A0A087Y992_POEFO Loading...

FAM20A golgi associated secretory pathway pseudokinase

AlphaFold DB , UniProt , Accession A0A087Y992, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 542 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	A	53.8	Low	59	Low	142 Å²	142	142.2 Å²	142.2	100%	1.174	72%	0.716	S	S	*	*				0	4.3	0	0	0	0	0	0	114.6
2	S	53.8	Low	60.2	Low	99 Å²	99	135.1 Å²	135.1	69%	0.692	70%	0.696	S	S	*	*			trans	-100.6	-14.3	-175	53.8	0	0	0	0	115.6
3	T	51.6	Low	61.4	Low	110 Å²	110	129.4 Å²	129.4	68%	0.675	68%	0.681	S	S	*	*	H	α-helix	trans	-88	-36.7	-178.1	38.2	0	0	0	0	113.5	R5 R6	T3-R5 PolarHBondContact O-N 3.36Å; T3-R6 PolarHBondContact O-N 3.3Å
4	M	51.1	Low	62.3	Low	152 Å²	152	125.3 Å²	125.3	75%	0.749	66%	0.664	S	S	*	*	H	α-helix	trans	-67.5	-17.6	178.7	-115.7	-171.5	-77.8	0	0	114.6
5	R	53.5	Low	63.3	Low	187 Å²	187	122.9 Å²	122.9	71%	0.706	65%	0.651	S	S	*	*	H	α-helix	trans	-82.1	-33.7	-178.7	-136.1	177.4	-169.6	178.6	3.1	111.6	T3 F9	T3-R5 PolarHBondContact O-N 3.36Å; R5-F9 HydrophobicContact CG-CE2 4.39Å; R5-F9 WeakPolarHBondContact O-CD2 3.28Å; R5-F9 PolarHBondContact O-N 2.9Å
6	R	55.9	Low	64.2	Low	198 Å²	198	118.4 Å²	118.4	75%	0.747	64%	0.637	S	S	*	*	H	α-helix	trans	-70.5	-38.4	-177.3	-111.3	176.6	172.5	168.2	-2.9	112.7	T3 R8 F9 L10	T3-R6 PolarHBondContact O-N 3.3Å; R6-R8 PolarHBondContact O-N 3.05Å; R6-F9 PolarHBondContact O-N 2.96Å; R6-L10 PolarHBondContact O-N 3.07Å; R6-L10 VanDerWaalsContact O-N 3.1Å
7	D	58.3	Low	65	Low	107 Å²	107	115.1 Å²	115.1	57%	0.572	63%	0.63	S	S	*	*	H	α-helix	trans	-68.6	-33.9	179.2	-69.9	-22.2	0	0	0	112.7	L10 L11	D7-L10 PolarHBondContact O-N 3.44Å; D7-L11 WeakPolarHBondContact O-CB 3.48Å; D7-L11 PolarHBondContact O-N 2.99Å
8	R	62.3	Low	65.7	Low	198 Å²	198	115 Å²	115	75%	0.747	63%	0.627	S	S	*	*	H	α-helix	trans	-68	-34.7	174.8	-74	-176.2	165.2	-175	-3.5	112.7	R6 A12	R6-R8 PolarHBondContact O-N 3.05Å; R8-A12 VanDerWaalsContact O-CB 3.28Å; R8-A12 WeakPolarHBondContact O-CB 3.47Å; R8-A12 PolarHBondContact O-N 3.1Å
9	F	66.2	Low	66.2	Low	149 Å²	149	116.8 Å²	116.8	65%	0.654	63%	0.629	S	S	*	*	H	α-helix	trans	-70.5	-37	174.3	-83.5	-71	0	0	0	112.2	R5 R6 A12 A13	R5-F9 HydrophobicContact CG-CE2 4.39Å; R5-F9 WeakPolarHBondContact O-CD2 3.28Å; R5-F9 PolarHBondContact O-N 2.9Å; R6-F9 PolarHBondContact O-N 2.96Å; F9-A12 PolarHBondContact O-N 3.37Å; F9-A13 VanDerWaalsContact O-CB 3.23Å; F9-A13 WeakPolarHBondContact O-CB 3.46Å; F9-A13 PolarHBondContact O-N 3.03Å
10	L	68.6	Low	66.7	Low	112 Å²	112	114.8 Å²	114.8	59%	0.586	62%	0.624	S	S	*	*	H	α-helix	trans	-67.3	-40.3	174.4	-106.3	141.6	0	0	0	112.3	R6 D7 A13 T14	R6-L10 PolarHBondContact O-N 3.07Å; R6-L10 VanDerWaalsContact O-N 3.1Å; D7-L10 PolarHBondContact O-N 3.44Å; L10-A13 PolarHBondContact O-N 3.27Å; L10-T14 WeakPolarHBondContact O-CB 3.43Å; L10-T14 WeakPolarHBondContact O-CG2 3.27Å; L10-T14 PolarHBondContact O-N 2.82Å; L10-T14 PolarHBondContact O-OG1 3.5Å
11	L	73.8	Confident	67.1	Low	110 Å²	110	111.1 Å²	111.1	58%	0.576	61%	0.609	S	S	*	*	H	α-helix	trans	-67.4	-40.7	175	-121.3	142.9	0	0	0	112	D7 T14 L15	D7-L11 WeakPolarHBondContact O-CB 3.48Å; D7-L11 PolarHBondContact O-N 2.99Å; L11-T14 WeakPolarHBondContact CA-OG1 3.41Å; L11-T14 PolarHBondContact O-OG1 3.14Å; L11-L15 HydrophobicContact CD2-CD1 3.98Å; L11-L15 WeakPolarHBondContact O-CB 3.31Å; L11-L15 WeakPolarHBondContact O-CG 3.05Å; L11-L15 PolarHBondContact O-N 3.49Å
12	A	74.1	Confident	68.1	Low	57 Å²	57	108.4 Å²	108.4	47%	0.471	58%	0.575	S	S	.	*	H	α-helix	trans	-66.6	-40.1	175	0	0	0	0	0	112	R8 F9 A16	R8-A12 VanDerWaalsContact O-CB 3.28Å; R8-A12 WeakPolarHBondContact O-CB 3.47Å; R8-A12 PolarHBondContact O-N 3.1Å; F9-A12 PolarHBondContact O-N 3.37Å; A12-A16 WeakPolarHBondContact O-CB 3.19Å; A12-A16 PolarHBondContact O-N 3.22Å
13	A	74.6	Confident	69.2	Low	61 Å²	61	108.7 Å²	108.7	50%	0.504	56%	0.564	S	S	.	*	H	α-helix	trans	-68	-39.3	177.8	0	0	0	0	0	112.4	F9 L10 A16 A17	F9-A13 VanDerWaalsContact O-CB 3.23Å; F9-A13 WeakPolarHBondContact O-CB 3.46Å; F9-A13 PolarHBondContact O-N 3.03Å; L10-A13 PolarHBondContact O-N 3.27Å; A13-A16 PolarHBondContact O-N 2.91Å; A13-A17 WeakPolarHBondContact O-CB 3.46Å; A13-A17 PolarHBondContact O-N 3.04Å
14	T	75.3	Confident	70.3	Confident	72 Å²	72	111 Å²	111	44%	0.442	56%	0.561	S	S	.	*	H	α-helix	trans	-70.5	-40.7	176.7	45.9	0	0	0	0	112.2	L10 L11 A17 L18	L10-T14 WeakPolarHBondContact O-CB 3.43Å; L10-T14 WeakPolarHBondContact O-CG2 3.27Å; L10-T14 PolarHBondContact O-N 2.82Å; L10-T14 PolarHBondContact O-OG1 3.5Å; L11-T14 WeakPolarHBondContact CA-OG1 3.41Å; L11-T14 PolarHBondContact O-OG1 3.14Å; T14-A17 PolarHBondContact O-N 2.66Å; T14-L18 WeakPolarHBondContact O-CB 3.32Å; T14-L18 WeakPolarHBondContact O-CG 3.31Å; T14-L18 PolarHBondContact O-N 3.24Å
15	L	76.4	Confident	71	Confident	89 Å²	89	111.3 Å²	111.3	47%	0.466	56%	0.559	S	S	.	*	H	α-helix	trans	-65	-39.7	172.5	-76.6	167.5	0	0	0	111.9	L11 L18 F19	L11-L15 HydrophobicContact CD2-CD1 3.98Å; L11-L15 WeakPolarHBondContact O-CB 3.31Å; L11-L15 WeakPolarHBondContact O-CG 3.05Å; L11-L15 PolarHBondContact O-N 3.49Å; L15-L18 PolarHBondContact O-N 3.18Å; L15-F19 WeakPolarHBondContact O-CB 3.37Å; L15-F19 PolarHBondContact O-N 3.31Å
16	A	77.9	Confident	71.8	Confident	52 Å²	52	106.3 Å²	106.3	43%	0.43	55%	0.545	S	S	.	.	H	α-helix	trans	-64.4	-39.9	174.7	0	0	0	0	0	111.7	A12 A13 S20	A12-A16 WeakPolarHBondContact O-CB 3.19Å; A12-A16 PolarHBondContact O-N 3.22Å; A13-A16 PolarHBondContact O-N 2.91Å; A16-S20 VanDerWaalsContact O-CB 3.27Å; A16-S20 WeakPolarHBondContact O-CB 3.26Å; A16-S20 PolarHBondContact O-N 3.23Å; A16-S20 PolarHBondContact O-OG 3.48Å
17	A	77.8	Confident	72.3	Confident	62 Å²	62	100.9 Å²	100.9	51%	0.512	53%	0.531	S	S	.	.	H	α-helix	trans	-65.7	-42.5	175.7	0	0	0	0	0	112.1	A13 T14 S20 A21	A13-A17 WeakPolarHBondContact O-CB 3.46Å; A13-A17 PolarHBondContact O-N 3.04Å; T14-A17 PolarHBondContact O-N 2.66Å; A17-S20 PolarHBondContact O-N 2.72Å; A17-A21 WeakPolarHBondContact O-CB 3.44Å; A17-A21 PolarHBondContact O-N 3.09Å
18	L	76.9	Confident	72.7	Confident	113 Å²	113	98 Å²	98	59%	0.592	52%	0.515	S	S	*	.	H	α-helix	trans	-64.9	-44.4	175.5	-77.5	167	0	0	0	111.9	T14 L15 S20 A21 D22	T14-L18 WeakPolarHBondContact O-CB 3.32Å; T14-L18 WeakPolarHBondContact O-CG 3.31Å; T14-L18 PolarHBondContact O-N 3.24Å; L15-L18 PolarHBondContact O-N 3.18Å; L18-S20 VanDerWaalsContact C-N 3.31Å; L18-S20 PolarHBondContact O-N 3.36Å; L18-A21 PolarHBondContact O-N 2.71Å; L18-D22 PolarHBondContact O-N 3.3Å
19	F	75.6	Confident	72.9	Confident	150 Å²	150	91.4 Å²	91.4	66%	0.658	50%	0.498	S	S	*	.	H	α-helix	trans	-64.4	-36.6	175.1	-101.9	-82.4	0	0	0	112.4	L15 F23	L15-F19 WeakPolarHBondContact O-CB 3.37Å; L15-F19 PolarHBondContact O-N 3.31Å; F19-F23 WeakPolarHBondContact O-CB 3.49Å; F19-F23 PolarHBondContact O-N 3.37Å
20	S	76.6	Confident	72.9	Confident	75 Å²	75	90.6 Å²	90.6	52%	0.524	49%	0.494	S	S	.	.	H	α-helix	trans	-67	-40.2	175.8	-57.4	0	0	0	0	111.1	A16 A17 L18 F23 Y24	A16-S20 VanDerWaalsContact O-CB 3.27Å; A16-S20 WeakPolarHBondContact O-CB 3.26Å; A16-S20 PolarHBondContact O-N 3.23Å; A16-S20 PolarHBondContact O-OG 3.48Å; A17-S20 PolarHBondContact O-N 2.72Å; L18-S20 VanDerWaalsContact C-N 3.31Å; L18-S20 PolarHBondContact O-N 3.36Å; S20-F23 PolarHBondContact O-N 3.33Å; S20-Y24 WeakPolarHBondContact O-CB 3.33Å; S20-Y24 PolarHBondContact O-N 3.44Å
21	A	75.7	Confident	72.6	Confident	38 Å²	38	89.8 Å²	89.8	31%	0.314	49%	0.49	S	S	.	.	H	α-helix	trans	-66.4	-46.6	175.3	0	0	0	0	0	111.8	A17 L18 F23 Y24 F25	A17-A21 WeakPolarHBondContact O-CB 3.44Å; A17-A21 PolarHBondContact O-N 3.09Å; L18-A21 PolarHBondContact O-N 2.71Å; A21-F23 VanDerWaalsContact C-N 3.29Å; A21-F23 PolarHBondContact O-N 3.16Å; A21-Y24 PolarHBondContact O-N 3.25Å; A21-F25 HydrophobicContact CB-CD2 4.29Å; A21-F25 WeakPolarHBondContact O-CB 3.3Å; A21-F25 VanDerWaalsContact O-CD2 3.28Å; A21-F25 WeakPolarHBondContact O-CD2 3.48Å; A21-F25 PolarHBondContact O-N 2.72Å
22	D	74.6	Confident	71.8	Confident	86 Å²	86	89.7 Å²	89.7	46%	0.46	49%	0.486	S	S	.	.	H	α-helix	trans	-63.2	-37.5	175	-92.5	-0.1	0	0	0	111.8	L18 I26 L27	L18-D22 PolarHBondContact O-N 3.3Å; D22-I26 WeakPolarHBondContact O-CA 3.19Å; D22-I26 VanDerWaalsContact O-CB 3.29Å; D22-I26 WeakPolarHBondContact O-CB 3.31Å; D22-I26 PolarHBondContact O-N 2.98Å; D22-I26 VanDerWaalsContact OD1-CD1 3.28Å; D22-I26 WeakPolarHBondContact OD1-CD1 3.35Å; D22-L27 PolarHBondContact O-N 2.72Å
23	F	77.4	Confident	70.7	Confident	105 Å²	105	89.8 Å²	89.8	46%	0.461	48%	0.483	S	S	.	.	I	π-helix	trans	-63.8	-46.5	174.9	-170.5	-98	0	0	0	111.2	F19 S20 A21 L27 L28	F19-F23 WeakPolarHBondContact O-CB 3.49Å; F19-F23 PolarHBondContact O-N 3.37Å; S20-F23 PolarHBondContact O-N 3.33Å; A21-F23 VanDerWaalsContact C-N 3.29Å; A21-F23 PolarHBondContact O-N 3.16Å; F23-L27 HydrophobicContact CD2-CB 4.14Å; F23-L27 HydrophobicContact CD2-CD1 4.05Å; F23-L27 PolarHBondContact O-N 3.04Å; F23-L28 HydrophobicContact CE1-CD1 4.16Å; F23-L28 WeakPolarHBondContact O-CB 3.47Å; F23-L28 PolarHBondContact O-N 2.84Å
24	Y	72.8	Confident	69.4	Low	157 Å²	157	96.2 Å²	96.2	62%	0.616	50%	0.495	S	S	*	.	I	π-helix	trans	-77.1	-37.7	-175.2	-143.3	-88.5	0	0	0	113.7	S20 A21 L28 P29	S20-Y24 WeakPolarHBondContact O-CB 3.33Å; S20-Y24 PolarHBondContact O-N 3.44Å; A21-Y24 PolarHBondContact O-N 3.25Å; Y24-L28 HydrophobicContact CD2-CD2 4.2Å; Y24-L28 HydrophobicContact CE2-CD2 4.17Å; Y24-L28 HydrophobicContact CG-CD2 4.43Å; Y24-P29 WeakPolarHBondContact O-CD 3.46Å
25	F	67.3	Low	67.8	Low	160 Å²	160	102.8 Å²	102.8	70%	0.702	51%	0.511	S	S	*	.	I	π-helix	trans	-96.6	-22.3	-174.8	-68.3	-72.2	0	0	0	114.1	A21	A21-F25 HydrophobicContact CB-CD2 4.29Å; A21-F25 WeakPolarHBondContact O-CB 3.3Å; A21-F25 VanDerWaalsContact O-CD2 3.28Å; A21-F25 WeakPolarHBondContact O-CD2 3.48Å; A21-F25 PolarHBondContact O-N 2.72Å
26	I	69.3	Low	66.3	Low	81 Å²	81	105.2 Å²	105.2	42%	0.415	52%	0.52	S	S	.	.	I	π-helix	trans	-117.3	-49.6	-176.1	-52.4	-175.8	0	0	0	112	D22 K30	D22-I26 WeakPolarHBondContact O-CA 3.19Å; D22-I26 VanDerWaalsContact O-CB 3.29Å; D22-I26 WeakPolarHBondContact O-CB 3.31Å; D22-I26 PolarHBondContact O-N 2.98Å; D22-I26 VanDerWaalsContact OD1-CD1 3.28Å; D22-I26 WeakPolarHBondContact OD1-CD1 3.35Å; I26-K30 WeakPolarHBondContact O-CD 3.3Å; I26-K30 VanDerWaalsContact O-CG 3.29Å; I26-K30 WeakPolarHBondContact O-CG 3.47Å
27	L	67.9	Low	64.5	Low	85 Å²	85	113.1 Å²	113.1	45%	0.445	54%	0.539	S	S	.	.	I	π-helix	trans	-83.1	-41.6	-173.5	-67.7	165.2	0	0	0	113.2	D22 F23 K30 L31	D22-L27 PolarHBondContact O-N 2.72Å; F23-L27 HydrophobicContact CD2-CB 4.14Å; F23-L27 HydrophobicContact CD2-CD1 4.05Å; F23-L27 PolarHBondContact O-N 3.04Å; L27-K30 PolarHBondContact O-N 3.19Å; L27-L31 WeakPolarHBondContact O-CB 3.24Å; L27-L31 PolarHBondContact O-N 3.31Å
28	L	65.1	Low	62.6	Low	47 Å²	47	114.4 Å²	114.4	25%	0.246	55%	0.549	C	S	.	.	H	α-helix	trans	-64	-43.1	-179.4	-165.9	73	0	0	0	112.2	F23 Y24 K30 L31 Q32	F23-L28 HydrophobicContact CE1-CD1 4.16Å; F23-L28 WeakPolarHBondContact O-CB 3.47Å; F23-L28 PolarHBondContact O-N 2.84Å; Y24-L28 HydrophobicContact CD2-CD2 4.2Å; Y24-L28 HydrophobicContact CE2-CD2 4.17Å; Y24-L28 HydrophobicContact CG-CD2 4.43Å; L28-K30 VanDerWaalsContact C-N 3.34Å; L28-K30 PolarHBondContact O-N 3.47Å; L28-L31 PolarHBondContact O-N 2.91Å; L28-Q32 WeakPolarHBondContact O-CB 3.17Å; L28-Q32 WeakPolarHBondContact O-CG 3.09Å; L28-Q32 PolarHBondContact O-N 3.02Å
29	P	66.2	Low	60.7	Low	58 Å²	58	112.3 Å²	112.3	38%	0.377	55%	0.549	S	S	.	.	H	α-helix	trans	-66.1	-35.3	174	-21.5	35.5	0	0	0	112.3	Y24 S33	Y24-P29 WeakPolarHBondContact O-CD 3.46Å; P29-S33 WeakPolarHBondContact O-CB 3.5Å; P29-S33 PolarHBondContact O-N 3.2Å
30	K	66.3	Low	59	Low	132 Å²	132	111.3 Å²	111.3	57%	0.574	55%	0.55	S	S	*	.	H	α-helix	trans	-67.9	-39.3	175.2	-78.4	-179.5	178.4	176	0	112.2	I26 L27 L28 S33 R34	I26-K30 WeakPolarHBondContact O-CD 3.3Å; I26-K30 VanDerWaalsContact O-CG 3.29Å; I26-K30 WeakPolarHBondContact O-CG 3.47Å; L27-K30 PolarHBondContact O-N 3.19Å; L28-K30 VanDerWaalsContact C-N 3.34Å; L28-K30 PolarHBondContact O-N 3.47Å; K30-S33 PolarHBondContact O-N 3.37Å; K30-S33 PolarHBondContact O-OG 3.13Å; K30-R34 PolarHBondContact O-N 3.23Å
31	L	63.7	Low	57	Low	95 Å²	95	112.8 Å²	112.8	50%	0.497	56%	0.56	S	S	.	*	H	α-helix	trans	-68.6	-40.5	175.1	-84.8	160.3	0	0	0	112.1	L27 L28 S33 R34 R35	L27-L31 WeakPolarHBondContact O-CB 3.24Å; L27-L31 PolarHBondContact O-N 3.31Å; L28-L31 PolarHBondContact O-N 2.91Å; L31-S33 VanDerWaalsContact C-N 3.35Å; L31-R34 PolarHBondContact O-N 2.71Å; L31-R35 PolarHBondContact O-N 2.97Å
32	Q	57	Low	54.8	Low	108 Å²	108	116.9 Å²	116.9	51%	0.505	59%	0.586	S	S	.	*	H	α-helix	trans	-63.7	-39.4	172	-74.2	173.3	-15.8	0	0	111.6	L28 R34 R35 H36	L28-Q32 WeakPolarHBondContact O-CB 3.17Å; L28-Q32 WeakPolarHBondContact O-CG 3.09Å; L28-Q32 PolarHBondContact O-N 3.02Å; Q32-R34 VanDerWaalsContact C-N 3.33Å; Q32-R34 PolarHBondContact O-N 3.34Å; Q32-R35 PolarHBondContact O-N 2.66Å; Q32-H36 PolarHBondContact O-CD2 3.35Å; Q32-H36 VanDerWaalsContact O-CD2 3.29Å; Q32-H36 PolarHBondContact O-N 3.16Å
33	S	49.4	Very low	52.5	Low	59 Å²	59	118 Å²	118	41%	0.413	60%	0.6	S	S	.	*	H	α-helix	trans	-64.3	-34.3	174.6	85.2	0	0	0	0	113.1	P29 K30 L31 R37	P29-S33 WeakPolarHBondContact O-CB 3.5Å; P29-S33 PolarHBondContact O-N 3.2Å; K30-S33 PolarHBondContact O-N 3.37Å; K30-S33 PolarHBondContact O-OG 3.13Å; L31-S33 VanDerWaalsContact C-N 3.35Å; S33-R37 WeakPolarHBondContact O-CG 3.48Å; S33-R37 PolarHBondContact O-N 3.44Å; S33-R37 VanDerWaalsContact O-N 3.17Å
34	R	48.9	Very low	50.2	Low	197 Å²	197	119.1 Å²	119.1	74%	0.743	62%	0.619	S	S	*	*	H	α-helix	trans	-72	-36.2	173.7	-88	-173.7	172.5	-175.7	-2	112.1	K30 L31 Q32 R37 A38	K30-R34 PolarHBondContact O-N 3.23Å; L31-R34 PolarHBondContact O-N 2.71Å; Q32-R34 VanDerWaalsContact C-N 3.33Å; Q32-R34 PolarHBondContact O-N 3.34Å; R34-R37 PolarHBondContact O-N 2.47Å; R34-A38 PolarHBondContact O-N 3.4Å
35	R	41.4	Very low	48	Very low	209 Å²	209	117 Å²	117	79%	0.789	63%	0.628	S	S	*	*	H	α-helix	trans	-69.5	-35.6	176.9	-157.2	176	-177.9	-178.3	-0.2	112.1	L31 Q32 A38	L31-R35 PolarHBondContact O-N 2.97Å; Q32-R35 PolarHBondContact O-N 2.66Å; R35-A38 PolarHBondContact O-N 2.94Å
36	H	43.7	Very low	46.7	Very low	140 Å²	140	114.6 Å²	114.6	65%	0.648	63%	0.628	S	S	*	*	H	α-helix	trans	-73.1	-26.2	172.8	-77.9	-60.6	0	0	0	114	Q32 A38	Q32-H36 PolarHBondContact O-CD2 3.35Å; Q32-H36 VanDerWaalsContact O-CD2 3.29Å; Q32-H36 PolarHBondContact O-N 3.16Å; H36-A38 VanDerWaalsContact C-N 3.34Å
37	R	42.1	Very low	44.8	Very low	218 Å²	218	118.4 Å²	118.4	82%	0.823	65%	0.649	S	S	*	*	H	α-helix	trans	-72.8	-22.8	172.1	-82.3	-177.5	177.3	-175.3	-0.1	114.1	S33 R34	S33-R37 WeakPolarHBondContact O-CG 3.48Å; S33-R37 PolarHBondContact O-N 3.44Å; S33-R37 VanDerWaalsContact O-N 3.17Å; R34-R37 PolarHBondContact O-N 2.47Å
38	A	37.6	Very low	43	Very low	89 Å²	89	119.5 Å²	119.5	74%	0.736	66%	0.664	S	S	*	*	H	α-helix	trans	-88.3	-16	179.7	0	0	0	0	0	113.9	R34 R35 H36	R34-A38 PolarHBondContact O-N 3.4Å; R35-A38 PolarHBondContact O-N 2.94Å; H36-A38 VanDerWaalsContact C-N 3.34Å
39	A	36.8	Very low	41.3	Very low	70 Å²	70	125.2 Å²	125.2	58%	0.579	70%	0.695	S	S	*	*	H	α-helix	trans	-101.7	-12.7	-173.5	0	0	0	0	0	115.1
40	N	40.3	Very low	39.6	Very low	128 Å²	128	130.1 Å²	130.1	68%	0.684	72%	0.717	S	S	*	*			trans	-120.5	69.9	-180	-72.3	-5.2	0	0	0	111.1	C42	N40-C42 PolarHBondContact O-N 3.46Å
41	S	32.9	Very low	37.6	Very low	106 Å²	106	129.1 Å²	129.1	74%	0.741	73%	0.727	S	S	*	*			trans	-73.5	107.8	147.7	57	0	0	0	0	107	S43	S41-S43 PolarHBondContact O-N 3.4Å
42	C	29.4	Very low	35.8	Very low	125 Å²	125	132.5 Å²	132.5	85%	0.845	75%	0.745	S	S	*	*			trans	-66.4	105.9	172.7	-72.4	0	0	0	0	109.5	N40	N40-C42 PolarHBondContact O-N 3.46Å
43	S	26.6	Very low	34.4	Very low	110 Å²	110	133.1 Å²	133.1	77%	0.769	76%	0.758	S	S	*	*			trans	-89.3	124.7	156.3	52.6	0	0	0	0	108.3	S41	S41-S43 PolarHBondContact O-N 3.4Å
44	C	28.7	Very low	33.2	Very low	127 Å²	127	141 Å²	141	86%	0.858	78%	0.778	S	S	*	*			trans	-94.8	105.5	166.5	-65.9	0	0	0	0	107.4
45	S	27.3	Very low	32.1	Very low	114 Å²	114	139.7 Å²	139.7	80%	0.797	79%	0.785	S	S	*	*			trans	-87.9	134.3	164.7	-116.7	0	0	0	0	109.1
46	P	40.4	Very low	31.3	Very low	109 Å²	109	137 Å²	137	71%	0.708	78%	0.782	S	S	*	*			trans	-86.1	117.7	170.2	32.4	-24.6	0	0	0	107.9
47	D	29.5	Very low	30.4	Very low	160 Å²	160	136.8 Å²	136.8	86%	0.856	79%	0.791	S	S	*	*			trans	176.7	106.6	151.3	-88.8	-24.9	0	0	0	110.1
48	S	30.8	Very low	29.6	Very low	109 Å²	109	134.1 Å²	134.1	76%	0.762	79%	0.792	S	S	*	*			trans	-153.7	100.3	148.6	50.2	0	0	0	0	109.7	L50	S48-L50 PolarHBondContact O-N 3.33Å
49	N	29.5	Very low	29	Very low	167 Å²	167	134.6 Å²	134.6	89%	0.893	80%	0.795	S	S	*	*			trans	-51.4	117.1	164.8	-76.6	-41.6	0	0	0	110.3
50	L	29.4	Very low	28.7	Very low	160 Å²	160	137.6 Å²	137.6	84%	0.838	81%	0.807	S	S	*	*			trans	-121.8	107.1	162.5	-92.4	156.8	0	0	0	108.3	S48	S48-L50 PolarHBondContact O-N 3.33Å
51	S	24.6	Very low	28	Very low	112 Å²	112	137.1 Å²	137.1	78%	0.783	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-60.1	125.6	177	43.2	0	0	0	0	112.5
52	L	25.8	Very low	27.6	Very low	166 Å²	166	140.6 Å²	140.6	87%	0.869	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-69.7	134.7	166.8	-84.3	148.9	0	0	0	111.5
53	P	26.9	Very low	27.5	Very low	121 Å²	121	142.8 Å²	142.8	79%	0.786	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-84.9	128.2	156.7	5.2	12.8	0	0	0	110.1
54	R	24.5	Very low	27.5	Very low	223 Å²	223	141.8 Å²	141.8	84%	0.842	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-83.3	124.6	172	-150.4	-179.8	-169.2	178	1.9	108.2
55	L	26.9	Very low	27.3	Very low	170 Å²	170	143.1 Å²	143.1	89%	0.89	81%	0.809	S	S	*	*			trans	-141.4	106.7	162.7	-154.7	78.1	0	0	0	109.7
56	E	24.2	Very low	27.3	Very low	154 Å²	154	148.1 Å²	148.1	72%	0.72	81%	0.81	S	S	*	*			trans	-79.3	134.6	162.5	-71.6	173	167.3	0	0	108.7
57	T	24.4	Very low	26.5	Very low	135 Å²	135	149.2 Å²	149.2	83%	0.828	82%	0.815	S	S	*	*				176	150.1	123.7	28.2	0	0	0	0	111.8
58	L	25.8	Very low	26.5	Very low	162 Å²	162	150.6 Å²	150.6	85%	0.848	82%	0.816	S	S	*	*			trans	-58.6	149.3	-167.7	-73.7	73.3	0	0	0	116.2
59	A	23.9	Very low	26.3	Very low	98 Å²	98	149.8 Å²	149.8	81%	0.81	82%	0.816	S	S	*	*				-166.5	108.3	125.2	0	0	0	0	0	111.5
60	T	30.1	Very low	26.3	Very low	134 Å²	134	147.9 Å²	147.9	82%	0.822	81%	0.813	S	S	*	*			trans	-74.6	142.4	160.1	40.2	0	0	0	0	110.7
61	P	26.3	Very low	26.4	Very low	118 Å²	118	148.2 Å²	148.2	77%	0.766	82%	0.815	S	S	*	*			trans	-125	118.4	146.3	30.4	-15.8	0	0	0	112.6
62	H	24	Very low	26.5	Very low	178 Å²	178	148.5 Å²	148.5	82%	0.824	82%	0.817	S	S	*	*			trans	36.5	100.7	136.8	-90.3	-85.3	0	0	0	119.7	S64	H62-S64 PolarHBondContact O-N 3.48Å
63	L	27	Very low	26.5	Very low	171 Å²	171	146.1 Å²	146.1	90%	0.895	81%	0.814	S	S	*	*			trans	-52.5	115.1	145.2	-78.2	149.3	0	0	0	109.6
64	S	26.9	Very low	26.6	Very low	89 Å²	89	144.5 Å²	144.5	62%	0.622	81%	0.811	S	S	*	*			trans	-100.4	108.9	162.7	36.5	0	0	0	0	108.6	H62 W66	H62-S64 PolarHBondContact O-N 3.48Å; S64-W66 PolarHBondContact O-N 2.86Å
65	N	25.6	Very low	27	Very low	155 Å²	155	139 Å²	139	83%	0.829	81%	0.813	S	S	*	*			trans	-60.7	115.8	166.4	-79.9	-22	0	0	0	108.9
66	W	26.1	Very low	27.1	Very low	219 Å²	219	136.8 Å²	136.8	83%	0.83	81%	0.807	S	S	*	*			trans	-110.2	110.8	166.6	-77.6	81	0	0	0	109.5	S64	S64-W66 PolarHBondContact O-N 2.86Å
67	T	25.3	Very low	27.5	Very low	132 Å²	132	134.4 Å²	134.4	81%	0.81	80%	0.803	S	S	*	*			trans	-54	127.1	172.2	30.5	0	0	0	0	111	A69	T67-A69 PolarHBondContact O-N 2.9Å
68	H	27.6	Very low	27.9	Very low	190 Å²	190	134.2 Å²	134.2	88%	0.88	80%	0.804	S	S	*	*			trans	-63.1	113.5	169.4	-76.3	-77.9	0	0	0	109.9
69	A	27	Very low	29	Very low	92 Å²	92	132 Å²	132	76%	0.76	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-82.8	125.8	161.8	0	0	0	0	0	108.8	T67	T67-A69 PolarHBondContact O-N 2.9Å
70	P	30.2	Very low	30	Very low	126 Å²	126	132.9 Å²	132.9	82%	0.818	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-73.4	130.2	178.3	17.8	-12.5	0	0	0	110.4	S72	P70-S72 PolarHBondContact O-N 3.03Å
71	L	30.4	Very low	30.9	Very low	167 Å²	167	131.7 Å²	131.7	87%	0.874	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-69.8	124.3	170.7	-138.8	84.6	0	0	0	108.4	S73	L71-S73 PolarHBondContact O-N 3Å
72	S	28.1	Very low	32.2	Very low	118 Å²	118	132.2 Å²	132.2	83%	0.825	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-48	126.9	-178.9	-61.1	0	0	0	0	113.3	P70 A74	P70-S72 PolarHBondContact O-N 3.03Å; S72-A74 PolarHBondContact O-N 3.18Å
73	S	26.2	Very low	34	Very low	116 Å²	116	127.4 Å²	127.4	81%	0.811	77%	0.767	S	S	*	*			trans	-64.7	103.8	169.5	52.7	0	0	0	0	110.4	L71 A75	L71-S73 PolarHBondContact O-N 3Å; S73-A75 PolarHBondContact O-N 2.97Å
74	A	29	Very low	36.4	Very low	87 Å²	87	121.3 Å²	121.3	72%	0.719	75%	0.746	S	S	*	*			trans	-70.4	123.8	153.1	0	0	0	0	0	107	S72 T76	S72-A74 PolarHBondContact O-N 3.18Å; A74-T76 PolarHBondContact O-N 3.09Å; A74-T76 VanDerWaalsContact O-N 3.14Å
75	A	31.6	Very low	39.3	Very low	107 Å²	107	118.7 Å²	118.7	88%	0.884	73%	0.728	S	S	*	*			trans	-53.4	117.2	-178.3	0	0	0	0	0	110.7	S73	S73-A75 PolarHBondContact O-N 2.97Å
76	T	30.6	Very low	42.4	Very low	124 Å²	124	113.4 Å²	113.4	76%	0.761	70%	0.697	S	S	*	*			trans	-112.4	114.7	166.1	-5.1	0	0	0	0	106	A74	A74-T76 PolarHBondContact O-N 3.09Å; A74-T76 VanDerWaalsContact O-N 3.14Å
77	T	31	Very low	45.5	Very low	104 Å²	104	104 Å²	104	64%	0.638	66%	0.663	S	S	*	*			trans	-44.1	143.7	167.8	38.5	0	0	0	0	110.9	E79	T77-E79 VanDerWaalsContact C-N 3.32Å; T77-E79 PolarHBondContact O-N 3.21Å
78	P	33.5	Very low	48.6	Very low	131 Å²	131	104.6 Å²	104.6	85%	0.851	66%	0.657	S	S	*	*			trans	-67.9	94.5	177.2	28.3	-31.1	0	0	0	108.4	V80	P78-V80 PolarHBondContact O-N 2.94Å
79	E	48.1	Very low	51.6	Low	116 Å²	116	98.3 Å²	98.3	54%	0.542	63%	0.625	S	S	.	*			trans	-81.8	104	-179.3	-84.4	-166.6	151.9	0	0	109.3	T77 R469	T77-E79 VanDerWaalsContact C-N 3.32Å; T77-E79 PolarHBondContact O-N 3.21Å; E79-R469 VanDerWaalsContact CB-CZ 3.49Å; E79-R469 IonicContact OE1-NH1 3.5Å; E79-R469 PolarHBondContact OE1-NH1 2.9Å; E79-R469 IonicContact OE2-CZ 3.3Å; E79-R469 IonicContact OE2-NE 3.83Å; E79-R469 IonicContact OE2-NH1 2.66Å; E79-R469 PolarHBondContact OE2-NH1 3.5Å
