	52.7	10%	0.099	27%	0.274	C	S	.	.	H	α-helix	trans	-64.3	-44.4	177.7	0	0	0	0	0	112.3	M38 A57 V58 V59 N64 F65 L530	M38-A61 HydrophobicContact CE-CB 4.07Å; M38-A61 HydrophobicContact SD-CB 4.12Å; A57-A61 PolarHBondContact O-N 2.88Å; V58-A61 PolarHBondContact O-N 3.29Å; V59-A61 PolarHBondContact O-N 3.15Å; A61-N64 PolarHBondContact O-N 3.34Å; A61-F65 WeakPolarHBondContact O-CB 3.33Å; A61-F65 PolarHBondContact O-N 3.41Å; A61-L530 HydrophobicContact CB-CD1 3.93Å
62	C	87	Confident	86.7	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65.2	-42.5	176.8	-65.7	0	0	0	0	111.4	V43 L47 V58 V59 N64 F65 L66	V43-C62 HydrophobicContact CG2-CB 3.96Å; L47-C62 HydrophobicContact CB-CB 4.07Å; L47-C62 HydrophobicContact CD1-CB 3.78Å; L47-C62 HydrophobicContact CG-CB 4.41Å; V58-C62 WeakPolarHBondContact O-CB 3.4Å; V58-C62 PolarHBondContact O-N 3.11Å; V58-C62 PolarHBondContact O-SG 2.99Å; V59-C62 PolarHBondContact O-N 2.96Å; C62-N64 VanDerWaalsContact C-N 3.34Å; C62-N64 PolarHBondContact O-N 2.86Å; C62-F65 WeakPolarHBondContact O-CB 3.43Å; C62-F65 PolarHBondContact O-N 3.02Å; C62-L66 WeakPolarHBondContact O-CG 3.37Å; C62-L66 PolarHBondContact O-N 3.37Å
63	C	86.4	Confident	86.7	Confident	6 Å²	6	50 Å²	50	4%	0.041	26%	0.262	C	S	.	.	H	α-helix	trans	-59.1	-44.1	174.1	-70.8	0	0	0	0	111.8	V59 T60 F65 L66 A67 L90	V59-C63 WeakPolarHBondContact O-CB 3.32Å; V59-C63 PolarHBondContact O-N 3.23Å; V59-C63 PolarHBondContact O-SG 3.22Å; T60-C63 PolarHBondContact O-N 3.24Å; C63-F65 VanDerWaalsContact C-N 3.31Å; C63-F65 PolarHBondContact O-N 3.39Å; C63-L66 PolarHBondContact O-N 3.48Å; C63-A67 VanDerWaalsContact O-CB 3.23Å; C63-A67 WeakPolarHBondContact O-CB 3.4Å; C63-A67 PolarHBondContact O-N 2.98Å; C63-L90 HydrophobicContact CB-CB 4.33Å
64	N	85.5	Confident	86.9	Confident	80 Å²	80	48.3 Å²	48.3	43%	0.428	25%	0.254	S	S	.	.	H	α-helix	trans	-66.2	-33.9	177.1	-75.5	-25.8	0	0	0	112.6	T60 A61 C62 R68	T60-N64 WeakPolarHBondContact O-CB 3.3Å; T60-N64 VanDerWaalsContact O-CG 3.29Å; T60-N64 PolarHBondContact O-N 2.8Å; T60-N64 PolarHBondContact O-ND2 3.12Å; A61-N64 PolarHBondContact O-N 3.34Å; C62-N64 VanDerWaalsContact C-N 3.34Å; C62-N64 PolarHBondContact O-N 2.86Å; N64-R68 WeakPolarHBondContact O-CG 3.45Å; N64-R68 PolarHBondContact O-N 2.93Å
65	F	85.9	Confident	87	Confident	9 Å²	9	40.8 Å²	40.8	4%	0.039	22%	0.219	C	C	.	.	H	α-helix	trans	-67.4	-50.7	175.3	-177.1	-93.6	0	0	0	111.1	M38 E40 V43 A61 C62 C63 A67 R68 W525	M38-F65 HydrophobicContact CB-CD2 4.26Å; M38-F65 HydrophobicContact CB-CE2 4.37Å; M38-F65 HydrophobicContact CB-CG 4.44Å; M38-F65 HydrophobicContact SD-CB 4.04Å; M38-F65 HydrophobicContact SD-CG 4.44Å; E40-F65 HydrophobicContact CG-CE1 4.3Å; E40-F65 HydrophobicContact CG-CZ 4.17Å; V43-F65 HydrophobicContact CB-CD1 4.13Å; V43-F65 HydrophobicContact CB-CE1 4.21Å; V43-F65 HydrophobicContact CG1-CD1 4.1Å; V43-F65 HydrophobicContact CG1-CE1 4.03Å; V43-F65 HydrophobicContact CG2-CD1 3.81Å; V43-F65 HydrophobicContact CG2-CE1 4.39Å; A61-F65 WeakPolarHBondContact O-CB 3.33Å; A61-F65 PolarHBondContact O-N 3.41Å; C62-F65 WeakPolarHBondContact O-CB 3.43Å; C62-F65 PolarHBondContact O-N 3.02Å; C63-F65 VanDerWaalsContact C-N 3.31Å; C63-F65 PolarHBondContact O-N 3.39Å; F65-A67 PolarHBondContact O-N 3.47Å; F65-R68 WeakPolarHBondContact O-CB 3.41Å; F65-R68 PolarHBondContact O-N 3.13Å; F65-R68 VanDerWaalsContact O-N 3.15Å; F65-W525 HydrophobicContact CD2-CE3 4.26Å; F65-W525 HydrophobicContact CD2-CH2 4.3Å; F65-W525 HydrophobicContact CD2-CZ3 4.04Å; F65-W525 AromaticContact CE2-CD2 3.75Å; F65-W525 HydrophobicContact CE2-CD2 3.75Å; F65-W525 AromaticContact CE2-CE2 3.89Å; F65-W525 AromaticContact CE2-CE3 3.7Å; F65-W525 HydrophobicContact CE2-CE3 3.7Å; F65-W525 HydrophobicContact CE2-CG 4.38Å; F65-W525 AromaticContact CE2-CH2 3.97Å; F65-W525 HydrophobicContact CE2-CH2 3.97Å; F65-W525 HydrophobicContact CE2-CZ2 4.02Å; F65-W525 AromaticContact CE2-CZ3 3.81Å; F65-W525 HydrophobicContact CE2-CZ3 3.81Å; F65-W525 HydrophobicContact CZ-CD2 4.45Å; F65-W525 HydrophobicContact CZ-CZ2 4.45Å
66	L	86.5	Confident	87.2	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-61.9	-40.3	177.2	-72.9	172.1	0	0	0	112.3	V43 L47 C62 C63 R68 Q69 L70 F78 F81 L90	V43-L66 HydrophobicContact CG1-CD2 3.63Å; V43-L66 HydrophobicContact CG1-CG 4.24Å; V43-L66 HydrophobicContact CG2-CD1 4.49Å; V43-L66 HydrophobicContact CG2-CD2 4.46Å; V43-L66 HydrophobicContact CG2-CG 4.15Å; L47-L66 HydrophobicContact CD2-CD1 3.9Å; C62-L66 WeakPolarHBondContact O-CG 3.37Å; C62-L66 PolarHBondContact O-N 3.37Å; C63-L66 PolarHBondContact O-N 3.48Å; L66-R68 PolarHBondContact O-N 3.19Å; L66-Q69 WeakPolarHBondContact O-CA 3.4Å; L66-Q69 PolarHBondContact O-N 3.32Å; L66-L70 PolarHBondContact O-N 3.38Å; L66-F78 HydrophobicContact CD2-CD1 4.47Å; L66-F78 HydrophobicContact CD2-CE1 3.81Å; L66-F78 HydrophobicContact CD2-CE2 4.37Å; L66-F78 HydrophobicContact CD2-CZ 3.75Å; L66-F81 HydrophobicContact CD1-CE1 4.38Å; L66-L90 HydrophobicContact CB-CD1 3.9Å; L66-L90 HydrophobicContact CB-CD2 4.13Å; L66-L90 HydrophobicContact CD1-CD2 3.62Å
67	A	84.4	Confident	87.3	Confident	27 Å²	27	36.2 Å²	36.2	22%	0.223	20%	0.2	C	C	.	.	H	α-helix	trans	-59.5	-29.6	176.7	0	0	0	0	0	113.2	C63 F65 Q69 L93	C63-A67 VanDerWaalsContact O-CB 3.23Å; C63-A67 WeakPolarHBondContact O-CB 3.4Å; C63-A67 PolarHBondContact O-N 2.98Å; F65-A67 PolarHBondContact O-N 3.47Å; A67-Q69 VanDerWaalsContact C-N 3.25Å; A67-Q69 PolarHBondContact O-N 3.22Å; A67-L93 HydrophobicContact CB-CD1 3.76Å
68	R	85.8	Confident	87.5	Confident	192 Å²	192	34.8 Å²	34.8	73%	0.725	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-12.1	175.9	-69.9	169.9	-179.8	-174.1	-0.4	113.3	N64 F65 L66	N64-R68 WeakPolarHBondContact O-CG 3.45Å; N64-R68 PolarHBondContact O-N 2.93Å; F65-R68 WeakPolarHBondContact O-CB 3.41Å; F65-R68 PolarHBondContact O-N 3.13Å; F65-R68 VanDerWaalsContact O-N 3.15Å; L66-R68 PolarHBondContact O-N 3.19Å
69	Q	86.6	Confident	87.7	Confident	42 Å²	42	35.4 Å²	35.4	20%	0.196	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.5	7.2	-178.5	-61.2	-173.5	-1.8	0	0	113	E40 L66 A67 H71 N74 F78	E40-Q69 PolarHBondContact OE1-NE2 3.44Å; L66-Q69 WeakPolarHBondContact O-CA 3.4Å; L66-Q69 PolarHBondContact O-N 3.32Å; A67-Q69 VanDerWaalsContact C-N 3.25Å; A67-Q69 PolarHBondContact O-N 3.22Å; Q69-H71 PolarHBondContact O-N 3.01Å; Q69-N74 PolarHBondContact O-ND2 2.86Å; Q69-F78 HydrophobicContact CB-CE2 4.34Å
70	L	88.1	Confident	87.8	Confident	23 Å²	23	38.8 Å²	38.8	12%	0.12	20%	0.204	C	C	.	.			trans	-59.1	124.8	174.6	-78.3	166	0	0	0	110.6	L66 C75 F78 L93 A94 Y97	L66-L70 PolarHBondContact O-N 3.38Å; L70-C75 HydrophobicContact CD2-CB 3.99Å; L70-F78 HydrophobicContact CD2-CB 4.36Å; L70-F78 HydrophobicContact CD2-CD2 3.81Å; L70-F78 HydrophobicContact CG-CD2 4.42Å; L70-L93 HydrophobicContact CD1-CB 4.38Å; L70-A94 HydrophobicContact CD2-CB 4Å; L70-Y97 HydrophobicContact CB-CD1 4.36Å; L70-Y97 HydrophobicContact CB-CD2 3.86Å; L70-Y97 HydrophobicContact CB-CE2 3.98Å; L70-Y97 HydrophobicContact CB-CG 4.05Å; L70-Y97 HydrophobicContact CD1-CD2 4.35Å; L70-Y97 HydrophobicContact CD1-CG 4.36Å; L70-Y97 PolarHBondContact O-OH 3.08Å
71	H	90.3	Very high	87.9	Confident	85 Å²	85	36.3 Å²	36.3	39%	0.394	19%	0.187	S	C	.	.			trans	-137.2	151.8	179.8	-172	-98	0	0	0	109	Q69 S73 N74 C75	Q69-H71 PolarHBondContact O-N 3.01Å; H71-S73 PolarHBondContact ND1-N 3.29Å; H71-S73 PolarHBondContact ND1-OG 2.93Å; H71-S73 PolarHBondContact O-N 2.93Å; H71-N74 WeakPolarHBondContact CA-OD1 3.49Å; H71-N74 PolarHBondContact N-OD1 3.46Å; H71-N74 PolarHBondContact O-N 3.29Å; H71-N74 VanDerWaalsContact O-N 3.07Å; H71-N74 PolarHBondContact O-OD1 2.84Å; H71-C75 WeakPolarHBondContact O-CB 3.42Å; H71-C75 PolarHBondContact O-N 3.15Å; H71-C75 VanDerWaalsContact O-N 3.07Å
72	P	88.3	Confident	88.1	Confident	6 Å²	6	35.8 Å²	35.8	4%	0.039	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-19.7	-179.2	-27	36.8	0	0	0	114.7	Y97 Q104 V105 N108	P72-Y97 WeakPolarHBondContact CD-OH 3.32Å; P72-Y97 HydrophobicContact CG-CE1 4.27Å; P72-Q104 HydrophobicContact CB-CB 3.82Å; P72-Q104 HydrophobicContact CG-CB 4.07Å; P72-Q104 VanDerWaalsContact CG-OE1 3.29Å; P72-V105 HydrophobicContact CB-CG2 4.14Å; P72-N108 PolarHBondContact O-ND2 3.15Å
73	S	88.9	Confident	88.1	Confident	48 Å²	48	40 Å²	40	34%	0.336	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-12.2	179.6	69.4	0	0	0	0	115.4	H71 E110	H71-S73 PolarHBondContact ND1-N 3.29Å; H71-S73 PolarHBondContact ND1-OG 2.93Å; H71-S73 PolarHBondContact O-N 2.93Å; S73-E110 WeakPolarHBondContact O-CG 3.49Å
74	N	89.6	Confident	88.1	Confident	36 Å²	36	45.2 Å²	45.2	19%	0.193	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.1	-8.3	-176.8	69.9	7.9	0	0	0	114	Q69 H71 L76 G77 F78 E110	Q69-N74 PolarHBondContact O-ND2 2.86Å; H71-N74 WeakPolarHBondContact CA-OD1 3.49Å; H71-N74 PolarHBondContact N-OD1 3.46Å; H71-N74 PolarHBondContact O-N 3.29Å; H71-N74 VanDerWaalsContact O-N 3.07Å; H71-N74 PolarHBondContact O-OD1 2.84Å; N74-L76 VanDerWaalsContact C-N 3.29Å; N74-L76 PolarHBondContact O-N 2.92Å; N74-G77 PolarHBondContact O-N 3.09Å; N74-F78 PolarHBondContact O-N 2.97Å; N74-E110 WeakPolarHBondContact CA-OE1 3.49Å; N74-E110 VanDerWaalsContact CA-OE2 3.24Å; N74-E110 WeakPolarHBondContact CA-OE2 3.49Å
75	C	90.8	Very high	88.1	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-66.7	-28.9	-171.6	62.4	0	0	0	0	113.5	L70 H71 A79 Y97 V105	L70-C75 HydrophobicContact CD2-CB 3.99Å; H71-C75 WeakPolarHBondContact O-CB 3.42Å; H71-C75 PolarHBondContact O-N 3.15Å; H71-C75 VanDerWaalsContact O-N 3.07Å; C75-A79 WeakPolarHBondContact O-CB 3.5Å; C75-A79 PolarHBondContact O-N 3.24Å; C75-Y97 HydrophobicContact CB-CD1 3.84Å; C75-Y97 HydrophobicContact CB-CE1 4.39Å; C75-V105 VanDerWaalsContact SG-CG2 3.51Å
76	L	90.4	Very high	88	Confident	20 Å²	20	48.3 Å²	48.3	11%	0.105	25%	0.249	C	C	.	.	H	α-helix	trans	-73.8	-42.5	175.8	-65.7	172.1	0	0	0	110.1	N74 A79 F80 T98 V105 E110 F111 L114 L122	N74-L76 VanDerWaalsContact C-N 3.29Å; N74-L76 PolarHBondContact O-N 2.92Å; L76-A79 PolarHBondContact O-N 2.85Å; L76-F80 WeakPolarHBondContact O-CB 3.49Å; L76-F80 PolarHBondContact O-N 3.42Å; L76-T98 HydrophobicContact CD2-CG2 3.58Å; L76-T98 HydrophobicContact CG-CG2 4.49Å; L76-V105 HydrophobicContact CD1-CG1 3.58Å; L76-V105 HydrophobicContact CD2-CG1 4.29Å; L76-V105 HydrophobicContact CG-CG1 3.82Å; L76-E110 HydrophobicContact CB-CB 4.13Å; L76-E110 WeakPolarHBondContact CB-OE2 3.47Å; L76-E110 HydrophobicContact CD1-CB 4.04Å; L76-E110 PolarHBondContact N-OE2 3.09Å; L76-F111 HydrophobicContact CD1-CB 4.02Å; L76-F111 HydrophobicContact CD1-CD2 4.42Å; L76-L114 HydrophobicContact CD1-CD1 3.98Å; L76-L114 HydrophobicContact CD1-CD2 4.36Å; L76-L114 HydrophobicContact CD1-CG 4.28Å; L76-L114 HydrophobicContact CD2-CD1 4.32Å; L76-L122 HydrophobicContact CD2-CD2 4.43Å
77	G	88.6	Confident	88	Confident	27 Å²	27	48.8 Å²	48.8	28%	0.278	25%	0.252	S	S	.	.	H	α-helix	trans	-57.3	-48.1	172	0	0	0	0	0	112.2	N74 A79 F80 F81 E110	N74-G77 PolarHBondContact O-N 3.09Å; G77-A79 PolarHBondContact O-N 3.07Å; G77-F80 PolarHBondContact O-N 2.94Å; G77-F81 WeakPolarHBondContact O-CB 3.39Å; G77-F81 PolarHBondContact O-N 2.91Å; G77-E110 PolarHBondContact N-OE2 2.94Å
78	F	89.9	Confident	88.1	Confident	15 Å²	15	52.5 Å²	52.5	7%	0.066	27%	0.272	C	S	.	.	H	α-helix	trans	-65.1	-35.2	176.2	-72.8	-18.1	0	0	0	113.5	L66 Q69 L70 N74 A82 A94	L66-F78 HydrophobicContact CD2-CD1 4.47Å; L66-F78 HydrophobicContact CD2-CE1 3.81Å; L66-F78 HydrophobicContact CD2-CE2 4.37Å; L66-F78 HydrophobicContact CD2-CZ 3.75Å; Q69-F78 HydrophobicContact CB-CE2 4.34Å; L70-F78 HydrophobicContact CD2-CB 4.36Å; L70-F78 HydrophobicContact CD2-CD2 3.81Å; L70-F78 HydrophobicContact CG-CD2 4.42Å; N74-F78 PolarHBondContact O-N 2.97Å; F78-A82 WeakPolarHBondContact O-CB 3.48Å; F78-A82 PolarHBondContact O-N 3.02Å; F78-A94 HydrophobicContact CB-CB 4.45Å
79	A	89.6	Confident	88.1	Confident	13 Å²	13	46.6 Å²	46.6	11%	0.107	26%	0.258	C	S	.	.	H	α-helix	trans	-64.4	-47.4	173.7	0	0	0	0	0	110.9	C75 L76 G77 A82 E83 L91 A94	C75-A79 WeakPolarHBondContact O-CB 3.5Å; C75-A79 PolarHBondContact O-N 3.24Å; L76-A79 PolarHBondContact O-N 2.85Å; G77-A79 PolarHBondContact O-N 3.07Å; A79-A82 PolarHBondContact O-N 2.78Å; A79-E83 PolarHBondContact O-N 3.45Å; A79-L91 HydrophobicContact CB-CD1 4.21Å; A79-L91 WeakPolarHBondContact O-CD1 3.5Å; A79-A94 HydrophobicContact CB-CB 3.86Å
80	F	88.8	Confident	88.2	Confident	92 Å²	92	44.6 Å²	44.6	40%	0.404	25%	0.248	S	C	.	.	H	α-helix	trans	-61.7	-46	177.8	180	-107.4	0	0	0	112.1	L76 G77 A82 E83 Q84 Q118	L76-F80 WeakPolarHBondContact O-CB 3.49Å; L76-F80 PolarHBondContact O-N 3.42Å; G77-F80 PolarHBondContact O-N 2.94Å; F80-A82 VanDerWaalsContact C-N 3.34Å; F80-A82 PolarHBondContact O-N 2.99Å; F80-E83 WeakPolarHBondContact O-CB 3.22Å; F80-E83 PolarHBondContact O-N 3.28Å; F80-Q84 HydrophobicContact CE1-CG 4.3Å; F80-Q84 HydrophobicContact CZ-CG 4.32Å; F80-Q84 WeakPolarHBondContact O-CG 3.41Å; F80-Q84 PolarHBondContact O-N 2.87Å; F80-Q118 VanDerWaalsContact CD2-NE2 3.34Å
81	F	88.3	Confident	88.3	Confident	29 Å²	29	45 Å²	45	13%	0.127	25%	0.25	C	S	.	.	H	α-helix	trans	-60.3	-43.3	175.9	177.7	-112	0	0	0	111.9	E44 L47 L66 G77 E83 Q84 Q85	E44-F81 HydrophobicContact CB-CE1 4.19Å; E44-F81 HydrophobicContact CB-CE2 4.31Å; E44-F81 HydrophobicContact CB-CZ 3.86Å; E44-F81 HydrophobicContact CG-CE1 4.22Å; E44-F81 HydrophobicContact CG-CZ 4.37Å; E44-F81 WeakPolarHBondContact O-CZ 3.42Å; L47-F81 HydrophobicContact CB-CE1 4.41Å; L47-F81 HydrophobicContact CB-CZ 4.47Å; L47-F81 HydrophobicContact CD2-CD1 4.45Å; L47-F81 HydrophobicContact CD2-CE1 3.62Å; L47-F81 HydrophobicContact CD2-CZ 4.32Å; L47-F81 HydrophobicContact CG-CE1 4.4Å; L66-F81 HydrophobicContact CD1-CE1 4.38Å; G77-F81 WeakPolarHBondContact O-CB 3.39Å; G77-F81 PolarHBondContact O-N 2.91Å; F81-E83 VanDerWaalsContact C-N 3.34Å; F81-E83 PolarHBondContact O-N 2.87Å; F81-Q84 PolarHBondContact O-N 3.33Å; F81-Q85 HydrophobicContact CD2-CG 4.22Å; F81-Q85 HydrophobicContact CE1-CG 4.34Å; F81-Q85 HydrophobicContact CE2-CG 3.76Å; F81-Q85 HydrophobicContact CZ-CG 3.81Å; F81-Q85 WeakPolarHBondContact O-CG 3.34Å; F81-Q85 PolarHBondContact O-N 3.08Å
82	A	89.3	Confident	88.3	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-65.6	-35.6	177	0	0	0	0	0	112.7	F78 A79 F80 S86 C87 L90 L91	F78-A82 WeakPolarHBondContact O-CB 3.48Å; F78-A82 PolarHBondContact O-N 3.02Å; A79-A82 PolarHBondContact O-N 2.78Å; F80-A82 VanDerWaalsContact C-N 3.34Å; F80-A82 PolarHBondContact O-N 2.99Å; A82-S86 PolarHBondContact O-N 3.18Å; A82-S86 VanDerWaalsContact O-N 3.15Å; A82-C87 HydrophobicContact CB-CB 4.19Å; A82-C87 PolarHBondContact O-N 3.36Å; A82-L90 HydrophobicContact CB-CB 3.97Å; A82-L90 HydrophobicContact CB-CD2 4Å; A82-L90 HydrophobicContact CB-CG 3.91Å; A82-L91 HydrophobicContact CB-CB 3.79Å; A82-L91 HydrophobicContact CB-CD1 4.46Å
83	E	88.8	Confident	88.3	Confident	88 Å²	88	51.9 Å²	51.9	41%	0.411	28%	0.277	S	S	.	.	H	α-helix	trans	-63.6	-45.5	174	-167.9	173.2	-157.8	0	0	110.8	A79 F80 F81 Q85 S86 L91 K121	A79-E83 PolarHBondContact O-N 3.45Å; F80-E83 WeakPolarHBondContact O-CB 3.22Å; F80-E83 PolarHBondContact O-N 3.28Å; F81-E83 VanDerWaalsContact C-N 3.34Å; F81-E83 PolarHBondContact O-N 2.87Å; E83-Q85 PolarHBondContact O-N 3.46Å; E83-S86 PolarHBondContact O-N 2.98Å; E83-L91 HydrophobicContact CB-CD1 4.16Å; E83-L91 HydrophobicContact CB-CD2 4.41Å; E83-K121 IonicContact OE1-NZ 3.42Å; E83-K121 PolarHBondContact OE1-NZ 3.28Å
84	Q	86.6	Confident	88.4	Confident	116 Å²	116	49.6 Å²	49.6	54%	0.542	26%	0.261	S	S	.	.	H	α-helix	trans	-61.3	-42.4	176.7	-71.5	-172.9	-19.5	0	0	113	F80 F81 S86	F80-Q84 HydrophobicContact CE1-CG 4.3Å; F80-Q84 HydrophobicContact CZ-CG 4.32Å; F80-Q84 WeakPolarHBondContact O-CG 3.41Å; F80-Q84 PolarHBondContact O-N 2.87Å; F81-Q84 PolarHBondContact O-N 3.33Å; Q84-S86 PolarHBondContact O-N 3.47Å
85	Q	84.7	Confident	88.5	Confident	54 Å²	54	52.3 Å²	52.3	25%	0.252	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	5.7	-179.4	-59	-55.4	-37	0	0	113.3	A48 F81 E83 C87	A48-Q85 HydrophobicContact CB-CG 4.5Å; F81-Q85 HydrophobicContact CD2-CG 4.22Å; F81-Q85 HydrophobicContact CE1-CG 4.34Å; F81-Q85 HydrophobicContact CE2-CG 3.76Å; F81-Q85 HydrophobicContact CZ-CG 3.81Å; F81-Q85 WeakPolarHBondContact O-CG 3.34Å; F81-Q85 PolarHBondContact O-N 3.08Å; E83-Q85 PolarHBondContact O-N 3.46Å; Q85-C87 PolarHBondContact O-N 3.36Å; Q85-C87 VanDerWaalsContact O-N 3.09Å
86	S	84.7	Confident	88.4	Confident	101 Å²	101	54.9 Å²	54.9	71%	0.706	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	28.3	-174.3	-60.9	0	0	0	0	113.8	A82 E83 Q84 T88	A82-S86 PolarHBondContact O-N 3.18Å; A82-S86 VanDerWaalsContact O-N 3.15Å; E83-S86 PolarHBondContact O-N 2.98Å; Q84-S86 PolarHBondContact O-N 3.47Å; S86-T88 PolarHBondContact O-N 3.1Å; S86-T88 VanDerWaalsContact O-N 3.09Å
87	C	85.5	Confident	88.4	Confident	10 Å²	10	55.3 Å²	55.3	7%	0.068	29%	0.294	C	S	.	.			trans	-82.1	81.9	179.1	-74.6	0	0	0	0	110.7	A82 Q85 T89 L90 L91	A82-C87 HydrophobicContact CB-CB 4.19Å; A82-C87 PolarHBondContact O-N 3.36Å; Q85-C87 PolarHBondContact O-N 3.36Å; Q85-C87 VanDerWaalsContact O-N 3.09Å; C87-T89 VanDerWaalsContact C-N 3.32Å; C87-T89 PolarHBondContact O-N 3Å; C87-L90 HydrophobicContact CB-CB 4.28Å; C87-L90 PolarHBondContact O-N 3.1Å; C87-L91 WeakPolarHBondContact O-CB 3.22Å; C87-L91 PolarHBondContact O-N 3.25Å
88	T	86.6	Confident	88.6	Confident	106 Å²	106	54.2 Å²	54.2	65%	0.65	28%	0.282	S	S	*	.	H	α-helix	trans	-58.7	-38	-175.2	56.9	0	0	0	0	114	S86 R92	S86-T88 PolarHBondContact O-N 3.1Å; S86-T88 VanDerWaalsContact O-N 3.09Å; T88-R92 WeakPolarHBondContact O-CB 3.45Å; T88-R92 PolarHBondContact O-N 2.89Å
89	T	85.9	Confident	88.6	Confident	68 Å²	68	54 Å²	54	42%	0.417	28%	0.282	S	S	.	.	H	α-helix	trans	-64.5	-49.1	179.8	-56.9	0	0	0	0	112	C87 L93	C87-T89 VanDerWaalsContact C-N 3.32Å; C87-T89 PolarHBondContact O-N 3Å; T89-L93 HydrophobicContact CG2-CD1 4.39Å; T89-L93 WeakPolarHBondContact O-CG 3.49Å; T89-L93 PolarHBondContact O-N 3.13Å
90	L	89.1	Confident	88.5	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-67.6	-42	179.1	-179.2	62.2	0	0	0	110.7	L47 C63 L66 A82 C87 R92 L93 A94	L47-L90 HydrophobicContact CD2-CD2 4.25Å; C63-L90 HydrophobicContact CB-CB 4.33Å; L66-L90 HydrophobicContact CB-CD1 3.9Å; L66-L90 HydrophobicContact CB-CD2 4.13Å; L66-L90 HydrophobicContact CD1-CD2 3.62Å; A82-L90 HydrophobicContact CB-CB 3.97Å; A82-L90 HydrophobicContact CB-CD2 4Å; A82-L90 HydrophobicContact CB-CG 3.91Å; C87-L90 HydrophobicContact CB-CB 4.28Å; C87-L90 PolarHBondContact O-N 3.1Å; L90-R92 PolarHBondContact O-N 3.31Å; L90-L93 PolarHBondContact O-N 2.87Å; L90-A94 WeakPolarHBondContact O-CB 3.23Å; L90-A94 PolarHBondContact O-N 3.39Å
91	L	90.7	Very high	88.5	Confident	31 Å²	31	53.8 Å²	53.8	16%	0.162	28%	0.279	C	S	.	.	H	α-helix	trans	-56.1	-49.6	177.1	179.5	62	0	0	0	111.1	A79 A82 E83 C87 L93 A94 Q95	A79-L91 HydrophobicContact CB-CD1 4.21Å; A79-L91 WeakPolarHBondContact O-CD1 3.5Å; A82-L91 HydrophobicContact CB-CB 3.79Å; A82-L91 HydrophobicContact CB-CD1 4.46Å; E83-L91 HydrophobicContact CB-CD1 4.16Å; E83-L91 HydrophobicContact CB-CD2 4.41Å; C87-L91 WeakPolarHBondContact O-CB 3.22Å; C87-L91 PolarHBondContact O-N 3.25Å; L91-L93 VanDerWaalsContact C-N 3.34Å; L91-L93 PolarHBondContact O-N 3.46Å; L91-A94 PolarHBondContact O-N 3.48Å; L91-Q95 HydrophobicContact CD1-CG 4.09Å; L91-Q95 HydrophobicContact CG-CG 4.45Å; L91-Q95 WeakPolarHBondContact O-CB 3.29Å; L91-Q95 VanDerWaalsContact O-CG 3.29Å; L91-Q95 WeakPolarHBondContact O-CG 3.38Å; L91-Q95 PolarHBondContact O-N 3.35Å
92	R	89.6	Confident	88.7	Confident	169 Å²	169	52.4 Å²	52.4	64%	0.638	27%	0.273	S	S	*	.	H	α-helix	trans	-61.1	-41.9	178.5	-174.1	-178.2	64.6	171.7	-0.8	112.1	T88 L90 A96	T88-R92 WeakPolarHBondContact O-CB 3.45Å; T88-R92 PolarHBondContact O-N 2.89Å; L90-R92 PolarHBondContact O-N 3.31Å; R92-A96 VanDerWaalsContact O-CB 3.24Å; R92-A96 WeakPolarHBondContact O-CB 3.42Å; R92-A96 PolarHBondContact O-N 3.31Å
93	L	87.9	Confident	88.8	Confident	66 Å²	66	55.1 Å²	55.1	35%	0.346	29%	0.286	S	S	.	.	H	α-helix	trans	-66.8	-43.3	178.2	-70.4	173.4	0	0	0	111.7	A67 L70 T89 L90 L91 A96 Y97	A67-L93 HydrophobicContact CB-CD1 3.76Å; L70-L93 HydrophobicContact CD1-CB 4.38Å; T89-L93 HydrophobicContact CG2-CD1 4.39Å; T89-L93 WeakPolarHBondContact O-CG 3.49Å; T89-L93 PolarHBondContact O-N 3.13Å; L90-L93 PolarHBondContact O-N 2.87Å; L91-L93 VanDerWaalsContact C-N 3.34Å; L91-L93 PolarHBondContact O-N 3.46Å; L93-A96 PolarHBondContact O-N 2.97Å; L93-Y97 VanDerWaalsContact O-CB 3.32Å; L93-Y97 WeakPolarHBondContact O-CB 3.26Å; L93-Y97 PolarHBondContact O-N 3.31Å
94	A	91.8	Very high	88.9	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-66.1	-42.9	178.1	0	0	0	0	0	111.9	L70 F78 A79 L90 L91 Y97 T98	L70-A94 HydrophobicContact CD2-CB 4Å; F78-A94 HydrophobicContact CB-CB 4.45Å; A79-A94 HydrophobicContact CB-CB 3.86Å; L90-A94 WeakPolarHBondContact O-CB 3.23Å; L90-A94 PolarHBondContact O-N 3.39Å; L91-A94 PolarHBondContact O-N 3.48Å; A94-Y97 PolarHBondContact O-N 3.32Å; A94-T98 WeakPolarHBondContact O-CB 3.33Å; A94-T98 PolarHBondContact O-N 2.77Å; A94-T98 PolarHBondContact O-OG1 3.49Å
95	Q	91.3	Very high	89.1	Confident	94 Å²	94	48.2 Å²	48.2	44%	0.439	25%	0.254	S	S	.	.	H	α-helix	trans	-64.2	-44.7	174.9	-74.2	175	-20	0	0	112.2	L91 Y97 T98 C99	L91-Q95 HydrophobicContact CD1-CG 4.09Å; L91-Q95 HydrophobicContact CG-CG 4.45Å; L91-Q95 WeakPolarHBondContact O-CB 3.29Å; L91-Q95 VanDerWaalsContact O-CG 3.29Å; L91-Q95 WeakPolarHBondContact O-CG 3.38Å; L91-Q95 PolarHBondContact O-N 3.35Å; Q95-Y97 VanDerWaalsContact C-N 3.33Å; Q95-Y97 PolarHBondContact O-N 3.28Å; Q95-T98 WeakPolarHBondContact O-CB 3.34Å; Q95-T98 PolarHBondContact O-N 2.95Å; Q95-C99 PolarHBondContact O-N 3.21Å; Q95-C99 PolarHBondContact O-SG 3.06Å
96	A	88.6	Confident	89.4	Confident	54 Å²	54	46.6 Å²	46.6	45%	0.446	25%	0.248	S	C	.	.	H	α-helix	trans	-61.8	-41.5	176.1	0	0	0	0	0	111.7	R92 L93 C99 Q100	R92-A96 VanDerWaalsContact O-CB 3.24Å; R92-A96 WeakPolarHBondContact O-CB 3.42Å; R92-A96 PolarHBondContact O-N 3.31Å; L93-A96 PolarHBondContact O-N 2.97Å; A96-C99 PolarHBondContact O-N 3.45Å; A96-Q100 WeakPolarHBondContact O-CB 3.2Å; A96-Q100 PolarHBondContact O-N 3.3Å
97	Y	90.3	Very high	89.7	Confident	28 Å²	28	48.7 Å²	48.7	11%	0.11	25%	0.247	C	C	.	.	H	α-helix	trans	-63.8	-45.6	174.8	-170.1	-81	0	0	0	111.7	L70 P72 C75 L93 A94 Q95 C99 Q100 Y101	L70-Y97 HydrophobicContact CB-CD1 4.36Å; L70-Y97 HydrophobicContact CB-CD2 3.86Å; L70-Y97 HydrophobicContact CB-CE2 3.98Å; L70-Y97 HydrophobicContact CB-CG 4.05Å; L70-Y97 HydrophobicContact CD1-CD2 4.35Å; L70-Y97 HydrophobicContact CD1-CG 4.36Å; L70-Y97 PolarHBondContact O-OH 3.08Å; P72-Y97 WeakPolarHBondContact CD-OH 3.32Å; P72-Y97 HydrophobicContact CG-CE1 4.27Å; C75-Y97 HydrophobicContact CB-CD1 3.84Å; C75-Y97 HydrophobicContact CB-CE1 4.39Å; L93-Y97 VanDerWaalsContact O-CB 3.32Å; L93-Y97 WeakPolarHBondContact O-CB 3.26Å; L93-Y97 PolarHBondContact O-N 3.31Å; A94-Y97 PolarHBondContact O-N 3.32Å; Q95-Y97 VanDerWaalsContact C-N 3.33Å; Q95-Y97 PolarHBondContact O-N 3.28Å; Y97-C99 VanDerWaalsContact C-N 3.34Å; Y97-C99 PolarHBondContact O-N 3.09Å; Y97-Q100 PolarHBondContact O-N 3.02Å; Y97-Q100 VanDerWaalsContact O-N 3.14Å; Y97-Y101 AromaticContact CD1-CD2 3.78Å; Y97-Y101 HydrophobicContact CD1-CD2 3.78Å; Y97-Y101 AromaticContact CD2-CD2 3.86Å; Y97-Y101 HydrophobicContact CD2-CD2 3.86Å; Y97-Y101 AromaticContact CD2-CE2 3.79Å; Y97-Y101 HydrophobicContact CD2-CE2 3.79Å; Y97-Y101 AromaticContact CE1-CD2 3.53Å; Y97-Y101 HydrophobicContact CE1-CD2 3.53Å; Y97-Y101 HydrophobicContact CE1-CE2 4.19Å; Y97-Y101 HydrophobicContact CE1-CG 4.12Å; Y97-Y101 AromaticContact CE2-CD2 3.65Å; Y97-Y101 HydrophobicContact CE2-CD2 3.65Å; Y97-Y101 AromaticContact CE2-CE2 3.44Å; Y97-Y101 HydrophobicContact CE2-CE2 3.44Å; Y97-Y101 VanDerWaalsContact CE2-CE2 3.44Å; Y97-Y101 AromaticContact CG-CD2 3.93Å; Y97-Y101 HydrophobicContact CG-CD2 3.93Å; Y97-Y101 HydrophobicContact CG-CE2 4.32Å; Y97-Y101 AromaticContact CZ-CD2 3.47Å; Y97-Y101 VanDerWaalsContact CZ-CD2 3.47Å; Y97-Y101 AromaticContact CZ-CE2 3.66Å; Y97-Y101 WeakPolarHBondContact O-CD2 3.26Å; Y97-Y101 PolarHBondContact O-N 3.1Å
98	T	92.1	Very high	90	Very high	4 Å²	4	50.4 Å²	50.4	3%	0.025	26%	0.255	C	S	.	.	H	α-helix	trans	-57.2	-48	177.1	-58.5	0	0	0	0	110.6	L76 A94 Q95 Q100 Y101 F102 V105 L122	L76-T98 HydrophobicContact CD2-CG2 3.58Å; L76-T98 HydrophobicContact CG-CG2 4.49Å; A94-T98 WeakPolarHBondContact O-CB 3.33Å; A94-T98 PolarHBondContact O-N 2.77Å; A94-T98 PolarHBondContact O-OG1 3.49Å; Q95-T98 WeakPolarHBondContact O-CB 3.34Å; Q95-T98 PolarHBondContact O-N 2.95Å; T98-Q100 VanDerWaalsContact C-N 3.34Å; T98-Q100 PolarHBondContact O-N 3.25Å; T98-Y101 PolarHBondContact O-N 3.46Å; T98-F102 VanDerWaalsContact O-CA 3.26Å; T98-F102 WeakPolarHBondContact O-CA 3.41Å; T98-F102 PolarHBondContact O-N 2.99Å; T98-V105 HydrophobicContact CG2-CG1 4.32Å; T98-L122 HydrophobicContact CG2-CD1 3.77Å; T98-L122 HydrophobicContact CG2-CD2 4.36Å
99	C	89.9	Confident	90.1	Very high	12 Å²	12	52.3 Å²	52.3	8%	0.081	26%	0.257	C	S	.	.	H	α-helix	trans	-63.7	-40	177.3	-66.4	0	0	0	0	111.7	Q95 A96 Y97 D127 L128 N129	Q95-C99 PolarHBondContact O-N 3.21Å; Q95-C99 PolarHBondContact O-SG 3.06Å; A96-C99 PolarHBondContact O-N 3.45Å; Y97-C99 VanDerWaalsContact C-N 3.34Å; Y97-C99 PolarHBondContact O-N 3.09Å; C99-D127 HydrophobicContact CB-CB 4.36Å; C99-D127 WeakPolarHBondContact CB-O 3.4Å; C99-L128 HydrophobicContact CB-CD2 4.49Å; C99-N129 WeakPolarHBondContact O-CB 3.39Å; C99-N129 PolarHBondContact O-N 3.09Å
100	Q	88.3	Confident	90.3	Very high	66 Å²	66	51.3 Å²	51.3	31%	0.308	25%	0.248	S	C	.	.	H	α-helix	trans	-66.6	-39.6	179.9	177.8	172.8	-10.7	0	0	113.4	A96 Y97 T98 N129	A96-Q100 WeakPolarHBondContact O-CB 3.2Å; A96-Q100 PolarHBondContact O-N 3.3Å; Y97-Q100 PolarHBondContact O-N 3.02Å; Y97-Q100 VanDerWaalsContact O-N 3.14Å; T98-Q100 VanDerWaalsContact C-N 3.34Å; T98-Q100 PolarHBondContact O-N 3.25Å; Q100-N129 WeakPolarHBondContact O-CB 3.34Å; Q100-N129 PolarHBondContact O-ND2 3.15Å
101	Y	89.1	Confident	90.5	Very high	33 Å²	33	51.3 Å²	51.3	13%	0.129	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.6	21.9	-175.7	-64.5	-78.9	0	0	0	112.9	Y97 T98 M103 Q104 V105	Y97-Y101 AromaticContact CD1-CD2 3.78Å; Y97-Y101 HydrophobicContact CD1-CD2 3.78Å; Y97-Y101 AromaticContact CD2-CD2 3.86Å; Y97-Y101 HydrophobicContact CD2-CD2 3.86Å; Y97-Y101 AromaticContact CD2-CE2 3.79Å; Y97-Y101 HydrophobicContact CD2-CE2 3.79Å; Y97-Y101 AromaticContact CE1-CD2 3.53Å; Y97-Y101 HydrophobicContact CE1-CD2 3.53Å; Y97-Y101 HydrophobicContact CE1-CE2 4.19Å; Y97-Y101 HydrophobicContact CE1-CG 4.12Å; Y97-Y101 AromaticContact CE2-CD2 3.65Å; Y97-Y101 HydrophobicContact CE2-CD2 3.65Å; Y97-Y101 AromaticContact CE2-CE2 3.44Å; Y97-Y101 HydrophobicContact CE2-CE2 3.44Å; Y97-Y101 VanDerWaalsContact CE2-CE2 3.44Å; Y97-Y101 AromaticContact CG-CD2 3.93Å; Y97-Y101 HydrophobicContact CG-CD2 3.93Å; Y97-Y101 HydrophobicContact CG-CE2 4.32Å; Y97-Y101 AromaticContact CZ-CD2 3.47Å; Y97-Y101 VanDerWaalsContact CZ-CD2 3.47Å; Y97-Y101 AromaticContact CZ-CE2 3.66Å; Y97-Y101 WeakPolarHBondContact O-CD2 3.26Å; Y97-Y101 PolarHBondContact O-N 3.1Å; T98-Y101 PolarHBondContact O-N 3.46Å; Y101-M103 VanDerWaalsContact C-N 3.25Å; Y101-M103 PolarHBondContact O-N 3.35Å; Y101-M103 VanDerWaalsContact O-N 3.08Å; Y101-Q104 WeakPolarHBondContact O-CA 3.48Å; Y101-Q104 WeakPolarHBondContact O-CB 3.4Å; Y101-Q104 PolarHBondContact O-N 2.97Å; Y101-V105 WeakPolarHBondContact O-CG2 3.45Å; Y101-V105 PolarHBondContact O-N 3.44Å
102	F	92.1	Very high	90.5	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-49.1	-42.4	-172.9	-179.4	-102.1	0	0	0	114	T98 Q104 V105 C106 F111 L122 L123 L128 V130 S139	T98-F102 VanDerWaalsContact O-CA 3.26Å; T98-F102 WeakPolarHBondContact O-CA 3.41Å; T98-F102 PolarHBondContact O-N 2.99Å; F102-Q104 PolarHBondContact O-N 3.35Å; F102-V105 PolarHBondContact O-N 2.9Å; F102-V105 VanDerWaalsContact O-N 3.11Å; F102-C106 PolarHBondContact O-N 2.97Å; F102-C106 PolarHBondContact O-SG 3.42Å; F102-F111 HydrophobicContact CE2-CE2 4.16Å; F102-F111 HydrophobicContact CZ-CE2 4.46Å; F102-L122 HydrophobicContact CD2-CD1 4.46Å; F102-L122 HydrophobicContact CD2-CD2 4.14Å; F102-L122 HydrophobicContact CD2-CG 4.34Å; F102-L122 HydrophobicContact CE2-CD2 3.7Å; F102-L122 HydrophobicContact CE2-CG 3.97Å; F102-L123 HydrophobicContact CZ-CD2 4.34Å; F102-L128 HydrophobicContact CB-CD2 4.29Å; F102-L128 HydrophobicContact CD2-CD2 3.66Å; F102-L128 HydrophobicContact CE2-CD2 4.11Å; F102-L128 HydrophobicContact CG-CD2 3.94Å; F102-V130 HydrophobicContact CD1-CG1 3.55Å; F102-V130 HydrophobicContact CE1-CG1 3.99Å; F102-S139 WeakPolarHBondContact CZ-OG 3.38Å
103	M	91.8	Very high	90.6	Very high	57 Å²	57	50.1 Å²	50.1	28%	0.281	25%	0.248	S	C	.	.	H	α-helix	trans	-61	-25.7	178.4	-65.9	-53.3	-60	0	0	114.4	Y101 C106 Q107 V130 D135	Y101-M103 VanDerWaalsContact C-N 3.25Å; Y101-M103 PolarHBondContact O-N 3.35Å; Y101-M103 VanDerWaalsContact O-N 3.08Å; M103-C106 PolarHBondContact O-SG 3.07Å; M103-Q107 PolarHBondContact O-NE2 2.86Å; M103-Q107 VanDerWaalsContact O-NE2 3.08Å; M103-V130 HydrophobicContact SD-CG1 4.05Å; M103-D135 HydrophobicContact CE-CB 3.84Å; M103-D135 HydrophobicContact SD-CB 3.77Å
104	Q	89.6	Confident	90.7	Very high	60 Å²	60	48 Å²	48	28%	0.28	24%	0.237	S	C	.	.	H	α-helix	trans	-89.7	-38.7	174	-63.7	169.7	3.8	0	0	110.3	P72 Y101 F102 C106 Q107 N108	P72-Q104 HydrophobicContact CB-CB 3.82Å; P72-Q104 HydrophobicContact CG-CB 4.07Å; P72-Q104 VanDerWaalsContact CG-OE1 3.29Å; Y101-Q104 WeakPolarHBondContact O-CA 3.48Å; Y101-Q104 WeakPolarHBondContact O-CB 3.4Å; Y101-Q104 PolarHBondContact O-N 2.97Å; F102-Q104 PolarHBondContact O-N 3.35Å; Q104-C106 VanDerWaalsContact C-N 3.34Å; Q104-C106 PolarHBondContact O-N 3.12Å; Q104-Q107 WeakPolarHBondContact O-CB 3.49Å; Q104-Q107 PolarHBondContact O-N 3.25Å; Q104-N108 PolarHBondContact O-ND2 3.44Å
105	V	91.5	Very high	90.6	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59.8	-43.3	179.2	177.2	0	0	0	0	111.4	P72 C75 L76 T98 Y101 F102 Q107 N108	P72-V105 HydrophobicContact CB-CG2 4.14Å; C75-V105 VanDerWaalsContact SG-CG2 3.51Å; L76-V105 HydrophobicContact CD1-CG1 3.58Å; L76-V105 HydrophobicContact CD2-CG1 4.29Å; L76-V105 HydrophobicContact CG-CG1 3.82Å; T98-V105 HydrophobicContact CG2-CG1 4.32Å; Y101-V105 WeakPolarHBondContact O-CG2 3.45Å; Y101-V105 PolarHBondContact O-N 3.44Å; F102-V105 PolarHBondContact O-N 2.9Å; F102-V105 VanDerWaalsContact O-N 3.11Å; V105-Q107 PolarHBondContact O-N 3.25Å; V105-N108 PolarHBondContact O-N 2.93Å
106	C	91.5	Very high	90.6	Very high	19 Å²	19	47.9 Å²	47.9	13%	0.128	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-9.9	-178.1	67.6	0	0	0	0	114.5	F102 M103 Q104 F111	F102-C106 PolarHBondContact O-N 2.97Å; F102-C106 PolarHBondContact O-SG 3.42Å; M103-C106 PolarHBondContact O-SG 3.07Å; Q104-C106 VanDerWaalsContact C-N 3.34Å; Q104-C106 PolarHBondContact O-N 3.12Å; C106-F111 HydrophobicContact CB-CD1 4.26Å; C106-F111 HydrophobicContact CB-CD2 4.4Å; C106-F111 HydrophobicContact CB-CE1 4.17Å; C106-F111 HydrophobicContact CB-CE2 4.32Å; C106-F111 HydrophobicContact CB-CG 4.38Å; C106-F111 HydrophobicContact CB-CZ 4.21Å
107	Q	90.4	Very high	90.7	Very high	145 Å²	145	50.5 Å²	50.5	68%	0.678	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-12.2	176.2	-56.8	176.6	9.1	0	0	112.7	M103 Q104 V105	M103-Q107 PolarHBondContact O-NE2 2.86Å; M103-Q107 VanDerWaalsContact O-NE2 3.08Å; Q104-Q107 WeakPolarHBondContact O-CB 3.49Å; Q104-Q107 PolarHBondContact O-N 3.25Å; V105-Q107 PolarHBondContact O-N 3.25Å
108	N	92.1	Very high	90.7	Very high	46 Å²	46	51.4 Å²	51.4	25%	0.246	25%	0.253	C	S	.	.	S	Bend	trans	-94	158.3	-174.6	-68.7	-67.3	0	0	0	112.7	P72 Q104 V105 E110 F111 F112	P72-N108 PolarHBondContact O-ND2 3.15Å; Q104-N108 PolarHBondContact O-ND2 3.44Å; V105-N108 PolarHBondContact O-N 2.93Å; N108-E110 PolarHBondContact O-N 3.15Å; N108-F111 WeakPolarHBondContact O-CB 3.32Å; N108-F111 PolarHBondContact O-N 3.46Å; N108-F112 VanDerWaalsContact O-CD2 3.31Å; N108-F112 WeakPolarHBondContact O-CD2 3.37Å
109	Q	88.8	Confident	90.8	Very high	147 Å²	147	51.2 Å²	51.2	69%	0.687	25%	0.252	S	S	*	.	H	α-helix	trans	-61.7	-37.3	-175.8	-167.6	175.9	6.9	0	0	113.7	F111 F112 Q113	Q109-F111 PolarHBondContact O-N 3.43Å; Q109-F112 PolarHBondContact O-N 2.75Å; Q109-Q113 PolarHBondContact O-N 2.88Å
110	E	90.8	Very high	90.9	Very high	47 Å²	47	51.2 Å²	51.2	22%	0.22	25%	0.254	C	S	.	.	H	α-helix	trans	-57.5	-33.2	179.1	-68.9	-167.3	162	0	0	112.5	S73 N74 L76 G77 N108 F112 Q113 L114	S73-E110 WeakPolarHBondContact O-CG 3.49Å; N74-E110 WeakPolarHBondContact CA-OE1 3.49Å; N74-E110 VanDerWaalsContact CA-OE2 3.24Å; N74-E110 WeakPolarHBondContact CA-OE2 3.49Å; L76-E110 HydrophobicContact CB-CB 4.13Å; L76-E110 WeakPolarHBondContact CB-OE2 3.47Å; L76-E110 HydrophobicContact CD1-CB 4.04Å; L76-E110 PolarHBondContact N-OE2 3.09Å; G77-E110 PolarHBondContact N-OE2 2.94Å; N108-E110 PolarHBondContact O-N 3.15Å; E110-F112 VanDerWaalsContact C-N 3.33Å; E110-F112 PolarHBondContact O-N 3.35Å; E110-Q113 PolarHBondContact O-N 2.83Å; E110-L114 PolarHBondContact O-N 2.66Å
111	F	92.3	Very high	91	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-63.9	-39.9	177.8	-179.8	-101.3	0	0	0	111.9	L76 F102 C106 N108 Q109 Q113 L114 L119 L122 W143	L76-F111 HydrophobicContact CD1-CB 4.02Å; L76-F111 HydrophobicContact CD1-CD2 4.42Å; F102-F111 HydrophobicContact CE2-CE2 4.16Å; F102-F111 HydrophobicContact CZ-CE2 4.46Å; C106-F111 HydrophobicContact CB-CD1 4.26Å; C106-F111 HydrophobicContact CB-CD2 4.4Å; C106-F111 HydrophobicContact CB-CE1 4.17Å; C106-F111 HydrophobicContact CB-CE2 4.32Å; C106-F111 HydrophobicContact CB-CG 4.38Å; C106-F111 HydrophobicContact CB-CZ 4.21Å; N108-F111 WeakPolarHBondContact O-CB 3.32Å; N108-F111 PolarHBondContact O-N 3.46Å; Q109-F111 PolarHBondContact O-N 3.43Å; F111-Q113 PolarHBondContact O-N 3.05Å; F111-L114 HydrophobicContact CD2-CD1 4.01Å; F111-L114 HydrophobicContact CE2-CD1 4.46Å; F111-L114 WeakPolarHBondContact O-CB 3.31Å; F111-L114 WeakPolarHBondContact O-CG 3.37Å; F111-L114 PolarHBondContact O-N 2.96Å; F111-L119 HydrophobicContact CE2-CD1 3.68Å; F111-L119 HydrophobicContact CZ-CD1 3.74Å; F111-L122 HydrophobicContact CD2-CD2 4.47Å; F111-L122 HydrophobicContact CE2-CD2 4.18Å; F111-W143 HydrophobicContact CE1-CB 3.9Å; F111-W143 HydrophobicContact CZ-CB 4.47Å