80	V	45.7	Very low	54.7	Low	116 Å²	116	93.9 Å²	93.9	70%	0.703	59%	0.589	S	S	*	*			trans	-38.9	130	179.7	-176.5	0	0	0	0	112.6	P78 D82 R469	P78-V80 PolarHBondContact O-N 2.94Å; V80-D82 PolarHBondContact O-N 3.16Å; V80-R469 PolarHBondContact O-NH2 3.48Å
81	D	49.4	Very low	57.6	Low	109 Å²	109	90.1 Å²	90.1	58%	0.583	56%	0.56	S	S	*	*			trans	-80.3	91.2	171.5	-164.7	20.4	0	0	0	108.4	G83 R89	D81-G83 PolarHBondContact O-N 3.41Å; D81-R89 IonicContact OD1-NH2 2.64Å
82	D	52.8	Low	60.4	Low	130 Å²	130	85.9 Å²	85.9	70%	0.695	54%	0.544	S	S	*	.			trans	-71.2	113.1	170.2	-166.4	20.5	0	0	0	107.1	V80 G84 R89	V80-D82 PolarHBondContact O-N 3.16Å; D82-G84 PolarHBondContact O-N 2.94Å; D82-R89 PolarHBondContact O-NH2 2.97Å
83	G	62.8	Low	63.5	Low	76 Å²	76	82.6 Å²	82.6	78%	0.784	52%	0.516	S	S	*	.			trans	-64.6	27.2	-164.7	0	0	0	0	0	117.2	D81	D81-G83 PolarHBondContact O-N 3.41Å
84	G	76.1	Confident	66.5	Low	43 Å²	43	81.6 Å²	81.6	44%	0.443	51%	0.506	S	S	.	.	S	Bend	trans	-80.6	171.1	175.2	0	0	0	0	0	114.3	D82 K86 R89	D82-G84 PolarHBondContact O-N 2.94Å; G84-K86 PolarHBondContact O-N 3.05Å; G84-R89 PolarHBondContact O-NH2 2.5Å
85	S	88.7	Confident	69.3	Low	34 Å²	34	78.9 Å²	78.9	24%	0.238	48%	0.48	C	S	.	.			trans	-53.2	126.2	174.5	167.3	0	0	0	0	111.9	L87 Q88 R89 E478	S85-L87 PolarHBondContact OG-N 3.45Å; S85-Q88 VanDerWaalsContact OG-CB 3.31Å; S85-Q88 WeakPolarHBondContact OG-CB 3.36Å; S85-Q88 PolarHBondContact OG-N 3.36Å; S85-R89 VanDerWaalsContact O-CG 3.28Å; S85-R89 WeakPolarHBondContact O-CG 3.36Å; S85-R89 PolarHBondContact O-N 2.94Å; S85-R89 PolarHBondContact O-NE 3.39Å; S85-E478 WeakPolarHBondContact CA-OE1 3.44Å; S85-E478 WeakPolarHBondContact CB-OE1 3.34Å; S85-E478 VanDerWaalsContact OG-CD 3.26Å; S85-E478 PolarHBondContact OG-OE1 2.66Å; S85-E478 PolarHBondContact OG-OE2 3.26Å
86	K	91.1	Very high	71.9	Confident	44 Å²	44	74 Å²	74	19%	0.191	44%	0.438	C	S	.	.	H	α-helix	trans	-74.9	-35.6	175.7	-76	177	174.7	170.5	0	110.4	G84 R89 L90 D474 V475 E478	G84-K86 PolarHBondContact O-N 3.05Å; K86-R89 PolarHBondContact O-N 2.8Å; K86-L90 PolarHBondContact O-N 3.02Å; K86-D474 HydrophobicContact CD-CB 3.71Å; K86-D474 IonicContact NZ-OD2 3.33Å; K86-D474 PolarHBondContact NZ-OD2 3.39Å; K86-V475 HydrophobicContact CB-CG1 4.09Å; K86-E478 PolarHBondContact N-OE2 3.5Å
87	L	90.6	Very high	74.5	Confident	23 Å²	23	71.7 Å²	71.7	12%	0.12	42%	0.421	C	S	.	.	H	α-helix	trans	-64.2	-45.4	177.3	-175.3	65.3	0	0	0	112.3	S85 R89 L90 F91 I271 V475 E478	S85-L87 PolarHBondContact OG-N 3.45Å; L87-R89 VanDerWaalsContact C-N 3.33Å; L87-R89 PolarHBondContact O-N 3.07Å; L87-L90 WeakPolarHBondContact O-CB 3.32Å; L87-L90 PolarHBondContact O-N 3.48Å; L87-F91 HydrophobicContact CD1-CD2 4.13Å; L87-F91 HydrophobicContact CD1-CE2 3.41Å; L87-F91 VanDerWaalsContact CD1-CE2 3.41Å; L87-F91 HydrophobicContact CD1-CZ 3.91Å; L87-F91 HydrophobicContact CD2-CE2 4.26Å; L87-F91 HydrophobicContact CG-CD2 4.05Å; L87-F91 HydrophobicContact CG-CE2 3.62Å; L87-F91 VanDerWaalsContact O-CD2 3.31Å; L87-F91 WeakPolarHBondContact O-CD2 3.23Å; L87-F91 PolarHBondContact O-N 3.42Å; L87-F91 VanDerWaalsContact O-N 3.09Å; L87-I271 HydrophobicContact CD1-CG1 4.31Å; L87-V475 HydrophobicContact CD1-CB 4.36Å; L87-E478 HydrophobicContact CB-CB 4.36Å; L87-E478 HydrophobicContact CB-CG 3.99Å; L87-E478 WeakPolarHBondContact CB-OE2 3.27Å; L87-E478 HydrophobicContact CD2-CG 4.38Å; L87-E478 PolarHBondContact N-OE2 3.37Å
88	Q	90.3	Very high	76.7	Confident	144 Å²	144	69.3 Å²	69.3	67%	0.673	40%	0.404	S	S	*	.	H	α-helix	trans	-63.4	-41.9	176.6	-171.4	178	4.7	0	0	111.1	S85 L90 F91 S92	S85-Q88 VanDerWaalsContact OG-CB 3.31Å; S85-Q88 WeakPolarHBondContact OG-CB 3.36Å; S85-Q88 PolarHBondContact OG-N 3.36Å; Q88-L90 VanDerWaalsContact C-N 3.32Å; Q88-L90 PolarHBondContact O-N 3.36Å; Q88-F91 PolarHBondContact O-N 2.6Å; Q88-S92 WeakPolarHBondContact O-CB 3.41Å; Q88-S92 PolarHBondContact O-N 2.88Å
89	R	91.1	Very high	78.4	Confident	57 Å²	57	71.7 Å²	71.7	22%	0.215	40%	0.404	C	S	.	.	H	α-helix	trans	-59.6	-42.2	173.9	-75.1	-177.2	-81.3	168.1	-11.1	111.6	D81 D82 G84 S85 K86 L87 S92 H93 F470	D81-R89 IonicContact OD1-NH2 2.64Å; D82-R89 PolarHBondContact O-NH2 2.97Å; G84-R89 PolarHBondContact O-NH2 2.5Å; S85-R89 VanDerWaalsContact O-CG 3.28Å; S85-R89 WeakPolarHBondContact O-CG 3.36Å; S85-R89 PolarHBondContact O-N 2.94Å; S85-R89 PolarHBondContact O-NE 3.39Å; K86-R89 PolarHBondContact O-N 2.8Å; L87-R89 VanDerWaalsContact C-N 3.33Å; L87-R89 PolarHBondContact O-N 3.07Å; R89-S92 WeakPolarHBondContact CA-OG 3.41Å; R89-S92 PolarHBondContact O-N 3.45Å; R89-S92 PolarHBondContact O-OG 3Å; R89-H93 PolarHBondContact O-N 3.35Å; R89-F470 HydrophobicContact CB-CE1 3.95Å
90	L	92	Very high	79.5	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-58.1	-50.9	176.4	-176.8	71.5	0	0	0	111.4	K86 L87 Q88 S92 H93 Y96 I271 L464 L465 F470 V475	K86-L90 PolarHBondContact O-N 3.02Å; L87-L90 WeakPolarHBondContact O-CB 3.32Å; L87-L90 PolarHBondContact O-N 3.48Å; Q88-L90 VanDerWaalsContact C-N 3.32Å; Q88-L90 PolarHBondContact O-N 3.36Å; L90-S92 VanDerWaalsContact C-N 3.27Å; L90-S92 PolarHBondContact O-N 3.26Å; L90-H93 WeakPolarHBondContact O-CB 3.35Å; L90-H93 PolarHBondContact O-N 3.44Å; L90-H93 VanDerWaalsContact O-N 3.09Å; L90-Y96 HydrophobicContact CD1-CD2 4.32Å; L90-Y96 HydrophobicContact CD1-CE2 3.46Å; L90-Y96 VanDerWaalsContact CD1-CE2 3.46Å; L90-Y96 HydrophobicContact CD2-CE1 4.35Å; L90-Y96 HydrophobicContact CD2-CE2 4.47Å; L90-Y96 HydrophobicContact CG-CD2 4.34Å; L90-Y96 HydrophobicContact CG-CE1 4.28Å; L90-Y96 HydrophobicContact CG-CE2 3.73Å; L90-Y96 VanDerWaalsContact O-CD2 3.26Å; L90-Y96 WeakPolarHBondContact O-CD2 3.16Å; L90-I271 HydrophobicContact CD2-CG2 3.93Å; L90-L464 HydrophobicContact CD1-CD2 3.8Å; L90-L465 HydrophobicContact CD1-CD2 3.87Å; L90-L465 HydrophobicContact CD2-CD2 3.93Å; L90-F470 HydrophobicContact CB-CD1 4.19Å; L90-F470 HydrophobicContact CD1-CB 4.25Å; L90-F470 HydrophobicContact CD1-CD1 4.02Å; L90-F470 HydrophobicContact CD1-CG 4.37Å; L90-V475 HydrophobicContact CD2-CB 4.42Å; L90-V475 HydrophobicContact CD2-CG1 4.32Å; L90-V475 HydrophobicContact CD2-CG2 4.4Å
91	F	90.4	Very high	80.9	Confident	47 Å²	47	67.5 Å²	67.5	21%	0.206	39%	0.388	C	S	.	.	H	α-helix	trans	-69.3	-25.2	-179	-67.9	-52.4	0	0	0	113.5	L87 Q88 H93 Y96 R172 R270	L87-F91 HydrophobicContact CD1-CD2 4.13Å; L87-F91 HydrophobicContact CD1-CE2 3.41Å; L87-F91 VanDerWaalsContact CD1-CE2 3.41Å; L87-F91 HydrophobicContact CD1-CZ 3.91Å; L87-F91 HydrophobicContact CD2-CE2 4.26Å; L87-F91 HydrophobicContact CG-CD2 4.05Å; L87-F91 HydrophobicContact CG-CE2 3.62Å; L87-F91 VanDerWaalsContact O-CD2 3.31Å; L87-F91 WeakPolarHBondContact O-CD2 3.23Å; L87-F91 PolarHBondContact O-N 3.42Å; L87-F91 VanDerWaalsContact O-N 3.09Å; Q88-F91 PolarHBondContact O-N 2.6Å; F91-H93 VanDerWaalsContact C-N 3.27Å; F91-H93 PolarHBondContact O-N 2.94Å; F91-Y96 HydrophobicContact CD1-CD1 4.01Å; F91-Y96 HydrophobicContact CD1-CE1 4.48Å; F91-Y96 HydrophobicContact CE1-CD1 4.33Å; F91-Y96 HydrophobicContact CE1-CE1 4.46Å; F91-R172 PolarHBondContact O-NH1 3.06Å; F91-R270 HydrophobicContact CZ-CG 4.35Å
92	S	90.3	Very high	82.2	Confident	78 Å²	78	71.2 Å²	71.2	55%	0.545	40%	0.402	S	S	.	.	H	α-helix	trans	-73.8	-16.5	172.5	75.9	0	0	0	0	113.7	Q88 R89 L90 N97	Q88-S92 WeakPolarHBondContact O-CB 3.41Å; Q88-S92 PolarHBondContact O-N 2.88Å; R89-S92 WeakPolarHBondContact CA-OG 3.41Å; R89-S92 PolarHBondContact O-N 3.45Å; R89-S92 PolarHBondContact O-OG 3Å; L90-S92 VanDerWaalsContact C-N 3.27Å; L90-S92 PolarHBondContact O-N 3.26Å; S92-N97 PolarHBondContact O-ND2 2.89Å; S92-N97 VanDerWaalsContact O-ND2 3.16Å
93	H	91.3	Very high	83.6	Confident	49 Å²	49	68 Å²	68	23%	0.227	38%	0.384	C	S	.	.	S	Bend	trans	-66.2	140.8	-176.4	-169.9	-88.7	0	0	0	111.7	R89 L90 F91 L95 Y96 N97 L464	R89-H93 PolarHBondContact O-N 3.35Å; L90-H93 WeakPolarHBondContact O-CB 3.35Å; L90-H93 PolarHBondContact O-N 3.44Å; L90-H93 VanDerWaalsContact O-N 3.09Å; F91-H93 VanDerWaalsContact C-N 3.27Å; F91-H93 PolarHBondContact O-N 2.94Å; H93-L95 WeakPolarHBondContact ND1-CB 3.32Å; H93-L95 PolarHBondContact ND1-N 2.92Å; H93-L95 PolarHBondContact O-N 3.37Å; H93-Y96 HydrophobicContact CB-CD2 4.32Å; H93-Y96 PolarHBondContact O-N 3.46Å; H93-N97 PolarHBondContact O-N 2.9Å; H93-L464 HydrophobicContact CB-CD2 4.33Å
94	P	89.8	Confident	84.6	Confident	95 Å²	95	70.9 Å²	70.9	62%	0.617	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-29.5	-177.1	-29	35.3	0	0	0	115.3	Y96 N97	P94-Y96 PolarHBondContact O-N 2.96Å; P94-N97 PolarHBondContact O-N 3.37Å
95	L	88.3	Confident	84.9	Confident	30 Å²	30	73.7 Å²	73.7	16%	0.157	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-22.8	176.5	-69.7	174.7	0	0	0	114.1	H93 I98 L460 L464	H93-L95 WeakPolarHBondContact ND1-CB 3.32Å; H93-L95 PolarHBondContact ND1-N 2.92Å; H93-L95 PolarHBondContact O-N 3.37Å; L95-I98 WeakPolarHBondContact O-CD1 3.49Å; L95-L460 HydrophobicContact CD1-CB 3.99Å; L95-L460 HydrophobicContact CD2-CB 4.06Å; L95-L460 HydrophobicContact CD2-CD1 4.01Å; L95-L464 HydrophobicContact CD1-CB 4.43Å; L95-L464 HydrophobicContact CD1-CD2 4.31Å
96	Y	87	Confident	84.7	Confident	4 Å²	4	79.6 Å²	79.6	2%	0.016	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-21.8	175.9	-72.8	-98.7	0	0	0	111.3	L90 F91 H93 P94 I98 R172 I271 D273 R461 L464	L90-Y96 HydrophobicContact CD1-CD2 4.32Å; L90-Y96 HydrophobicContact CD1-CE2 3.46Å; L90-Y96 VanDerWaalsContact CD1-CE2 3.46Å; L90-Y96 HydrophobicContact CD2-CE1 4.35Å; L90-Y96 HydrophobicContact CD2-CE2 4.47Å; L90-Y96 HydrophobicContact CG-CD2 4.34Å; L90-Y96 HydrophobicContact CG-CE1 4.28Å; L90-Y96 HydrophobicContact CG-CE2 3.73Å; L90-Y96 VanDerWaalsContact O-CD2 3.26Å; L90-Y96 WeakPolarHBondContact O-CD2 3.16Å; F91-Y96 HydrophobicContact CD1-CD1 4.01Å; F91-Y96 HydrophobicContact CD1-CE1 4.48Å; F91-Y96 HydrophobicContact CE1-CD1 4.33Å; F91-Y96 HydrophobicContact CE1-CE1 4.46Å; H93-Y96 HydrophobicContact CB-CD2 4.32Å; H93-Y96 PolarHBondContact O-N 3.46Å; P94-Y96 PolarHBondContact O-N 2.96Å; Y96-I98 VanDerWaalsContact C-N 3.28Å; Y96-I98 PolarHBondContact O-N 3.12Å; Y96-R172 VanDerWaalsContact CB-NH1 3.31Å; Y96-R172 VanDerWaalsContact O-CZ 3.24Å; Y96-R172 PolarHBondContact O-NH1 3.08Å; Y96-I271 WeakPolarHBondContact CE1-O 3.29Å; Y96-I271 PolarHBondContact OH-O 2.96Å; Y96-D273 HydrophobicContact CD1-CB 3.95Å; Y96-D273 HydrophobicContact CE1-CB 3.81Å; Y96-R461 HydrophobicContact CE2-CG 4.48Å; Y96-L464 HydrophobicContact CE2-CD2 3.93Å
97	N	83.7	Confident	84.5	Confident	76 Å²	76	78.5 Å²	78.5	41%	0.406	41%	0.405	S	S	.	.			trans	-87.2	17.2	179.3	-67.1	-32.8	0	0	0	113.9	S92 H93 P94 Q99 R172	S92-N97 PolarHBondContact O-ND2 2.89Å; S92-N97 VanDerWaalsContact O-ND2 3.16Å; H93-N97 PolarHBondContact O-N 2.9Å; P94-N97 PolarHBondContact O-N 3.37Å; N97-Q99 PolarHBondContact O-N 3.22Å; N97-R172 PolarHBondContact OD1-NH1 3.42Å; N97-R172 PolarHBondContact OD1-NH2 3Å
98	I	78.7	Confident	84.4	Confident	53 Å²	53	82.2 Å²	82.2	27%	0.272	42%	0.42	S	S	.	.			trans	-72.1	113.2	177.7	-57.9	172.1	0	0	0	108	L95 Y96 F525	L95-I98 WeakPolarHBondContact O-CD1 3.49Å; Y96-I98 VanDerWaalsContact C-N 3.28Å; Y96-I98 PolarHBondContact O-N 3.12Å; I98-F525 HydrophobicContact CD1-CD1 4.4Å; I98-F525 HydrophobicContact CD1-CD2 3.84Å; I98-F525 HydrophobicContact CD1-CE1 4.39Å; I98-F525 HydrophobicContact CD1-CE2 3.81Å; I98-F525 HydrophobicContact CD1-CG 4.14Å; I98-F525 HydrophobicContact CD1-CZ 4.09Å; I98-F525 HydrophobicContact CG2-CB 4.16Å; I98-F525 HydrophobicContact CG2-CD2 4.35Å; I98-F525 HydrophobicContact CG2-CG 4.41Å
99	Q	68.4	Low	84.4	Confident	182 Å²	182	75.7 Å²	75.7	85%	0.85	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-67.2	135.7	-179.9	-67	-169.2	-4.1	0	0	111	N97	N97-Q99 PolarHBondContact O-N 3.22Å
100	T	70.5	Confident	84.3	Confident	67 Å²	67	73.6 Å²	73.6	41%	0.411	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-69.7	152.6	165.7	50.6	0	0	0	0	109.7
101	P	76.1	Confident	84.2	Confident	77 Å²	77	78.4 Å²	78.4	50%	0.5	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-51.7	152.3	172.1	-23.7	33.3	0	0	0	112.1	L103	P101-L103 PolarHBondContact O-N 3.05Å; P101-L103 VanDerWaalsContact O-N 3.13Å
102	E	75.9	Confident	84	Confident	187 Å²	187	80.4 Å²	80.4	87%	0.874	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-56.8	119.6	174.8	-73.1	-170.6	167.2	0	0	110.5	K104	E102-K104 PolarHBondContact O-N 3.01Å
103	L	81.5	Confident	83.8	Confident	62 Å²	62	85.4 Å²	85.4	33%	0.325	43%	0.433	S	S	.	.			trans	-71	114.3	-172.7	-66.9	174.3	0	0	0	111.2	P101 E107 N165 Y167	P101-L103 PolarHBondContact O-N 3.05Å; P101-L103 VanDerWaalsContact O-N 3.13Å; L103-E107 WeakPolarHBondContact CA-OE2 3.25Å; L103-E107 HydrophobicContact CD2-CB 4.35Å; L103-N165 HydrophobicContact CD1-CB 4.14Å; L103-N165 HydrophobicContact CD2-CB 4.02Å; L103-Y167 HydrophobicContact CD2-CD2 3.95Å; L103-Y167 HydrophobicContact CD2-CE2 4.05Å
104	K	84.2	Confident	83.6	Confident	137 Å²	137	88.6 Å²	88.6	60%	0.596	45%	0.448	S	S	*	.			trans	-71.1	156.9	170	-65.2	-179.2	-177.9	178.5	0	110.7	E102 E106 E107	E102-K104 PolarHBondContact O-N 3.01Å; K104-E106 PolarHBondContact O-N 3.5Å; K104-E106 VanDerWaalsContact O-N 3.12Å; K104-E107 HydrophobicContact CB-CG 4.22Å; K104-E107 PolarHBondContact N-OE2 3.36Å; K104-E107 WeakPolarHBondContact O-CB 3.49Å; K104-E107 PolarHBondContact O-N 3.13Å
105	P	82.3	Confident	83.4	Confident	101 Å²	101	84.1 Å²	84.1	66%	0.656	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-55.7	-30.1	176.6	-26.5	35.1	0	0	0	114.2	E107	P105-E107 VanDerWaalsContact C-N 3.31Å
106	E	84.3	Confident	83.4	Confident	158 Å²	158	84 Å²	84	74%	0.738	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-70.6	-27.1	177.5	-63.6	174	-168.7	0	0	112.8	K104 K108	K104-E106 PolarHBondContact O-N 3.5Å; K104-E106 VanDerWaalsContact O-N 3.12Å; E106-K108 VanDerWaalsContact C-N 3.31Å
107	E	87.1	Confident	83.4	Confident	22 Å²	22	88.5 Å²	88.5	10%	0.103	44%	0.439	C	S	.	.	G	3₁₀ helix	trans	-85	-6.9	-177.9	-61.9	177	146.7	0	0	112.6	L103 K104 P105 N165 R166 Y167 F419	L103-E107 WeakPolarHBondContact CA-OE2 3.25Å; L103-E107 HydrophobicContact CD2-CB 4.35Å; K104-E107 HydrophobicContact CB-CG 4.22Å; K104-E107 PolarHBondContact N-OE2 3.36Å; K104-E107 WeakPolarHBondContact O-CB 3.49Å; K104-E107 PolarHBondContact O-N 3.13Å; P105-E107 VanDerWaalsContact C-N 3.31Å; E107-N165 CarbonylContact O-C 3.6Å; E107-N165 WeakPolarHBondContact O-CA 3.41Å; E107-N165 WeakPolarHBondContact O-CB 3.43Å; E107-R166 HydrophobicContact CB-CB 4.17Å; E107-R166 PolarHBondContact O-N 3.39Å; E107-R166 IonicContact OE1-NH1 3.19Å; E107-Y167 PolarHBondContact OE1-OH 3.3Å; E107-F419 WeakPolarHBondContact O-CE1 3.33Å
108	K	90	Very high	83.7	Confident	101 Å²	101	87 Å²	87	44%	0.439	43%	0.428	S	S	.	.	B	Isolated β-bridge	trans	-86.5	135.9	168.7	-63.9	-174.3	179.5	-177.4	0	109.6	E106 K418	E106-K108 VanDerWaalsContact C-N 3.31Å; K108-K418 PolarHBondContact O-NZ 3.31Å
109	L	89.9	Confident	84.1	Confident	6 Å²	6	85.5 Å²	85.5	3%	0.031	42%	0.419	C	S	.	.	S	Bend	trans	-64.7	-48.9	-178.8	-176.5	66.2	0	0	0	111.2	I164 P344 A349 F416 K418 F419	L109-I164 HydrophobicContact CB-CB 4.07Å; L109-I164 HydrophobicContact CB-CG2 3.96Å; L109-I164 WeakPolarHBondContact CB-O 3.36Å; L109-I164 HydrophobicContact CD2-CB 4.04Å; L109-I164 HydrophobicContact CD2-CD1 4.08Å; L109-I164 HydrophobicContact CD2-CG2 3.73Å; L109-I164 HydrophobicContact CG-CG2 4.45Å; L109-I164 PolarHBondContact N-O 2.95Å; L109-P344 HydrophobicContact CD2-CG 4.26Å; L109-A349 HydrophobicContact CD1-CB 4.27Å; L109-A349 HydrophobicContact CD2-CB 3.81Å; L109-A349 HydrophobicContact CG-CB 4.14Å; L109-F416 HydrophobicContact CD1-CB 3.73Å; L109-F416 HydrophobicContact CD1-CD1 3.72Å; L109-F416 HydrophobicContact CD1-CD2 4.2Å; L109-F416 HydrophobicContact CD1-CE1 4.38Å; L109-F416 HydrophobicContact CD1-CG 3.62Å; L109-F416 HydrophobicContact CD2-CD1 3.76Å; L109-F416 HydrophobicContact CD2-CD2 4.3Å; L109-F416 HydrophobicContact CD2-CE1 3.53Å; L109-F416 HydrophobicContact CD2-CE2 4.08Å; L109-F416 HydrophobicContact CD2-CG 4.14Å; L109-F416 HydrophobicContact CD2-CZ 3.7Å; L109-F416 HydrophobicContact CG-CD1 4.4Å; L109-K418 HydrophobicContact CD1-CB 4.22Å; L109-K418 HydrophobicContact CD1-CD 4.41Å; L109-K418 WeakPolarHBondContact O-CD 3.41Å; L109-K418 PolarHBondContact O-NZ 3.08Å; L109-F419 HydrophobicContact CB-CE2 4.26Å; L109-F419 HydrophobicContact CB-CZ 3.8Å; L109-F419 HydrophobicContact CD1-CE2 3.99Å; L109-F419 HydrophobicContact CD1-CZ 4.06Å
110	L	89.3	Confident	85	Confident	13 Å²	13	84.2 Å²	84.2	7%	0.068	41%	0.407	C	S	.	.	S	Bend	trans	-122.4	139.7	-172.3	-64.2	168.6	0	0	0	111.1	L115 H161 P344 V348 A349	L110-L115 HydrophobicContact CB-CD2 4.42Å; L110-L115 HydrophobicContact CD1-CD1 3.73Å; L110-L115 HydrophobicContact CD1-CD2 3.92Å; L110-L115 HydrophobicContact CD1-CG 4.36Å; L110-H161 HydrophobicContact CD1-CB 4.32Å; L110-P344 HydrophobicContact CD1-CB 3.75Å; L110-P344 HydrophobicContact CD1-CG 3.64Å; L110-V348 HydrophobicContact CD2-CB 4.08Å; L110-V348 HydrophobicContact CD2-CG2 4.3Å; L110-A349 HydrophobicContact CD2-CB 4.39Å
111	Q	88.2	Confident	85.9	Confident	102 Å²	102	89 Å²	89	48%	0.477	42%	0.417	S	S	.	.			trans	-86.9	139.3	168.7	-65.4	-174.8	2.5	0	0	109.9	K113 Q114 L115	Q111-K113 VanDerWaalsContact C-N 3.34Å; Q111-K113 PolarHBondContact O-N 3.33Å; Q111-Q114 HydrophobicContact CB-CG 4.37Å; Q111-Q114 PolarHBondContact O-N 3.4Å; Q111-L115 PolarHBondContact O-N 2.9Å; Q111-L115 VanDerWaalsContact O-N 3.08Å
112	V	87	Confident	86.4	Confident	89 Å²	89	89.6 Å²	89.6	54%	0.539	41%	0.412	S	S	.	.	H	α-helix	trans	-53	-49.5	-176.3	-178.1	0	0	0	0	111.8	Q114 L115 M116 L162	V112-Q114 PolarHBondContact O-N 3.18Å; V112-L115 PolarHBondContact O-N 3.08Å; V112-M116 HydrophobicContact CG1-CG 4.23Å; V112-M116 WeakPolarHBondContact O-CB 3.39Å; V112-M116 WeakPolarHBondContact O-CG 3.5Å; V112-M116 PolarHBondContact O-N 3.15Å; V112-L162 HydrophobicContact CB-CD2 4.39Å; V112-L162 HydrophobicContact CG2-CD1 4.36Å; V112-L162 HydrophobicContact CG2-CD2 4.02Å
113	K	87.2	Confident	86.9	Confident	182 Å²	182	81.3 Å²	81.3	79%	0.791	37%	0.374	S	S	*	.	H	α-helix	trans	-60.2	-48.1	-177.1	-66	-173.5	178.5	-179.4	0	112.4	Q111 L115 M116 E117	Q111-K113 VanDerWaalsContact C-N 3.34Å; Q111-K113 PolarHBondContact O-N 3.33Å; K113-L115 PolarHBondContact O-N 3.3Å; K113-M116 PolarHBondContact O-N 3.19Å; K113-E117 PolarHBondContact O-N 3.25Å
114	Q	86.1	Confident	87.2	Confident	116 Å²	116	81.1 Å²	81.1	54%	0.542	38%	0.378	S	S	.	.	H	α-helix	trans	-63.4	-42.8	-178.9	-67.9	177.1	-16.5	0	0	111.7	Q111 V112 E117 Y118	Q111-Q114 HydrophobicContact CB-CG 4.37Å; Q111-Q114 PolarHBondContact O-N 3.4Å; V112-Q114 PolarHBondContact O-N 3.18Å; Q114-E117 PolarHBondContact O-N 3.38Å; Q114-Y118 WeakPolarHBondContact O-CB 3.42Å; Q114-Y118 PolarHBondContact O-N 2.94Å
115	L	85.9	Confident	87.3	Confident	2 Å²	2	78.5 Å²	78.5	1%	0.01	37%	0.367	C	S	.	.	H	α-helix	trans	-66.4	-44	-179.4	-169.4	59.9	0	0	0	111.9	L110 Q111 V112 K113 E117 Y118 Y119 L158 H161 L162 V348	L110-L115 HydrophobicContact CB-CD2 4.42Å; L110-L115 HydrophobicContact CD1-CD1 3.73Å; L110-L115 HydrophobicContact CD1-CD2 3.92Å; L110-L115 HydrophobicContact CD1-CG 4.36Å; Q111-L115 PolarHBondContact O-N 2.9Å; Q111-L115 VanDerWaalsContact O-N 3.08Å; V112-L115 PolarHBondContact O-N 3.08Å; K113-L115 PolarHBondContact O-N 3.3Å; L115-E117 PolarHBondContact O-N 2.88Å; L115-Y118 PolarHBondContact O-N 3.36Å; L115-Y119 HydrophobicContact CD1-CD2 3.77Å; L115-Y119 HydrophobicContact CD1-CE2 3.34Å; L115-Y119 HydrophobicContact CD2-CE2 4.35Å; L115-Y119 HydrophobicContact CG-CD2 3.85Å; L115-Y119 HydrophobicContact CG-CE2 3.76Å; L115-Y119 WeakPolarHBondContact O-CD2 3.48Å; L115-Y119 PolarHBondContact O-N 3Å; L115-L158 HydrophobicContact CD2-CD1 3.53Å; L115-L158 HydrophobicContact CG-CD1 3.89Å; L115-H161 HydrophobicContact CD2-CB 3.94Å; L115-L162 HydrophobicContact CB-CD2 4.26Å; L115-L162 HydrophobicContact CD2-CD2 3.47Å; L115-L162 VanDerWaalsContact CD2-CD2 3.47Å; L115-L162 HydrophobicContact CD2-CG 3.77Å; L115-V348 HydrophobicContact CD1-CG2 4.37Å
116	M	87.4	Confident	87.3	Confident	27 Å²	27	75.9 Å²	75.9	13%	0.133	34%	0.344	C	S	.	.	H	α-helix	trans	-62.5	-42.7	178.2	-70.2	-59.8	-79.2	0	0	111.9	V112 K113 Y119 R120 Y151 P153 L158	V112-M116 HydrophobicContact CG1-CG 4.23Å; V112-M116 WeakPolarHBondContact O-CB 3.39Å; V112-M116 WeakPolarHBondContact O-CG 3.5Å; V112-M116 PolarHBondContact O-N 3.15Å; K113-M116 PolarHBondContact O-N 3.19Å; M116-Y119 PolarHBondContact O-N 3.34Å; M116-R120 WeakPolarHBondContact O-CB 3.46Å; M116-R120 VanDerWaalsContact O-CG 3.28Å; M116-R120 WeakPolarHBondContact O-CG 3.46Å; M116-R120 PolarHBondContact O-N 3.45Å; M116-Y151 HydrophobicContact CE-CE1 4.48Å; M116-Y151 PolarHBondContact SD-OH 3.36Å; M116-P153 HydrophobicContact CE-CB 3.55Å; M116-P153 HydrophobicContact CE-CG 4.07Å; M116-L158 HydrophobicContact SD-CD2 3.63Å
117	E	88.6	Confident	87.3	Confident	98 Å²	98	73.3 Å²	73.3	46%	0.458	33%	0.332	S	S	.	.	H	α-helix	trans	-64.6	-43	176.7	-170.2	179.3	174.4	0	0	111.9	K113 Q114 L115 Y119 R120 R121	K113-E117 PolarHBondContact O-N 3.25Å; Q114-E117 PolarHBondContact O-N 3.38Å; L115-E117 PolarHBondContact O-N 2.88Å; E117-Y119 PolarHBondContact O-N 3.18Å; E117-R120 PolarHBondContact O-N 2.88Å; E117-R121 WeakPolarHBondContact O-CG 3.11Å; E117-R121 PolarHBondContact O-N 3.17Å; E117-R121 IonicContact OE1-CZ 3.39Å; E117-R121 IonicContact OE1-NE 3.68Å; E117-R121 IonicContact OE1-NH2 2.76Å; E117-R121 PolarHBondContact OE1-NH2 3.39Å
118	Y	89	Confident	87.2	Confident	46 Å²	46	79.7 Å²	79.7	18%	0.18	36%	0.356	C	S	.	.	H	α-helix	trans	-58.8	-47.7	176.3	171.5	-102.4	0	0	0	112.2	Q114 L115 R121 K122 T347 V348	Q114-Y118 WeakPolarHBondContact O-CB 3.42Å; Q114-Y118 PolarHBondContact O-N 2.94Å; L115-Y118 PolarHBondContact O-N 3.36Å; Y118-R121 PolarHBondContact O-N 2.87Å; Y118-K122 HydrophobicContact CE1-CG 4.15Å; Y118-K122 HydrophobicContact CE2-CG 4.28Å; Y118-K122 VanDerWaalsContact CZ-CE 3.41Å; Y118-K122 WeakPolarHBondContact O-CG 3.45Å; Y118-K122 PolarHBondContact O-N 3.45Å; Y118-K122 WeakPolarHBondContact OH-CE 3.03Å; Y118-T347 WeakPolarHBondContact CE2-OG1 3.32Å; Y118-T347 VanDerWaalsContact CZ-OG1 3.3Å; Y118-T347 PolarHBondContact OH-OG1 3.13Å; Y118-V348 HydrophobicContact CD1-CG1 3.64Å; Y118-V348 HydrophobicContact CD1-CG2 4.38Å; Y118-V348 HydrophobicContact CD2-CG1 3.5Å; Y118-V348 VanDerWaalsContact CD2-CG1 3.5Å; Y118-V348 HydrophobicContact CE1-CG1 3.98Å; Y118-V348 HydrophobicContact CE1-CG2 4.24Å; Y118-V348 HydrophobicContact CE2-CG1 3.87Å; Y118-V348 HydrophobicContact CG-CG1 3.37Å