112	F	91.1	Very high	91.2	Very high	40 Å²	40	53.4 Å²	53.4	18%	0.175	26%	0.264	C	S	.	.	H	α-helix	trans	-74	-15.9	178.5	-59.7	-74.4	0	0	0	113.2	N108 Q109 E110 S142 H146 R151	N108-F112 VanDerWaalsContact O-CD2 3.31Å; N108-F112 WeakPolarHBondContact O-CD2 3.37Å; Q109-F112 PolarHBondContact O-N 2.75Å; E110-F112 VanDerWaalsContact C-N 3.33Å; E110-F112 PolarHBondContact O-N 3.35Å; F112-S142 WeakPolarHBondContact CE1-O 3.21Å; F112-H146 HydrophobicContact CD1-CB 3.86Å; F112-R151 PolarHBondContact O-NH1 3.29Å; F112-R151 PolarHBondContact O-NH2 3.15Å
113	Q	90.4	Very high	91.2	Very high	135 Å²	135	53.4 Å²	53.4	63%	0.631	26%	0.264	S	S	*	.	H	α-helix	trans	-85.9	-10.6	176.6	-67.4	175.6	-6	0	0	113.3	Q109 E110 F111	Q109-Q113 PolarHBondContact O-N 2.88Å; E110-Q113 PolarHBondContact O-N 2.83Å; F111-Q113 PolarHBondContact O-N 3.05Å
114	L	90.7	Very high	91.3	Very high	20 Å²	20	53.7 Å²	53.7	11%	0.105	27%	0.271	C	S	.	.			trans	-62.3	142.7	177.4	-63	178.3	0	0	0	111.7	L76 E110 F111 Q118 L122 W143	L76-L114 HydrophobicContact CD1-CD1 3.98Å; L76-L114 HydrophobicContact CD1-CD2 4.36Å; L76-L114 HydrophobicContact CD1-CG 4.28Å; L76-L114 HydrophobicContact CD2-CD1 4.32Å; E110-L114 PolarHBondContact O-N 2.66Å; F111-L114 HydrophobicContact CD2-CD1 4.01Å; F111-L114 HydrophobicContact CE2-CD1 4.46Å; F111-L114 WeakPolarHBondContact O-CB 3.31Å; F111-L114 WeakPolarHBondContact O-CG 3.37Å; F111-L114 PolarHBondContact O-N 2.96Å; L114-Q118 HydrophobicContact CB-CB 4.36Å; L114-Q118 HydrophobicContact CD2-CB 4.16Å; L114-L122 HydrophobicContact CD1-CD2 4.38Å; L114-W143 WeakPolarHBondContact O-CZ2 3.4Å; L114-W143 PolarHBondContact O-NE1 3.02Å
115	N	91	Very high	91.3	Very high	77 Å²	77	52.2 Å²	52.2	41%	0.412	27%	0.268	S	S	.	.			trans	-80	170.2	168.2	70.1	21.1	0	0	0	111.4	D117 Q118 L119	N115-D117 VanDerWaalsContact C-N 3.34Å; N115-D117 PolarHBondContact O-N 3.16Å; N115-D117 PolarHBondContact OD1-N 3.11Å; N115-Q118 VanDerWaalsContact N-OE1 3.15Å; N115-Q118 PolarHBondContact O-N 2.91Å; N115-Q118 WeakPolarHBondContact OD1-CB 3.42Å; N115-Q118 WeakPolarHBondContact OD1-CG 3.32Å; N115-Q118 PolarHBondContact OD1-N 3.05Å; N115-Q118 PolarHBondContact OD1-OE1 2.88Å; N115-L119 WeakPolarHBondContact O-CB 3.46Å; N115-L119 PolarHBondContact O-N 3.46Å
116	A	90.6	Very high	91.2	Very high	15 Å²	15	55.7 Å²	55.7	12%	0.124	29%	0.286	C	S	.	.	H	α-helix	trans	-59.6	-42	-177.4	0	0	0	0	0	112.4	L119 G120 W143 H154	A116-L119 PolarHBondContact O-N 3.37Å; A116-G120 PolarHBondContact O-N 3.06Å; A116-W143 HydrophobicContact CB-CH2 4.32Å; A116-H154 HydrophobicContact CB-CB 4.27Å
117	D	90.8	Very high	91.1	Very high	109 Å²	109	57.6 Å²	57.6	58%	0.583	30%	0.295	S	S	*	.	H	α-helix	trans	-65.4	-42.9	-179.7	-63.6	-25.5	0	0	0	112.6	N115 G120 K121	N115-D117 VanDerWaalsContact C-N 3.34Å; N115-D117 PolarHBondContact O-N 3.16Å; N115-D117 PolarHBondContact OD1-N 3.11Å; D117-G120 PolarHBondContact O-N 3.2Å; D117-K121 WeakPolarHBondContact O-CG 3.48Å; D117-K121 PolarHBondContact O-N 3.22Å
118	Q	90.9	Very high	91	Very high	48 Å²	48	50.7 Å²	50.7	22%	0.224	26%	0.263	C	S	.	.	H	α-helix	trans	-65.5	-43.5	177.7	-73.7	167.3	-21.7	0	0	111	F80 L114 N115 G120 K121 L122	F80-Q118 VanDerWaalsContact CD2-NE2 3.34Å; L114-Q118 HydrophobicContact CB-CB 4.36Å; L114-Q118 HydrophobicContact CD2-CB 4.16Å; N115-Q118 VanDerWaalsContact N-OE1 3.15Å; N115-Q118 PolarHBondContact O-N 2.91Å; N115-Q118 WeakPolarHBondContact OD1-CB 3.42Å; N115-Q118 WeakPolarHBondContact OD1-CG 3.32Å; N115-Q118 PolarHBondContact OD1-N 3.05Å; N115-Q118 PolarHBondContact OD1-OE1 2.88Å; Q118-G120 VanDerWaalsContact C-N 3.34Å; Q118-K121 PolarHBondContact O-N 3.34Å; Q118-L122 PolarHBondContact O-N 2.61Å; Q118-L122 VanDerWaalsContact O-N 3.13Å
119	L	92.9	Very high	90.9	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-64.7	-41.2	174.8	-178.3	60.7	0	0	0	110.8	F111 N115 A116 L122 L123 L140 W143 L158	F111-L119 HydrophobicContact CE2-CD1 3.68Å; F111-L119 HydrophobicContact CZ-CD1 3.74Å; N115-L119 WeakPolarHBondContact O-CB 3.46Å; N115-L119 PolarHBondContact O-N 3.46Å; A116-L119 PolarHBondContact O-N 3.37Å; L119-L122 WeakPolarHBondContact O-CB 3.24Å; L119-L122 PolarHBondContact O-N 2.79Å; L119-L122 VanDerWaalsContact O-N 3.12Å; L119-L123 HydrophobicContact CD1-CD1 4.13Å; L119-L123 HydrophobicContact CD1-CD2 4.37Å; L119-L123 HydrophobicContact CD1-CG 3.98Å; L119-L123 HydrophobicContact CD2-CD1 4.4Å; L119-L123 HydrophobicContact CG-CD1 3.87Å; L119-L123 HydrophobicContact CG-CG 4.15Å; L119-L123 WeakPolarHBondContact O-CG 3.43Å; L119-L123 PolarHBondContact O-N 3.45Å; L119-L140 HydrophobicContact CD2-CD1 4.04Å; L119-W143 HydrophobicContact CD2-CB 4.09Å; L119-W143 HydrophobicContact CD2-CD2 3.38Å; L119-W143 HydrophobicContact CD2-CE3 3.61Å; L119-W143 HydrophobicContact CD2-CG 3.59Å; L119-W143 HydrophobicContact CD2-CZ2 4.35Å; L119-W143 HydrophobicContact CD2-CZ3 4.19Å; L119-L158 HydrophobicContact CD2-CD1 4.04Å
120	G	92.3	Very high	90.9	Very high	11 Å²	11	43.5 Å²	43.5	11%	0.113	23%	0.229	C	C	.	.	H	α-helix	trans	-57	-50.4	175.3	0	0	0	0	0	112.2	A116 D117 Q118 L122 L123 S124 L161	A116-G120 PolarHBondContact O-N 3.06Å; D117-G120 PolarHBondContact O-N 3.2Å; Q118-G120 VanDerWaalsContact C-N 3.34Å; G120-L122 PolarHBondContact O-N 3.23Å; G120-L123 PolarHBondContact O-N 3.35Å; G120-S124 WeakPolarHBondContact O-CB 3.34Å; G120-S124 PolarHBondContact O-N 3.42Å; G120-S124 PolarHBondContact O-OG 3.27Å; G120-L161 VanDerWaalsContact CA-CD1 3.47Å; G120-L161 WeakPolarHBondContact O-CD1 3.48Å
121	K	91.4	Very high	90.6	Very high	125 Å²	125	44.8 Å²	44.8	54%	0.543	24%	0.242	S	C	.	.	H	α-helix	trans	-56.6	-36.1	174.6	-73.1	176.6	-178.2	178.5	0	112.8	E83 D117 Q118 S124	E83-K121 IonicContact OE1-NZ 3.42Å; E83-K121 PolarHBondContact OE1-NZ 3.28Å; D117-K121 WeakPolarHBondContact O-CG 3.48Å; D117-K121 PolarHBondContact O-N 3.22Å; Q118-K121 PolarHBondContact O-N 3.34Å; K121-S124 PolarHBondContact O-OG 3Å
122	L	92.5	Very high	90.4	Very high	21 Å²	21	46.4 Å²	46.4	11%	0.11	25%	0.253	C	S	.	.	H	α-helix	trans	-72.1	-47.7	178.2	-176.1	59.9	0	0	0	111.3	L76 T98 F102 F111 L114 Q118 L119 G120 S124 S125 L128	L76-L122 HydrophobicContact CD2-CD2 4.43Å; T98-L122 HydrophobicContact CG2-CD1 3.77Å; T98-L122 HydrophobicContact CG2-CD2 4.36Å; F102-L122 HydrophobicContact CD2-CD1 4.46Å; F102-L122 HydrophobicContact CD2-CD2 4.14Å; F102-L122 HydrophobicContact CD2-CG 4.34Å; F102-L122 HydrophobicContact CE2-CD2 3.7Å; F102-L122 HydrophobicContact CE2-CG 3.97Å; F111-L122 HydrophobicContact CD2-CD2 4.47Å; F111-L122 HydrophobicContact CE2-CD2 4.18Å; L114-L122 HydrophobicContact CD1-CD2 4.38Å; Q118-L122 PolarHBondContact O-N 2.61Å; Q118-L122 VanDerWaalsContact O-N 3.13Å; L119-L122 WeakPolarHBondContact O-CB 3.24Å; L119-L122 PolarHBondContact O-N 2.79Å; L119-L122 VanDerWaalsContact O-N 3.12Å; G120-L122 PolarHBondContact O-N 3.23Å; L122-S124 VanDerWaalsContact C-N 3.33Å; L122-S124 PolarHBondContact O-N 2.87Å; L122-S125 VanDerWaalsContact O-CB 3.32Å; L122-S125 WeakPolarHBondContact O-CB 3.4Å; L122-S125 PolarHBondContact O-N 3.45Å; L122-L128 HydrophobicContact CD1-CD2 3.8Å; L122-L128 HydrophobicContact CG-CD2 4.25Å; L122-L128 WeakPolarHBondContact O-CD1 3.35Å
123	L	92.5	Very high	90.4	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-68.3	-29	-179.5	-65.5	179.8	0	0	0	113.1	F102 L119 G120 S125 V136 L140 L161 R213	F102-L123 HydrophobicContact CZ-CD2 4.34Å; L119-L123 HydrophobicContact CD1-CD1 4.13Å; L119-L123 HydrophobicContact CD1-CD2 4.37Å; L119-L123 HydrophobicContact CD1-CG 3.98Å; L119-L123 HydrophobicContact CD2-CD1 4.4Å; L119-L123 HydrophobicContact CG-CD1 3.87Å; L119-L123 HydrophobicContact CG-CG 4.15Å; L119-L123 WeakPolarHBondContact O-CG 3.43Å; L119-L123 PolarHBondContact O-N 3.45Å; G120-L123 PolarHBondContact O-N 3.35Å; L123-S125 PolarHBondContact O-N 2.94Å; L123-V136 HydrophobicContact CD2-CG1 3.65Å; L123-L140 HydrophobicContact CD1-CB 4.41Å; L123-L140 HydrophobicContact CD1-CD1 4.09Å; L123-L161 HydrophobicContact CB-CB 4.11Å; L123-L161 HydrophobicContact CB-CD1 4.36Å; L123-R213 PolarHBondContact O-NH1 3.39Å; L123-R213 PolarHBondContact O-NH2 3.24Å; L123-R213 VanDerWaalsContact O-NH2 3.11Å
124	S	92.3	Very high	90.4	Very high	63 Å²	63	41.1 Å²	41.1	44%	0.441	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-18	175.1	65	0	0	0	0	113.1	G120 K121 L122 D126	G120-S124 WeakPolarHBondContact O-CB 3.34Å; G120-S124 PolarHBondContact O-N 3.42Å; G120-S124 PolarHBondContact O-OG 3.27Å; K121-S124 PolarHBondContact O-OG 3Å; L122-S124 VanDerWaalsContact C-N 3.33Å; L122-S124 PolarHBondContact O-N 2.87Å; S124-D126 PolarHBondContact O-N 3.26Å
125	S	90.9	Very high	90.4	Very high	29 Å²	29	42 Å²	42	20%	0.203	23%	0.233	C	C	.	.			trans	-68.7	125.3	-175.4	-179.9	0	0	0	0	113.5	L122 L123 D127 R213	L122-S125 VanDerWaalsContact O-CB 3.32Å; L122-S125 WeakPolarHBondContact O-CB 3.4Å; L122-S125 PolarHBondContact O-N 3.45Å; L123-S125 PolarHBondContact O-N 2.94Å; S125-D127 PolarHBondContact O-N 2.93Å; S125-D127 PolarHBondContact OG-N 2.93Å; S125-R213 PolarHBondContact O-NH1 3.43Å
126	D	88.9	Confident	90.5	Very high	73 Å²	73	38.3 Å²	38.3	39%	0.39	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-18.8	171.6	-82.3	-54.9	0	0	0	114.1	S124 R163 K214	S124-D126 PolarHBondContact O-N 3.26Å; D126-R163 IonicContact OD1-CZ 3.94Å; D126-R163 IonicContact OD1-NH1 4Å; D126-R163 PolarHBondContact OD1-NH1 2.83Å; D126-R163 IonicContact OD1-NH2 3.87Å; D126-R163 PolarHBondContact OD1-NH2 2.81Å; D126-K214 PolarHBondContact O-N 3.25Å
127	D	88.6	Confident	90.6	Very high	58 Å²	58	37.8 Å²	37.8	31%	0.31	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-0.5	-173.8	-69.2	-44.9	0	0	0	113.3	C99 S125 N129 K214 R241	C99-D127 HydrophobicContact CB-CB 4.36Å; C99-D127 WeakPolarHBondContact CB-O 3.4Å; S125-D127 PolarHBondContact O-N 2.93Å; S125-D127 PolarHBondContact OG-N 2.93Å; D127-N129 PolarHBondContact O-N 2.99Å; D127-K214 VanDerWaalsContact OD1-CD 3.27Å; D127-K214 WeakPolarHBondContact OD1-CD 3.29Å; D127-K214 WeakPolarHBondContact OD1-CE 3.45Å; D127-K214 IonicContact OD1-NZ 2.83Å; D127-K214 PolarHBondContact OD1-NZ 3.06Å; D127-K214 IonicContact OD2-NZ 3.77Å; D127-R241 VanDerWaalsContact O-CD 3.24Å; D127-R241 WeakPolarHBondContact O-CD 3.34Å
128	L	90.1	Very high	90.7	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.199	C	C	.	.			trans	-55.9	122.5	175.4	-72.6	-176.7	0	0	0	111.2	C99 F102 L122 V130 S215	C99-L128 HydrophobicContact CB-CD2 4.49Å; F102-L128 HydrophobicContact CB-CD2 4.29Å; F102-L128 HydrophobicContact CD2-CD2 3.66Å; F102-L128 HydrophobicContact CE2-CD2 4.11Å; F102-L128 HydrophobicContact CG-CD2 3.94Å; L122-L128 HydrophobicContact CD1-CD2 3.8Å; L122-L128 HydrophobicContact CG-CD2 4.25Å; L122-L128 WeakPolarHBondContact O-CD1 3.35Å; L128-V130 PolarHBondContact O-N 3.42Å; L128-S215 WeakPolarHBondContact O-CB 3.5Å; L128-S215 PolarHBondContact O-OG 2.95Å
129	N	89.3	Confident	90.8	Very high	42 Å²	42	34.5 Å²	34.5	23%	0.225	19%	0.19	C	C	.	.			trans	-87.5	85.1	178.5	-172	37.7	0	0	0	110.5	C99 Q100 D127	C99-N129 WeakPolarHBondContact O-CB 3.39Å; C99-N129 PolarHBondContact O-N 3.09Å; Q100-N129 WeakPolarHBondContact O-CB 3.34Å; Q100-N129 PolarHBondContact O-ND2 3.15Å; D127-N129 PolarHBondContact O-N 2.99Å
130	V	87.9	Confident	90.8	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.191	C	C	.	.			trans	-118.2	145.6	178.7	-68.6	0	0	0	0	110.8	F102 M103 L128 V136 T216	F102-V130 HydrophobicContact CD1-CG1 3.55Å; F102-V130 HydrophobicContact CE1-CG1 3.99Å; M103-V130 HydrophobicContact SD-CG1 4.05Å; L128-V130 PolarHBondContact O-N 3.42Å; V130-V136 HydrophobicContact CB-CG2 4.23Å; V130-V136 HydrophobicContact CG1-CG2 3.87Å; V130-V136 HydrophobicContact CG2-CG2 3.83Å; V130-T216 HydrophobicContact CG2-CG2 4.18Å
131	P	85.6	Confident	90.8	Very high	75 Å²	75	34.9 Å²	34.9	49%	0.487	19%	0.189	S	C	.	.	S	Bend	trans	-65.5	-40.2	171.7	-19.4	31.5	0	0	0	112.2	D135	P131-D135 WeakPolarHBondContact CD-OD2 3.36Å
132	S	87.8	Confident	90.9	Very high	34 Å²	34	31.3 Å²	31.3	24%	0.238	18%	0.18	C	C	.	.			trans	-147.7	162.2	-178.2	74.4	0	0	0	0	111.8	Q134 D135	S132-Q134 PolarHBondContact O-N 3.13Å; S132-Q134 WeakPolarHBondContact OG-CB 3.36Å; S132-Q134 PolarHBondContact OG-N 3.48Å; S132-D135 PolarHBondContact N-OD2 3.42Å; S132-D135 WeakPolarHBondContact O-CB 3.37Å; S132-D135 PolarHBondContact O-N 2.99Å; S132-D135 PolarHBondContact OG-N 3.34Å; S132-D135 PolarHBondContact OG-OD2 2.93Å
133	E	90.5	Very high	90.9	Very high	9 Å²	9	30.5 Å²	30.5	4%	0.042	18%	0.176	C	C	.	.	H	α-helix	trans	-68.8	-17.7	172.4	-161.3	68.6	-167.1	0	0	111.9	D135 V136 F137 V162 R163 L167 R213	E133-D135 VanDerWaalsContact C-N 3.26Å; E133-D135 PolarHBondContact O-N 3.32Å; E133-V136 WeakPolarHBondContact O-CB 3.28Å; E133-V136 PolarHBondContact O-N 2.97Å; E133-F137 PolarHBondContact O-N 2.84Å; E133-F137 VanDerWaalsContact O-N 3.1Å; E133-V162 HydrophobicContact CG-CG1 3.89Å; E133-R163 HydrophobicContact CG-CB 3.88Å; E133-R163 PolarHBondContact OE1-N 2.92Å; E133-L167 HydrophobicContact CB-CD2 3.74Å; E133-L167 HydrophobicContact CB-CG 4.42Å; E133-L167 HydrophobicContact CG-CD2 4.23Å; E133-R213 IonicContact OE1-CZ 2.85Å; E133-R213 IonicContact OE1-NE 2.81Å; E133-R213 PolarHBondContact OE1-NE 3.2Å; E133-R213 IonicContact OE1-NH2 3.42Å; E133-R213 PolarHBondContact OE1-NH2 3.27Å; E133-R213 WeakPolarHBondContact OE2-CD 3.29Å; E133-R213 IonicContact OE2-CZ 3.16Å; E133-R213 IonicContact OE2-NE 2.72Å; E133-R213 PolarHBondContact OE2-NE 3.33Å; E133-R213 IonicContact OE2-NH2 3.2Å
134	Q	91.2	Very high	90.9	Very high	54 Å²	54	30.8 Å²	30.8	25%	0.252	18%	0.178	S	C	.	.	H	α-helix	trans	-62.9	-37.1	173.3	-66.3	175.3	-16.6	0	0	110.8	S132 V136 F137 H138 L167 F171	S132-Q134 PolarHBondContact O-N 3.13Å; S132-Q134 WeakPolarHBondContact OG-CB 3.36Å; S132-Q134 PolarHBondContact OG-N 3.48Å; Q134-V136 VanDerWaalsContact C-N 3.3Å; Q134-V136 PolarHBondContact O-N 2.88Å; Q134-F137 WeakPolarHBondContact O-CB 3.2Å; Q134-F137 PolarHBondContact O-N 3.35Å; Q134-H138 PolarHBondContact O-N 2.86Å; Q134-L167 HydrophobicContact CB-CD2 4.23Å; Q134-L167 HydrophobicContact CG-CD2 3.54Å; Q134-L167 VanDerWaalsContact N-CD2 3.33Å; Q134-F171 HydrophobicContact CB-CE1 4.45Å; Q134-F171 HydrophobicContact CB-CE2 4.38Å; Q134-F171 HydrophobicContact CB-CZ 4.16Å; Q134-F171 HydrophobicContact CG-CD1 4.08Å; Q134-F171 HydrophobicContact CG-CD2 4.13Å; Q134-F171 HydrophobicContact CG-CE1 4.08Å; Q134-F171 HydrophobicContact CG-CE2 4.13Å; Q134-F171 HydrophobicContact CG-CG 4.1Å; Q134-F171 HydrophobicContact CG-CZ 4.1Å
135	D	90.8	Very high	90.7	Very high	38 Å²	38	36.9 Å²	36.9	20%	0.203	19%	0.191	C	C	.	.	H	α-helix	trans	-65.2	-36.5	177.8	-60.4	-67.4	0	0	0	111.8	M103 P131 S132 E133 H138 S139	M103-D135 HydrophobicContact CE-CB 3.84Å; M103-D135 HydrophobicContact SD-CB 3.77Å; P131-D135 WeakPolarHBondContact CD-OD2 3.36Å; S132-D135 PolarHBondContact N-OD2 3.42Å; S132-D135 WeakPolarHBondContact O-CB 3.37Å; S132-D135 PolarHBondContact O-N 2.99Å; S132-D135 PolarHBondContact OG-N 3.34Å; S132-D135 PolarHBondContact OG-OD2 2.93Å; E133-D135 VanDerWaalsContact C-N 3.26Å; E133-D135 PolarHBondContact O-N 3.32Å; D135-H138 PolarHBondContact O-N 3.19Å; D135-S139 WeakPolarHBondContact O-CB 3.33Å; D135-S139 PolarHBondContact O-N 3.38Å
136	V	93.1	Very high	90.7	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-63.8	-47.6	173.7	-174.1	0	0	0	0	110	L123 V130 E133 Q134 H138 S139 L140 V162	L123-V136 HydrophobicContact CD2-CG1 3.65Å; V130-V136 HydrophobicContact CB-CG2 4.23Å; V130-V136 HydrophobicContact CG1-CG2 3.87Å; V130-V136 HydrophobicContact CG2-CG2 3.83Å; E133-V136 WeakPolarHBondContact O-CB 3.28Å; E133-V136 PolarHBondContact O-N 2.97Å; Q134-V136 VanDerWaalsContact C-N 3.3Å; Q134-V136 PolarHBondContact O-N 2.88Å; V136-H138 PolarHBondContact O-N 3.22Å; V136-S139 PolarHBondContact O-N 3.4Å; V136-S139 PolarHBondContact O-OG 3.48Å; V136-L140 PolarHBondContact O-N 2.86Å; V136-V162 HydrophobicContact CG1-CG2 4.2Å
137	F	93	Very high	90.6	Very high	5 Å²	5	41.3 Å²	41.3	2%	0.022	21%	0.208	C	C	.	.	H	α-helix	trans	-59.4	-46.6	175.9	178.1	-95.3	0	0	0	112.2	E133 Q134 S139 L140 M141 L159 V162 F171 H175 V176	E133-F137 PolarHBondContact O-N 2.84Å; E133-F137 VanDerWaalsContact O-N 3.1Å; Q134-F137 WeakPolarHBondContact O-CB 3.2Å; Q134-F137 PolarHBondContact O-N 3.35Å; F137-S139 VanDerWaalsContact C-N 3.31Å; F137-S139 PolarHBondContact O-N 3.5Å; F137-L140 PolarHBondContact O-N 3.03Å; F137-M141 HydrophobicContact CD1-CG 4.07Å; F137-M141 HydrophobicContact CE1-CG 3.62Å; F137-M141 HydrophobicContact CE2-CG 4.09Å; F137-M141 HydrophobicContact CE2-SD 4.24Å; F137-M141 HydrophobicContact CZ-CG 3.63Å; F137-M141 HydrophobicContact CZ-SD 4.02Å; F137-M141 WeakPolarHBondContact O-CG 3.26Å; F137-M141 PolarHBondContact O-N 2.83Å; F137-L159 HydrophobicContact CD2-CD1 3.83Å; F137-L159 HydrophobicContact CE2-CD1 3.79Å; F137-V162 HydrophobicContact CB-CG1 4.23Å; F137-F171 HydrophobicContact CB-CE1 4.47Å; F137-F171 AromaticContact CD1-CE1 3.74Å; F137-F171 HydrophobicContact CD1-CE1 3.74Å; F137-F171 AromaticContact CD1-CZ 3.7Å; F137-F171 HydrophobicContact CD1-CZ 3.7Å; F137-F171 HydrophobicContact CE1-CE1 4.21Å; F137-F171 HydrophobicContact CE1-CZ 4.17Å; F137-F171 HydrophobicContact CG-CE1 4.17Å; F137-F171 HydrophobicContact CG-CZ 4.48Å; F137-H175 HydrophobicContact CE1-CB 4.03Å; F137-H175 HydrophobicContact CZ-CB 4.41Å; F137-V176 HydrophobicContact CD2-CG2 4.25Å; F137-V176 HydrophobicContact CE2-CB 4.48Å; F137-V176 HydrophobicContact CE2-CG2 3.83Å; F137-V176 HydrophobicContact CZ-CG2 4.04Å
138	H	92.1	Very high	90.4	Very high	81 Å²	81	41.4 Å²	41.4	38%	0.375	21%	0.213	S	C	.	.	H	α-helix	trans	-61.9	-37.9	177.2	-69.9	160.2	0	0	0	112.7	Q134 D135 V136 M141 S142 F171	Q134-H138 PolarHBondContact O-N 2.86Å; D135-H138 PolarHBondContact O-N 3.19Å; V136-H138 PolarHBondContact O-N 3.22Å; H138-M141 PolarHBondContact O-N 2.68Å; H138-S142 WeakPolarHBondContact O-CB 3.35Å; H138-S142 PolarHBondContact O-N 3.15Å; H138-S142 PolarHBondContact O-OG 2.78Å; H138-F171 AromaticContact NE2-CE2 3.53Å; H138-F171 AromaticContact NE2-CZ 3.45Å; H138-F171 WeakPolarHBondContact NE2-CZ 3.45Å
139	S	93.1	Very high	90.1	Very high	6 Å²	6	45.8 Å²	45.8	4%	0.042	25%	0.25	C	C	.	.	H	α-helix	trans	-63	-43.5	175.4	76.7	0	0	0	0	111.9	F102 D135 V136 F137 S142 W143	F102-S139 WeakPolarHBondContact CZ-OG 3.38Å; D135-S139 WeakPolarHBondContact O-CB 3.33Å; D135-S139 PolarHBondContact O-N 3.38Å; V136-S139 PolarHBondContact O-N 3.4Å; V136-S139 PolarHBondContact O-OG 3.48Å; F137-S139 VanDerWaalsContact C-N 3.31Å; F137-S139 PolarHBondContact O-N 3.5Å; S139-S142 PolarHBondContact O-N 2.9Å; S139-W143 PolarHBondContact O-N 2.87Å; S139-W143 VanDerWaalsContact O-N 3.07Å
140	L	93.9	Very high	90	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-61.9	-48.8	175.3	173.6	60.6	0	0	0	110.9	L119 L123 V136 F137 S142 W143 V144 L158 L159 V162	L119-L140 HydrophobicContact CD2-CD1 4.04Å; L123-L140 HydrophobicContact CD1-CB 4.41Å; L123-L140 HydrophobicContact CD1-CD1 4.09Å; V136-L140 PolarHBondContact O-N 2.86Å; F137-L140 PolarHBondContact O-N 3.03Å; L140-S142 VanDerWaalsContact C-N 3.28Å; L140-S142 PolarHBondContact O-N 3.27Å; L140-W143 WeakPolarHBondContact O-CB 3.29Å; L140-W143 PolarHBondContact O-N 3.44Å; L140-W143 VanDerWaalsContact O-N 3.12Å; L140-V144 HydrophobicContact CD1-CG2 4.35Å; L140-V144 WeakPolarHBondContact O-CG2 3.37Å; L140-V144 PolarHBondContact O-N 2.97Å; L140-L158 HydrophobicContact CD1-CB 3.67Å; L140-L158 HydrophobicContact CD1-CD1 3.75Å; L140-L158 HydrophobicContact CD1-CG 4.34Å; L140-L158 HydrophobicContact CD2-CB 4.08Å; L140-L159 HydrophobicContact CD2-CD1 4.43Å; L140-V162 HydrophobicContact CD2-CG2 3.98Å
141	M	91.8	Very high	90.1	Very high	18 Å²	18	47.3 Å²	47.3	9%	0.089	26%	0.261	C	S	.	.	H	α-helix	trans	-64.2	-33.9	179.6	-67.8	-50.6	-58.9	0	0	112.5	F137 H138 V144 R145 V179	F137-M141 HydrophobicContact CD1-CG 4.07Å; F137-M141 HydrophobicContact CE1-CG 3.62Å; F137-M141 HydrophobicContact CE2-CG 4.09Å; F137-M141 HydrophobicContact CE2-SD 4.24Å; F137-M141 HydrophobicContact CZ-CG 3.63Å; F137-M141 HydrophobicContact CZ-SD 4.02Å; F137-M141 WeakPolarHBondContact O-CG 3.26Å; F137-M141 PolarHBondContact O-N 2.83Å; H138-M141 PolarHBondContact O-N 2.68Å; M141-V144 PolarHBondContact O-N 3.28Å; M141-R145 WeakPolarHBondContact O-CB 3.42Å; M141-R145 WeakPolarHBondContact O-CG 3.35Å; M141-R145 PolarHBondContact O-N 3.24Å; M141-V179 HydrophobicContact CE-CB 4.39Å; M141-V179 HydrophobicContact CE-CG1 3.74Å; M141-V179 HydrophobicContact CE-CG2 3.67Å; M141-V179 HydrophobicContact SD-CG1 3.96Å; M141-V179 HydrophobicContact SD-CG2 4.27Å
142	S	91.9	Very high	90	Very high	50 Å²	50	49.3 Å²	49.3	35%	0.35	26%	0.264	S	S	.	.	H	α-helix	trans	-65.6	-40	174.3	-59.6	0	0	0	0	111.4	F112 H138 S139 L140 H146	F112-S142 WeakPolarHBondContact CE1-O 3.21Å; H138-S142 WeakPolarHBondContact O-CB 3.35Å; H138-S142 PolarHBondContact O-N 3.15Å; H138-S142 PolarHBondContact O-OG 2.78Å; S139-S142 PolarHBondContact O-N 2.9Å; L140-S142 VanDerWaalsContact C-N 3.28Å; L140-S142 PolarHBondContact O-N 3.27Å; S142-H146 PolarHBondContact O-N 3.44Å
143	W	94.4	Very high	90	Very high	5 Å²	5	54.5 Å²	54.5	2%	0.019	29%	0.285	C	S	.	.	H	α-helix	trans	-64.8	-42.4	174.7	-179.7	92.4	0	0	0	112.3	F111 L114 A116 L119 S139 L140 H146 R151 L158	F111-W143 HydrophobicContact CE1-CB 3.9Å; F111-W143 HydrophobicContact CZ-CB 4.47Å; L114-W143 WeakPolarHBondContact O-CZ2 3.4Å; L114-W143 PolarHBondContact O-NE1 3.02Å; A116-W143 HydrophobicContact CB-CH2 4.32Å; L119-W143 HydrophobicContact CD2-CB 4.09Å; L119-W143 HydrophobicContact CD2-CD2 3.38Å; L119-W143 HydrophobicContact CD2-CE3 3.61Å; L119-W143 HydrophobicContact CD2-CG 3.59Å; L119-W143 HydrophobicContact CD2-CZ2 4.35Å; L119-W143 HydrophobicContact CD2-CZ3 4.19Å; S139-W143 PolarHBondContact O-N 2.87Å; S139-W143 VanDerWaalsContact O-N 3.07Å; L140-W143 WeakPolarHBondContact O-CB 3.29Å; L140-W143 PolarHBondContact O-N 3.44Å; L140-W143 VanDerWaalsContact O-N 3.12Å; W143-H146 PolarHBondContact O-N 3.47Å; W143-R151 HydrophobicContact CE3-CB 4.28Å; W143-R151 HydrophobicContact CE3-CG 4.28Å; W143-R151 HydrophobicContact CH2-CB 4.07Å; W143-R151 HydrophobicContact CH2-CG 3.61Å; W143-R151 HydrophobicContact CZ2-CG 4.13Å; W143-R151 HydrophobicContact CZ3-CB 3.68Å; W143-R151 HydrophobicContact CZ3-CG 3.7Å; W143-R151 VanDerWaalsContact O-CD 3.32Å; W143-R151 WeakPolarHBondContact O-CD 3.43Å; W143-R151 PolarHBondContact O-NH1 3.04Å; W143-L158 HydrophobicContact CE3-CD1 4.29Å; W143-L158 HydrophobicContact CH2-CD1 4.27Å; W143-L158 HydrophobicContact CZ3-CD1 3.73Å
144	V	90.9	Very high	89.9	Confident	6 Å²	6	56.7 Å²	56.7	4%	0.036	30%	0.295	C	S	.	.	H	α-helix	trans	-63.7	-44.9	176.7	173.7	0	0	0	0	111.3	L140 M141 H146 D147 S148 R151 E152 I155	L140-V144 HydrophobicContact CD1-CG2 4.35Å; L140-V144 WeakPolarHBondContact O-CG2 3.37Å; L140-V144 PolarHBondContact O-N 2.97Å; M141-V144 PolarHBondContact O-N 3.28Å; V144-H146 PolarHBondContact O-N 3.38Å; V144-H146 VanDerWaalsContact O-N 3.14Å; V144-D147 CarbonylContact O-C 3.6Å; V144-D147 VanDerWaalsContact O-C 3.23Å; V144-D147 PolarHBondContact O-N 3.17Å; V144-D147 VanDerWaalsContact O-N 3.17Å; V144-S148 WeakPolarHBondContact O-CA 3.48Å; V144-S148 PolarHBondContact O-N 2.89Å; V144-R151 HydrophobicContact CG1-CB 4.45Å; V144-E152 HydrophobicContact CG1-CG 4.39Å; V144-I155 HydrophobicContact CG1-CD1 4.01Å; V144-I155 HydrophobicContact CG1-CG1 4.27Å; V144-I155 HydrophobicContact CG2-CG1 4.04Å
145	R	89.6	Confident	89.8	Confident	191 Å²	191	54.9 Å²	54.9	72%	0.721	29%	0.287	S	S	*	.	H	α-helix	trans	-62	-21.9	-179	-75.7	171.3	-175.2	176.9	2.4	114.1	M141 D147	M141-R145 WeakPolarHBondContact O-CB 3.42Å; M141-R145 WeakPolarHBondContact O-CG 3.35Å; M141-R145 PolarHBondContact O-N 3.24Å; R145-D147 VanDerWaalsContact C-N 3.33Å
146	H	89.8	Confident	89.7	Confident	127 Å²	127	54.6 Å²	54.6	59%	0.588	29%	0.287	S	S	*	.	H	α-helix	trans	-69.9	-31.3	178.6	-167.1	74.9	0	0	0	112.7	F112 S142 W143 V144	F112-H146 HydrophobicContact CD1-CB 3.86Å; S142-H146 PolarHBondContact O-N 3.44Å; W143-H146 PolarHBondContact O-N 3.47Å; V144-H146 PolarHBondContact O-N 3.38Å; V144-H146 VanDerWaalsContact O-N 3.14Å
147	D	88	Confident	89.6	Confident	67 Å²	67	60.4 Å²	60.4	36%	0.358	31%	0.314	S	S	.	.	S	Bend	trans	-148.5	74	177.2	178.8	8.7	0	0	0	109.2	V144 R145 A149 A150 R151	V144-D147 CarbonylContact O-C 3.6Å; V144-D147 VanDerWaalsContact O-C 3.23Å; V144-D147 PolarHBondContact O-N 3.17Å; V144-D147 VanDerWaalsContact O-N 3.17Å; R145-D147 VanDerWaalsContact C-N 3.33Å; D147-A149 VanDerWaalsContact C-N 3.27Å; D147-A149 PolarHBondContact O-N 3.34Å; D147-A150 PolarHBondContact O-N 3.43Å; D147-A150 PolarHBondContact OD1-N 3.26Å; D147-A150 WeakPolarHBondContact OD2-CB 3.36Å; D147-R151 HydrophobicContact CB-CG 4.23Å; D147-R151 WeakPolarHBondContact O-CB 3.47Å; D147-R151 WeakPolarHBondContact O-CG 3.26Å; D147-R151 PolarHBondContact O-N 3.2Å; D147-R151 VanDerWaalsContact O-N 3.09Å
148	S	84	Confident	89.5	Confident	60 Å²	60	60.3 Å²	60.3	42%	0.42	31%	0.314	S	S	.	.	H	α-helix	trans	-62.4	-36	-173.1	58.1	0	0	0	0	112.3	V144 A150 E152	V144-S148 WeakPolarHBondContact O-CA 3.48Å; V144-S148 PolarHBondContact O-N 2.89Å; S148-A150 PolarHBondContact O-N 3.49Å; S148-E152 WeakPolarHBondContact O-CB 3.4Å; S148-E152 WeakPolarHBondContact O-CG 3.45Å; S148-E152 PolarHBondContact O-N 3.16Å
149	A	83.6	Confident	89.4	Confident	93 Å²	93	56.6 Å²	56.6	77%	0.769	30%	0.297	S	S	*	.	H	α-helix	trans	-63.9	-41.6	-176.1	0	0	0	0	0	113	D147	D147-A149 VanDerWaalsContact C-N 3.27Å; D147-A149 PolarHBondContact O-N 3.34Å
150	A	87.5	Confident	89.3	Confident	44 Å²	44	57.9 Å²	57.9	36%	0.364	31%	0.308	S	S	.	.	H	α-helix	trans	-91	-24.2	-179.7	0	0	0	0	0	113.5	D147 S148 Q153	D147-A150 PolarHBondContact O-N 3.43Å; D147-A150 PolarHBondContact OD1-N 3.26Å; D147-A150 WeakPolarHBondContact OD2-CB 3.36Å; S148-A150 PolarHBondContact O-N 3.49Å; A150-Q153 WeakPolarHBondContact O-CG 3.42Å; A150-Q153 PolarHBondContact O-NE2 3.26Å
151	R	88.8	Confident	89.2	Confident	29 Å²	29	60.6 Å²	60.6	11%	0.109	32%	0.322	C	S	.	.	H	α-helix	trans	-98.1	-19.3	-168.7	-62.8	176.8	179.7	-171.3	-3.7	114.7	F112 W143 V144 D147 Q153 H154	F112-R151 PolarHBondContact O-NH1 3.29Å; F112-R151 PolarHBondContact O-NH2 3.15Å; W143-R151 HydrophobicContact CE3-CB 4.28Å; W143-R151 HydrophobicContact CE3-CG 4.28Å; W143-R151 HydrophobicContact CH2-CB 4.07Å; W143-R151 HydrophobicContact CH2-CG 3.61Å; W143-R151 HydrophobicContact CZ2-CG 4.13Å; W143-R151 HydrophobicContact CZ3-CB 3.68Å; W143-R151 HydrophobicContact CZ3-CG 3.7Å; W143-R151 VanDerWaalsContact O-CD 3.32Å; W143-R151 WeakPolarHBondContact O-CD 3.43Å; W143-R151 PolarHBondContact O-NH1 3.04Å; V144-R151 HydrophobicContact CG1-CB 4.45Å; D147-R151 HydrophobicContact CB-CG 4.23Å; D147-R151 WeakPolarHBondContact O-CB 3.47Å; D147-R151 WeakPolarHBondContact O-CG 3.26Å; D147-R151 PolarHBondContact O-N 3.2Å; D147-R151 VanDerWaalsContact O-N 3.09Å; R151-Q153 PolarHBondContact O-N 3.22Å; R151-H154 PolarHBondContact O-N 2.91Å
152	E	85	Confident	89.2	Confident	117 Å²	117	59.8 Å²	59.8	55%	0.547	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-57.1	-34.6	179	-85.3	174.8	-163.9	0	0	113	V144 S148 H154 I155	V144-E152 HydrophobicContact CG1-CG 4.39Å; S148-E152 WeakPolarHBondContact O-CB 3.4Å; S148-E152 WeakPolarHBondContact O-CG 3.45Å; S148-E152 PolarHBondContact O-N 3.16Å; E152-H154 PolarHBondContact O-N 3.41Å; E152-I155 HydrophobicContact CB-CD1 4.3Å; E152-I155 HydrophobicContact CG-CD1 4.09Å; E152-I155 WeakPolarHBondContact O-CB 3.48Å; E152-I155 WeakPolarHBondContact O-CG1 3.46Å; E152-I155 PolarHBondContact O-N 3.2Å
153	Q	87.1	Confident	89.2	Confident	143 Å²	143	58.1 Å²	58.1	67%	0.668	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-63.3	-24.5	177.5	68.3	-172.8	-30.5	0	0	114	A150 R151	A150-Q153 WeakPolarHBondContact O-CG 3.42Å; A150-Q153 PolarHBondContact O-NE2 3.26Å; R151-Q153 PolarHBondContact O-N 3.22Å
154	H	88.9	Confident	89	Confident	56 Å²	56	57.9 Å²	57.9	26%	0.259	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-91.6	-4.4	-178.1	-63.5	-69	0	0	0	113.2	A116 R151 E152 E157 L158	A116-H154 HydrophobicContact CB-CB 4.27Å; R151-H154 PolarHBondContact O-N 2.91Å; E152-H154 PolarHBondContact O-N 3.41Å; H154-E157 PolarHBondContact O-N 3.46Å; H154-L158 HydrophobicContact CB-CD1 4.07Å; H154-L158 HydrophobicContact CB-CG 4.48Å; H154-L158 WeakPolarHBondContact O-CG 3.39Å; H154-L158 PolarHBondContact O-N 3.39Å
155	I	88.3	Confident	88.9	Confident	16 Å²	16	57.6 Å²	57.6	8%	0.082	30%	0.302	C	S	.	.	H	α-helix	trans	-55.7	-48.7	-179.4	-67.6	171.8	0	0	0	112	V144 E152 E157 L158 L159 V179	V144-I155 HydrophobicContact CG1-CD1 4.01Å; V144-I155 HydrophobicContact CG1-CG1 4.27Å; V144-I155 HydrophobicContact CG2-CG1 4.04Å; E152-I155 HydrophobicContact CB-CD1 4.3Å; E152-I155 HydrophobicContact CG-CD1 4.09Å; E152-I155 WeakPolarHBondContact O-CB 3.48Å; E152-I155 WeakPolarHBondContact O-CG1 3.46Å; E152-I155 PolarHBondContact O-N 3.2Å; I155-E157 VanDerWaalsContact C-N 3.3Å; I155-E157 PolarHBondContact O-N 2.99Å; I155-L158 PolarHBondContact O-N 3.03Å; I155-L159 WeakPolarHBondContact O-CB 3.37Å; I155-L159 PolarHBondContact O-N 2.87Å; I155-V179 HydrophobicContact CD1-CG1 4.03Å; I155-V179 HydrophobicContact CG2-CG1 4.1Å
156	P	88.6	Confident	88.9	Confident	32 Å²	32	51.3 Å²	51.3	21%	0.208	28%	0.282	C	S	.	.	H	α-helix	trans	-60	-40.8	-175.6	-23	33.8	0	0	0	113.3	A160 A182 E184 C185	P156-A160 PolarHBondContact O-N 3.48Å; P156-A182 HydrophobicContact CG-CB 4.22Å; P156-E184 HydrophobicContact CB-CB 4.21Å; P156-C185 VanDerWaalsContact CA-SG 3.56Å
157	E	90.9	Very high	88.8	Confident	122 Å²	122	45.4 Å²	45.4	57%	0.57	26%	0.255	S	S	*	.	H	α-helix	trans	-69.6	-48.6	179.6	-175.4	177.8	-170.3	0	0	111.7	H154 I155 A160	H154-E157 PolarHBondContact O-N 3.46Å; I155-E157 VanDerWaalsContact C-N 3.3Å; I155-E157 PolarHBondContact O-N 2.99Å; E157-A160 WeakPolarHBondContact O-CB 3.3Å; E157-A160 PolarHBondContact O-N 3.25Å
158	L	91.1	Very high	88.8	Confident	3 Å²	3	48.6 Å²	48.6	2%	0.016	27%	0.267	C	S	.	.	H	α-helix	trans	-71.9	-33.3	-178.3	-65.1	174.5	0	0	0	112.6	L119 L140 W143 H154 I155 A160 L161	L119-L158 HydrophobicContact CD2-CD1 4.04Å; L140-L158 HydrophobicContact CD1-CB 3.67Å; L140-L158 HydrophobicContact CD1-CD1 3.75Å; L140-L158 HydrophobicContact CD1-CG 4.34Å; L140-L158 HydrophobicContact CD2-CB 4.08Å; W143-L158 HydrophobicContact CE3-CD1 4.29Å; W143-L158 HydrophobicContact CH2-CD1 4.27Å; W143-L158 HydrophobicContact CZ3-CD1 3.73Å; H154-L158 HydrophobicContact CB-CD1 4.07Å; H154-L158 HydrophobicContact CB-CG 4.48Å; H154-L158 WeakPolarHBondContact O-CG 3.39Å; H154-L158 PolarHBondContact O-N 3.39Å; I155-L158 PolarHBondContact O-N 3.03Å; L158-A160 PolarHBondContact O-N 3.45Å; L158-L161 HydrophobicContact CD2-CD1 4.3Å; L158-L161 WeakPolarHBondContact O-CB 3.5Å; L158-L161 PolarHBondContact O-N 3.35Å; L158-L161 VanDerWaalsContact O-N 3.11Å
159	L	90.6	Very high	89	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-67.1	-27.6	175.3	-170.7	67.3	0	0	0	111.6	F137 L140 I155 L161 V162 L164 V176 C180 C185 L188 R209	F137-L159 HydrophobicContact CD2-CD1 3.83Å; F137-L159 HydrophobicContact CE2-CD1 3.79Å; L140-L159 HydrophobicContact CD2-CD1 4.43Å; I155-L159 WeakPolarHBondContact O-CB 3.37Å; I155-L159 PolarHBondContact O-N 2.87Å; L159-L161 PolarHBondContact O-N 3.24Å; L159-V162 HydrophobicContact CD1-CB 4.49Å; L159-V162 PolarHBondContact O-N 3.39Å; L159-V162 VanDerWaalsContact O-N 3.15Å; L159-L164 HydrophobicContact CD1-CD2 4.07Å; L159-L164 HydrophobicContact CD2-CD1 4.47Å; L159-L164 HydrophobicContact CG-CD1 4.26Å; L159-V176 HydrophobicContact CD2-CG1 4.17Å; L159-C180 WeakPolarHBondContact CD2-SG 3.42Å; L159-C185 HydrophobicContact CD2-CB 4.41Å; L159-L188 HydrophobicContact CB-CD1 4.42Å; L159-L188 HydrophobicContact CD2-CD1 4.45Å; L159-L188 HydrophobicContact CG-CD1 4.33Å; L159-R209 PolarHBondContact O-NH2 3.23Å
160	A	90.3	Very high	89.2	Confident	34 Å²	34	46.3 Å²	46.3	28%	0.281	25%	0.248	S	C	.	.	H	α-helix	trans	-62.7	-24.7	172.7	0	0	0	0	0	112.8	P156 E157 L158 L188 R209	P156-A160 PolarHBondContact O-N 3.48Å; E157-A160 WeakPolarHBondContact O-CB 3.3Å; E157-A160 PolarHBondContact O-N 3.25Å; L158-A160 PolarHBondContact O-N 3.45Å; A160-L188 HydrophobicContact CB-CD1 4.06Å; A160-R209 VanDerWaalsContact O-CD 3.3Å; A160-R209 WeakPolarHBondContact O-CD 3.41Å; A160-R209 PolarHBondContact O-NE 2.78Å
161	L	91.8	Very high	89.3	Confident	58 Å²	58	45.1 Å²	45.1	30%	0.304	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-12.3	178.1	-54.9	174.2	0	0	0	113.2	G120 L123 L158 L159 R213	G120-L161 VanDerWaalsContact CA-CD1 3.47Å; G120-L161 WeakPolarHBondContact O-CD1 3.48Å; L123-L161 HydrophobicContact CB-CB 4.11Å; L123-L161 HydrophobicContact CB-CD1 4.36Å; L158-L161 HydrophobicContact CD2-CD1 4.3Å; L158-L161 WeakPolarHBondContact O-CB 3.5Å; L158-L161 PolarHBondContact O-N 3.35Å; L158-L161 VanDerWaalsContact O-N 3.11Å; L159-L161 PolarHBondContact O-N 3.24Å; L161-R213 PolarHBondContact O-NH2 3.08Å; L161-R213 VanDerWaalsContact O-NH2 3.16Å
162	V	92	Very high	89.2	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.229	C	C	.	.	S	Bend	trans	-85.7	132.4	172.7	-175	0	0	0	0	109.1	E133 V136 F137 L140 L159 L164 R209	E133-V162 HydrophobicContact CG-CG1 3.89Å; V136-V162 HydrophobicContact CG1-CG2 4.2Å; F137-V162 HydrophobicContact CB-CG1 4.23Å; L140-V162 HydrophobicContact CD2-CG2 3.98Å; L159-V162 HydrophobicContact CD1-CB 4.49Å; L159-V162 PolarHBondContact O-N 3.39Å; L159-V162 VanDerWaalsContact O-N 3.15Å; V162-L164 HydrophobicContact CB-CD2 4.43Å; V162-L164 HydrophobicContact CG1-CD2 4.11Å; V162-L164 PolarHBondContact O-N 3.42Å; V162-R209 PolarHBondContact O-NE 2.97Å; V162-R209 PolarHBondContact O-NH2 3.44Å
163	R	92	Very high	89.1	Confident	15 Å²	15	42.6 Å²	42.6	6%	0.057	23%	0.225	C	C	.	.			trans	-81.3	65.6	-175	-56.3	-174.4	-165.8	-174.5	0.1	111.9	D126 E133 P165 L166 R209 T211 P212 R213	D126-R163 IonicContact OD1-CZ 3.94Å; D126-R163 IonicContact OD1-NH1 4Å; D126-R163 PolarHBondContact OD1-NH1 2.83Å; D126-R163 IonicContact OD1-NH2 3.87Å; D126-R163 PolarHBondContact OD1-NH2 2.81Å; E133-R163 HydrophobicContact CG-CB 3.88Å; E133-R163 PolarHBondContact OE1-N 2.92Å; R163-P165 VanDerWaalsContact C-N 3.3Å; R163-L166 HydrophobicContact CB-CB 4.44Å; R163-L166 HydrophobicContact CB-CD1 3.78Å; R163-L166 HydrophobicContact CB-CG 4.14Å; R163-L166 WeakPolarHBondContact O-CB 3.38Å; R163-L166 PolarHBondContact O-N 3.24Å; R163-R209 WeakPolarHBondContact CB-O 3.41Å; R163-T211 WeakPolarHBondContact CD-O 3.43Å; R163-T211 PolarHBondContact NH1-O 3.31Å; R163-P212 PolarHBondContact NH1-O 3.33Å; R163-R213 VanDerWaalsContact NH1-CA 3.29Å
164	L	90.4	Very high	89	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-49.8	-38.8	-178.1	-57.9	-179.4	0	0	0	114.5	L159 V162 L166 L167 I172 V176 L188 A192	L159-L164 HydrophobicContact CD1-CD2 4.07Å; L159-L164 HydrophobicContact CD2-CD1 4.47Å; L159-L164 HydrophobicContact CG-CD1 4.26Å; V162-L164 HydrophobicContact CB-CD2 4.43Å; V162-L164 HydrophobicContact CG1-CD2 4.11Å; V162-L164 PolarHBondContact O-N 3.42Å; L164-L166 PolarHBondContact O-N 3.1Å; L164-L167 HydrophobicContact CD2-CD1 3.57Å; L164-L167 WeakPolarHBondContact O-CB 3.48Å; L164-L167 PolarHBondContact O-N 2.67Å; L164-I172 WeakPolarHBondContact O-CD1 3.31Å; L164-V176 HydrophobicContact CD1-CG1 4.15Å; L164-V176 HydrophobicContact CD2-CG1 4.16Å; L164-V176 HydrophobicContact CD2-CG2 4.16Å; L164-L188 HydrophobicContact CD1-CB 3.77Å; L164-A192 HydrophobicContact CB-CB 3.97Å
165	P	89.7	Confident	88.8	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.006	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-58.2	-19.1	176.2	-26	36	0	0	0	114.8	R163 A192 W195 H196 R209 T210	R163-P165 VanDerWaalsContact C-N 3.3Å; P165-A192 HydrophobicContact CG-CB 4.29Å; P165-W195 HydrophobicContact CB-CB 4Å; P165-W195 HydrophobicContact CB-CG 3.85Å; P165-W195 VanDerWaalsContact O-CD1 3.28Å; P165-H196 PolarHBondContact O-CE1 3.36Å; P165-H196 PolarHBondContact O-NE2 3.35Å; P165-R209 HydrophobicContact CG-CB 4.47Å; P165-T210 HydrophobicContact CB-CG2 3.92Å; P165-T210 HydrophobicContact CG-CG2 3.99Å
166	L	87.8	Confident	88.4	Confident	58 Å²	58	41.1 Å²	41.1	30%	0.304	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-94.2	-5.6	179.1	-55.8	-179.8	0	0	0	113.4	R163 L164 P212	R163-L166 HydrophobicContact CB-CB 4.44Å; R163-L166 HydrophobicContact CB-CD1 3.78Å; R163-L166 HydrophobicContact CB-CG 4.14Å; R163-L166 WeakPolarHBondContact O-CB 3.38Å; R163-L166 PolarHBondContact O-N 3.24Å; L164-L166 PolarHBondContact O-N 3.1Å; L166-P212 VanDerWaalsContact CD1-CA 3.44Å; L166-P212 HydrophobicContact CD1-CB 4.05Å; L166-P212 HydrophobicContact CD1-CG 4.06Å; L166-P212 HydrophobicContact CD2-CG 4.25Å
167	L	89.4	Confident	87.7	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.021	24%	0.235	C	C	.	.	S	Bend	trans	-78.9	154.3	173.2	-62.9	174.5	0	0	0	110.9	E133 Q134 L164 F171 I172 V176 H196	E133-L167 HydrophobicContact CB-CD2 3.74Å; E133-L167 HydrophobicContact CB-CG 4.42Å; E133-L167 HydrophobicContact CG-CD2 4.23Å; Q134-L167 HydrophobicContact CB-CD2 4.23Å; Q134-L167 HydrophobicContact CG-CD2 3.54Å; Q134-L167 VanDerWaalsContact N-CD2 3.33Å; L164-L167 HydrophobicContact CD2-CD1 3.57Å; L164-L167 WeakPolarHBondContact O-CB 3.48Å; L164-L167 PolarHBondContact O-N 2.67Å; L167-F171 HydrophobicContact CD1-CD1 4.06Å; L167-F171 HydrophobicContact CD1-CE1 4.2Å; L167-F171 HydrophobicContact CD2-CD1 4.34Å; L167-F171 HydrophobicContact CD2-CE1 4.48Å; L167-I172 HydrophobicContact CB-CD1 4.09Å; L167-I172 HydrophobicContact CB-CG1 3.81Å; L167-I172 HydrophobicContact CD1-CG1 4.44Å; L167-V176 HydrophobicContact CD1-CG2 4.38Å; L167-H196 PolarHBondContact O-CE1 3.2Å; L167-H196 PolarHBondContact O-NE2 2.88Å
168	Q	87.8	Confident	86.9	Confident	133 Å²	133	44.9 Å²	44.9	62%	0.621	24%	0.24	S	C	*	.			trans	-66.4	138.7	173.1	-68.7	-173.3	-14.6	0	0	110.9	A170 F171 I172	Q168-A170 VanDerWaalsContact C-N 3.3Å; Q168-A170 PolarHBondContact O-N 3.02Å; Q168-F171 HydrophobicContact CB-CB 4.47Å; Q168-F171 WeakPolarHBondContact O-CB 3.45Å; Q168-F171 PolarHBondContact O-N 3.25Å; Q168-I172 PolarHBondContact O-N 3.45Å
169	P	87.3	Confident	86.1	Confident	54 Å²	54	46.8 Å²	46.8	35%	0.351	25%	0.251	S	S	.	.	H	α-helix	trans	-54.6	-39.8	-178.4	-28.7	34.8	0	0	0	114.6	F171 I172 M173 F193 H196	P169-F171 VanDerWaalsContact C-N 3.33Å; P169-F171 PolarHBondContact O-N 2.94Å; P169-I172 PolarHBondContact O-N 3.23Å; P169-M173 PolarHBondContact O-N 2.83Å; P169-F193 HydrophobicContact CB-CE1 4.46Å; P169-H196 HydrophobicContact CG-CB 4.44Å
170	A	87.6	Confident	85	Confident	51 Å²	51	47 Å²	47	42%	0.421	25%	0.253	S	S	.	.	H	α-helix	trans	-59.9	-43.1	177.1	0	0	0	0	0	111.9	Q168 I172 M173 D174	Q168-A170 VanDerWaalsContact C-N 3.3Å; Q168-A170 PolarHBondContact O-N 3.02Å; A170-I172 VanDerWaalsContact C-N 3.34Å; A170-I172 PolarHBondContact O-N 3.3Å; A170-M173 PolarHBondContact O-N 3.38Å; A170-D174 WeakPolarHBondContact O-CB 3.1Å; A170-D174 VanDerWaalsContact O-CG 3.26Å; A170-D174 PolarHBondContact O-N 3.03Å
171	F	89.1	Confident	83.9	Confident	19 Å²	19	52.5 Å²	52.5	8%	0.083	28%	0.277	C	S	.	.	H	α-helix	trans	-65	-38.1	178.4	-174.1	-90.3	0	0	0	112.4	Q134 F137 H138 L167 Q168 P169 H175 V176	Q134-F171 HydrophobicContact CB-CE1 4.45Å; Q134-F171 HydrophobicContact CB-CE2 4.38Å; Q134-F171 HydrophobicContact CB-CZ 4.16Å; Q134-F171 HydrophobicContact CG-CD1 4.08Å; Q134-F171 HydrophobicContact CG-CD2 4.13Å; Q134-F171 HydrophobicContact CG-CE1 4.08Å; Q134-F171 HydrophobicContact CG-CE2 4.13Å; Q134-F171 HydrophobicContact CG-CG 4.1Å; Q134-F171 HydrophobicContact CG-CZ 4.1Å; F137-F171 HydrophobicContact CB-CE1 4.47Å; F137-F171 AromaticContact CD1-CE1 3.74Å; F137-F171 HydrophobicContact CD1-CE1 3.74Å; F137-F171 AromaticContact CD1-CZ 3.7Å; F137-F171 HydrophobicContact CD1-CZ 3.7Å; F137-F171 HydrophobicContact CE1-CE1 4.21Å; F137-F171 HydrophobicContact CE1-CZ 4.17Å; F137-F171 HydrophobicContact CG-CE1 4.17Å; F137-F171 HydrophobicContact CG-CZ 4.48Å; H138-F171 AromaticContact NE2-CE2 3.53Å; H138-F171 AromaticContact NE2-CZ 3.45Å; H138-F171 WeakPolarHBondContact NE2-CZ 3.45Å; L167-F171 HydrophobicContact CD1-CD1 4.06Å; L167-F171 HydrophobicContact CD1-CE1 4.2Å; L167-F171 HydrophobicContact CD2-CD1 4.34Å; L167-F171 HydrophobicContact CD2-CE1 4.48Å; Q168-F171 HydrophobicContact CB-CB 4.47Å; Q168-F171 WeakPolarHBondContact O-CB 3.45Å; Q168-F171 PolarHBondContact O-N 3.25Å; P169-F171 VanDerWaalsContact C-N 3.33Å; P169-F171 PolarHBondContact O-N 2.94Å; F171-H175 AromaticContact CD2-ND1 3.86Å; F171-H175 HydrophobicContact CE1-CB 4.29Å; F171-H175 HydrophobicContact CE2-CB 4.42Å; F171-H175 AromaticContact CE2-CG 3.95Å; F171-H175 AromaticContact CE2-ND1 3.98Å; F171-H175 HydrophobicContact CZ-CB 4.19Å; F171-H175 WeakPolarHBondContact O-CB 3.43Å; F171-H175 PolarHBondContact O-N 2.78Å; F171-V176 HydrophobicContact CE1-CG2 4.48Å
172	I	87	Confident	83.1	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.276	C	S	.	.	I	π-helix	trans	-62.4	-46.9	178.1	-60.8	170.6	0	0	0	110.4	L164 L167 Q168 P169 A170 V176 E177 V189 A192 F193	L164-I172 WeakPolarHBondContact O-CD1 3.31Å; L167-I172 HydrophobicContact CB-CD1 4.09Å; L167-I172 HydrophobicContact CB-CG1 3.81Å; L167-I172 HydrophobicContact CD1-CG1 4.44Å; Q168-I172 PolarHBondContact O-N 3.45Å; P169-I172 PolarHBondContact O-N 3.23Å; A170-I172 VanDerWaalsContact C-N 3.34Å; A170-I172 PolarHBondContact O-N 3.3Å; I172-V176 HydrophobicContact CG2-CB 4.27Å; I172-V176 WeakPolarHBondContact O-CB 3.39Å; I172-V176 PolarHBondContact O-N 2.91Å; I172-E177 PolarHBondContact O-N 2.77Å; I172-E177 VanDerWaalsContact O-N 3.09Å; I172-V189 HydrophobicContact CG2-CG1 3.98Å; I172-A192 HydrophobicContact CD1-CB 3.91Å; I172-F193 HydrophobicContact CB-CZ 4.41Å; I172-F193 HydrophobicContact CG2-CE2 4.1Å; I172-F193 HydrophobicContact CG2-CZ 4Å
173	M	84.2	Confident	82.5	Confident	94 Å²	94	57 Å²	57	46%	0.463	31%	0.306	S	S	.	.	I	π-helix	trans	-63	-48.9	177.6	-67.2	-171.1	-56.9	0	0	111.8	P169 A170 H175 F193	P169-M173 PolarHBondContact O-N 2.83Å; A170-M173 PolarHBondContact O-N 3.38Å; M173-H175 PolarHBondContact O-N 3.32Å; M173-F193 HydrophobicContact CG-CE1 4.16Å; M173-F193 HydrophobicContact CG-CZ 3.58Å; M173-F193 HydrophobicContact SD-CZ 4.47Å
174	D	84.9	Confident	82	Confident	99 Å²	99	61.6 Å²	61.6	53%	0.529	33%	0.328	S	S	.	.	I	π-helix	trans	-73	-32.7	-170.8	-67.9	-17.3	0	0	0	113.1	A170 N178	A170-D174 WeakPolarHBondContact O-CB 3.1Å; A170-D174 VanDerWaalsContact O-CG 3.26Å; A170-D174 PolarHBondContact O-N 3.03Å; D174-N178 PolarHBondContact O-ND2 2.74Å
175	H	83.2	Confident	81.6	Confident	84 Å²	84	61.7 Å²	61.7	39%	0.389	33%	0.329	S	S	.	.	I	π-helix	trans	-118.4	-44.1	-169	-63.2	71.6	0	0	0	113.3	F137 F171 M173 V179	F137-H175 HydrophobicContact CE1-CB 4.03Å; F137-H175 HydrophobicContact CZ-CB 4.41Å; F171-H175 AromaticContact CD2-ND1 3.86Å; F171-H175 HydrophobicContact CE1-CB 4.29Å; F171-H175 HydrophobicContact CE2-CB 4.42Å; F171-H175 AromaticContact CE2-CG 3.95Å; F171-H175 AromaticContact CE2-ND1 3.98Å; F171-H175 HydrophobicContact CZ-CB 4.19Å; F171-H175 WeakPolarHBondContact O-CB 3.43Å; F171-H175 PolarHBondContact O-N 2.78Å; M173-H175 PolarHBondContact O-N 3.32Å; H175-V179 WeakPolarHBondContact O-CG2 3.42Å
176	V	80	Confident	81.3	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	35%	0.35	C	S	.	.	I	π-helix	trans	-77.4	-46.7	-172.3	-175.6	0	0	0	0	109.9	F137 L159 L164 L167 F171 I172 N178 V179 C180 V189	F137-V176 HydrophobicContact CD2-CG2 4.25Å; F137-V176 HydrophobicContact CE2-CB 4.48Å; F137-V176 HydrophobicContact CE2-CG2 3.83Å; F137-V176 HydrophobicContact CZ-CG2 4.04Å; L159-V176 HydrophobicContact CD2-CG1 4.17Å; L164-V176 HydrophobicContact CD1-CG1 4.15Å; L164-V176 HydrophobicContact CD2-CG1 4.16Å; L164-V176 HydrophobicContact CD2-CG2 4.16Å; L167-V176 HydrophobicContact CD1-CG2 4.38Å; F171-V176 HydrophobicContact CE1-CG2 4.48Å; I172-V176 HydrophobicContact CG2-CB 4.27Å; I172-V176 WeakPolarHBondContact O-CB 3.39Å; I172-V176 PolarHBondContact O-N 2.91Å; V176-N178 VanDerWaalsContact C-N 3.28Å; V176-N178 PolarHBondContact O-N 2.99Å; V176-V179 PolarHBondContact O-N 3.46Å; V176-V179 VanDerWaalsContact O-N 3.08Å; V176-C180 PolarHBondContact O-N 3.33Å; V176-C180 PolarHBondContact O-SG 3.17Å; V176-V189 HydrophobicContact CG1-CG2 3.84Å
177	E	75.4	Confident	81.3	Confident	110 Å²	110	69.4 Å²	69.4	51%	0.514	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-57.8	-40.3	-178.7	-166.7	169.6	-175.7	0	0	112.5	I172 V179 C180	I172-E177 PolarHBondContact O-N 2.77Å; I172-E177 VanDerWaalsContact O-N 3.09Å; E177-V179 PolarHBondContact O-N 3.43Å; E177-C180 PolarHBondContact O-N 2.93Å; E177-C180 VanDerWaalsContact O-N 3.11Å
178	N	73.9	Confident	81.2	Confident	124 Å²	124	70.3 Å²	70.3	66%	0.663	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-64.4	-22.2	179.1	-74.6	-34.2	0	0	0	114.7	D174 V176	D174-N178 PolarHBondContact O-ND2 2.74Å; V176-N178 VanDerWaalsContact C-N 3.28Å; V176-N178 PolarHBondContact O-N 2.99Å
179	V	73.3	Confident	81.2	Confident	43 Å²	43	64.6 Å²	64.6	26%	0.261	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-94.9	-17.3	179	-179	0	0	0	0	111	M141 I155 H175 V176 E177 N181	M141-V179 HydrophobicContact CE-CB 4.39Å; M141-V179 HydrophobicContact CE-CG1 3.74Å; M141-V179 HydrophobicContact CE-CG2 3.67Å; M141-V179 HydrophobicContact SD-CG1 3.96Å; M141-V179 HydrophobicContact SD-CG2 4.27Å; I155-V179 HydrophobicContact CD1-CG1 4.03Å; I155-V179 HydrophobicContact CG2-CG1 4.1Å; H175-V179 WeakPolarHBondContact O-CG2 3.42Å; V176-V179 PolarHBondContact O-N 3.46Å; V176-V179 VanDerWaalsContact O-N 3.08Å; E177-V179 PolarHBondContact O-N 3.43Å; V179-N181 PolarHBondContact O-N 3.25Å
180	C	68.3	Low	81.2	Confident	6 Å²	6	67.7 Å²	67.7	4%	0.041	35%	0.354	C	S	.	.			trans	-95.5	71.2	-168.8	-67.8	0	0	0	0	112.5	L159 V176 E177 A182 C185	L159-C180 WeakPolarHBondContact CD2-SG 3.42Å; V176-C180 PolarHBondContact O-N 3.33Å; V176-C180 PolarHBondContact O-SG 3.17Å; E177-C180 PolarHBondContact O-N 2.93Å; E177-C180 VanDerWaalsContact O-N 3.11Å; C180-A182 VanDerWaalsContact C-N 3.34Å; C180-C185 HydrophobicContact CB-CB 3.39Å; C180-C185 WeakPolarHBondContact SG-CB 3.48Å
181	N	67.6	Low	81.3	Confident	149 Å²	149	67.8 Å²	67.8	80%	0.797	35%	0.345	S	S	*	.			trans	-79.2	-16.3	175.4	-70.6	-25	0	0	0	113.9	V179	V179-N181 PolarHBondContact O-N 3.25Å
182	A	73.9	Confident	81.3	Confident	33 Å²	33	66.9 Å²	66.9	27%	0.273	34%	0.341	S	S	.	.	S	Bend	trans	-89.1	147	-178.6	0	0	0	0	0	112.2	P156 C180 E184 C185 Q186	P156-A182 HydrophobicContact CG-CB 4.22Å; C180-A182 VanDerWaalsContact C-N 3.34Å; A182-E184 VanDerWaalsContact C-N 3.25Å; A182-E184 PolarHBondContact O-N 2.98Å; A182-C185 PolarHBondContact O-N 3.46Å; A182-C185 VanDerWaalsContact O-N 3.17Å; A182-Q186 PolarHBondContact O-N 3.43Å
183	N	79.2	Confident	81.4	Confident	120 Å²	120	69.5 Å²	69.5	64%	0.642	35%	0.353	S	S	*	.	H	α-helix	trans	-59.1	-35.9	179	-75.3	-11	0	0	0	112	C185 Q186 Q187	N183-C185 PolarHBondContact O-N 3.48Å; N183-Q186 PolarHBondContact O-N 2.91Å; N183-Q187 PolarHBondContact O-N 2.84Å
184	E	81.1	Confident	81.6	Confident	111 Å²	111	70.2 Å²	70.2	52%	0.519	35%	0.353	S	S	.	.	H	α-helix	trans	-62.4	-43.8	178.1	-62	88.6	176.1	0	0	111.2	P156 A182 Q186 Q187 L188	P156-E184 HydrophobicContact CB-CB 4.21Å; A182-E184 VanDerWaalsContact C-N 3.25Å; A182-E184 PolarHBondContact O-N 2.98Å; E184-Q186 VanDerWaalsContact C-N 3.33Å; E184-Q186 PolarHBondContact O-N 3.33Å; E184-Q187 WeakPolarHBondContact O-CB 3.37Å; E184-Q187 PolarHBondContact O-N 2.73Å; E184-L188 WeakPolarHBondContact O-CG 3.19Å; E184-L188 PolarHBondContact O-N 3.48Å
185	C	82	Confident	81.7	Confident	2 Å²	2	66.9 Å²	66.9	1%	0.014	33%	0.333	C	S	.	.	H	α-helix	trans	-65.1	-37.3	180	-64.7	0	0	0	0	112.5	P156 L159 C180 A182 N183 Q187 L188 V189	P156-C185 VanDerWaalsContact CA-SG 3.56Å; L159-C185 HydrophobicContact CD2-CB 4.41Å; C180-C185 HydrophobicContact CB-CB 3.39Å; C180-C185 WeakPolarHBondContact SG-CB 3.48Å; A182-C185 PolarHBondContact O-N 3.46Å; A182-C185 VanDerWaalsContact O-N 3.17Å; N183-C185 PolarHBondContact O-N 3.48Å; C185-Q187 VanDerWaalsContact C-N 3.27Å; C185-Q187 PolarHBondContact O-N 3.29Å; C185-L188 WeakPolarHBondContact O-CB 3.49Å; C185-L188 PolarHBondContact O-N 3.07Å; C185-L188 VanDerWaalsContact O-N 3.12Å; C185-V189 PolarHBondContact O-N 2.84Å; C185-V189 VanDerWaalsContact O-N 3.1Å
186	Q	84	Confident	81.8	Confident	95 Å²	95	65.5 Å²	65.5	44%	0.444	33%	0.327	S	S	.	.	H	α-helix	trans	-62.2	-35.3	175.5	-68.5	-178.6	-9	0	0	112	A182 N183 E184 L188 V189 M190	A182-Q186 PolarHBondContact O-N 3.43Å; N183-Q186 PolarHBondContact O-N 2.91Å; E184-Q186 VanDerWaalsContact C-N 3.33Å; E184-Q186 PolarHBondContact O-N 3.33Å; Q186-L188 VanDerWaalsContact C-N 3.3Å; Q186-L188 PolarHBondContact O-N 2.97Å; Q186-V189 PolarHBondContact O-N 3.46Å; Q186-M190 WeakPolarHBondContact O-CB 3.44Å; Q186-M190 WeakPolarHBondContact O-CG 3.37Å; Q186-M190 PolarHBondContact O-N 3.49Å
187	Q	87.7	Confident	82.2	Confident	126 Å²	126	71.9 Å²	71.9	59%	0.589	36%	0.361	S	S	*	.	H	α-helix	trans	-62.4	-39	174.1	-66.8	178.7	-4.6	0	0	111.9	N183 E184 C185 M190 E191	N183-Q187 PolarHBondContact O-N 2.84Å; E184-Q187 WeakPolarHBondContact O-CB 3.37Å; E184-Q187 PolarHBondContact O-N 2.73Å; C185-Q187 VanDerWaalsContact C-N 3.27Å; C185-Q187 PolarHBondContact O-N 3.29Å; Q187-M190 HydrophobicContact CG-CE 4.15Å; Q187-M190 PolarHBondContact O-N 2.96Å; Q187-E191 PolarHBondContact O-N 2.86Å
188	L	87.7	Confident	82.6	Confident	24 Å²	24	70 Å²	70	13%	0.126	35%	0.353	C	S	.	.	H	α-helix	trans	-66.9	-39.2	177.6	-47.3	-175.9	0	0	0	112.1	L159 A160 L164 E184 C185 Q186 E191 A192	L159-L188 HydrophobicContact CB-CD1 4.42Å; L159-L188 HydrophobicContact CD2-CD1 4.45Å; L159-L188 HydrophobicContact CG-CD1 4.33Å; A160-L188 HydrophobicContact CB-CD1 4.06Å; L164-L188 HydrophobicContact CD1-CB 3.77Å; E184-L188 WeakPolarHBondContact O-CG 3.19Å; E184-L188 PolarHBondContact O-N 3.48Å; C185-L188 WeakPolarHBondContact O-CB 3.49Å; C185-L188 PolarHBondContact O-N 3.07Å; C185-L188 VanDerWaalsContact O-N 3.12Å; Q186-L188 VanDerWaalsContact C-N 3.3Å; Q186-L188 PolarHBondContact O-N 2.97Å; L188-E191 WeakPolarHBondContact O-CB 3.34Å; L188-E191 PolarHBondContact O-N 2.72Å; L188-A192 PolarHBondContact O-N 2.89Å; L188-A192 VanDerWaalsContact O-N 3.1Å
189	V	88.1	Confident	82.7	Confident	12 Å²	12	67.7 Å²	67.7	7%	0.073	34%	0.344	C	S	.	.	H	α-helix	trans	-66.5	-44	176	173.6	0	0	0	0	110.7	I172 V176 C185 Q186 E191 A192 F193	I172-V189 HydrophobicContact CG2-CG1 3.98Å; V176-V189 HydrophobicContact CG1-CG2 3.84Å; C185-V189 PolarHBondContact O-N 2.84Å; C185-V189 VanDerWaalsContact O-N 3.1Å; Q186-V189 PolarHBondContact O-N 3.46Å; V189-E191 VanDerWaalsContact C-N 3.34Å; V189-E191 PolarHBondContact O-N 2.94Å; V189-A192 PolarHBondContact O-N 3.38Å; V189-F193 HydrophobicContact CG1-CD2 3.67Å; V189-F193 HydrophobicContact CG1-CE2 3.36Å; V189-F193 HydrophobicContact CG1-CZ 4.49Å; V189-F193 VanDerWaalsContact O-CD2 3.26Å; V189-F193 WeakPolarHBondContact O-CD2 3.27Å; V189-F193 PolarHBondContact O-N 2.79Å
190	M	87.5	Confident	82.6	Confident	119 Å²	119	74.5 Å²	74.5	59%	0.586	37%	0.373	S	S	*	.	H	α-helix	trans	-61.5	-40.2	175.1	-74.5	-170.7	-70.3	0	0	112.5	Q186 Q187 F193 K194	Q186-M190 WeakPolarHBondContact O-CB 3.44Å; Q186-M190 WeakPolarHBondContact O-CG 3.37Å; Q186-M190 PolarHBondContact O-N 3.49Å; Q187-M190 HydrophobicContact CG-CE 4.15Å; Q187-M190 PolarHBondContact O-N 2.96Å; M190-F193 PolarHBondContact O-N 2.96Å; M190-K194 WeakPolarHBondContact O-CB 3.5Å; M190-K194 PolarHBondContact O-N 3.24Å
191	E	89.9	Confident	83	Confident	53 Å²	53	80.8 Å²	80.8	25%	0.248	40%	0.396	C	S	.	.	H	α-helix	trans	-57.1	-49.2	173.1	-177.1	-170.7	-177.7	0	0	110.9	Q187 L188 V189 F193 K194 W195 T207 R209	Q187-E191 PolarHBondContact O-N 2.86Å; L188-E191 WeakPolarHBondContact O-CB 3.34Å; L188-E191 PolarHBondContact O-N 2.72Å; V189-E191 VanDerWaalsContact C-N 3.34Å; V189-E191 PolarHBondContact O-N 2.94Å; E191-F193 PolarHBondContact O-N 3.35Å; E191-K194 WeakPolarHBondContact O-CB 3.4Å; E191-K194 PolarHBondContact O-N 2.84Å; E191-W195 PolarHBondContact O-N 3.39Å; E191-T207 PolarHBondContact OE1-OG1 3.07Å; E191-R209 IonicContact OE2-NH1 2.71Å
192	A	88.2	Confident	83.5	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-62.5	-43.3	-179.8	0	0	0	0	0	112.5	L164 P165 I172 L188 V189 W195 H196	L164-A192 HydrophobicContact CB-CB 3.97Å; P165-A192 HydrophobicContact CG-CB 4.29Å; I172-A192 HydrophobicContact CD1-CB 3.91Å; L188-A192 PolarHBondContact O-N 2.89Å; L188-A192 VanDerWaalsContact O-N 3.1Å; V189-A192 PolarHBondContact O-N 3.38Å; A192-W195 WeakPolarHBondContact O-CB 3.46Å; A192-W195 PolarHBondContact O-N 2.92Å; A192-H196 PolarHBondContact O-CD2 3.37Å; A192-H196 PolarHBondContact O-N 3.18Å
193	F	88.6	Confident	83.4	Confident	56 Å²	56	81.3 Å²	81.3	25%	0.246	40%	0.395	C	S	.	.	H	α-helix	trans	-64.8	-40.4	175	-77.1	-60	0	0	0	112.5	P169 I172 M173 V189 M190 E191 W195 H196 L197	P169-F193 HydrophobicContact CB-CE1 4.46Å; I172-F193 HydrophobicContact CB-CZ 4.41Å; I172-F193 HydrophobicContact CG2-CE2 4.1Å; I172-F193 HydrophobicContact CG2-CZ 4Å; M173-F193 HydrophobicContact CG-CE1 4.16Å; M173-F193 HydrophobicContact CG-CZ 3.58Å; M173-F193 HydrophobicContact SD-CZ 4.47Å; V189-F193 HydrophobicContact CG1-CD2 3.67Å; V189-F193 HydrophobicContact CG1-CE2 3.36Å; V189-F193 HydrophobicContact CG1-CZ 4.49Å; V189-F193 VanDerWaalsContact O-CD2 3.26Å; V189-F193 WeakPolarHBondContact O-CD2 3.27Å; V189-F193 PolarHBondContact O-N 2.79Å; M190-F193 PolarHBondContact O-N 2.96Å; E191-F193 PolarHBondContact O-N 3.35Å; F193-W195 VanDerWaalsContact C-N 3.26Å; F193-W195 PolarHBondContact O-N 2.84Å; F193-H196 PolarHBondContact O-N 2.99Å; F193-H196 VanDerWaalsContact O-N 3.16Å; F193-L197 WeakPolarHBondContact O-CB 3.24Å; F193-L197 VanDerWaalsContact O-CG 3.26Å; F193-L197 WeakPolarHBondContact O-CG 3.49Å; F193-L197 PolarHBondContact O-N 3.45Å
194	K	88.8	Confident	83.2	Confident	108 Å²	108	85.4 Å²	85.4	47%	0.47	40%	0.401	S	S	.	.	H	α-helix	trans	-59.8	-38.2	176.2	-174.2	-178.6	179.3	-174.7	0	111.8	M190 E191 L197 M198 I205	M190-K194 WeakPolarHBondContact O-CB 3.5Å; M190-K194 PolarHBondContact O-N 3.24Å; E191-K194 WeakPolarHBondContact O-CB 3.4Å; E191-K194 PolarHBondContact O-N 2.84Å; K194-L197 PolarHBondContact O-N 3.48Å; K194-M198 HydrophobicContact CG-SD 4.29Å; K194-M198 PolarHBondContact O-N 3.17Å; K194-M198 VanDerWaalsContact O-N 3.15Å; K194-I205 HydrophobicContact CG-CD1 4.48Å
195	W	86.6	Confident	83.2	Confident	29 Å²	29	81.9 Å²	81.9	11%	0.11	39%	0.386	C	S	.	.	H	α-helix	trans	-62.6	-41	175	179.7	-102.2	0	0	0	113.2	P165 E191 A192 F193 R202 I205 A206 T210	P165-W195 HydrophobicContact CB-CB 4Å; P165-W195 HydrophobicContact CB-CG 3.85Å; P165-W195 VanDerWaalsContact O-CD1 3.28Å; E191-W195 PolarHBondContact O-N 3.39Å; A192-W195 WeakPolarHBondContact O-CB 3.46Å; A192-W195 PolarHBondContact O-N 2.92Å; F193-W195 VanDerWaalsContact C-N 3.26Å; F193-W195 PolarHBondContact O-N 2.84Å; W195-R202 HydrophobicContact CD2-CG 4.14Å; W195-R202 HydrophobicContact CE3-CB 4.41Å; W195-R202 HydrophobicContact CE3-CG 3.93Å; W195-R202 HydrophobicContact CH2-CB 3.61Å; W195-R202 HydrophobicContact CH2-CG 3.65Å; W195-R202 HydrophobicContact CZ2-CB 4.26Å; W195-R202 HydrophobicContact CZ2-CG 3.86Å; W195-R202 HydrophobicContact CZ3-CB 3.7Å; W195-R202 HydrophobicContact CZ3-CG 3.68Å; W195-R202 WeakPolarHBondContact CZ3-O 3.46Å; W195-I205 HydrophobicContact CE3-CD1 3.84Å; W195-I205 HydrophobicContact CE3-CG1 3.76Å; W195-I205 HydrophobicContact CZ3-CD1 4.49Å; W195-I205 HydrophobicContact CZ3-CG1 3.98Å; W195-A206 HydrophobicContact CH2-CB 4.41Å; W195-A206 HydrophobicContact CZ3-CB 4.16Å; W195-T210 HydrophobicContact CD2-CG2 3.76Å; W195-T210 HydrophobicContact CE3-CG2 3.5Å; W195-T210 VanDerWaalsContact CE3-CG2 3.5Å; W195-T210 HydrophobicContact CG-CG2 4.38Å; W195-T210 HydrophobicContact CH2-CG2 4.15Å; W195-T210 HydrophobicContact CZ2-CG2 4.38Å; W195-T210 HydrophobicContact CZ3-CG2 3.72Å
196	H	86.7	Confident	83	Confident	55 Å²	55	84.6 Å²	84.6	26%	0.255	41%	0.408	S	S	.	.	H	α-helix	trans	-72.5	-38	177.1	-74.1	-59.6	0	0	0	112.9	P165 L167 P169 A192 F193	P165-H196 PolarHBondContact O-CE1 3.36Å; P165-H196 PolarHBondContact O-NE2 3.35Å; L167-H196 PolarHBondContact O-CE1 3.2Å; L167-H196 PolarHBondContact O-NE2 2.88Å; P169-H196 HydrophobicContact CG-CB 4.44Å; A192-H196 PolarHBondContact O-CD2 3.37Å; A192-H196 PolarHBondContact O-N 3.18Å; F193-H196 PolarHBondContact O-N 2.99Å; F193-H196 VanDerWaalsContact O-N 3.16Å
197	L	87.3	Confident	83.1	Confident	135 Å²	135	82.8 Å²	82.8	71%	0.707	40%	0.403	S	S	*	.	H	α-helix	trans	-77.6	-18.5	-177.1	-69.4	170.2	0	0	0	114.1	F193 K194	F193-L197 WeakPolarHBondContact O-CB 3.24Å; F193-L197 VanDerWaalsContact O-CG 3.26Å; F193-L197 WeakPolarHBondContact O-CG 3.49Å; F193-L197 PolarHBondContact O-N 3.45Å; K194-L197 PolarHBondContact O-N 3.48Å
198	M	84.2	Confident	82.8	Confident	71 Å²	71	85 Å²	85	35%	0.35	41%	0.414	S	S	.	.			trans	-126.3	66.2	-175.8	-58	-171.2	-177.1	0	0	114.2	K194 E200 R201 I205	K194-M198 HydrophobicContact CG-SD 4.29Å; K194-M198 PolarHBondContact O-N 3.17Å; K194-M198 VanDerWaalsContact O-N 3.15Å; M198-E200 VanDerWaalsContact C-N 3.31Å; M198-E200 PolarHBondContact O-N 3.47Å; M198-R201 HydrophobicContact CB-CB 4.23Å; M198-R201 PolarHBondContact O-N 2.91Å; M198-R201 VanDerWaalsContact O-N 3.15Å; M198-I205 HydrophobicContact CB-CD1 4.4Å
199	P	75.3	Confident	82.7	Confident	75 Å²	75	85.4 Å²	85.4	49%	0.487	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-57.1	-40.2	-179.9	-23.7	33.7	0	0	0	114	R201 R202	P199-R201 PolarHBondContact O-N 3.18Å; P199-R202 WeakPolarHBondContact O-CB 3.16Å; P199-R202 VanDerWaalsContact O-CG 3.3Å; P199-R202 WeakPolarHBondContact O-CG 3.23Å; P199-R202 PolarHBondContact O-N 3.43Å
200	E	71.8	Confident	82.5	Confident	186 Å²	186	85.3 Å²	85.3	87%	0.869	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-66.3	-22	-178.2	-61.6	176.9	178	0	0	113.4	M198	M198-E200 VanDerWaalsContact C-N 3.31Å; M198-E200 PolarHBondContact O-N 3.47Å
201	R	76.3	Confident	82.4	Confident	138 Å²	138	81.8 Å²	81.8	52%	0.521	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-104.5	5.4	-176.3	-61.4	-177.1	-179.5	-176.9	0.2	113.2	M198 P199 S203 R204 I205	M198-R201 HydrophobicContact CB-CB 4.23Å; M198-R201 PolarHBondContact O-N 2.91Å; M198-R201 VanDerWaalsContact O-N 3.15Å; P199-R201 PolarHBondContact O-N 3.18Å; R201-S203 PolarHBondContact O-N 2.96Å; R201-S203 VanDerWaalsContact O-N 3.15Å; R201-R204 WeakPolarHBondContact O-CB 3.02Å; R201-R204 PolarHBondContact O-N 3.33Å; R201-I205 WeakPolarHBondContact O-CG1 3.49Å; R201-I205 PolarHBondContact O-N 2.82Å
202	R	79.3	Confident	82.2	Confident	96 Å²	96	81.5 Å²	81.5	36%	0.362	40%	0.401	S	S	.	.	H	α-helix	trans	-51.7	-39.2	-176.4	-78.5	179.5	176.4	173.6	1.4	113.3	W195 P199 R204 I205 A206	W195-R202 HydrophobicContact CD2-CG 4.14Å; W195-R202 HydrophobicContact CE3-CB 4.41Å; W195-R202 HydrophobicContact CE3-CG 3.93Å; W195-R202 HydrophobicContact CH2-CB 3.61Å; W195-R202 HydrophobicContact CH2-CG 3.65Å; W195-R202 HydrophobicContact CZ2-CB 4.26Å; W195-R202 HydrophobicContact CZ2-CG 3.86Å; W195-R202 HydrophobicContact CZ3-CB 3.7Å; W195-R202 HydrophobicContact CZ3-CG 3.68Å; W195-R202 WeakPolarHBondContact CZ3-O 3.46Å; P199-R202 WeakPolarHBondContact O-CB 3.16Å; P199-R202 VanDerWaalsContact O-CG 3.3Å; P199-R202 WeakPolarHBondContact O-CG 3.23Å; P199-R202 PolarHBondContact O-N 3.43Å; R202-R204 PolarHBondContact O-N 3Å; R202-R204 VanDerWaalsContact O-N 3.15Å; R202-I205 PolarHBondContact O-N 3.3Å; R202-A206 WeakPolarHBondContact O-CB 3.49Å; R202-A206 PolarHBondContact O-N 2.86Å
203	S	71	Confident	82.2	Confident	96 Å²	96	81.5 Å²	81.5	67%	0.671	40%	0.401	S	S	*	.	H	α-helix	trans	-59.3	-26.1	176.2	56	0	0	0	0	114.4	R201	R201-S203 PolarHBondContact O-N 2.96Å; R201-S203 VanDerWaalsContact O-N 3.15Å
204	R	74.8	Confident	82.1	Confident	207 Å²	207	81.7 Å²	81.7	78%	0.781	40%	0.402	S	S	*	.	H	α-helix	trans	-96.3	-21.4	-179.4	-67.9	177.9	58.9	-175.9	-0.9	114.1	R201 R202	R201-R204 WeakPolarHBondContact O-CB 3.02Å; R201-R204 PolarHBondContact O-N 3.33Å; R202-R204 PolarHBondContact O-N 3Å; R202-R204 VanDerWaalsContact O-N 3.15Å
205	I	81.5	Confident	81.9	Confident	37 Å²	37	76.7 Å²	76.7	19%	0.19	38%	0.38	C	S	.	.	H	α-helix	trans	-109.3	3.7	-178.1	63.2	170.5	0	0	0	112.3	K194 W195 M198 R201 R202 T207	K194-I205 HydrophobicContact CG-CD1 4.48Å; W195-I205 HydrophobicContact CE3-CD1 3.84Å; W195-I205 HydrophobicContact CE3-CG1 3.76Å; W195-I205 HydrophobicContact CZ3-CD1 4.49Å; W195-I205 HydrophobicContact CZ3-CG1 3.98Å; M198-I205 HydrophobicContact CB-CD1 4.4Å; R201-I205 WeakPolarHBondContact O-CG1 3.49Å; R201-I205 PolarHBondContact O-N 2.82Å; R202-I205 PolarHBondContact O-N 3.3Å; I205-T207 PolarHBondContact O-N 3.07Å
206	A	78.8	Confident	81.8	Confident	58 Å²	58	77.1 Å²	77.1	48%	0.479	39%	0.386	S	S	.	.			trans	-63.6	131.6	177.7	0	0	0	0	0	110.7	W195 R202 T210	W195-A206 HydrophobicContact CH2-CB 4.41Å; W195-A206 HydrophobicContact CZ3-CB 4.16Å; R202-A206 WeakPolarHBondContact O-CB 3.49Å; R202-A206 PolarHBondContact O-N 2.86Å; A206-T210 WeakPolarHBondContact CA-OG1 3.45Å
207	T	84.1	Confident	81.7	Confident	57 Å²	57	75.6 Å²	75.6	35%	0.35	38%	0.381	S	S	.	.			trans	-126.7	170.5	173.1	63.2	0	0	0	0	108.9	E191 I205 R209 T210	E191-T207 PolarHBondContact OE1-OG1 3.07Å; I205-T207 PolarHBondContact O-N 3.07Å; T207-R209 PolarHBondContact O-N 3.16Å; T207-R209 PolarHBondContact OG1-N 3.07Å; T207-T210 PolarHBondContact N-OG1 3.02Å; T207-T210 PolarHBondContact O-N 3.21Å; T207-T210 PolarHBondContact O-OG1 3.3Å
208	E	81.9	Confident	81.7	Confident	173 Å²	173	69.2 Å²	69.2	81%	0.808	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-56.6	-21.9	172.9	-63.7	-175.9	166.9	0	0	112.7	T210 T211	E208-T210 VanDerWaalsContact C-N 3.3Å; E208-T211 PolarHBondContact O-OG1 3.41Å
209	R	85.8	Confident	82.1	Confident	33 Å²	33	69 Å²	69	13%	0.125	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-81.4	-10.5	176.8	-61.3	-176.2	65.3	172.4	6.2	114	L159 A160 V162 R163 P165 E191 T207	L159-R209 PolarHBondContact O-NH2 3.23Å; A160-R209 VanDerWaalsContact O-CD 3.3Å; A160-R209 WeakPolarHBondContact O-CD 3.41Å; A160-R209 PolarHBondContact O-NE 2.78Å; V162-R209 PolarHBondContact O-NE 2.97Å; V162-R209 PolarHBondContact O-NH2 3.44Å; R163-R209 WeakPolarHBondContact CB-O 3.41Å; P165-R209 HydrophobicContact CG-CB 4.47Å; E191-R209 IonicContact OE2-NH1 2.71Å; T207-R209 PolarHBondContact O-N 3.16Å; T207-R209 PolarHBondContact OG1-N 3.07Å
210	T	84.7	Confident	83	Confident	10 Å²	10	65.4 Å²	65.4	6%	0.061	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-96.7	-4.6	177.2	65.6	0	0	0	0	112.6	P165 W195 A206 T207 E208	P165-T210 HydrophobicContact CB-CG2 3.92Å; P165-T210 HydrophobicContact CG-CG2 3.99Å; W195-T210 HydrophobicContact CD2-CG2 3.76Å; W195-T210 HydrophobicContact CE3-CG2 3.5Å; W195-T210 VanDerWaalsContact CE3-CG2 3.5Å; W195-T210 HydrophobicContact CG-CG2 4.38Å; W195-T210 HydrophobicContact CH2-CG2 4.15Å; W195-T210 HydrophobicContact CZ2-CG2 4.38Å; W195-T210 HydrophobicContact CZ3-CG2 3.72Å; A206-T210 WeakPolarHBondContact CA-OG1 3.45Å; T207-T210 PolarHBondContact N-OG1 3.02Å; T207-T210 PolarHBondContact O-N 3.21Å; T207-T210 PolarHBondContact O-OG1 3.3Å; E208-T210 VanDerWaalsContact C-N 3.3Å
211	T	85.3	Confident	84.1	Confident	44 Å²	44	56.5 Å²	56.5	27%	0.27	28%	0.278	S	S	.	.	S	Bend	trans	-90.4	124.5	176	58.4	0	0	0	0	110.1	R163 E208	R163-T211 WeakPolarHBondContact CD-O 3.43Å; R163-T211 PolarHBondContact NH1-O 3.31Å; E208-T211 PolarHBondContact O-OG1 3.41Å
212	P	86.1	Confident	85	Confident	48 Å²	48	50 Å²	50	31%	0.312	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-63.2	149	177.6	-22.8	33.6	0	0	0	113.4	R163 L166 V217	R163-P212 PolarHBondContact NH1-O 3.33Å; L166-P212 VanDerWaalsContact CD1-CA 3.44Å; L166-P212 HydrophobicContact CD1-CB 4.05Å; L166-P212 HydrophobicContact CD1-CG 4.06Å; L166-P212 HydrophobicContact CD2-CG 4.25Å; P212-V217 HydrophobicContact CB-CB 4.16Å; P212-V217 HydrophobicContact CB-CG2 4.46Å
213	R	88.3	Confident	85.7	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-62	155.8	171.1	-66.1	-178.6	-166.1	-87.4	-1.2	109.6	L123 S125 E133 L161 R163 S215 T216 V217	L123-R213 PolarHBondContact O-NH1 3.39Å; L123-R213 PolarHBondContact O-NH2 3.24Å; L123-R213 VanDerWaalsContact O-NH2 3.11Å; S125-R213 PolarHBondContact O-NH1 3.43Å; E133-R213 IonicContact OE1-CZ 2.85Å; E133-R213 IonicContact OE1-NE 2.81Å; E133-R213 PolarHBondContact OE1-NE 3.2Å; E133-R213 IonicContact OE1-NH2 3.42Å; E133-R213 PolarHBondContact OE1-NH2 3.27Å; E133-R213 WeakPolarHBondContact OE2-CD 3.29Å; E133-R213 IonicContact OE2-CZ 3.16Å; E133-R213 IonicContact OE2-NE 2.72Å; E133-R213 PolarHBondContact OE2-NE 3.33Å; E133-R213 IonicContact OE2-NH2 3.2Å; L161-R213 PolarHBondContact O-NH2 3.08Å; L161-R213 VanDerWaalsContact O-NH2 3.16Å; R163-R213 VanDerWaalsContact NH1-CA 3.29Å; R213-S215 PolarHBondContact O-N 2.68Å; R213-S215 VanDerWaalsContact O-N 3.1Å; R213-T216 PolarHBondContact N-OG1 3.01Å; R213-T216 PolarHBondContact O-N 3.05Å; R213-T216 PolarHBondContact O-OG1 2.6Å; R213-T216 VanDerWaalsContact O-OG1 3.05Å; R213-V217 PolarHBondContact O-N 3.2Å
214	K	85.6	Confident	86.6	Confident	59 Å²	59	40.8 Å²	40.8	26%	0.257	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-25.4	178.9	-61.4	-174.5	-160.9	159.1	0	112.5	D126 D127 P240 R241	D126-K214 PolarHBondContact O-N 3.25Å; D127-K214 VanDerWaalsContact OD1-CD 3.27Å; D127-K214 WeakPolarHBondContact OD1-CD 3.29Å; D127-K214 WeakPolarHBondContact OD1-CE 3.45Å; D127-K214 IonicContact OD1-NZ 2.83Å; D127-K214 PolarHBondContact OD1-NZ 3.06Å; D127-K214 IonicContact OD2-NZ 3.77Å; K214-P240 WeakPolarHBondContact O-CG 3.43Å; K214-R241 HydrophobicContact CB-CB 3.9Å; K214-R241 HydrophobicContact CB-CG 4.44Å
215	S	83.9	Confident	87.2	Confident	3 Å²	3	31 Å²	31	2%	0.021	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-33.2	173.6	52.5	0	0	0	0	113.3	L128 R213 N506	L128-S215 WeakPolarHBondContact O-CB 3.5Å; L128-S215 PolarHBondContact O-OG 2.95Å; R213-S215 PolarHBondContact O-N 2.68Å; R213-S215 VanDerWaalsContact O-N 3.1Å; S215-N506 WeakPolarHBondContact O-CB 3.24Å; S215-N506 PolarHBondContact O-ND2 2.87Å
216	T	84.3	Confident	87.5	Confident	38 Å²	38	33.2 Å²	33.2	23%	0.233	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-18.9	-174.6	54	0	0	0	0	113.9	V130 R213 G218	V130-T216 HydrophobicContact CG2-CG2 4.18Å; R213-T216 PolarHBondContact N-OG1 3.01Å; R213-T216 PolarHBondContact O-N 3.05Å; R213-T216 PolarHBondContact O-OG1 2.6Å; R213-T216 VanDerWaalsContact O-OG1 3.05Å; T216-G218 PolarHBondContact O-N 2.93Å
217	V	86.3	Confident	87.6	Confident	23 Å²	23	31.8 Å²	31.8	14%	0.139	16%	0.163	C	C	.	.	S	Bend	trans	-62.2	-27.1	-175.1	72.7	0	0	0	0	113.8	P212 R213 P240 L457 G458	P212-V217 HydrophobicContact CB-CB 4.16Å; P212-V217 HydrophobicContact CB-CG2 4.46Å; R213-V217 PolarHBondContact O-N 3.2Å; V217-P240 HydrophobicContact CG1-CG 3.64Å; V217-L457 HydrophobicContact CG1-CG 4.36Å; V217-L457 HydrophobicContact CG2-CG 4.39Å; V217-G458 VanDerWaalsContact CG2-CA 3.43Å
218	G	87.4	Confident	87.1	Confident	2 Å²	2	33.6 Å²	33.6	2%	0.021	18%	0.183	C	C	.	.			trans	116.5	-166.1	-175.7	0	0	0	0	0	113.6	T216 I504	T216-G218 PolarHBondContact O-N 2.93Å; G218-I504 CarbonylContact C-O 3.6Å; G218-I504 WeakPolarHBondContact CA-O 3.48Å
219	R	90.8	Very high	86.7	Confident	65 Å²	65	33.3 Å²	33.3	25%	0.245	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	148.9	177.7	-63.9	173.6	-179.1	-105.1	-0.7	109.7	A503 I504 N506	R219-A503 WeakPolarHBondContact O-CA 3.48Å; R219-I504 HydrophobicContact CB-CD1 4.46Å; R219-I504 HydrophobicContact CB-CG1 4.05Å; R219-I504 PolarHBondContact N-O 2.9Å; R219-I504 PolarHBondContact O-N 2.97Å; R219-N506 PolarHBondContact NE-OD1 3.01Å; R219-N506 PolarHBondContact NH2-OD1 3.03Å
220	L	94.2	Very high	85.9	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	136.8	169.8	-157.3	67.2	0	0	0	108.8	S237 Y238 W245 A455 L457 I462 V464 V501 A503	L220-S237 CarbonylContact O-C 3.43Å; L220-S237 VanDerWaalsContact O-CA 3.31Å; L220-S237 WeakPolarHBondContact O-CA 3.4Å; L220-Y238 HydrophobicContact CB-CD1 4.32Å; L220-Y238 PolarHBondContact N-O 2.92Å; L220-Y238 PolarHBondContact O-N 2.83Å; L220-W245 HydrophobicContact CD2-CH2 4.12Å; L220-W245 HydrophobicContact CD2-CZ2 4.4Å; L220-A455 HydrophobicContact CD1-CB 3.92Å; L220-L457 HydrophobicContact CB-CD2 4.44Å; L220-I462 HydrophobicContact CD2-CB 4.03Å; L220-I462 HydrophobicContact CD2-CD1 4.27Å; L220-I462 HydrophobicContact CD2-CG2 3.69Å; L220-V464 HydrophobicContact CD2-CG2 3.68Å; L220-V501 HydrophobicContact CD1-CG1 3.58Å; L220-V501 HydrophobicContact CD2-CG1 3.7Å; L220-V501 HydrophobicContact CG-CG1 3.56Å; L220-A503 HydrophobicContact CD1-CB 4.39Å