119	Y	87.7	Confident	86.7	Confident	21 Å²	21	82 Å²	82	8%	0.082	36%	0.362	C	S	.	.	H	α-helix	trans	-71.2	-36.1	179.9	-78.2	-63.5	0	0	0	113	L115 M116 E117 R121 K122 V123 Y151 W157 L158 H161 F229	L115-Y119 HydrophobicContact CD1-CD2 3.77Å; L115-Y119 HydrophobicContact CD1-CE2 3.34Å; L115-Y119 HydrophobicContact CD2-CE2 4.35Å; L115-Y119 HydrophobicContact CG-CD2 3.85Å; L115-Y119 HydrophobicContact CG-CE2 3.76Å; L115-Y119 WeakPolarHBondContact O-CD2 3.48Å; L115-Y119 PolarHBondContact O-N 3Å; M116-Y119 PolarHBondContact O-N 3.34Å; E117-Y119 PolarHBondContact O-N 3.18Å; Y119-R121 VanDerWaalsContact C-N 3.31Å; Y119-R121 PolarHBondContact O-N 3.19Å; Y119-K122 WeakPolarHBondContact O-CB 3.5Å; Y119-K122 PolarHBondContact O-N 2.7Å; Y119-K122 VanDerWaalsContact O-N 3.09Å; Y119-V123 VanDerWaalsContact O-CG2 3.26Å; Y119-V123 WeakPolarHBondContact O-CG2 3.42Å; Y119-V123 PolarHBondContact O-N 3.35Å; Y119-Y151 HydrophobicContact CG-CE2 4.47Å; Y119-W157 AromaticContact CD1-CH2 3.71Å; Y119-W157 HydrophobicContact CD1-CH2 3.71Å; Y119-W157 HydrophobicContact CD1-CZ3 4.3Å; Y119-W157 AromaticContact CD2-CH2 3.85Å; Y119-W157 HydrophobicContact CD2-CH2 3.85Å; Y119-W157 HydrophobicContact CD2-CZ3 4.08Å; Y119-W157 AromaticContact CE1-CH2 3.59Å; Y119-W157 HydrophobicContact CE1-CH2 3.59Å; Y119-W157 AromaticContact CE1-CZ3 3.75Å; Y119-W157 HydrophobicContact CE1-CZ3 3.75Å; Y119-W157 AromaticContact CE2-CH2 3.69Å; Y119-W157 HydrophobicContact CE2-CH2 3.69Å; Y119-W157 AromaticContact CE2-CZ3 3.46Å; Y119-W157 HydrophobicContact CE2-CZ3 3.46Å; Y119-W157 VanDerWaalsContact CE2-CZ3 3.46Å; Y119-W157 AromaticContact CG-CH2 3.86Å; Y119-W157 HydrophobicContact CG-CH2 3.86Å; Y119-W157 HydrophobicContact CG-CZ3 4.47Å; Y119-W157 AromaticContact CZ-CH2 3.6Å; Y119-W157 AromaticContact CZ-CZ3 3.3Å; Y119-W157 WeakPolarHBondContact OH-CZ3 3.5Å; Y119-L158 HydrophobicContact CD2-CD1 3.7Å; Y119-L158 HydrophobicContact CE2-CD1 3.76Å; Y119-H161 AromaticContact CZ-ND1 3.94Å; Y119-H161 PolarHBondContact OH-CE1 2.97Å; Y119-H161 PolarHBondContact OH-ND1 3.4Å; Y119-F229 HydrophobicContact CD1-CD1 4.39Å; Y119-F229 HydrophobicContact CD1-CE1 4.26Å
120	R	87.4	Confident	86.1	Confident	155 Å²	155	84.4 Å²	84.4	59%	0.585	37%	0.372	S	S	*	.	H	α-helix	trans	-54.6	-47.7	170.3	-77.9	175.4	-177.4	165.9	0.7	111.5	M116 E117 K122 V123 S124	M116-R120 WeakPolarHBondContact O-CB 3.46Å; M116-R120 VanDerWaalsContact O-CG 3.28Å; M116-R120 WeakPolarHBondContact O-CG 3.46Å; M116-R120 PolarHBondContact O-N 3.45Å; E117-R120 PolarHBondContact O-N 2.88Å; R120-K122 VanDerWaalsContact C-N 3.33Å; R120-K122 PolarHBondContact O-N 3.46Å; R120-V123 PolarHBondContact O-N 3.44Å; R120-S124 PolarHBondContact O-N 2.89Å; R120-S124 PolarHBondContact O-OG 3.14Å
121	R	88.8	Confident	85.7	Confident	166 Å²	166	89.9 Å²	89.9	63%	0.626	40%	0.395	S	S	*	.	H	α-helix	trans	-61	-39.7	176.1	-68.1	175.8	-174.9	-162.9	2.6	112.3	E117 Y118 Y119 H125	E117-R121 WeakPolarHBondContact O-CG 3.11Å; E117-R121 PolarHBondContact O-N 3.17Å; E117-R121 IonicContact OE1-CZ 3.39Å; E117-R121 IonicContact OE1-NE 3.68Å; E117-R121 IonicContact OE1-NH2 2.76Å; E117-R121 PolarHBondContact OE1-NH2 3.39Å; Y118-R121 PolarHBondContact O-N 2.87Å; Y119-R121 VanDerWaalsContact C-N 3.31Å; Y119-R121 PolarHBondContact O-N 3.19Å; R121-H125 WeakPolarHBondContact O-CB 3.42Å; R121-H125 PolarHBondContact O-N 3.26Å
122	K	86.7	Confident	85.2	Confident	90 Å²	90	90.3 Å²	90.3	39%	0.391	40%	0.4	S	S	.	.	H	α-helix	trans	-66.6	-39.2	176.7	-74.9	-69.4	-169.6	-175.4	0	112.6	Y118 Y119 R120 H125 W126 F229	Y118-K122 HydrophobicContact CE1-CG 4.15Å; Y118-K122 HydrophobicContact CE2-CG 4.28Å; Y118-K122 VanDerWaalsContact CZ-CE 3.41Å; Y118-K122 WeakPolarHBondContact O-CG 3.45Å; Y118-K122 PolarHBondContact O-N 3.45Å; Y118-K122 WeakPolarHBondContact OH-CE 3.03Å; Y119-K122 WeakPolarHBondContact O-CB 3.5Å; Y119-K122 PolarHBondContact O-N 2.7Å; Y119-K122 VanDerWaalsContact O-N 3.09Å; R120-K122 VanDerWaalsContact C-N 3.33Å; R120-K122 PolarHBondContact O-N 3.46Å; K122-H125 PolarHBondContact O-N 2.94Å; K122-W126 WeakPolarHBondContact O-CB 3.49Å; K122-W126 PolarHBondContact O-N 3.09Å; K122-F229 HydrophobicContact CB-CE1 4.07Å; K122-F229 HydrophobicContact CB-CZ 4.08Å
123	V	86.6	Confident	84.5	Confident	14 Å²	14	90 Å²	90	9%	0.085	39%	0.391	C	S	.	.	H	α-helix	trans	-63.7	-51.9	176.1	173.1	0	0	0	0	109.6	Y119 R120 H125 W126 E127 Y151 F229	Y119-V123 VanDerWaalsContact O-CG2 3.26Å; Y119-V123 WeakPolarHBondContact O-CG2 3.42Å; Y119-V123 PolarHBondContact O-N 3.35Å; R120-V123 PolarHBondContact O-N 3.44Å; V123-H125 VanDerWaalsContact C-N 3.27Å; V123-H125 PolarHBondContact O-N 3.47Å; V123-W126 CarbonylContact O-C 3.48Å; V123-W126 WeakPolarHBondContact O-CA 3.43Å; V123-W126 WeakPolarHBondContact O-CB 3.31Å; V123-W126 PolarHBondContact O-N 3.21Å; V123-E127 HydrophobicContact CG1-CG 4.41Å; V123-E127 WeakPolarHBondContact CG1-OE1 3.37Å; V123-E127 WeakPolarHBondContact O-CG 3.49Å; V123-E127 PolarHBondContact O-N 3.27Å; V123-Y151 HydrophobicContact CG2-CD1 4.45Å; V123-Y151 HydrophobicContact CG2-CD2 3.68Å; V123-Y151 HydrophobicContact CG2-CE2 4.39Å; V123-Y151 HydrophobicContact CG2-CG 3.7Å; V123-F229 HydrophobicContact CB-CE2 4.31Å; V123-F229 HydrophobicContact CB-CZ 4.48Å; V123-F229 HydrophobicContact CG2-CD1 4.3Å; V123-F229 HydrophobicContact CG2-CD2 3.86Å; V123-F229 HydrophobicContact CG2-CE1 4.1Å; V123-F229 HydrophobicContact CG2-CE2 3.67Å; V123-F229 HydrophobicContact CG2-CG 4.2Å; V123-F229 HydrophobicContact CG2-CZ 3.8Å
124	S	87.2	Confident	83.9	Confident	57 Å²	57	84.6 Å²	84.6	40%	0.399	37%	0.369	S	S	.	.	H	α-helix	trans	-61.7	-32.7	177.6	-52.1	0	0	0	0	113.4	R120 R128	R120-S124 PolarHBondContact O-N 2.89Å; R120-S124 PolarHBondContact O-OG 3.14Å; S124-R128 WeakPolarHBondContact O-CG 3.15Å; S124-R128 PolarHBondContact O-N 2.83Å; S124-R128 PolarHBondContact O-NE 3.43Å
125	H	86.4	Confident	83.6	Confident	82 Å²	82	83.2 Å²	83.2	38%	0.38	36%	0.363	S	S	.	.	H	α-helix	trans	-69.3	-38.3	171.9	-173.8	-50.4	0	0	0	111.9	R121 K122 V123 R129	R121-H125 WeakPolarHBondContact O-CB 3.42Å; R121-H125 PolarHBondContact O-N 3.26Å; K122-H125 PolarHBondContact O-N 2.94Å; V123-H125 VanDerWaalsContact C-N 3.27Å; V123-H125 PolarHBondContact O-N 3.47Å; H125-R129 PolarHBondContact CE1-NE 2.72Å; H125-R129 PolarHBondContact CE1-NH2 3.27Å; H125-R129 PolarHBondContact ND1-NE 2.8Å; H125-R129 VanDerWaalsContact ND1-NE 3.16Å; H125-R129 PolarHBondContact ND1-NH2 2.69Å; H125-R129 PolarHBondContact O-N 2.94Å
126	W	82.5	Confident	83.1	Confident	46 Å²	46	85.5 Å²	85.5	17%	0.174	38%	0.382	C	S	.	.	H	α-helix	trans	-68.4	-44.4	178.2	177.6	78.7	0	0	0	111.5	K122 V123 R128 R129 K130 M149 K225 F229	K122-W126 WeakPolarHBondContact O-CB 3.49Å; K122-W126 PolarHBondContact O-N 3.09Å; V123-W126 CarbonylContact O-C 3.48Å; V123-W126 WeakPolarHBondContact O-CA 3.43Å; V123-W126 WeakPolarHBondContact O-CB 3.31Å; V123-W126 PolarHBondContact O-N 3.21Å; W126-R128 VanDerWaalsContact C-N 3.33Å; W126-R128 PolarHBondContact O-N 2.88Å; W126-R129 PolarHBondContact O-N 2.81Å; W126-R129 VanDerWaalsContact O-N 3.1Å; W126-K130 HydrophobicContact CH2-CD 3.46Å; W126-K130 VanDerWaalsContact CH2-CD 3.46Å; W126-K130 HydrophobicContact CZ2-CD 3.87Å; W126-K130 HydrophobicContact CZ3-CD 3.97Å; W126-K130 PolarHBondContact O-N 3.26Å; W126-M149 HydrophobicContact CD2-SD 3.98Å; W126-M149 HydrophobicContact CE3-SD 4.04Å; W126-M149 HydrophobicContact CH2-CB 3.3Å; W126-M149 HydrophobicContact CH2-CG 4.03Å; W126-M149 HydrophobicContact CH2-SD 3.62Å; W126-M149 HydrophobicContact CZ2-CB 4.05Å; W126-M149 HydrophobicContact CZ2-CG 4.46Å; W126-M149 HydrophobicContact CZ2-SD 3.57Å; W126-M149 VanDerWaalsContact CZ2-SD 3.57Å; W126-M149 HydrophobicContact CZ3-CB 3.72Å; W126-M149 HydrophobicContact CZ3-CG 4.3Å; W126-M149 HydrophobicContact CZ3-SD 3.88Å; W126-K225 VanDerWaalsContact CG-NZ 3.3Å; W126-F229 HydrophobicContact CB-CE2 4.07Å; W126-F229 HydrophobicContact CB-CZ 4.35Å; W126-F229 HydrophobicContact CD2-CE2 4.48Å; W126-F229 HydrophobicContact CG-CE2 4.23Å
127	E	83.7	Confident	82.3	Confident	104 Å²	104	84.6 Å²	84.6	49%	0.486	38%	0.378	S	S	.	.	H	α-helix	trans	-56.3	-45.4	175.5	-70.8	168.2	171	0	0	111.8	V123 R129 K130 K131	V123-E127 HydrophobicContact CG1-CG 4.41Å; V123-E127 WeakPolarHBondContact CG1-OE1 3.37Å; V123-E127 WeakPolarHBondContact O-CG 3.49Å; V123-E127 PolarHBondContact O-N 3.27Å; E127-R129 PolarHBondContact O-N 2.96Å; E127-K130 PolarHBondContact O-N 2.95Å; E127-K131 PolarHBondContact O-N 3.24Å
128	R	85.3	Confident	81.7	Confident	157 Å²	157	84.8 Å²	84.8	59%	0.592	39%	0.386	S	S	*	.	H	α-helix	trans	-59.2	-44.1	174.6	-76.6	-176.5	-71.7	165.4	-4.1	112.8	S124 W126 K131 L132	S124-R128 WeakPolarHBondContact O-CG 3.15Å; S124-R128 PolarHBondContact O-N 2.83Å; S124-R128 PolarHBondContact O-NE 3.43Å; W126-R128 VanDerWaalsContact C-N 3.33Å; W126-R128 PolarHBondContact O-N 2.88Å; R128-K131 PolarHBondContact O-N 3.07Å; R128-L132 WeakPolarHBondContact O-CG 3.41Å; R128-L132 PolarHBondContact O-N 3.02Å
129	R	80.4	Confident	81	Confident	149 Å²	149	89.7 Å²	89.7	56%	0.562	42%	0.415	S	S	*	.	H	α-helix	trans	-66.7	-38.5	177.2	-85	-167.7	-74.2	-163.6	-12.6	112.3	H125 W126 E127 L132 F133	H125-R129 PolarHBondContact CE1-NE 2.72Å; H125-R129 PolarHBondContact CE1-NH2 3.27Å; H125-R129 PolarHBondContact ND1-NE 2.8Å; H125-R129 VanDerWaalsContact ND1-NE 3.16Å; H125-R129 PolarHBondContact ND1-NH2 2.69Å; H125-R129 PolarHBondContact O-N 2.94Å; W126-R129 PolarHBondContact O-N 2.81Å; W126-R129 VanDerWaalsContact O-N 3.1Å; E127-R129 PolarHBondContact O-N 2.96Å; R129-L132 PolarHBondContact O-N 3.31Å; R129-F133 WeakPolarHBondContact O-CB 3.44Å; R129-F133 PolarHBondContact O-N 3.28Å
130	K	76.6	Confident	80.1	Confident	56 Å²	56	92.8 Å²	92.8	24%	0.243	44%	0.436	C	S	.	.	H	α-helix	trans	-61.3	-48.1	176.7	-175.5	178.5	179.7	-158.5	0	110.4	W126 E127 L132 F133 E134 Q147	W126-K130 HydrophobicContact CH2-CD 3.46Å; W126-K130 VanDerWaalsContact CH2-CD 3.46Å; W126-K130 HydrophobicContact CZ2-CD 3.87Å; W126-K130 HydrophobicContact CZ3-CD 3.97Å; W126-K130 PolarHBondContact O-N 3.26Å; E127-K130 PolarHBondContact O-N 2.95Å; K130-L132 PolarHBondContact O-N 3.39Å; K130-F133 WeakPolarHBondContact O-CB 3.23Å; K130-F133 PolarHBondContact O-N 2.76Å; K130-F133 VanDerWaalsContact O-N 3.07Å; K130-E134 WeakPolarHBondContact CE-OE1 3.34Å; K130-E134 HydrophobicContact CG-CG 4.41Å; K130-E134 IonicContact NZ-OE1 3.88Å; K130-E134 WeakPolarHBondContact O-CG 3.35Å; K130-E134 PolarHBondContact O-N 3.45Å; K130-Q147 PolarHBondContact NZ-O 3.39Å
131	K	80.6	Confident	79.1	Confident	129 Å²	129	93 Å²	93	56%	0.561	45%	0.449	S	S	*	.	H	α-helix	trans	-56.7	-46.4	177.2	-171.7	179.2	179.5	-174.5	0	112.5	E127 R128 F133 E134 E135	E127-K131 PolarHBondContact O-N 3.24Å; R128-K131 PolarHBondContact O-N 3.07Å; K131-F133 VanDerWaalsContact C-N 3.3Å; K131-F133 PolarHBondContact O-N 2.57Å; K131-E134 PolarHBondContact O-N 3.12Å; K131-E135 WeakPolarHBondContact CE-OE1 3.38Å; K131-E135 WeakPolarHBondContact O-CB 3.38Å; K131-E135 VanDerWaalsContact O-CG 3.32Å; K131-E135 WeakPolarHBondContact O-CG 3.02Å; K131-E135 PolarHBondContact O-N 2.92Å
132	L	79.3	Confident	77.6	Confident	110 Å²	110	90 Å²	90	58%	0.576	44%	0.443	S	S	*	.	H	α-helix	trans	-62.3	-37.7	176.4	-69.6	170.3	0	0	0	112.5	R128 R129 K130 A136	R128-L132 WeakPolarHBondContact O-CG 3.41Å; R128-L132 PolarHBondContact O-N 3.02Å; R129-L132 PolarHBondContact O-N 3.31Å; K130-L132 PolarHBondContact O-N 3.39Å; L132-A136 WeakPolarHBondContact O-CB 3.49Å; L132-A136 PolarHBondContact O-N 3.32Å
133	F	72.1	Confident	76.1	Confident	82 Å²	82	91.8 Å²	91.8	36%	0.36	47%	0.467	S	S	.	.	H	α-helix	trans	-70.7	-39.2	177.8	-173.6	-101.8	0	0	0	111.9	R129 K130 K131 A136 A137 L144 H296	R129-F133 WeakPolarHBondContact O-CB 3.44Å; R129-F133 PolarHBondContact O-N 3.28Å; K130-F133 WeakPolarHBondContact O-CB 3.23Å; K130-F133 PolarHBondContact O-N 2.76Å; K130-F133 VanDerWaalsContact O-N 3.07Å; K131-F133 VanDerWaalsContact C-N 3.3Å; K131-F133 PolarHBondContact O-N 2.57Å; F133-A136 PolarHBondContact O-N 2.95Å; F133-A137 WeakPolarHBondContact O-CB 3.18Å; F133-A137 PolarHBondContact O-N 2.97Å; F133-L144 HydrophobicContact CD1-CD1 3.59Å; F133-L144 HydrophobicContact CD1-CD2 4.42Å; F133-L144 HydrophobicContact CE1-CD1 3.53Å; F133-L144 HydrophobicContact CE1-CD2 3.52Å; F133-L144 HydrophobicContact CE1-CG 4.18Å; F133-L144 HydrophobicContact CZ-CD2 4.17Å; F133-H296 AromaticContact CD1-ND1 3.98Å; F133-H296 AromaticContact CE1-CE1 3.82Å; F133-H296 AromaticContact CE1-ND1 3.4Å; F133-H296 WeakPolarHBondContact CE1-ND1 3.4Å; F133-H296 AromaticContact CZ-ND1 3.55Å
134	E	73.4	Confident	74.7	Confident	70 Å²	70	94.4 Å²	94.4	33%	0.327	48%	0.48	S	S	.	.	H	α-helix	trans	-62.9	-45.9	172.7	-72.4	171.2	162.2	0	0	111.1	K130 K131 A136 A137 T138 L144	K130-E134 WeakPolarHBondContact CE-OE1 3.34Å; K130-E134 HydrophobicContact CG-CG 4.41Å; K130-E134 IonicContact NZ-OE1 3.88Å; K130-E134 WeakPolarHBondContact O-CG 3.35Å; K130-E134 PolarHBondContact O-N 3.45Å; K131-E134 PolarHBondContact O-N 3.12Å; E134-A136 PolarHBondContact O-N 3.13Å; E134-A137 PolarHBondContact O-N 2.9Å; E134-T138 WeakPolarHBondContact O-CG2 3.3Å; E134-T138 PolarHBondContact O-N 3.48Å; E134-T138 PolarHBondContact O-OG1 2.84Å; E134-L144 HydrophobicContact CG-CD1 4.42Å
135	E	80.6	Confident	73.2	Confident	87 Å²	87	99.3 Å²	99.3	41%	0.407	50%	0.499	S	S	.	.	H	α-helix	trans	-57.6	-47	174	-73.5	169.1	-173.1	0	0	111.2	K131 A137 T138 L139	K131-E135 WeakPolarHBondContact CE-OE1 3.38Å; K131-E135 WeakPolarHBondContact O-CB 3.38Å; K131-E135 VanDerWaalsContact O-CG 3.32Å; K131-E135 WeakPolarHBondContact O-CG 3.02Å; K131-E135 PolarHBondContact O-N 2.92Å; E135-A137 PolarHBondContact O-N 3.31Å; E135-T138 PolarHBondContact O-N 3.37Å; E135-T138 PolarHBondContact O-OG1 3.44Å; E135-L139 WeakPolarHBondContact O-CG 3.34Å; E135-L139 PolarHBondContact O-N 3.19Å; E135-L139 VanDerWaalsContact O-N 3.13Å
136	A	75.1	Confident	71.7	Confident	50 Å²	50	103.8 Å²	103.8	41%	0.413	52%	0.52	S	S	.	.	H	α-helix	trans	-63.9	-37.1	176.7	0	0	0	0	0	113.4	L132 F133 E134 L139 T140	L132-A136 WeakPolarHBondContact O-CB 3.49Å; L132-A136 PolarHBondContact O-N 3.32Å; F133-A136 PolarHBondContact O-N 2.95Å; E134-A136 PolarHBondContact O-N 3.13Å; A136-L139 PolarHBondContact O-N 3.3Å; A136-T140 PolarHBondContact O-N 3.45Å; A136-T140 PolarHBondContact O-OG1 3Å
137	A	70.4	Confident	70.7	Confident	7 Å²	7	102.8 Å²	102.8	6%	0.058	52%	0.517	C	S	.	.	H	α-helix	trans	-71.5	-38.5	178.3	0	0	0	0	0	112.9	F133 E134 E135 L139 T140 N141 M142 L144	F133-A137 WeakPolarHBondContact O-CB 3.18Å; F133-A137 PolarHBondContact O-N 2.97Å; E134-A137 PolarHBondContact O-N 2.9Å; E135-A137 PolarHBondContact O-N 3.31Å; A137-L139 VanDerWaalsContact C-N 3.31Å; A137-L139 PolarHBondContact O-N 2.94Å; A137-T140 WeakPolarHBondContact CA-OG1 3.36Å; A137-T140 CarbonylContact O-C 3.56Å; A137-T140 PolarHBondContact O-N 3.04Å; A137-T140 VanDerWaalsContact O-N 3.12Å; A137-T140 PolarHBondContact O-OG1 2.98Å; A137-T140 VanDerWaalsContact O-OG1 3.13Å; A137-N141 PolarHBondContact O-N 2.93Å; A137-N141 VanDerWaalsContact O-N 3.1Å; A137-M142 HydrophobicContact CB-CB 4.35Å; A137-M142 PolarHBondContact O-N 2.94Å; A137-L144 HydrophobicContact CB-CD1 3.24Å; A137-L144 HydrophobicContact CB-CD2 4.42Å; A137-L144 HydrophobicContact CB-CG 3.62Å
138	T	75.3	Confident	69.8	Low	102 Å²	102	106.9 Å²	106.9	63%	0.626	53%	0.534	S	S	*	.	H	α-helix	trans	-63	-38.6	173.2	58.3	0	0	0	0	111.7	E134 E135 T140 N141	E134-T138 WeakPolarHBondContact O-CG2 3.3Å; E134-T138 PolarHBondContact O-N 3.48Å; E134-T138 PolarHBondContact O-OG1 2.84Å; E135-T138 PolarHBondContact O-N 3.37Å; E135-T138 PolarHBondContact O-OG1 3.44Å; T138-T140 PolarHBondContact O-N 3.34Å; T138-N141 PolarHBondContact O-N 3.37Å
139	L	74.8	Confident	69.3	Low	150 Å²	150	100.8 Å²	100.8	79%	0.785	51%	0.512	S	S	*	.	H	α-helix	trans	-65.2	-24	174	-72.9	167.3	0	0	0	113.5	E135 A136 A137	E135-L139 WeakPolarHBondContact O-CG 3.34Å; E135-L139 PolarHBondContact O-N 3.19Å; E135-L139 VanDerWaalsContact O-N 3.13Å; A136-L139 PolarHBondContact O-N 3.3Å; A137-L139 VanDerWaalsContact C-N 3.31Å; A137-L139 PolarHBondContact O-N 2.94Å
140	T	69.8	Low	69.2	Low	86 Å²	86	97.5 Å²	97.5	53%	0.528	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	8.4	-178.7	46.3	0	0	0	0	113.4	A136 A137 T138 M142	A136-T140 PolarHBondContact O-N 3.45Å; A136-T140 PolarHBondContact O-OG1 3Å; A137-T140 WeakPolarHBondContact CA-OG1 3.36Å; A137-T140 CarbonylContact O-C 3.56Å; A137-T140 PolarHBondContact O-N 3.04Å; A137-T140 VanDerWaalsContact O-N 3.12Å; A137-T140 PolarHBondContact O-OG1 2.98Å; A137-T140 VanDerWaalsContact O-OG1 3.13Å; T138-T140 PolarHBondContact O-N 3.34Å; T140-M142 PolarHBondContact O-N 2.87Å; T140-M142 VanDerWaalsContact O-N 3.16Å
141	N	64.8	Low	69.5	Low	160 Å²	160	96.9 Å²	96.9	86%	0.856	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	33	-174.6	-77.1	-18	0	0	0	113.5	A137 T138	A137-N141 PolarHBondContact O-N 2.93Å; A137-N141 VanDerWaalsContact O-N 3.1Å; T138-N141 PolarHBondContact O-N 3.37Å
142	M	59.1	Low	69.6	Low	101 Å²	101	94.2 Å²	94.2	50%	0.498	50%	0.5	S	S	.	.			trans	-90.5	120	177	-69.2	-176.3	63.1	0	0	110	A137 T140 L144	A137-M142 HydrophobicContact CB-CB 4.35Å; A137-M142 PolarHBondContact O-N 2.94Å; T140-M142 PolarHBondContact O-N 2.87Å; T140-M142 VanDerWaalsContact O-N 3.16Å; M142-L144 PolarHBondContact O-N 2.89Å
143	S	54.1	Low	69.8	Low	128 Å²	128	92 Å²	92	90%	0.895	49%	0.493	S	S	*	.			trans	-68.6	109.2	173.7	176.3	0	0	0	0	110.3
144	L	56.9	Low	70.5	Confident	69 Å²	69	92.9 Å²	92.9	36%	0.361	50%	0.501	S	S	.	.			trans	-94.2	133	172.3	-71	178.9	0	0	0	110.7	F133 E134 A137 M142 E146	F133-L144 HydrophobicContact CD1-CD1 3.59Å; F133-L144 HydrophobicContact CD1-CD2 4.42Å; F133-L144 HydrophobicContact CE1-CD1 3.53Å; F133-L144 HydrophobicContact CE1-CD2 3.52Å; F133-L144 HydrophobicContact CE1-CG 4.18Å; F133-L144 HydrophobicContact CZ-CD2 4.17Å; E134-L144 HydrophobicContact CG-CD1 4.42Å; A137-L144 HydrophobicContact CB-CD1 3.24Å; A137-L144 HydrophobicContact CB-CD2 4.42Å; A137-L144 HydrophobicContact CB-CG 3.62Å; M142-L144 PolarHBondContact O-N 2.89Å; L144-E146 PolarHBondContact O-N 3.45Å
145	M	55.7	Low	71.3	Confident	160 Å²	160	89.8 Å²	89.8	79%	0.788	49%	0.487	S	S	*	.			trans	-69.5	121.3	169.5	-150.3	179.6	179.9	0	0	108.4	Q147	M145-Q147 PolarHBondContact O-N 3.48Å
146	E	54.4	Low	71.9	Confident	176 Å²	176	86 Å²	86	82%	0.822	47%	0.47	S	S	*	.			trans	-64.2	97.8	177.3	-87.1	-168.5	159.1	0	0	110.5	L144 K148	L144-E146 PolarHBondContact O-N 3.45Å; E146-K148 PolarHBondContact O-N 3Å; E146-K148 VanDerWaalsContact O-N 3.16Å
147	Q	62.4	Low	72.7	Confident	26 Å²	26	84.1 Å²	84.1	12%	0.121	45%	0.453	C	S	.	.			trans	-82	100.5	172.7	-71.3	172.2	3.7	0	0	108.9	K130 M145 M149 V190 V294	K130-Q147 PolarHBondContact NZ-O 3.39Å; M145-Q147 PolarHBondContact O-N 3.48Å; Q147-M149 PolarHBondContact O-N 3.29Å; Q147-V190 HydrophobicContact CB-CB 4.19Å; Q147-V190 HydrophobicContact CB-CG1 4.36Å; Q147-V190 HydrophobicContact CG-CB 4.42Å; Q147-V190 VanDerWaalsContact OE1-C 3.27Å; Q147-V190 PolarHBondContact OE1-O 3.21Å; Q147-V294 VanDerWaalsContact NE2-CB 3.29Å
148	K	65.7	Low	73.8	Confident	190 Å²	190	83.9 Å²	83.9	83%	0.826	45%	0.45	S	S	*	.			trans	-73.8	111	172.7	-166.4	174.1	-176	176.3	0	108.6	E146	E146-K148 PolarHBondContact O-N 3Å; E146-K148 VanDerWaalsContact O-N 3.16Å
149	M	73.6	Confident	74.6	Confident	28 Å²	28	85 Å²	85	14%	0.138	44%	0.443	C	S	.	.			trans	-112.4	133.7	177.8	-164.1	179	-167.1	0	0	108.7	W126 Q147 V190 K225 M226 S227 F229	W126-M149 HydrophobicContact CD2-SD 3.98Å; W126-M149 HydrophobicContact CE3-SD 4.04Å; W126-M149 HydrophobicContact CH2-CB 3.3Å; W126-M149 HydrophobicContact CH2-CG 4.03Å; W126-M149 HydrophobicContact CH2-SD 3.62Å; W126-M149 HydrophobicContact CZ2-CB 4.05Å; W126-M149 HydrophobicContact CZ2-CG 4.46Å; W126-M149 HydrophobicContact CZ2-SD 3.57Å; W126-M149 VanDerWaalsContact CZ2-SD 3.57Å; W126-M149 HydrophobicContact CZ3-CB 3.72Å; W126-M149 HydrophobicContact CZ3-CG 4.3Å; W126-M149 HydrophobicContact CZ3-SD 3.88Å; Q147-M149 PolarHBondContact O-N 3.29Å; M149-V190 HydrophobicContact CE-CG2 4.1Å; M149-V190 HydrophobicContact CG-CG2 4.28Å; M149-V190 HydrophobicContact SD-CG2 4.24Å; M149-K225 HydrophobicContact CE-CD 4.15Å; M149-K225 HydrophobicContact CE-CG 4.03Å; M149-K225 WeakPolarHBondContact SD-CE 3.41Å; M149-K225 PolarHBondContact SD-NZ 3.04Å; M149-M226 WeakPolarHBondContact CE-O 3.32Å; M149-S227 VanDerWaalsContact CG-O 3.29Å; M149-S227 WeakPolarHBondContact CG-O 3.44Å; M149-F229 HydrophobicContact CE-CB 3.57Å; M149-F229 HydrophobicContact CE-CD2 3.26Å; M149-F229 HydrophobicContact CE-CE2 4.18Å; M149-F229 HydrophobicContact CE-CG 3.68Å; M149-F229 VanDerWaalsContact CE-N 3.26Å; M149-F229 HydrophobicContact SD-CD2 3.64Å; M149-F229 HydrophobicContact SD-CE2 4.16Å
150	S	78.5	Confident	75.5	Confident	81 Å²	81	78 Å²	78	57%	0.566	41%	0.406	S	S	*	.			trans	-126.5	133.4	179.1	-168.6	0	0	0	0	109.9	S227 N228	S150-S227 PolarHBondContact N-O 3.18Å; S150-N228 CarbonylContact O-C 3.45Å; S150-N228 WeakPolarHBondContact O-CA 3.31Å
151	Y	82.3	Confident	76.7	Confident	43 Å²	43	74.2 Å²	74.2	17%	0.169	38%	0.383	C	S	.	.			trans	-92.4	113.5	173	175.7	-103.9	0	0	0	108.9	M116 Y119 V123 P153 W157 F229	M116-Y151 HydrophobicContact CE-CE1 4.48Å; M116-Y151 PolarHBondContact SD-OH 3.36Å; Y119-Y151 HydrophobicContact CG-CE2 4.47Å; V123-Y151 HydrophobicContact CG2-CD1 4.45Å; V123-Y151 HydrophobicContact CG2-CD2 3.68Å; V123-Y151 HydrophobicContact CG2-CE2 4.39Å; V123-Y151 HydrophobicContact CG2-CG 3.7Å; Y151-P153 HydrophobicContact CE1-CG 4.19Å; Y151-P153 WeakPolarHBondContact O-CD 3.37Å; Y151-W157 HydrophobicContact CE2-CH2 4.41Å; Y151-W157 HydrophobicContact CE2-CZ2 4.18Å; Y151-F229 HydrophobicContact CD2-CB 4.19Å; Y151-F229 HydrophobicContact CD2-CG 4.45Å
152	D	83.7	Confident	77.9	Confident	73 Å²	73	68.7 Å²	68.7	39%	0.39	35%	0.353	S	S	.	.			trans	-101.3	115.7	173.8	-179.8	10.6	0	0	0	110.6	N154 A155	D152-N154 PolarHBondContact O-N 3.36Å; D152-N154 VanDerWaalsContact O-N 3.09Å; D152-N154 PolarHBondContact OD1-N 3.22Å; D152-A155 HydrophobicContact CB-CB 4.3Å; D152-A155 VanDerWaalsContact O-CB 3.29Å; D152-A155 WeakPolarHBondContact O-CB 3.5Å; D152-A155 PolarHBondContact O-N 2.94Å; D152-A155 VanDerWaalsContact O-N 3.08Å
153	P	83.3	Confident	79.5	Confident	64 Å²	64	65 Å²	65	42%	0.416	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-20.5	169.4	-31.6	39.8	0	0	0	115.9	M116 Y151 L158	M116-P153 HydrophobicContact CE-CB 3.55Å; M116-P153 HydrophobicContact CE-CG 4.07Å; Y151-P153 HydrophobicContact CE1-CG 4.19Å; Y151-P153 WeakPolarHBondContact O-CD 3.37Å; P153-L158 WeakPolarHBondContact O-CD2 3.32Å
154	N	86.4	Confident	81.4	Confident	99 Å²	99	58.9 Å²	58.9	53%	0.529	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	9.6	-179.2	-72.1	-47.1	0	0	0	113.5	D152 R159	D152-N154 PolarHBondContact O-N 3.36Å; D152-N154 VanDerWaalsContact O-N 3.09Å; D152-N154 PolarHBondContact OD1-N 3.22Å; N154-R159 PolarHBondContact O-NE 3.2Å
155	A	90.8	Very high	83	Confident	5 Å²	5	55.9 Å²	55.9	4%	0.041	28%	0.282	C	S	.	.			trans	-55.9	142.9	-178.3	0	0	0	0	0	112.7	D152 W157 L158 R159	D152-A155 HydrophobicContact CB-CB 4.3Å; D152-A155 VanDerWaalsContact O-CB 3.29Å; D152-A155 WeakPolarHBondContact O-CB 3.5Å; D152-A155 PolarHBondContact O-N 2.94Å; D152-A155 VanDerWaalsContact O-N 3.08Å; A155-W157 VanDerWaalsContact C-N 3.33Å; A155-W157 HydrophobicContact CB-CG 4.44Å; A155-W157 PolarHBondContact O-N 3.25Å; A155-L158 HydrophobicContact CB-CB 4.45Å; A155-L158 WeakPolarHBondContact O-CB 3.32Å; A155-L158 PolarHBondContact O-N 3.49Å; A155-R159 PolarHBondContact O-N 3.45Å
156	S	93.1	Very high	84.7	Confident	7 Å²	7	51.9 Å²	51.9	5%	0.049	26%	0.258	C	S	.	.	H	α-helix	trans	-54.4	-44.2	-179.2	57.6	0	0	0	0	113	L158 R159 F160 D183	S156-L158 VanDerWaalsContact C-N 3.28Å; S156-L158 PolarHBondContact O-N 2.99Å; S156-R159 PolarHBondContact O-N 2.83Å; S156-F160 PolarHBondContact O-N 2.92Å; S156-D183 VanDerWaalsContact CB-OD2 3.31Å; S156-D183 WeakPolarHBondContact CB-OD2 3.07Å; S156-D183 PolarHBondContact OG-OD2 3.32Å
157	W	92.6	Very high	86.3	Confident	12 Å²	12	47.5 Å²	47.5	5%	0.045	24%	0.235	C	C	.	.	H	α-helix	trans	-64.8	-31.3	178.9	69.3	-95.2	0	0	0	112.8	Y119 Y151 A155 F160 H161 L180 N228 F229 G230	Y119-W157 AromaticContact CD1-CH2 3.71Å; Y119-W157 HydrophobicContact CD1-CH2 3.71Å; Y119-W157 HydrophobicContact CD1-CZ3 4.3Å; Y119-W157 AromaticContact CD2-CH2 3.85Å; Y119-W157 HydrophobicContact CD2-CH2 3.85Å; Y119-W157 HydrophobicContact CD2-CZ3 4.08Å; Y119-W157 AromaticContact CE1-CH2 3.59Å; Y119-W157 HydrophobicContact CE1-CH2 3.59Å; Y119-W157 AromaticContact CE1-CZ3 3.75Å; Y119-W157 HydrophobicContact CE1-CZ3 3.75Å; Y119-W157 AromaticContact CE2-CH2 3.69Å; Y119-W157 HydrophobicContact CE2-CH2 3.69Å; Y119-W157 AromaticContact CE2-CZ3 3.46Å; Y119-W157 HydrophobicContact CE2-CZ3 3.46Å; Y119-W157 VanDerWaalsContact CE2-CZ3 3.46Å; Y119-W157 AromaticContact CG-CH2 3.86Å; Y119-W157 HydrophobicContact CG-CH2 3.86Å; Y119-W157 HydrophobicContact CG-CZ3 4.47Å; Y119-W157 AromaticContact CZ-CH2 3.6Å; Y119-W157 AromaticContact CZ-CZ3 3.3Å; Y119-W157 WeakPolarHBondContact OH-CZ3 3.5Å; Y151-W157 HydrophobicContact CE2-CH2 4.41Å; Y151-W157 HydrophobicContact CE2-CZ2 4.18Å; A155-W157 VanDerWaalsContact C-N 3.33Å; A155-W157 HydrophobicContact CB-CG 4.44Å; A155-W157 PolarHBondContact O-N 3.25Å; W157-F160 WeakPolarHBondContact O-CB 3.46Å; W157-H161 AromaticContact CE3-CE1 3.63Å; W157-H161 AromaticContact CE3-ND1 3.74Å; W157-H161 AromaticContact CZ3-CE1 3.83Å; W157-H161 AromaticContact CZ3-ND1 3.69Å; W157-H161 PolarHBondContact O-CD2 3.33Å; W157-H161 VanDerWaalsContact O-CD2 3.22Å; W157-H161 PolarHBondContact O-N 3.11Å; W157-L180 HydrophobicContact CB-CD1 3.77Å; W157-N228 PolarHBondContact NE1-O 3.15Å; W157-F229 HydrophobicContact CZ2-CB 4.2Å; W157-F229 HydrophobicContact CZ2-CD1 4.48Å; W157-G230 VanDerWaalsContact NE1-N 3.19Å
158	L	92.4	Very high	87.7	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-77.5	-38.9	178.9	-174	64.1	0	0	0	110.9	L115 M116 Y119 P153 A155 S156 F160 H161 L162	L115-L158 HydrophobicContact CD2-CD1 3.53Å; L115-L158 HydrophobicContact CG-CD1 3.89Å; M116-L158 HydrophobicContact SD-CD2 3.63Å; Y119-L158 HydrophobicContact CD2-CD1 3.7Å; Y119-L158 HydrophobicContact CE2-CD1 3.76Å; P153-L158 WeakPolarHBondContact O-CD2 3.32Å; A155-L158 HydrophobicContact CB-CB 4.45Å; A155-L158 WeakPolarHBondContact O-CB 3.32Å; A155-L158 PolarHBondContact O-N 3.49Å; S156-L158 VanDerWaalsContact C-N 3.28Å; S156-L158 PolarHBondContact O-N 2.99Å; L158-F160 VanDerWaalsContact C-N 3.31Å; L158-H161 PolarHBondContact O-N 3.43Å; L158-L162 WeakPolarHBondContact O-CG 3.43Å; L158-L162 PolarHBondContact O-N 3.03Å
159	R	92.4	Very high	89.1	Confident	127 Å²	127	37.3 Å²	37.3	48%	0.479	19%	0.191	S	C	.	.	H	α-helix	trans	-60.1	-42.9	169.8	-68.8	-175.6	178.3	-179	0.4	111.2	N154 A155 S156 H161 L162 G163 A176	N154-R159 PolarHBondContact O-NE 3.2Å; A155-R159 PolarHBondContact O-N 3.45Å; S156-R159 PolarHBondContact O-N 2.83Å; R159-H161 PolarHBondContact O-N 3.22Å; R159-L162 PolarHBondContact O-N 3.11Å; R159-G163 PolarHBondContact O-N 2.84Å; R159-A176 HydrophobicContact CB-CB 3.8Å
160	F	93.9	Very high	90	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.009	19%	0.185	C	C	.	.	H	α-helix	trans	-56.1	-49.2	171.8	166	-121.1	0	0	0	111.6	S156 W157 L158 L162 G163 I164 L169 I177 L180 P279 A341 L343	S156-F160 PolarHBondContact O-N 2.92Å; W157-F160 WeakPolarHBondContact O-CB 3.46Å; L158-F160 VanDerWaalsContact C-N 3.31Å; F160-L162 VanDerWaalsContact C-N 3.28Å; F160-L162 PolarHBondContact O-N 2.8Å; F160-G163 PolarHBondContact O-N 3.46Å; F160-G163 VanDerWaalsContact O-N 3.11Å; F160-I164 HydrophobicContact CE2-CG1 4.46Å; F160-I164 HydrophobicContact CZ-CD1 4.47Å; F160-I164 WeakPolarHBondContact O-CG1 3.49Å; F160-I164 PolarHBondContact O-N 3.49Å; F160-L169 HydrophobicContact CE2-CB 4.35Å; F160-L169 WeakPolarHBondContact CE2-O 3.42Å; F160-I177 HydrophobicContact CB-CD1 4.23Å; F160-I177 HydrophobicContact CD2-CD1 3.64Å; F160-I177 HydrophobicContact CE2-CD1 4.44Å; F160-I177 HydrophobicContact CG-CD1 4.26Å; F160-L180 HydrophobicContact CB-CD2 3.84Å; F160-L180 HydrophobicContact CD1-CD2 3.95Å; F160-L180 HydrophobicContact CG-CD2 3.94Å; F160-P279 HydrophobicContact CD2-CG 4.38Å; F160-P279 HydrophobicContact CE2-CG 4.17Å; F160-P279 HydrophobicContact CZ-CG 4.38Å; F160-A341 HydrophobicContact CE1-CB 4.3Å; F160-L343 HydrophobicContact CE1-CD2 4.33Å; F160-L343 HydrophobicContact CZ-CD2 4.05Å
161	H	94.1	Very high	90.4	Very high	6 Å²	6	35.4 Å²	35.4	3%	0.028	18%	0.177	C	C	.	.	H	α-helix	trans	-60.2	-36.3	178.1	-71.1	-173.2	0	0	0	113.2	L110 L115 Y119 W157 L158 R159 Y342 P344	L110-H161 HydrophobicContact CD1-CB 4.32Å; L115-H161 HydrophobicContact CD2-CB 3.94Å; Y119-H161 AromaticContact CZ-ND1 3.94Å; Y119-H161 PolarHBondContact OH-CE1 2.97Å; Y119-H161 PolarHBondContact OH-ND1 3.4Å; W157-H161 AromaticContact CE3-CE1 3.63Å; W157-H161 AromaticContact CE3-ND1 3.74Å; W157-H161 AromaticContact CZ3-CE1 3.83Å; W157-H161 AromaticContact CZ3-ND1 3.69Å; W157-H161 PolarHBondContact O-CD2 3.33Å; W157-H161 VanDerWaalsContact O-CD2 3.22Å; W157-H161 PolarHBondContact O-N 3.11Å; L158-H161 PolarHBondContact O-N 3.43Å; R159-H161 PolarHBondContact O-N 3.22Å; H161-Y342 PolarHBondContact NE2-O 3.49Å; H161-P344 HydrophobicContact CB-CG 4.02Å
162	L	91.6	Very high	90.5	Very high	45 Å²	45	36.4 Å²	36.4	24%	0.236	18%	0.18	C	C	.	.	H	α-helix	trans	-75.6	-26.2	177.1	-68.5	172.6	0	0	0	113.3	V112 L115 L158 R159 F160 I164	V112-L162 HydrophobicContact CB-CD2 4.39Å; V112-L162 HydrophobicContact CG2-CD1 4.36Å; V112-L162 HydrophobicContact CG2-CD2 4.02Å; L115-L162 HydrophobicContact CB-CD2 4.26Å; L115-L162 HydrophobicContact CD2-CD2 3.47Å; L115-L162 VanDerWaalsContact CD2-CD2 3.47Å; L115-L162 HydrophobicContact CD2-CG 3.77Å; L158-L162 WeakPolarHBondContact O-CG 3.43Å; L158-L162 PolarHBondContact O-N 3.03Å; R159-L162 PolarHBondContact O-N 3.11Å; F160-L162 VanDerWaalsContact C-N 3.28Å; F160-L162 PolarHBondContact O-N 2.8Å; L162-I164 VanDerWaalsContact C-N 3.32Å
163	G	91.1	Very high	90.4	Very high	23 Å²	23	38.7 Å²	38.7	24%	0.237	19%	0.192	C	C	.	.	H	α-helix	trans	-75.1	-16.9	178.6	0	0	0	0	0	114.4	R159 F160 N165	R159-G163 PolarHBondContact O-N 2.84Å; F160-G163 PolarHBondContact O-N 3.46Å; F160-G163 VanDerWaalsContact O-N 3.11Å; G163-N165 PolarHBondContact O-N 3.03Å; G163-N165 PolarHBondContact O-ND2 3.37Å
164	I	93.8	Very high	90.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.181	C	C	.	.			trans	-64.2	123.5	-179.1	-55.9	173.1	0	0	0	110.3	L109 F160 L162 L169 L343 P344 F416	L109-I164 HydrophobicContact CB-CB 4.07Å; L109-I164 HydrophobicContact CB-CG2 3.96Å; L109-I164 WeakPolarHBondContact CB-O 3.36Å; L109-I164 HydrophobicContact CD2-CB 4.04Å; L109-I164 HydrophobicContact CD2-CD1 4.08Å; L109-I164 HydrophobicContact CD2-CG2 3.73Å; L109-I164 HydrophobicContact CG-CG2 4.45Å; L109-I164 PolarHBondContact N-O 2.95Å; F160-I164 HydrophobicContact CE2-CG1 4.46Å; F160-I164 HydrophobicContact CZ-CD1 4.47Å; F160-I164 WeakPolarHBondContact O-CG1 3.49Å; F160-I164 PolarHBondContact O-N 3.49Å; L162-I164 VanDerWaalsContact C-N 3.32Å; I164-L169 HydrophobicContact CD1-CD2 4.17Å; I164-L169 HydrophobicContact CG1-CD2 4.21Å; I164-L169 WeakPolarHBondContact CG1-O 3.33Å; I164-L169 HydrophobicContact CG2-CD2 3.98Å; I164-L343 HydrophobicContact CD1-CD2 4.27Å; I164-P344 HydrophobicContact CD1-CG 3.86Å; I164-F416 HydrophobicContact CD1-CZ 4.35Å; I164-F416 HydrophobicContact CG2-CD2 4.41Å; I164-F416 HydrophobicContact CG2-CE2 3.73Å; I164-F416 HydrophobicContact CG2-CZ 4.19Å
165	N	91.8	Very high	90.5	Very high	6 Å²	6	37.1 Å²	37.1	3%	0.032	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-129.3	178.9	179.7	62.7	68.2	0	0	0	111.3	L103 E107 G163 Y167 A168 F419 L424	L103-N165 HydrophobicContact CD1-CB 4.14Å; L103-N165 HydrophobicContact CD2-CB 4.02Å; E107-N165 CarbonylContact O-C 3.6Å; E107-N165 WeakPolarHBondContact O-CA 3.41Å; E107-N165 WeakPolarHBondContact O-CB 3.43Å; G163-N165 PolarHBondContact O-N 3.03Å; G163-N165 PolarHBondContact O-ND2 3.37Å; N165-Y167 PolarHBondContact O-N 2.9Å; N165-Y167 PolarHBondContact OD1-N 3.02Å; N165-A168 PolarHBondContact N-O 2.55Å; N165-A168 VanDerWaalsContact N-O 3.14Å; N165-A168 PolarHBondContact OD1-N 3.1Å; N165-A168 PolarHBondContact OD1-O 2.76Å; N165-F419 WeakPolarHBondContact O-CE2 3.3Å; N165-L424 VanDerWaalsContact O-CD2 3.23Å; N165-L424 WeakPolarHBondContact O-CD2 3.45Å
166	R	90.4	Very high	90.5	Very high	76 Å²	76	37.1 Å²	37.1	29%	0.287	19%	0.186	S	C	.	.	S	Bend	trans	-59.1	-29.6	-177.5	-175.3	179	-179.7	178.7	3.9	113.7	E107 F419 L424	E107-R166 HydrophobicContact CB-CB 4.17Å; E107-R166 PolarHBondContact O-N 3.39Å; E107-R166 IonicContact OE1-NH1 3.19Å; R166-F419 HydrophobicContact CB-CD1 4Å; R166-F419 HydrophobicContact CB-CE1 4.04Å; R166-F419 HydrophobicContact CB-CG 4.29Å; R166-F419 HydrophobicContact CB-CZ 4.36Å; R166-F419 HydrophobicContact CG-CB 4.4Å; R166-F419 HydrophobicContact CG-CD1 4.22Å; R166-F419 HydrophobicContact CG-CG 4.24Å; R166-L424 PolarHBondContact O-N 3.02Å
167	Y	89.1	Confident	90.5	Very high	84 Å²	84	37.1 Å²	37.1	33%	0.329	19%	0.185	S	C	.	.	S	Bend	trans	-99.9	-32.4	-170.8	-55	-69.1	0	0	0	113.7	L103 E107 N165	L103-Y167 HydrophobicContact CD2-CD2 3.95Å; L103-Y167 HydrophobicContact CD2-CE2 4.05Å; E107-Y167 PolarHBondContact OE1-OH 3.3Å; N165-Y167 PolarHBondContact O-N 2.9Å; N165-Y167 PolarHBondContact OD1-N 3.02Å
168	A	91.8	Very high	90.5	Very high	2 Å²	2	41.7 Å²	41.7	2%	0.017	21%	0.21	C	C	.	.			trans	-150.2	153.7	-176.1	0	0	0	0	0	112.8	N165 Y170 R275	N165-A168 PolarHBondContact N-O 2.55Å; N165-A168 VanDerWaalsContact N-O 3.14Å; N165-A168 PolarHBondContact OD1-N 3.1Å; N165-A168 PolarHBondContact OD1-O 2.76Å; A168-Y170 WeakPolarHBondContact CB-O 3.5Å; A168-R275 HydrophobicContact CB-CB 3.92Å
169	L	93.9	Very high	90.5	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.231	C	C	.	.	S	Bend	trans	-71	-32.5	172.7	-79.3	-178.3	0	0	0	112.8	F160 I164 R275 R276 P278 L343 F416 L424 L426	F160-L169 HydrophobicContact CE2-CB 4.35Å; F160-L169 WeakPolarHBondContact CE2-O 3.42Å; I164-L169 HydrophobicContact CD1-CD2 4.17Å; I164-L169 HydrophobicContact CG1-CD2 4.21Å; I164-L169 WeakPolarHBondContact CG1-O 3.33Å; I164-L169 HydrophobicContact CG2-CD2 3.98Å; L169-R275 WeakPolarHBondContact CB-O 3.36Å; L169-R275 PolarHBondContact N-O 3.19Å; L169-R276 VanDerWaalsContact CD1-C 3.5Å; L169-R276 VanDerWaalsContact CD1-O 3.26Å; L169-R276 WeakPolarHBondContact CD1-O 3.3Å; L169-P278 HydrophobicContact CD1-CG 4.21Å; L169-L343 HydrophobicContact CD1-CD2 4.43Å; L169-L343 HydrophobicContact CD2-CD2 3.91Å; L169-F416 HydrophobicContact CD2-CE2 3.87Å; L169-F416 HydrophobicContact CD2-CZ 4.16Å; L169-L424 HydrophobicContact CG-CD1 4.45Å; L169-L426 HydrophobicContact CD1-CD2 3.9Å; L169-L426 HydrophobicContact CD2-CD2 3.59Å; L169-L426 HydrophobicContact CG-CD2 3.9Å
170	Y	92.8	Very high	90.6	Very high	5 Å²	5	40.5 Å²	40.5	2%	0.02	21%	0.21	C	C	.	.	S	Bend	trans	-146.7	157.2	179.2	54.6	-87.5	0	0	0	109.9	A168 I177 F266 R270 R275 V277	A168-Y170 WeakPolarHBondContact CB-O 3.5Å; Y170-I177 HydrophobicContact CD2-CG1 4.28Å; Y170-I177 HydrophobicContact CG-CD1 4.14Å; Y170-I177 HydrophobicContact CG-CG1 4.17Å; Y170-F266 AromaticContact CE1-CE2 3.97Å; Y170-F266 HydrophobicContact CE1-CE2 3.97Å; Y170-F266 AromaticContact CZ-CE2 3.77Å; Y170-R270 HydrophobicContact CE2-CG 4.48Å; Y170-R275 HydrophobicContact CD1-CB 4.43Å; Y170-R275 HydrophobicContact CD2-CB 4.3Å; Y170-R275 HydrophobicContact CD2-CG 4.28Å; Y170-R275 HydrophobicContact CE1-CB 4.07Å; Y170-R275 HydrophobicContact CE2-CB 3.95Å; Y170-R275 HydrophobicContact CE2-CG 3.75Å; Y170-R275 VanDerWaalsContact O-CD 3.32Å; Y170-R275 WeakPolarHBondContact O-CD 3.42Å; Y170-R275 PolarHBondContact O-NE 3.16Å; Y170-V277 WeakPolarHBondContact CE1-O 3.43Å
171	T	88.4	Confident	90.6	Very high	64 Å²	64	41.1 Å²	41.1	39%	0.393	21%	0.213	S	C	.	.			trans	-89.8	154.5	174.1	69	0	0	0	0	109.8	D174	T171-D174 WeakPolarHBondContact O-CB 3.48Å; T171-D174 WeakPolarHBondContact OG1-CB 3.37Å
172	R	83.9	Confident	90.7	Very high	63 Å²	63	43.6 Å²	43.6	24%	0.238	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-43.8	-171.7	-176.1	-170.5	61.5	176	-13.5	112.5	F91 Y96 N97 D174	F91-R172 PolarHBondContact O-NH1 3.06Å; Y96-R172 VanDerWaalsContact CB-NH1 3.31Å; Y96-R172 VanDerWaalsContact O-CZ 3.24Å; Y96-R172 PolarHBondContact O-NH1 3.08Å; N97-R172 PolarHBondContact OD1-NH1 3.42Å; N97-R172 PolarHBondContact OD1-NH2 3Å; R172-D174 PolarHBondContact O-N 3.38Å
173	D	81.1	Confident	90.7	Very high	122 Å²	122	42.8 Å²	42.8	65%	0.652	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.4	22.7	-174.8	-52.7	-37.7	0	0	0	111.5	P175	D173-P175 WeakPolarHBondContact O-CD 3.5Å
174	D	84.2	Confident	90.9	Very high	32 Å²	32	42 Å²	42	17%	0.171	22%	0.215	C	C	.	.			trans	-80.9	108.2	-178.8	-166.1	-12.5	0	0	0	111.5	T171 R172 A176 I177	T171-D174 WeakPolarHBondContact O-CB 3.48Å; T171-D174 WeakPolarHBondContact OG1-CB 3.37Å; R172-D174 PolarHBondContact O-N 3.38Å; D174-A176 PolarHBondContact O-N 2.99Å; D174-A176 WeakPolarHBondContact OD1-CB 3.25Å; D174-A176 PolarHBondContact OD1-N 3.41Å; D174-I177 HydrophobicContact CB-CG1 3.98Å; D174-I177 PolarHBondContact O-N 2.94Å
175	P	88.3	Confident	90.8	Very high	97 Å²	97	44 Å²	44	63%	0.63	22%	0.224	S	C	*	.	H	α-helix	trans	-64.9	-20.8	176.7	29.1	-35.7	0	0	0	112.3	D173 I177 L178 Q179	D173-P175 WeakPolarHBondContact O-CD 3.5Å; P175-I177 PolarHBondContact O-N 3.25Å; P175-L178 PolarHBondContact O-N 3.39Å; P175-Q179 PolarHBondContact O-N 3.37Å; P175-Q179 VanDerWaalsContact O-N 3.08Å
176	A	90.8	Very high	90.8	Very high	5 Å²	5	49.3 Å²	49.3	4%	0.041	25%	0.253	C	S	.	.	H	α-helix	trans	-65.4	-27.1	179.7	0	0	0	0	0	112.4	R159 D174 L180	R159-A176 HydrophobicContact CB-CB 3.8Å; D174-A176 PolarHBondContact O-N 2.99Å; D174-A176 WeakPolarHBondContact OD1-CB 3.25Å; D174-A176 PolarHBondContact OD1-N 3.41Å; A176-L180 WeakPolarHBondContact O-CB 3.44Å; A176-L180 PolarHBondContact O-N 3.1Å
177	I	92.3	Very high	90.9	Very high	8 Å²	8	47.6 Å²	47.6	4%	0.041	25%	0.248	C	C	.	.	H	α-helix	trans	-72.9	-43.6	178.7	-56.9	-59.8	0	0	0	110.8	F160 Y170 D174 P175 Q179 L180 L181 F266 P279	F160-I177 HydrophobicContact CB-CD1 4.23Å; F160-I177 HydrophobicContact CD2-CD1 3.64Å; F160-I177 HydrophobicContact CE2-CD1 4.44Å; F160-I177 HydrophobicContact CG-CD1 4.26Å; Y170-I177 HydrophobicContact CD2-CG1 4.28Å; Y170-I177 HydrophobicContact CG-CD1 4.14Å; Y170-I177 HydrophobicContact CG-CG1 4.17Å; D174-I177 HydrophobicContact CB-CG1 3.98Å; D174-I177 PolarHBondContact O-N 2.94Å; P175-I177 PolarHBondContact O-N 3.25Å; I177-Q179 VanDerWaalsContact C-N 3.32Å; I177-Q179 PolarHBondContact O-N 2.95Å; I177-L180 WeakPolarHBondContact O-CB 3.31Å; I177-L180 PolarHBondContact O-N 2.85Å; I177-L181 WeakPolarHBondContact O-CG 3.13Å; I177-L181 PolarHBondContact O-N 3.08Å; I177-F266 HydrophobicContact CG2-CZ 4.31Å; I177-P279 HydrophobicContact CD1-CG 4.07Å; I177-P279 HydrophobicContact CG2-CB 4.36Å; I177-P279 HydrophobicContact CG2-CG 3.99Å
178	L	91.8	Very high	90.9	Very high	107 Å²	107	47.7 Å²	47.7	56%	0.56	26%	0.258	S	S	*	.	H	α-helix	trans	-63.7	-40.7	175.4	-63.8	177.6	0	0	0	111.2	P175 L181 T182	P175-L178 PolarHBondContact O-N 3.39Å; L178-L181 HydrophobicContact CD2-CD1 4.48Å; L178-L181 PolarHBondContact O-N 3.24Å; L178-T182 PolarHBondContact O-N 3.09Å; L178-T182 VanDerWaalsContact O-N 3.11Å; L178-T182 PolarHBondContact O-OG1 3.06Å
179	Q	93.5	Very high	90.7	Very high	97 Å²	97	48.1 Å²	48.1	45%	0.453	26%	0.26	S	S	.	.	H	α-helix	trans	-63.4	-41.9	173	-171	61.8	49.3	0	0	111.6	P175 I177 L181 T182 D183	P175-Q179 PolarHBondContact O-N 3.37Å; P175-Q179 VanDerWaalsContact O-N 3.08Å; I177-Q179 VanDerWaalsContact C-N 3.32Å; I177-Q179 PolarHBondContact O-N 2.95Å; Q179-L181 PolarHBondContact O-N 2.05Å; Q179-T182 WeakPolarHBondContact O-CB 3.34Å; Q179-T182 PolarHBondContact O-N 3.31Å; Q179-D183 PolarHBondContact NE2-OD1 3.04Å; Q179-D183 WeakPolarHBondContact O-CB 3.22Å; Q179-D183 PolarHBondContact O-N 3.43Å
180	L	94.5	Very high	90.3	Very high	6 Å²	6	48.5 Å²	48.5	3%	0.031	26%	0.262	C	S	.	.	H	α-helix	trans	-62.4	-40.8	178.1	179.1	57.9	0	0	0	112.2	W157 F160 A176 I177 D183 M184 P279 A341	W157-L180 HydrophobicContact CB-CD1 3.77Å; F160-L180 HydrophobicContact CB-CD2 3.84Å; F160-L180 HydrophobicContact CD1-CD2 3.95Å; F160-L180 HydrophobicContact CG-CD2 3.94Å; A176-L180 WeakPolarHBondContact O-CB 3.44Å; A176-L180 PolarHBondContact O-N 3.1Å; I177-L180 WeakPolarHBondContact O-CB 3.31Å; I177-L180 PolarHBondContact O-N 2.85Å; L180-D183 PolarHBondContact O-N 3.34Å; L180-M184 HydrophobicContact CD1-CG 4.27Å; L180-M184 HydrophobicContact CG-CE 4.35Å; L180-M184 WeakPolarHBondContact O-CG 3.33Å; L180-M184 PolarHBondContact O-N 2.91Å; L180-P279 HydrophobicContact CD2-CB 4.24Å; L180-P279 HydrophobicContact CD2-CG 4.1Å; L180-A341 HydrophobicContact CD2-CB 3.96Å
181	L	94.6	Very high	89.7	Confident	16 Å²	16	48.5 Å²	48.5	8%	0.084	26%	0.264	C	S	.	.	H	α-helix	trans	-60.8	-46.8	174.3	-66.5	170.1	0	0	0	110.6	I177 L178 Q179 D183 M184 Q185 F266 P279 V280 A281	I177-L181 WeakPolarHBondContact O-CG 3.13Å; I177-L181 PolarHBondContact O-N 3.08Å; L178-L181 HydrophobicContact CD2-CD1 4.48Å; L178-L181 PolarHBondContact O-N 3.24Å; Q179-L181 PolarHBondContact O-N 2.05Å; L181-D183 PolarHBondContact O-N 3.05Å; L181-M184 HydrophobicContact CD2-CE 3.9Å; L181-M184 PolarHBondContact O-N 3.22Å; L181-Q185 VanDerWaalsContact O-CG 3.25Å; L181-Q185 WeakPolarHBondContact O-CG 3.29Å; L181-Q185 PolarHBondContact O-N 3.3Å; L181-Q185 VanDerWaalsContact O-N 3.1Å; L181-F266 HydrophobicContact CD1-CE1 3.86Å; L181-F266 HydrophobicContact CD1-CZ 4.21Å; L181-F266 HydrophobicContact CD2-CD1 4.48Å; L181-F266 HydrophobicContact CD2-CE1 3.79Å; L181-F266 HydrophobicContact CD2-CZ 4.29Å; L181-F266 HydrophobicContact CG-CE1 4.43Å; L181-P279 HydrophobicContact CD2-CB 3.96Å; L181-V280 WeakPolarHBondContact CD2-O 3.18Å; L181-A281 HydrophobicContact CD2-CB 4.02Å
182	T	94.4	Very high	89.2	Confident	58 Å²	58	45.4 Å²	45.4	36%	0.356	25%	0.245	S	C	.	.	H	α-helix	trans	-62.4	-42.5	177.7	-52.5	0	0	0	0	111.8	L178 Q179 Q185 N186	L178-T182 PolarHBondContact O-N 3.09Å; L178-T182 VanDerWaalsContact O-N 3.11Å; L178-T182 PolarHBondContact O-OG1 3.06Å; Q179-T182 WeakPolarHBondContact O-CB 3.34Å; Q179-T182 PolarHBondContact O-N 3.31Å; T182-Q185 PolarHBondContact O-N 3.11Å; T182-N186 PolarHBondContact O-N 3.25Å
183	D	93.3	Very high	88.7	Confident	28 Å²	28	45.9 Å²	45.9	15%	0.15	25%	0.254	C	S	.	.	H	α-helix	trans	-63.2	-43.9	177.3	-69.5	-11.1	0	0	0	110.7	S156 Q179 L180 L181 Q185 N186 M187	S156-D183 VanDerWaalsContact CB-OD2 3.31Å; S156-D183 WeakPolarHBondContact CB-OD2 3.07Å; S156-D183 PolarHBondContact OG-OD2 3.32Å; Q179-D183 PolarHBondContact NE2-OD1 3.04Å; Q179-D183 WeakPolarHBondContact O-CB 3.22Å; Q179-D183 PolarHBondContact O-N 3.43Å; L180-D183 PolarHBondContact O-N 3.34Å; L181-D183 PolarHBondContact O-N 3.05Å; D183-Q185 VanDerWaalsContact C-N 3.27Å; D183-Q185 PolarHBondContact O-N 3.43Å; D183-N186 PolarHBondContact O-N 3.04Å; D183-M187 HydrophobicContact CB-CE 4.27Å; D183-M187 WeakPolarHBondContact O-CA 3.44Å; D183-M187 WeakPolarHBondContact O-CB 3.27Å; D183-M187 PolarHBondContact O-N 3.22Å
184	M	93.8	Very high	87.6	Confident	7 Å²	7	40.9 Å²	40.9	3%	0.034	23%	0.228	C	C	.	.	H	α-helix	trans	-62.7	-35.5	177.5	-72.7	-170.9	-58.2	0	0	112.4	L180 L181 A232 P279 A281 R283 L339 A341	L180-M184 HydrophobicContact CD1-CG 4.27Å; L180-M184 HydrophobicContact CG-CE 4.35Å; L180-M184 WeakPolarHBondContact O-CG 3.33Å; L180-M184 PolarHBondContact O-N 2.91Å; L181-M184 HydrophobicContact CD2-CE 3.9Å; L181-M184 PolarHBondContact O-N 3.22Å; M184-A232 HydrophobicContact SD-CB 4.24Å; M184-P279 HydrophobicContact CE-CB 4.27Å; M184-A281 HydrophobicContact CB-CB 4.46Å; M184-A281 HydrophobicContact CE-CB 4.17Å; M184-R283 PolarHBondContact O-NH1 3.01Å; M184-L339 HydrophobicContact CB-CB 4.41Å; M184-L339 HydrophobicContact CB-CD1 4.41Å; M184-L339 WeakPolarHBondContact O-CD1 3.45Å; M184-L339 HydrophobicContact SD-CB 4.49Å; M184-A341 HydrophobicContact CE-CB 4.33Å; M184-A341 HydrophobicContact SD-CB 3.84Å