221	L	95.1	Very high	85.5	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	131.1	171.4	-59.4	-178.6	0	0	0	109.6	V223 I235 E236 W248 L267 V501 V502 I504	L221-V223 HydrophobicContact CB-CG2 4.1Å; L221-I235 HydrophobicContact CB-CG2 4.22Å; L221-I235 HydrophobicContact CD2-CG2 4.43Å; L221-E236 CarbonylContact C-O 3.58Å; L221-E236 WeakPolarHBondContact CA-O 3.47Å; L221-W248 HydrophobicContact CD1-CE3 3.96Å; L221-W248 HydrophobicContact CD1-CH2 3.71Å; L221-W248 HydrophobicContact CD1-CZ2 4.48Å; L221-W248 HydrophobicContact CD1-CZ3 3.41Å; L221-W248 VanDerWaalsContact CD1-CZ3 3.41Å; L221-W248 HydrophobicContact CD2-CD2 3.91Å; L221-W248 HydrophobicContact CD2-CE3 3.74Å; L221-W248 HydrophobicContact CD2-CG 4.42Å; L221-W248 HydrophobicContact CD2-CH2 4.5Å; L221-W248 HydrophobicContact CD2-CZ3 4.06Å; L221-W248 HydrophobicContact CG-CE3 4.48Å; L221-W248 HydrophobicContact CG-CZ3 4.37Å; L221-L267 HydrophobicContact CD1-CD2 4.13Å; L221-V501 VanDerWaalsContact O-CA 3.29Å; L221-V501 WeakPolarHBondContact O-CA 3.25Å; L221-V502 HydrophobicContact CB-CG2 3.92Å; L221-V502 HydrophobicContact CD1-CG2 4.32Å; L221-V502 PolarHBondContact N-O 2.83Å; L221-V502 PolarHBondContact O-N 2.75Å; L221-V502 VanDerWaalsContact O-N 3.1Å; L221-I504 HydrophobicContact CD1-CD1 3.9Å; L221-I504 HydrophobicContact CD1-CG1 4.18Å; L221-I504 HydrophobicContact CD1-CG2 3.8Å; L221-I504 HydrophobicContact CD2-CD1 4.07Å; L221-I504 HydrophobicContact CD2-CG1 4.46Å; L221-I504 HydrophobicContact CG-CD1 4.04Å; L221-I504 HydrophobicContact CG-CG1 4.06Å; L221-I504 HydrophobicContact CG-CG2 4.34Å
222	A	95.2	Very high	85.3	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	106.6	166.2	0	0	0	0	0	108.3	I235 E236 W245 V464 M492	A222-I235 WeakPolarHBondContact O-CA 3.26Å; A222-E236 PolarHBondContact N-O 3.08Å; A222-E236 PolarHBondContact O-N 3.11Å; A222-E236 VanDerWaalsContact O-N 3.09Å; A222-W245 HydrophobicContact CB-CH2 3.89Å; A222-W245 HydrophobicContact CB-CZ3 3.61Å; A222-V464 HydrophobicContact CB-CG1 4.31Å; A222-M492 HydrophobicContact CB-SD 3.91Å
223	V	94.6	Very high	85.5	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	117.7	-171.7	-171	0	0	0	0	109.8	L221 I235 M251 F258 L267 L269 C500 V502	L221-V223 HydrophobicContact CB-CG2 4.1Å; V223-I235 HydrophobicContact CG1-CD1 3.96Å; V223-I235 HydrophobicContact CG1-CG1 3.98Å; V223-I235 HydrophobicContact CG2-CG2 3.93Å; V223-M251 HydrophobicContact CG1-CG 4.43Å; V223-M251 HydrophobicContact CG1-SD 3.99Å; V223-F258 HydrophobicContact CB-CE2 4.46Å; V223-F258 HydrophobicContact CB-CZ 4.38Å; V223-F258 HydrophobicContact CG1-CE2 3.96Å; V223-F258 HydrophobicContact CG1-CZ 3.87Å; V223-F258 WeakPolarHBondContact O-CZ 3.4Å; V223-L267 HydrophobicContact CG2-CD2 4.01Å; V223-L269 HydrophobicContact CG1-CD1 4.33Å; V223-L269 HydrophobicContact CG1-CD2 3.99Å; V223-C500 HydrophobicContact CB-CB 4.37Å; V223-C500 PolarHBondContact N-O 2.71Å; V223-C500 PolarHBondContact O-N 3.15Å; V223-V502 HydrophobicContact CG2-CG2 4.38Å
224	G	90.9	Very high	85.6	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.207	C	C	.	.			trans	61.7	-139.6	172.4	0	0	0	0	0	113.9	A232 S234 R496	G224-A232 VanDerWaalsContact CA-O 3.29Å; G224-A232 WeakPolarHBondContact CA-O 3.45Å; G224-S234 PolarHBondContact N-O 2.95Å; G224-R496 WeakPolarHBondContact O-CD 3.49Å; G224-R496 PolarHBondContact O-NH1 3.33Å
225	G	87.3	Confident	86	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.01	20%	0.195	C	C	.	.			trans	96.6	176.8	-176.1	0	0	0	0	0	113.3	G231 A232 A497	G225-G231 WeakPolarHBondContact O-CA 3.23Å; G225-A232 PolarHBondContact O-N 3.19Å; G225-A497 CarbonylContact C-O 3.58Å; G225-A497 WeakPolarHBondContact CA-O 3.49Å
226	M	86	Confident	86.5	Confident	83 Å²	83	36.1 Å²	36.1	41%	0.409	20%	0.195	S	C	.	.	B	Isolated β-bridge	trans	-89.8	119.5	177.4	-168.5	175.6	-66.8	0	0	109.9	L256 R496 A497	M226-L256 HydrophobicContact CB-CD2 4.39Å; M226-L256 HydrophobicContact CE-CD1 4.21Å; M226-R496 WeakPolarHBondContact O-CA 3.4Å; M226-A497 HydrophobicContact CB-CB 4.43Å; M226-A497 PolarHBondContact N-O 3.03Å; M226-A497 PolarHBondContact O-N 3.36Å
227	D	82.4	Confident	87	Confident	29 Å²	29	34.3 Å²	34.3	16%	0.155	18%	0.184	C	C	.	.			trans	-105.2	-172.8	172.2	65.8	-5.5	0	0	0	110.6	H229 K230 G231 A232	D227-H229 PolarHBondContact O-N 3.02Å; D227-H229 VanDerWaalsContact O-N 3.15Å; D227-H229 WeakPolarHBondContact OD1-CA 3.31Å; D227-H229 PolarHBondContact OD1-N 2.87Å; D227-K230 PolarHBondContact O-N 3.19Å; D227-K230 PolarHBondContact OD1-N 2.85Å; D227-G231 PolarHBondContact OD1-N 2.55Å; D227-A232 HydrophobicContact CB-CB 4.2Å
228	A	73.3	Confident	87.3	Confident	95 Å²	95	33.4 Å²	33.4	79%	0.785	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-25	175.1	0	0	0	0	0	113.3	K230	A228-K230 VanDerWaalsContact C-N 3.3Å
229	H	72.8	Confident	87.4	Confident	166 Å²	166	34 Å²	34	77%	0.769	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.6	14.6	176.7	-57.7	-63	0	0	0	113	D227 G231	D227-H229 PolarHBondContact O-N 3.02Å; D227-H229 VanDerWaalsContact O-N 3.15Å; D227-H229 WeakPolarHBondContact OD1-CA 3.31Å; D227-H229 PolarHBondContact OD1-N 2.87Å; H229-G231 VanDerWaalsContact C-N 3.27Å; H229-G231 PolarHBondContact O-N 3.01Å
230	K	69.3	Low	87.3	Confident	146 Å²	146	31.3 Å²	31.3	64%	0.635	17%	0.172	S	C	*	.	S	Bend	trans	65.3	18.4	176.1	-55.7	-179.6	178.5	178	0	114.3	D227 A228 R254	D227-K230 PolarHBondContact O-N 3.19Å; D227-K230 PolarHBondContact OD1-N 2.85Å; A228-K230 VanDerWaalsContact C-N 3.3Å; K230-R254 PolarHBondContact O-NE 3.39Å; K230-R254 PolarHBondContact O-NH2 3.41Å
231	G	76	Confident	86.9	Confident	14 Å²	14	33.2 Å²	33.2	14%	0.144	18%	0.18	C	C	.	.			trans	163.6	104	167.7	0	0	0	0	0	114.4	G225 D227 H229	G225-G231 WeakPolarHBondContact O-CA 3.23Å; D227-G231 PolarHBondContact OD1-N 2.55Å; H229-G231 VanDerWaalsContact C-N 3.27Å; H229-G231 PolarHBondContact O-N 3.01Å
232	A	81.3	Confident	86.5	Confident	4 Å²	4	37.6 Å²	37.6	3%	0.033	20%	0.203	C	C	.	.			trans	-78.1	134.6	178.9	0	0	0	0	0	111.3	G224 G225 D227	G224-A232 VanDerWaalsContact CA-O 3.29Å; G224-A232 WeakPolarHBondContact CA-O 3.45Å; G225-A232 PolarHBondContact O-N 3.19Å; D227-A232 HydrophobicContact CB-CB 4.2Å
233	I	89.9	Confident	86.3	Confident	69 Å²	69	40.9 Å²	40.9	35%	0.354	22%	0.22	S	C	.	.			trans	-97	-7.5	165.3	58.3	167.9	0	0	0	112.1	H250 M251 G253 R254	I233-H250 CarbonylContact O-C 3.6Å; I233-H250 VanDerWaalsContact O-CA 3.3Å; I233-H250 WeakPolarHBondContact O-CA 3.39Å; I233-M251 HydrophobicContact CB-CB 4.29Å; I233-M251 PolarHBondContact O-N 2.79Å; I233-G253 WeakPolarHBondContact CG2-O 3.13Å; I233-R254 HydrophobicContact CG2-CB 4.29Å
234	S	91.6	Very high	86.1	Confident	21 Å²	21	46.7 Å²	46.7	15%	0.147	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	146	-178.4	52.2	0	0	0	0	111.3	G224 R496	G224-S234 PolarHBondContact N-O 2.95Å; S234-R496 PolarHBondContact O-NH1 2.84Å; S234-R496 PolarHBondContact O-NH2 3.02Å; S234-R496 PolarHBondContact OG-NH2 2.69Å
235	I	93.9	Very high	86.3	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	123.9	173.2	-50.9	178.1	0	0	0	107	L221 A222 V223 W248 K249 M251 W292	L221-I235 HydrophobicContact CB-CG2 4.22Å; L221-I235 HydrophobicContact CD2-CG2 4.43Å; A222-I235 WeakPolarHBondContact O-CA 3.26Å; V223-I235 HydrophobicContact CG1-CD1 3.96Å; V223-I235 HydrophobicContact CG1-CG1 3.98Å; V223-I235 HydrophobicContact CG2-CG2 3.93Å; I235-W248 HydrophobicContact CB-CE3 4.12Å; I235-W248 HydrophobicContact CD1-CZ3 4.45Å; I235-W248 HydrophobicContact CG2-CE3 3.6Å; I235-W248 HydrophobicContact CG2-CZ3 4.15Å; I235-W248 WeakPolarHBondContact O-CB 3.17Å; I235-W248 PolarHBondContact O-N 3.27Å; I235-K249 WeakPolarHBondContact CA-O 3.48Å; I235-K249 VanDerWaalsContact CB-O 3.32Å; I235-K249 WeakPolarHBondContact CB-O 3.24Å; I235-K249 HydrophobicContact CD1-CB 4.47Å; I235-K249 PolarHBondContact N-O 2.73Å; I235-K249 PolarHBondContact O-N 3.14Å; I235-M251 HydrophobicContact CD1-CG 4.14Å; I235-M251 HydrophobicContact CG1-CG 4.26Å; I235-W292 HydrophobicContact CD1-CZ2 3.99Å
236	E	94.1	Very high	86.5	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.005	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	143.5	175.1	-67.7	173.8	-108.7	0	0	109.8	L221 A222 W245 A493 F494 R496	L221-E236 CarbonylContact C-O 3.58Å; L221-E236 WeakPolarHBondContact CA-O 3.47Å; A222-E236 PolarHBondContact N-O 3.08Å; A222-E236 PolarHBondContact O-N 3.11Å; A222-E236 VanDerWaalsContact O-N 3.09Å; E236-W245 HydrophobicContact CB-CE3 3.68Å; E236-W245 HydrophobicContact CB-CZ3 4.15Å; E236-A493 VanDerWaalsContact OE2-CB 3.27Å; E236-A493 WeakPolarHBondContact OE2-CB 3.03Å; E236-A493 PolarHBondContact OE2-N 3.28Å; E236-F494 PolarHBondContact OE1-N 3Å; E236-R496 IonicContact OE1-CZ 3.72Å; E236-R496 VanDerWaalsContact OE1-CZ 3.25Å; E236-R496 IonicContact OE1-NE 3.28Å; E236-R496 PolarHBondContact OE1-NE 2.86Å; E236-R496 IonicContact OE1-NH2 3.97Å; E236-R496 PolarHBondContact OE1-NH2 2.92Å
237	S	94.2	Very high	86.8	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	129.5	175.3	177	0	0	0	0	110.2	L220 W245 T246	L220-S237 CarbonylContact O-C 3.43Å; L220-S237 VanDerWaalsContact O-CA 3.31Å; L220-S237 WeakPolarHBondContact O-CA 3.4Å; S237-W245 CarbonylContact O-C 3.56Å; S237-W245 WeakPolarHBondContact O-CA 3.5Å; S237-T246 PolarHBondContact N-O 3.37Å; S237-T246 PolarHBondContact O-N 3.1Å; S237-T246 PolarHBondContact O-OG1 3.21Å
238	Y	94.1	Very high	87.2	Confident	5 Å²	5	52.6 Å²	52.6	2%	0.02	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	127.3	171.5	-178.3	-117.3	0	0	0	110.4	L220 P240 D243 W245 L457 I462 L489	L220-Y238 HydrophobicContact CB-CD1 4.32Å; L220-Y238 PolarHBondContact N-O 2.92Å; L220-Y238 PolarHBondContact O-N 2.83Å; Y238-P240 HydrophobicContact CE1-CB 4.05Å; Y238-D243 VanDerWaalsContact CE2-OD1 3.25Å; Y238-D243 WeakPolarHBondContact CE2-OD1 3.29Å; Y238-D243 PolarHBondContact OH-OD1 2.83Å; Y238-W245 AromaticContact CD2-CD1 3.71Å; Y238-W245 HydrophobicContact CD2-CD2 4.05Å; Y238-W245 AromaticContact CD2-CE2 3.67Å; Y238-W245 HydrophobicContact CD2-CG 4.1Å; Y238-W245 HydrophobicContact CD2-CZ2 4.26Å; Y238-W245 AromaticContact CD2-NE1 3.4Å; Y238-W245 HydrophobicContact CG-CD2 4.33Å; Y238-W245 AromaticContact CG-CE2 3.92Å; Y238-W245 HydrophobicContact CG-CZ2 4.09Å; Y238-L457 HydrophobicContact CD1-CD2 4.33Å; Y238-I462 HydrophobicContact CD1-CD1 4.47Å; Y238-I462 HydrophobicContact CE1-CD1 4.25Å; Y238-L489 HydrophobicContact CE1-CD1 4.23Å
239	C	89.4	Confident	88.1	Confident	14 Å²	14	50.6 Å²	50.6	10%	0.095	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	111.5	170.4	-174.9	0	0	0	0	109.7	R241 L242 D243 K244	C239-R241 VanDerWaalsContact C-N 3.25Å; C239-R241 PolarHBondContact O-N 2.81Å; C239-L242 HydrophobicContact CB-CB 4.44Å; C239-L242 PolarHBondContact O-N 2.76Å; C239-D243 PolarHBondContact O-N 3.14Å; C239-K244 PolarHBondContact N-O 2.88Å; C239-K244 PolarHBondContact O-N 2.96Å
240	P	87.9	Confident	89	Confident	8 Å²	8	47.9 Å²	47.9	5%	0.052	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-23.6	-176.9	25.7	-34.5	0	0	0	113.6	K214 V217 Y238 L457 R460	K214-P240 WeakPolarHBondContact O-CG 3.43Å; V217-P240 HydrophobicContact CG1-CG 3.64Å; Y238-P240 HydrophobicContact CE1-CB 4.05Å; P240-L457 HydrophobicContact CB-CD2 4.12Å; P240-L457 HydrophobicContact CG-CD2 3.97Å; P240-R460 VanDerWaalsContact CB-NH2 3.34Å
241	R	86.1	Confident	90.1	Very high	41 Å²	41	41.4 Å²	41.4	16%	0.155	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-40.6	176.9	-175.6	-178.4	63.1	78.4	-0.6	112.4	D127 K214 C239	D127-R241 VanDerWaalsContact O-CD 3.24Å; D127-R241 WeakPolarHBondContact O-CD 3.34Å; K214-R241 HydrophobicContact CB-CB 3.9Å; K214-R241 HydrophobicContact CB-CG 4.44Å; C239-R241 VanDerWaalsContact C-N 3.25Å; C239-R241 PolarHBondContact O-N 2.81Å
242	L	86.1	Confident	90.8	Very high	92 Å²	92	44.8 Å²	44.8	48%	0.482	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-4.4	-177.2	-66.7	178.1	0	0	0	112.9	C239 K244	C239-L242 HydrophobicContact CB-CB 4.44Å; C239-L242 PolarHBondContact O-N 2.76Å; L242-K244 VanDerWaalsContact C-N 3.29Å; L242-K244 HydrophobicContact CB-CB 4.13Å; L242-K244 PolarHBondContact O-N 3.31Å
243	D	90.9	Very high	91.1	Very high	69 Å²	69	46.1 Å²	46.1	37%	0.369	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	40.9	59.2	-167.2	-172.4	32.1	0	0	0	111.1	Y238 C239 A490	Y238-D243 VanDerWaalsContact CE2-OD1 3.25Å; Y238-D243 WeakPolarHBondContact CE2-OD1 3.29Å; Y238-D243 PolarHBondContact OH-OD1 2.83Å; C239-D243 PolarHBondContact O-N 3.14Å; D243-A490 WeakPolarHBondContact O-CB 3.44Å; D243-A490 WeakPolarHBondContact OD1-CB 3.31Å; D243-A490 PolarHBondContact OD1-N 2.83Å; D243-A490 PolarHBondContact OD2-N 2.98Å
244	K	91.8	Very high	91.1	Very high	122 Å²	122	47.1 Å²	47.1	53%	0.53	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	135.4	-172.8	-173.1	173.8	179.7	179	0	112.3	C239 L242 T246	C239-K244 PolarHBondContact N-O 2.88Å; C239-K244 PolarHBondContact O-N 2.96Å; L242-K244 VanDerWaalsContact C-N 3.29Å; L242-K244 HydrophobicContact CB-CB 4.13Å; L242-K244 PolarHBondContact O-N 3.31Å; K244-T246 HydrophobicContact CG-CG2 4.44Å
245	W	93.9	Very high	91.1	Very high	16 Å²	16	46.3 Å²	46.3	6%	0.061	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	135.9	167.2	-68.4	88.4	0	0	0	111.2	L220 A222 E236 S237 Y238 V464 V476 A490 M492	L220-W245 HydrophobicContact CD2-CH2 4.12Å; L220-W245 HydrophobicContact CD2-CZ2 4.4Å; A222-W245 HydrophobicContact CB-CH2 3.89Å; A222-W245 HydrophobicContact CB-CZ3 3.61Å; E236-W245 HydrophobicContact CB-CE3 3.68Å; E236-W245 HydrophobicContact CB-CZ3 4.15Å; S237-W245 CarbonylContact O-C 3.56Å; S237-W245 WeakPolarHBondContact O-CA 3.5Å; Y238-W245 AromaticContact CD2-CD1 3.71Å; Y238-W245 HydrophobicContact CD2-CD2 4.05Å; Y238-W245 AromaticContact CD2-CE2 3.67Å; Y238-W245 HydrophobicContact CD2-CG 4.1Å; Y238-W245 HydrophobicContact CD2-CZ2 4.26Å; Y238-W245 AromaticContact CD2-NE1 3.4Å; Y238-W245 HydrophobicContact CG-CD2 4.33Å; Y238-W245 AromaticContact CG-CE2 3.92Å; Y238-W245 HydrophobicContact CG-CZ2 4.09Å; W245-V464 HydrophobicContact CH2-CG1 3.99Å; W245-V464 HydrophobicContact CH2-CG2 4.14Å; W245-V464 HydrophobicContact CZ2-CG1 4.05Å; W245-V464 HydrophobicContact CZ2-CG2 4.09Å; W245-V476 HydrophobicContact CZ2-CG1 4.34Å; W245-V476 HydrophobicContact CZ2-CG2 3.88Å; W245-A490 PolarHBondContact NE1-O 3.28Å; W245-M492 HydrophobicContact CD2-CG 3.86Å; W245-M492 HydrophobicContact CE3-CG 4.23Å; W245-M492 HydrophobicContact CG-CG 4.28Å; W245-M492 HydrophobicContact CH2-CG 4.33Å; W245-M492 HydrophobicContact CZ2-CG 4Å; W245-M492 HydrophobicContact CZ3-CG 4.44Å
246	T	92.3	Very high	91	Very high	52 Å²	52	46.5 Å²	46.5	32%	0.319	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	140	175.3	53.5	0	0	0	0	110	S237 K244 W248	S237-T246 PolarHBondContact N-O 3.37Å; S237-T246 PolarHBondContact O-N 3.1Å; S237-T246 PolarHBondContact O-OG1 3.21Å; K244-T246 HydrophobicContact CG-CG2 4.44Å; T246-W248 PolarHBondContact O-N 3.26Å
247	P	91.8	Very high	90.9	Very high	100 Å²	100	49.9 Å²	49.9	65%	0.649	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.9	133.5	168.7	-22.2	33.1	0	0	0	110.1
248	W	91.4	Very high	90.9	Very high	68 Å²	68	50.3 Å²	50.3	26%	0.258	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	-59.5	-174	-177.2	61.6	0	0	0	112.7	L221 I235 T246 L267 L285 L287 M290 I504	L221-W248 HydrophobicContact CD1-CE3 3.96Å; L221-W248 HydrophobicContact CD1-CH2 3.71Å; L221-W248 HydrophobicContact CD1-CZ2 4.48Å; L221-W248 HydrophobicContact CD1-CZ3 3.41Å; L221-W248 VanDerWaalsContact CD1-CZ3 3.41Å; L221-W248 HydrophobicContact CD2-CD2 3.91Å; L221-W248 HydrophobicContact CD2-CE3 3.74Å; L221-W248 HydrophobicContact CD2-CG 4.42Å; L221-W248 HydrophobicContact CD2-CH2 4.5Å; L221-W248 HydrophobicContact CD2-CZ3 4.06Å; L221-W248 HydrophobicContact CG-CE3 4.48Å; L221-W248 HydrophobicContact CG-CZ3 4.37Å; I235-W248 HydrophobicContact CB-CE3 4.12Å; I235-W248 HydrophobicContact CD1-CZ3 4.45Å; I235-W248 HydrophobicContact CG2-CE3 3.6Å; I235-W248 HydrophobicContact CG2-CZ3 4.15Å; I235-W248 WeakPolarHBondContact O-CB 3.17Å; I235-W248 PolarHBondContact O-N 3.27Å; T246-W248 PolarHBondContact O-N 3.26Å; W248-L267 HydrophobicContact CZ3-CD2 4.46Å; W248-L285 HydrophobicContact CH2-CD2 3.56Å; W248-L285 HydrophobicContact CZ3-CD2 3.64Å; W248-L287 HydrophobicContact CH2-CD2 3.64Å; W248-L287 HydrophobicContact CZ2-CD2 4.15Å; W248-M290 HydrophobicContact CD2-CE 4.19Å; W248-M290 HydrophobicContact CH2-CE 3.97Å; W248-M290 HydrophobicContact CH2-SD 4.13Å; W248-M290 HydrophobicContact CZ2-CE 3.29Å; W248-M290 HydrophobicContact CZ2-SD 3.57Å; W248-M290 VanDerWaalsContact CZ2-SD 3.57Å; W248-I504 HydrophobicContact CZ2-CD1 4.24Å
249	K	91.7	Very high	91	Very high	53 Å²	53	50.2 Å²	50.2	23%	0.23	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	172.4	-178.4	-166.5	160.1	-176	110.9	0	110.9	I235 L285 M290	I235-K249 WeakPolarHBondContact CA-O 3.48Å; I235-K249 VanDerWaalsContact CB-O 3.32Å; I235-K249 WeakPolarHBondContact CB-O 3.24Å; I235-K249 HydrophobicContact CD1-CB 4.47Å; I235-K249 PolarHBondContact N-O 2.73Å; I235-K249 PolarHBondContact O-N 3.14Å; K249-L285 HydrophobicContact CD-CD1 3.82Å; K249-L285 HydrophobicContact CD-CD2 3.88Å; K249-M290 HydrophobicContact CD-CE 3.82Å; K249-M290 WeakPolarHBondContact CE-O 3.41Å; K249-M290 PolarHBondContact NZ-O 3.35Å
250	H	92	Very high	91.3	Very high	110 Å²	110	50.2 Å²	50.2	51%	0.509	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	146.9	171.6	-59.9	89.4	0	0	0	110.6	I233 W292	I233-H250 CarbonylContact O-C 3.6Å; I233-H250 VanDerWaalsContact O-CA 3.3Å; I233-H250 WeakPolarHBondContact O-CA 3.39Å; H250-W292 PolarHBondContact O-NE1 2.72Å
251	M	91.7	Very high	91.6	Very high	9 Å²	9	50.3 Å²	50.3	4%	0.044	26%	0.259	C	S	.	.			trans	-68.2	158.7	167.2	-61.7	174.6	56.9	0	0	110.2	V223 I233 I235 G253 R255 F258 L269 W292	V223-M251 HydrophobicContact CG1-CG 4.43Å; V223-M251 HydrophobicContact CG1-SD 3.99Å; I233-M251 HydrophobicContact CB-CB 4.29Å; I233-M251 PolarHBondContact O-N 2.79Å; I235-M251 HydrophobicContact CD1-CG 4.14Å; I235-M251 HydrophobicContact CG1-CG 4.26Å; M251-G253 PolarHBondContact O-N 2.98Å; M251-R255 HydrophobicContact CE-CB 3.49Å; M251-R255 VanDerWaalsContact CE-CB 3.49Å; M251-R255 HydrophobicContact CE-CG 4.36Å; M251-F258 HydrophobicContact CE-CE1 4.04Å; M251-F258 HydrophobicContact CE-CZ 4.06Å; M251-F258 HydrophobicContact SD-CE1 4.25Å; M251-F258 HydrophobicContact SD-CZ 3.97Å; M251-L269 HydrophobicContact CE-CD1 3.44Å; M251-L269 VanDerWaalsContact CE-CD1 3.44Å; M251-L269 HydrophobicContact CG-CD1 4.14Å; M251-L269 HydrophobicContact SD-CD1 4.11Å; M251-W292 HydrophobicContact CG-CZ2 4.38Å
252	T	90.3	Very high	92	Very high	86 Å²	86	50.4 Å²	50.4	53%	0.528	27%	0.265	S	S	.	.	S	Bend	trans	-66.4	-26.9	177.2	54.6	0	0	0	0	112.9	E283 W292	T252-E283 WeakPolarHBondContact CB-OE2 3.29Å; T252-E283 VanDerWaalsContact CG2-OE2 3.3Å; T252-E283 WeakPolarHBondContact CG2-OE2 3.44Å; T252-E283 VanDerWaalsContact OG1-CD 3.28Å; T252-E283 PolarHBondContact OG1-OE1 3.06Å; T252-E283 PolarHBondContact OG1-OE2 2.97Å; T252-W292 HydrophobicContact CG2-CB 3.78Å; T252-W292 HydrophobicContact CG2-CD2 4.14Å; T252-W292 HydrophobicContact CG2-CG 3.69Å
253	G	87.9	Confident	92.3	Very high	31 Å²	31	46.9 Å²	46.9	32%	0.32	25%	0.246	S	C	.	.	S	Bend	trans	-163.1	173.1	-178.8	0	0	0	0	0	112.4	I233 M251 R255	I233-G253 WeakPolarHBondContact CG2-O 3.13Å; M251-G253 PolarHBondContact O-N 2.98Å; G253-R255 PolarHBondContact O-N 2.83Å
254	R	89.6	Confident	92	Very high	90 Å²	90	49.7 Å²	49.7	34%	0.34	26%	0.257	S	S	.	.			trans	-70.2	128.7	179.2	-177	173.3	173.4	-124.2	9.1	110	K230 I233 D274	K230-R254 PolarHBondContact O-NE 3.39Å; K230-R254 PolarHBondContact O-NH2 3.41Å; I233-R254 HydrophobicContact CG2-CB 4.29Å; R254-D274 WeakPolarHBondContact O-CB 3.42Å
255	R	92.2	Very high	91.8	Very high	5 Å²	5	47.6 Å²	47.6	2%	0.019	25%	0.251	C	S	.	.			trans	-145.5	127.8	179.1	-162.9	-176	-85	-124.1	2.4	108.6	M251 G253 F258 G271 L279 T281 E283	M251-R255 HydrophobicContact CE-CB 3.49Å; M251-R255 VanDerWaalsContact CE-CB 3.49Å; M251-R255 HydrophobicContact CE-CG 4.36Å; G253-R255 PolarHBondContact O-N 2.83Å; R255-F258 HydrophobicContact CB-CD1 3.8Å; R255-F258 HydrophobicContact CB-CE1 4.16Å; R255-F258 HydrophobicContact CG-CB 3.81Å; R255-F258 HydrophobicContact CG-CD1 3.55Å; R255-F258 HydrophobicContact CG-CE1 4.38Å; R255-F258 HydrophobicContact CG-CG 3.87Å; R255-F258 WeakPolarHBondContact O-CD1 3.44Å; R255-F258 WeakPolarHBondContact O-CE1 3.5Å; R255-G271 WeakPolarHBondContact CD-O 3.45Å; R255-G271 WeakPolarHBondContact CG-O 3.48Å; R255-G271 PolarHBondContact NH1-O 2.84Å; R255-L279 HydrophobicContact CG-CD1 4.19Å; R255-T281 PolarHBondContact NH1-O 3.46Å; R255-T281 PolarHBondContact NH2-OG1 2.86Å; R255-E283 IonicContact CZ-OE1 3.21Å; R255-E283 IonicContact NE-OE1 3.62Å; R255-E283 IonicContact NH2-OE1 2.88Å; R255-E283 PolarHBondContact NH2-OE1 3.49Å
256	L	91.8	Very high	91.8	Very high	4 Å²	4	50.4 Å²	50.4	2%	0.021	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-119.6	151.6	177.7	-64.9	175.5	0	0	0	110.3	M226 F258 G272 R273	M226-L256 HydrophobicContact CB-CD2 4.39Å; M226-L256 HydrophobicContact CE-CD1 4.21Å; L256-F258 PolarHBondContact O-N 2.98Å; L256-G272 CarbonylContact O-C 3.44Å; L256-G272 WeakPolarHBondContact O-CA 3.34Å; L256-R273 HydrophobicContact CB-CG 3.92Å; L256-R273 PolarHBondContact N-O 3.37Å; L256-R273 PolarHBondContact O-N 3.2Å
257	Q	91.9	Very high	91.9	Very high	73 Å²	73	48 Å²	48	34%	0.341	25%	0.249	S	C	.	.	S	Bend	trans	51.1	33.1	175.4	-55.9	178.7	-50.5	0	0	112.9	H303 G304	Q257-H303 HydrophobicContact CB-CB 4.34Å; Q257-H303 PolarHBondContact OE1-CD2 2.71Å; Q257-H303 VanDerWaalsContact OE1-CD2 3.23Å; Q257-G304 PolarHBondContact O-N 2.72Å
258	F	95.1	Very high	92.1	Very high	8 Å²	8	43.3 Å²	43.3	4%	0.035	22%	0.218	C	C	.	.			trans	-82	168.2	169.5	59	-84.5	0	0	0	109.4	V223 M251 R255 L256 A260 L269 V270 G271 C500	V223-F258 HydrophobicContact CB-CE2 4.46Å; V223-F258 HydrophobicContact CB-CZ 4.38Å; V223-F258 HydrophobicContact CG1-CE2 3.96Å; V223-F258 HydrophobicContact CG1-CZ 3.87Å; V223-F258 WeakPolarHBondContact O-CZ 3.4Å; M251-F258 HydrophobicContact CE-CE1 4.04Å; M251-F258 HydrophobicContact CE-CZ 4.06Å; M251-F258 HydrophobicContact SD-CE1 4.25Å; M251-F258 HydrophobicContact SD-CZ 3.97Å; R255-F258 HydrophobicContact CB-CD1 3.8Å; R255-F258 HydrophobicContact CB-CE1 4.16Å; R255-F258 HydrophobicContact CG-CB 3.81Å; R255-F258 HydrophobicContact CG-CD1 3.55Å; R255-F258 HydrophobicContact CG-CE1 4.38Å; R255-F258 HydrophobicContact CG-CG 3.87Å; R255-F258 WeakPolarHBondContact O-CD1 3.44Å; R255-F258 WeakPolarHBondContact O-CE1 3.5Å; L256-F258 PolarHBondContact O-N 2.98Å; F258-A260 HydrophobicContact CE2-CB 4.31Å; F258-L269 HydrophobicContact CD2-CB 4.33Å; F258-L269 HydrophobicContact CD2-CD2 4.2Å; F258-L269 HydrophobicContact CE2-CD1 4.31Å; F258-L269 HydrophobicContact CE2-CD2 3.83Å; F258-V270 WeakPolarHBondContact CB-O 3.46Å; F258-G271 WeakPolarHBondContact CB-O 3.42Å; F258-C500 HydrophobicContact CE2-CB 3.95Å; F258-C500 VanDerWaalsContact CE2-SG 3.56Å; F258-C500 PolarHBondContact O-SG 2.83Å
259	G	95	Very high	92.4	Very high	4 Å²	4	40 Å²	40	4%	0.041	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	150.3	165.6	0	0	0	0	0	110.5	V270	G259-V270 PolarHBondContact N-O 3.32Å; G259-V270 PolarHBondContact O-N 3.08Å
260	A	95.8	Very high	92.6	Very high	14 Å²	14	37.5 Å²	37.5	12%	0.116	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	145.8	174	0	0	0	0	0	110.9	F258 L267 I268 L269 C500 V502	F258-A260 HydrophobicContact CE2-CB 4.31Å; A260-L267 HydrophobicContact CB-CD1 4.21Å; A260-I268 VanDerWaalsContact CA-O 3.23Å; A260-I268 WeakPolarHBondContact CA-O 3.09Å; A260-L269 HydrophobicContact CB-CD2 3.63Å; A260-C500 HydrophobicContact CB-CB 3.48Å; A260-C500 VanDerWaalsContact CB-CB 3.48Å; A260-V502 HydrophobicContact CB-CG1 4.15Å
261	A	95.3	Very high	92.8	Very high	10 Å²	10	32.3 Å²	32.3	8%	0.083	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	162.8	170.2	0	0	0	0	0	110.3	I268 V307 V309 L314	A261-I268 PolarHBondContact N-O 3.2Å; A261-I268 PolarHBondContact O-N 2.91Å; A261-V307 HydrophobicContact CB-CG1 3.96Å; A261-V309 HydrophobicContact CB-CG2 3.95Å; A261-L314 HydrophobicContact CB-CD1 3.58Å
262	V	93.9	Very high	92.9	Very high	43 Å²	43	31.9 Å²	31.9	26%	0.261	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	126.9	176	179.4	0	0	0	0	108.2	K266 L267 L287 V502 I504	V262-K266 WeakPolarHBondContact CA-O 3.43Å; V262-L267 HydrophobicContact CG2-CD1 4.32Å; V262-L287 HydrophobicContact CG1-CD1 4.34Å; V262-V502 HydrophobicContact CG2-CB 3.93Å; V262-V502 HydrophobicContact CG2-CG2 4.04Å; V262-I504 HydrophobicContact CG1-CG2 4.45Å; V262-I504 HydrophobicContact CG2-CG2 3.76Å
263	M	91.8	Very high	93	Very high	17 Å²	17	31.7 Å²	31.7	8%	0.084	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	128.5	-178.4	-169.5	-177.4	80.3	0	0	108.5	D265 K266 I268 V309 L314 P334	M263-D265 PolarHBondContact O-N 3.15Å; M263-K266 PolarHBondContact N-O 3.32Å; M263-K266 WeakPolarHBondContact O-CB 3.43Å; M263-K266 PolarHBondContact O-N 3.33Å; M263-I268 HydrophobicContact CB-CD1 3.98Å; M263-I268 HydrophobicContact CE-CD1 3.64Å; M263-I268 HydrophobicContact SD-CD1 4.43Å; M263-V309 HydrophobicContact CB-CG2 4Å; M263-V309 HydrophobicContact CG-CG1 4.36Å; M263-V309 HydrophobicContact CG-CG2 4.25Å; M263-V309 HydrophobicContact SD-CG2 4.45Å; M263-L314 HydrophobicContact SD-CB 4.06Å; M263-P334 HydrophobicContact CE-CB 3.86Å
264	E	85.9	Confident	93	Very high	129 Å²	129	34 Å²	34	60%	0.603	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.8	52.5	177.4	-60.5	177.8	175	0	0	113.9	K266	E264-K266 PolarHBondContact O-N 3.07Å; E264-K266 VanDerWaalsContact O-N 3.08Å
265	D	87.7	Confident	92.7	Very high	77 Å²	77	31 Å²	31	41%	0.412	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	23.3	-177	-56.7	-38.8	0	0	0	114.9	M263 L287	M263-D265 PolarHBondContact O-N 3.15Å; D265-L287 WeakPolarHBondContact O-CB 2.85Å; D265-L287 WeakPolarHBondContact O-CG 3.2Å; D265-L287 PolarHBondContact O-N 3.43Å
266	K	92.3	Very high	92.2	Very high	76 Å²	76	39.5 Å²	39.5	33%	0.33	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	133.4	175.4	-64.4	167.5	-173.1	171	0	110.5	V262 M263 E264 I268 L285 D286	V262-K266 WeakPolarHBondContact CA-O 3.43Å; M263-K266 PolarHBondContact N-O 3.32Å; M263-K266 WeakPolarHBondContact O-CB 3.43Å; M263-K266 PolarHBondContact O-N 3.33Å; E264-K266 PolarHBondContact O-N 3.07Å; E264-K266 VanDerWaalsContact O-N 3.08Å; K266-I268 HydrophobicContact CB-CG1 4.3Å; K266-L285 CarbonylContact C-O 3.58Å; K266-L285 VanDerWaalsContact CA-O 3.25Å; K266-L285 WeakPolarHBondContact CA-O 3.33Å; K266-D286 HydrophobicContact CG-CB 4.49Å
267	L	95.3	Very high	92.2	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	114.3	165.1	170	61	0	0	0	108.5	L221 V223 W248 A260 V262 L269 S284 L285 L287 V502	L221-L267 HydrophobicContact CD1-CD2 4.13Å; V223-L267 HydrophobicContact CG2-CD2 4.01Å; W248-L267 HydrophobicContact CZ3-CD2 4.46Å; A260-L267 HydrophobicContact CB-CD1 4.21Å; V262-L267 HydrophobicContact CG2-CD1 4.32Å; L267-L269 HydrophobicContact CD1-CD2 4.14Å; L267-L269 HydrophobicContact CD2-CD2 4.47Å; L267-L269 HydrophobicContact CG-CD2 4.09Å; L267-S284 CarbonylContact O-C 3.58Å; L267-S284 WeakPolarHBondContact O-CA 3.45Å; L267-L285 HydrophobicContact CB-CB 4.21Å; L267-L285 HydrophobicContact CD2-CD2 4.31Å; L267-L285 PolarHBondContact N-O 3.29Å; L267-L285 PolarHBondContact O-N 3.13Å; L267-L287 HydrophobicContact CB-CD2 4.3Å; L267-V502 HydrophobicContact CD1-CG2 3.79Å
268	I	96.1	Very high	92.3	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.01	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	127.5	-177.7	-56.7	177.6	0	0	0	109.5	A260 A261 M263 K266 V270 V282 E283 L295 L314	A260-I268 VanDerWaalsContact CA-O 3.23Å; A260-I268 WeakPolarHBondContact CA-O 3.09Å; A261-I268 PolarHBondContact N-O 3.2Å; A261-I268 PolarHBondContact O-N 2.91Å; M263-I268 HydrophobicContact CB-CD1 3.98Å; M263-I268 HydrophobicContact CE-CD1 3.64Å; M263-I268 HydrophobicContact SD-CD1 4.43Å; K266-I268 HydrophobicContact CB-CG1 4.3Å; I268-V270 HydrophobicContact CG2-CG2 3.93Å; I268-V282 HydrophobicContact CG2-CG1 3.54Å; I268-E283 CarbonylContact C-O 3.59Å; I268-E283 WeakPolarHBondContact CA-O 3.32Å; I268-L295 HydrophobicContact CD1-CD1 4.09Å; I268-L295 HydrophobicContact CG1-CD1 4.28Å; I268-L295 HydrophobicContact CG2-CD1 4.05Å; I268-L314 HydrophobicContact CB-CD2 4.45Å; I268-L314 HydrophobicContact CD1-CD2 4.4Å; I268-L314 HydrophobicContact CG2-CD2 3.9Å
269	L	96.6	Very high	92.3	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	124.6	174.9	-50.9	-168.8	0	0	0	109.5	V223 M251 F258 A260 L267 V282 E283 W292	V223-L269 HydrophobicContact CG1-CD1 4.33Å; V223-L269 HydrophobicContact CG1-CD2 3.99Å; M251-L269 HydrophobicContact CE-CD1 3.44Å; M251-L269 VanDerWaalsContact CE-CD1 3.44Å; M251-L269 HydrophobicContact CG-CD1 4.14Å; M251-L269 HydrophobicContact SD-CD1 4.11Å; F258-L269 HydrophobicContact CD2-CB 4.33Å; F258-L269 HydrophobicContact CD2-CD2 4.2Å; F258-L269 HydrophobicContact CE2-CD1 4.31Å; F258-L269 HydrophobicContact CE2-CD2 3.83Å; A260-L269 HydrophobicContact CB-CD2 3.63Å; L267-L269 HydrophobicContact CD1-CD2 4.14Å; L267-L269 HydrophobicContact CD2-CD2 4.47Å; L267-L269 HydrophobicContact CG-CD2 4.09Å; L269-V282 VanDerWaalsContact O-CA 3.3Å; L269-V282 WeakPolarHBondContact O-CA 3.36Å; L269-V282 WeakPolarHBondContact O-CG1 3.48Å; L269-E283 PolarHBondContact N-O 3.16Å; L269-E283 PolarHBondContact O-N 3.2Å; L269-W292 HydrophobicContact CD1-CH2 3.52Å; L269-W292 HydrophobicContact CD1-CZ3 3.82Å; L269-W292 HydrophobicContact CG-CH2 3.93Å; L269-W292 HydrophobicContact CG-CZ3 3.94Å
270	V	96.9	Very high	92.4	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	125.9	-172	-172.9	0	0	0	0	109.9	F258 G259 I268 V282 M298 L305 V307 L314 A316 W339	F258-V270 WeakPolarHBondContact CB-O 3.46Å; G259-V270 PolarHBondContact N-O 3.32Å; G259-V270 PolarHBondContact O-N 3.08Å; I268-V270 HydrophobicContact CG2-CG2 3.93Å; V270-V282 HydrophobicContact CG1-CG2 4.17Å; V270-V282 HydrophobicContact CG2-CG1 4.17Å; V270-M298 HydrophobicContact CG1-CE 3.7Å; V270-M298 HydrophobicContact CG1-CG 4.27Å; V270-M298 HydrophobicContact CG1-SD 3.36Å; V270-M298 WeakPolarHBondContact CG1-SD 3.25Å; V270-L305 HydrophobicContact CB-CD1 4.39Å; V270-L305 HydrophobicContact CG1-CD1 3.9Å; V270-V307 HydrophobicContact CB-CG2 3.94Å; V270-V307 HydrophobicContact CG1-CG2 4.37Å; V270-V307 HydrophobicContact CG2-CG1 4.09Å; V270-V307 HydrophobicContact CG2-CG2 4.21Å; V270-L314 HydrophobicContact CG2-CD2 3.77Å; V270-A316 HydrophobicContact CG1-CB 4.27Å; V270-W339 HydrophobicContact CG1-CH2 4.06Å; V270-W339 HydrophobicContact CG1-CZ2 4.29Å
271	G	95.6	Very high	92.4	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.252	C	S	.	.			trans	60.5	-138.6	172.6	0	0	0	0	0	114.3	R255 F258 L279 T281 R302	R255-G271 WeakPolarHBondContact CD-O 3.45Å; R255-G271 WeakPolarHBondContact CG-O 3.48Å; R255-G271 PolarHBondContact NH1-O 2.84Å; F258-G271 WeakPolarHBondContact CB-O 3.42Å; G271-L279 WeakPolarHBondContact CA-O 3.43Å; G271-T281 PolarHBondContact N-O 3Å; G271-T281 VanDerWaalsContact N-O 3.11Å; G271-R302 CarbonylContact C-O 3.45Å
272	G	94.4	Very high	92.5	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.248	C	C	.	.			trans	90.4	-162.9	-172.3	0	0	0	0	0	112.8	L256 L279 R302	L256-G272 CarbonylContact O-C 3.44Å; L256-G272 WeakPolarHBondContact O-CA 3.34Å; G272-L279 WeakPolarHBondContact O-CB 3.48Å; G272-L279 PolarHBondContact O-N 2.81Å; G272-R302 PolarHBondContact N-O 2.75Å
273	R	91.7	Very high	92.5	Very high	83 Å²	83	48.2 Å²	48.2	31%	0.313	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	143.5	179.8	66.8	-177.8	-131.1	-168.5	6.9	111.8	L256 K277 H303	L256-R273 HydrophobicContact CB-CG 3.92Å; L256-R273 PolarHBondContact N-O 3.37Å; L256-R273 PolarHBondContact O-N 3.2Å; R273-K277 CarbonylContact C-O 3.51Å; R273-K277 VanDerWaalsContact CA-O 3.24Å; R273-K277 WeakPolarHBondContact CA-O 3.37Å; R273-K277 WeakPolarHBondContact CB-O 3.33Å; R273-H303 HydrophobicContact CB-CB 4.1Å; R273-H303 HydrophobicContact CG-CB 4.42Å
274	D	88.9	Confident	92.7	Very high	80 Å²	80	47.7 Å²	47.7	43%	0.428	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	90.1	170.2	-175.9	15.2	0	0	0	108.8	R254 L276 K277 L279	R254-D274 WeakPolarHBondContact O-CB 3.42Å; D274-L276 PolarHBondContact O-N 2.69Å; D274-K277 PolarHBondContact N-O 2.83Å; D274-K277 PolarHBondContact O-N 3.09Å; D274-L279 HydrophobicContact CB-CD1 4.22Å
275	G	83.6	Confident	93.1	Very high	25 Å²	25	41.6 Å²	41.6	26%	0.258	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.5	-104.4	-173.8	0	0	0	0	0	112.5
276	L	81	Confident	93.4	Very high	185 Å²	185	39.8 Å²	39.8	97%	0.969	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-19.1	-177.8	-65.8	174.8	0	0	0	113.2	D274	D274-L276 PolarHBondContact O-N 2.69Å
277	K	90.6	Very high	93.3	Very high	146 Å²	146	36.6 Å²	36.6	64%	0.635	19%	0.19	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-92.7	123.8	-175.6	-174.5	178.4	178.7	-177.5	0	110.8	R273 D274 L279	R273-K277 CarbonylContact C-O 3.51Å; R273-K277 VanDerWaalsContact CA-O 3.24Å; R273-K277 WeakPolarHBondContact CA-O 3.37Å; R273-K277 WeakPolarHBondContact CB-O 3.33Å; D274-K277 PolarHBondContact N-O 2.83Å; D274-K277 PolarHBondContact O-N 3.09Å; K277-L279 HydrophobicContact CD-CD2 4.3Å; K277-L279 HydrophobicContact CG-CD2 4.31Å
278	T	94.4	Very high	92.9	Very high	21 Å²	21	41.3 Å²	41.3	13%	0.129	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	136.2	165.3	-48.4	0	0	0	0	109.8	P301 H303 D321	T278-P301 HydrophobicContact CG2-CB 3.85Å; T278-H303 HydrophobicContact CG2-CB 4.15Å; T278-H303 WeakPolarHBondContact CG2-ND1 3.34Å; T278-H303 PolarHBondContact OG1-ND1 2.89Å; T278-D321 VanDerWaalsContact CB-O 3.25Å; T278-D321 WeakPolarHBondContact CB-O 3.43Å; T278-D321 PolarHBondContact OG1-O 2.81Å; T278-D321 VanDerWaalsContact OG1-O 3.05Å
279	L	95.5	Very high	92.6	Very high	23 Å²	23	45.6 Å²	45.6	12%	0.12	24%	0.241	C	C	.	.			trans	-104.6	142	-175.7	-56.3	175.5	0	0	0	110.9	R255 G271 G272 D274 K277 P301 R302	R255-L279 HydrophobicContact CG-CD1 4.19Å; G271-L279 WeakPolarHBondContact CA-O 3.43Å; G272-L279 WeakPolarHBondContact O-CB 3.48Å; G272-L279 PolarHBondContact O-N 2.81Å; D274-L279 HydrophobicContact CB-CD1 4.22Å; K277-L279 HydrophobicContact CD-CD2 4.3Å; K277-L279 HydrophobicContact CG-CD2 4.31Å; L279-P301 WeakPolarHBondContact O-CA 3.42Å; L279-R302 PolarHBondContact O-N 3.46Å
280	N	96.4	Very high	92.3	Very high	57 Å²	57	47.8 Å²	47.8	31%	0.305	25%	0.252	S	S	.	.			trans	-105	-0.5	163.6	66.8	-24.5	0	0	0	112.2	A297 M298 P301	N280-A297 CarbonylContact O-C 3.6Å; N280-A297 WeakPolarHBondContact O-CA 3.36Å; N280-A297 WeakPolarHBondContact O-CB 3.23Å; N280-M298 HydrophobicContact CB-CB 4.28Å; N280-M298 WeakPolarHBondContact CB-O 3.39Å; N280-M298 PolarHBondContact ND2-O 3.47Å; N280-M298 PolarHBondContact O-N 3.17Å; N280-P301 HydrophobicContact CB-CB 4.09Å
281	T	96.4	Very high	92	Very high	56 Å²	56	50 Å²	50	34%	0.344	27%	0.271	S	S	.	.			trans	-72.3	146.8	-174.9	57.2	0	0	0	0	111.4	R255 G271	R255-T281 PolarHBondContact NH1-O 3.46Å; R255-T281 PolarHBondContact NH2-OG1 2.86Å; G271-T281 PolarHBondContact N-O 3Å; G271-T281 VanDerWaalsContact N-O 3.11Å