185	Q	92.6	Very high	86.4	Confident	40 Å²	40	41 Å²	41	19%	0.187	23%	0.229	C	C	.	.	H	α-helix	trans	-69	-44.4	178.5	-68.9	168.7	4.6	0	0	112.4	L181 T182 D183 A281 R283 P484	L181-Q185 VanDerWaalsContact O-CG 3.25Å; L181-Q185 WeakPolarHBondContact O-CG 3.29Å; L181-Q185 PolarHBondContact O-N 3.3Å; L181-Q185 VanDerWaalsContact O-N 3.1Å; T182-Q185 PolarHBondContact O-N 3.11Å; D183-Q185 VanDerWaalsContact C-N 3.27Å; D183-Q185 PolarHBondContact O-N 3.43Å; Q185-A281 HydrophobicContact CG-CB 3.79Å; Q185-R283 WeakPolarHBondContact O-CD 3.47Å; Q185-R283 PolarHBondContact O-NE 3.48Å; Q185-R283 PolarHBondContact O-NH1 2.89Å; Q185-P484 HydrophobicContact CG-CG 3.95Å
186	N	91.9	Very high	84.8	Confident	119 Å²	119	39.2 Å²	39.2	64%	0.636	21%	0.21	S	C	*	.	H	α-helix	trans	-109.3	-19.8	-165.3	-64.1	-26.9	0	0	0	114.8	T182 D183	T182-N186 PolarHBondContact O-N 3.25Å; D183-N186 PolarHBondContact O-N 3.04Å
187	M	91.3	Very high	83	Confident	39 Å²	39	40.5 Å²	40.5	19%	0.192	22%	0.218	C	C	.	.	S	Bend	trans	-71.4	144.5	-171.5	-171.5	166.2	-76.3	0	0	112.3	D183 I189 M226 S227 N228 R283	D183-M187 HydrophobicContact CB-CE 4.27Å; D183-M187 WeakPolarHBondContact O-CA 3.44Å; D183-M187 WeakPolarHBondContact O-CB 3.27Å; D183-M187 PolarHBondContact O-N 3.22Å; M187-I189 PolarHBondContact O-N 3.21Å; M187-M226 HydrophobicContact CG-CB 4.07Å; M187-M226 HydrophobicContact SD-CB 3.73Å; M187-S227 WeakPolarHBondContact CG-OG 3.45Å; M187-N228 HydrophobicContact CE-CB 3.82Å; M187-N228 WeakPolarHBondContact CE-ND2 3.17Å; M187-N228 HydrophobicContact SD-CB 3.53Å; M187-N228 VanDerWaalsContact SD-CB 3.53Å; M187-N228 PolarHBondContact SD-ND2 3.29Å; M187-N228 VanDerWaalsContact SD-ND2 3.38Å; M187-N228 PolarHBondContact SD-OD1 2.85Å; M187-N228 VanDerWaalsContact SD-OD1 3.36Å; M187-R283 VanDerWaalsContact O-CZ 3.24Å; M187-R283 PolarHBondContact O-NH1 3.03Å; M187-R283 PolarHBondContact O-NH2 3.32Å
188	T	89.6	Confident	80.8	Confident	86 Å²	86	46.7 Å²	46.7	53%	0.528	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-65.2	133.7	178.3	50.4	0	0	0	0	112	M226 S227	T188-M226 WeakPolarHBondContact O-CA 3.36Å; T188-S227 PolarHBondContact O-N 3.19Å; T188-S227 VanDerWaalsContact OG1-CB 3.26Å; T188-S227 WeakPolarHBondContact OG1-CB 3.47Å; T188-S227 PolarHBondContact OG1-OG 3.45Å
189	I	88.5	Confident	78.3	Confident	11 Å²	11	46 Å²	46	6%	0.056	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	123.5	174.1	-61.2	155.6	0	0	0	108	M187 L224 M226 V285 E290 V294	M187-I189 PolarHBondContact O-N 3.21Å; I189-L224 HydrophobicContact CD1-CD1 3.74Å; I189-L224 HydrophobicContact CG1-CD1 4.31Å; I189-L224 HydrophobicContact CG2-CB 4.23Å; I189-L224 HydrophobicContact CG2-CD2 4.43Å; I189-M226 HydrophobicContact CG1-CE 4.33Å; I189-M226 HydrophobicContact CG1-SD 3.78Å; I189-V285 HydrophobicContact CD1-CG1 4.07Å; I189-V285 HydrophobicContact CD1-CG2 4.43Å; I189-E290 HydrophobicContact CB-CB 4.33Å; I189-E290 HydrophobicContact CD1-CB 3.86Å; I189-E290 HydrophobicContact CD1-CG 4.45Å; I189-E290 VanDerWaalsContact CG2-O 3.31Å; I189-E290 WeakPolarHBondContact CG2-O 3.5Å; I189-V294 HydrophobicContact CG2-CG2 4.23Å
190	V	84.9	Confident	76.2	Confident	8 Å²	8	42.9 Å²	42.9	5%	0.048	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	19.5	-177.3	-59.2	0	0	0	0	111.7	Q147 M149 K225 M226	Q147-V190 HydrophobicContact CB-CB 4.19Å; Q147-V190 HydrophobicContact CB-CG1 4.36Å; Q147-V190 HydrophobicContact CG-CB 4.42Å; Q147-V190 VanDerWaalsContact OE1-C 3.27Å; Q147-V190 PolarHBondContact OE1-O 3.21Å; M149-V190 HydrophobicContact CE-CG2 4.1Å; M149-V190 HydrophobicContact CG-CG2 4.28Å; M149-V190 HydrophobicContact SD-CG2 4.24Å; V190-K225 HydrophobicContact CG2-CG 4.41Å; V190-K225 WeakPolarHBondContact CG2-O 3.43Å; V190-K225 PolarHBondContact N-O 3.16Å; V190-M226 WeakPolarHBondContact CG2-O 3.19Å
191	G	80.4	Confident	74	Confident	5 Å²	5	47.9 Å²	47.9	5%	0.052	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170	138.2	177.5	0	0	0	0	0	111.8	K225	G191-K225 PolarHBondContact N-O 3.49Å; G191-K225 PolarHBondContact O-N 3.34Å
192	A	78.1	Confident	71.7	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	132.7	174.2	0	0	0	0	0	109.1	L224 V291 V294 L300	A192-L224 HydrophobicContact CB-CD2 3.74Å; A192-V291 HydrophobicContact CB-CB 4.48Å; A192-V291 HydrophobicContact CB-CG1 3.82Å; A192-V294 HydrophobicContact CB-CG2 4.06Å; A192-L300 HydrophobicContact CB-CD2 4.19Å
193	V	73.1	Confident	69.3	Low	72 Å²	72	50 Å²	50	44%	0.436	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	140.7	175.2	-172.6	0	0	0	0	107.6	D195 A223	V193-D195 PolarHBondContact O-N 3.37Å; V193-A223 PolarHBondContact N-O 3.29Å; V193-A223 PolarHBondContact O-N 3.13Å
194	P	57.5	Low	67.3	Low	17 Å²	17	57.9 Å²	57.9	11%	0.11	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	130	168.8	-16.3	28.7	0	0	0	108.8	Y196 L300	P194-Y196 VanDerWaalsContact C-N 3.34Å; P194-Y196 HydrophobicContact CB-CD1 4.48Å; P194-Y196 HydrophobicContact CB-CD2 4.18Å; P194-Y196 HydrophobicContact CB-CE1 4.04Å; P194-Y196 HydrophobicContact CB-CE2 3.71Å; P194-Y196 HydrophobicContact CG-CE2 3.95Å; P194-Y196 PolarHBondContact O-N 2.87Å; P194-Y196 VanDerWaalsContact O-N 3.14Å; P194-L300 HydrophobicContact CG-CB 3.72Å; P194-L300 HydrophobicContact CG-CD1 4.17Å; P194-L300 HydrophobicContact CG-CD2 4.23Å; P194-L300 HydrophobicContact CG-CG 4.23Å
195	D	59.4	Low	65.2	Low	34 Å²	34	60.1 Å²	60.1	18%	0.182	33%	0.328	C	S	.	.			trans	-86.3	86.3	168.9	-159.1	10.3	0	0	0	109.5	V193 T197 K201 K221 A223 M233 Y342	V193-D195 PolarHBondContact O-N 3.37Å; D195-T197 PolarHBondContact O-N 3.46Å; D195-K201 IonicContact OD1-NZ 3.93Å; D195-K201 PolarHBondContact OD1-NZ 3.24Å; D195-K201 VanDerWaalsContact OD1-NZ 3.11Å; D195-K221 HydrophobicContact CB-CG 4.3Å; D195-K221 PolarHBondContact N-O 3.26Å; D195-K221 WeakPolarHBondContact O-CE 3.32Å; D195-A223 HydrophobicContact CB-CB 4.12Å; D195-M233 HydrophobicContact CB-CE 3.79Å; D195-M233 HydrophobicContact CB-SD 4.18Å; D195-M233 WeakPolarHBondContact OD2-CE 3.34Å; D195-Y342 VanDerWaalsContact CG-OH 3.32Å; D195-Y342 PolarHBondContact OD2-OH 3.29Å
196	Y	55.2	Low	63.1	Low	61 Å²	61	61 Å²	61	24%	0.239	34%	0.342	C	S	.	.			trans	-62.3	131.8	169.2	-60.9	-66.5	0	0	0	109.2	P194 E200 K201	P194-Y196 VanDerWaalsContact C-N 3.34Å; P194-Y196 HydrophobicContact CB-CD1 4.48Å; P194-Y196 HydrophobicContact CB-CD2 4.18Å; P194-Y196 HydrophobicContact CB-CE1 4.04Å; P194-Y196 HydrophobicContact CB-CE2 3.71Å; P194-Y196 HydrophobicContact CG-CE2 3.95Å; P194-Y196 PolarHBondContact O-N 2.87Å; P194-Y196 VanDerWaalsContact O-N 3.14Å; Y196-E200 WeakPolarHBondContact CA-OE2 3.33Å; Y196-E200 HydrophobicContact CD1-CB 4.19Å; Y196-E200 HydrophobicContact CG-CB 4.44Å; Y196-K201 VanDerWaalsContact O-CE 3.31Å; Y196-K201 WeakPolarHBondContact O-CE 3.48Å; Y196-K201 PolarHBondContact O-NZ 3.08Å
197	T	51.5	Low	61	Low	32 Å²	32	59.1 Å²	59.1	20%	0.196	34%	0.337	C	S	.	.			trans	-54.8	159.9	168.4	57.4	0	0	0	0	110.1	D195 D199 E200 K201	D195-T197 PolarHBondContact O-N 3.46Å; T197-D199 PolarHBondContact O-N 2.86Å; T197-E200 PolarHBondContact N-OE2 3.01Å; T197-E200 PolarHBondContact O-N 3.35Å; T197-E200 VanDerWaalsContact O-N 3.12Å; T197-E200 WeakPolarHBondContact OG1-CB 3.3Å; T197-E200 VanDerWaalsContact OG1-CG 3.25Å; T197-E200 WeakPolarHBondContact OG1-CG 3.31Å; T197-E200 PolarHBondContact OG1-N 3.49Å; T197-E200 VanDerWaalsContact OG1-N 3.11Å; T197-E200 PolarHBondContact OG1-OE2 3.03Å; T197-K201 WeakPolarHBondContact O-CG 3.47Å; T197-K201 PolarHBondContact O-N 3.29Å
198	Q	47.4	Very low	58.9	Low	138 Å²	138	59.5 Å²	59.5	65%	0.645	34%	0.34	S	S	*	.	H	α-helix	trans	-54.9	-34.9	173.7	-84.2	178.4	-30.7	0	0	111.4	K201 A202	Q198-K201 PolarHBondContact O-N 3.46Å; Q198-A202 WeakPolarHBondContact O-CB 3.5Å; Q198-A202 PolarHBondContact O-N 3.49Å
199	D	39.1	Very low	56.8	Low	93 Å²	93	59 Å²	59	50%	0.497	34%	0.339	S	S	.	.	H	α-helix	trans	-66.7	-43.1	176.8	-55	-23.2	0	0	0	111.8	T197 A202 L203	T197-D199 PolarHBondContact O-N 2.86Å; D199-A202 WeakPolarHBondContact O-CB 3.44Å; D199-A202 PolarHBondContact O-N 3.44Å; D199-L203 WeakPolarHBondContact O-CD1 3.45Å; D199-L203 VanDerWaalsContact O-CG 3.32Å; D199-L203 WeakPolarHBondContact O-CG 3.43Å; D199-L203 PolarHBondContact O-N 3.49Å
200	E	48	Very low	54.6	Low	30 Å²	30	63.9 Å²	63.9	14%	0.14	37%	0.37	C	S	.	.	H	α-helix	trans	-67.8	-35	174.6	-74.3	166.8	167.7	0	0	112.7	Y196 T197 A202 L203 K204 H218	Y196-E200 WeakPolarHBondContact CA-OE2 3.33Å; Y196-E200 HydrophobicContact CD1-CB 4.19Å; Y196-E200 HydrophobicContact CG-CB 4.44Å; T197-E200 PolarHBondContact N-OE2 3.01Å; T197-E200 PolarHBondContact O-N 3.35Å; T197-E200 VanDerWaalsContact O-N 3.12Å; T197-E200 WeakPolarHBondContact OG1-CB 3.3Å; T197-E200 VanDerWaalsContact OG1-CG 3.25Å; T197-E200 WeakPolarHBondContact OG1-CG 3.31Å; T197-E200 PolarHBondContact OG1-N 3.49Å; T197-E200 VanDerWaalsContact OG1-N 3.11Å; T197-E200 PolarHBondContact OG1-OE2 3.03Å; E200-A202 VanDerWaalsContact C-N 3.35Å; E200-L203 PolarHBondContact O-N 3.49Å; E200-K204 PolarHBondContact O-N 3.07Å; E200-K204 VanDerWaalsContact O-N 3.13Å; E200-H218 IonicContact OE1-CE1 2.83Å; E200-H218 PolarHBondContact OE1-CE1 3.07Å; E200-H218 IonicContact OE1-CG 3.75Å; E200-H218 IonicContact OE1-ND1 3.71Å; E200-H218 PolarHBondContact OE1-ND1 3.39Å
201	K	49.8	Very low	52.5	Low	112 Å²	112	70.5 Å²	70.5	49%	0.487	40%	0.4	S	S	.	.	H	α-helix	trans	-66.5	-37.1	172.6	-71.2	175	176.3	125.2	0	111.4	D195 Y196 T197 Q198 K204	D195-K201 IonicContact OD1-NZ 3.93Å; D195-K201 PolarHBondContact OD1-NZ 3.24Å; D195-K201 VanDerWaalsContact OD1-NZ 3.11Å; Y196-K201 VanDerWaalsContact O-CE 3.31Å; Y196-K201 WeakPolarHBondContact O-CE 3.48Å; Y196-K201 PolarHBondContact O-NZ 3.08Å; T197-K201 WeakPolarHBondContact O-CG 3.47Å; T197-K201 PolarHBondContact O-N 3.29Å; Q198-K201 PolarHBondContact O-N 3.46Å; K201-K204 PolarHBondContact O-N 3.38Å
202	A	44.8	Very low	50.8	Low	81 Å²	81	71.1 Å²	71.1	67%	0.669	40%	0.403	S	S	*	.	H	α-helix	trans	-68	-37.3	175.8	0	0	0	0	0	111.8	Q198 D199 E200 K204	Q198-A202 WeakPolarHBondContact O-CB 3.5Å; Q198-A202 PolarHBondContact O-N 3.49Å; D199-A202 WeakPolarHBondContact O-CB 3.44Å; D199-A202 PolarHBondContact O-N 3.44Å; E200-A202 VanDerWaalsContact C-N 3.35Å; A202-K204 VanDerWaalsContact C-N 3.34Å
203	L	45.3	Very low	48.8	Very low	36 Å²	36	76.5 Å²	76.5	19%	0.188	44%	0.435	C	S	.	.	H	α-helix	trans	-81	-9.4	179.6	-68.6	161.4	0	0	0	113.8	D199 E200 G205 A206 V212 L319	D199-L203 WeakPolarHBondContact O-CD1 3.45Å; D199-L203 VanDerWaalsContact O-CG 3.32Å; D199-L203 WeakPolarHBondContact O-CG 3.43Å; D199-L203 PolarHBondContact O-N 3.49Å; E200-L203 PolarHBondContact O-N 3.49Å; L203-G205 PolarHBondContact O-N 3.45Å; L203-A206 VanDerWaalsContact O-CB 3.25Å; L203-A206 WeakPolarHBondContact O-CB 3.46Å; L203-A206 PolarHBondContact O-N 3.27Å; L203-V212 HydrophobicContact CD1-CG2 3.34Å; L203-V212 HydrophobicContact CD2-CG2 4.5Å; L203-L319 HydrophobicContact CB-CD1 4.39Å; L203-L319 HydrophobicContact CD1-CD1 3.51Å
204	K	50.5	Low	47.4	Very low	195 Å²	195	78.2 Å²	78.2	85%	0.848	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.9	32.6	-178.7	-62.5	-178.1	179.8	176	0	113.3	E200 K201 A202	E200-K204 PolarHBondContact O-N 3.07Å; E200-K204 VanDerWaalsContact O-N 3.13Å; K201-K204 PolarHBondContact O-N 3.38Å; A202-K204 VanDerWaalsContact C-N 3.34Å
205	G	50	Low	46.5	Very low	53 Å²	53	79.9 Å²	79.9	55%	0.546	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	14.1	-176.2	0	0	0	0	0	116	L203	L203-G205 PolarHBondContact O-N 3.45Å
206	A	49	Very low	45.5	Very low	59 Å²	59	78.6 Å²	78.6	49%	0.488	44%	0.442	S	S	.	.			trans	-80.6	114.3	171.6	0	0	0	0	0	110.6	L203 D208 L319	L203-A206 VanDerWaalsContact O-CB 3.25Å; L203-A206 WeakPolarHBondContact O-CB 3.46Å; L203-A206 PolarHBondContact O-N 3.27Å; A206-D208 PolarHBondContact O-N 2.84Å; A206-L319 WeakPolarHBondContact O-CD2 3.3Å
207	C	46.5	Very low	44.9	Very low	79 Å²	79	77 Å²	77	53%	0.534	44%	0.444	S	S	.	.			trans	-70.1	90.5	175.5	-56.7	0	0	0	0	110.7	L319	C207-L319 HydrophobicContact CB-CD2 4.28Å
208	D	48.3	Very low	45	Very low	47 Å²	47	77.6 Å²	77.6	25%	0.251	44%	0.444	S	S	.	.			trans	-101.8	94.3	161.3	-170.4	-12.7	0	0	0	109.6	A206 T210 Q211 V212	A206-D208 PolarHBondContact O-N 2.84Å; D208-T210 PolarHBondContact O-N 3.25Å; D208-T210 VanDerWaalsContact O-N 3.11Å; D208-T210 WeakPolarHBondContact OD1-CB 3.38Å; D208-T210 PolarHBondContact OD1-N 3.2Å; D208-T210 PolarHBondContact OD1-OG1 3.14Å; D208-Q211 HydrophobicContact CB-CB 4.39Å; D208-Q211 PolarHBondContact O-N 3.42Å; D208-Q211 VanDerWaalsContact OD2-CD 3.22Å; D208-Q211 VanDerWaalsContact OD2-CG 3.28Å; D208-Q211 WeakPolarHBondContact OD2-CG 3.17Å; D208-Q211 PolarHBondContact OD2-NE2 3.17Å; D208-V212 WeakPolarHBondContact O-CG2 3.11Å
209	C	44.9	Very low	45.6	Very low	75 Å²	75	73.4 Å²	73.4	51%	0.507	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-15.1	-179.8	-58.3	0	0	0	0	113.4	Y320	C209-Y320 HydrophobicContact CB-CE1 4.5Å; C209-Y320 PolarHBondContact O-OH 2.96Å
210	T	43.4	Very low	47.1	Very low	114 Å²	114	70.4 Å²	70.4	70%	0.699	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-27.4	-178.9	68.6	0	0	0	0	113.3	D208	D208-T210 PolarHBondContact O-N 3.25Å; D208-T210 VanDerWaalsContact O-N 3.11Å; D208-T210 WeakPolarHBondContact OD1-CB 3.38Å; D208-T210 PolarHBondContact OD1-N 3.2Å; D208-T210 PolarHBondContact OD1-OG1 3.14Å
211	Q	41.2	Very low	48.6	Very low	148 Å²	148	71 Å²	71	69%	0.692	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-14.7	-178.8	-69.4	-175.3	37.9	0	0	113.8	D208	D208-Q211 HydrophobicContact CB-CB 4.39Å; D208-Q211 PolarHBondContact O-N 3.42Å; D208-Q211 VanDerWaalsContact OD2-CD 3.22Å; D208-Q211 VanDerWaalsContact OD2-CG 3.28Å; D208-Q211 WeakPolarHBondContact OD2-CG 3.17Å; D208-Q211 PolarHBondContact OD2-NE2 3.17Å
212	V	43.3	Very low	50.3	Low	17 Å²	17	65.7 Å²	65.7	10%	0.103	39%	0.387	C	S	.	.			trans	-116.7	38.1	-169	-163	0	0	0	0	111.7	L203 D208 K214 L319 Y320	L203-V212 HydrophobicContact CD1-CG2 3.34Å; L203-V212 HydrophobicContact CD2-CG2 4.5Å; D208-V212 WeakPolarHBondContact O-CG2 3.11Å; V212-K214 PolarHBondContact O-N 3.28Å; V212-L319 HydrophobicContact CG1-CD1 4.44Å; V212-L319 HydrophobicContact CG2-CD1 4.3Å; V212-Y320 VanDerWaalsContact CA-OH 3.29Å; V212-Y320 WeakPolarHBondContact CA-OH 3.41Å; V212-Y320 HydrophobicContact CB-CE2 3.59Å; V212-Y320 VanDerWaalsContact CB-OH 3.27Å; V212-Y320 WeakPolarHBondContact CB-OH 3.44Å; V212-Y320 HydrophobicContact CG1-CE2 3.64Å; V212-Y320 WeakPolarHBondContact O-CE2 3.48Å; V212-Y320 PolarHBondContact O-OH 2.84Å
213	V	36.8	Very low	52.3	Low	113 Å²	113	62.7 Å²	62.7	69%	0.685	36%	0.363	S	S	*	.			trans	-71.6	65.6	179	-166.9	0	0	0	0	111.3	Y320	V213-Y320 PolarHBondContact N-OH 3.49Å
214	K	42.9	Very low	54.4	Low	108 Å²	108	61 Å²	61	47%	0.47	35%	0.354	S	S	.	.			trans	-130.1	99.1	169	-72	-169.9	-178.1	175.5	0	108.8	V212 S216	V212-K214 PolarHBondContact O-N 3.28Å; K214-S216 PolarHBondContact O-N 2.91Å; K214-S216 VanDerWaalsContact O-N 3.12Å
215	P	39.1	Very low	56.3	Low	52 Å²	52	53.2 Å²	53.2	34%	0.338	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-7	176.1	25	-31	0	0	0	113.6	F253 Y362	P215-F253 HydrophobicContact CB-CB 4.25Å; P215-F253 HydrophobicContact CB-CD2 3.65Å; P215-F253 HydrophobicContact CB-CE2 4.39Å; P215-F253 HydrophobicContact CB-CG 4.23Å; P215-F253 HydrophobicContact CG-CB 4.08Å; P215-F253 HydrophobicContact CG-CD2 3.72Å; P215-F253 HydrophobicContact CG-CE2 4.34Å; P215-F253 HydrophobicContact CG-CG 3.94Å; P215-Y362 HydrophobicContact CG-CD1 4.21Å
216	S	38.4	Very low	58.2	Low	8 Å²	8	51 Å²	51	6%	0.056	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-15.6	-172.5	58.2	0	0	0	0	115.6	K214 H411 R432	K214-S216 PolarHBondContact O-N 2.91Å; K214-S216 VanDerWaalsContact O-N 3.12Å; S216-H411 PolarHBondContact OG-CE1 3.44Å; S216-H411 PolarHBondContact OG-NE2 2.87Å; S216-R432 PolarHBondContact O-NH2 2.78Å
217	G	43.2	Very low	60.1	Low	27 Å²	27	49.3 Å²	49.3	28%	0.278	28%	0.28	S	S	.	.	S	Bend	trans	-111.5	-13.5	-157	0	0	0	0	0	119.9	H219	G217-H219 PolarHBondContact O-N 3.15Å
218	H	52.9	Low	62.2	Low	44 Å²	44	46.4 Å²	46.4	20%	0.204	26%	0.259	C	S	.	.			trans	-105.4	70.7	-164.9	-58.2	-71.9	0	0	0	113.5	E200 C318 Y320	E200-H218 IonicContact OE1-CE1 2.83Å; E200-H218 PolarHBondContact OE1-CE1 3.07Å; E200-H218 IonicContact OE1-CG 3.75Å; E200-H218 IonicContact OE1-ND1 3.71Å; E200-H218 PolarHBondContact OE1-ND1 3.39Å; H218-C318 WeakPolarHBondContact CB-SG 2.98Å; H218-Y320 AromaticContact CD2-CD2 3.66Å; H218-Y320 AromaticContact NE2-CD2 3.76Å; H218-Y320 AromaticContact NE2-CE2 3.91Å
219	H	60.6	Low	64.1	Low	51 Å²	51	45 Å²	45	24%	0.236	25%	0.251	C	S	.	.			trans	-112	148.2	173.9	-66.1	-101.5	0	0	0	110.1	G217 K221 Q257 R432	G217-H219 PolarHBondContact O-N 3.15Å; H219-K221 PolarHBondContact O-N 2.68Å; H219-K221 VanDerWaalsContact O-N 3.17Å; H219-Q257 HydrophobicContact CB-CB 4.3Å; H219-Q257 HydrophobicContact CB-CG 4.15Å; H219-Q257 PolarHBondContact CD2-NE2 3.41Å; H219-R432 PolarHBondContact NE2-NH2 2.56Å
220	L	70.9	Confident	66.2	Low	30 Å²	30	41.6 Å²	41.6	16%	0.157	23%	0.229	C	C	.	.			trans	-62.7	116.5	-178.3	178.3	64.8	0	0	0	110.5	P236 F314 A316 V328	L220-P236 HydrophobicContact CB-CG 4.39Å; L220-P236 HydrophobicContact CD2-CG 3.83Å; L220-P236 HydrophobicContact CG-CG 4.08Å; L220-P236 VanDerWaalsContact O-CD 3.23Å; L220-P236 WeakPolarHBondContact O-CD 3.45Å; L220-F314 HydrophobicContact CD1-CD2 3.96Å; L220-F314 HydrophobicContact CD1-CE2 3.72Å; L220-F314 HydrophobicContact CD2-CD2 3.8Å; L220-F314 HydrophobicContact CD2-CE2 3.39Å; L220-F314 HydrophobicContact CD2-CZ 3.85Å; L220-F314 HydrophobicContact CG-CD2 4.39Å; L220-F314 HydrophobicContact CG-CE2 3.83Å; L220-A316 HydrophobicContact CB-CB 4.21Å; L220-A316 HydrophobicContact CD1-CB 3.81Å; L220-V328 HydrophobicContact CD2-CB 4.28Å; L220-V328 HydrophobicContact CD2-CG1 4.05Å; L220-V328 HydrophobicContact CD2-CG2 3.26Å
221	K	79.6	Confident	68.4	Low	42 Å²	42	41.6 Å²	41.6	18%	0.183	22%	0.219	C	C	.	.			trans	-140.8	134.5	179.5	68.1	-171.7	180	-170.6	0	110.5	D195 H219 M233 F234	D195-K221 HydrophobicContact CB-CG 4.3Å; D195-K221 PolarHBondContact N-O 3.26Å; D195-K221 WeakPolarHBondContact O-CE 3.32Å; H219-K221 PolarHBondContact O-N 2.68Å; H219-K221 VanDerWaalsContact O-N 3.17Å; K221-M233 HydrophobicContact CB-SD 3.7Å; K221-M233 HydrophobicContact CD-CE 4.06Å; K221-M233 HydrophobicContact CD-SD 4.22Å; K221-M233 HydrophobicContact CG-CE 4.42Å; K221-M233 HydrophobicContact CG-SD 4.04Å; K221-F234 WeakPolarHBondContact CA-O 3.43Å
222	L	84	Confident	70.9	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	132.3	-177.7	-59.5	179.8	0	0	0	110.3	L224 F234 V291 L300 F314	L222-L224 HydrophobicContact CB-CD2 3.97Å; L222-L224 PolarHBondContact O-N 3Å; L222-F234 HydrophobicContact CB-CB 4.3Å; L222-F234 HydrophobicContact CB-CD1 4.47Å; L222-F234 HydrophobicContact CD1-CD1 4.22Å; L222-F234 PolarHBondContact N-O 3.41Å; L222-F234 PolarHBondContact O-N 2.68Å; L222-V291 HydrophobicContact CD1-CG1 3.64Å; L222-V291 HydrophobicContact CD1-CG2 4.45Å; L222-L300 HydrophobicContact CD2-CD1 3.77Å; L222-L300 HydrophobicContact CD2-CD2 4.23Å; L222-F314 HydrophobicContact CD1-CE2 3.66Å; L222-F314 HydrophobicContact CD1-CZ 3.91Å; L222-F314 HydrophobicContact CD2-CE2 4.39Å; L222-F314 HydrophobicContact CG-CE2 4.21Å
223	A	87.8	Confident	73.2	Confident	18 Å²	18	35 Å²	35	15%	0.149	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	104.3	166.1	0	0	0	0	0	108.7	V193 D195 Y342	V193-A223 PolarHBondContact N-O 3.29Å; V193-A223 PolarHBondContact O-N 3.13Å; D195-A223 HydrophobicContact CB-CB 4.12Å; A223-Y342 HydrophobicContact CB-CE2 4.35Å; A223-Y342 VanDerWaalsContact CB-OH 3.25Å; A223-Y342 WeakPolarHBondContact CB-OH 3.33Å
224	L	89.9	Confident	75.8	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	138.8	174.7	-55	-171.1	0	0	0	110.2	I189 A192 L222 K231 A232 F234 L339	I189-L224 HydrophobicContact CD1-CD1 3.74Å; I189-L224 HydrophobicContact CG1-CD1 4.31Å; I189-L224 HydrophobicContact CG2-CB 4.23Å; I189-L224 HydrophobicContact CG2-CD2 4.43Å; A192-L224 HydrophobicContact CB-CD2 3.74Å; L222-L224 HydrophobicContact CB-CD2 3.97Å; L222-L224 PolarHBondContact O-N 3Å; L224-K231 CarbonylContact O-C 3.59Å; L224-K231 VanDerWaalsContact O-CA 3.27Å; L224-K231 WeakPolarHBondContact O-CA 3.49Å; L224-A232 PolarHBondContact N-O 3.43Å; L224-A232 PolarHBondContact O-N 3.44Å; L224-F234 HydrophobicContact CD1-CB 3.63Å; L224-F234 HydrophobicContact CD1-CD2 4.41Å; L224-F234 HydrophobicContact CD1-CG 4.01Å; L224-F234 HydrophobicContact CG-CB 3.76Å; L224-L339 HydrophobicContact CD1-CD2 3.78Å
225	K	89.1	Confident	78	Confident	30 Å²	30	25 Å²	25	13%	0.13	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	122.6	179.5	-169.9	174.2	173.5	-164.8	0	108.6	W126 M149 V190 G191	W126-K225 VanDerWaalsContact CG-NZ 3.3Å; M149-K225 HydrophobicContact CE-CD 4.15Å; M149-K225 HydrophobicContact CE-CG 4.03Å; M149-K225 WeakPolarHBondContact SD-CE 3.41Å; M149-K225 PolarHBondContact SD-NZ 3.04Å; V190-K225 HydrophobicContact CG2-CG 4.41Å; V190-K225 WeakPolarHBondContact CG2-O 3.43Å; V190-K225 PolarHBondContact N-O 3.16Å; G191-K225 PolarHBondContact N-O 3.49Å; G191-K225 PolarHBondContact O-N 3.34Å
226	M	90.5	Very high	80.3	Confident	6 Å²	6	23 Å²	23	3%	0.03	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	159.2	-177.5	-56.1	-57.1	-174.3	0	0	111.2	M149 M187 T188 I189 V190 N228 F229 G230 A232 L339	M149-M226 WeakPolarHBondContact CE-O 3.32Å; M187-M226 HydrophobicContact CG-CB 4.07Å; M187-M226 HydrophobicContact SD-CB 3.73Å; T188-M226 WeakPolarHBondContact O-CA 3.36Å; I189-M226 HydrophobicContact CG1-CE 4.33Å; I189-M226 HydrophobicContact CG1-SD 3.78Å; V190-M226 WeakPolarHBondContact CG2-O 3.19Å; M226-N228 PolarHBondContact O-N 3.2Å; M226-N228 VanDerWaalsContact O-N 3.12Å; M226-F229 PolarHBondContact O-N 3.3Å; M226-G230 PolarHBondContact N-O 2.92Å; M226-A232 HydrophobicContact CE-CB 3.9Å; M226-L339 HydrophobicContact CE-CD1 3.85Å
227	S	89.4	Confident	82.4	Confident	24 Å²	24	24.7 Å²	24.7	17%	0.168	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-24.6	-178.7	49.6	0	0	0	0	114.7	M149 S150 M187 T188 F229	M149-S227 VanDerWaalsContact CG-O 3.29Å; M149-S227 WeakPolarHBondContact CG-O 3.44Å; S150-S227 PolarHBondContact N-O 3.18Å; M187-S227 WeakPolarHBondContact CG-OG 3.45Å; T188-S227 PolarHBondContact O-N 3.19Å; T188-S227 VanDerWaalsContact OG1-CB 3.26Å; T188-S227 WeakPolarHBondContact OG1-CB 3.47Å; T188-S227 PolarHBondContact OG1-OG 3.45Å; S227-F229 VanDerWaalsContact C-N 3.34Å; S227-F229 PolarHBondContact O-N 2.95Å
228	N	89.1	Confident	83.6	Confident	19 Å²	19	24.4 Å²	24.4	10%	0.102	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87	12.4	175.8	73.1	-5.1	0	0	0	115.3	S150 W157 M187 M226 G230	S150-N228 CarbonylContact O-C 3.45Å; S150-N228 WeakPolarHBondContact O-CA 3.31Å; W157-N228 PolarHBondContact NE1-O 3.15Å; M187-N228 HydrophobicContact CE-CB 3.82Å; M187-N228 WeakPolarHBondContact CE-ND2 3.17Å; M187-N228 HydrophobicContact SD-CB 3.53Å; M187-N228 VanDerWaalsContact SD-CB 3.53Å; M187-N228 PolarHBondContact SD-ND2 3.29Å; M187-N228 VanDerWaalsContact SD-ND2 3.38Å; M187-N228 PolarHBondContact SD-OD1 2.85Å; M187-N228 VanDerWaalsContact SD-OD1 3.36Å; M226-N228 PolarHBondContact O-N 3.2Å; M226-N228 VanDerWaalsContact O-N 3.12Å; N228-G230 PolarHBondContact O-N 3.44Å; N228-G230 WeakPolarHBondContact OD1-CA 3.16Å; N228-G230 PolarHBondContact OD1-N 2.76Å
229	F	88.1	Confident	84.2	Confident	16 Å²	16	30.6 Å²	30.6	7%	0.07	15%	0.145	C	C	.	.	S	Bend	trans	74.4	-1.3	-176.1	-144.2	-89.4	0	0	0	116.7	Y119 K122 V123 W126 M149 Y151 W157 M226 S227	Y119-F229 HydrophobicContact CD1-CD1 4.39Å; Y119-F229 HydrophobicContact CD1-CE1 4.26Å; K122-F229 HydrophobicContact CB-CE1 4.07Å; K122-F229 HydrophobicContact CB-CZ 4.08Å; V123-F229 HydrophobicContact CB-CE2 4.31Å; V123-F229 HydrophobicContact CB-CZ 4.48Å; V123-F229 HydrophobicContact CG2-CD1 4.3Å; V123-F229 HydrophobicContact CG2-CD2 3.86Å; V123-F229 HydrophobicContact CG2-CE1 4.1Å; V123-F229 HydrophobicContact CG2-CE2 3.67Å; V123-F229 HydrophobicContact CG2-CG 4.2Å; V123-F229 HydrophobicContact CG2-CZ 3.8Å; W126-F229 HydrophobicContact CB-CE2 4.07Å; W126-F229 HydrophobicContact CB-CZ 4.35Å; W126-F229 HydrophobicContact CD2-CE2 4.48Å; W126-F229 HydrophobicContact CG-CE2 4.23Å; M149-F229 HydrophobicContact CE-CB 3.57Å; M149-F229 HydrophobicContact CE-CD2 3.26Å; M149-F229 HydrophobicContact CE-CE2 4.18Å; M149-F229 HydrophobicContact CE-CG 3.68Å; M149-F229 VanDerWaalsContact CE-N 3.26Å; M149-F229 HydrophobicContact SD-CD2 3.64Å; M149-F229 HydrophobicContact SD-CE2 4.16Å; Y151-F229 HydrophobicContact CD2-CB 4.19Å; Y151-F229 HydrophobicContact CD2-CG 4.45Å; W157-F229 HydrophobicContact CZ2-CB 4.2Å; W157-F229 HydrophobicContact CZ2-CD1 4.48Å; M226-F229 PolarHBondContact O-N 3.3Å; S227-F229 VanDerWaalsContact C-N 3.34Å; S227-F229 PolarHBondContact O-N 2.95Å
230	G	89.3	Confident	84.8	Confident	4 Å²	4	29 Å²	29	4%	0.041	14%	0.137	C	C	.	.			trans	-61.4	153.8	166.7	0	0	0	0	0	111.8	W157 M226 N228	W157-G230 VanDerWaalsContact NE1-N 3.19Å; M226-G230 PolarHBondContact N-O 2.92Å; N228-G230 PolarHBondContact O-N 3.44Å; N228-G230 WeakPolarHBondContact OD1-CA 3.16Å; N228-G230 PolarHBondContact OD1-N 2.76Å
231	K	91.1	Very high	85.3	Confident	114 Å²	114	32.9 Å²	32.9	50%	0.496	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	140.3	172.5	-65.5	-178.8	-178.3	-175.3	0	109.2	L224 Y342	L224-K231 CarbonylContact O-C 3.59Å; L224-K231 VanDerWaalsContact O-CA 3.27Å; L224-K231 WeakPolarHBondContact O-CA 3.49Å; K231-Y342 HydrophobicContact CB-CD2 3.66Å; K231-Y342 HydrophobicContact CB-CE2 4.26Å; K231-Y342 HydrophobicContact CB-CG 3.8Å; K231-Y342 WeakPolarHBondContact O-CB 3.26Å; K231-Y342 WeakPolarHBondContact O-CD2 3.28Å; K231-Y342 PolarHBondContact O-N 3.01Å
232	A	92.7	Very high	85.5	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.008	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	140.7	174.5	0	0	0	0	0	109.8	M184 L224 M226 L339 S340 Y342	M184-A232 HydrophobicContact SD-CB 4.24Å; L224-A232 PolarHBondContact N-O 3.43Å; L224-A232 PolarHBondContact O-N 3.44Å; M226-A232 HydrophobicContact CE-CB 3.9Å; A232-L339 HydrophobicContact CB-CB 4.17Å; A232-L339 HydrophobicContact CB-CD2 3.97Å; A232-S340 CarbonylContact C-O 3.58Å; A232-S340 VanDerWaalsContact CA-O 3.31Å; A232-S340 WeakPolarHBondContact CA-O 3.46Å; A232-Y342 VanDerWaalsContact C-CE2 3.4Å
233	M	91.4	Very high	85.4	Confident	27 Å²	27	38 Å²	38	13%	0.133	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	116.8	173.7	177.6	67.2	83	0	0	107.8	D195 K221 K235 S338 L339 S340 Y342	D195-M233 HydrophobicContact CB-CE 3.79Å; D195-M233 HydrophobicContact CB-SD 4.18Å; D195-M233 WeakPolarHBondContact OD2-CE 3.34Å; K221-M233 HydrophobicContact CB-SD 3.7Å; K221-M233 HydrophobicContact CD-CE 4.06Å; K221-M233 HydrophobicContact CD-SD 4.22Å; K221-M233 HydrophobicContact CG-CE 4.42Å; K221-M233 HydrophobicContact CG-SD 4.04Å; M233-K235 HydrophobicContact CG-CG 4.43Å; M233-S338 VanDerWaalsContact O-O 3.12Å; M233-L339 CarbonylContact O-C 3.26Å; M233-L339 WeakPolarHBondContact O-CA 3.27Å; M233-S340 PolarHBondContact N-O 2.84Å; M233-S340 PolarHBondContact O-N 2.64Å; M233-Y342 HydrophobicContact CB-CD2 4.36Å; M233-Y342 HydrophobicContact CB-CE2 3.79Å; M233-Y342 VanDerWaalsContact CE-OH 3.3Å; M233-Y342 WeakPolarHBondContact CE-OH 3.26Å; M233-Y342 VanDerWaalsContact N-CE2 3.32Å
234	F	91.1	Very high	85.4	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	119.6	175.2	-179.4	-111	0	0	0	110.3	K221 L222 L224 P236 V285 G337 S338 L339	K221-F234 WeakPolarHBondContact CA-O 3.43Å; L222-F234 HydrophobicContact CB-CB 4.3Å; L222-F234 HydrophobicContact CB-CD1 4.47Å; L222-F234 HydrophobicContact CD1-CD1 4.22Å; L222-F234 PolarHBondContact N-O 3.41Å; L222-F234 PolarHBondContact O-N 2.68Å; L224-F234 HydrophobicContact CD1-CB 3.63Å; L224-F234 HydrophobicContact CD1-CD2 4.41Å; L224-F234 HydrophobicContact CD1-CG 4.01Å; L224-F234 HydrophobicContact CG-CB 3.76Å; F234-P236 HydrophobicContact CE1-CB 3.8Å; F234-P236 HydrophobicContact CE1-CG 4.48Å; F234-P236 HydrophobicContact CZ-CB 4.14Å; F234-V285 HydrophobicContact CD2-CG2 4.07Å; F234-V285 HydrophobicContact CE2-CB 4.24Å; F234-V285 HydrophobicContact CE2-CG2 3.57Å; F234-V285 HydrophobicContact CZ-CB 4.16Å; F234-V285 HydrophobicContact CZ-CG2 4Å; F234-G337 VanDerWaalsContact CE2-CA 3.5Å; F234-S338 WeakPolarHBondContact CA-O 3.34Å; F234-L339 HydrophobicContact CB-CD2 3.67Å; F234-L339 HydrophobicContact CD2-CD2 3.7Å; F234-L339 HydrophobicContact CD2-CG 4.25Å; F234-L339 HydrophobicContact CG-CD2 4.15Å
235	K	89	Confident	85.3	Confident	11 Å²	11	43.6 Å²	43.6	5%	0.048	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	112.2	167	-59.2	-168.8	-177.4	-174.5	0	108.1	M233 Q257 E262 G337 S338 D429 A431	M233-K235 HydrophobicContact CG-CG 4.43Å; K235-Q257 VanDerWaalsContact NZ-OE1 3.15Å; K235-E262 HydrophobicContact CD-CG 4.12Å; K235-E262 IonicContact NZ-OE1 3.46Å; K235-E262 PolarHBondContact NZ-OE1 3.38Å; K235-G337 CarbonylContact O-C 3.56Å; K235-G337 WeakPolarHBondContact O-CA 3.42Å; K235-S338 PolarHBondContact N-O 2.64Å; K235-S338 PolarHBondContact O-N 3.02Å; K235-D429 IonicContact NZ-OD1 3.11Å; K235-D429 PolarHBondContact NZ-OD1 2.67Å; K235-A431 HydrophobicContact CD-CB 4.23Å
236	P	87.7	Confident	85	Confident	9 Å²	9	42.5 Å²	42.5	6%	0.058	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	161	-179.6	28.5	-32.1	0	0	0	111.1	L220 F234 S238 V328 L335	L220-P236 HydrophobicContact CB-CG 4.39Å; L220-P236 HydrophobicContact CD2-CG 3.83Å; L220-P236 HydrophobicContact CG-CG 4.08Å; L220-P236 VanDerWaalsContact O-CD 3.23Å; L220-P236 WeakPolarHBondContact O-CD 3.45Å; F234-P236 HydrophobicContact CE1-CB 3.8Å; F234-P236 HydrophobicContact CE1-CG 4.48Å; F234-P236 HydrophobicContact CZ-CB 4.14Å; P236-S238 PolarHBondContact O-N 3.06Å; P236-V328 HydrophobicContact CB-CG1 4.42Å; P236-V328 HydrophobicContact CB-CG2 4.18Å; P236-V328 HydrophobicContact CG-CG1 4.18Å; P236-V328 HydrophobicContact CG-CG2 4.13Å; P236-L335 HydrophobicContact CB-CD2 3.6Å; P236-L335 HydrophobicContact CB-CG 4.16Å
237	M	83.7	Confident	84.8	Confident	44 Å²	44	45 Å²	45	22%	0.217	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-58.4	117.4	161.4	177.9	-173	-166.5	0	0	109.6	Q240 H259 L335 E336	M237-Q240 WeakPolarHBondContact CE-O 3.45Å; M237-H259 WeakPolarHBondContact CA-ND1 3.43Å; M237-H259 WeakPolarHBondContact CB-ND1 3.24Å; M237-L335 HydrophobicContact CB-CD1 4.41Å; M237-E336 HydrophobicContact CB-CG 3.77Å; M237-E336 WeakPolarHBondContact CB-O 3.4Å; M237-E336 HydrophobicContact CG-CG 4.21Å; M237-E336 PolarHBondContact N-O 2.78Å; M237-E336 VanDerWaalsContact SD-CD 3.6Å; M237-E336 HydrophobicContact SD-CG 3.56Å; M237-E336 VanDerWaalsContact SD-CG 3.56Å
238	S	67.2	Low	84.3	Confident	20 Å²	20	47 Å²	47	14%	0.14	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-70.8	165.6	164.2	55.5	0	0	0	0	109.4	P236 Q240 Q257	P236-S238 PolarHBondContact O-N 3.06Å; S238-Q240 PolarHBondContact O-N 3.43Å; S238-Q257 WeakPolarHBondContact CB-O 3.25Å; S238-Q257 PolarHBondContact OG-O 3.48Å
239	R	65.8	Low	84	Confident	175 Å²	175	53.1 Å²	53.1	66%	0.66	27%	0.273	S	S	*	.	S	Bend	trans	-53.6	-4.1	-176.7	-95.1	-172.4	-176.4	139.3	10.3	116.8	E325	R239-E325 PolarHBondContact NH1-O 2.81Å
240	Q	72.9	Confident	83.6	Confident	17 Å²	17	56 Å²	56	8%	0.079	29%	0.285	C	S	.	.			trans	-80.8	125.6	-179.5	-64.7	-169.2	-49.1	0	0	112.1	M237 S238 E244 F256	M237-Q240 WeakPolarHBondContact CE-O 3.45Å; S238-Q240 PolarHBondContact O-N 3.43Å; Q240-E244 VanDerWaalsContact CA-OE2 3.26Å; Q240-E244 WeakPolarHBondContact CA-OE2 3.34Å; Q240-F256 HydrophobicContact CG-CB 4.39Å; Q240-F256 HydrophobicContact CG-CD2 3.98Å; Q240-F256 HydrophobicContact CG-CG 4.32Å
241	Q	81	Confident	83.1	Confident	112 Å²	112	59.7 Å²	59.7	52%	0.523	30%	0.3	S	S	.	.			trans	-70.2	167.9	170	-59.1	-170.2	23.4	0	0	111.3	D243 E244	Q241-D243 VanDerWaalsContact C-N 3.26Å; Q241-D243 VanDerWaalsContact CB-OD1 3.26Å; Q241-D243 WeakPolarHBondContact CB-OD1 3.42Å; Q241-D243 PolarHBondContact O-N 2.89Å; Q241-E244 HydrophobicContact CB-CG 3.98Å; Q241-E244 WeakPolarHBondContact CG-OE1 3.09Å; Q241-E244 PolarHBondContact N-OE2 3.24Å; Q241-E244 PolarHBondContact O-N 3.19Å
242	R	84.2	Confident	82.3	Confident	50 Å²	50	55.7 Å²	55.7	19%	0.189	28%	0.283	C	S	.	.	S	Bend	trans	-67.4	-28.5	-173.5	-64.4	-179.7	-178.5	-82.8	-16.1	112.8	H259 N260 E336 L485 P487 T490	R242-H259 PolarHBondContact NH2-NE2 2.81Å; R242-N260 PolarHBondContact NH1-OD1 3.36Å; R242-E336 IonicContact CZ-OE1 2.72Å; R242-E336 IonicContact CZ-OE2 3.75Å; R242-E336 IonicContact NE-OE1 3.51Å; R242-E336 IonicContact NH2-OE1 3.6Å; R242-E336 PolarHBondContact NH2-OE1 3.38Å; R242-E336 IonicContact NH2-OE2 2.82Å; R242-E336 PolarHBondContact NH2-OE2 2.89Å; R242-L485 PolarHBondContact NH1-O 2.89Å; R242-P487 PolarHBondContact NH1-O 3.48Å; R242-T490 HydrophobicContact CB-CG2 4.05Å; R242-T490 VanDerWaalsContact O-CG2 3.32Å; R242-T490 WeakPolarHBondContact O-CG2 3.36Å
243	D	83.5	Confident	81.4	Confident	101 Å²	101	56.2 Å²	56.2	54%	0.54	28%	0.284	S	S	.	.	S	Bend	trans	-92.1	-13.8	-179.5	57.1	-49.3	0	0	0	113.4	Q241 E245	Q241-D243 VanDerWaalsContact C-N 3.26Å; Q241-D243 VanDerWaalsContact CB-OD1 3.26Å; Q241-D243 WeakPolarHBondContact CB-OD1 3.42Å; Q241-D243 PolarHBondContact O-N 2.89Å; D243-E245 PolarHBondContact O-N 3.19Å
244	E	86.4	Confident	80.6	Confident	74 Å²	74	58 Å²	58	35%	0.346	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-73.7	119.8	-178.5	-75.4	174.7	-165.3	0	0	111.9	Q240 Q241 R258	Q240-E244 VanDerWaalsContact CA-OE2 3.26Å; Q240-E244 WeakPolarHBondContact CA-OE2 3.34Å; Q241-E244 HydrophobicContact CB-CG 3.98Å; Q241-E244 WeakPolarHBondContact CG-OE1 3.09Å; Q241-E244 PolarHBondContact N-OE2 3.24Å; Q241-E244 PolarHBondContact O-N 3.19Å; E244-R258 PolarHBondContact O-NH1 3.3Å; E244-R258 PolarHBondContact O-NH2 3.2Å
245	E	87.3	Confident	79.8	Confident	61 Å²	61	58.9 Å²	58.9	29%	0.285	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-80.6	145.2	169.2	-62.5	-160.5	-116.1	0	0	110.9	D243 G435 K436 H437 S438	D243-E245 PolarHBondContact O-N 3.19Å; E245-G435 CarbonylContact C-O 3.47Å; E245-G435 VanDerWaalsContact CA-O 3.31Å; E245-G435 WeakPolarHBondContact CA-O 3.43Å; E245-K436 VanDerWaalsContact OE2-CA 3.3Å; E245-K436 WeakPolarHBondContact OE2-CA 2.93Å; E245-H437 VanDerWaalsContact CD-CE1 3.46Å; E245-H437 IonicContact OE1-CD2 3.31Å; E245-H437 IonicContact OE1-CE1 2.67Å; E245-H437 PolarHBondContact OE1-CE1 3.02Å; E245-H437 IonicContact OE1-CG 3.36Å; E245-H437 IonicContact OE1-ND1 3.42Å; E245-H437 PolarHBondContact OE1-ND1 3.17Å; E245-H437 IonicContact OE1-NE2 3.42Å; E245-H437 PolarHBondContact OE1-NE2 3.38Å; E245-H437 IonicContact OE2-CG 2.68Å; E245-H437 PolarHBondContact OE2-N 3.31Å; E245-H437 IonicContact OE2-ND1 3.72Å; E245-S438 VanDerWaalsContact CD-OG 3.3Å; E245-S438 WeakPolarHBondContact OE1-CB 3.37Å; E245-S438 PolarHBondContact OE1-OG 3.33Å; E245-S438 PolarHBondContact OE2-N 2.95Å; E245-S438 VanDerWaalsContact OE2-N 3.08Å; E245-S438 PolarHBondContact OE2-OG 2.81Å
246	T	83.8	Confident	79.3	Confident	7 Å²	7	61.2 Å²	61.2	4%	0.043	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-63.3	133	170	-62.5	0	0	0	0	108.7	F250 D255 R258 G435 K436	T246-F250 HydrophobicContact CG2-CB 3.69Å; T246-F250 HydrophobicContact CG2-CD2 4.3Å; T246-F250 HydrophobicContact CG2-CG 4.21Å; T246-D255 WeakPolarHBondContact CB-OD1 3.34Å; T246-D255 HydrophobicContact CG2-CB 4.43Å; T246-D255 WeakPolarHBondContact CG2-OD1 3.35Å; T246-D255 PolarHBondContact OG1-OD1 2.86Å; T246-R258 PolarHBondContact OG1-NH2 2.84Å; T246-G435 PolarHBondContact N-O 3.35Å; T246-K436 WeakPolarHBondContact O-CE 3.47Å
247	P	85.8	Confident	79.1	Confident	59 Å²	59	62.2 Å²	62.2	38%	0.383	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-58	155.6	-178.7	-25.3	33.9	0	0	0	113.5	D249 F250 K436	P247-D249 VanDerWaalsContact C-N 3.28Å; P247-D249 PolarHBondContact O-N 3.14Å; P247-F250 HydrophobicContact CB-CD1 3.66Å; P247-F250 HydrophobicContact CB-CE1 4.05Å; P247-F250 HydrophobicContact CB-CG 4.36Å; P247-F250 HydrophobicContact CG-CD1 3.78Å; P247-F250 HydrophobicContact CG-CE1 3.78Å; P247-F250 HydrophobicContact CG-CG 4.35Å; P247-F250 HydrophobicContact CG-CZ 4.35Å; P247-F250 PolarHBondContact O-N 3.48Å; P247-K436 VanDerWaalsContact O-CE 3.28Å; P247-K436 WeakPolarHBondContact O-CE 3.14Å; P247-K436 PolarHBondContact O-NZ 2.8Å
248	G	80	Confident	79.2	Confident	66 Å²	66	60.8 Å²	60.8	68%	0.68	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-42.1	178.4	0	0	0	0	0	112.8	F250	G248-F250 VanDerWaalsContact C-N 3.26Å; G248-F250 PolarHBondContact O-N 2.83Å
249	D	82.2	Confident	80.3	Confident	147 Å²	147	60 Å²	60	79%	0.786	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-9.9	-173.5	-54.3	-27.5	0	0	0	113.9	P247 F251	P247-D249 VanDerWaalsContact C-N 3.28Å; P247-D249 PolarHBondContact O-N 3.14Å; D249-F251 PolarHBondContact O-N 3.23Å
250	F	79.6	Confident	81.7	Confident	77 Å²	77	52.4 Å²	52.4	34%	0.338	28%	0.275	S	S	.	.			trans	-76.2	120.6	-179.1	-85.9	48.8	0	0	0	110	T246 P247 G248 V254 F256	T246-F250 HydrophobicContact CG2-CB 3.69Å; T246-F250 HydrophobicContact CG2-CD2 4.3Å; T246-F250 HydrophobicContact CG2-CG 4.21Å; P247-F250 HydrophobicContact CB-CD1 3.66Å; P247-F250 HydrophobicContact CB-CE1 4.05Å; P247-F250 HydrophobicContact CB-CG 4.36Å; P247-F250 HydrophobicContact CG-CD1 3.78Å; P247-F250 HydrophobicContact CG-CE1 3.78Å; P247-F250 HydrophobicContact CG-CG 4.35Å; P247-F250 HydrophobicContact CG-CZ 4.35Å; P247-F250 PolarHBondContact O-N 3.48Å; G248-F250 VanDerWaalsContact C-N 3.26Å; G248-F250 PolarHBondContact O-N 2.83Å; F250-V254 HydrophobicContact CD2-CG1 4.08Å; F250-V254 HydrophobicContact CE2-CG1 4.26Å; F250-F256 AromaticContact CE2-CE2 3.84Å; F250-F256 HydrophobicContact CE2-CE2 3.84Å; F250-F256 HydrophobicContact CE2-CZ 4.46Å
251	F	77.9	Confident	82.7	Confident	81 Å²	81	51.6 Å²	51.6	36%	0.355	27%	0.271	S	S	.	.			trans	-65.6	146.7	169.4	-72.3	-97.8	0	0	0	110.1	D249 F253 V254 D255 F364	D249-F251 PolarHBondContact O-N 3.23Å; F251-F253 HydrophobicContact CB-CD1 4.06Å; F251-F253 HydrophobicContact CB-CE1 3.68Å; F251-F253 HydrophobicContact CB-CE2 4.18Å; F251-F253 HydrophobicContact CB-CG 4.46Å; F251-F253 HydrophobicContact CB-CZ 3.75Å; F251-F253 AromaticContact CD1-CE1 3.99Å; F251-F253 HydrophobicContact CD1-CE1 3.99Å; F251-F253 HydrophobicContact CD1-CZ 4.27Å; F251-F253 HydrophobicContact CG-CE1 4.06Å; F251-F253 HydrophobicContact CG-CZ 4.03Å; F251-F253 PolarHBondContact O-N 3.28Å; F251-V254 HydrophobicContact CB-CG2 4.21Å; F251-V254 WeakPolarHBondContact O-CA 3.49Å; F251-V254 WeakPolarHBondContact O-CB 3.18Å; F251-V254 PolarHBondContact O-N 3.1Å; F251-D255 PolarHBondContact O-N 3.29Å; F251-F364 HydrophobicContact CD1-CD1 4.08Å; F251-F364 AromaticContact CD2-CD1 3.6Å; F251-F364 HydrophobicContact CD2-CD1 3.6Å; F251-F364 AromaticContact CD2-CE1 3.56Å; F251-F364 HydrophobicContact CD2-CE1 3.56Å; F251-F364 AromaticContact CE1-CD1 3.92Å; F251-F364 HydrophobicContact CE1-CD1 3.92Å; F251-F364 AromaticContact CE2-CD1 3.44Å; F251-F364 HydrophobicContact CE2-CD1 3.44Å; F251-F364 VanDerWaalsContact CE2-CD1 3.44Å; F251-F364 AromaticContact CE2-CE1 3.8Å; F251-F364 HydrophobicContact CE2-CE1 3.8Å; F251-F364 AromaticContact CG-CD1 3.93Å; F251-F364 HydrophobicContact CG-CD1 3.93Å; F251-F364 AromaticContact CG-CE1 4Å; F251-F364 HydrophobicContact CG-CE1 4Å; F251-F364 HydrophobicContact CZ-CB 4.45Å; F251-F364 AromaticContact CZ-CD1 3.61Å; F251-F364 HydrophobicContact CZ-CD1 3.61Å; F251-F364 HydrophobicContact CZ-CE1 4.41Å
252	Y	75.9	Confident	83.3	Confident	31 Å²	31	46.6 Å²	46.6	12%	0.122	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-26.3	-175.8	56.5	-90.2	0	0	0	114.1	R360 S361 Y362 M408 R432	Y252-R360 HydrophobicContact CE1-CB 4.32Å; Y252-R360 HydrophobicContact CE2-CB 3.78Å; Y252-R360 HydrophobicContact CE2-CG 4.37Å; Y252-R360 WeakPolarHBondContact OH-CB 3.38Å; Y252-S361 PolarHBondContact OH-N 3.36Å; Y252-S361 PolarHBondContact OH-O 3.5Å; Y252-Y362 HydrophobicContact CD2-CE1 4.33Å; Y252-Y362 HydrophobicContact CE2-CD1 4.09Å; Y252-Y362 AromaticContact CE2-CE1 3.74Å; Y252-Y362 HydrophobicContact CE2-CE1 3.74Å; Y252-M408 HydrophobicContact CD1-CE 4.02Å; Y252-M408 HydrophobicContact CG-CB 4.27Å; Y252-M408 HydrophobicContact CG-CE 4.26Å; Y252-R432 PolarHBondContact O-NH1 2.83Å
253	F	73.1	Confident	83.9	Confident	11 Å²	11	44.2 Å²	44.2	5%	0.048	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-14.3	176	59	-103.5	0	0	0	114.1	P215 F251 Y362 F364 R432	P215-F253 HydrophobicContact CB-CB 4.25Å; P215-F253 HydrophobicContact CB-CD2 3.65Å; P215-F253 HydrophobicContact CB-CE2 4.39Å; P215-F253 HydrophobicContact CB-CG 4.23Å; P215-F253 HydrophobicContact CG-CB 4.08Å; P215-F253 HydrophobicContact CG-CD2 3.72Å; P215-F253 HydrophobicContact CG-CE2 4.34Å; P215-F253 HydrophobicContact CG-CG 3.94Å; F251-F253 HydrophobicContact CB-CD1 4.06Å; F251-F253 HydrophobicContact CB-CE1 3.68Å; F251-F253 HydrophobicContact CB-CE2 4.18Å; F251-F253 HydrophobicContact CB-CG 4.46Å; F251-F253 HydrophobicContact CB-CZ 3.75Å; F251-F253 AromaticContact CD1-CE1 3.99Å; F251-F253 HydrophobicContact CD1-CE1 3.99Å; F251-F253 HydrophobicContact CD1-CZ 4.27Å; F251-F253 HydrophobicContact CG-CE1 4.06Å; F251-F253 HydrophobicContact CG-CZ 4.03Å; F251-F253 PolarHBondContact O-N 3.28Å; F253-Y362 HydrophobicContact CB-CD1 3.65Å; F253-Y362 HydrophobicContact CB-CE1 3.93Å; F253-Y362 HydrophobicContact CD1-CD1 4.22Å; F253-Y362 HydrophobicContact CG-CD1 4.21Å; F253-F364 AromaticContact CE2-CE1 3.94Å; F253-F364 HydrophobicContact CE2-CE1 3.94Å; F253-F364 AromaticContact CE2-CZ 4Å; F253-F364 HydrophobicContact CE2-CZ 4Å; F253-F364 AromaticContact CZ-CD1 3.83Å; F253-F364 HydrophobicContact CZ-CD1 3.83Å; F253-F364 AromaticContact CZ-CE1 3.55Å; F253-F364 HydrophobicContact CZ-CE1 3.55Å; F253-F364 HydrophobicContact CZ-CG 4.46Å; F253-F364 AromaticContact CZ-CZ 3.94Å; F253-F364 HydrophobicContact CZ-CZ 3.94Å; F253-R432 PolarHBondContact O-NH1 3.32Å; F253-R432 PolarHBondContact O-NH2 2.98Å
254	V	74.2	Confident	84.5	Confident	66 Å²	66	39.4 Å²	39.4	40%	0.4	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-18.7	173.7	-175.9	0	0	0	0	111.4	F250 F251	F250-V254 HydrophobicContact CD2-CG1 4.08Å; F250-V254 HydrophobicContact CE2-CG1 4.26Å; F251-V254 HydrophobicContact CB-CG2 4.21Å; F251-V254 WeakPolarHBondContact O-CA 3.49Å; F251-V254 WeakPolarHBondContact O-CB 3.18Å; F251-V254 PolarHBondContact O-N 3.1Å
255	D	74.9	Confident	85	Confident	17 Å²	17	35.9 Å²	35.9	9%	0.091	20%	0.196	C	C	.	.	S	Bend	trans	-53.6	146.2	-178.8	-161.4	11.7	0	0	0	112.9	T246 F251 R432	T246-D255 WeakPolarHBondContact CB-OD1 3.34Å; T246-D255 HydrophobicContact CG2-CB 4.43Å; T246-D255 WeakPolarHBondContact CG2-OD1 3.35Å; T246-D255 PolarHBondContact OG1-OD1 2.86Å; F251-D255 PolarHBondContact O-N 3.29Å; D255-R432 PolarHBondContact O-NH1 2.93Å
256	F	78.4	Confident	85.5	Confident	60 Å²	60	33 Å²	33	26%	0.263	18%	0.183	S	C	.	.	P	Polyproline II helix	trans	-77.4	144.3	-178	-65.4	-79.8	0	0	0	110.7	Q240 F250	Q240-F256 HydrophobicContact CG-CB 4.39Å; Q240-F256 HydrophobicContact CG-CD2 3.98Å; Q240-F256 HydrophobicContact CG-CG 4.32Å; F250-F256 AromaticContact CE2-CE2 3.84Å; F250-F256 HydrophobicContact CE2-CE2 3.84Å; F250-F256 HydrophobicContact CE2-CZ 4.46Å
257	Q	82.4	Confident	86.1	Confident	31 Å²	31	33 Å²	33	15%	0.145	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-77.7	126.8	168.9	-74	-165.3	35.5	0	0	110	H219 K235 S238 A431 R432	H219-Q257 HydrophobicContact CB-CB 4.3Å; H219-Q257 HydrophobicContact CB-CG 4.15Å; H219-Q257 PolarHBondContact CD2-NE2 3.41Å; K235-Q257 VanDerWaalsContact NZ-OE1 3.15Å; S238-Q257 WeakPolarHBondContact CB-O 3.25Å; S238-Q257 PolarHBondContact OG-O 3.48Å; Q257-A431 HydrophobicContact CB-CB 3.58Å; Q257-A431 HydrophobicContact CG-CB 3.69Å; Q257-R432 HydrophobicContact CG-CG 4.2Å