282	V	96.7	Very high	92	Very high	3 Å²	3	52.6 Å²	52.6	2%	0.018	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	133.4	179.4	-173.8	0	0	0	0	108.1	I268 L269 V270 L295 M298 W339	I268-V282 HydrophobicContact CG2-CG1 3.54Å; L269-V282 VanDerWaalsContact O-CA 3.3Å; L269-V282 WeakPolarHBondContact O-CA 3.36Å; L269-V282 WeakPolarHBondContact O-CG1 3.48Å; V270-V282 HydrophobicContact CG1-CG2 4.17Å; V270-V282 HydrophobicContact CG2-CG1 4.17Å; V282-L295 HydrophobicContact CB-CB 3.98Å; V282-L295 HydrophobicContact CG1-CB 3.87Å; V282-L295 HydrophobicContact CG1-CD1 4.01Å; V282-L295 HydrophobicContact CG1-CG 4.48Å; V282-L295 PolarHBondContact O-N 2.85Å; V282-M298 HydrophobicContact CG2-CG 4.26Å; V282-W339 HydrophobicContact CG2-CZ2 3.85Å
283	E	95.4	Very high	92.1	Very high	33 Å²	33	54.8 Å²	54.8	15%	0.154	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	137.9	-179.7	-63.9	-177.7	-106.1	0	0	109.2	T252 R255 I268 L269 W292	T252-E283 WeakPolarHBondContact CB-OE2 3.29Å; T252-E283 VanDerWaalsContact CG2-OE2 3.3Å; T252-E283 WeakPolarHBondContact CG2-OE2 3.44Å; T252-E283 VanDerWaalsContact OG1-CD 3.28Å; T252-E283 PolarHBondContact OG1-OE1 3.06Å; T252-E283 PolarHBondContact OG1-OE2 2.97Å; R255-E283 IonicContact CZ-OE1 3.21Å; R255-E283 IonicContact NE-OE1 3.62Å; R255-E283 IonicContact NH2-OE1 2.88Å; R255-E283 PolarHBondContact NH2-OE1 3.49Å; I268-E283 CarbonylContact C-O 3.59Å; I268-E283 WeakPolarHBondContact CA-O 3.32Å; L269-E283 PolarHBondContact N-O 3.16Å; L269-E283 PolarHBondContact O-N 3.2Å; E283-W292 HydrophobicContact CB-CE3 4.1Å; E283-W292 HydrophobicContact CB-CZ3 4.16Å
284	S	95.4	Very high	92.2	Very high	6 Å²	6	56.3 Å²	56.3	4%	0.042	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	133	175.3	61.1	0	0	0	0	110.6	L267 W292 A293	L267-S284 CarbonylContact O-C 3.58Å; L267-S284 WeakPolarHBondContact O-CA 3.45Å; S284-W292 CarbonylContact O-C 3.53Å; S284-W292 WeakPolarHBondContact O-CA 3Å; S284-A293 PolarHBondContact N-O 3.16Å; S284-A293 PolarHBondContact O-N 3.39Å; S284-A293 PolarHBondContact OG-O 3.05Å
285	L	95	Very high	92.5	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	116.3	167.1	172.4	69.1	0	0	0	108.3	W248 K249 K266 L267 L287 A291 W292	W248-L285 HydrophobicContact CH2-CD2 3.56Å; W248-L285 HydrophobicContact CZ3-CD2 3.64Å; K249-L285 HydrophobicContact CD-CD1 3.82Å; K249-L285 HydrophobicContact CD-CD2 3.88Å; K266-L285 CarbonylContact C-O 3.58Å; K266-L285 VanDerWaalsContact CA-O 3.25Å; K266-L285 WeakPolarHBondContact CA-O 3.33Å; L267-L285 HydrophobicContact CB-CB 4.21Å; L267-L285 HydrophobicContact CD2-CD2 4.31Å; L267-L285 PolarHBondContact N-O 3.29Å; L267-L285 PolarHBondContact O-N 3.13Å; L285-L287 PolarHBondContact O-N 2.79Å; L285-A291 WeakPolarHBondContact CA-O 3.33Å; L285-W292 HydrophobicContact CB-CD2 3.92Å; L285-W292 HydrophobicContact CB-CE3 3.72Å; L285-W292 HydrophobicContact CB-CH2 3.78Å; L285-W292 HydrophobicContact CB-CZ2 4.01Å; L285-W292 HydrophobicContact CB-CZ3 3.65Å; L285-W292 HydrophobicContact CD1-CD2 4.19Å; L285-W292 HydrophobicContact CD1-CG 4.28Å; L285-W292 HydrophobicContact CD2-CH2 4.44Å; L285-W292 HydrophobicContact CD2-CZ2 4.1Å; L285-W292 HydrophobicContact CG-CZ2 4.48Å
286	D	92.4	Very high	93.1	Very high	40 Å²	40	57.9 Å²	57.9	21%	0.214	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	122.2	169.8	175.8	-10.9	0	0	0	109.3	K266 N288 T289 M290 A291	K266-D286 HydrophobicContact CG-CB 4.49Å; D286-N288 VanDerWaalsContact C-N 3.27Å; D286-N288 PolarHBondContact O-N 2.92Å; D286-N288 WeakPolarHBondContact OD1-CB 3.45Å; D286-N288 PolarHBondContact OD1-N 2.88Å; D286-T289 VanDerWaalsContact CB-OG1 3.26Å; D286-T289 WeakPolarHBondContact CB-OG1 3.3Å; D286-T289 PolarHBondContact OD1-N 2.71Å; D286-T289 WeakPolarHBondContact OD2-CG2 3.43Å; D286-T289 PolarHBondContact OD2-OG1 2.8Å; D286-M290 WeakPolarHBondContact O-CA 3.49Å; D286-M290 PolarHBondContact O-N 3.49Å; D286-A291 PolarHBondContact N-O 3.12Å
287	L	89.9	Confident	93.8	Very high	8 Å²	8	51.3 Å²	51.3	4%	0.042	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-17.8	-175.9	-61.7	175.3	0	0	0	112.8	W248 V262 D265 L267 L285 I504	W248-L287 HydrophobicContact CH2-CD2 3.64Å; W248-L287 HydrophobicContact CZ2-CD2 4.15Å; V262-L287 HydrophobicContact CG1-CD1 4.34Å; D265-L287 WeakPolarHBondContact O-CB 2.85Å; D265-L287 WeakPolarHBondContact O-CG 3.2Å; D265-L287 PolarHBondContact O-N 3.43Å; L267-L287 HydrophobicContact CB-CD2 4.3Å; L285-L287 PolarHBondContact O-N 2.79Å; L287-I504 HydrophobicContact CD1-CB 4.12Å; L287-I504 HydrophobicContact CD1-CG2 3.77Å; L287-I504 HydrophobicContact CD2-CD1 4.48Å; L287-I504 HydrophobicContact CD2-CG2 4.33Å
288	N	88.1	Confident	94.1	Very high	99 Å²	99	44.5 Å²	44.5	53%	0.529	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-50.4	178	-61.8	-54.2	0	0	0	111.1	D286	D286-N288 VanDerWaalsContact C-N 3.27Å; D286-N288 PolarHBondContact O-N 2.92Å; D286-N288 WeakPolarHBondContact OD1-CB 3.45Å; D286-N288 PolarHBondContact OD1-N 2.88Å
289	T	89.3	Confident	94.2	Very high	92 Å²	92	46.7 Å²	46.7	56%	0.564	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-14.7	-179.7	61.8	0	0	0	0	112.8	D286 A291	D286-T289 VanDerWaalsContact CB-OG1 3.26Å; D286-T289 WeakPolarHBondContact CB-OG1 3.3Å; D286-T289 PolarHBondContact OD1-N 2.71Å; D286-T289 WeakPolarHBondContact OD2-CG2 3.43Å; D286-T289 PolarHBondContact OD2-OG1 2.8Å; T289-A291 PolarHBondContact O-N 2.59Å; T289-A291 PolarHBondContact OG1-N 3.07Å
290	M	89.7	Confident	94.2	Very high	46 Å²	46	46.8 Å²	46.8	23%	0.227	29%	0.286	C	S	.	.			trans	53.9	36.1	-172.6	-65.5	-67	-79.4	0	0	111.4	W248 K249 D286	W248-M290 HydrophobicContact CD2-CE 4.19Å; W248-M290 HydrophobicContact CH2-CE 3.97Å; W248-M290 HydrophobicContact CH2-SD 4.13Å; W248-M290 HydrophobicContact CZ2-CE 3.29Å; W248-M290 HydrophobicContact CZ2-SD 3.57Å; W248-M290 VanDerWaalsContact CZ2-SD 3.57Å; K249-M290 HydrophobicContact CD-CE 3.82Å; K249-M290 WeakPolarHBondContact CE-O 3.41Å; K249-M290 PolarHBondContact NZ-O 3.35Å; D286-M290 WeakPolarHBondContact O-CA 3.49Å; D286-M290 PolarHBondContact O-N 3.49Å
291	A	92.4	Very high	94.2	Very high	48 Å²	48	46 Å²	46	40%	0.397	28%	0.284	S	S	.	.			trans	-110.3	137.3	179.6	0	0	0	0	0	111.5	L285 D286 T289	L285-A291 WeakPolarHBondContact CA-O 3.33Å; D286-A291 PolarHBondContact N-O 3.12Å; T289-A291 PolarHBondContact O-N 2.59Å; T289-A291 PolarHBondContact OG1-N 3.07Å
292	W	95.6	Very high	94.2	Very high	54 Å²	54	43.4 Å²	43.4	21%	0.205	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	135.6	171.9	-73.8	107.4	0	0	0	110.1	I235 H250 M251 T252 L269 E283 S284 L285	I235-W292 HydrophobicContact CD1-CZ2 3.99Å; H250-W292 PolarHBondContact O-NE1 2.72Å; M251-W292 HydrophobicContact CG-CZ2 4.38Å; T252-W292 HydrophobicContact CG2-CB 3.78Å; T252-W292 HydrophobicContact CG2-CD2 4.14Å; T252-W292 HydrophobicContact CG2-CG 3.69Å; L269-W292 HydrophobicContact CD1-CH2 3.52Å; L269-W292 HydrophobicContact CD1-CZ3 3.82Å; L269-W292 HydrophobicContact CG-CH2 3.93Å; L269-W292 HydrophobicContact CG-CZ3 3.94Å; E283-W292 HydrophobicContact CB-CE3 4.1Å; E283-W292 HydrophobicContact CB-CZ3 4.16Å; S284-W292 CarbonylContact O-C 3.53Å; S284-W292 WeakPolarHBondContact O-CA 3Å; L285-W292 HydrophobicContact CB-CD2 3.92Å; L285-W292 HydrophobicContact CB-CE3 3.72Å; L285-W292 HydrophobicContact CB-CH2 3.78Å; L285-W292 HydrophobicContact CB-CZ2 4.01Å; L285-W292 HydrophobicContact CB-CZ3 3.65Å; L285-W292 HydrophobicContact CD1-CD2 4.19Å; L285-W292 HydrophobicContact CD1-CG 4.28Å; L285-W292 HydrophobicContact CD2-CH2 4.44Å; L285-W292 HydrophobicContact CD2-CZ2 4.1Å; L285-W292 HydrophobicContact CG-CZ2 4.48Å
293	A	95.2	Very high	94.1	Very high	45 Å²	45	44.4 Å²	44.4	37%	0.372	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	140.9	173.9	0	0	0	0	0	110.3	S284	S284-A293 PolarHBondContact N-O 3.16Å; S284-A293 PolarHBondContact O-N 3.39Å; S284-A293 PolarHBondContact OG-O 3.05Å
294	P	95.1	Very high	93.9	Very high	115 Å²	115	43.2 Å²	43.2	75%	0.747	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.9	142	172	30.3	-33.5	0	0	0	110.7
295	L	94.6	Very high	94	Very high	47 Å²	47	43.4 Å²	43.4	25%	0.246	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	167.4	166.4	-69.7	-179.4	0	0	0	109.9	I268 V282 A297	I268-L295 HydrophobicContact CD1-CD1 4.09Å; I268-L295 HydrophobicContact CG1-CD1 4.28Å; I268-L295 HydrophobicContact CG2-CD1 4.05Å; V282-L295 HydrophobicContact CB-CB 3.98Å; V282-L295 HydrophobicContact CG1-CB 3.87Å; V282-L295 HydrophobicContact CG1-CD1 4.01Å; V282-L295 HydrophobicContact CG1-CG 4.48Å; V282-L295 PolarHBondContact O-N 2.85Å; L295-A297 PolarHBondContact O-N 3.36Å
296	N	95.4	Very high	94	Very high	91 Å²	91	43.8 Å²	43.8	49%	0.487	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-59.1	133.8	176.7	-70.5	-8.6	0	0	0	110.1	W332 R337 W339	N296-W332 HydrophobicContact CB-CH2 3.78Å; N296-W332 HydrophobicContact CB-CZ3 3.66Å; N296-R337 PolarHBondContact ND2-O 3.07Å; N296-W339 PolarHBondContact O-NE1 3.02Å
297	A	96.6	Very high	94.2	Very high	48 Å²	48	42.7 Å²	42.7	40%	0.397	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-71.3	152.1	-178.1	0	0	0	0	0	111.3	N280 L295 W339	N280-A297 CarbonylContact O-C 3.6Å; N280-A297 WeakPolarHBondContact O-CA 3.36Å; N280-A297 WeakPolarHBondContact O-CB 3.23Å; L295-A297 PolarHBondContact O-N 3.36Å; A297-W339 VanDerWaalsContact O-CD1 3.23Å
298	M	96.9	Very high	94.5	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.015	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-64.6	157.9	169	-65.3	179.6	-62.4	0	0	110.7	V270 N280 V282 R302 L305 A316 W339	V270-M298 HydrophobicContact CG1-CE 3.7Å; V270-M298 HydrophobicContact CG1-CG 4.27Å; V270-M298 HydrophobicContact CG1-SD 3.36Å; V270-M298 WeakPolarHBondContact CG1-SD 3.25Å; N280-M298 HydrophobicContact CB-CB 4.28Å; N280-M298 WeakPolarHBondContact CB-O 3.39Å; N280-M298 PolarHBondContact ND2-O 3.47Å; N280-M298 PolarHBondContact O-N 3.17Å; V282-M298 HydrophobicContact CG2-CG 4.26Å; M298-R302 HydrophobicContact CE-CB 4.17Å; M298-R302 HydrophobicContact CE-CG 4.29Å; M298-L305 HydrophobicContact CE-CD1 4.4Å; M298-L305 HydrophobicContact SD-CD1 4.4Å; M298-A316 HydrophobicContact SD-CB 3.69Å; M298-W339 HydrophobicContact CG-CD2 3.86Å; M298-W339 HydrophobicContact CG-CE3 4.15Å; M298-W339 HydrophobicContact CG-CG 4.39Å; M298-W339 HydrophobicContact CG-CH2 4.15Å; M298-W339 HydrophobicContact CG-CZ2 3.89Å; M298-W339 HydrophobicContact CG-CZ3 4.28Å; M298-W339 HydrophobicContact SD-CH2 4.42Å
299	A	95.8	Very high	94.9	Very high	66 Å²	66	40.2 Å²	40.2	55%	0.545	26%	0.257	S	S	.	.	S	Bend	trans	-68.8	-40.5	174.6	0	0	0	0	0	111.1	E330 Y341	A299-E330 WeakPolarHBondContact CB-OE2 3.31Å; A299-E330 PolarHBondContact N-OE2 2.86Å; A299-Y341 HydrophobicContact CB-CE2 4.09Å; A299-Y341 WeakPolarHBondContact CB-OH 3.12Å
300	T	95.2	Very high	95.1	Very high	25 Å²	25	35.9 Å²	35.9	15%	0.153	23%	0.231	C	C	.	.	S	Bend	trans	-107.1	134.9	178.7	-49.7	0	0	0	0	110.8	D321 L326 E330 Y341	T300-D321 HydrophobicContact CG2-CB 4.03Å; T300-L326 HydrophobicContact CG2-CD1 4.02Å; T300-L326 HydrophobicContact CG2-CD2 4.48Å; T300-E330 PolarHBondContact N-OE1 2.9Å; T300-Y341 PolarHBondContact OG1-OH 3.18Å
301	P	96.4	Very high	95.1	Very high	42 Å²	42	39.5 Å²	39.5	27%	0.273	25%	0.247	S	C	.	.			trans	-67.8	137.8	168.5	29.6	-33.7	0	0	0	110	T278 L279 N280 D321	T278-P301 HydrophobicContact CG2-CB 3.85Å; L279-P301 WeakPolarHBondContact O-CA 3.42Å; N280-P301 HydrophobicContact CB-CB 4.09Å; P301-D321 HydrophobicContact CG-CB 4.37Å; P301-D321 WeakPolarHBondContact O-CA 2.97Å; P301-D321 VanDerWaalsContact O-CB 3.27Å; P301-D321 WeakPolarHBondContact O-CB 3.1Å
302	R	96.2	Very high	95	Very high	0 Å²	0	39 Å²	39	0%	0	25%	0.246	C	C	.	.			trans	-143.3	130.6	-174.1	-58.5	174.1	-176.6	-90.7	-5.6	110.7	G271 G272 L279 M298 L305 G318 H320 L326 T328 E330	G271-R302 CarbonylContact C-O 3.45Å; G272-R302 PolarHBondContact N-O 2.75Å; L279-R302 PolarHBondContact O-N 3.46Å; M298-R302 HydrophobicContact CE-CB 4.17Å; M298-R302 HydrophobicContact CE-CG 4.29Å; R302-L305 HydrophobicContact CB-CB 4.26Å; R302-L305 HydrophobicContact CB-CD1 4.12Å; R302-G318 PolarHBondContact NH1-O 2.95Å; R302-H320 WeakPolarHBondContact CA-O 3.43Å; R302-L326 HydrophobicContact CG-CD1 3.72Å; R302-T328 PolarHBondContact NH1-O 3.42Å; R302-T328 PolarHBondContact NH1-OG1 2.84Å; R302-T328 PolarHBondContact NH2-OG1 2.8Å; R302-E330 IonicContact CZ-OE1 2.66Å; R302-E330 IonicContact NE-OE1 3.46Å; R302-E330 PolarHBondContact NE-OE1 3.48Å; R302-E330 IonicContact NH2-OE1 3.08Å; R302-E330 PolarHBondContact NH2-OE1 3.18Å
303	H	94.7	Very high	94.9	Very high	25 Å²	25	37.3 Å²	37.3	12%	0.116	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-124.5	157	163.1	69.5	-96.4	0	0	0	110.9	Q257 R273 T278 L305 G319 H320	Q257-H303 HydrophobicContact CB-CB 4.34Å; Q257-H303 PolarHBondContact OE1-CD2 2.71Å; Q257-H303 VanDerWaalsContact OE1-CD2 3.23Å; R273-H303 HydrophobicContact CB-CB 4.1Å; R273-H303 HydrophobicContact CG-CB 4.42Å; T278-H303 HydrophobicContact CG2-CB 4.15Å; T278-H303 WeakPolarHBondContact CG2-ND1 3.34Å; T278-H303 PolarHBondContact OG1-ND1 2.89Å; H303-L305 PolarHBondContact O-N 3.01Å; H303-G319 CarbonylContact O-C 3.54Å; H303-G319 VanDerWaalsContact O-CA 3.23Å; H303-G319 WeakPolarHBondContact O-CA 3.15Å; H303-H320 AromaticContact CE1-CG 3.87Å; H303-H320 AromaticContact CE1-ND1 3.26Å; H303-H320 PolarHBondContact CE1-ND1 3.13Å; H303-H320 VanDerWaalsContact CE1-ND1 3.26Å; H303-H320 PolarHBondContact N-O 3.42Å; H303-H320 PolarHBondContact ND1-O 3.05Å; H303-H320 VanDerWaalsContact ND1-O 3.12Å; H303-H320 AromaticContact NE2-ND1 3.77Å; H303-H320 PolarHBondContact O-N 3.3Å
304	G	92.7	Very high	95	Very high	7 Å²	7	35.2 Å²	35.2	7%	0.072	23%	0.225	C	C	.	.	S	Bend	trans	65.2	23.3	-172.9	0	0	0	0	0	112.9	Q257 T351	Q257-G304 PolarHBondContact O-N 2.72Å; G304-T351 WeakPolarHBondContact O-CA 3.37Å; G304-T351 PolarHBondContact O-N 3.27Å
305	L	95.9	Very high	95.1	Very high	11 Å²	11	30.1 Å²	30.1	6%	0.058	19%	0.191	C	C	.	.			trans	-78.4	154.4	176.4	71.6	168.7	0	0	0	111.5	V270 M298 R302 H303 V307 A316	V270-L305 HydrophobicContact CB-CD1 4.39Å; V270-L305 HydrophobicContact CG1-CD1 3.9Å; M298-L305 HydrophobicContact CE-CD1 4.4Å; M298-L305 HydrophobicContact SD-CD1 4.4Å; R302-L305 HydrophobicContact CB-CB 4.26Å; R302-L305 HydrophobicContact CB-CD1 4.12Å; H303-L305 PolarHBondContact O-N 3.01Å; L305-V307 HydrophobicContact CD1-CG2 3.78Å; L305-V307 HydrophobicContact CG-CG2 3.99Å; L305-A316 HydrophobicContact CD1-CB 3.99Å
306	G	95.5	Very high	95.3	Very high	8 Å²	8	27.9 Å²	27.9	8%	0.082	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	144.8	164	0	0	0	0	0	110.8	V317	G306-V317 PolarHBondContact N-O 2.81Å; G306-V317 VanDerWaalsContact N-O 3.08Å; G306-V317 PolarHBondContact O-N 2.85Å
307	V	96.8	Very high	95.4	Very high	17 Å²	17	23.7 Å²	23.7	10%	0.103	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	131.7	-178.8	176.4	0	0	0	0	109.5	A261 V270 L305 L314 Y315	A261-V307 HydrophobicContact CB-CG1 3.96Å; V270-V307 HydrophobicContact CB-CG2 3.94Å; V270-V307 HydrophobicContact CG1-CG2 4.37Å; V270-V307 HydrophobicContact CG2-CG1 4.09Å; V270-V307 HydrophobicContact CG2-CG2 4.21Å; L305-V307 HydrophobicContact CD1-CG2 3.78Å; L305-V307 HydrophobicContact CG-CG2 3.99Å; V307-L314 HydrophobicContact CG1-CD1 3.45Å; V307-L314 VanDerWaalsContact CG1-CD1 3.45Å; V307-L314 HydrophobicContact CG1-CD2 4.39Å; V307-L314 HydrophobicContact CG1-CG 4.02Å; V307-Y315 VanDerWaalsContact CA-O 3.3Å; V307-Y315 WeakPolarHBondContact CA-O 3.34Å
308	A	96.3	Very high	95.4	Very high	10 Å²	10	21.4 Å²	21.4	8%	0.083	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	153.6	175.1	0	0	0	0	0	111.8	Y315 V354 V356 L361	A308-Y315 PolarHBondContact N-O 3.42Å; A308-Y315 PolarHBondContact O-N 3.43Å; A308-V354 HydrophobicContact CB-CG1 3.95Å; A308-V356 HydrophobicContact CB-CG2 3.83Å; A308-L361 HydrophobicContact CB-CD1 3.77Å
309	V	95.9	Very high	95.3	Very high	44 Å²	44	21.3 Å²	21.3	27%	0.267	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	124.6	174.2	177.3	0	0	0	0	108.4	A261 M263 P313 L314	A261-V309 HydrophobicContact CB-CG2 3.95Å; M263-V309 HydrophobicContact CB-CG2 4Å; M263-V309 HydrophobicContact CG-CG1 4.36Å; M263-V309 HydrophobicContact CG-CG2 4.25Å; M263-V309 HydrophobicContact SD-CG2 4.45Å; V309-P313 WeakPolarHBondContact CA-O 3.37Å; V309-L314 HydrophobicContact CG2-CB 4.5Å; V309-L314 HydrophobicContact CG2-CD1 3.53Å
310	L	94.6	Very high	95.2	Very high	1 Å²	1	19.5 Å²	19.5	1%	0.005	12%	0.118	C	C	.	.			trans	-127.8	115.3	178.6	168.5	67.1	0	0	0	108.6	G312 P313 Y315 V356 G359 L361 P381	L310-G312 PolarHBondContact O-N 3.47Å; L310-G312 VanDerWaalsContact O-N 3.14Å; L310-P313 PolarHBondContact N-O 3.39Å; L310-P313 VanDerWaalsContact O-CD 3.27Å; L310-P313 WeakPolarHBondContact O-CD 3.31Å; L310-Y315 HydrophobicContact CB-CD2 3.95Å; L310-Y315 HydrophobicContact CB-CE2 3.67Å; L310-Y315 HydrophobicContact CD2-CE2 4.21Å; L310-Y315 HydrophobicContact CG-CE2 4.28Å; L310-V356 HydrophobicContact CB-CG1 4.41Å; L310-V356 HydrophobicContact CB-CG2 3.91Å; L310-V356 HydrophobicContact CD1-CG1 3.54Å; L310-V356 HydrophobicContact CD1-CG2 4.39Å; L310-G359 VanDerWaalsContact CD1-C 3.45Å; L310-G359 WeakPolarHBondContact CD1-O 3Å; L310-L361 HydrophobicContact CD2-CB 4.08Å; L310-P381 HydrophobicContact CD2-CB 4.1Å; L310-P381 HydrophobicContact CD2-CG 3.84Å
311	E	89	Confident	95.2	Very high	123 Å²	123	19.8 Å²	19.8	58%	0.575	12%	0.119	S	C	*	.	S	Bend	trans	55	29	176.5	-61.2	179.1	167.5	0	0	114.4	P313 H382	E311-P313 WeakPolarHBondContact O-CD 3.35Å; E311-H382 IonicContact OE1-CE1 3.62Å; E311-H382 IonicContact OE2-CE1 2.91Å
312	G	90.3	Very high	94.9	Very high	36 Å²	36	19.7 Å²	19.7	37%	0.371	13%	0.125	S	C	.	.	S	Bend	trans	111.6	-59.2	-179.5	0	0	0	0	0	112.9	L310	L310-G312 PolarHBondContact O-N 3.47Å; L310-G312 VanDerWaalsContact O-N 3.14Å
313	P	94.6	Very high	94.5	Very high	20 Å²	20	31.1 Å²	31.1	13%	0.13	17%	0.169	C	C	.	.			trans	-61	150.1	176.6	-26.7	34.6	0	0	0	114.5	V309 L310 E311 Y315 R331 W332	V309-P313 WeakPolarHBondContact CA-O 3.37Å; L310-P313 PolarHBondContact N-O 3.39Å; L310-P313 VanDerWaalsContact O-CD 3.27Å; L310-P313 WeakPolarHBondContact O-CD 3.31Å; E311-P313 WeakPolarHBondContact O-CD 3.35Å; P313-Y315 HydrophobicContact CB-CE2 3.83Å; P313-R331 HydrophobicContact CB-CG 3.81Å; P313-W332 WeakPolarHBondContact CA-O 3.46Å; P313-W332 WeakPolarHBondContact CB-O 3.48Å
314	L	96.6	Very high	94.4	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	133.5	176.1	178.7	79.5	0	0	0	109.8	A261 M263 I268 V270 V307 V309 R331 W332 W339	A261-L314 HydrophobicContact CB-CD1 3.58Å; M263-L314 HydrophobicContact SD-CB 4.06Å; I268-L314 HydrophobicContact CB-CD2 4.45Å; I268-L314 HydrophobicContact CD1-CD2 4.4Å; I268-L314 HydrophobicContact CG2-CD2 3.9Å; V270-L314 HydrophobicContact CG2-CD2 3.77Å; V307-L314 HydrophobicContact CG1-CD1 3.45Å; V307-L314 VanDerWaalsContact CG1-CD1 3.45Å; V307-L314 HydrophobicContact CG1-CD2 4.39Å; V307-L314 HydrophobicContact CG1-CG 4.02Å; V309-L314 HydrophobicContact CG2-CB 4.5Å; V309-L314 HydrophobicContact CG2-CD1 3.53Å; L314-R331 CarbonylContact O-C 3.55Å; L314-R331 WeakPolarHBondContact O-CA 3.48Å; L314-W332 HydrophobicContact CB-CB 4.03Å; L314-W332 HydrophobicContact CB-CG 4.49Å; L314-W332 PolarHBondContact N-O 2.88Å; L314-W332 PolarHBondContact O-N 3.07Å; L314-W339 HydrophobicContact CD2-CH2 4.07Å; L314-W339 HydrophobicContact CD2-CZ2 4.49Å
315	Y	97.8	Very high	94.5	Very high	7 Å²	7	35.1 Å²	35.1	3%	0.027	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	130.4	-177.4	-66.9	-101.2	0	0	0	110.6	V307 A308 L310 P313 V329 E330 R331 V342 L361 Y379	V307-Y315 VanDerWaalsContact CA-O 3.3Å; V307-Y315 WeakPolarHBondContact CA-O 3.34Å; A308-Y315 PolarHBondContact N-O 3.42Å; A308-Y315 PolarHBondContact O-N 3.43Å; L310-Y315 HydrophobicContact CB-CD2 3.95Å; L310-Y315 HydrophobicContact CB-CE2 3.67Å; L310-Y315 HydrophobicContact CD2-CE2 4.21Å; L310-Y315 HydrophobicContact CG-CE2 4.28Å; P313-Y315 HydrophobicContact CB-CE2 3.83Å; Y315-V329 HydrophobicContact CD1-CG1 4.37Å; Y315-E330 CarbonylContact C-O 3.51Å; Y315-E330 WeakPolarHBondContact CA-O 3.39Å; Y315-R331 HydrophobicContact CD1-CB 4.01Å; Y315-R331 HydrophobicContact CD1-CG 4.27Å; Y315-R331 HydrophobicContact CE1-CB 3.85Å; Y315-R331 HydrophobicContact CE1-CG 3.81Å; Y315-R331 HydrophobicContact CE2-CG 4.37Å; Y315-V342 HydrophobicContact CE1-CG1 4.39Å; Y315-L361 HydrophobicContact CD1-CD2 4.26Å; Y315-L361 HydrophobicContact CG-CD2 4.1Å; Y315-Y379 AromaticContact CE1-CE1 3.88Å; Y315-Y379 HydrophobicContact CE1-CE1 3.88Å
316	A	97.7	Very high	94.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	110.5	172.6	0	0	0	0	0	109	V270 M298 L305 V329 E330 W339	V270-A316 HydrophobicContact CG1-CB 4.27Å; M298-A316 HydrophobicContact SD-CB 3.69Å; L305-A316 HydrophobicContact CD1-CB 3.99Å; A316-V329 WeakPolarHBondContact O-CA 3.35Å; A316-E330 HydrophobicContact CB-CB 4.49Å; A316-E330 PolarHBondContact N-O 2.9Å; A316-E330 PolarHBondContact O-N 3.42Å; A316-W339 HydrophobicContact CB-CH2 4.17Å; A316-W339 HydrophobicContact CB-CZ3 3.84Å
317	V	97.8	Very high	94.6	Very high	4 Å²	4	37.6 Å²	37.6	2%	0.024	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	122.5	-167.7	-175.9	0	0	0	0	110.6	G306 V329 M345 V354 L361 A363 W386	G306-V317 PolarHBondContact N-O 2.81Å; G306-V317 VanDerWaalsContact N-O 3.08Å; G306-V317 PolarHBondContact O-N 2.85Å; V317-V329 HydrophobicContact CB-CG2 4.44Å; V317-V329 HydrophobicContact CG1-CG2 4Å; V317-V329 HydrophobicContact CG2-CG1 3.93Å; V317-M345 HydrophobicContact CG1-CE 3.81Å; V317-M345 HydrophobicContact CG1-SD 3.52Å; V317-M345 VanDerWaalsContact CG1-SD 3.52Å; V317-V354 HydrophobicContact CB-CG2 3.95Å; V317-V354 HydrophobicContact CG1-CG2 4.12Å; V317-V354 HydrophobicContact CG2-CG1 4.03Å; V317-V354 HydrophobicContact CG2-CG2 4.28Å; V317-L361 HydrophobicContact CG2-CD2 3.7Å; V317-A363 HydrophobicContact CG1-CB 4.24Å; V317-W386 HydrophobicContact CG1-CH2 4.21Å
318	G	96.4	Very high	94.6	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.207	C	C	.	.			trans	63.6	-137.6	172.6	0	0	0	0	0	113.6	R302 L326 T328	R302-G318 PolarHBondContact NH1-O 2.95Å; G318-L326 WeakPolarHBondContact CA-O 3.45Å; G318-T328 PolarHBondContact N-O 3.42Å; G318-T328 VanDerWaalsContact N-O 3.16Å
319	G	95.6	Very high	94.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.203	C	C	.	.			trans	95	-159.3	-176.2	0	0	0	0	0	113.3	H303 L326 R349	H303-G319 CarbonylContact O-C 3.54Å; H303-G319 VanDerWaalsContact O-CA 3.23Å; H303-G319 WeakPolarHBondContact O-CA 3.15Å; G319-L326 PolarHBondContact O-N 2.86Å; G319-R349 PolarHBondContact N-O 2.91Å
320	H	94.2	Very high	94.8	Very high	29 Å²	29	36.1 Å²	36.1	13%	0.134	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-137.2	133.7	178	-173.7	-88.2	0	0	0	109.4	R302 H303 G322 W323 S324 Y325	R302-H320 WeakPolarHBondContact CA-O 3.43Å; H303-H320 AromaticContact CE1-CG 3.87Å; H303-H320 AromaticContact CE1-ND1 3.26Å; H303-H320 PolarHBondContact CE1-ND1 3.13Å; H303-H320 VanDerWaalsContact CE1-ND1 3.26Å; H303-H320 PolarHBondContact N-O 3.42Å; H303-H320 PolarHBondContact ND1-O 3.05Å; H303-H320 VanDerWaalsContact ND1-O 3.12Å; H303-H320 AromaticContact NE2-ND1 3.77Å; H303-H320 PolarHBondContact O-N 3.3Å; H320-G322 VanDerWaalsContact CE1-CA 3.49Å; H320-G322 WeakPolarHBondContact CE1-CA 3.46Å; H320-G322 PolarHBondContact CE1-N 2.77Å; H320-G322 WeakPolarHBondContact ND1-CA 3.42Å; H320-G322 PolarHBondContact ND1-N 2.85Å; H320-W323 PolarHBondContact CE1-N 2.84Å; H320-S324 WeakPolarHBondContact CA-O 3.15Å; H320-S324 PolarHBondContact CD2-O 3.05Å; H320-Y325 AromaticContact CD2-CD1 4Å; H320-Y325 AromaticContact CD2-CD2 3.8Å; H320-Y325 AromaticContact CD2-CE2 3.85Å; H320-Y325 AromaticContact CD2-CG 3.86Å; H320-Y325 AromaticContact CD2-CZ 3.99Å
321	D	94	Very high	94.9	Very high	31 Å²	31	39.7 Å²	39.7	17%	0.166	20%	0.204	C	C	.	.			trans	-86.4	-11	-176.1	60.8	12.3	0	0	0	114.1	T278 T300 P301 W323 S324 L326	T278-D321 VanDerWaalsContact CB-O 3.25Å; T278-D321 WeakPolarHBondContact CB-O 3.43Å; T278-D321 PolarHBondContact OG1-O 2.81Å; T278-D321 VanDerWaalsContact OG1-O 3.05Å; T300-D321 HydrophobicContact CG2-CB 4.03Å; P301-D321 HydrophobicContact CG-CB 4.37Å; P301-D321 WeakPolarHBondContact O-CA 2.97Å; P301-D321 VanDerWaalsContact O-CB 3.27Å; P301-D321 WeakPolarHBondContact O-CB 3.1Å; D321-W323 WeakPolarHBondContact OD1-CA 3.37Å; D321-W323 WeakPolarHBondContact OD1-CB 3.29Å; D321-W323 PolarHBondContact OD1-N 2.84Å; D321-S324 PolarHBondContact N-O 2.83Å; D321-S324 VanDerWaalsContact N-O 3.17Å; D321-S324 PolarHBondContact OD1-N 2.88Å; D321-S324 PolarHBondContact OD2-OG 2.97Å; D321-S324 VanDerWaalsContact OD2-OG 3.11Å; D321-L326 HydrophobicContact CB-CD1 4.13Å; D321-L326 HydrophobicContact CB-CD2 4.28Å; D321-L326 HydrophobicContact CB-CG 4.5Å
322	G	89.8	Confident	95.3	Very high	40 Å²	40	34.3 Å²	34.3	41%	0.412	18%	0.178	S	C	.	.	S	Bend	trans	116	-16.5	-172.5	0	0	0	0	0	112.5	H320	H320-G322 VanDerWaalsContact CE1-CA 3.49Å; H320-G322 WeakPolarHBondContact CE1-CA 3.46Å; H320-G322 PolarHBondContact CE1-N 2.77Å; H320-G322 WeakPolarHBondContact ND1-CA 3.42Å; H320-G322 PolarHBondContact ND1-N 2.85Å
323	W	89.5	Confident	95.4	Very high	240 Å²	240	34.2 Å²	34.2	91%	0.909	17%	0.169	S	C	*	.	S	Bend	trans	-124.5	-41.8	-178.6	-56.7	89.9	0	0	0	112.3	H320 D321	H320-W323 PolarHBondContact CE1-N 2.84Å; D321-W323 WeakPolarHBondContact OD1-CA 3.37Å; D321-W323 WeakPolarHBondContact OD1-CB 3.29Å; D321-W323 PolarHBondContact OD1-N 2.84Å
324	S	92.5	Very high	95.3	Very high	54 Å²	54	34.5 Å²	34.5	38%	0.378	17%	0.171	S	C	.	.	S	Bend	trans	-137.4	151.3	-172.4	73.1	0	0	0	0	112.6	H320 D321	H320-S324 WeakPolarHBondContact CA-O 3.15Å; H320-S324 PolarHBondContact CD2-O 3.05Å; D321-S324 PolarHBondContact N-O 2.83Å; D321-S324 VanDerWaalsContact N-O 3.17Å; D321-S324 PolarHBondContact OD1-N 2.88Å; D321-S324 PolarHBondContact OD2-OG 2.97Å; D321-S324 VanDerWaalsContact OD2-OG 3.11Å
325	Y	94.1	Very high	95	Very high	62 Å²	62	41.9 Å²	41.9	24%	0.243	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-76.7	136	168.6	-65.9	-95.9	0	0	0	109	H320 R367 D368 G369	H320-Y325 AromaticContact CD2-CD1 4Å; H320-Y325 AromaticContact CD2-CD2 3.8Å; H320-Y325 AromaticContact CD2-CE2 3.85Å; H320-Y325 AromaticContact CD2-CG 3.86Å; H320-Y325 AromaticContact CD2-CZ 3.99Å; Y325-R367 WeakPolarHBondContact CD1-O 3.44Å; Y325-R367 HydrophobicContact CE1-CG 4.05Å; Y325-R367 PolarHBondContact OH-NE 3.17Å; Y325-D368 VanDerWaalsContact CD2-O 3.24Å; Y325-D368 WeakPolarHBondContact CD2-O 3.43Å; Y325-G369 WeakPolarHBondContact OH-CA 3.18Å
326	L	96.1	Very high	94.7	Very high	13 Å²	13	44.4 Å²	44.4	7%	0.068	23%	0.231	C	C	.	.			trans	-102.8	138.1	-171	-56.7	172.7	0	0	0	110.8	T300 R302 G318 G319 D321 R349	T300-L326 HydrophobicContact CG2-CD1 4.02Å; T300-L326 HydrophobicContact CG2-CD2 4.48Å; R302-L326 HydrophobicContact CG-CD1 3.72Å; G318-L326 WeakPolarHBondContact CA-O 3.45Å; G319-L326 PolarHBondContact O-N 2.86Å; D321-L326 HydrophobicContact CB-CD1 4.13Å; D321-L326 HydrophobicContact CB-CD2 4.28Å; D321-L326 HydrophobicContact CB-CG 4.5Å; L326-R349 PolarHBondContact O-N 2.8Å
327	N	96.4	Very high	94.5	Very high	58 Å²	58	52.6 Å²	52.6	31%	0.31	26%	0.262	S	S	.	.			trans	-104.4	-5.1	162.7	69.3	-22.6	0	0	0	112.2	P344 M345 S347 M348	N327-P344 CarbonylContact O-C 3.53Å; N327-P344 WeakPolarHBondContact O-CA 3.39Å; N327-M345 HydrophobicContact CB-CB 4.24Å; N327-M345 WeakPolarHBondContact CB-O 3.37Å; N327-M345 PolarHBondContact ND2-O 3.22Å; N327-M345 PolarHBondContact O-N 2.97Å; N327-S347 WeakPolarHBondContact CB-O 3.28Å; N327-M348 HydrophobicContact CB-CB 4.31Å
328	T	97.6	Very high	94.4	Very high	39 Å²	39	55.8 Å²	55.8	24%	0.239	28%	0.282	C	S	.	.			trans	-73.8	150.4	-178.6	58.1	0	0	0	0	111.3	R302 G318	R302-T328 PolarHBondContact NH1-O 3.42Å; R302-T328 PolarHBondContact NH1-OG1 2.84Å; R302-T328 PolarHBondContact NH2-OG1 2.8Å; G318-T328 PolarHBondContact N-O 3.42Å; G318-T328 VanDerWaalsContact N-O 3.16Å
329	V	97.9	Very high	94.5	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	131.2	-179.5	-177	0	0	0	0	108.5	Y315 A316 V317 V342 M345 W386	Y315-V329 HydrophobicContact CD1-CG1 4.37Å; A316-V329 WeakPolarHBondContact O-CA 3.35Å; V317-V329 HydrophobicContact CB-CG2 4.44Å; V317-V329 HydrophobicContact CG1-CG2 4Å; V317-V329 HydrophobicContact CG2-CG1 3.93Å; V329-V342 HydrophobicContact CB-CG2 3.63Å; V329-V342 HydrophobicContact CG1-CG2 3.57Å; V329-V342 PolarHBondContact O-N 2.78Å; V329-M345 HydrophobicContact CG2-CG 4.15Å; V329-W386 HydrophobicContact CG2-CZ2 3.82Å
330	E	97.8	Very high	94.5	Very high	1 Å²	1	59.9 Å²	59.9	1%	0.005	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	136.5	177.3	-69.1	178.3	-113.7	0	0	109.6	A299 T300 R302 Y315 A316 W339 S340 Y341	A299-E330 WeakPolarHBondContact CB-OE2 3.31Å; A299-E330 PolarHBondContact N-OE2 2.86Å; T300-E330 PolarHBondContact N-OE1 2.9Å; R302-E330 IonicContact CZ-OE1 2.66Å; R302-E330 IonicContact NE-OE1 3.46Å; R302-E330 PolarHBondContact NE-OE1 3.48Å; R302-E330 IonicContact NH2-OE1 3.08Å; R302-E330 PolarHBondContact NH2-OE1 3.18Å; Y315-E330 CarbonylContact C-O 3.51Å; Y315-E330 WeakPolarHBondContact CA-O 3.39Å; A316-E330 HydrophobicContact CB-CB 4.49Å; A316-E330 PolarHBondContact N-O 2.9Å; A316-E330 PolarHBondContact O-N 3.42Å; E330-W339 HydrophobicContact CB-CE3 3.73Å; E330-W339 HydrophobicContact CB-CZ3 4.21Å; E330-S340 CarbonylContact C-O 3.52Å; E330-S340 WeakPolarHBondContact CA-O 3.27Å; E330-Y341 HydrophobicContact CG-CD1 3.67Å; E330-Y341 HydrophobicContact CG-CE1 3.51Å; E330-Y341 HydrophobicContact CG-CG 4.48Å
331	R	97.3	Very high	94.7	Very high	76 Å²	76	64.5 Å²	64.5	29%	0.287	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	125.7	176.2	175.4	-169.7	143.6	-165	-8.1	109.1	P313 L314 Y315 D333 W339 S340 V342	P313-R331 HydrophobicContact CB-CG 3.81Å; L314-R331 CarbonylContact O-C 3.55Å; L314-R331 WeakPolarHBondContact O-CA 3.48Å; Y315-R331 HydrophobicContact CD1-CB 4.01Å; Y315-R331 HydrophobicContact CD1-CG 4.27Å; Y315-R331 HydrophobicContact CE1-CB 3.85Å; Y315-R331 HydrophobicContact CE1-CG 3.81Å; Y315-R331 HydrophobicContact CE2-CG 4.37Å; R331-D333 IonicContact NH2-OD2 3.21Å; R331-D333 PolarHBondContact NH2-OD2 3.4Å; R331-W339 CarbonylContact O-C 3.56Å; R331-W339 WeakPolarHBondContact O-CA 3.42Å; R331-S340 PolarHBondContact N-O 3.22Å; R331-S340 PolarHBondContact O-N 3.06Å; R331-S340 PolarHBondContact O-OG 3.48Å; R331-V342 HydrophobicContact CB-CG1 3.76Å
332	W	96.7	Very high	94.9	Very high	9 Å²	9	64 Å²	64	3%	0.034	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	123	169.3	172.1	-106.9	0	0	0	110.3	N296 P313 L314 R337 T338 W339	N296-W332 HydrophobicContact CB-CH2 3.78Å; N296-W332 HydrophobicContact CB-CZ3 3.66Å; P313-W332 WeakPolarHBondContact CA-O 3.46Å; P313-W332 WeakPolarHBondContact CB-O 3.48Å; L314-W332 HydrophobicContact CB-CB 4.03Å; L314-W332 HydrophobicContact CB-CG 4.49Å; L314-W332 PolarHBondContact N-O 2.88Å; L314-W332 PolarHBondContact O-N 3.07Å; W332-R337 HydrophobicContact CH2-CB 3.78Å; W332-R337 WeakPolarHBondContact CH2-O 3.24Å; W332-R337 HydrophobicContact CZ2-CB 4.06Å; W332-R337 HydrophobicContact CZ2-CG 4.4Å; W332-R337 VanDerWaalsContact CZ3-O 3.23Å; W332-R337 WeakPolarHBondContact CZ3-O 3.27Å; W332-T338 VanDerWaalsContact CE3-C 3.49Å; W332-W339 HydrophobicContact CB-CD2 3.86Å; W332-W339 HydrophobicContact CB-CE3 3.72Å; W332-W339 HydrophobicContact CB-CH2 3.67Å; W332-W339 HydrophobicContact CB-CZ2 3.76Å; W332-W339 HydrophobicContact CB-CZ3 3.65Å; W332-W339 HydrophobicContact CD2-CZ2 4.46Å; W332-W339 AromaticContact CE3-CD1 3.41Å; W332-W339 VanDerWaalsContact CE3-CD1 3.41Å; W332-W339 AromaticContact CE3-CD2 3.93Å; W332-W339 HydrophobicContact CE3-CD2 3.93Å; W332-W339 AromaticContact CE3-CE2 3.65Å; W332-W339 AromaticContact CE3-CG 3.79Å; W332-W339 HydrophobicContact CE3-CG 3.79Å; W332-W339 HydrophobicContact CE3-CZ2 4.39Å; W332-W339 AromaticContact CE3-NE1 3.29Å; W332-W339 VanDerWaalsContact CE3-NE1 3.29Å; W332-W339 HydrophobicContact CG-CZ2 4.25Å; W332-W339 AromaticContact CZ3-CD1 3.67Å; W332-W339 HydrophobicContact CZ3-CG 4.39Å; W332-W339 AromaticContact CZ3-NE1 3.7Å
333	D	93.8	Very high	95.2	Very high	35 Å²	35	63 Å²	63	19%	0.187	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	114.9	170.7	-166.1	-55.2	0	0	0	109.9	R331 I335 A336 R337 T338	R331-D333 IonicContact NH2-OD2 3.21Å; R331-D333 PolarHBondContact NH2-OD2 3.4Å; D333-I335 VanDerWaalsContact C-N 3.29Å; D333-I335 PolarHBondContact O-N 3.1Å; D333-I335 WeakPolarHBondContact OD1-CB 3.44Å; D333-I335 PolarHBondContact OD1-N 3.36Å; D333-A336 HydrophobicContact CB-CB 4.04Å; D333-A336 PolarHBondContact OD1-N 2.87Å; D333-R337 WeakPolarHBondContact O-CA 3.4Å; D333-R337 PolarHBondContact O-N 3.42Å; D333-T338 PolarHBondContact N-O 3.26Å; D333-T338 PolarHBondContact O-N 2.8Å
334	P	91.3	Very high	95.6	Very high	25 Å²	25	55 Å²	55	16%	0.162	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-27	-178	26.2	-33.1	0	0	0	113.4	M263 R337	M263-P334 HydrophobicContact CE-CB 3.86Å; P334-R337 WeakPolarHBondContact O-CG 3.47Å
335	I	90.6	Very high	95.8	Very high	156 Å²	156	52.6 Å²	52.6	80%	0.8	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-52.8	-179.3	-58.7	173.7	0	0	0	109.3	D333 R337	D333-I335 VanDerWaalsContact C-N 3.29Å; D333-I335 PolarHBondContact O-N 3.1Å; D333-I335 WeakPolarHBondContact OD1-CB 3.44Å; D333-I335 PolarHBondContact OD1-N 3.36Å; I335-R337 PolarHBondContact O-N 2.81Å
336	A	92.4	Very high	95.9	Very high	60 Å²	60	54 Å²	54	50%	0.496	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-14.6	179.5	0	0	0	0	0	112.7	D333 T338	D333-A336 HydrophobicContact CB-CB 4.04Å; D333-A336 PolarHBondContact OD1-N 2.87Å; A336-T338 PolarHBondContact O-N 2.74Å
337	R	93.1	Very high	95.6	Very high	172 Å²	172	55 Å²	55	65%	0.649	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	41.7	-176	-60	-179.3	174.5	178.5	-1	112.4	N296 W332 D333 P334 I335	N296-R337 PolarHBondContact ND2-O 3.07Å; W332-R337 HydrophobicContact CH2-CB 3.78Å; W332-R337 WeakPolarHBondContact CH2-O 3.24Å; W332-R337 HydrophobicContact CZ2-CB 4.06Å; W332-R337 HydrophobicContact CZ2-CG 4.4Å; W332-R337 VanDerWaalsContact CZ3-O 3.23Å; W332-R337 WeakPolarHBondContact CZ3-O 3.27Å; D333-R337 WeakPolarHBondContact O-CA 3.4Å; D333-R337 PolarHBondContact O-N 3.42Å; P334-R337 WeakPolarHBondContact O-CG 3.47Å; I335-R337 PolarHBondContact O-N 2.81Å
338	T	95.7	Very high	95.5	Very high	72 Å²	72	56.5 Å²	56.5	44%	0.442	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	150.3	-179.2	49.6	0	0	0	0	111.7	W332 D333 A336	W332-T338 VanDerWaalsContact CE3-C 3.49Å; D333-T338 PolarHBondContact N-O 3.26Å; D333-T338 PolarHBondContact O-N 2.8Å; A336-T338 PolarHBondContact O-N 2.74Å
339	W	97.6	Very high	95.4	Very high	34 Å²	34	54.7 Å²	54.7	13%	0.129	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	139.5	169.4	-70	95.4	0	0	0	109.7	V270 V282 N296 A297 M298 L314 A316 E330 R331 W332	V270-W339 HydrophobicContact CG1-CH2 4.06Å; V270-W339 HydrophobicContact CG1-CZ2 4.29Å; V282-W339 HydrophobicContact CG2-CZ2 3.85Å; N296-W339 PolarHBondContact O-NE1 3.02Å; A297-W339 VanDerWaalsContact O-CD1 3.23Å; M298-W339 HydrophobicContact CG-CD2 3.86Å; M298-W339 HydrophobicContact CG-CE3 4.15Å; M298-W339 HydrophobicContact CG-CG 4.39Å; M298-W339 HydrophobicContact CG-CH2 4.15Å; M298-W339 HydrophobicContact CG-CZ2 3.89Å; M298-W339 HydrophobicContact CG-CZ3 4.28Å; M298-W339 HydrophobicContact SD-CH2 4.42Å; L314-W339 HydrophobicContact CD2-CH2 4.07Å; L314-W339 HydrophobicContact CD2-CZ2 4.49Å; A316-W339 HydrophobicContact CB-CH2 4.17Å; A316-W339 HydrophobicContact CB-CZ3 3.84Å; E330-W339 HydrophobicContact CB-CE3 3.73Å; E330-W339 HydrophobicContact CB-CZ3 4.21Å; R331-W339 CarbonylContact O-C 3.56Å; R331-W339 WeakPolarHBondContact O-CA 3.42Å; W332-W339 HydrophobicContact CB-CD2 3.86Å; W332-W339 HydrophobicContact CB-CE3 3.72Å; W332-W339 HydrophobicContact CB-CH2 3.67Å; W332-W339 HydrophobicContact CB-CZ2 3.76Å; W332-W339 HydrophobicContact CB-CZ3 3.65Å; W332-W339 HydrophobicContact CD2-CZ2 4.46Å; W332-W339 AromaticContact CE3-CD1 3.41Å; W332-W339 VanDerWaalsContact CE3-CD1 3.41Å; W332-W339 AromaticContact CE3-CD2 3.93Å; W332-W339 HydrophobicContact CE3-CD2 3.93Å; W332-W339 AromaticContact CE3-CE2 3.65Å; W332-W339 AromaticContact CE3-CG 3.79Å; W332-W339 HydrophobicContact CE3-CG 3.79Å; W332-W339 HydrophobicContact CE3-CZ2 4.39Å; W332-W339 AromaticContact CE3-NE1 3.29Å; W332-W339 VanDerWaalsContact CE3-NE1 3.29Å; W332-W339 HydrophobicContact CG-CZ2 4.25Å; W332-W339 AromaticContact CZ3-CD1 3.67Å; W332-W339 HydrophobicContact CZ3-CG 4.39Å; W332-W339 AromaticContact CZ3-NE1 3.7Å
340	S	97.1	Very high	95.1	Very high	52 Å²	52	55 Å²	55	36%	0.364	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	149.7	176.4	58.1	0	0	0	0	110.4	E330 R331	E330-S340 CarbonylContact C-O 3.52Å; E330-S340 WeakPolarHBondContact CA-O 3.27Å; R331-S340 PolarHBondContact N-O 3.22Å; R331-S340 PolarHBondContact O-N 3.06Å; R331-S340 PolarHBondContact O-OG 3.48Å
341	Y	97.8	Very high	94.9	Very high	126 Å²	126	56.6 Å²	56.6	49%	0.494	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	139.3	174.6	-70	-76.7	0	0	0	110.9	A299 T300 E330	A299-Y341 HydrophobicContact CB-CE2 4.09Å; A299-Y341 WeakPolarHBondContact CB-OH 3.12Å; T300-Y341 PolarHBondContact OG1-OH 3.18Å; E330-Y341 HydrophobicContact CG-CD1 3.67Å; E330-Y341 HydrophobicContact CG-CE1 3.51Å; E330-Y341 HydrophobicContact CG-CG 4.48Å
342	V	97.4	Very high	94.7	Very high	19 Å²	19	53.6 Å²	53.6	12%	0.115	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	-179.6	166	-59.8	0	0	0	0	109.5	Y315 V329 R331 Y379	Y315-V342 HydrophobicContact CE1-CG1 4.39Å; V329-V342 HydrophobicContact CB-CG2 3.63Å; V329-V342 HydrophobicContact CG1-CG2 3.57Å; V329-V342 PolarHBondContact O-N 2.78Å; R331-V342 HydrophobicContact CB-CG1 3.76Å; V342-Y379 HydrophobicContact CB-CE2 4.42Å; V342-Y379 HydrophobicContact CG2-CE2 4.36Å
343	A	97.4	Very high	94.6	Very high	20 Å²	20	53.5 Å²	53.5	17%	0.165	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-53.3	133	178.4	0	0	0	0	0	111.1	Y379 N384 W386	A343-Y379 HydrophobicContact CB-CE2 4.42Å; A343-N384 WeakPolarHBondContact CB-O 3.27Å; A343-N384 WeakPolarHBondContact CB-OD1 3.26Å; A343-N384 PolarHBondContact N-OD1 3.42Å; A343-W386 VanDerWaalsContact O-CD1 3.3Å; A343-W386 PolarHBondContact O-NE1 2.89Å
344	P	97.5	Very high	94.7	Very high	72 Å²	72	52.8 Å²	52.8	47%	0.468	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-72.8	153.9	177.4	31.3	-34.8	0	0	0	110.6	N327	N327-P344 CarbonylContact O-C 3.53Å; N327-P344 WeakPolarHBondContact O-CA 3.39Å
345	M	96.9	Very high	94.9	Very high	3 Å²	3	52 Å²	52	2%	0.015	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-65.3	158.1	168.8	-63.5	178.9	-64	0	0	110.7	V317 N327 V329 S347 R349 A363 W386	V317-M345 HydrophobicContact CG1-CE 3.81Å; V317-M345 HydrophobicContact CG1-SD 3.52Å; V317-M345 VanDerWaalsContact CG1-SD 3.52Å; N327-M345 HydrophobicContact CB-CB 4.24Å; N327-M345 WeakPolarHBondContact CB-O 3.37Å; N327-M345 PolarHBondContact ND2-O 3.22Å; N327-M345 PolarHBondContact O-N 2.97Å; V329-M345 HydrophobicContact CG2-CG 4.15Å; M345-S347 WeakPolarHBondContact CB-O 3.3Å; M345-R349 HydrophobicContact CE-CB 4.08Å; M345-R349 HydrophobicContact CE-CG 4.37Å; M345-A363 HydrophobicContact SD-CB 3.71Å; M345-W386 HydrophobicContact CG-CD2 3.78Å; M345-W386 HydrophobicContact CG-CE3 4.07Å; M345-W386 HydrophobicContact CG-CG 4.4Å; M345-W386 HydrophobicContact CG-CH2 4Å; M345-W386 HydrophobicContact CG-CZ2 3.74Å; M345-W386 HydrophobicContact CG-CZ3 4.15Å; M345-W386 HydrophobicContact SD-CH2 4.21Å; M345-W386 HydrophobicContact SD-CZ2 4.42Å; M345-W386 HydrophobicContact SD-CZ3 4.42Å
346	S	94.8	Very high	95.2	Very high	91 Å²	91	46.7 Å²	46.7	64%	0.636	27%	0.265	S	S	*	.	S	Bend	trans	-71.8	-34.3	176.4	-40.3	0	0	0	0	111.4	E377	S346-E377 WeakPolarHBondContact CA-OE2 3.47Å; S346-E377 WeakPolarHBondContact CB-OE2 3.37Å; S346-E377 PolarHBondContact N-OE2 3.06Å; S346-E377 PolarHBondContact OG-OE2 3.09Å
347	S	91.4	Very high	95.2	Very high	36 Å²	36	44.7 Å²	44.7	25%	0.252	25%	0.246	S	C	.	.	S	Bend	trans	-113.4	144.5	177.8	-58	0	0	0	0	111.4	N327 M345 E377	N327-S347 WeakPolarHBondContact CB-O 3.28Å; M345-S347 WeakPolarHBondContact CB-O 3.3Å; S347-E377 PolarHBondContact N-OE1 2.8Å
348	M	93.9	Very high	95	Very high	88 Å²	88	40 Å²	40	43%	0.433	25%	0.25	S	S	.	.			trans	-74.5	134	170.4	61.8	-176.5	80.8	0	0	110.2	N327 D368 H373	N327-M348 HydrophobicContact CB-CB 4.31Å; M348-D368 HydrophobicContact CG-CB 3.45Å; M348-D368 VanDerWaalsContact CG-CB 3.45Å; M348-D368 HydrophobicContact SD-CB 4.02Å; M348-H373 PolarHBondContact O-NE2 2.88Å
349	R	94.1	Very high	94.8	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.008	24%	0.242	C	C	.	.			trans	-142.7	113.5	-170.7	-63.5	176.6	-173.1	-93.7	0.1	111.1	G319 L326 M345 A352 G365 S375 E377	G319-R349 PolarHBondContact N-O 2.91Å; L326-R349 PolarHBondContact O-N 2.8Å; M345-R349 HydrophobicContact CE-CB 4.08Å; M345-R349 HydrophobicContact CE-CG 4.37Å; R349-A352 HydrophobicContact CB-CB 4Å; R349-G365 PolarHBondContact NH1-O 3.01Å; R349-S375 PolarHBondContact NH1-O 2.86Å; R349-S375 PolarHBondContact NH1-OG 2.74Å; R349-S375 PolarHBondContact NH2-OG 2.9Å; R349-E377 IonicContact CZ-OE1 3.39Å; R349-E377 VanDerWaalsContact CZ-OE1 3.25Å; R349-E377 IonicContact NE-OE1 2.73Å; R349-E377 PolarHBondContact NE-OE1 3.15Å; R349-E377 IonicContact NH2-OE1 3.84Å; R349-E377 PolarHBondContact NH2-OE1 2.83Å
350	S	92.9	Very high	94.7	Very high	7 Å²	7	40.7 Å²	40.7	5%	0.049	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-105.1	152.7	161.2	-176.3	0	0	0	0	110.2	A352 G366 R367	S350-A352 PolarHBondContact O-N 2.84Å; S350-A352 VanDerWaalsContact O-N 3.15Å; S350-G366 CarbonylContact O-C 3.6Å; S350-G366 WeakPolarHBondContact O-CA 3.09Å; S350-R367 PolarHBondContact N-O 2.84Å; S350-R367 PolarHBondContact O-N 3.08Å
351	T	92.2	Very high	94.7	Very high	33 Å²	33	38.2 Å²	38.2	20%	0.202	24%	0.236	C	C	.	.	S	Bend	trans	52.6	31.5	-177	68.1	0	0	0	0	113.9	G304 G398	G304-T351 WeakPolarHBondContact O-CA 3.37Å; G304-T351 PolarHBondContact O-N 3.27Å; T351-G398 WeakPolarHBondContact O-CA 3.2Å; T351-G398 PolarHBondContact O-N 2.88Å; T351-G398 PolarHBondContact OG1-N 2.93Å
352	A	93.5	Very high	94.7	Very high	14 Å²	14	32.8 Å²	32.8	12%	0.116	22%	0.215	C	C	.	.			trans	-79	146.2	170.3	0	0	0	0	0	110.4	R349 S350	R349-A352 HydrophobicContact CB-CB 4Å; S350-A352 PolarHBondContact O-N 2.84Å; S350-A352 VanDerWaalsContact O-N 3.15Å
353	G	94.3	Very high	94.7	Very high	7 Å²	7	31.9 Å²	31.9	7%	0.072	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	138.9	170.2	0	0	0	0	0	110	V364	G353-V364 PolarHBondContact N-O 2.98Å; G353-V364 PolarHBondContact O-N 3.03Å
354	V	96.4	Very high	94.6	Very high	19 Å²	19	31 Å²	31	12%	0.115	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	130.8	-176.5	176.2	0	0	0	0	109.2	A308 V317 L361 Y362	A308-V354 HydrophobicContact CB-CG1 3.95Å; V317-V354 HydrophobicContact CB-CG2 3.95Å; V317-V354 HydrophobicContact CG1-CG2 4.12Å; V317-V354 HydrophobicContact CG2-CG1 4.03Å; V317-V354 HydrophobicContact CG2-CG2 4.28Å; V354-L361 HydrophobicContact CG1-CD1 3.42Å; V354-L361 VanDerWaalsContact CG1-CD1 3.42Å; V354-L361 HydrophobicContact CG1-CG 4.1Å; V354-Y362 VanDerWaalsContact CA-O 3.29Å; V354-Y362 WeakPolarHBondContact CA-O 3.43Å
355	A	96.1	Very high	94.5	Very high	9 Å²	9	27.5 Å²	27.5	7%	0.074	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	164.2	176.8	0	0	0	0	0	111.6	Y362 V401 V403 L408	A355-Y362 PolarHBondContact N-O 3.14Å; A355-Y362 VanDerWaalsContact N-O 3.17Å; A355-Y362 PolarHBondContact O-N 3.43Å; A355-V401 HydrophobicContact CB-CG1 3.83Å; A355-V403 HydrophobicContact CB-CG2 3.78Å; A355-L408 HydrophobicContact CB-CD1 3.76Å
356	V	95.6	Very high	94.3	Very high	45 Å²	45	27.4 Å²	27.4	27%	0.273	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	126.7	-177.7	170.4	0	0	0	0	109.6	A308 L310 R360 L361	A308-V356 HydrophobicContact CB-CG2 3.83Å; L310-V356 HydrophobicContact CB-CG1 4.41Å; L310-V356 HydrophobicContact CB-CG2 3.91Å; L310-V356 HydrophobicContact CD1-CG1 3.54Å; L310-V356 HydrophobicContact CD1-CG2 4.39Å; V356-R360 WeakPolarHBondContact CA-O 3.22Å; V356-L361 HydrophobicContact CG2-CD1 3.64Å
357	L	93.7	Very high	94	Very high	18 Å²	18	26.9 Å²	26.9	9%	0.094	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	127.4	-180	173.5	61.1	0	0	0	109.7	G359 R360 Y362 V403 G406 L408 P434	L357-G359 PolarHBondContact O-N 2.94Å; L357-R360 PolarHBondContact N-O 2.93Å; L357-R360 PolarHBondContact O-N 3.4Å; L357-R360 VanDerWaalsContact O-N 3.13Å; L357-Y362 HydrophobicContact CB-CD2 4.1Å; L357-Y362 HydrophobicContact CB-CE2 3.68Å; L357-Y362 HydrophobicContact CG-CE2 4.42Å; L357-Y362 WeakPolarHBondContact O-CE2 3.38Å; L357-V403 HydrophobicContact CB-CG1 4.24Å; L357-V403 HydrophobicContact CB-CG2 3.93Å; L357-V403 HydrophobicContact CD1-CG1 3.67Å; L357-V403 HydrophobicContact CG-CG1 4.41Å; L357-G406 WeakPolarHBondContact CD1-O 3.46Å; L357-L408 HydrophobicContact CD2-CB 4.15Å; L357-P434 HydrophobicContact CD2-CB 4.43Å; L357-P434 HydrophobicContact CD2-CG 3.9Å
358	G	88.8	Confident	93.8	Very high	72 Å²	72	27 Å²	27	74%	0.742	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	56	43	176.2	0	0	0	0	0	114.5	R360	G358-R360 PolarHBondContact O-N 2.93Å
359	G	91.7	Very high	93.1	Very high	26 Å²	26	24.3 Å²	24.3	27%	0.268	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.5	13.5	179.2	0	0	0	0	0	114.7	L310 L357 P381	L310-G359 VanDerWaalsContact CD1-C 3.45Å; L310-G359 WeakPolarHBondContact CD1-O 3Å; L357-G359 PolarHBondContact O-N 2.94Å; G359-P381 WeakPolarHBondContact O-CD 3.4Å
360	R	95.3	Very high	92.4	Very high	95 Å²	95	28.1 Å²	28.1	36%	0.358	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	151.6	179.7	-63.9	172.8	-176.9	-84.8	-15.3	111	V356 L357 G358 Y362 C378 D380	V356-R360 WeakPolarHBondContact CA-O 3.22Å; L357-R360 PolarHBondContact N-O 2.93Å; L357-R360 PolarHBondContact O-N 3.4Å; L357-R360 VanDerWaalsContact O-N 3.13Å; G358-R360 PolarHBondContact O-N 2.93Å; R360-Y362 HydrophobicContact CB-CE2 3.8Å; R360-C378 VanDerWaalsContact CB-SG 3.6Å; R360-D380 IonicContact CZ-OD2 3.14Å; R360-D380 VanDerWaalsContact NH1-CB 3.34Å; R360-D380 VanDerWaalsContact NH1-CG 3.3Å; R360-D380 IonicContact NH1-OD2 2.9Å; R360-D380 PolarHBondContact NH1-OD2 3.48Å; R360-D380 IonicContact NH2-OD2 3.46Å; R360-D380 PolarHBondContact NH2-OD2 3.46Å
361	L	97.1	Very high	92	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	130.2	178.3	-178.7	72.8	0	0	0	109.6	A308 L310 Y315 V317 V354 V356 C378 Y379 W386	A308-L361 HydrophobicContact CB-CD1 3.77Å; L310-L361 HydrophobicContact CD2-CB 4.08Å; Y315-L361 HydrophobicContact CD1-CD2 4.26Å; Y315-L361 HydrophobicContact CG-CD2 4.1Å; V317-L361 HydrophobicContact CG2-CD2 3.7Å; V354-L361 HydrophobicContact CG1-CD1 3.42Å; V354-L361 VanDerWaalsContact CG1-CD1 3.42Å; V354-L361 HydrophobicContact CG1-CG 4.1Å; V356-L361 HydrophobicContact CG2-CD1 3.64Å; L361-C378 CarbonylContact O-C 3.58Å; L361-C378 WeakPolarHBondContact O-CA 3.37Å; L361-Y379 HydrophobicContact CB-CD1 4.27Å; L361-Y379 HydrophobicContact CD2-CD1 4.43Å; L361-Y379 PolarHBondContact N-O 2.85Å; L361-Y379 VanDerWaalsContact N-O 3.13Å; L361-Y379 PolarHBondContact O-N 2.88Å; L361-W386 HydrophobicContact CD2-CH2 4.1Å; L361-W386 HydrophobicContact CD2-CZ2 4.4Å; L361-W386 HydrophobicContact CG-CH2 4.4Å
362	Y	97.4	Very high	91.8	Very high	13 Å²	13	29 Å²	29	5%	0.051	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	129.2	-178.6	-64.7	-101.9	0	0	0	109.7	V354 A355 L357 R360 I376 E377 C378 L389 L408 Y432	V354-Y362 VanDerWaalsContact CA-O 3.29Å; V354-Y362 WeakPolarHBondContact CA-O 3.43Å; A355-Y362 PolarHBondContact N-O 3.14Å; A355-Y362 VanDerWaalsContact N-O 3.17Å; A355-Y362 PolarHBondContact O-N 3.43Å; L357-Y362 HydrophobicContact CB-CD2 4.1Å; L357-Y362 HydrophobicContact CB-CE2 3.68Å; L357-Y362 HydrophobicContact CG-CE2 4.42Å; L357-Y362 WeakPolarHBondContact O-CE2 3.38Å; R360-Y362 HydrophobicContact CB-CE2 3.8Å; Y362-I376 HydrophobicContact CD1-CD1 3.81Å; Y362-I376 HydrophobicContact CD1-CG1 4.34Å; Y362-E377 CarbonylContact C-O 3.56Å; Y362-E377 WeakPolarHBondContact CA-O 3.33Å; Y362-C378 HydrophobicContact CD1-CB 3.93Å; Y362-C378 HydrophobicContact CE1-CB 3.9Å; Y362-L389 HydrophobicContact CD1-CD1 3.84Å; Y362-L389 HydrophobicContact CE1-CD1 3.49Å; Y362-L389 VanDerWaalsContact CE1-CD1 3.49Å; Y362-L408 HydrophobicContact CD1-CD2 4.24Å; Y362-L408 HydrophobicContact CG-CD2 4.21Å; Y362-Y432 HydrophobicContact CE1-CE1 4.17Å
363	A	97.2	Very high	91.6	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	114.2	172.2	0	0	0	0	0	109	V317 M345 I376 E377 W386	V317-A363 HydrophobicContact CG1-CB 4.24Å; M345-A363 HydrophobicContact SD-CB 3.71Å; A363-I376 WeakPolarHBondContact O-CA 3.37Å; A363-E377 PolarHBondContact N-O 3.06Å; A363-E377 PolarHBondContact O-N 3.35Å; A363-W386 HydrophobicContact CB-CH2 4.04Å; A363-W386 HydrophobicContact CB-CZ3 3.76Å
364	V	96.5	Very high	91.6	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	127.3	-169.7	-168.1	0	0	0	0	110.3	G353 I376 M392 V399 V401 L408 A410 W439	G353-V364 PolarHBondContact N-O 2.98Å; G353-V364 PolarHBondContact O-N 3.03Å; V364-I376 HydrophobicContact CG2-CD1 3.78Å; V364-I376 HydrophobicContact CG2-CG1 4.13Å; V364-M392 HydrophobicContact CG1-CE 3.76Å; V364-M392 HydrophobicContact CG1-CG 4.42Å; V364-M392 HydrophobicContact CG1-SD 3.45Å; V364-M392 WeakPolarHBondContact CG1-SD 3.27Å; V364-V399 WeakPolarHBondContact O-CG1 3.13Å; V364-V401 HydrophobicContact CB-CG2 3.88Å; V364-V401 HydrophobicContact CG1-CG2 4.34Å; V364-V401 HydrophobicContact CG2-CG1 3.97Å; V364-V401 HydrophobicContact CG2-CG2 4.18Å; V364-L408 HydrophobicContact CG2-CD2 3.77Å; V364-A410 HydrophobicContact CG1-CB 4.44Å; V364-W439 HydrophobicContact CG1-CH2 4.07Å; V364-W439 HydrophobicContact CG1-CZ2 4.29Å
365	G	94.3	Very high	91.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	21%	0.207	C	C	.	.			trans	63.9	-139.2	175	0	0	0	0	0	113.3	R349 S375 R396	R349-G365 PolarHBondContact NH1-O 3.01Å; G365-S375 PolarHBondContact N-O 2.75Å; G365-R396 WeakPolarHBondContact CA-O 3.45Å
366	G	92.1	Very high	91.5	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.203	C	C	.	.			trans	89.5	-170.5	-173.7	0	0	0	0	0	113	S350 C372 H373 R396	S350-G366 CarbonylContact O-C 3.6Å; S350-G366 WeakPolarHBondContact O-CA 3.09Å; G366-C372 CarbonylContact O-C 3.54Å; G366-C372 WeakPolarHBondContact O-CA 3.47Å; G366-H373 PolarHBondContact O-CD2 2.95Å; G366-H373 PolarHBondContact O-N 2.85Å; G366-R396 PolarHBondContact N-O 2.82Å
367	R	89.6	Confident	91.5	Very high	80 Å²	80	32.3 Å²	32.3	30%	0.302	19%	0.19	S	C	.	.	B	Isolated β-bridge	trans	-135.1	146.9	-179.6	61.1	178.4	-71.7	159.2	2.6	112.5	Y325 S350 V371	Y325-R367 WeakPolarHBondContact CD1-O 3.44Å; Y325-R367 HydrophobicContact CE1-CG 4.05Å; Y325-R367 PolarHBondContact OH-NE 3.17Å; S350-R367 PolarHBondContact N-O 2.84Å; S350-R367 PolarHBondContact O-N 3.08Å; R367-V371 WeakPolarHBondContact CA-O 3.21Å
368	D	86.4	Confident	91.7	Very high	38 Å²	38	31.8 Å²	31.8	20%	0.203	19%	0.188	C	C	.	.			trans	-100.8	3.5	175.4	59.4	19.3	0	0	0	113.8	Y325 M348 S370 V371 H373	Y325-D368 VanDerWaalsContact CD2-O 3.24Å; Y325-D368 WeakPolarHBondContact CD2-O 3.43Å; M348-D368 HydrophobicContact CG-CB 3.45Å; M348-D368 VanDerWaalsContact CG-CB 3.45Å; M348-D368 HydrophobicContact SD-CB 4.02Å; D368-S370 WeakPolarHBondContact OD1-CA 3.38Å; D368-S370 PolarHBondContact OD1-N 2.95Å; D368-S370 PolarHBondContact OD1-OG 3.34Å; D368-V371 PolarHBondContact N-O 2.79Å; D368-V371 PolarHBondContact OD1-N 2.93Å; D368-H373 WeakPolarHBondContact CB-NE2 3.46Å; D368-H373 PolarHBondContact N-NE2 2.93Å; D368-H373 IonicContact OD2-CE1 2.73Å; D368-H373 PolarHBondContact OD2-CE1 2.84Å; D368-H373 IonicContact OD2-NE2 2.82Å; D368-H373 PolarHBondContact OD2-NE2 2.88Å
369	G	78.8	Confident	92.1	Very high	33 Å²	33	28.7 Å²	28.7	34%	0.34	15%	0.154	S	C	.	.	S	Bend	trans	101.3	-24.1	-176.1	0	0	0	0	0	114.2	Y325	Y325-G369 WeakPolarHBondContact OH-CA 3.18Å
370	S	80.3	Confident	92.3	Very high	81 Å²	81	28.3 Å²	28.3	57%	0.566	15%	0.145	S	C	*	.	S	Bend	trans	-102.2	-46.9	176.2	70.9	0	0	0	0	112.3	D368	D368-S370 WeakPolarHBondContact OD1-CA 3.38Å; D368-S370 PolarHBondContact OD1-N 2.95Å; D368-S370 PolarHBondContact OD1-OG 3.34Å
371	V	84.5	Confident	92.3	Very high	57 Å²	57	25.1 Å²	25.1	35%	0.345	14%	0.137	S	C	.	.			trans	-140.2	158.8	-174	-65.8	0	0	0	0	112	R367 D368	R367-V371 WeakPolarHBondContact CA-O 3.21Å; D368-V371 PolarHBondContact N-O 2.79Å; D368-V371 PolarHBondContact OD1-N 2.93Å
372	C	89.1	Confident	92.2	Very high	3 Å²	3	32.1 Å²	32.1	2%	0.02	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-80.7	140.9	167.1	-64.1	0	0	0	0	110.1	G366 R395	G366-C372 CarbonylContact O-C 3.54Å; G366-C372 WeakPolarHBondContact O-CA 3.47Å; C372-R395 HydrophobicContact CB-CB 3.92Å; C372-R395 VanDerWaalsContact O-CD 3.25Å; C372-R395 WeakPolarHBondContact O-CD 3.16Å; C372-R395 WeakPolarHBondContact O-CG 3.34Å; C372-R395 PolarHBondContact O-NH1 2.9Å
373	H	89.3	Confident	92.1	Very high	18 Å²	18	35.2 Å²	35.2	8%	0.083	19%	0.19	C	C	.	.			trans	-89	144.7	178.3	-61.9	-70.4	0	0	0	111.4	M348 G366 D368 R396	M348-H373 PolarHBondContact O-NE2 2.88Å; G366-H373 PolarHBondContact O-CD2 2.95Å; G366-H373 PolarHBondContact O-N 2.85Å; D368-H373 WeakPolarHBondContact CB-NE2 3.46Å; D368-H373 PolarHBondContact N-NE2 2.93Å; D368-H373 IonicContact OD2-CE1 2.73Å; D368-H373 PolarHBondContact OD2-CE1 2.84Å; D368-H373 IonicContact OD2-NE2 2.82Å; D368-H373 PolarHBondContact OD2-NE2 2.88Å; H373-R396 PolarHBondContact O-N 3.21Å
374	R	92.4	Very high	92	Very high	123 Å²	123	38.9 Å²	38.9	46%	0.464	21%	0.209	S	C	.	.			trans	-102.3	-8.5	160.8	66.6	173.7	-178.4	-162.7	1.4	112.6	P391 M392 R394 R395	R374-P391 HydrophobicContact CG-CB 3.99Å; R374-P391 WeakPolarHBondContact O-CA 2.99Å; R374-M392 HydrophobicContact CB-CB 4.35Å; R374-M392 WeakPolarHBondContact CD-O 3.29Å; R374-M392 PolarHBondContact O-N 3.28Å; R374-R394 WeakPolarHBondContact CB-O 3.47Å; R374-R395 HydrophobicContact CB-CG 4.05Å
375	S	94.8	Very high	92	Very high	22 Å²	22	45.5 Å²	45.5	15%	0.154	24%	0.238	C	C	.	.			trans	-73.6	149.5	-178.7	52	0	0	0	0	111	R349 G365	R349-S375 PolarHBondContact NH1-O 2.86Å; R349-S375 PolarHBondContact NH1-OG 2.74Å; R349-S375 PolarHBondContact NH2-OG 2.9Å; G365-S375 PolarHBondContact N-O 2.75Å
376	I	96.4	Very high	92.2	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	137.6	173.7	170.2	167.4	0	0	0	108	Y362 A363 V364 L389 A390 L408 W439	Y362-I376 HydrophobicContact CD1-CD1 3.81Å; Y362-I376 HydrophobicContact CD1-CG1 4.34Å; A363-I376 WeakPolarHBondContact O-CA 3.37Å; V364-I376 HydrophobicContact CG2-CD1 3.78Å; V364-I376 HydrophobicContact CG2-CG1 4.13Å; I376-L389 HydrophobicContact CG1-CD1 4.46Å; I376-L389 HydrophobicContact CG2-CB 3.85Å; I376-L389 PolarHBondContact O-N 2.79Å; I376-L389 VanDerWaalsContact O-N 3.09Å; I376-A390 WeakPolarHBondContact CG2-O 3.36Å; I376-L408 HydrophobicContact CD1-CD2 3.57Å; I376-W439 HydrophobicContact CD1-CZ2 3.86Å; I376-W439 HydrophobicContact CG2-CZ2 4.32Å
377	E	96.9	Very high	92.4	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	141.9	174.2	-65.6	176.6	-105.8	0	0	109.2	S346 S347 R349 Y362 A363 W386 S387 L388	S346-E377 WeakPolarHBondContact CA-OE2 3.47Å; S346-E377 WeakPolarHBondContact CB-OE2 3.37Å; S346-E377 PolarHBondContact N-OE2 3.06Å; S346-E377 PolarHBondContact OG-OE2 3.09Å; S347-E377 PolarHBondContact N-OE1 2.8Å; R349-E377 IonicContact CZ-OE1 3.39Å; R349-E377 VanDerWaalsContact CZ-OE1 3.25Å; R349-E377 IonicContact NE-OE1 2.73Å; R349-E377 PolarHBondContact NE-OE1 3.15Å; R349-E377 IonicContact NH2-OE1 3.84Å; R349-E377 PolarHBondContact NH2-OE1 2.83Å; Y362-E377 CarbonylContact C-O 3.56Å; Y362-E377 WeakPolarHBondContact CA-O 3.33Å; A363-E377 PolarHBondContact N-O 3.06Å; A363-E377 PolarHBondContact O-N 3.35Å; E377-W386 HydrophobicContact CB-CE3 3.6Å; E377-W386 HydrophobicContact CB-CZ3 4.1Å; E377-S387 CarbonylContact C-O 3.54Å; E377-S387 WeakPolarHBondContact CA-O 3.45Å; E377-L388 HydrophobicContact CG-CD1 4.07Å
378	C	97.1	Very high	92.8	Very high	7 Å²	7	51.7 Å²	51.7	5%	0.047	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	128.7	179	176.9	0	0	0	0	110.1	R360 L361 Y362 W386 S387 L389	R360-C378 VanDerWaalsContact CB-SG 3.6Å; L361-C378 CarbonylContact O-C 3.58Å; L361-C378 WeakPolarHBondContact O-CA 3.37Å; Y362-C378 HydrophobicContact CD1-CB 3.93Å; Y362-C378 HydrophobicContact CE1-CB 3.9Å; C378-W386 CarbonylContact O-C 3.58Å; C378-W386 VanDerWaalsContact O-CA 3.31Å; C378-W386 WeakPolarHBondContact O-CA 3.25Å; C378-S387 PolarHBondContact N-O 3.3Å; C378-S387 PolarHBondContact O-N 2.99Å; C378-L389 HydrophobicContact CB-CD1 3.41Å; C378-L389 VanDerWaalsContact CB-CD1 3.41Å; C378-L389 HydrophobicContact CB-CG 3.96Å
379	Y	97.8	Very high	93.2	Very high	6 Å²	6	51.6 Å²	51.6	2%	0.024	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	129.7	177.8	175.2	-104.1	0	0	0	110.9	Y315 V342 A343 L361 P381 N384 K385 W386	Y315-Y379 AromaticContact CE1-CE1 3.88Å; Y315-Y379 HydrophobicContact CE1-CE1 3.88Å; V342-Y379 HydrophobicContact CB-CE2 4.42Å; V342-Y379 HydrophobicContact CG2-CE2 4.36Å; A343-Y379 HydrophobicContact CB-CE2 4.42Å; L361-Y379 HydrophobicContact CB-CD1 4.27Å; L361-Y379 HydrophobicContact CD2-CD1 4.43Å; L361-Y379 PolarHBondContact N-O 2.85Å; L361-Y379 VanDerWaalsContact N-O 3.13Å; L361-Y379 PolarHBondContact O-N 2.88Å; Y379-P381 HydrophobicContact CE1-CB 4Å; Y379-N384 WeakPolarHBondContact CE2-OD1 3.42Å; Y379-N384 PolarHBondContact OH-OD1 3.38Å; Y379-K385 WeakPolarHBondContact CA-O 3.47Å; Y379-W386 AromaticContact CD2-CD1 3.8Å; Y379-W386 HydrophobicContact CD2-CD2 4.14Å; Y379-W386 AromaticContact CD2-CE2 3.7Å; Y379-W386 HydrophobicContact CD2-CG 4.2Å; Y379-W386 HydrophobicContact CD2-CZ2 4.17Å; Y379-W386 AromaticContact CD2-NE1 3.46Å; Y379-W386 HydrophobicContact CG-CD2 4.33Å; Y379-W386 AromaticContact CG-CE2 3.9Å; Y379-W386 HydrophobicContact CG-CH2 4.47Å; Y379-W386 AromaticContact CG-CZ2 3.96Å; Y379-W386 HydrophobicContact CG-CZ2 3.96Å
380	D	96.2	Very high	94	Very high	18 Å²	18	51 Å²	51	10%	0.096	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	114.1	171.8	-168.7	-29.1	0	0	0	109.6	R360 H382 T383 N384 K385	R360-D380 IonicContact CZ-OD2 3.14Å; R360-D380 VanDerWaalsContact NH1-CB 3.34Å; R360-D380 VanDerWaalsContact NH1-CG 3.3Å; R360-D380 IonicContact NH1-OD2 2.9Å; R360-D380 PolarHBondContact NH1-OD2 3.48Å; R360-D380 IonicContact NH2-OD2 3.46Å; R360-D380 PolarHBondContact NH2-OD2 3.46Å; D380-H382 PolarHBondContact O-N 3.47Å; D380-H382 WeakPolarHBondContact OD1-CB 3.13Å; D380-H382 IonicContact OD1-CG 3.25Å; D380-H382 PolarHBondContact OD1-N 2.86Å; D380-H382 IonicContact OD1-ND1 2.73Å; D380-H382 PolarHBondContact OD1-ND1 3.14Å; D380-T383 WeakPolarHBondContact CB-OG1 3.36Å; D380-T383 PolarHBondContact O-N 2.82Å; D380-N384 WeakPolarHBondContact O-CA 3.45Å; D380-N384 PolarHBondContact O-N 2.86Å; D380-K385 PolarHBondContact N-O 2.86Å
381	P	94.9	Very high	94.8	Very high	28 Å²	28	50.3 Å²	50.3	18%	0.182	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-26	-179.6	29.5	-36.8	0	0	0	112.9	L310 G359 Y379	L310-P381 HydrophobicContact CD2-CB 4.1Å; L310-P381 HydrophobicContact CD2-CG 3.84Å; G359-P381 WeakPolarHBondContact O-CD 3.4Å; Y379-P381 HydrophobicContact CE1-CB 4Å
382	H	93.8	Very high	95.3	Very high	147 Å²	147	47.8 Å²	47.8	68%	0.681	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-33.3	-177.4	-60.4	91.2	0	0	0	112.3	E311 D380	E311-H382 IonicContact OE1-CE1 3.62Å; E311-H382 IonicContact OE2-CE1 2.91Å; D380-H382 PolarHBondContact O-N 3.47Å; D380-H382 WeakPolarHBondContact OD1-CB 3.13Å; D380-H382 IonicContact OD1-CG 3.25Å; D380-H382 PolarHBondContact OD1-N 2.86Å; D380-H382 IonicContact OD1-ND1 2.73Å; D380-H382 PolarHBondContact OD1-ND1 3.14Å
383	T	95.4	Very high	95.3	Very high	79 Å²	79	52.6 Å²	52.6	49%	0.485	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-9.3	179.2	68	0	0	0	0	113.1	D380 K385	D380-T383 WeakPolarHBondContact CB-OG1 3.36Å; D380-T383 PolarHBondContact O-N 2.82Å; T383-K385 VanDerWaalsContact C-N 3.3Å; T383-K385 PolarHBondContact O-N 2.85Å
384	N	96.2	Very high	95.1	Very high	76 Å²	76	57.7 Å²	57.7	41%	0.406	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	50	-174	-173	28.3	0	0	0	111.3	A343 Y379 D380	A343-N384 WeakPolarHBondContact CB-O 3.27Å; A343-N384 WeakPolarHBondContact CB-OD1 3.26Å; A343-N384 PolarHBondContact N-OD1 3.42Å; Y379-N384 WeakPolarHBondContact CE2-OD1 3.42Å; Y379-N384 PolarHBondContact OH-OD1 3.38Å; D380-N384 WeakPolarHBondContact O-CA 3.45Å; D380-N384 PolarHBondContact O-N 2.86Å
385	K	96.9	Very high	95	Very high	139 Å²	139	56.2 Å²	56.2	60%	0.604	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.1	144.9	-178	-73.4	178.4	-177	-178.7	0	111.6	Y379 D380 T383	Y379-K385 WeakPolarHBondContact CA-O 3.47Å; D380-K385 PolarHBondContact N-O 2.86Å; T383-K385 VanDerWaalsContact C-N 3.3Å; T383-K385 PolarHBondContact O-N 2.85Å
386	W	97.8	Very high	94.8	Very high	26 Å²	26	55.2 Å²	55.2	10%	0.098	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	139.7	168.7	-69.3	88.1	0	0	0	110.2	V317 V329 A343 M345 L361 A363 E377 C378 Y379	V317-W386 HydrophobicContact CG1-CH2 4.21Å; V329-W386 HydrophobicContact CG2-CZ2 3.82Å; A343-W386 VanDerWaalsContact O-CD1 3.3Å; A343-W386 PolarHBondContact O-NE1 2.89Å; M345-W386 HydrophobicContact CG-CD2 3.78Å; M345-W386 HydrophobicContact CG-CE3 4.07Å; M345-W386 HydrophobicContact CG-CG 4.4Å; M345-W386 HydrophobicContact CG-CH2 4Å; M345-W386 HydrophobicContact CG-CZ2 3.74Å; M345-W386 HydrophobicContact CG-CZ3 4.15Å; M345-W386 HydrophobicContact SD-CH2 4.21Å; M345-W386 HydrophobicContact SD-CZ2 4.42Å; M345-W386 HydrophobicContact SD-CZ3 4.42Å; L361-W386 HydrophobicContact CD2-CH2 4.1Å; L361-W386 HydrophobicContact CD2-CZ2 4.4Å; L361-W386 HydrophobicContact CG-CH2 4.4Å; A363-W386 HydrophobicContact CB-CH2 4.04Å; A363-W386 HydrophobicContact CB-CZ3 3.76Å; E377-W386 HydrophobicContact CB-CE3 3.6Å; E377-W386 HydrophobicContact CB-CZ3 4.1Å; C378-W386 CarbonylContact O-C 3.58Å; C378-W386 VanDerWaalsContact O-CA 3.31Å; C378-W386 WeakPolarHBondContact O-CA 3.25Å; Y379-W386 AromaticContact CD2-CD1 3.8Å; Y379-W386 HydrophobicContact CD2-CD2 4.14Å; Y379-W386 AromaticContact CD2-CE2 3.7Å; Y379-W386 HydrophobicContact CD2-CG 4.2Å; Y379-W386 HydrophobicContact CD2-CZ2 4.17Å; Y379-W386 AromaticContact CD2-NE1 3.46Å; Y379-W386 HydrophobicContact CG-CD2 4.33Å; Y379-W386 AromaticContact CG-CE2 3.9Å; Y379-W386 HydrophobicContact CG-CH2 4.47Å; Y379-W386 AromaticContact CG-CZ2 3.96Å; Y379-W386 HydrophobicContact CG-CZ2 3.96Å
387	S	96.7	Very high	94.4	Very high	64 Å²	64	55.2 Å²	55.2	45%	0.448	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	139.3	174.4	-58.4	0	0	0	0	109.7	E377 C378	E377-S387 CarbonylContact C-O 3.54Å; E377-S387 WeakPolarHBondContact CA-O 3.45Å; C378-S387 PolarHBondContact N-O 3.3Å; C378-S387 PolarHBondContact O-N 2.99Å
388	L	96.6	Very high	94	Very high	120 Å²	120	55.7 Å²	55.7	63%	0.628	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	135	174.4	-168.8	74	0	0	0	109.6	E377	E377-L388 HydrophobicContact CG-CD1 4.07Å
389	L	96.3	Very high	93.8	Very high	36 Å²	36	55.8 Å²	55.8	19%	0.188	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	176.4	177.8	-61.5	177.5	0	0	0	111.3	Y362 I376 C378 Y432	Y362-L389 HydrophobicContact CD1-CD1 3.84Å; Y362-L389 HydrophobicContact CE1-CD1 3.49Å; Y362-L389 VanDerWaalsContact CE1-CD1 3.49Å; I376-L389 HydrophobicContact CG1-CD1 4.46Å; I376-L389 HydrophobicContact CG2-CB 3.85Å; I376-L389 PolarHBondContact O-N 2.79Å; I376-L389 VanDerWaalsContact O-N 3.09Å; C378-L389 HydrophobicContact CB-CD1 3.41Å; C378-L389 VanDerWaalsContact CB-CD1 3.41Å; C378-L389 HydrophobicContact CB-CG 3.96Å; L389-Y432 HydrophobicContact CD1-CE1 4.34Å; L389-Y432 WeakPolarHBondContact CD1-OH 3.44Å
390	A	95.6	Very high	93.6	Very high	21 Å²	21	55.6 Å²	55.6	17%	0.174	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-54.3	127.9	178.4	0	0	0	0	0	111.5	I376 D437 W439	I376-A390 WeakPolarHBondContact CG2-O 3.36Å; A390-D437 WeakPolarHBondContact CB-O 3.47Å; A390-D437 VanDerWaalsContact CB-OD1 3.31Å; A390-D437 WeakPolarHBondContact CB-OD1 3.39Å; A390-D437 PolarHBondContact N-OD1 2.88Å; A390-D437 PolarHBondContact N-OD2 3.34Å; A390-W439 PolarHBondContact O-NE1 3.11Å
391	P	96.1	Very high	93.6	Very high	67 Å²	67	55.4 Å²	55.4	44%	0.435	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-71.4	152.3	-177.5	29.8	-34.8	0	0	0	111.8	R374	R374-P391 HydrophobicContact CG-CB 3.99Å; R374-P391 WeakPolarHBondContact O-CA 2.99Å
392	M	94.6	Very high	93.6	Very high	3 Å²	3	54.7 Å²	54.7	2%	0.015	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-61	158.5	169	-66.6	179.6	-62.6	0	0	111.3	V364 R374 R394 R396 A410 W439	V364-M392 HydrophobicContact CG1-CE 3.76Å; V364-M392 HydrophobicContact CG1-CG 4.42Å; V364-M392 HydrophobicContact CG1-SD 3.45Å; V364-M392 WeakPolarHBondContact CG1-SD 3.27Å; R374-M392 HydrophobicContact CB-CB 4.35Å; R374-M392 WeakPolarHBondContact CD-O 3.29Å; R374-M392 PolarHBondContact O-N 3.28Å; M392-R394 VanDerWaalsContact C-N 3.32Å; M392-R394 WeakPolarHBondContact CB-O 3.32Å; M392-R394 PolarHBondContact O-N 3.47Å; M392-R396 HydrophobicContact CE-CB 4.12Å; M392-R396 HydrophobicContact CE-CG 4.08Å; M392-R396 HydrophobicContact SD-CG 4.33Å; M392-A410 HydrophobicContact SD-CB 3.71Å; M392-W439 HydrophobicContact CG-CD2 3.84Å; M392-W439 VanDerWaalsContact CG-CE2 3.47Å; M392-W439 HydrophobicContact CG-CE3 4.15Å; M392-W439 HydrophobicContact CG-CH2 3.78Å; M392-W439 HydrophobicContact CG-CZ2 3.44Å; M392-W439 VanDerWaalsContact CG-CZ2 3.44Å; M392-W439 HydrophobicContact CG-CZ3 4.12Å; M392-W439 HydrophobicContact SD-CH2 4.07Å; M392-W439 HydrophobicContact SD-CZ2 4.23Å; M392-W439 HydrophobicContact SD-CZ3 4.47Å
393	N	90.2	Very high	93.5	Very high	105 Å²	105	49 Å²	49	56%	0.561	26%	0.256	S	S	*	.	S	Bend	trans	-69.9	-31.7	176.6	-61.8	-73	0	0	0	111.6	E430	N393-E430 WeakPolarHBondContact CA-OE1 3.43Å; N393-E430 WeakPolarHBondContact CB-OE1 3.44Å; N393-E430 VanDerWaalsContact CG-OE1 3.3Å; N393-E430 PolarHBondContact N-OE1 2.85Å; N393-E430 PolarHBondContact ND2-OE1 3.45Å
394	R	85.6	Confident	93.3	Very high	124 Å²	124	45.4 Å²	45.4	47%	0.468	23%	0.234	S	C	.	.	S	Bend	trans	-120.2	154.9	178.2	-54	-164.2	101.1	139.8	4.1	112	R374 M392	R374-R394 WeakPolarHBondContact CB-O 3.47Å; M392-R394 VanDerWaalsContact C-N 3.32Å; M392-R394 WeakPolarHBondContact CB-O 3.32Å; M392-R394 PolarHBondContact O-N 3.47Å
395	R	89.3	Confident	92.8	Very high	93 Å²	93	45.8 Å²	45.8	35%	0.351	24%	0.236	S	C	.	.			trans	-77.5	139.8	171.3	-65.4	171.4	-178.1	-80.8	0.1	108.9	C372 R374 D415	C372-R395 HydrophobicContact CB-CB 3.92Å; C372-R395 VanDerWaalsContact O-CD 3.25Å; C372-R395 WeakPolarHBondContact O-CD 3.16Å; C372-R395 WeakPolarHBondContact O-CG 3.34Å; C372-R395 PolarHBondContact O-NH1 2.9Å; R374-R395 HydrophobicContact CB-CG 4.05Å; R395-D415 HydrophobicContact CB-CB 4.44Å
396	R	90.8	Very high	92.3	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.228	C	C	.	.			trans	-141.3	110.1	-175.7	-53.6	180	179.8	-91.8	-5	111.3	G365 G366 H373 M392 V399 G412 T426 T428 E430	G365-R396 WeakPolarHBondContact CA-O 3.45Å; G366-R396 PolarHBondContact N-O 2.82Å; H373-R396 PolarHBondContact O-N 3.21Å; M392-R396 HydrophobicContact CE-CB 4.12Å; M392-R396 HydrophobicContact CE-CG 4.08Å; M392-R396 HydrophobicContact SD-CG 4.33Å; R396-V399 HydrophobicContact CB-CB 3.85Å; R396-V399 HydrophobicContact CB-CG2 4.04Å; R396-G412 WeakPolarHBondContact CD-O 3.33Å; R396-G412 PolarHBondContact NH1-O 2.73Å; R396-T426 PolarHBondContact NH1-OG1 2.86Å; R396-T426 VanDerWaalsContact NH1-OG1 3.17Å; R396-T428 PolarHBondContact NH1-O 3.48Å; R396-T428 PolarHBondContact NH1-OG1 3.45Å; R396-T428 PolarHBondContact NH2-O 3.39Å; R396-T428 PolarHBondContact NH2-OG1 2.81Å; R396-E430 IonicContact CZ-OE2 3.91Å; R396-E430 IonicContact NE-OE2 3.98Å; R396-E430 PolarHBondContact NE-OE2 2.82Å; R396-E430 IonicContact NH2-OE2 3.25Å; R396-E430 PolarHBondContact NH2-OE2 3.07Å
397	G	88.4	Confident	92.1	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-97.8	143.4	163.3	0	0	0	0	0	110.9	V399 G413 H414	G397-V399 VanDerWaalsContact C-N 3.28Å; G397-V399 PolarHBondContact O-N 2.8Å; G397-G413 CarbonylContact O-C 3.58Å; G397-G413 VanDerWaalsContact O-CA 3.27Å; G397-G413 WeakPolarHBondContact O-CA 3.44Å; G397-H414 PolarHBondContact N-O 2.73Å; G397-H414 PolarHBondContact O-N 3.02Å
398	G	87.7	Confident	92	Very high	10 Å²	10	39.2 Å²	39.2	10%	0.103	21%	0.212	C	C	.	.	S	Bend	trans	63.9	34.7	-176.8	0	0	0	0	0	113.1	T351 A451	T351-G398 WeakPolarHBondContact O-CA 3.2Å; T351-G398 PolarHBondContact O-N 2.88Å; T351-G398 PolarHBondContact OG1-N 2.93Å; G398-A451 PolarHBondContact O-N 2.86Å
399	V	92.7	Very high	92	Very high	10 Å²	10	33.7 Å²	33.7	6%	0.061	18%	0.183	C	C	.	.			trans	-74.5	136.3	-176.5	60.5	0	0	0	0	111.1	V364 R396 G397 V401 A410	V364-V399 WeakPolarHBondContact O-CG1 3.13Å; R396-V399 HydrophobicContact CB-CB 3.85Å; R396-V399 HydrophobicContact CB-CG2 4.04Å; G397-V399 VanDerWaalsContact C-N 3.28Å; G397-V399 PolarHBondContact O-N 2.8Å; V399-V401 HydrophobicContact CB-CG2 4.45Å; V399-V401 HydrophobicContact CG1-CG2 3.87Å; V399-V401 HydrophobicContact CG2-CG2 3.92Å; V399-A410 HydrophobicContact CG2-CB 4.11Å