258	R	86.9	Confident	86.7	Confident	14 Å²	14	30.2 Å²	30.2	5%	0.053	16%	0.164	C	C	.	.			trans	-109.6	131.1	-178.4	-58.2	176.8	-178.2	-134.1	0.6	110	E244 T246 N260 A261 A431 G435	E244-R258 PolarHBondContact O-NH1 3.3Å; E244-R258 PolarHBondContact O-NH2 3.2Å; T246-R258 PolarHBondContact OG1-NH2 2.84Å; R258-N260 VanDerWaalsContact C-N 3.31Å; R258-N260 PolarHBondContact O-N 3.49Å; R258-A261 HydrophobicContact CB-CB 4.14Å; R258-A261 PolarHBondContact O-N 3.27Å; R258-A431 PolarHBondContact N-O 2.98Å; R258-G435 PolarHBondContact NH2-O 3.38Å
259	H	91.2	Very high	87.4	Confident	4 Å²	4	27 Å²	27	2%	0.019	13%	0.132	C	C	.	.	H	α-helix	trans	-64.1	-37.4	173.4	70.6	-78.6	0	0	0	112.2	M237 R242 A261 E262 I263 E336	M237-H259 WeakPolarHBondContact CA-ND1 3.43Å; M237-H259 WeakPolarHBondContact CB-ND1 3.24Å; R242-H259 PolarHBondContact NH2-NE2 2.81Å; H259-A261 PolarHBondContact O-N 2.98Å; H259-E262 PolarHBondContact O-N 3.2Å; H259-I263 PolarHBondContact O-N 3.04Å; H259-E336 IonicContact CE1-OE1 2.81Å; H259-E336 PolarHBondContact CE1-OE1 2.91Å; H259-E336 IonicContact NE2-OE1 3.81Å
260	N	93.4	Very high	88	Confident	15 Å²	15	22 Å²	22	8%	0.08	10%	0.102	C	C	.	.	H	α-helix	trans	-56.5	-38	176.8	-66.8	-33	0	0	0	112.3	R242 R258 I263 A264 V488	R242-N260 PolarHBondContact NH1-OD1 3.36Å; R258-N260 VanDerWaalsContact C-N 3.31Å; R258-N260 PolarHBondContact O-N 3.49Å; N260-I263 PolarHBondContact O-N 3.38Å; N260-A264 VanDerWaalsContact O-CB 3.24Å; N260-A264 WeakPolarHBondContact O-CB 2.92Å; N260-A264 PolarHBondContact O-N 2.91Å; N260-V488 HydrophobicContact CB-CG1 4.18Å; N260-V488 WeakPolarHBondContact CB-O 3.04Å; N260-V488 VanDerWaalsContact CG-O 3.27Å; N260-V488 PolarHBondContact OD1-O 3.13Å
261	A	94.3	Very high	88.8	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-68.8	-37.8	-178	0	0	0	0	0	112.3	R258 H259 A265 N430 G433 F434	R258-A261 HydrophobicContact CB-CB 4.14Å; R258-A261 PolarHBondContact O-N 3.27Å; H259-A261 PolarHBondContact O-N 2.98Å; A261-A265 WeakPolarHBondContact O-CB 3.47Å; A261-A265 PolarHBondContact O-N 2.83Å; A261-N430 WeakPolarHBondContact CB-O 3.36Å; A261-G433 WeakPolarHBondContact CB-O 3.18Å; A261-F434 HydrophobicContact CB-CB 4.47Å; A261-F434 HydrophobicContact CB-CD2 4.06Å
262	E	94.6	Very high	89.6	Confident	6 Å²	6	14.6 Å²	14.6	3%	0.028	7%	0.069	C	C	.	.	H	α-helix	trans	-65.8	-42.8	175.7	-66.4	-71	-173.1	0	0	112	K235 H259 F266 V280 D429 N430 A431	K235-E262 HydrophobicContact CD-CG 4.12Å; K235-E262 IonicContact NZ-OE1 3.46Å; K235-E262 PolarHBondContact NZ-OE1 3.38Å; H259-E262 PolarHBondContact O-N 3.2Å; E262-F266 PolarHBondContact O-N 2.94Å; E262-V280 HydrophobicContact CB-CG1 4.12Å; E262-D429 WeakPolarHBondContact OE1-CA 3.06Å; E262-N430 VanDerWaalsContact CD-N 3.35Å; E262-N430 PolarHBondContact OE1-N 2.95Å; E262-N430 WeakPolarHBondContact OE2-CB 3.37Å; E262-N430 PolarHBondContact OE2-N 2.89Å; E262-N430 VanDerWaalsContact OE2-N 3.09Å; E262-A431 HydrophobicContact CG-CB 3.84Å; E262-A431 WeakPolarHBondContact OE1-CB 3.39Å; E262-A431 PolarHBondContact OE1-N 3.47Å
263	I	96.2	Very high	90.5	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-64.4	-53.2	177.6	-58.6	162.2	0	0	0	109.1	H259 N260 A265 F266 H267 V280 L480 L485 V488	H259-I263 PolarHBondContact O-N 3.04Å; N260-I263 PolarHBondContact O-N 3.38Å; I263-A265 VanDerWaalsContact C-N 3.31Å; I263-A265 PolarHBondContact O-N 3.05Å; I263-F266 PolarHBondContact O-N 3.37Å; I263-H267 PolarHBondContact O-CD2 2.92Å; I263-H267 VanDerWaalsContact O-CD2 3.24Å; I263-H267 PolarHBondContact O-N 3.36Å; I263-V280 HydrophobicContact CG1-CG1 3.9Å; I263-L480 HydrophobicContact CG2-CD2 4.24Å; I263-L485 HydrophobicContact CD1-CD1 3.99Å; I263-V488 HydrophobicContact CB-CG1 3.93Å; I263-V488 HydrophobicContact CD1-CG1 4.42Å; I263-V488 HydrophobicContact CG2-CG1 3.94Å; I263-V488 HydrophobicContact CG2-CG2 4.16Å
264	A	96.8	Very high	91.4	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-62.2	-36.8	-179.5	0	0	0	0	0	113.5	N260 H267 L268 F434 M476 L489	N260-A264 VanDerWaalsContact O-CB 3.24Å; N260-A264 WeakPolarHBondContact O-CB 2.92Å; N260-A264 PolarHBondContact O-N 2.91Å; A264-H267 PolarHBondContact O-N 3.38Å; A264-L268 WeakPolarHBondContact O-CB 3.47Å; A264-L268 PolarHBondContact O-N 3.14Å; A264-F434 HydrophobicContact CB-CD2 4.02Å; A264-F434 HydrophobicContact CB-CE2 3.49Å; A264-F434 VanDerWaalsContact CB-CE2 3.49Å; A264-F434 HydrophobicContact CB-CZ 3.88Å; A264-M476 HydrophobicContact CB-CE 4.12Å; A264-L489 HydrophobicContact CB-CD1 3.72Å; A264-L489 HydrophobicContact CB-CD2 3.84Å; A264-L489 HydrophobicContact CB-CG 3.78Å
265	A	97.3	Very high	92.4	Very high	0 Å²	0	12 Å²	12	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-60.6	-43.6	175.4	0	0	0	0	0	111.9	A261 I263 L268 D269 F401 N430	A261-A265 WeakPolarHBondContact O-CB 3.47Å; A261-A265 PolarHBondContact O-N 2.83Å; I263-A265 VanDerWaalsContact C-N 3.31Å; I263-A265 PolarHBondContact O-N 3.05Å; A265-L268 PolarHBondContact O-N 2.85Å; A265-D269 VanDerWaalsContact O-CB 3.25Å; A265-D269 WeakPolarHBondContact O-CB 3.47Å; A265-D269 PolarHBondContact O-N 3.13Å; A265-F401 HydrophobicContact CB-CZ 3.83Å; A265-F401 WeakPolarHBondContact O-CE2 3.32Å; A265-F401 WeakPolarHBondContact O-CZ 3.37Å; A265-N430 HydrophobicContact CB-CB 3.42Å; A265-N430 VanDerWaalsContact CB-CB 3.42Å
266	F	96.9	Very high	93.4	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-62	-46.6	175.5	166	-112.9	0	0	0	112.1	Y170 I177 L181 E262 I263 L268 D269 R270 V277 P278 P279 V280	Y170-F266 AromaticContact CE1-CE2 3.97Å; Y170-F266 HydrophobicContact CE1-CE2 3.97Å; Y170-F266 AromaticContact CZ-CE2 3.77Å; I177-F266 HydrophobicContact CG2-CZ 4.31Å; L181-F266 HydrophobicContact CD1-CE1 3.86Å; L181-F266 HydrophobicContact CD1-CZ 4.21Å; L181-F266 HydrophobicContact CD2-CD1 4.48Å; L181-F266 HydrophobicContact CD2-CE1 3.79Å; L181-F266 HydrophobicContact CD2-CZ 4.29Å; L181-F266 HydrophobicContact CG-CE1 4.43Å; E262-F266 PolarHBondContact O-N 2.94Å; I263-F266 PolarHBondContact O-N 3.37Å; F266-L268 PolarHBondContact O-N 3.07Å; F266-D269 PolarHBondContact O-N 2.74Å; F266-R270 WeakPolarHBondContact O-CB 2.99Å; F266-R270 PolarHBondContact O-N 3.24Å; F266-V277 HydrophobicContact CB-CG1 3.98Å; F266-P278 WeakPolarHBondContact CD2-O 3.39Å; F266-P279 HydrophobicContact CE2-CB 4.18Å; F266-P279 HydrophobicContact CE2-CG 4.33Å; F266-P279 HydrophobicContact CZ-CB 4.16Å; F266-V280 HydrophobicContact CB-CB 3.98Å; F266-V280 HydrophobicContact CB-CG2 3.99Å; F266-V280 WeakPolarHBondContact CD1-O 3.26Å; F266-V280 HydrophobicContact CG-CB 4.39Å
267	H	96.4	Very high	94.2	Very high	8 Å²	8	9.1 Å²	9.1	4%	0.037	4%	0.039	C	C	.	.	H	α-helix	trans	-65.5	-38.8	179	-76	-111.3	0	0	0	112.2	I263 A264 R270 I271 M476 S479 L480	I263-H267 PolarHBondContact O-CD2 2.92Å; I263-H267 VanDerWaalsContact O-CD2 3.24Å; I263-H267 PolarHBondContact O-N 3.36Å; A264-H267 PolarHBondContact O-N 3.38Å; H267-R270 PolarHBondContact ND1-NH2 3.25Å; H267-R270 WeakPolarHBondContact O-CB 3.3Å; H267-R270 PolarHBondContact O-N 2.81Å; H267-I271 VanDerWaalsContact O-CG1 3.32Å; H267-I271 WeakPolarHBondContact O-CG1 3.29Å; H267-I271 PolarHBondContact O-N 3.22Å; H267-M476 HydrophobicContact CB-CE 4.04Å; H267-M476 HydrophobicContact CB-SD 3.74Å; H267-S479 PolarHBondContact CE1-O 2.87Å; H267-S479 PolarHBondContact ND1-O 3.41Å; H267-S479 PolarHBondContact ND1-OG 3.34Å; H267-L480 HydrophobicContact CB-CD2 3.99Å
268	L	97.4	Very high	94.9	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-66.7	-43.4	176	-179.7	64	0	0	0	111.9	A264 A265 F266 R270 I271 L272 F401 L404 I405 L472 M476 L497	A264-L268 WeakPolarHBondContact O-CB 3.47Å; A264-L268 PolarHBondContact O-N 3.14Å; A265-L268 PolarHBondContact O-N 2.85Å; F266-L268 PolarHBondContact O-N 3.07Å; L268-R270 PolarHBondContact O-N 2.78Å; L268-I271 PolarHBondContact O-N 3.19Å; L268-I271 VanDerWaalsContact O-N 3.15Å; L268-L272 HydrophobicContact CD1-CD1 4.09Å; L268-L272 HydrophobicContact CD1-CG 4.17Å; L268-L272 HydrophobicContact CG-CD1 3.93Å; L268-L272 HydrophobicContact CG-CG 4.4Å; L268-L272 WeakPolarHBondContact O-CB 3.32Å; L268-L272 WeakPolarHBondContact O-CG 3.44Å; L268-L272 PolarHBondContact O-N 2.02Å; L268-F401 HydrophobicContact CB-CE2 4.26Å; L268-F401 HydrophobicContact CD2-CD2 4.22Å; L268-F401 HydrophobicContact CD2-CE2 4.1Å; L268-F401 HydrophobicContact CG-CD2 4.4Å; L268-F401 HydrophobicContact CG-CE2 4.17Å; L268-L404 HydrophobicContact CD2-CB 3.97Å; L268-I405 HydrophobicContact CD2-CG2 3.43Å; L268-I405 VanDerWaalsContact CD2-CG2 3.43Å; L268-L472 HydrophobicContact CD1-CD1 3.85Å; L268-L472 HydrophobicContact CD1-CD2 4.35Å; L268-M476 HydrophobicContact CB-SD 4.23Å; L268-M476 HydrophobicContact CD1-CG 4.42Å; L268-L497 HydrophobicContact CD2-CD2 4.29Å
269	D	96.6	Very high	95.3	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-59.8	-37.1	176	178.9	81.8	0	0	0	111.7	A265 F266 D273 F274 R275 R276 V277 F401 H427	A265-D269 VanDerWaalsContact O-CB 3.25Å; A265-D269 WeakPolarHBondContact O-CB 3.47Å; A265-D269 PolarHBondContact O-N 3.13Å; F266-D269 PolarHBondContact O-N 2.74Å; D269-D273 PolarHBondContact O-N 3.22Å; D269-F274 PolarHBondContact O-N 3.38Å; D269-F274 WeakPolarHBondContact OD1-CB 3.44Å; D269-R275 WeakPolarHBondContact OD2-CA 3.4Å; D269-R275 PolarHBondContact OD2-N 2.86Å; D269-R276 PolarHBondContact OD1-N 3.24Å; D269-R276 PolarHBondContact OD2-N 3Å; D269-V277 HydrophobicContact CB-CB 4.01Å; D269-V277 HydrophobicContact CB-CG2 3.5Å; D269-V277 PolarHBondContact OD2-N 3Å; D269-V277 VanDerWaalsContact OD2-N 3.08Å; D269-F401 HydrophobicContact CB-CE2 3.83Å; D269-F401 HydrophobicContact CB-CZ 4.25Å; D269-H427 IonicContact OD1-ND1 3.99Å; D269-H427 PolarHBondContact OD1-ND1 3.22Å
270	R	94.6	Very high	95.6	Very high	41 Å²	41	7.3 Å²	7.3	16%	0.155	3%	0.032	C	C	.	.	H	α-helix	trans	-67.3	-42.4	173.2	-171.4	174	69	-180	1	112.5	F91 Y170 F266 H267 L268 D273 S479	F91-R270 HydrophobicContact CZ-CG 4.35Å; Y170-R270 HydrophobicContact CE2-CG 4.48Å; F266-R270 WeakPolarHBondContact O-CB 2.99Å; F266-R270 PolarHBondContact O-N 3.24Å; H267-R270 PolarHBondContact ND1-NH2 3.25Å; H267-R270 WeakPolarHBondContact O-CB 3.3Å; H267-R270 PolarHBondContact O-N 2.81Å; L268-R270 PolarHBondContact O-N 2.78Å; R270-D273 PolarHBondContact O-N 3.04Å; R270-S479 PolarHBondContact NH2-OG 2.88Å
271	I	95.3	Very high	95.7	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	3%	0.028	C	C	.	.	H	α-helix	trans	-69.5	-35.6	178.7	-72.5	167.3	0	0	0	112	L87 L90 Y96 H267 L268 D273 L465 L472 V475 M476	L87-I271 HydrophobicContact CD1-CG1 4.31Å; L90-I271 HydrophobicContact CD2-CG2 3.93Å; Y96-I271 WeakPolarHBondContact CE1-O 3.29Å; Y96-I271 PolarHBondContact OH-O 2.96Å; H267-I271 VanDerWaalsContact O-CG1 3.32Å; H267-I271 WeakPolarHBondContact O-CG1 3.29Å; H267-I271 PolarHBondContact O-N 3.22Å; L268-I271 PolarHBondContact O-N 3.19Å; L268-I271 VanDerWaalsContact O-N 3.15Å; I271-D273 PolarHBondContact O-N 3.05Å; I271-L465 HydrophobicContact CG2-CD1 4.16Å; I271-L465 HydrophobicContact CG2-CD2 3.82Å; I271-L472 HydrophobicContact CG2-CD1 3.89Å; I271-V475 HydrophobicContact CD1-CB 4.46Å; I271-V475 HydrophobicContact CD1-CG2 4.15Å; I271-V475 HydrophobicContact CG2-CG2 3.88Å; I271-M476 HydrophobicContact CD1-CB 4.3Å; I271-M476 HydrophobicContact CD1-CG 3.66Å; I271-M476 HydrophobicContact CD1-SD 3.46Å; I271-M476 WeakPolarHBondContact CD1-SD 3.03Å
272	L	95.1	Very high	95.8	Very high	3 Å²	3	6.6 Å²	6.6	2%	0.016	3%	0.028	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-6.3	174.2	-66.6	173	0	0	0	112.9	L268 F274 F401 L404 R461 L462 L465	L268-L272 HydrophobicContact CD1-CD1 4.09Å; L268-L272 HydrophobicContact CD1-CG 4.17Å; L268-L272 HydrophobicContact CG-CD1 3.93Å; L268-L272 HydrophobicContact CG-CG 4.4Å; L268-L272 WeakPolarHBondContact O-CB 3.32Å; L268-L272 WeakPolarHBondContact O-CG 3.44Å; L268-L272 PolarHBondContact O-N 2.02Å; L272-F274 HydrophobicContact CB-CD1 4.48Å; L272-F274 HydrophobicContact CB-CD2 3.89Å; L272-F274 HydrophobicContact CB-CE2 3.95Å; L272-F274 HydrophobicContact CB-CG 4.16Å; L272-F274 HydrophobicContact CB-CZ 4.29Å; L272-F274 HydrophobicContact CD1-CD2 4.11Å; L272-F274 HydrophobicContact CD1-CE2 3.71Å; L272-F274 HydrophobicContact CD1-CZ 4.44Å; L272-F274 HydrophobicContact CG-CE2 4.44Å; L272-F274 PolarHBondContact O-N 2.96Å; L272-F401 HydrophobicContact CD1-CD2 4.14Å; L272-L404 HydrophobicContact CD1-CD1 3.8Å; L272-L404 HydrophobicContact CD2-CD1 4.37Å; L272-R461 VanDerWaalsContact O-CD 3.31Å; L272-R461 WeakPolarHBondContact O-CD 3.25Å; L272-L462 HydrophobicContact CD2-CD2 3.83Å; L272-L465 HydrophobicContact CD2-CD1 3.68Å
273	D	93.7	Very high	95.8	Very high	10 Å²	10	7.1 Å²	7.1	5%	0.053	3%	0.03	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	28.3	-178.7	-156.4	48.8	0	0	0	113.7	Y96 D269 R270 I271 R275 R461	Y96-D273 HydrophobicContact CD1-CB 3.95Å; Y96-D273 HydrophobicContact CE1-CB 3.81Å; D269-D273 PolarHBondContact O-N 3.22Å; R270-D273 PolarHBondContact O-N 3.04Å; I271-D273 PolarHBondContact O-N 3.05Å; D273-R275 IonicContact OD1-CZ 2.84Å; D273-R275 IonicContact OD1-NH1 3.7Å; D273-R275 PolarHBondContact OD1-NH1 3.47Å; D273-R275 IonicContact OD2-NH1 3.88Å; D273-R275 PolarHBondContact OD2-NH1 3.23Å; D273-R461 IonicContact OD2-CZ 2.66Å; D273-R461 IonicContact OD2-NE 2.94Å; D273-R461 IonicContact OD2-NH2 2.6Å; D273-R461 PolarHBondContact OD2-NH2 2.69Å
274	F	93.4	Very high	95.7	Very high	8 Å²	8	14.5 Å²	14.5	4%	0.035	6%	0.058	C	C	.	.			trans	-78.5	-44.2	176	-70.3	-23.4	0	0	0	111.5	D269 L272 R276 D397 F401 T458	D269-F274 PolarHBondContact O-N 3.38Å; D269-F274 WeakPolarHBondContact OD1-CB 3.44Å; L272-F274 HydrophobicContact CB-CD1 4.48Å; L272-F274 HydrophobicContact CB-CD2 3.89Å; L272-F274 HydrophobicContact CB-CE2 3.95Å; L272-F274 HydrophobicContact CB-CG 4.16Å; L272-F274 HydrophobicContact CB-CZ 4.29Å; L272-F274 HydrophobicContact CD1-CD2 4.11Å; L272-F274 HydrophobicContact CD1-CE2 3.71Å; L272-F274 HydrophobicContact CD1-CZ 4.44Å; L272-F274 HydrophobicContact CG-CE2 4.44Å; L272-F274 PolarHBondContact O-N 2.96Å; F274-R276 VanDerWaalsContact C-N 3.35Å; F274-R276 HydrophobicContact CB-CG 4.44Å; F274-R276 WeakPolarHBondContact O-CG 3.49Å; F274-R276 PolarHBondContact O-N 3.02Å; F274-D397 HydrophobicContact CE1-CB 3.97Å; F274-D397 HydrophobicContact CE2-CB 4.41Å; F274-D397 HydrophobicContact CZ-CB 3.86Å; F274-F401 HydrophobicContact CD2-CB 4.42Å; F274-F401 HydrophobicContact CD2-CD2 4.48Å; F274-F401 HydrophobicContact CE2-CB 4.07Å; F274-T458 HydrophobicContact CE1-CG2 3.92Å; F274-T458 HydrophobicContact CZ-CG2 3.86Å
275	R	94.7	Very high	95.5	Very high	34 Å²	34	14.5 Å²	14.5	13%	0.128	6%	0.058	C	C	.	.			trans	55.9	46.2	177.4	-51.1	179.4	-58.7	-99	-7.9	112.4	A168 L169 Y170 D269 D273	A168-R275 HydrophobicContact CB-CB 3.92Å; L169-R275 WeakPolarHBondContact CB-O 3.36Å; L169-R275 PolarHBondContact N-O 3.19Å; Y170-R275 HydrophobicContact CD1-CB 4.43Å; Y170-R275 HydrophobicContact CD2-CB 4.3Å; Y170-R275 HydrophobicContact CD2-CG 4.28Å; Y170-R275 HydrophobicContact CE1-CB 4.07Å; Y170-R275 HydrophobicContact CE2-CB 3.95Å; Y170-R275 HydrophobicContact CE2-CG 3.75Å; Y170-R275 VanDerWaalsContact O-CD 3.32Å; Y170-R275 WeakPolarHBondContact O-CD 3.42Å; Y170-R275 PolarHBondContact O-NE 3.16Å; D269-R275 WeakPolarHBondContact OD2-CA 3.4Å; D269-R275 PolarHBondContact OD2-N 2.86Å; D273-R275 IonicContact OD1-CZ 2.84Å; D273-R275 IonicContact OD1-NH1 3.7Å; D273-R275 PolarHBondContact OD1-NH1 3.47Å; D273-R275 IonicContact OD2-NH1 3.88Å; D273-R275 PolarHBondContact OD2-NH1 3.23Å
276	R	95.4	Very high	95.2	Very high	16 Å²	16	17.1 Å²	17.1	6%	0.06	7%	0.072	C	C	.	.			trans	-118.3	-8.5	-175.6	-70.3	172.7	-164.5	172.9	12.4	113.6	L169 D269 F274 D397 L424 L425 H427	L169-R276 VanDerWaalsContact CD1-C 3.5Å; L169-R276 VanDerWaalsContact CD1-O 3.26Å; L169-R276 WeakPolarHBondContact CD1-O 3.3Å; D269-R276 PolarHBondContact OD1-N 3.24Å; D269-R276 PolarHBondContact OD2-N 3Å; F274-R276 VanDerWaalsContact C-N 3.35Å; F274-R276 HydrophobicContact CB-CG 4.44Å; F274-R276 WeakPolarHBondContact O-CG 3.49Å; F274-R276 PolarHBondContact O-N 3.02Å; R276-D397 IonicContact CZ-OD2 2.74Å; R276-D397 IonicContact NH1-OD2 3.8Å; R276-D397 IonicContact NH2-OD2 3.51Å; R276-D397 PolarHBondContact NH2-OD2 2.77Å; R276-L424 HydrophobicContact CG-CD1 4.32Å; R276-L425 WeakPolarHBondContact CB-O 3.3Å; R276-L425 VanDerWaalsContact CD-O 3.3Å; R276-L425 WeakPolarHBondContact CD-O 3.46Å; R276-L425 VanDerWaalsContact CG-O 3.31Å; R276-L425 WeakPolarHBondContact CG-O 3.29Å; R276-H427 HydrophobicContact CB-CB 4.31Å; R276-H427 WeakPolarHBondContact CD-NE2 3.32Å; R276-H427 PolarHBondContact O-N 2.84Å
277	V	96.4	Very high	94.9	Very high	1 Å²	1	17.1 Å²	17.1	1%	0.006	7%	0.072	C	C	.	.	S	Bend	trans	-95.8	132.7	172.4	-176.6	0	0	0	0	109.3	Y170 F266 D269 F401 H427	Y170-V277 WeakPolarHBondContact CE1-O 3.43Å; F266-V277 HydrophobicContact CB-CG1 3.98Å; D269-V277 HydrophobicContact CB-CB 4.01Å; D269-V277 HydrophobicContact CB-CG2 3.5Å; D269-V277 PolarHBondContact OD2-N 3Å; D269-V277 VanDerWaalsContact OD2-N 3.08Å; V277-F401 HydrophobicContact CG2-CE1 4.37Å; V277-F401 HydrophobicContact CG2-CZ 3.92Å; V277-H427 HydrophobicContact CG2-CB 3.54Å
278	P	96	Very high	94.5	Very high	10 Å²	10	17.6 Å²	17.6	7%	0.065	8%	0.076	C	C	.	.	P	Polyproline II helix	trans	-57.7	151.5	172.6	-22.7	33	0	0	0	111.9	L169 F266 V280 L343 L428	L169-P278 HydrophobicContact CD1-CG 4.21Å; F266-P278 WeakPolarHBondContact CD2-O 3.39Å; P278-V280 VanDerWaalsContact O-CG2 3.3Å; P278-V280 WeakPolarHBondContact O-CG2 3.47Å; P278-V280 PolarHBondContact O-N 2.96Å; P278-L343 HydrophobicContact CG-CD1 4.43Å; P278-L343 HydrophobicContact CG-CD2 4.16Å; P278-L343 HydrophobicContact CG-CG 4.16Å; P278-L428 HydrophobicContact CG-CD2 3.51Å
279	P	96.8	Very high	94	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.092	C	C	.	.	P	Polyproline II helix	trans	-54.7	129.4	175.1	-28	36.9	0	0	0	112.3	F160 I177 L180 L181 M184 F266 A341	F160-P279 HydrophobicContact CD2-CG 4.38Å; F160-P279 HydrophobicContact CE2-CG 4.17Å; F160-P279 HydrophobicContact CZ-CG 4.38Å; I177-P279 HydrophobicContact CD1-CG 4.07Å; I177-P279 HydrophobicContact CG2-CB 4.36Å; I177-P279 HydrophobicContact CG2-CG 3.99Å; L180-P279 HydrophobicContact CD2-CB 4.24Å; L180-P279 HydrophobicContact CD2-CG 4.1Å; L181-P279 HydrophobicContact CD2-CB 3.96Å; M184-P279 HydrophobicContact CE-CB 4.27Å; F266-P279 HydrophobicContact CE2-CB 4.18Å; F266-P279 HydrophobicContact CE2-CG 4.33Å; F266-P279 HydrophobicContact CZ-CB 4.16Å; P279-A341 HydrophobicContact CB-CB 4.31Å; P279-A341 WeakPolarHBondContact O-CB 3.46Å; P279-A341 PolarHBondContact O-N 3.15Å
280	V	96.7	Very high	93.5	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.006	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	133.3	178.5	-171.2	0	0	0	0	109.7	L181 E262 I263 F266 P278 L339 S340	L181-V280 WeakPolarHBondContact CD2-O 3.18Å; E262-V280 HydrophobicContact CB-CG1 4.12Å; I263-V280 HydrophobicContact CG1-CG1 3.9Å; F266-V280 HydrophobicContact CB-CB 3.98Å; F266-V280 HydrophobicContact CB-CG2 3.99Å; F266-V280 WeakPolarHBondContact CD1-O 3.26Å; F266-V280 HydrophobicContact CG-CB 4.39Å; P278-V280 VanDerWaalsContact O-CG2 3.3Å; P278-V280 WeakPolarHBondContact O-CG2 3.47Å; P278-V280 PolarHBondContact O-N 2.96Å; V280-L339 VanDerWaalsContact CA-O 3.3Å; V280-L339 WeakPolarHBondContact CA-O 3.37Å; V280-S340 WeakPolarHBondContact CG2-OG 3.1Å
281	A	96.1	Very high	93.1	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.008	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	147.4	173.8	0	0	0	0	0	111	L181 M184 Q185 L339	L181-A281 HydrophobicContact CD2-CB 4.02Å; M184-A281 HydrophobicContact CB-CB 4.46Å; M184-A281 HydrophobicContact CE-CB 4.17Å; Q185-A281 HydrophobicContact CG-CB 3.79Å; A281-L339 PolarHBondContact N-O 3.42Å; A281-L339 PolarHBondContact O-N 3.18Å
282	G	95.5	Very high	92.6	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	146.6	169.7	0	0	0	0	0	112.4	D483 P484 L485	G282-D483 WeakPolarHBondContact CA-OD1 3.38Å; G282-D483 PolarHBondContact N-OD1 3.31Å; G282-D483 PolarHBondContact N-OD2 3.12Å; G282-P484 WeakPolarHBondContact O-CG 3.27Å; G282-L485 VanDerWaalsContact CA-CD1 3.43Å
283	R	94.8	Very high	92.1	Very high	16 Å²	16	27.9 Å²	27.9	6%	0.06	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	143.8	170.3	-175.2	178.3	177.1	155.1	-4.2	111.2	M184 Q185 M187 V285 E290 G337 L339	M184-R283 PolarHBondContact O-NH1 3.01Å; Q185-R283 WeakPolarHBondContact O-CD 3.47Å; Q185-R283 PolarHBondContact O-NE 3.48Å; Q185-R283 PolarHBondContact O-NH1 2.89Å; M187-R283 VanDerWaalsContact O-CZ 3.24Å; M187-R283 PolarHBondContact O-NH1 3.03Å; M187-R283 PolarHBondContact O-NH2 3.32Å; R283-V285 HydrophobicContact CB-CG2 4.37Å; R283-V285 HydrophobicContact CG-CG2 4.01Å; R283-E290 IonicContact CZ-OE1 2.81Å; R283-E290 IonicContact NH2-OE1 3.67Å; R283-E290 PolarHBondContact NH2-OE1 3.42Å; R283-G337 PolarHBondContact N-O 3.49Å; R283-G337 PolarHBondContact O-N 2.76Å; R283-L339 HydrophobicContact CB-CD1 3.79Å; R283-L339 HydrophobicContact CB-CG 4.34Å; R283-L339 HydrophobicContact CG-CD1 4.33Å
284	R	93.8	Very high	91.5	Very high	156 Å²	156	27.8 Å²	27.8	59%	0.589	14%	0.135	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-89.2	113	163.7	-64.1	-179.1	-179.4	159.3	1.4	108.2	E336 L485	R284-E336 HydrophobicContact CG-CB 4.38Å; R284-L485 HydrophobicContact CG-CD2 3.79Å
285	V	92.3	Very high	90.9	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	131.5	-177.1	178.9	0	0	0	0	108.6	I189 F234 R283 V287 E290 V291 L335	I189-V285 HydrophobicContact CD1-CG1 4.07Å; I189-V285 HydrophobicContact CD1-CG2 4.43Å; F234-V285 HydrophobicContact CD2-CG2 4.07Å; F234-V285 HydrophobicContact CE2-CB 4.24Å; F234-V285 HydrophobicContact CE2-CG2 3.57Å; F234-V285 HydrophobicContact CZ-CB 4.16Å; F234-V285 HydrophobicContact CZ-CG2 4Å; R283-V285 HydrophobicContact CB-CG2 4.37Å; R283-V285 HydrophobicContact CG-CG2 4.01Å; V285-V287 PolarHBondContact O-N 3.15Å; V285-E290 WeakPolarHBondContact CA-OE2 3.43Å; V285-E290 HydrophobicContact CG1-CB 3.96Å; V285-V291 HydrophobicContact CG1-CG2 3.74Å; V285-L335 PolarHBondContact N-O 3Å; V285-L335 PolarHBondContact O-N 2.88Å