400	G	94	Very high	92	Very high	2 Å²	2	32 Å²	32	2%	0.021	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	125	166.7	0	0	0	0	0	109.2	L411 C454	G400-L411 PolarHBondContact N-O 2.78Å; G400-L411 WeakPolarHBondContact O-CB 3.37Å; G400-L411 PolarHBondContact O-N 3.21Å; G400-C454 VanDerWaalsContact C-SG 3.5Å
401	V	95.6	Very high	91.9	Very high	14 Å²	14	31 Å²	31	9%	0.085	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	130.7	179.7	179.8	0	0	0	0	110.1	A355 V364 V399 L408 Y409 C454	A355-V401 HydrophobicContact CB-CG1 3.83Å; V364-V401 HydrophobicContact CB-CG2 3.88Å; V364-V401 HydrophobicContact CG1-CG2 4.34Å; V364-V401 HydrophobicContact CG2-CG1 3.97Å; V364-V401 HydrophobicContact CG2-CG2 4.18Å; V399-V401 HydrophobicContact CB-CG2 4.45Å; V399-V401 HydrophobicContact CG1-CG2 3.87Å; V399-V401 HydrophobicContact CG2-CG2 3.92Å; V401-L408 HydrophobicContact CG1-CD1 3.47Å; V401-L408 VanDerWaalsContact CG1-CD1 3.47Å; V401-L408 HydrophobicContact CG1-CG 4.12Å; V401-Y409 WeakPolarHBondContact CA-O 3.37Å; V401-C454 VanDerWaalsContact C-SG 3.54Å; V401-C454 PolarHBondContact N-SG 2.96Å; V401-C454 PolarHBondContact O-SG 3.37Å; V401-C454 VanDerWaalsContact O-SG 3.4Å
402	T	94.9	Very high	91.8	Very high	12 Å²	12	27.8 Å²	27.8	7%	0.074	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	168.4	177.3	-164	0	0	0	0	110.5	Y409 L411 C454 L461	T402-Y409 PolarHBondContact N-O 3.08Å; T402-Y409 PolarHBondContact O-N 3.25Å; T402-L411 HydrophobicContact CG2-CD1 4.12Å; T402-C454 HydrophobicContact CG2-CB 4.36Å; T402-L461 HydrophobicContact CG2-CD1 3.57Å; T402-L461 HydrophobicContact CG2-CD2 4.18Å; T402-L461 HydrophobicContact CG2-CG 3.58Å
403	V	93.3	Very high	91.6	Very high	28 Å²	28	27.7 Å²	27.7	17%	0.17	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	129.9	-176.7	170.2	0	0	0	0	108.1	A355 L357 F407 L408	A355-V403 HydrophobicContact CB-CG2 3.78Å; L357-V403 HydrophobicContact CB-CG1 4.24Å; L357-V403 HydrophobicContact CB-CG2 3.93Å; L357-V403 HydrophobicContact CD1-CG1 3.67Å; L357-V403 HydrophobicContact CG-CG1 4.41Å; V403-F407 WeakPolarHBondContact CA-O 3.46Å; V403-L408 HydrophobicContact CG2-CD1 3.6Å
404	A	90.2	Very high	91.4	Very high	3 Å²	3	23.7 Å²	23.7	3%	0.025	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	137.6	176.8	0	0	0	0	0	109.5	G406 F407 Y409 L456 L461	A404-G406 PolarHBondContact O-N 2.82Å; A404-F407 PolarHBondContact N-O 3.23Å; A404-F407 PolarHBondContact O-N 3.46Å; A404-Y409 HydrophobicContact CB-CD2 4.08Å; A404-Y409 HydrophobicContact CB-CE2 3.7Å; A404-Y409 WeakPolarHBondContact O-CE2 3.29Å; A404-L456 HydrophobicContact CB-CD1 3.68Å; A404-L461 HydrophobicContact CB-CB 4.34Å; A404-L461 HydrophobicContact CB-CD1 4.23Å
405	N	84.9	Confident	91.3	Very high	85 Å²	85	19.6 Å²	19.6	46%	0.455	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	32.5	175	-58.7	-29.3	0	0	0	114.9	F407	N405-F407 VanDerWaalsContact C-N 3.29Å; N405-F407 HydrophobicContact CB-CD2 4.41Å; N405-F407 WeakPolarHBondContact O-CD2 3.36Å; N405-F407 WeakPolarHBondContact O-CE2 3.44Å; N405-F407 PolarHBondContact O-N 3.02Å
406	G	87.6	Confident	90.3	Very high	42 Å²	42	17.3 Å²	17.3	43%	0.433	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	4.9	-179	0	0	0	0	0	115.3	L357 A404	L357-G406 WeakPolarHBondContact CD1-O 3.46Å; A404-G406 PolarHBondContact O-N 2.82Å
407	F	92.8	Very high	89	Confident	49 Å²	49	19.7 Å²	19.7	22%	0.215	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	154.5	176	-58.2	-82.9	0	0	0	111.2	V403 A404 N405 Y409 R431 D433	V403-F407 WeakPolarHBondContact CA-O 3.46Å; A404-F407 PolarHBondContact N-O 3.23Å; A404-F407 PolarHBondContact O-N 3.46Å; N405-F407 VanDerWaalsContact C-N 3.29Å; N405-F407 HydrophobicContact CB-CD2 4.41Å; N405-F407 WeakPolarHBondContact O-CD2 3.36Å; N405-F407 WeakPolarHBondContact O-CE2 3.44Å; N405-F407 PolarHBondContact O-N 3.02Å; F407-Y409 HydrophobicContact CB-CD2 4.44Å; F407-Y409 HydrophobicContact CB-CE2 3.76Å; F407-R431 HydrophobicContact CB-CG 3.57Å; F407-R431 HydrophobicContact CD1-CG 4.15Å; F407-R431 HydrophobicContact CG-CG 3.95Å; F407-D433 HydrophobicContact CD1-CB 3.96Å; F407-D433 HydrophobicContact CE1-CB 3.83Å
408	L	95.4	Very high	87.5	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	130	174.4	-179.3	75.5	0	0	0	109.2	A355 L357 Y362 V364 I376 V401 V403 R431 Y432 W439	A355-L408 HydrophobicContact CB-CD1 3.76Å; L357-L408 HydrophobicContact CD2-CB 4.15Å; Y362-L408 HydrophobicContact CD1-CD2 4.24Å; Y362-L408 HydrophobicContact CG-CD2 4.21Å; V364-L408 HydrophobicContact CG2-CD2 3.77Å; I376-L408 HydrophobicContact CD1-CD2 3.57Å; V401-L408 HydrophobicContact CG1-CD1 3.47Å; V401-L408 VanDerWaalsContact CG1-CD1 3.47Å; V401-L408 HydrophobicContact CG1-CG 4.12Å; V403-L408 HydrophobicContact CG2-CD1 3.6Å; L408-R431 CarbonylContact O-C 3.52Å; L408-R431 WeakPolarHBondContact O-CA 3.23Å; L408-Y432 HydrophobicContact CB-CD1 4.23Å; L408-Y432 HydrophobicContact CD2-CD1 4.27Å; L408-Y432 PolarHBondContact N-O 2.99Å; L408-Y432 VanDerWaalsContact N-O 3.14Å; L408-Y432 PolarHBondContact O-N 2.95Å; L408-W439 HydrophobicContact CD2-CH2 4.25Å
409	Y	96	Very high	86	Confident	4 Å²	4	29 Å²	29	2%	0.016	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	126.5	-178.7	-68.9	-103	0	0	0	109.7	V401 T402 A404 F407 V429 E430 R431 I442 L461 Y479	V401-Y409 WeakPolarHBondContact CA-O 3.37Å; T402-Y409 PolarHBondContact N-O 3.08Å; T402-Y409 PolarHBondContact O-N 3.25Å; A404-Y409 HydrophobicContact CB-CD2 4.08Å; A404-Y409 HydrophobicContact CB-CE2 3.7Å; A404-Y409 WeakPolarHBondContact O-CE2 3.29Å; F407-Y409 HydrophobicContact CB-CD2 4.44Å; F407-Y409 HydrophobicContact CB-CE2 3.76Å; Y409-V429 HydrophobicContact CD1-CG1 4.48Å; Y409-E430 CarbonylContact C-O 3.36Å; Y409-E430 WeakPolarHBondContact CA-O 3.47Å; Y409-R431 HydrophobicContact CD1-CB 4.25Å; Y409-R431 HydrophobicContact CD1-CG 4.32Å; Y409-R431 HydrophobicContact CE1-CB 4.06Å; Y409-R431 HydrophobicContact CE1-CG 3.87Å; Y409-R431 HydrophobicContact CE2-CG 4.18Å; Y409-R431 WeakPolarHBondContact OH-CD 3.48Å; Y409-I442 HydrophobicContact CD1-CD1 3.69Å; Y409-I442 HydrophobicContact CE1-CD1 3.6Å; Y409-L461 HydrophobicContact CD1-CD1 3.93Å; Y409-L461 HydrophobicContact CD2-CD1 3.89Å; Y409-L461 HydrophobicContact CE1-CD1 4.44Å; Y409-L461 HydrophobicContact CE2-CD1 4.43Å; Y409-L461 HydrophobicContact CG-CD1 3.62Å; Y409-Y479 HydrophobicContact CE1-CD1 4.2Å; Y409-Y479 AromaticContact CE1-CE1 3.79Å; Y409-Y479 HydrophobicContact CE1-CE1 3.79Å
410	A	96.1	Very high	84.3	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	115.7	173.1	0	0	0	0	0	109.4	V364 M392 V399 V429 E430 W439	V364-A410 HydrophobicContact CG1-CB 4.44Å; M392-A410 HydrophobicContact SD-CB 3.71Å; V399-A410 HydrophobicContact CG2-CB 4.11Å; A410-V429 WeakPolarHBondContact O-CA 3.46Å; A410-E430 PolarHBondContact N-O 2.79Å; A410-E430 PolarHBondContact O-N 2.99Å; A410-W439 HydrophobicContact CB-CH2 3.87Å; A410-W439 HydrophobicContact CB-CZ3 3.63Å
411	L	94.9	Very high	82.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	121.6	-166.5	-58.5	154.6	0	0	0	109.6	G400 T402 G413 V429 I452 C454 L461 V463 W486	G400-L411 PolarHBondContact N-O 2.78Å; G400-L411 WeakPolarHBondContact O-CB 3.37Å; G400-L411 PolarHBondContact O-N 3.21Å; T402-L411 HydrophobicContact CG2-CD1 4.12Å; L411-G413 PolarHBondContact O-N 2.99Å; L411-V429 HydrophobicContact CD2-CB 4.22Å; L411-V429 HydrophobicContact CD2-CG1 3.39Å; L411-V429 HydrophobicContact CD2-CG2 3.77Å; L411-V429 HydrophobicContact CG-CG1 4.28Å; L411-I452 HydrophobicContact CB-CD1 4.22Å; L411-I452 WeakPolarHBondContact O-CD1 3.26Å; L411-C454 HydrophobicContact CD1-CB 3.7Å; L411-L461 HydrophobicContact CD1-CD2 4.22Å; L411-V463 HydrophobicContact CD1-CG2 3.88Å; L411-V463 HydrophobicContact CD2-CG2 4.17Å; L411-W486 HydrophobicContact CD2-CH2 3.57Å; L411-W486 HydrophobicContact CD2-CZ2 3.72Å
412	G	92.8	Very high	80.5	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	28%	0.276	C	S	.	.			trans	48.4	-133	174.6	0	0	0	0	0	114.7	R396 T426 T428	R396-G412 WeakPolarHBondContact CD-O 3.33Å; R396-G412 PolarHBondContact NH1-O 2.73Å; G412-T426 WeakPolarHBondContact CA-O 3.08Å; G412-T426 PolarHBondContact O-OG1 3.3Å; G412-T428 PolarHBondContact N-O 2.85Å
413	G	90	Very high	78.7	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	30%	0.303	C	S	.	.			trans	92.9	-179.2	-172	0	0	0	0	0	112.1	G397 L411 R425 T426 R449	G397-G413 CarbonylContact O-C 3.58Å; G397-G413 VanDerWaalsContact O-CA 3.27Å; G397-G413 WeakPolarHBondContact O-CA 3.44Å; L411-G413 PolarHBondContact O-N 2.99Å; G413-R425 WeakPolarHBondContact O-CA 3.36Å; G413-T426 PolarHBondContact O-N 2.76Å; G413-R449 PolarHBondContact N-O 2.81Å
414	H	86.6	Confident	77.5	Confident	21 Å²	21	49.8 Å²	49.8	10%	0.097	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-114.8	151.7	176.5	58.6	-135	0	0	0	112.6	G397 C424 R425 D450	G397-H414 PolarHBondContact N-O 2.73Å; G397-H414 PolarHBondContact O-N 3.02Å; H414-C424 CarbonylContact C-O 3.52Å; H414-C424 VanDerWaalsContact CA-O 3.27Å; H414-C424 WeakPolarHBondContact CA-O 3.42Å; H414-R425 HydrophobicContact CB-CG 4.15Å; H414-D450 HydrophobicContact CB-CB 4.33Å; H414-D450 IonicContact CE1-OD2 3.61Å; H414-D450 PolarHBondContact CE1-OD2 2.94Å; H414-D450 IonicContact CG-OD2 2.86Å; H414-D450 IonicContact ND1-OD2 3.74Å; H414-D450 PolarHBondContact ND1-OD2 2.78Å
415	D	82.8	Confident	77	Confident	39 Å²	39	52.9 Å²	52.9	21%	0.209	32%	0.321	C	S	.	.			trans	-109	104.4	159.3	-167.4	7	0	0	0	106.8	R395 P417 C424	R395-D415 HydrophobicContact CB-CB 4.44Å; D415-P417 WeakPolarHBondContact O-CD 3.3Å; D415-C424 HydrophobicContact CB-CB 3.94Å; D415-C424 PolarHBondContact N-O 3.39Å; D415-C424 WeakPolarHBondContact O-CB 3.4Å
416	C	68.9	Low	77.1	Confident	44 Å²	44	49.1 Å²	49.1	30%	0.297	30%	0.301	S	S	.	.			trans	-101.4	86.9	175.2	-72.6	0	0	0	0	109
417	P	64.2	Low	77.2	Confident	50 Å²	50	51 Å²	51	33%	0.325	30%	0.299	S	S	.	.			trans	-71.3	149.6	171.2	29.7	-33.5	0	0	0	110.3	D415 S419 N420	D415-P417 WeakPolarHBondContact O-CD 3.3Å; P417-S419 PolarHBondContact O-N 2.95Å; P417-N420 PolarHBondContact O-N 2.86Å
418	A	56.5	Low	77.2	Confident	97 Å²	97	49 Å²	49	80%	0.802	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-21.3	-179.2	0	0	0	0	0	114.3
419	S	56.6	Low	77.2	Confident	109 Å²	109	49 Å²	49	76%	0.762	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-21.1	-176.6	55.5	0	0	0	0	115.1	P417	P417-S419 PolarHBondContact O-N 2.95Å
420	N	56.4	Low	77.2	Confident	81 Å²	81	48.9 Å²	48.9	43%	0.433	29%	0.291	S	S	.	.			trans	-148.8	92.2	178.1	-173.2	-3.9	0	0	0	110.8	P417 M422	P417-N420 PolarHBondContact O-N 2.86Å; N420-M422 PolarHBondContact O-N 3.07Å; N420-M422 PolarHBondContact OD1-N 2.77Å; N420-M422 VanDerWaalsContact OD1-N 3.08Å
421	P	55.4	Low	77.1	Confident	106 Å²	106	52.2 Å²	52.2	69%	0.688	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-12.1	179.2	-18.3	31	0	0	0	114.4
422	M	55.1	Low	77.2	Confident	162 Å²	162	52.4 Å²	52.4	80%	0.798	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-21.9	-164.7	-82.9	-176.9	77.9	0	0	116	N420	N420-M422 PolarHBondContact O-N 3.07Å; N420-M422 PolarHBondContact OD1-N 2.77Å; N420-M422 VanDerWaalsContact OD1-N 3.08Å
423	V	57.5	Low	77.3	Confident	106 Å²	106	54.1 Å²	54.1	64%	0.642	31%	0.313	S	S	*	.			trans	-152.1	121.1	174.3	-177.4	0	0	0	0	112.6
424	C	66.8	Low	77.4	Confident	47 Å²	47	56.6 Å²	56.6	32%	0.318	33%	0.329	S	S	.	.			trans	-166.9	53.6	138.2	-132.7	0	0	0	0	111.3	H414 D415	H414-C424 CarbonylContact C-O 3.52Å; H414-C424 VanDerWaalsContact CA-O 3.27Å; H414-C424 WeakPolarHBondContact CA-O 3.42Å; D415-C424 HydrophobicContact CB-CB 3.94Å; D415-C424 PolarHBondContact N-O 3.39Å; D415-C424 WeakPolarHBondContact O-CB 3.4Å
425	R	80.7	Confident	77.6	Confident	68 Å²	68	59.9 Å²	59.9	26%	0.257	36%	0.36	S	S	.	.	B	Isolated β-bridge	trans	-70.4	132.7	164.7	-74.6	171.3	-177.2	80	11.3	107.8	G413 H414 D450 Y467 D468	G413-R425 WeakPolarHBondContact O-CA 3.36Å; H414-R425 HydrophobicContact CB-CG 4.15Å; R425-D450 HydrophobicContact CG-CB 4.39Å; R425-D450 IonicContact CZ-OD1 3.02Å; R425-D450 IonicContact NE-OD1 2.85Å; R425-D450 PolarHBondContact NE-OD1 2.8Å; R425-D450 IonicContact NH2-OD1 2.73Å; R425-D450 IonicContact NH2-OD2 2.82Å; R425-Y467 WeakPolarHBondContact CD-O 3.32Å; R425-Y467 PolarHBondContact NE-O 2.77Å; R425-Y467 VanDerWaalsContact NH2-CD1 3.34Å; R425-Y467 VanDerWaalsContact NH2-CE1 3.35Å; R425-D468 VanDerWaalsContact CD-O 3.32Å; R425-D468 WeakPolarHBondContact CD-O 3.25Å
426	T	85.9	Confident	78.2	Confident	6 Å²	6	62 Å²	62	4%	0.037	37%	0.374	C	S	.	.			trans	-108.4	139.1	-175.1	84.2	0	0	0	0	109.6	R396 G412 G413 T428 R449	R396-T426 PolarHBondContact NH1-OG1 2.86Å; R396-T426 VanDerWaalsContact NH1-OG1 3.17Å; G412-T426 WeakPolarHBondContact CA-O 3.08Å; G412-T426 PolarHBondContact O-OG1 3.3Å; G413-T426 PolarHBondContact O-N 2.76Å; T426-T428 VanDerWaalsContact C-N 3.31Å; T426-T428 PolarHBondContact OG1-OG1 2.8Å; T426-R449 PolarHBondContact O-N 3.26Å
427	E	90.1	Very high	79.4	Confident	81 Å²	81	62.9 Å²	62.9	38%	0.379	38%	0.376	S	S	.	.			trans	-85.9	-13.6	167.6	67.6	-80	-174.2	0	0	111.2	S444 L445	E427-S444 CarbonylContact O-C 3.59Å; E427-S444 WeakPolarHBondContact O-CA 3.19Å; E427-L445 HydrophobicContact CB-CB 4.41Å; E427-L445 PolarHBondContact O-N 3.41Å
428	T	92.6	Very high	80.9	Confident	9 Å²	9	63.6 Å²	63.6	6%	0.055	38%	0.38	C	S	.	.			trans	-63.9	142.3	-174.2	61.8	0	0	0	0	112	R396 G412 T426 L441	R396-T428 PolarHBondContact NH1-O 3.48Å; R396-T428 PolarHBondContact NH1-OG1 3.45Å; R396-T428 PolarHBondContact NH2-O 3.39Å; R396-T428 PolarHBondContact NH2-OG1 2.81Å; G412-T428 PolarHBondContact N-O 2.85Å; T426-T428 VanDerWaalsContact C-N 3.31Å; T426-T428 PolarHBondContact OG1-OG1 2.8Å; T428-L441 HydrophobicContact CG2-CD1 4.43Å
429	V	95.3	Very high	82.8	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	134.6	176	-177.1	0	0	0	0	109.1	Y409 A410 L411 L441 I442 L445 W486	Y409-V429 HydrophobicContact CD1-CG1 4.48Å; A410-V429 WeakPolarHBondContact O-CA 3.46Å; L411-V429 HydrophobicContact CD2-CB 4.22Å; L411-V429 HydrophobicContact CD2-CG1 3.39Å; L411-V429 HydrophobicContact CD2-CG2 3.77Å; L411-V429 HydrophobicContact CG-CG1 4.28Å; V429-L441 WeakPolarHBondContact O-CD1 3.42Å; V429-I442 HydrophobicContact CB-CD1 4.16Å; V429-I442 HydrophobicContact CB-CG1 3.71Å; V429-I442 HydrophobicContact CG1-CD1 3.55Å; V429-I442 HydrophobicContact CG1-CG1 3.62Å; V429-I442 WeakPolarHBondContact O-CG1 3.43Å; V429-I442 PolarHBondContact O-N 3.34Å; V429-L445 HydrophobicContact CG2-CD1 4.36Å; V429-L445 HydrophobicContact CG2-CD2 3.89Å; V429-L445 HydrophobicContact CG2-CG 3.72Å; V429-W486 HydrophobicContact CG1-CZ2 4.36Å; V429-W486 HydrophobicContact CG2-CZ2 3.97Å
430	E	95.3	Very high	84.7	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.005	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	138.5	178.1	-61.4	175.5	93.7	0	0	110.3	N393 R396 Y409 A410 W439 T440 L441	N393-E430 WeakPolarHBondContact CA-OE1 3.43Å; N393-E430 WeakPolarHBondContact CB-OE1 3.44Å; N393-E430 VanDerWaalsContact CG-OE1 3.3Å; N393-E430 PolarHBondContact N-OE1 2.85Å; N393-E430 PolarHBondContact ND2-OE1 3.45Å; R396-E430 IonicContact CZ-OE2 3.91Å; R396-E430 IonicContact NE-OE2 3.98Å; R396-E430 PolarHBondContact NE-OE2 2.82Å; R396-E430 IonicContact NH2-OE2 3.25Å; R396-E430 PolarHBondContact NH2-OE2 3.07Å; Y409-E430 CarbonylContact C-O 3.36Å; Y409-E430 WeakPolarHBondContact CA-O 3.47Å; A410-E430 PolarHBondContact N-O 2.79Å; A410-E430 PolarHBondContact O-N 2.99Å; E430-W439 HydrophobicContact CB-CD2 4.48Å; E430-W439 HydrophobicContact CB-CE3 3.51Å; E430-W439 HydrophobicContact CB-CZ3 3.99Å; E430-T440 WeakPolarHBondContact CA-O 3.29Å; E430-L441 HydrophobicContact CG-CD1 4.01Å
431	R	95.8	Very high	86.5	Confident	70 Å²	70	58.9 Å²	58.9	26%	0.264	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	125.3	175.5	-175.5	-169.1	72	-171.1	1.1	109.3	F407 L408 Y409 W439 T440 I442	F407-R431 HydrophobicContact CB-CG 3.57Å; F407-R431 HydrophobicContact CD1-CG 4.15Å; F407-R431 HydrophobicContact CG-CG 3.95Å; L408-R431 CarbonylContact O-C 3.52Å; L408-R431 WeakPolarHBondContact O-CA 3.23Å; Y409-R431 HydrophobicContact CD1-CB 4.25Å; Y409-R431 HydrophobicContact CD1-CG 4.32Å; Y409-R431 HydrophobicContact CE1-CB 4.06Å; Y409-R431 HydrophobicContact CE1-CG 3.87Å; Y409-R431 HydrophobicContact CE2-CG 4.18Å; Y409-R431 WeakPolarHBondContact OH-CD 3.48Å; R431-W439 CarbonylContact O-C 3.54Å; R431-W439 WeakPolarHBondContact O-CA 3.46Å; R431-T440 PolarHBondContact N-O 3.27Å; R431-T440 PolarHBondContact O-N 2.76Å; R431-I442 HydrophobicContact CB-CG2 4Å
432	Y	96.8	Very high	88.4	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.016	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	130.3	175.5	175.7	-104.6	0	0	0	111	Y362 L389 L408 P434 D437 T438 W439	Y362-Y432 HydrophobicContact CE1-CE1 4.17Å; L389-Y432 HydrophobicContact CD1-CE1 4.34Å; L389-Y432 WeakPolarHBondContact CD1-OH 3.44Å; L408-Y432 HydrophobicContact CB-CD1 4.23Å; L408-Y432 HydrophobicContact CD2-CD1 4.27Å; L408-Y432 PolarHBondContact N-O 2.99Å; L408-Y432 VanDerWaalsContact N-O 3.14Å; L408-Y432 PolarHBondContact O-N 2.95Å; Y432-P434 HydrophobicContact CE1-CB 3.99Å; Y432-D437 VanDerWaalsContact CE2-OD1 3.23Å; Y432-D437 WeakPolarHBondContact CE2-OD1 3.35Å; Y432-D437 VanDerWaalsContact CZ-OD1 3.3Å; Y432-D437 PolarHBondContact OH-OD1 2.81Å; Y432-T438 WeakPolarHBondContact CA-O 3.49Å; Y432-W439 AromaticContact CD2-CD1 3.81Å; Y432-W439 AromaticContact CD2-CD2 3.98Å; Y432-W439 HydrophobicContact CD2-CD2 3.98Å; Y432-W439 AromaticContact CD2-CE2 3.62Å; Y432-W439 HydrophobicContact CD2-CG 4.12Å; Y432-W439 HydrophobicContact CD2-CZ2 4.12Å; Y432-W439 AromaticContact CD2-NE1 3.47Å; Y432-W439 HydrophobicContact CG-CD2 4.27Å; Y432-W439 AromaticContact CG-CE2 3.94Å; Y432-W439 HydrophobicContact CG-CH2 4.42Å; Y432-W439 HydrophobicContact CG-CZ2 4.04Å
433	D	94.4	Very high	90.2	Very high	36 Å²	36	48.3 Å²	48.3	19%	0.193	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	113.1	171.5	-173.7	-16.1	0	0	0	109.8	F407 A435 T436 D437 T438	F407-D433 HydrophobicContact CD1-CB 3.96Å; F407-D433 HydrophobicContact CE1-CB 3.83Å; D433-A435 PolarHBondContact O-N 3.08Å; D433-A435 VanDerWaalsContact OD1-CB 3.31Å; D433-A435 WeakPolarHBondContact OD1-CB 3.2Å; D433-A435 PolarHBondContact OD1-N 2.86Å; D433-T436 WeakPolarHBondContact CB-OG1 3.32Å; D433-D437 WeakPolarHBondContact O-CA 3.45Å; D433-D437 PolarHBondContact O-N 3.42Å; D433-T438 PolarHBondContact N-O 3.16Å; D433-T438 PolarHBondContact O-N 2.78Å
434	P	92.2	Very high	92	Very high	51 Å²	51	45.8 Å²	45.8	33%	0.331	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-19.1	178.6	31.1	-37.7	0	0	0	113.6	L357 Y432	L357-P434 HydrophobicContact CD2-CB 4.43Å; L357-P434 HydrophobicContact CD2-CG 3.9Å; Y432-P434 HydrophobicContact CE1-CB 3.99Å
435	A	91.4	Very high	93.2	Very high	91 Å²	91	43.9 Å²	43.9	75%	0.752	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-34.6	180	0	0	0	0	0	112.1	D433	D433-A435 PolarHBondContact O-N 3.08Å; D433-A435 VanDerWaalsContact OD1-CB 3.31Å; D433-A435 WeakPolarHBondContact OD1-CB 3.2Å; D433-A435 PolarHBondContact OD1-N 2.86Å
436	T	93.6	Very high	93.7	Very high	82 Å²	82	44.5 Å²	44.5	50%	0.503	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-9.9	179.5	59.9	0	0	0	0	113.5	D433 T438	D433-T436 WeakPolarHBondContact CB-OG1 3.32Å; T436-T438 VanDerWaalsContact C-N 3.35Å; T436-T438 PolarHBondContact OG1-OG1 2.85Å
437	D	94.9	Very high	93.8	Very high	63 Å²	63	48.3 Å²	48.3	34%	0.337	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	48.7	-172.1	-167.9	31.7	0	0	0	112	A390 Y432 D433	A390-D437 WeakPolarHBondContact CB-O 3.47Å; A390-D437 VanDerWaalsContact CB-OD1 3.31Å; A390-D437 WeakPolarHBondContact CB-OD1 3.39Å; A390-D437 PolarHBondContact N-OD1 2.88Å; A390-D437 PolarHBondContact N-OD2 3.34Å; Y432-D437 VanDerWaalsContact CE2-OD1 3.23Å; Y432-D437 WeakPolarHBondContact CE2-OD1 3.35Å; Y432-D437 VanDerWaalsContact CZ-OD1 3.3Å; Y432-D437 PolarHBondContact OH-OD1 2.81Å; D433-D437 WeakPolarHBondContact O-CA 3.45Å; D433-D437 PolarHBondContact O-N 3.42Å
438	T	96.3	Very high	93.8	Very high	65 Å²	65	45.4 Å²	45.4	40%	0.399	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	144.8	-178.4	59.8	0	0	0	0	113.2	Y432 D433 T436	Y432-T438 WeakPolarHBondContact CA-O 3.49Å; D433-T438 PolarHBondContact N-O 3.16Å; D433-T438 PolarHBondContact O-N 2.78Å; T436-T438 VanDerWaalsContact C-N 3.35Å; T436-T438 PolarHBondContact OG1-OG1 2.85Å
439	W	96.7	Very high	93.7	Very high	25 Å²	25	45 Å²	45	10%	0.095	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	132.8	170.7	-69.2	90.1	0	0	0	111.4	V364 I376 A390 M392 L408 A410 E430 R431 Y432	V364-W439 HydrophobicContact CG1-CH2 4.07Å; V364-W439 HydrophobicContact CG1-CZ2 4.29Å; I376-W439 HydrophobicContact CD1-CZ2 3.86Å; I376-W439 HydrophobicContact CG2-CZ2 4.32Å; A390-W439 PolarHBondContact O-NE1 3.11Å; M392-W439 HydrophobicContact CG-CD2 3.84Å; M392-W439 VanDerWaalsContact CG-CE2 3.47Å; M392-W439 HydrophobicContact CG-CE3 4.15Å; M392-W439 HydrophobicContact CG-CH2 3.78Å; M392-W439 HydrophobicContact CG-CZ2 3.44Å; M392-W439 VanDerWaalsContact CG-CZ2 3.44Å; M392-W439 HydrophobicContact CG-CZ3 4.12Å; M392-W439 HydrophobicContact SD-CH2 4.07Å; M392-W439 HydrophobicContact SD-CZ2 4.23Å; M392-W439 HydrophobicContact SD-CZ3 4.47Å; L408-W439 HydrophobicContact CD2-CH2 4.25Å; A410-W439 HydrophobicContact CB-CH2 3.87Å; A410-W439 HydrophobicContact CB-CZ3 3.63Å; E430-W439 HydrophobicContact CB-CD2 4.48Å; E430-W439 HydrophobicContact CB-CE3 3.51Å; E430-W439 HydrophobicContact CB-CZ3 3.99Å; R431-W439 CarbonylContact O-C 3.54Å; R431-W439 WeakPolarHBondContact O-CA 3.46Å; Y432-W439 AromaticContact CD2-CD1 3.81Å; Y432-W439 AromaticContact CD2-CD2 3.98Å; Y432-W439 HydrophobicContact CD2-CD2 3.98Å; Y432-W439 AromaticContact CD2-CE2 3.62Å; Y432-W439 HydrophobicContact CD2-CG 4.12Å; Y432-W439 HydrophobicContact CD2-CZ2 4.12Å; Y432-W439 AromaticContact CD2-NE1 3.47Å; Y432-W439 HydrophobicContact CG-CD2 4.27Å; Y432-W439 AromaticContact CG-CE2 3.94Å; Y432-W439 HydrophobicContact CG-CH2 4.42Å; Y432-W439 HydrophobicContact CG-CZ2 4.04Å
440	T	95.4	Very high	93.5	Very high	60 Å²	60	45.7 Å²	45.7	37%	0.368	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	130.7	172.9	-51	0	0	0	0	109.5	E430 R431	E430-T440 WeakPolarHBondContact CA-O 3.29Å; R431-T440 PolarHBondContact N-O 3.27Å; R431-T440 PolarHBondContact O-N 2.76Å
441	L	94.7	Very high	93.3	Very high	104 Å²	104	47 Å²	47	55%	0.545	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	129.5	172	-170.8	73.8	0	0	0	109.4	T428 V429 E430	T428-L441 HydrophobicContact CG2-CD1 4.43Å; V429-L441 WeakPolarHBondContact O-CD1 3.42Å; E430-L441 HydrophobicContact CG-CD1 4.01Å
442	I	94.4	Very high	93.1	Very high	16 Å²	16	44.3 Å²	44.3	8%	0.082	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	-175.2	176.5	68	173.1	0	0	0	110.4	Y409 V429 R431 S444 Y479	Y409-I442 HydrophobicContact CD1-CD1 3.69Å; Y409-I442 HydrophobicContact CE1-CD1 3.6Å; V429-I442 HydrophobicContact CB-CD1 4.16Å; V429-I442 HydrophobicContact CB-CG1 3.71Å; V429-I442 HydrophobicContact CG1-CD1 3.55Å; V429-I442 HydrophobicContact CG1-CG1 3.62Å; V429-I442 WeakPolarHBondContact O-CG1 3.43Å; V429-I442 PolarHBondContact O-N 3.34Å; R431-I442 HydrophobicContact CB-CG2 4Å; I442-S444 PolarHBondContact O-N 2.95Å; I442-Y479 HydrophobicContact CD1-CE1 4.25Å; I442-Y479 HydrophobicContact CD1-CE2 3.96Å
443	C	93.8	Very high	93	Very high	29 Å²	29	44.3 Å²	44.3	20%	0.196	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-57.5	134.5	-179.8	65.9	0	0	0	0	112	Y479 N484 G485 W486	C443-Y479 VanDerWaalsContact SG-CE2 3.55Å; C443-N484 WeakPolarHBondContact CB-O 3.39Å; C443-N484 PolarHBondContact N-OD1 2.9Å; C443-N484 PolarHBondContact SG-O 2.78Å; C443-G485 VanDerWaalsContact SG-CA 3.55Å; C443-W486 PolarHBondContact O-NE1 2.74Å; C443-W486 PolarHBondContact SG-NE1 2.85Å
444	S	94.1	Very high	93	Very high	53 Å²	53	43.4 Å²	43.4	37%	0.371	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-69.6	153.7	177.8	-64.7	0	0	0	0	112.1	E427 I442	E427-S444 CarbonylContact O-C 3.59Å; E427-S444 WeakPolarHBondContact O-CA 3.19Å; I442-S444 PolarHBondContact O-N 2.95Å
445	L	93.3	Very high	93.1	Very high	7 Å²	7	41.5 Å²	41.5	4%	0.037	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-61.4	160.3	167.3	-57.5	176.5	0	0	0	110.6	E427 V429 L447 R449 I452 W486	E427-L445 HydrophobicContact CB-CB 4.41Å; E427-L445 PolarHBondContact O-N 3.41Å; V429-L445 HydrophobicContact CG2-CD1 4.36Å; V429-L445 HydrophobicContact CG2-CD2 3.89Å; V429-L445 HydrophobicContact CG2-CG 3.72Å; L445-L447 PolarHBondContact O-N 2.81Å; L445-R449 HydrophobicContact CD1-CG 4.22Å; L445-I452 HydrophobicContact CD1-CD1 3.9Å; L445-W486 HydrophobicContact CD2-CD2 3.74Å; L445-W486 VanDerWaalsContact CD2-CE2 3.42Å; L445-W486 HydrophobicContact CD2-CE3 4.07Å; L445-W486 HydrophobicContact CD2-CG 4.36Å; L445-W486 HydrophobicContact CD2-CH2 3.82Å; L445-W486 HydrophobicContact CD2-CZ2 3.5Å; L445-W486 VanDerWaalsContact CD2-CZ2 3.5Å; L445-W486 HydrophobicContact CD2-CZ3 4.09Å
446	A	90.6	Very high	93.1	Very high	81 Å²	81	40 Å²	40	67%	0.669	25%	0.247	S	C	*	.	S	Bend	trans	-63.6	-31.6	177.1	0	0	0	0	0	113.1	E477	A446-E477 PolarHBondContact N-OE2 3.03Å
447	L	88.8	Confident	93	Very high	87 Å²	87	36.1 Å²	36.1	46%	0.455	22%	0.224	S	C	.	.	S	Bend	trans	-135.2	145	-179.1	-66.4	172.2	0	0	0	111	L445 R449 L473	L445-L447 PolarHBondContact O-N 2.81Å; L447-R449 PolarHBondContact O-N 2.87Å; L447-L473 HydrophobicContact CD1-CD2 4.4Å
448	G	89.2	Confident	92.5	Very high	19 Å²	19	35 Å²	35	20%	0.196	23%	0.226	C	C	.	.			trans	-73.2	119	172.1	0	0	0	0	0	110.9
449	R	91.4	Very high	91.8	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	23%	0.228	C	C	.	.			trans	-142.9	147.2	-174.6	49.6	173	169.4	-124.6	-15.6	112.8	G413 T426 L445 L447 I452 G465 Y467 L473 S475 E477	G413-R449 PolarHBondContact N-O 2.81Å; T426-R449 PolarHBondContact O-N 3.26Å; L445-R449 HydrophobicContact CD1-CG 4.22Å; L447-R449 PolarHBondContact O-N 2.87Å; R449-I452 HydrophobicContact CB-CG1 4.41Å; R449-I452 HydrophobicContact CG-CD1 3.67Å; R449-I452 HydrophobicContact CG-CG1 3.85Å; R449-I452 WeakPolarHBondContact O-CD1 3.37Å; R449-G465 WeakPolarHBondContact CD-O 3.39Å; R449-Y467 VanDerWaalsContact CA-O 3.22Å; R449-Y467 WeakPolarHBondContact CA-O 3.49Å; R449-L473 HydrophobicContact CB-CD1 3.87Å; R449-L473 HydrophobicContact CG-CD1 4.36Å; R449-S475 PolarHBondContact NH1-OG 2.8Å; R449-E477 IonicContact CZ-OE1 2.74Å; R449-E477 IonicContact NH1-OE1 2.9Å; R449-E477 PolarHBondContact NH1-OE1 2.97Å; R449-E477 IonicContact NH2-OE1 3.19Å; R449-E477 PolarHBondContact NH2-OE1 3.3Å; R449-E477 IonicContact NH2-OE2 3.79Å; R449-E477 PolarHBondContact NH2-OE2 3.11Å; R449-E477 VanDerWaalsContact NH2-OE2 3.08Å
450	D	90.7	Very high	91.4	Very high	15 Å²	15	37 Å²	37	8%	0.08	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-114.3	174.9	168.9	70.8	-38.7	0	0	0	111.7	H414 R425 I452 G466 Y467	H414-D450 HydrophobicContact CB-CB 4.33Å; H414-D450 IonicContact CE1-OD2 3.61Å; H414-D450 PolarHBondContact CE1-OD2 2.94Å; H414-D450 IonicContact CG-OD2 2.86Å; H414-D450 IonicContact ND1-OD2 3.74Å; H414-D450 PolarHBondContact ND1-OD2 2.78Å; R425-D450 HydrophobicContact CG-CB 4.39Å; R425-D450 IonicContact CZ-OD1 3.02Å; R425-D450 IonicContact NE-OD1 2.85Å; R425-D450 PolarHBondContact NE-OD1 2.8Å; R425-D450 IonicContact NH2-OD1 2.73Å; R425-D450 IonicContact NH2-OD2 2.82Å; D450-I452 PolarHBondContact O-N 3.27Å; D450-G466 CarbonylContact O-C 3.58Å; D450-G466 VanDerWaalsContact O-CA 3.26Å; D450-G466 WeakPolarHBondContact O-CA 3.19Å; D450-Y467 PolarHBondContact N-O 3.36Å; D450-Y467 PolarHBondContact O-N 3.27Å; D450-Y467 WeakPolarHBondContact OD1-CB 3.36Å
451	A	90.4	Very high	91.3	Very high	28 Å²	28	34.2 Å²	34.2	23%	0.231	22%	0.216	C	C	.	.	S	Bend	trans	53.2	43.6	-177.1	0	0	0	0	0	112	G398 G498	G398-A451 PolarHBondContact O-N 2.86Å; A451-G498 WeakPolarHBondContact O-CA 3.45Å; A451-G498 PolarHBondContact O-N 3.04Å
452	I	92.6	Very high	91.4	Very high	14 Å²	14	29.3 Å²	29.3	7%	0.072	19%	0.19	C	C	.	.			trans	-75.8	133.4	-175.5	-56.5	-178.5	0	0	0	109.7	L411 L445 R449 D450 V463	L411-I452 HydrophobicContact CB-CD1 4.22Å; L411-I452 WeakPolarHBondContact O-CD1 3.26Å; L445-I452 HydrophobicContact CD1-CD1 3.9Å; R449-I452 HydrophobicContact CB-CG1 4.41Å; R449-I452 HydrophobicContact CG-CD1 3.67Å; R449-I452 HydrophobicContact CG-CG1 3.85Å; R449-I452 WeakPolarHBondContact O-CD1 3.37Å; D450-I452 PolarHBondContact O-N 3.27Å; I452-V463 HydrophobicContact CG2-CG1 3.47Å; I452-V463 VanDerWaalsContact CG2-CG1 3.47Å
453	G	93.4	Very high	91.4	Very high	4 Å²	4	28.5 Å²	28.5	4%	0.041	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	130.4	163.6	0	0	0	0	0	110.1	V464 V501	G453-V464 PolarHBondContact N-O 2.98Å; G453-V464 PolarHBondContact O-N 3.48Å; G453-V501 VanDerWaalsContact CA-CG2 3.46Å
454	C	94.6	Very high	91.5	Very high	17 Å²	17	27.2 Å²	27.2	12%	0.115	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	143.1	176.4	57.4	0	0	0	0	111	G400 V401 T402 L411 I462 V463	G400-C454 VanDerWaalsContact C-SG 3.5Å; V401-C454 VanDerWaalsContact C-SG 3.54Å; V401-C454 PolarHBondContact N-SG 2.96Å; V401-C454 PolarHBondContact O-SG 3.37Å; V401-C454 VanDerWaalsContact O-SG 3.4Å; T402-C454 HydrophobicContact CG2-CB 4.36Å; L411-C454 HydrophobicContact CD1-CB 3.7Å; C454-I462 VanDerWaalsContact CA-O 3.3Å; C454-I462 WeakPolarHBondContact CA-O 3.43Å; C454-V463 HydrophobicContact CB-CG2 4.46Å
455	A	94.6	Very high	91.5	Very high	11 Å²	11	24.7 Å²	24.7	9%	0.091	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	165.9	169.3	0	0	0	0	0	111.3	L220 I462 V501	L220-A455 HydrophobicContact CD1-CB 3.92Å; A455-I462 PolarHBondContact N-O 2.85Å; A455-I462 VanDerWaalsContact N-O 3.16Å; A455-I462 PolarHBondContact O-N 2.89Å; A455-V501 HydrophobicContact CB-CB 4.47Å; A455-V501 HydrophobicContact CB-CG1 3.86Å
456	L	92.3	Very high	91.4	Very high	60 Å²	60	24.4 Å²	24.4	31%	0.314	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	123.5	174.2	-167.7	75.4	0	0	0	109.4	A404 G458 A503	A404-L456 HydrophobicContact CB-CD1 3.68Å; L456-G458 VanDerWaalsContact CD2-O 3.29Å; L456-G458 WeakPolarHBondContact CD2-O 3.39Å; L456-G458 VanDerWaalsContact CG-O 3.31Å; L456-G458 WeakPolarHBondContact CG-O 3.45Å; L456-A503 VanDerWaalsContact O-CB 3.29Å; L456-A503 WeakPolarHBondContact O-CB 3.3Å
457	L	90.1	Very high	91.4	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.005	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	96.7	173.4	-177.5	64.9	0	0	0	109.2	V217 L220 Y238 P240 D459 R460 I462 A503	V217-L457 HydrophobicContact CG1-CG 4.36Å; V217-L457 HydrophobicContact CG2-CG 4.39Å; L220-L457 HydrophobicContact CB-CD2 4.44Å; Y238-L457 HydrophobicContact CD1-CD2 4.33Å; P240-L457 HydrophobicContact CB-CD2 4.12Å; P240-L457 HydrophobicContact CG-CD2 3.97Å; L457-D459 PolarHBondContact O-N 3.31Å; L457-R460 PolarHBondContact N-O 3.41Å; L457-R460 PolarHBondContact O-N 3.46Å; L457-I462 HydrophobicContact CB-CD1 3.9Å; L457-I462 HydrophobicContact CD2-CD1 3.9Å; L457-A503 HydrophobicContact CD1-CB 4.1Å
458	G	84.4	Confident	91.4	Very high	38 Å²	38	22.5 Å²	22.5	39%	0.392	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.6	-113.9	-167.3	0	0	0	0	0	110.2	V217 L456	V217-G458 VanDerWaalsContact CG2-CA 3.43Å; L456-G458 VanDerWaalsContact CD2-O 3.29Å; L456-G458 WeakPolarHBondContact CD2-O 3.39Å; L456-G458 VanDerWaalsContact CG-O 3.31Å; L456-G458 WeakPolarHBondContact CG-O 3.45Å
459	D	81.9	Confident	91	Very high	82 Å²	82	22.5 Å²	22.5	44%	0.439	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-2.6	174.6	57.5	-15.6	0	0	0	113.1	L457	L457-D459 PolarHBondContact O-N 3.31Å
460	R	88.6	Confident	90.6	Very high	50 Å²	50	28.3 Å²	28.3	19%	0.189	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	124.2	-174.9	-65.1	179.8	-74.1	-174.1	3.2	111.8	P240 L457 E478	P240-R460 VanDerWaalsContact CB-NH2 3.34Å; L457-R460 PolarHBondContact N-O 3.41Å; L457-R460 PolarHBondContact O-N 3.46Å; R460-E478 HydrophobicContact CB-CG 4.31Å; R460-E478 WeakPolarHBondContact CD-OE1 3.48Å; R460-E478 WeakPolarHBondContact CG-OE1 3.39Å
461	L	94.3	Very high	90.4	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.01	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	116.7	173.8	-174.6	169.5	0	0	0	108.5	T402 A404 Y409 L411 V463 E478 Y479 W486	T402-L461 HydrophobicContact CG2-CD1 3.57Å; T402-L461 HydrophobicContact CG2-CD2 4.18Å; T402-L461 HydrophobicContact CG2-CG 3.58Å; A404-L461 HydrophobicContact CB-CB 4.34Å; A404-L461 HydrophobicContact CB-CD1 4.23Å; Y409-L461 HydrophobicContact CD1-CD1 3.93Å; Y409-L461 HydrophobicContact CD2-CD1 3.89Å; Y409-L461 HydrophobicContact CE1-CD1 4.44Å; Y409-L461 HydrophobicContact CE2-CD1 4.43Å; Y409-L461 HydrophobicContact CG-CD1 3.62Å; L411-L461 HydrophobicContact CD1-CD2 4.22Å; L461-V463 HydrophobicContact CD2-CG2 3.86Å; L461-E478 WeakPolarHBondContact O-CA 3.49Å; L461-Y479 PolarHBondContact O-N 2.82Å; L461-W486 HydrophobicContact CD2-CH2 3.58Å; L461-W486 HydrophobicContact CD2-CZ3 3.82Å
462	I	95.4	Very high	90.4	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	132.4	-179	-57.3	175.5	0	0	0	110	L220 Y238 C454 A455 L457 V464 V476 E477 L489	L220-I462 HydrophobicContact CD2-CB 4.03Å; L220-I462 HydrophobicContact CD2-CD1 4.27Å; L220-I462 HydrophobicContact CD2-CG2 3.69Å; Y238-I462 HydrophobicContact CD1-CD1 4.47Å; Y238-I462 HydrophobicContact CE1-CD1 4.25Å; C454-I462 VanDerWaalsContact CA-O 3.3Å; C454-I462 WeakPolarHBondContact CA-O 3.43Å; A455-I462 PolarHBondContact N-O 2.85Å; A455-I462 VanDerWaalsContact N-O 3.16Å; A455-I462 PolarHBondContact O-N 2.89Å; L457-I462 HydrophobicContact CB-CD1 3.9Å; L457-I462 HydrophobicContact CD2-CD1 3.9Å; I462-V464 HydrophobicContact CG2-CG2 3.96Å; I462-V476 HydrophobicContact CG2-CG1 3.54Å; I462-E477 WeakPolarHBondContact CA-O 3.4Å; I462-L489 HydrophobicContact CD1-CD1 4.28Å; I462-L489 HydrophobicContact CG1-CD1 4.38Å; I462-L489 HydrophobicContact CG2-CD1 4.27Å
463	V	95.3	Very high	90.4	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	132.9	175.2	173.2	0	0	0	0	109.1	L411 I452 C454 L461 V476 E477 W486	L411-V463 HydrophobicContact CD1-CG2 3.88Å; L411-V463 HydrophobicContact CD2-CG2 4.17Å; I452-V463 HydrophobicContact CG2-CG1 3.47Å; I452-V463 VanDerWaalsContact CG2-CG1 3.47Å; C454-V463 HydrophobicContact CB-CG2 4.46Å; L461-V463 HydrophobicContact CD2-CG2 3.86Å; V463-V476 CarbonylContact O-C 3.59Å; V463-V476 VanDerWaalsContact O-CA 3.23Å; V463-V476 WeakPolarHBondContact O-CA 3.36Å; V463-V476 WeakPolarHBondContact O-CG1 3.23Å; V463-E477 HydrophobicContact CB-CB 4.5Å; V463-E477 PolarHBondContact N-O 3.05Å; V463-E477 PolarHBondContact O-N 3.27Å; V463-W486 HydrophobicContact CB-CZ3 4.2Å; V463-W486 HydrophobicContact CG2-CH2 3.64Å; V463-W486 HydrophobicContact CG2-CZ3 3.52Å
464	V	95.4	Very high	90.5	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.012	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	124.4	-172.4	-175.6	0	0	0	0	110.3	L220 A222 W245 G453 I462 V476 M492 V501	L220-V464 HydrophobicContact CD2-CG2 3.68Å; A222-V464 HydrophobicContact CB-CG1 4.31Å; W245-V464 HydrophobicContact CH2-CG1 3.99Å; W245-V464 HydrophobicContact CH2-CG2 4.14Å; W245-V464 HydrophobicContact CZ2-CG1 4.05Å; W245-V464 HydrophobicContact CZ2-CG2 4.09Å; G453-V464 PolarHBondContact N-O 2.98Å; G453-V464 PolarHBondContact O-N 3.48Å; I462-V464 HydrophobicContact CG2-CG2 3.96Å; V464-V476 HydrophobicContact CG1-CG2 4.18Å; V464-V476 HydrophobicContact CG2-CG1 4.22Å; V464-M492 HydrophobicContact CG1-CE 3.6Å; V464-M492 HydrophobicContact CG1-CG 4.06Å; V464-M492 HydrophobicContact CG1-SD 3.24Å; V464-M492 WeakPolarHBondContact CG1-SD 3.16Å; V464-V501 HydrophobicContact CB-CG2 3.81Å; V464-V501 HydrophobicContact CG1-CG2 4.3Å; V464-V501 HydrophobicContact CG2-CG1 4.04Å; V464-V501 HydrophobicContact CG2-CG2 4.04Å
465	G	93.9	Very high	90.5	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.212	C	C	.	.			trans	63.6	-140.4	171.1	0	0	0	0	0	113.5	R449 L473 S475	R449-G465 WeakPolarHBondContact CD-O 3.39Å; G465-L473 WeakPolarHBondContact CA-O 3.45Å; G465-S475 PolarHBondContact N-O 2.86Å
466	G	92.3	Very high	90.6	Very high	1 Å²	1	39 Å²	39	1%	0.01	21%	0.208	C	C	.	.			trans	109.8	-175.1	-173.7	0	0	0	0	0	112.4	D450 A472 L473 R496	D450-G466 CarbonylContact O-C 3.58Å; D450-G466 VanDerWaalsContact O-CA 3.26Å; D450-G466 WeakPolarHBondContact O-CA 3.19Å; G466-A472 CarbonylContact O-C 3.55Å; G466-A472 WeakPolarHBondContact O-CA 3.48Å; G466-L473 PolarHBondContact O-N 2.73Å; G466-R496 PolarHBondContact N-O 3.23Å
467	Y	89.9	Confident	90.7	Very high	75 Å²	75	36.5 Å²	36.5	29%	0.294	20%	0.195	S	C	.	.	B	Isolated β-bridge	trans	-126	127.1	178.6	-175.3	-113.9	0	0	0	109.8	R425 R449 D450 G469 N470 H471	R425-Y467 WeakPolarHBondContact CD-O 3.32Å; R425-Y467 PolarHBondContact NE-O 2.77Å; R425-Y467 VanDerWaalsContact NH2-CD1 3.34Å; R425-Y467 VanDerWaalsContact NH2-CE1 3.35Å; R449-Y467 VanDerWaalsContact CA-O 3.22Å; R449-Y467 WeakPolarHBondContact CA-O 3.49Å; D450-Y467 PolarHBondContact N-O 3.36Å; D450-Y467 PolarHBondContact O-N 3.27Å; D450-Y467 WeakPolarHBondContact OD1-CB 3.36Å; Y467-G469 VanDerWaalsContact CZ-C 3.4Å; Y467-G469 PolarHBondContact OH-O 2.94Å; Y467-N470 VanDerWaalsContact CE2-C 3.48Å; Y467-N470 WeakPolarHBondContact CE2-O 3.3Å; Y467-N470 PolarHBondContact OH-O 2.81Å; Y467-H471 WeakPolarHBondContact CD2-O 3.39Å
468	D	87.9	Confident	91	Very high	52 Å²	52	38.1 Å²	38.1	28%	0.278	20%	0.202	S	C	.	.			trans	-87.7	-6.6	-178.1	67.7	1.5	0	0	0	113.3	R425 N470 H471 L473	R425-D468 VanDerWaalsContact CD-O 3.32Å; R425-D468 WeakPolarHBondContact CD-O 3.25Å; D468-N470 WeakPolarHBondContact OD1-CA 3.39Å; D468-N470 PolarHBondContact OD1-N 2.83Å; D468-H471 PolarHBondContact N-O 2.85Å; D468-H471 PolarHBondContact OD1-N 2.76Å; D468-H471 VanDerWaalsContact OD1-O 3.08Å; D468-L473 HydrophobicContact CB-CD1 4.31Å; D468-L473 HydrophobicContact CB-CD2 4.16Å; D468-L473 HydrophobicContact CB-CG 4.4Å
469	G	81.9	Confident	91.5	Very high	19 Å²	19	36.9 Å²	36.9	20%	0.196	19%	0.186	C	C	.	.	S	Bend	trans	109.4	-15.8	-174.9	0	0	0	0	0	115.1	Y467	Y467-G469 VanDerWaalsContact CZ-C 3.4Å; Y467-G469 PolarHBondContact OH-O 2.94Å
470	N	83	Confident	91.9	Very high	122 Å²	122	34.3 Å²	34.3	65%	0.652	17%	0.172	S	C	*	.	S	Bend	trans	-118.1	-51.1	174.7	-64.3	-35.1	0	0	0	110.1	Y467 D468	Y467-N470 VanDerWaalsContact CE2-C 3.48Å; Y467-N470 WeakPolarHBondContact CE2-O 3.3Å; Y467-N470 PolarHBondContact OH-O 2.81Å; D468-N470 WeakPolarHBondContact OD1-CA 3.39Å; D468-N470 PolarHBondContact OD1-N 2.83Å
471	H	86.4	Confident	91.8	Very high	132 Å²	132	35.1 Å²	35.1	61%	0.611	18%	0.184	S	C	*	.	S	Bend	trans	-131	151.7	-172	-50.5	101.4	0	0	0	112.1	Y467 D468	Y467-H471 WeakPolarHBondContact CD2-O 3.39Å; D468-H471 PolarHBondContact N-O 2.85Å; D468-H471 PolarHBondContact OD1-N 2.76Å; D468-H471 VanDerWaalsContact OD1-O 3.08Å
472	A	91.1	Very high	91.4	Very high	25 Å²	25	41.5 Å²	41.5	21%	0.207	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-67.1	145	164.4	0	0	0	0	0	109.1	G466 A495 A497	G466-A472 CarbonylContact O-C 3.55Å; G466-A472 WeakPolarHBondContact O-CA 3.48Å; A472-A495 HydrophobicContact CB-CB 3.94Å; A472-A495 VanDerWaalsContact O-CB 3.29Å; A472-A495 WeakPolarHBondContact O-CB 3.24Å; A472-A497 HydrophobicContact CB-CB 4.21Å
473	L	92.4	Very high	91.1	Very high	18 Å²	18	50.7 Å²	50.7	9%	0.094	26%	0.257	C	S	.	.			trans	-99	148.7	-176.9	-61.7	175.3	0	0	0	111.2	L447 R449 G465 G466 D468 A495 R496	L447-L473 HydrophobicContact CD1-CD2 4.4Å; R449-L473 HydrophobicContact CB-CD1 3.87Å; R449-L473 HydrophobicContact CG-CD1 4.36Å; G465-L473 WeakPolarHBondContact CA-O 3.45Å; G466-L473 PolarHBondContact O-N 2.73Å; D468-L473 HydrophobicContact CB-CD1 4.31Å; D468-L473 HydrophobicContact CB-CD2 4.16Å; D468-L473 HydrophobicContact CB-CG 4.4Å; L473-A495 WeakPolarHBondContact O-CA 3.41Å; L473-R496 PolarHBondContact O-N 3.48Å
474	K	94.3	Very high	90.9	Very high	118 Å²	118	54.2 Å²	54.2	51%	0.513	28%	0.276	S	S	.	.			trans	-107.5	-3.6	169.1	65.7	177.2	-177.4	177.9	0	112.9	P491 M492 A495	K474-P491 HydrophobicContact CB-CB 4.42Å; K474-P491 HydrophobicContact CD-CB 4.14Å; K474-P491 HydrophobicContact CG-CB 4Å; K474-P491 CarbonylContact O-C 3.58Å; K474-P491 VanDerWaalsContact O-CA 3.28Å; K474-P491 WeakPolarHBondContact O-CA 3.38Å; K474-P491 WeakPolarHBondContact O-CB 3.23Å; K474-M492 HydrophobicContact CB-CB 4.39Å; K474-M492 PolarHBondContact O-N 2.55Å; K474-A495 HydrophobicContact CB-CB 4.38Å
475	S	94.9	Very high	90.8	Very high	20 Å²	20	55 Å²	55	14%	0.14	29%	0.285	C	S	.	.			trans	-66.7	146.2	-177.2	51.6	0	0	0	0	110.9	R449 G465	R449-S475 PolarHBondContact NH1-OG 2.8Å; G465-S475 PolarHBondContact N-O 2.86Å
476	V	96.4	Very high	90.9	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	129.9	177.5	-177.7	0	0	0	0	107.1	W245 I462 V463 V464 L489 M492	W245-V476 HydrophobicContact CZ2-CG1 4.34Å; W245-V476 HydrophobicContact CZ2-CG2 3.88Å; I462-V476 HydrophobicContact CG2-CG1 3.54Å; V463-V476 CarbonylContact O-C 3.59Å; V463-V476 VanDerWaalsContact O-CA 3.23Å; V463-V476 WeakPolarHBondContact O-CA 3.36Å; V463-V476 WeakPolarHBondContact O-CG1 3.23Å; V464-V476 HydrophobicContact CG1-CG2 4.18Å; V464-V476 HydrophobicContact CG2-CG1 4.22Å; V476-L489 HydrophobicContact CB-CB 4.15Å; V476-L489 HydrophobicContact CG1-CB 3.94Å; V476-L489 HydrophobicContact CG1-CD1 4.06Å; V476-L489 PolarHBondContact O-N 2.82Å; V476-M492 HydrophobicContact CG2-CG 4.11Å
477	E	95.6	Very high	91	Very high	9 Å²	9	60.1 Å²	60.1	4%	0.042	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	137.1	-175.9	-75.3	165.3	-116.6	0	0	110	A446 R449 I462 V463 W486 N487	A446-E477 PolarHBondContact N-OE2 3.03Å; R449-E477 IonicContact CZ-OE1 2.74Å; R449-E477 IonicContact NH1-OE1 2.9Å; R449-E477 PolarHBondContact NH1-OE1 2.97Å; R449-E477 IonicContact NH2-OE1 3.19Å; R449-E477 PolarHBondContact NH2-OE1 3.3Å; R449-E477 IonicContact NH2-OE2 3.79Å; R449-E477 PolarHBondContact NH2-OE2 3.11Å; R449-E477 VanDerWaalsContact NH2-OE2 3.08Å; I462-E477 WeakPolarHBondContact CA-O 3.4Å; V463-E477 HydrophobicContact CB-CB 4.5Å; V463-E477 PolarHBondContact N-O 3.05Å; V463-E477 PolarHBondContact O-N 3.27Å; E477-W486 HydrophobicContact CB-CE3 3.86Å; E477-N487 CarbonylContact C-O 3.57Å; E477-N487 WeakPolarHBondContact CA-O 3.3Å
478	E	95.4	Very high	91.2	Very high	34 Å²	34	64 Å²	64	16%	0.159	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	133.9	176.2	-175.3	-170.7	166.4	0	0	110	R460 L461 W486 N487 L489	R460-E478 HydrophobicContact CB-CG 4.31Å; R460-E478 WeakPolarHBondContact CD-OE1 3.48Å; R460-E478 WeakPolarHBondContact CG-OE1 3.39Å; L461-E478 WeakPolarHBondContact O-CA 3.49Å; E478-W486 CarbonylContact O-C 3.57Å; E478-W486 WeakPolarHBondContact O-CA 3.18Å; E478-N487 PolarHBondContact N-O 3.06Å; E478-N487 PolarHBondContact O-N 2.86Å; E478-L489 HydrophobicContact CB-CD1 3.85Å; E478-L489 HydrophobicContact CB-CD2 4.39Å; E478-L489 HydrophobicContact CB-CG 4Å
479	Y	95	Very high	91.6	Very high	12 Å²	12	62.4 Å²	62.4	5%	0.047	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	125	175.6	-176.6	-123	0	0	0	111.7	Y409 I442 C443 L461 P481 N484 W486	Y409-Y479 HydrophobicContact CE1-CD1 4.2Å; Y409-Y479 AromaticContact CE1-CE1 3.79Å; Y409-Y479 HydrophobicContact CE1-CE1 3.79Å; I442-Y479 HydrophobicContact CD1-CE1 4.25Å; I442-Y479 HydrophobicContact CD1-CE2 3.96Å; C443-Y479 VanDerWaalsContact SG-CE2 3.55Å; L461-Y479 PolarHBondContact O-N 2.82Å; Y479-P481 HydrophobicContact CD1-CB 4.38Å; Y479-P481 HydrophobicContact CE1-CB 3.92Å; Y479-P481 WeakPolarHBondContact O-CD 3.44Å; Y479-N484 PolarHBondContact OH-OD1 2.73Å; Y479-W486 HydrophobicContact CD2-CD2 4.17Å; Y479-W486 AromaticContact CD2-CE2 3.82Å; Y479-W486 HydrophobicContact CD2-CH2 4.45Å; Y479-W486 AromaticContact CD2-CZ2 3.96Å; Y479-W486 HydrophobicContact CD2-CZ2 3.96Å; Y479-W486 HydrophobicContact CG-CH2 4.31Å; Y479-W486 HydrophobicContact CG-CZ2 4.23Å
480	D	90.4	Very high	92.2	Very high	28 Å²	28	62.4 Å²	62.4	15%	0.15	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	106.5	168.2	-178.2	-19.2	0	0	0	109.6	V482 R483 N484 G485	D480-V482 VanDerWaalsContact C-N 3.28Å; D480-V482 PolarHBondContact O-N 2.7Å; D480-V482 WeakPolarHBondContact OD1-CA 3.4Å; D480-V482 WeakPolarHBondContact OD1-CB 3.34Å; D480-V482 PolarHBondContact OD1-N 2.94Å; D480-R483 HydrophobicContact CB-CB 4.41Å; D480-R483 PolarHBondContact OD1-N 2.87Å; D480-R483 VanDerWaalsContact OD1-N 3.09Å; D480-R483 VanDerWaalsContact OD2-CD 3.29Å; D480-R483 WeakPolarHBondContact OD2-CD 3.16Å; D480-R483 WeakPolarHBondContact OD2-CG 3.27Å; D480-R483 IonicContact OD2-NE 2.61Å; D480-R483 IonicContact OD2-NH1 2.71Å; D480-N484 VanDerWaalsContact O-CA 3.28Å; D480-N484 WeakPolarHBondContact O-CA 3.44Å; D480-N484 PolarHBondContact O-N 2.82Å; D480-G485 PolarHBondContact N-O 3.41Å; D480-G485 PolarHBondContact O-N 3.04Å
481	P	86.4	Confident	92.7	Very high	68 Å²	68	59.4 Å²	59.4	44%	0.442	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-20.2	-178.7	29.4	-35.3	0	0	0	113.5	Y479	Y479-P481 HydrophobicContact CD1-CB 4.38Å; Y479-P481 HydrophobicContact CE1-CB 3.92Å; Y479-P481 WeakPolarHBondContact O-CD 3.44Å
482	V	86.1	Confident	93.1	Very high	135 Å²	135	53.4 Å²	53.4	82%	0.818	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-45.9	-179.4	-179.6	0	0	0	0	110	D480 N484	D480-V482 VanDerWaalsContact C-N 3.28Å; D480-V482 PolarHBondContact O-N 2.7Å; D480-V482 WeakPolarHBondContact OD1-CA 3.4Å; D480-V482 WeakPolarHBondContact OD1-CB 3.34Å; D480-V482 PolarHBondContact OD1-N 2.94Å; V482-N484 VanDerWaalsContact C-N 3.34Å
483	R	88.9	Confident	93.1	Very high	195 Å²	195	55.3 Å²	55.3	74%	0.736	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-13.4	177.8	-65.9	-178	177.3	150	-1.5	113.3	D480 G485	D480-R483 HydrophobicContact CB-CB 4.41Å; D480-R483 PolarHBondContact OD1-N 2.87Å; D480-R483 VanDerWaalsContact OD1-N 3.09Å; D480-R483 VanDerWaalsContact OD2-CD 3.29Å; D480-R483 WeakPolarHBondContact OD2-CD 3.16Å; D480-R483 WeakPolarHBondContact OD2-CG 3.27Å; D480-R483 IonicContact OD2-NE 2.61Å; D480-R483 IonicContact OD2-NH1 2.71Å; R483-G485 VanDerWaalsContact C-N 3.34Å
484	N	90.8	Very high	93	Very high	73 Å²	73	59.4 Å²	59.4	39%	0.39	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	58.8	-167.5	-175.3	38.6	0	0	0	110.1	C443 Y479 D480 V482	C443-N484 WeakPolarHBondContact CB-O 3.39Å; C443-N484 PolarHBondContact N-OD1 2.9Å; C443-N484 PolarHBondContact SG-O 2.78Å; Y479-N484 PolarHBondContact OH-OD1 2.73Å; D480-N484 VanDerWaalsContact O-CA 3.28Å; D480-N484 WeakPolarHBondContact O-CA 3.44Å; D480-N484 PolarHBondContact O-N 2.82Å; V482-N484 VanDerWaalsContact C-N 3.34Å
485	G	94.1	Very high	92.8	Very high	20 Å²	20	55.4 Å²	55.4	21%	0.206	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	164	-177	0	0	0	0	0	112	C443 D480 R483	C443-G485 VanDerWaalsContact SG-CA 3.55Å; D480-G485 PolarHBondContact N-O 3.41Å; D480-G485 PolarHBondContact O-N 3.04Å; R483-G485 VanDerWaalsContact C-N 3.34Å
486	W	94.8	Very high	92.6	Very high	39 Å²	39	54.5 Å²	54.5	15%	0.148	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	129.8	176.5	-66.7	94.1	0	0	0	110.3	L411 V429 C443 L445 L461 V463 E477 E478 Y479	L411-W486 HydrophobicContact CD2-CH2 3.57Å; L411-W486 HydrophobicContact CD2-CZ2 3.72Å; V429-W486 HydrophobicContact CG1-CZ2 4.36Å; V429-W486 HydrophobicContact CG2-CZ2 3.97Å; C443-W486 PolarHBondContact O-NE1 2.74Å; C443-W486 PolarHBondContact SG-NE1 2.85Å; L445-W486 HydrophobicContact CD2-CD2 3.74Å; L445-W486 VanDerWaalsContact CD2-CE2 3.42Å; L445-W486 HydrophobicContact CD2-CE3 4.07Å; L445-W486 HydrophobicContact CD2-CG 4.36Å; L445-W486 HydrophobicContact CD2-CH2 3.82Å; L445-W486 HydrophobicContact CD2-CZ2 3.5Å; L445-W486 VanDerWaalsContact CD2-CZ2 3.5Å; L445-W486 HydrophobicContact CD2-CZ3 4.09Å; L461-W486 HydrophobicContact CD2-CH2 3.58Å; L461-W486 HydrophobicContact CD2-CZ3 3.82Å; V463-W486 HydrophobicContact CB-CZ3 4.2Å; V463-W486 HydrophobicContact CG2-CH2 3.64Å; V463-W486 HydrophobicContact CG2-CZ3 3.52Å; E477-W486 HydrophobicContact CB-CE3 3.86Å; E478-W486 CarbonylContact O-C 3.57Å; E478-W486 WeakPolarHBondContact O-CA 3.18Å; Y479-W486 HydrophobicContact CD2-CD2 4.17Å; Y479-W486 AromaticContact CD2-CE2 3.82Å; Y479-W486 HydrophobicContact CD2-CH2 4.45Å; Y479-W486 AromaticContact CD2-CZ2 3.96Å; Y479-W486 HydrophobicContact CD2-CZ2 3.96Å; Y479-W486 HydrophobicContact CG-CH2 4.31Å; Y479-W486 HydrophobicContact CG-CZ2 4.23Å
487	N	94.8	Very high	92.3	Very high	69 Å²	69	55 Å²	55	37%	0.369	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	136.1	174.3	-61.4	-45.7	0	0	0	109.5	E477 E478	E477-N487 CarbonylContact C-O 3.57Å; E477-N487 WeakPolarHBondContact CA-O 3.3Å; E478-N487 PolarHBondContact N-O 3.06Å; E478-N487 PolarHBondContact O-N 2.86Å
488	E	95.1	Very high	92	Very high	155 Å²	155	55.8 Å²	55.8	72%	0.724	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.9	129.4	175.1	-169.7	174.1	-172.9	0	0	110.2
489	L	95.2	Very high	91.8	Very high	19 Å²	19	54.5 Å²	54.5	10%	0.099	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	170	173.5	-65.5	-178.4	0	0	0	110.5	Y238 I462 V476 E478	Y238-L489 HydrophobicContact CE1-CD1 4.23Å; I462-L489 HydrophobicContact CD1-CD1 4.28Å; I462-L489 HydrophobicContact CG1-CD1 4.38Å; I462-L489 HydrophobicContact CG2-CD1 4.27Å; V476-L489 HydrophobicContact CB-CB 4.15Å; V476-L489 HydrophobicContact CG1-CB 3.94Å; V476-L489 HydrophobicContact CG1-CD1 4.06Å; V476-L489 PolarHBondContact O-N 2.82Å; E478-L489 HydrophobicContact CB-CD1 3.85Å; E478-L489 HydrophobicContact CB-CD2 4.39Å; E478-L489 HydrophobicContact CB-CG 4Å
490	A	94.4	Very high	91.7	Very high	19 Å²	19	54.9 Å²	54.9	16%	0.157	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-53.9	131.4	176.3	0	0	0	0	0	111.8	D243 W245	D243-A490 WeakPolarHBondContact O-CB 3.44Å; D243-A490 WeakPolarHBondContact OD1-CB 3.31Å; D243-A490 PolarHBondContact OD1-N 2.83Å; D243-A490 PolarHBondContact OD2-N 2.98Å; W245-A490 PolarHBondContact NE1-O 3.28Å
491	P	95.3	Very high	91.9	Very high	60 Å²	60	54.3 Å²	54.3	39%	0.39	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-71.1	155.2	-177.9	29.3	-35.3	0	0	0	111.3	K474	K474-P491 HydrophobicContact CB-CB 4.42Å; K474-P491 HydrophobicContact CD-CB 4.14Å; K474-P491 HydrophobicContact CG-CB 4Å; K474-P491 CarbonylContact O-C 3.58Å; K474-P491 VanDerWaalsContact O-CA 3.28Å; K474-P491 WeakPolarHBondContact O-CA 3.38Å; K474-P491 WeakPolarHBondContact O-CB 3.23Å
492	M	94.4	Very high	92.3	Very high	5 Å²	5	51.6 Å²	51.6	3%	0.025	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-61.6	155.6	169.9	-66.8	-176.3	-68.7	0	0	111.2	A222 W245 V464 K474 V476 F494 R496	A222-M492 HydrophobicContact CB-SD 3.91Å; W245-M492 HydrophobicContact CD2-CG 3.86Å; W245-M492 HydrophobicContact CE3-CG 4.23Å; W245-M492 HydrophobicContact CG-CG 4.28Å; W245-M492 HydrophobicContact CH2-CG 4.33Å; W245-M492 HydrophobicContact CZ2-CG 4Å; W245-M492 HydrophobicContact CZ3-CG 4.44Å; V464-M492 HydrophobicContact CG1-CE 3.6Å; V464-M492 HydrophobicContact CG1-CG 4.06Å; V464-M492 HydrophobicContact CG1-SD 3.24Å; V464-M492 WeakPolarHBondContact CG1-SD 3.16Å; K474-M492 HydrophobicContact CB-CB 4.39Å; K474-M492 PolarHBondContact O-N 2.55Å; V476-M492 HydrophobicContact CG2-CG 4.11Å; M492-F494 VanDerWaalsContact C-N 3.28Å; M492-F494 VanDerWaalsContact CB-O 3.3Å; M492-F494 WeakPolarHBondContact CB-O 3.49Å; M492-R496 HydrophobicContact CE-CB 4.1Å; M492-R496 HydrophobicContact CE-CG 4.3Å; M492-R496 HydrophobicContact SD-CG 4.4Å
493	A	90.4	Very high	92.7	Very high	65 Å²	65	47 Å²	47	54%	0.537	26%	0.264	S	S	.	.	S	Bend	trans	-67.3	-35.3	172.5	0	0	0	0	0	110.9	E236	E236-A493 VanDerWaalsContact OE2-CB 3.27Å; E236-A493 WeakPolarHBondContact OE2-CB 3.03Å; E236-A493 PolarHBondContact OE2-N 3.28Å
494	F	89.4	Confident	92.8	Very high	105 Å²	105	38.3 Å²	38.3	46%	0.461	23%	0.232	S	C	.	.	S	Bend	trans	-120.7	140.3	179.3	-55.7	-78.1	0	0	0	111.6	E236 M492	E236-F494 PolarHBondContact OE1-N 3Å; M492-F494 VanDerWaalsContact C-N 3.28Å; M492-F494 VanDerWaalsContact CB-O 3.3Å; M492-F494 WeakPolarHBondContact CB-O 3.49Å
495	A	91.1	Very high	92.3	Very high	33 Å²	33	37.9 Å²	37.9	27%	0.273	23%	0.233	S	C	.	.			trans	-72.2	136.6	173.4	0	0	0	0	0	110.9	A472 L473 K474	A472-A495 HydrophobicContact CB-CB 3.94Å; A472-A495 VanDerWaalsContact O-CB 3.29Å; A472-A495 WeakPolarHBondContact O-CB 3.24Å; L473-A495 WeakPolarHBondContact O-CA 3.41Å; K474-A495 HydrophobicContact CB-CB 4.38Å
496	R	91.5	Very high	91.3	Very high	1 Å²	1	38.4 Å²	38.4	0%	0.004	23%	0.231	C	C	.	.			trans	-141	131.7	-175	-59.7	173.6	-175.8	-90.6	-3.5	111.8	G224 M226 S234 E236 G466 L473 M492 A499	G224-R496 WeakPolarHBondContact O-CD 3.49Å; G224-R496 PolarHBondContact O-NH1 3.33Å; M226-R496 WeakPolarHBondContact O-CA 3.4Å; S234-R496 PolarHBondContact O-NH1 2.84Å; S234-R496 PolarHBondContact O-NH2 3.02Å; S234-R496 PolarHBondContact OG-NH2 2.69Å; E236-R496 IonicContact OE1-CZ 3.72Å; E236-R496 VanDerWaalsContact OE1-CZ 3.25Å; E236-R496 IonicContact OE1-NE 3.28Å; E236-R496 PolarHBondContact OE1-NE 2.86Å; E236-R496 IonicContact OE1-NH2 3.97Å; E236-R496 PolarHBondContact OE1-NH2 2.92Å; G466-R496 PolarHBondContact N-O 3.23Å; L473-R496 PolarHBondContact O-N 3.48Å; M492-R496 HydrophobicContact CE-CB 4.1Å; M492-R496 HydrophobicContact CE-CG 4.3Å; M492-R496 HydrophobicContact SD-CG 4.4Å; R496-A499 HydrophobicContact CB-CB 3.92Å
497	A	90.4	Very high	89.6	Confident	12 Å²	12	39.3 Å²	39.3	10%	0.099	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-114	131.4	167.7	0	0	0	0	0	110.7	G225 M226 A472 A499	G225-A497 CarbonylContact C-O 3.58Å; G225-A497 WeakPolarHBondContact CA-O 3.49Å; M226-A497 HydrophobicContact CB-CB 4.43Å; M226-A497 PolarHBondContact N-O 3.03Å; M226-A497 PolarHBondContact O-N 3.36Å; A472-A497 HydrophobicContact CB-CB 4.21Å; A497-A499 VanDerWaalsContact C-N 3.3Å; A497-A499 PolarHBondContact O-N 2.94Å
498	G	88	Confident	87.5	Confident	24 Å²	24	38.7 Å²	38.7	25%	0.247	24%	0.237	C	C	.	.	S	Bend	trans	67.6	29.3	-178	0	0	0	0	0	113.6	A451	A451-G498 WeakPolarHBondContact O-CA 3.45Å; A451-G498 PolarHBondContact O-N 3.04Å
499	A	91.2	Very high	85	Confident	8 Å²	8	34 Å²	34	7%	0.066	22%	0.22	C	C	.	.			trans	-70.7	139.4	169.1	0	0	0	0	0	109.7	R496 A497	R496-A499 HydrophobicContact CB-CB 3.92Å; A497-A499 VanDerWaalsContact C-N 3.3Å; A497-A499 PolarHBondContact O-N 2.94Å
500	C	93.6	Very high	82.2	Confident	19 Å²	19	38.9 Å²	38.9	13%	0.128	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	127.9	169.7	-67.6	0	0	0	0	108.7	V223 F258 A260	V223-C500 HydrophobicContact CB-CB 4.37Å; V223-C500 PolarHBondContact N-O 2.71Å; V223-C500 PolarHBondContact O-N 3.15Å; F258-C500 HydrophobicContact CE2-CB 3.95Å; F258-C500 VanDerWaalsContact CE2-SG 3.56Å; F258-C500 PolarHBondContact O-SG 2.83Å; A260-C500 HydrophobicContact CB-CB 3.48Å; A260-C500 VanDerWaalsContact CB-CB 3.48Å
501	V	95.1	Very high	79.4	Confident	16 Å²	16	42.7 Å²	42.7	10%	0.097	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	125.7	179.8	179.8	0	0	0	0	108.5	L220 L221 G453 A455 V464	L220-V501 HydrophobicContact CD1-CG1 3.58Å; L220-V501 HydrophobicContact CD2-CG1 3.7Å; L220-V501 HydrophobicContact CG-CG1 3.56Å; L221-V501 VanDerWaalsContact O-CA 3.29Å; L221-V501 WeakPolarHBondContact O-CA 3.25Å; G453-V501 VanDerWaalsContact CA-CG2 3.46Å; A455-V501 HydrophobicContact CB-CB 4.47Å; A455-V501 HydrophobicContact CB-CG1 3.86Å; V464-V501 HydrophobicContact CB-CG2 3.81Å; V464-V501 HydrophobicContact CG1-CG2 4.3Å; V464-V501 HydrophobicContact CG2-CG1 4.04Å; V464-V501 HydrophobicContact CG2-CG2 4.04Å
502	V	94.6	Very high	76.7	Confident	12 Å²	12	42.9 Å²	42.9	7%	0.073	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	142.2	-177.8	-65	0	0	0	0	110.1	L221 V223 A260 V262 L267	L221-V502 HydrophobicContact CB-CG2 3.92Å; L221-V502 HydrophobicContact CD1-CG2 4.32Å; L221-V502 PolarHBondContact N-O 2.83Å; L221-V502 PolarHBondContact O-N 2.75Å; L221-V502 VanDerWaalsContact O-N 3.1Å; V223-V502 HydrophobicContact CG2-CG2 4.38Å; A260-V502 HydrophobicContact CB-CG1 4.15Å; V262-V502 HydrophobicContact CG2-CB 3.93Å; V262-V502 HydrophobicContact CG2-CG2 4.04Å; L267-V502 HydrophobicContact CD1-CG2 3.79Å
503	A	93.1	Very high	74	Confident	37 Å²	37	49.6 Å²	49.6	31%	0.306	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	135	171.2	0	0	0	0	0	109.7	R219 L220 L456 L457	R219-A503 WeakPolarHBondContact O-CA 3.48Å; L220-A503 HydrophobicContact CD1-CB 4.39Å; L456-A503 VanDerWaalsContact O-CB 3.29Å; L456-A503 WeakPolarHBondContact O-CB 3.3Å; L457-A503 HydrophobicContact CD1-CB 4.1Å
504	I	90.7	Very high	71.5	Confident	13 Å²	13	53.7 Å²	53.7	7%	0.067	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	151.4	172.8	58.4	161.7	0	0	0	110	G218 R219 L221 W248 V262 L287	G218-I504 CarbonylContact C-O 3.6Å; G218-I504 WeakPolarHBondContact CA-O 3.48Å; R219-I504 HydrophobicContact CB-CD1 4.46Å; R219-I504 HydrophobicContact CB-CG1 4.05Å; R219-I504 PolarHBondContact N-O 2.9Å; R219-I504 PolarHBondContact O-N 2.97Å; L221-I504 HydrophobicContact CD1-CD1 3.9Å; L221-I504 HydrophobicContact CD1-CG1 4.18Å; L221-I504 HydrophobicContact CD1-CG2 3.8Å; L221-I504 HydrophobicContact CD2-CD1 4.07Å; L221-I504 HydrophobicContact CD2-CG1 4.46Å; L221-I504 HydrophobicContact CG-CD1 4.04Å; L221-I504 HydrophobicContact CG-CG1 4.06Å; L221-I504 HydrophobicContact CG-CG2 4.34Å; W248-I504 HydrophobicContact CZ2-CD1 4.24Å; V262-I504 HydrophobicContact CG1-CG2 4.45Å; V262-I504 HydrophobicContact CG2-CG2 3.76Å; L287-I504 HydrophobicContact CD1-CB 4.12Å; L287-I504 HydrophobicContact CD1-CG2 3.77Å; L287-I504 HydrophobicContact CD2-CD1 4.48Å; L287-I504 HydrophobicContact CD2-CG2 4.33Å
505	P	81.1	Confident	68.8	Low	64 Å²	64	53.9 Å²	53.9	42%	0.416	34%	0.342	S	S	.	.			trans	-56.8	153.9	168.6	-18.9	30.6	0	0	0	110.7	V507	P505-V507 HydrophobicContact CB-CG2 4.24Å; P505-V507 PolarHBondContact O-N 3.35Å
506	N	72.6	Confident	66.3	Low	32 Å²	32	54.5 Å²	54.5	17%	0.171	34%	0.343	C	S	.	.			trans	-78.5	70.6	175.2	-168.3	29.3	0	0	0	109.3	S215 R219 I508	S215-N506 WeakPolarHBondContact O-CB 3.24Å; S215-N506 PolarHBondContact O-ND2 2.87Å; R219-N506 PolarHBondContact NE-OD1 3.01Å; R219-N506 PolarHBondContact NH2-OD1 3.03Å; N506-I508 VanDerWaalsContact C-N 3.34Å; N506-I508 PolarHBondContact O-N 2.66Å
507	V	59.7	Low	63.8	Low	57 Å²	57	59.4 Å²	59.4	35%	0.345	38%	0.375	S	S	.	.			trans	-74.3	95.6	168	-170.5	0	0	0	0	105.8	P505 P509	P505-V507 HydrophobicContact CB-CG2 4.24Å; P505-V507 PolarHBondContact O-N 3.35Å; V507-P509 WeakPolarHBondContact O-CD 3.46Å
508	I	51.9	Low	61.1	Low	57 Å²	57	63.2 Å²	63.2	29%	0.292	40%	0.401	S	S	.	.			trans	-70.4	112.7	171.4	-59.6	171.3	0	0	0	105.6	N506	N506-I508 VanDerWaalsContact C-N 3.34Å; N506-I508 PolarHBondContact O-N 2.66Å
509	P	42	Very low	59	Low	56 Å²	56	66.9 Å²	66.9	36%	0.364	43%	0.429	S	S	.	.			trans	-61.5	136.5	171.3	-15.2	30.3	0	0	0	107.2	V507 A511 A512	V507-P509 WeakPolarHBondContact O-CD 3.46Å; P509-A511 PolarHBondContact O-N 2.52Å; P509-A512 PolarHBondContact O-N 3.34Å
510	P	35.5	Very low	56.5	Low	121 Å²	121	71.5 Å²	71.5	79%	0.786	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-50.6	-26.6	-179	-27	32.1	0	0	0	113.8
511	A	35	Very low	53.7	Low	100 Å²	100	79.4 Å²	79.4	83%	0.826	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-81.3	-8.4	-178.9	0	0	0	0	0	115.7	P509	P509-A511 PolarHBondContact O-N 2.52Å
512	A	39	Very low	50.9	Low	63 Å²	63	89.1 Å²	89.1	52%	0.521	53%	0.529	S	S	.	.	G	3₁₀ helix	trans	-92.8	3.1	-177.5	0	0	0	0	0	114	P509 Q514	P509-A512 PolarHBondContact O-N 3.34Å; A512-Q514 PolarHBondContact O-N 3.11Å
513	Q	38.5	Very low	48.5	Very low	146 Å²	146	95.8 Å²	95.8	68%	0.682	56%	0.558	S	S	*	*			trans	-68.6	89.7	161.2	-67.5	-177.4	4.9	0	0	107	P515	Q513-P515 VanDerWaalsContact O-N 3.15Å
514	Q	37.7	Very low	45.7	Very low	152 Å²	152	103.8 Å²	103.8	71%	0.71	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-50.9	125.6	165.4	-76.3	-176.2	-24.7	0	0	106.6	A512	A512-Q514 PolarHBondContact O-N 3.11Å
515	P	33.5	Very low	43.6	Very low	109 Å²	109	108.1 Å²	108.1	71%	0.708	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-54.4	142.7	171.6	23.1	-30.7	0	0	0	107.2	Q513	Q513-P515 VanDerWaalsContact O-N 3.15Å
516	P	37.9	Very low	41.8	Very low	45 Å²	45	114 Å²	114	29%	0.292	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-49.7	142	169.8	23.5	-32.1	0	0	0	107.3	S518	P516-S518 PolarHBondContact O-N 3.17Å
517	P	37.9	Very low	40.6	Very low	104 Å²	104	115.1 Å²	115.1	68%	0.675	63%	0.629	S	S	*	*			trans	-49.3	112.3	176.9	19.5	-30.5	0	0	0	107.5	A519	P517-A519 PolarHBondContact O-N 2.74Å; P517-A519 VanDerWaalsContact O-N 3.12Å
518	S	35.6	Very low	40.4	Very low	92 Å²	92	115 Å²	115	64%	0.643	63%	0.628	S	S	*	*			trans	-59.1	123.9	-171.9	53.9	0	0	0	0	107.8	P516 T520	P516-S518 PolarHBondContact O-N 3.17Å; S518-T520 WeakPolarHBondContact CB-OG1 3.48Å; S518-T520 PolarHBondContact O-N 2.75Å; S518-T520 PolarHBondContact OG-OG1 3.2Å; S518-T520 VanDerWaalsContact OG-OG1 3.07Å
519	A	43.2	Very low	40.3	Very low	101 Å²	101	122.8 Å²	122.8	84%	0.835	65%	0.654	S	S	*	*			trans	-68.9	68.1	171.2	0	0	0	0	0	109.5	P517	P517-A519 PolarHBondContact O-N 2.74Å; P517-A519 VanDerWaalsContact O-N 3.12Å
520	T	38.6	Very low	40.9	Very low	105 Å²	105	122.1 Å²	122.1	64%	0.644	65%	0.647	S	S	*	*			trans	-134.7	78.8	-180	44.9	0	0	0	0	110.2	S518	S518-T520 WeakPolarHBondContact CB-OG1 3.48Å; S518-T520 PolarHBondContact O-N 2.75Å; S518-T520 PolarHBondContact OG-OG1 3.2Å; S518-T520 VanDerWaalsContact OG-OG1 3.07Å
521	K	33.9	Very low	41.5	Very low	185 Å²	185	122.4 Å²	122.4	80%	0.804	64%	0.642	S	S	*	*			trans	-173.8	126	131.5	-97	163.1	-171.5	-179.2	0	105.2	K523	K521-K523 PolarHBondContact O-N 3.48Å
522	K	38	Very low	42.2	Very low	220 Å²	220	120.4 Å²	120.4	96%	0.957	62%	0.621	S	S	*	*			trans	-56.6	91.6	164.6	-80.4	-175.1	175.7	-178	0	107	K524	K522-K524 PolarHBondContact O-N 3.42Å
523	K	42.9	Very low	42.9	Very low	153 Å²	153	122 Å²	122	67%	0.665	62%	0.619	S	S	*	*			trans	-72.4	113.1	178	-78.6	-179.6	178.3	176.9	0	105.7	K521 W525	K521-K523 PolarHBondContact O-N 3.48Å; K523-W525 PolarHBondContact O-N 3.01Å
524	K	35.3	Very low	43.2	Very low	204 Å²	204	118.8 Å²	118.8	89%	0.887	61%	0.612	S	S	*	*			trans	-64.3	104.9	164.6	-90.4	-174.9	173.9	-178.3	0	106.8	K522 K526	K522-K524 PolarHBondContact O-N 3.42Å; K524-K526 PolarHBondContact O-N 3.05Å
525	W	45.2	Very low	43.3	Very low	104 Å²	104	120.8 Å²	120.8	39%	0.394	62%	0.615	S	S	.	*	P	Polyproline II helix	trans	-67	126.7	177.8	-63.4	100.8	0	0	0	109	E40 F65 K523	E40-W525 PolarHBondContact OE1-NE1 3.35Å; F65-W525 HydrophobicContact CD2-CE3 4.26Å; F65-W525 HydrophobicContact CD2-CH2 4.3Å; F65-W525 HydrophobicContact CD2-CZ3 4.04Å; F65-W525 AromaticContact CE2-CD2 3.75Å; F65-W525 HydrophobicContact CE2-CD2 3.75Å; F65-W525 AromaticContact CE2-CE2 3.89Å; F65-W525 AromaticContact CE2-CE3 3.7Å; F65-W525 HydrophobicContact CE2-CE3 3.7Å; F65-W525 HydrophobicContact CE2-CG 4.38Å; F65-W525 AromaticContact CE2-CH2 3.97Å; F65-W525 HydrophobicContact CE2-CH2 3.97Å; F65-W525 HydrophobicContact CE2-CZ2 4.02Å; F65-W525 AromaticContact CE2-CZ3 3.81Å; F65-W525 HydrophobicContact CE2-CZ3 3.81Å; F65-W525 HydrophobicContact CZ-CD2 4.45Å; F65-W525 HydrophobicContact CZ-CZ2 4.45Å; K523-W525 PolarHBondContact O-N 3.01Å
526	K	44.5	Very low	43.6	Very low	188 Å²	188	124 Å²	124	82%	0.817	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-92.5	142.5	168.6	-70.7	-175.5	-178.6	179.6	0	107.8	K524	K524-K526 PolarHBondContact O-N 3.05Å
527	P	47.3	Very low	43.7	Very low	55 Å²	55	132.1 Å²	132.1	36%	0.357	65%	0.651	S	S	.	*	P	Polyproline II helix	trans	-61.3	146.8	179.7	24.8	-36.1	0	0	0	112.3	F35 E37	F35-P527 HydrophobicContact CD1-CB 4.08Å; F35-P527 HydrophobicContact CD2-CB 4.38Å; F35-P527 HydrophobicContact CE1-CB 3.23Å; F35-P527 HydrophobicContact CE1-CG 3.51Å; F35-P527 HydrophobicContact CE2-CB 3.58Å; F35-P527 HydrophobicContact CE2-CG 3.6Å; F35-P527 HydrophobicContact CZ-CB 3.05Å; F35-P527 HydrophobicContact CZ-CG 2.91Å; E37-P527 HydrophobicContact CB-CB 4.27Å; E37-P527 HydrophobicContact CG-CB 4.36Å
528	V	54.1	Low	43.5	Very low	55 Å²	55	138.3 Å²	138.3	33%	0.333	66%	0.661	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.6	123	-172.1	-178.3	0	0	0	0	108.9	I36 M38 L530	I36-V528 PolarHBondContact N-O 3.12Å; I36-V528 VanDerWaalsContact N-O 3.16Å; I36-V528 PolarHBondContact O-N 3.03Å; I36-V528 VanDerWaalsContact O-N 3.07Å; M38-V528 HydrophobicContact CE-CB 3.87Å; M38-V528 HydrophobicContact CE-CG1 4.4Å; M38-V528 HydrophobicContact CE-CG2 3.39Å; V528-L530 HydrophobicContact CG1-CD2 4.21Å; V528-L530 HydrophobicContact CG1-CG 4.19Å
529	R	50.9	Low	43.5	Very low	221 Å²	221	140.3 Å²	140.3	83%	0.834	67%	0.672	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-86.6	121.5	173.5	-168.3	177.8	-177.3	-180	0.7	108.7	F35	F35-R529 HydrophobicContact CD2-CB 4.29Å
530	L	54.6	Low	43	Very low	41 Å²	41	146.6 Å²	146.6	22%	0.215	67%	0.674	C	S	.	*			trans	-119	155.3	176.1	-67.5	171.6	0	0	0	108.1	Y30 G34 I36 A61 V528	Y30-L530 HydrophobicContact CE2-CB 3.7Å; Y30-L530 HydrophobicContact CE2-CD1 4.25Å; G34-L530 CarbonylContact C-O 3.23Å; G34-L530 WeakPolarHBondContact CA-O 3.45Å; G34-L530 CarbonylContact O-C 3.6Å; G34-L530 PolarHBondContact O-N 3.23Å; I36-L530 HydrophobicContact CG2-CD1 3.9Å; A61-L530 HydrophobicContact CB-CD1 3.93Å; V528-L530 HydrophobicContact CG1-CD2 4.21Å; V528-L530 HydrophobicContact CG1-CG 4.19Å
531	D	48.8	Very low	42.5	Very low	128 Å²	128	147.9 Å²	147.9	68%	0.684	69%	0.685	S	S	*	*			trans	-64.4	133.6	177.6	-69.2	-42	0	0	0	110.3	Y30	Y30-D531 PolarHBondContact OH-O 2.82Å
532	P	48.6	Very low	42.5	Very low	58 Å²	58	143.7 Å²	143.7	38%	0.377	68%	0.675	S	S	.	*			trans	-68.5	135.2	178.5	23.3	-29.1	0	0	0	110.7	C534	P532-C534 PolarHBondContact O-N 2.97Å
533	I	53.2	Low	42	Very low	95 Å²	95	141.4 Å²	141.4	49%	0.487	67%	0.668	S	S	.	*	S	Bend	trans	-66.5	-26.8	-179.6	-63.3	172.7	0	0	0	111.4	Y30 L55	Y30-I533 HydrophobicContact CE1-CD1 3.76Å; Y30-I533 HydrophobicContact CE1-CG1 4.22Å; L55-I533 HydrophobicContact CD2-CD1 3.62Å
534	C	45.4	Very low	41.4	Very low	80 Å²	80	143.3 Å²	143.3	54%	0.541	68%	0.676	S	S	.	*	S	Bend	trans	-114.6	78.8	-178.2	-67.9	0	0	0	0	110.8	P532	P532-C534 PolarHBondContact O-N 2.97Å
535	Y	40	Very low	40.9	Very low	193 Å²	193	138.4 Å²	138.4	76%	0.757	66%	0.663	S	S	*	*			trans	-170.5	110.5	146	-104.3	-71	0	0	0	111.8	R537	Y535-R537 PolarHBondContact O-N 2.83Å
536	N	40.7	Very low	40.1	Very low	177 Å²	177	141 Å²	141	95%	0.947	69%	0.685	S	S	*	*			trans	-67.4	76.6	163.1	-103.3	-18.7	0	0	0	110.4
537	R	39	Very low	39.5	Very low	216 Å²	216	141.4 Å²	141.4	82%	0.815	68%	0.683	S	S	*	*			trans	-134.3	103.4	163.5	-83.6	-168.6	175.5	-174.1	0.8	110.1	Y535	Y535-R537 PolarHBondContact O-N 2.83Å
538	R	33.9	Very low	38.6	Very low	234 Å²	234	149.5 Å²	149.5	88%	0.883	71%	0.708	S	S	*	*			trans	25.8	131.2	163	-67.6	-174.4	-179.6	-175.8	0.3	117.8	R540	R538-R540 PolarHBondContact O-N 3.46Å
539	P	35	Very low	37.3	Very low	134 Å²	134	154.8 Å²	154.8	87%	0.87	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-62.2	116.7	179.1	28.8	-32.8	0	0	0	109.6
540	R	32.7	Very low	36.3	Very low	233 Å²	233	156.7 Å²	156.7	88%	0.879	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-100.5	122.9	156.7	-78.8	-171.8	175.6	-176.1	-1	106.5	R538 V542	R538-R540 PolarHBondContact O-N 3.46Å; R540-V542 PolarHBondContact O-N 3.26Å
541	C	29.5	Very low	35.4	Very low	131 Å²	131	162.5 Å²	162.5	89%	0.885	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-48.6	131	175.5	-62.6	0	0	0	0	110.5
542	V	33.4	Very low	34.7	Very low	98 Å²	98	164.3 Å²	164.3	59%	0.594	79%	0.788	S	S	*	*			trans	-89.3	115.4	170.8	-179.6	0	0	0	0	107.7	R540	R540-V542 PolarHBondContact O-N 3.26Å
543	E	26.4	Very low	33.9	Very low	172 Å²	172	170.2 Å²	170.2	80%	0.804	81%	0.811	S	S	*	*			trans	-75.8	123.8	162.3	-74.9	-179.8	157	0	0	108.8	V545	E543-V545 PolarHBondContact O-N 3.31Å
544	F	31.6	Very low	32.8	Very low	192 Å²	192	174.6 Å²	174.6	84%	0.842	83%	0.83	S	S	*	*			trans	-76.6	114.3	162.7	-74.9	-93.9	0	0	0	107.9
545	V	25.1	Very low	32	Very low	102 Å²	102	180.5 Å²	180.5	62%	0.618	85%	0.848	S	S	*	*			trans	-100.9	90.7	165.7	-173	0	0	0	0	107.9	E543 Y547	E543-V545 PolarHBondContact O-N 3.31Å; V545-Y547 HydrophobicContact CG1-CD2 3.34Å; V545-Y547 HydrophobicContact CG1-CE2 3.4Å; V545-Y547 HydrophobicContact CG1-CG 4.39Å; V545-Y547 PolarHBondContact O-N 3.06Å
546	D	27	Very low	31.4	Very low	158 Å²	158	179.7 Å²	179.7	85%	0.845	85%	0.854	S	S	*	*			trans	-76.3	103.9	162.3	-114.1	-24.8	0	0	0	108
547	Y	33	Very low	30.8	Very low	196 Å²	196	179.9 Å²	179.9	77%	0.769	85%	0.847	S	S	*	*			trans	-100.4	91.1	159.9	-89.3	-74.1	0	0	0	107.6	V545	V545-Y547 HydrophobicContact CG1-CD2 3.34Å; V545-Y547 HydrophobicContact CG1-CE2 3.4Å; V545-Y547 HydrophobicContact CG1-CG 4.39Å; V545-Y547 PolarHBondContact O-N 3.06Å
548	Y	28.6	Very low	30.1	Very low	225 Å²	225	177.1 Å²	177.1	88%	0.882	85%	0.85	S	S	*	*			trans	-168.5	77.2	143.3	-89.3	-63.9	0	0	0	109.7
549	N	27	Very low	29.8	Very low	166 Å²	166	172.3 Å²	172.3	89%	0.888	85%	0.847	S	S	*	*			trans	-102.4	104.2	144.8	-104.9	-20.4	0	0	0	106.3
550	M	28.8	Very low	29.4	Very low	261 Å²	261	175.8 Å²	175.8	100%	1.286	85%	0.845	S	S	*	*			trans	-173.7	0	146.8	-100.6	-176.9	-156.7	0	0	108.8

Retrieved 550 of 550 residues in 171.3 ms (Link to these results)

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