286	N	92	Very high	89.8	Confident	55 Å²	55	30.5 Å²	30.5	29%	0.294	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	102	169	-178.3	-25.7	0	0	0	108.5	S288 G289 E290 D333 L334	N286-S288 PolarHBondContact O-N 3.09Å; N286-S288 WeakPolarHBondContact OD1-CB 3.37Å; N286-S288 PolarHBondContact OD1-N 2.92Å; N286-S288 VanDerWaalsContact OD1-N 3.16Å; N286-G289 PolarHBondContact O-N 3.05Å; N286-G289 PolarHBondContact OD1-N 3.23Å; N286-E290 HydrophobicContact CB-CG 4.23Å; N286-E290 PolarHBondContact N-OE2 3.13Å; N286-E290 WeakPolarHBondContact O-CA 3.36Å; N286-E290 VanDerWaalsContact O-CB 3.29Å; N286-E290 WeakPolarHBondContact O-CB 3.49Å; N286-E290 PolarHBondContact O-N 3.18Å; N286-D333 CarbonylContact C-O 3.55Å; N286-D333 WeakPolarHBondContact CA-O 3.45Å; N286-L334 HydrophobicContact CB-CD2 4.07Å
287	V	90	Very high	88.8	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.157	C	C	.	.	I	π-helix	trans	-65.7	-28.6	-173.2	-62.9	0	0	0	0	112.4	V285 V291 L292 F304 T312 F314 D333 L335	V285-V287 PolarHBondContact O-N 3.15Å; V287-V291 WeakPolarHBondContact O-CB 3.43Å; V287-V291 PolarHBondContact O-N 3.09Å; V287-L292 PolarHBondContact O-N 2.67Å; V287-F304 HydrophobicContact CB-CE1 4.35Å; V287-T312 HydrophobicContact CG2-CG2 3.94Å; V287-F314 HydrophobicContact CB-CE1 4.31Å; V287-F314 HydrophobicContact CG1-CE1 3.83Å; V287-D333 VanDerWaalsContact CG2-O 3.29Å; V287-D333 WeakPolarHBondContact CG2-O 3.48Å; V287-D333 PolarHBondContact N-O 3.42Å; V287-L335 HydrophobicContact CG1-CB 3.56Å; V287-L335 HydrophobicContact CG1-CD2 3.86Å; V287-L335 HydrophobicContact CG1-CG 4.37Å
288	S	87.9	Confident	87.8	Confident	18 Å²	18	39.3 Å²	39.3	13%	0.126	19%	0.193	C	C	.	.	I	π-helix	trans	-69.9	-64.5	173.6	-67.1	0	0	0	0	109.6	N286 L292 H293 T312 D333	N286-S288 PolarHBondContact O-N 3.09Å; N286-S288 WeakPolarHBondContact OD1-CB 3.37Å; N286-S288 PolarHBondContact OD1-N 2.92Å; N286-S288 VanDerWaalsContact OD1-N 3.16Å; S288-L292 WeakPolarHBondContact O-CB 3.42Å; S288-L292 PolarHBondContact O-N 2.79Å; S288-H293 VanDerWaalsContact C-ND1 3.29Å; S288-H293 PolarHBondContact O-N 3.06Å; S288-H293 PolarHBondContact O-ND1 3.31Å; S288-T312 WeakPolarHBondContact OG-CG2 3.33Å; S288-T312 PolarHBondContact OG-OG1 2.82Å; S288-D333 PolarHBondContact OG-OD1 3.12Å
289	G	85.9	Confident	86.7	Confident	32 Å²	32	42.1 Å²	42.1	33%	0.33	21%	0.208	S	C	.	.	I	π-helix	trans	-70.5	-42.7	-173.2	0	0	0	0	0	115.1	N286	N286-G289 PolarHBondContact O-N 3.05Å; N286-G289 PolarHBondContact OD1-N 3.23Å
290	E	86.2	Confident	85.8	Confident	45 Å²	45	42.4 Å²	42.4	21%	0.21	21%	0.209	C	C	.	.	I	π-helix	trans	-99.9	-5.9	-170.5	-62.1	-177.1	111.4	0	0	114.1	I189 R283 V285 N286 V294	I189-E290 HydrophobicContact CB-CB 4.33Å; I189-E290 HydrophobicContact CD1-CB 3.86Å; I189-E290 HydrophobicContact CD1-CG 4.45Å; I189-E290 VanDerWaalsContact CG2-O 3.31Å; I189-E290 WeakPolarHBondContact CG2-O 3.5Å; R283-E290 IonicContact CZ-OE1 2.81Å; R283-E290 IonicContact NH2-OE1 3.67Å; R283-E290 PolarHBondContact NH2-OE1 3.42Å; V285-E290 WeakPolarHBondContact CA-OE2 3.43Å; V285-E290 HydrophobicContact CG1-CB 3.96Å; N286-E290 HydrophobicContact CB-CG 4.23Å; N286-E290 PolarHBondContact N-OE2 3.13Å; N286-E290 WeakPolarHBondContact O-CA 3.36Å; N286-E290 VanDerWaalsContact O-CB 3.29Å; N286-E290 WeakPolarHBondContact O-CB 3.49Å; N286-E290 PolarHBondContact O-N 3.18Å; E290-V294 WeakPolarHBondContact O-CG2 3.28Å
291	V	86.4	Confident	85	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.231	C	C	.	.	I	π-helix	trans	-123.4	-62.3	175.5	-174.8	0	0	0	0	111	A192 L222 V285 V287 V294 A295 F304	A192-V291 HydrophobicContact CB-CB 4.48Å; A192-V291 HydrophobicContact CB-CG1 3.82Å; L222-V291 HydrophobicContact CD1-CG1 3.64Å; L222-V291 HydrophobicContact CD1-CG2 4.45Å; V285-V291 HydrophobicContact CG1-CG2 3.74Å; V287-V291 WeakPolarHBondContact O-CB 3.43Å; V287-V291 PolarHBondContact O-N 3.09Å; V291-V294 WeakPolarHBondContact O-CG2 3.19Å; V291-V294 PolarHBondContact O-N 3.02Å; V291-A295 VanDerWaalsContact O-CB 3.28Å; V291-A295 WeakPolarHBondContact O-CB 3.19Å; V291-A295 PolarHBondContact O-N 3.49Å; V291-F304 HydrophobicContact CB-CZ 4.33Å; V291-F304 HydrophobicContact CG1-CE2 4.47Å; V291-F304 HydrophobicContact CG1-CZ 3.78Å
292	L	85.1	Confident	84.3	Confident	46 Å²	46	52.1 Å²	52.1	24%	0.241	26%	0.263	C	S	.	.	I	π-helix	trans	-64.3	-47.5	-174.2	176.9	59.8	0	0	0	112.6	V287 S288 V294 A295 R301 F304	V287-L292 PolarHBondContact O-N 2.67Å; S288-L292 WeakPolarHBondContact O-CB 3.42Å; S288-L292 PolarHBondContact O-N 2.79Å; L292-V294 VanDerWaalsContact C-N 3.27Å; L292-V294 PolarHBondContact O-N 3.29Å; L292-A295 PolarHBondContact O-N 3.24Å; L292-R301 HydrophobicContact CD1-CB 4.31Å; L292-R301 HydrophobicContact CD1-CG 4.21Å; L292-F304 HydrophobicContact CB-CD1 4.07Å; L292-F304 HydrophobicContact CB-CE1 3.95Å; L292-F304 HydrophobicContact CB-CG 4.41Å; L292-F304 HydrophobicContact CB-CZ 4.2Å; L292-F304 HydrophobicContact CD1-CB 4.07Å; L292-F304 HydrophobicContact CD1-CD1 4.27Å; L292-F304 HydrophobicContact CD1-CD2 3.79Å; L292-F304 HydrophobicContact CD1-CE2 4.31Å; L292-F304 HydrophobicContact CD1-CG 3.78Å; L292-F304 HydrophobicContact CD2-CB 4.29Å; L292-F304 HydrophobicContact CD2-CD1 4.11Å; L292-F304 HydrophobicContact CD2-CG 4.23Å; L292-F304 HydrophobicContact CG-CD1 4.38Å; L292-F304 HydrophobicContact CG-CG 4.36Å
293	H	84.4	Confident	83.6	Confident	137 Å²	137	52.6 Å²	52.6	63%	0.634	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-24.2	-179.5	-70.2	90.7	0	0	0	113.4	S288	S288-H293 VanDerWaalsContact C-ND1 3.29Å; S288-H293 PolarHBondContact O-N 3.06Å; S288-H293 PolarHBondContact O-ND1 3.31Å
294	V	82.2	Confident	83.1	Confident	7 Å²	7	53.1 Å²	53.1	4%	0.042	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-2.4	-178.8	-47.9	0	0	0	0	113.1	Q147 I189 A192 E290 V291 L292 H296	Q147-V294 VanDerWaalsContact NE2-CB 3.29Å; I189-V294 HydrophobicContact CG2-CG2 4.23Å; A192-V294 HydrophobicContact CB-CG2 4.06Å; E290-V294 WeakPolarHBondContact O-CG2 3.28Å; V291-V294 WeakPolarHBondContact O-CG2 3.19Å; V291-V294 PolarHBondContact O-N 3.02Å; L292-V294 VanDerWaalsContact C-N 3.27Å; L292-V294 PolarHBondContact O-N 3.29Å; V294-H296 PolarHBondContact O-N 3.27Å
295	A	80.4	Confident	82.9	Confident	5 Å²	5	48.9 Å²	48.9	4%	0.041	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-76.7	115.5	178	0	0	0	0	0	110.3	V291 L292 N297 L300 R301	V291-A295 VanDerWaalsContact O-CB 3.28Å; V291-A295 WeakPolarHBondContact O-CB 3.19Å; V291-A295 PolarHBondContact O-N 3.49Å; L292-A295 PolarHBondContact O-N 3.24Å; A295-N297 VanDerWaalsContact C-N 3.33Å; A295-L300 HydrophobicContact CB-CD2 3.89Å; A295-L300 HydrophobicContact CB-CG 4.27Å; A295-R301 HydrophobicContact CB-CG 3.94Å; A295-R301 WeakPolarHBondContact O-CD 3.35Å
296	H	72.3	Confident	82.8	Confident	95 Å²	95	53.1 Å²	53.1	44%	0.44	28%	0.281	S	S	.	.			trans	-85.2	-9.9	170.9	-58.4	-73.6	0	0	0	112.9	F133 V294	F133-H296 AromaticContact CD1-ND1 3.98Å; F133-H296 AromaticContact CE1-CE1 3.82Å; F133-H296 AromaticContact CE1-ND1 3.4Å; F133-H296 WeakPolarHBondContact CE1-ND1 3.4Å; F133-H296 AromaticContact CZ-ND1 3.55Å; V294-H296 PolarHBondContact O-N 3.27Å
297	N	73.8	Confident	82.6	Confident	39 Å²	39	51.4 Å²	51.4	21%	0.209	27%	0.273	C	S	.	.			trans	-89.4	118.9	-176.5	-179.7	-65	0	0	0	110.2	A295 D299 L300 R301	A295-N297 VanDerWaalsContact C-N 3.33Å; N297-D299 PolarHBondContact O-N 2.95Å; N297-D299 WeakPolarHBondContact OD1-CA 3.32Å; N297-D299 VanDerWaalsContact OD1-CB 3.27Å; N297-D299 WeakPolarHBondContact OD1-CB 3.5Å; N297-D299 PolarHBondContact OD1-N 3.41Å; N297-L300 HydrophobicContact CB-CB 4.13Å; N297-L300 PolarHBondContact O-N 2.85Å; N297-L300 PolarHBondContact OD1-N 3.43Å; N297-R301 WeakPolarHBondContact O-CG 3.43Å; N297-R301 PolarHBondContact O-N 3.07Å; N297-R301 VanDerWaalsContact O-N 3.08Å
298	E	75.3	Confident	82.6	Confident	163 Å²	163	58.5 Å²	58.5	76%	0.762	32%	0.319	S	S	*	.	H	α-helix	trans	-64.1	-37.1	-179	-66.8	-176.1	171.8	0	0	113	L300 R301 A302	E298-L300 VanDerWaalsContact C-N 3.3Å; E298-L300 PolarHBondContact O-N 3.41Å; E298-R301 PolarHBondContact O-N 2.73Å; E298-A302 VanDerWaalsContact O-CB 3.31Å; E298-A302 WeakPolarHBondContact O-CB 3.38Å; E298-A302 PolarHBondContact O-N 2.77Å
299	D	73	Confident	82.7	Confident	69 Å²	69	61.1 Å²	61.1	37%	0.369	34%	0.342	S	S	.	.	H	α-helix	trans	-61.9	-38.7	175.7	-71.5	-63.5	0	0	0	111.7	N297 K317	N297-D299 PolarHBondContact O-N 2.95Å; N297-D299 WeakPolarHBondContact OD1-CA 3.32Å; N297-D299 VanDerWaalsContact OD1-CB 3.27Å; N297-D299 WeakPolarHBondContact OD1-CB 3.5Å; N297-D299 PolarHBondContact OD1-N 3.41Å; D299-K317 IonicContact OD1-NZ 2.85Å; D299-K317 PolarHBondContact OD1-NZ 3.35Å
300	L	77.4	Confident	82.9	Confident	5 Å²	5	65.5 Å²	65.5	3%	0.026	36%	0.358	C	S	.	.	H	α-helix	trans	-68.3	-41.3	175.3	-176.8	54.9	0	0	0	111.2	A192 P194 L222 A295 N297 E298 A302 V303 F304	A192-L300 HydrophobicContact CB-CD2 4.19Å; P194-L300 HydrophobicContact CG-CB 3.72Å; P194-L300 HydrophobicContact CG-CD1 4.17Å; P194-L300 HydrophobicContact CG-CD2 4.23Å; P194-L300 HydrophobicContact CG-CG 4.23Å; L222-L300 HydrophobicContact CD2-CD1 3.77Å; L222-L300 HydrophobicContact CD2-CD2 4.23Å; A295-L300 HydrophobicContact CB-CD2 3.89Å; A295-L300 HydrophobicContact CB-CG 4.27Å; N297-L300 HydrophobicContact CB-CB 4.13Å; N297-L300 PolarHBondContact O-N 2.85Å; N297-L300 PolarHBondContact OD1-N 3.43Å; E298-L300 VanDerWaalsContact C-N 3.3Å; E298-L300 PolarHBondContact O-N 3.41Å; L300-A302 VanDerWaalsContact C-N 3.32Å; L300-A302 PolarHBondContact O-N 2.74Å; L300-V303 HydrophobicContact CD1-CG2 4.22Å; L300-V303 WeakPolarHBondContact O-CG2 3.48Å; L300-F304 HydrophobicContact CD1-CE2 3.98Å; L300-F304 HydrophobicContact CG-CE2 4.14Å; L300-F304 WeakPolarHBondContact O-CD2 3.46Å; L300-F304 WeakPolarHBondContact O-CE2 3.23Å
301	R	81.1	Confident	83.1	Confident	124 Å²	124	65.5 Å²	65.5	47%	0.468	36%	0.359	S	S	.	.	H	α-helix	trans	-66.5	-36.1	178.4	-66.6	177.6	74.3	-177.6	1.7	111.8	L292 A295 N297 E298 V303 F304	L292-R301 HydrophobicContact CD1-CB 4.31Å; L292-R301 HydrophobicContact CD1-CG 4.21Å; A295-R301 HydrophobicContact CB-CG 3.94Å; A295-R301 WeakPolarHBondContact O-CD 3.35Å; N297-R301 WeakPolarHBondContact O-CG 3.43Å; N297-R301 PolarHBondContact O-N 3.07Å; N297-R301 VanDerWaalsContact O-N 3.08Å; E298-R301 PolarHBondContact O-N 2.73Å; R301-V303 VanDerWaalsContact C-N 3.26Å; R301-V303 PolarHBondContact O-N 2.83Å; R301-F304 PolarHBondContact O-N 2.88Å
302	A	80.7	Confident	83.3	Confident	82 Å²	82	66.5 Å²	66.5	68%	0.678	37%	0.365	S	S	*	.	H	α-helix	trans	-68.9	-19	-177.3	0	0	0	0	0	114.3	E298 L300	E298-A302 VanDerWaalsContact O-CB 3.31Å; E298-A302 WeakPolarHBondContact O-CB 3.38Å; E298-A302 PolarHBondContact O-N 2.77Å; L300-A302 VanDerWaalsContact C-N 3.32Å; L300-A302 PolarHBondContact O-N 2.74Å
303	V	80.1	Confident	83.4	Confident	10 Å²	10	64.3 Å²	64.3	6%	0.061	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-2.1	178.9	-64.9	0	0	0	0	113.7	L300 R301 F314 F315 K317	L300-V303 HydrophobicContact CD1-CG2 4.22Å; L300-V303 WeakPolarHBondContact O-CG2 3.48Å; R301-V303 VanDerWaalsContact C-N 3.26Å; R301-V303 PolarHBondContact O-N 2.83Å; V303-F314 WeakPolarHBondContact O-CA 3.15Å; V303-F315 HydrophobicContact CB-CD1 4.1Å; V303-F315 HydrophobicContact CB-CE1 4Å; V303-F315 HydrophobicContact CB-CZ 4.37Å; V303-F315 VanDerWaalsContact CB-O 3.27Å; V303-F315 WeakPolarHBondContact CB-O 3.14Å; V303-F315 HydrophobicContact CG1-CE1 4.27Å; V303-F315 HydrophobicContact CG1-CE2 4.37Å; V303-F315 HydrophobicContact CG1-CZ 4.13Å; V303-F315 VanDerWaalsContact CG2-O 3.25Å; V303-F315 WeakPolarHBondContact CG2-O 3.34Å; V303-F315 WeakPolarHBondContact O-CD1 3.41Å; V303-K317 HydrophobicContact CG1-CB 4.1Å
304	F	85.8	Confident	83.4	Confident	27 Å²	27	57.8 Å²	57.8	12%	0.118	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	139.4	173.3	-78.8	-103.1	0	0	0	111	V287 V291 L292 L300 R301 T312 C313 F314	V287-F304 HydrophobicContact CB-CE1 4.35Å; V291-F304 HydrophobicContact CB-CZ 4.33Å; V291-F304 HydrophobicContact CG1-CE2 4.47Å; V291-F304 HydrophobicContact CG1-CZ 3.78Å; L292-F304 HydrophobicContact CB-CD1 4.07Å; L292-F304 HydrophobicContact CB-CE1 3.95Å; L292-F304 HydrophobicContact CB-CG 4.41Å; L292-F304 HydrophobicContact CB-CZ 4.2Å; L292-F304 HydrophobicContact CD1-CB 4.07Å; L292-F304 HydrophobicContact CD1-CD1 4.27Å; L292-F304 HydrophobicContact CD1-CD2 3.79Å; L292-F304 HydrophobicContact CD1-CE2 4.31Å; L292-F304 HydrophobicContact CD1-CG 3.78Å; L292-F304 HydrophobicContact CD2-CB 4.29Å; L292-F304 HydrophobicContact CD2-CD1 4.11Å; L292-F304 HydrophobicContact CD2-CG 4.23Å; L292-F304 HydrophobicContact CG-CD1 4.38Å; L292-F304 HydrophobicContact CG-CG 4.36Å; L300-F304 HydrophobicContact CD1-CE2 3.98Å; L300-F304 HydrophobicContact CG-CE2 4.14Å; L300-F304 WeakPolarHBondContact O-CD2 3.46Å; L300-F304 WeakPolarHBondContact O-CE2 3.23Å; R301-F304 PolarHBondContact O-N 2.88Å; F304-T312 HydrophobicContact CD1-CG2 3.97Å; F304-T312 HydrophobicContact CE1-CG2 4.49Å; F304-C313 CarbonylContact C-O 3.52Å; F304-C313 VanDerWaalsContact CA-O 3.27Å; F304-C313 WeakPolarHBondContact CA-O 3.26Å; F304-F314 HydrophobicContact CD1-CB 3.78Å; F304-F314 HydrophobicContact CD1-CD1 4.45Å; F304-F314 HydrophobicContact CD1-CG 4.38Å; F304-F314 HydrophobicContact CD2-CB 3.86Å; F304-F314 HydrophobicContact CE1-CB 3.75Å; F304-F314 AromaticContact CE1-CD1 3.76Å; F304-F314 HydrophobicContact CE1-CD1 3.76Å; F304-F314 AromaticContact CE1-CG 3.84Å; F304-F314 HydrophobicContact CE1-CG 3.84Å; F304-F314 HydrophobicContact CE2-CB 3.82Å; F304-F314 HydrophobicContact CE2-CD2 4.36Å; F304-F314 HydrophobicContact CE2-CG 4.11Å; F304-F314 HydrophobicContact CG-CB 3.83Å; F304-F314 HydrophobicContact CZ-CB 3.76Å; F304-F314 AromaticContact CZ-CD1 3.93Å; F304-F314 HydrophobicContact CZ-CD1 3.93Å; F304-F314 HydrophobicContact CZ-CD2 4.11Å; F304-F314 AromaticContact CZ-CG 3.68Å; F304-F314 HydrophobicContact CZ-CG 3.68Å
305	F	88.1	Confident	83.2	Confident	67 Å²	67	59.3 Å²	59.3	29%	0.294	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	158.9	175.7	67.3	-83.4	0	0	0	110.8	C313 F315 A327	F305-C313 HydrophobicContact CD1-CB 4.25Å; F305-C313 HydrophobicContact CD2-CB 4.3Å; F305-C313 HydrophobicContact CE1-CB 3.8Å; F305-C313 HydrophobicContact CE2-CB 3.86Å; F305-C313 HydrophobicContact CG-CB 4.49Å; F305-C313 HydrophobicContact CZ-CB 3.59Å; F305-C313 PolarHBondContact N-O 3.08Å; F305-C313 PolarHBondContact O-N 3.22Å; F305-F315 HydrophobicContact CD1-CD1 4.19Å; F305-F315 HydrophobicContact CD1-CE1 4.41Å; F305-F315 AromaticContact CE1-CD1 3.87Å; F305-F315 HydrophobicContact CE1-CD1 3.87Å; F305-F315 HydrophobicContact CE1-CE1 4.43Å; F305-A327 HydrophobicContact CE1-CB 3.68Å; F305-A327 HydrophobicContact CZ-CB 3.55Å
306	T	90.3	Very high	82.5	Confident	90 Å²	90	60.6 Å²	60.6	55%	0.552	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92	128.6	174.4	-50.5	0	0	0	0	109.6	N311	T306-N311 CarbonylContact C-O 3.58Å; T306-N311 WeakPolarHBondContact CA-O 3.45Å
307	S	88.4	Confident	81.8	Confident	19 Å²	19	61.7 Å²	61.7	13%	0.133	34%	0.344	C	S	.	.			trans	-71.9	162.7	176.4	81.2	0	0	0	0	111.8	A309 N310 N311	S307-A309 PolarHBondContact O-N 3.33Å; S307-A309 VanDerWaalsContact O-N 3.09Å; S307-A309 PolarHBondContact OG-N 3.41Å; S307-N310 WeakPolarHBondContact O-CA 3.35Å; S307-N310 PolarHBondContact O-N 3.26Å; S307-N311 PolarHBondContact N-O 3.46Å; S307-N311 WeakPolarHBondContact OG-CB 3.18Å; S307-N311 PolarHBondContact OG-N 3.33Å; S307-N311 VanDerWaalsContact OG-N 3.11Å
308	P	90.1	Very high	80.9	Confident	149 Å²	149	60.2 Å²	60.2	97%	0.968	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-22.2	171.6	-25.5	35.3	0	0	0	114.2	N310	P308-N310 VanDerWaalsContact C-N 3.26Å
309	A	90.1	Very high	79.5	Confident	73 Å²	73	53.3 Å²	53.3	60%	0.603	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	12.4	175.3	0	0	0	0	0	113.1	S307 N311	S307-A309 PolarHBondContact O-N 3.33Å; S307-A309 VanDerWaalsContact O-N 3.09Å; S307-A309 PolarHBondContact OG-N 3.41Å; A309-N311 VanDerWaalsContact C-N 3.31Å; A309-N311 PolarHBondContact O-N 2.94Å
310	N	90	Very high	78.1	Confident	124 Å²	124	54.3 Å²	54.3	66%	0.663	30%	0.304	S	S	*	.	S	Bend	trans	62.1	31.9	-178.2	-159.5	41.6	0	0	0	114.4	S307 P308	S307-N310 WeakPolarHBondContact O-CA 3.35Å; S307-N310 PolarHBondContact O-N 3.26Å; P308-N310 VanDerWaalsContact C-N 3.26Å
311	N	90.8	Very high	76.7	Confident	45 Å²	45	56.7 Å²	56.7	24%	0.241	32%	0.318	C	S	.	.			trans	-98.4	144.8	174.5	-61.3	-29.1	0	0	0	110.8	T306 S307 A309 C313 C329 G330 P332	T306-N311 CarbonylContact C-O 3.58Å; T306-N311 WeakPolarHBondContact CA-O 3.45Å; S307-N311 PolarHBondContact N-O 3.46Å; S307-N311 WeakPolarHBondContact OG-CB 3.18Å; S307-N311 PolarHBondContact OG-N 3.33Å; S307-N311 VanDerWaalsContact OG-N 3.11Å; A309-N311 VanDerWaalsContact C-N 3.31Å; A309-N311 PolarHBondContact O-N 2.94Å; N311-C313 PolarHBondContact O-N 3.28Å; N311-C329 HydrophobicContact CB-CB 4.36Å; N311-G330 WeakPolarHBondContact CB-O 3.29Å; N311-P332 WeakPolarHBondContact OD1-CA 3.31Å
312	T	90.1	Very high	75.3	Confident	21 Å²	21	54.3 Å²	54.3	13%	0.129	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	120	173.5	-58.4	0	0	0	0	109.8	V287 S288 F304 G330 P332 D333	V287-T312 HydrophobicContact CG2-CG2 3.94Å; S288-T312 WeakPolarHBondContact OG-CG2 3.33Å; S288-T312 PolarHBondContact OG-OG1 2.82Å; F304-T312 HydrophobicContact CD1-CG2 3.97Å; F304-T312 HydrophobicContact CE1-CG2 4.49Å; T312-G330 PolarHBondContact O-N 3.23Å; T312-P332 PolarHBondContact N-O 3.2Å; T312-D333 VanDerWaalsContact CB-OD1 3.31Å; T312-D333 WeakPolarHBondContact CB-OD1 3.43Å; T312-D333 PolarHBondContact OG1-OD1 2.98Å
313	C	87.5	Confident	74	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	155.1	-176.3	-54.3	0	0	0	0	111.6	F304 F305 N311 A327 V328 C329	F304-C313 CarbonylContact C-O 3.52Å; F304-C313 VanDerWaalsContact CA-O 3.27Å; F304-C313 WeakPolarHBondContact CA-O 3.26Å; F305-C313 HydrophobicContact CD1-CB 4.25Å; F305-C313 HydrophobicContact CD2-CB 4.3Å; F305-C313 HydrophobicContact CE1-CB 3.8Å; F305-C313 HydrophobicContact CE2-CB 3.86Å; F305-C313 HydrophobicContact CG-CB 4.49Å; F305-C313 HydrophobicContact CZ-CB 3.59Å; F305-C313 PolarHBondContact N-O 3.08Å; F305-C313 PolarHBondContact O-N 3.22Å; N311-C313 PolarHBondContact O-N 3.28Å; C313-A327 HydrophobicContact CB-CB 4.44Å; C313-V328 CarbonylContact C-O 3.49Å; C313-V328 VanDerWaalsContact CA-O 3.24Å; C313-V328 WeakPolarHBondContact CA-O 3.38Å; C313-C329 HydrophobicContact CB-CB 4.04Å; C313-C329 WeakPolarHBondContact CB-SG 3.2Å; C313-C329 WeakPolarHBondContact SG-CB 3.29Å; C313-C329 CovalentContact SG-SG 2.03Å; C313-C329 PolarHBondContact SG-SG 3.23Å
314	F	85.2	Confident	73	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	157.8	169.8	68	-73.1	0	0	0	110.8	L220 L222 V287 V303 F304 A327 V328 L335	L220-F314 HydrophobicContact CD1-CD2 3.96Å; L220-F314 HydrophobicContact CD1-CE2 3.72Å; L220-F314 HydrophobicContact CD2-CD2 3.8Å; L220-F314 HydrophobicContact CD2-CE2 3.39Å; L220-F314 HydrophobicContact CD2-CZ 3.85Å; L220-F314 HydrophobicContact CG-CD2 4.39Å; L220-F314 HydrophobicContact CG-CE2 3.83Å; L222-F314 HydrophobicContact CD1-CE2 3.66Å; L222-F314 HydrophobicContact CD1-CZ 3.91Å; L222-F314 HydrophobicContact CD2-CE2 4.39Å; L222-F314 HydrophobicContact CG-CE2 4.21Å; V287-F314 HydrophobicContact CB-CE1 4.31Å; V287-F314 HydrophobicContact CG1-CE1 3.83Å; V303-F314 WeakPolarHBondContact O-CA 3.15Å; F304-F314 HydrophobicContact CD1-CB 3.78Å; F304-F314 HydrophobicContact CD1-CD1 4.45Å; F304-F314 HydrophobicContact CD1-CG 4.38Å; F304-F314 HydrophobicContact CD2-CB 3.86Å; F304-F314 HydrophobicContact CE1-CB 3.75Å; F304-F314 AromaticContact CE1-CD1 3.76Å; F304-F314 HydrophobicContact CE1-CD1 3.76Å; F304-F314 AromaticContact CE1-CG 3.84Å; F304-F314 HydrophobicContact CE1-CG 3.84Å; F304-F314 HydrophobicContact CE2-CB 3.82Å; F304-F314 HydrophobicContact CE2-CD2 4.36Å; F304-F314 HydrophobicContact CE2-CG 4.11Å; F304-F314 HydrophobicContact CG-CB 3.83Å; F304-F314 HydrophobicContact CZ-CB 3.76Å; F304-F314 AromaticContact CZ-CD1 3.93Å; F304-F314 HydrophobicContact CZ-CD1 3.93Å; F304-F314 HydrophobicContact CZ-CD2 4.11Å; F304-F314 AromaticContact CZ-CG 3.68Å; F304-F314 HydrophobicContact CZ-CG 3.68Å; F314-A327 WeakPolarHBondContact O-CA 3.5Å; F314-V328 HydrophobicContact CD1-CG2 3.86Å; F314-V328 HydrophobicContact CE1-CG2 3.45Å; F314-V328 VanDerWaalsContact CE1-CG2 3.45Å; F314-V328 HydrophobicContact CE2-CG2 4.21Å; F314-V328 HydrophobicContact CG-CG2 4.37Å; F314-V328 HydrophobicContact CZ-CG2 3.64Å; F314-V328 PolarHBondContact N-O 2.85Å; F314-V328 PolarHBondContact O-N 3.09Å; F314-L335 HydrophobicContact CE1-CD2 3.78Å; F314-L335 HydrophobicContact CZ-CD2 4.23Å
315	F	76.7	Confident	71.9	Confident	39 Å²	39	62.9 Å²	62.9	17%	0.171	35%	0.35	C	S	.	.			trans	-136.5	159.5	178.8	68.8	-79.1	0	0	0	111.1	V303 F305 T324 A327	V303-F315 HydrophobicContact CB-CD1 4.1Å; V303-F315 HydrophobicContact CB-CE1 4Å; V303-F315 HydrophobicContact CB-CZ 4.37Å; V303-F315 VanDerWaalsContact CB-O 3.27Å; V303-F315 WeakPolarHBondContact CB-O 3.14Å; V303-F315 HydrophobicContact CG1-CE1 4.27Å; V303-F315 HydrophobicContact CG1-CE2 4.37Å; V303-F315 HydrophobicContact CG1-CZ 4.13Å; V303-F315 VanDerWaalsContact CG2-O 3.25Å; V303-F315 WeakPolarHBondContact CG2-O 3.34Å; V303-F315 WeakPolarHBondContact O-CD1 3.41Å; F305-F315 HydrophobicContact CD1-CD1 4.19Å; F305-F315 HydrophobicContact CD1-CE1 4.41Å; F305-F315 AromaticContact CE1-CD1 3.87Å; F305-F315 HydrophobicContact CE1-CD1 3.87Å; F305-F315 HydrophobicContact CE1-CE1 4.43Å; F315-T324 HydrophobicContact CE1-CG2 4.44Å; F315-A327 HydrophobicContact CB-CB 3.99Å
316	A	65.8	Low	71	Confident	31 Å²	31	66 Å²	66	26%	0.256	36%	0.361	S	S	.	.			trans	-78.5	128.8	174.8	0	0	0	0	0	109.8	L220 C318	L220-A316 HydrophobicContact CB-CB 4.21Å; L220-A316 HydrophobicContact CD1-CB 3.81Å; A316-C318 PolarHBondContact O-N 2.78Å
317	K	57.3	Low	70.4	Confident	119 Å²	119	62 Å²	62	52%	0.517	34%	0.337	S	S	.	.			trans	-71	84	166.3	-169.3	173.6	175.2	-179.2	0	108.2	D299 V303	D299-K317 IonicContact OD1-NZ 2.85Å; D299-K317 PolarHBondContact OD1-NZ 3.35Å; V303-K317 HydrophobicContact CG1-CB 4.1Å
318	C	54.8	Low	70.1	Confident	8 Å²	8	61.7 Å²	61.7	5%	0.054	33%	0.334	C	S	.	.			trans	-101.1	144.6	-171.5	172.2	0	0	0	0	112.2	H218 A316 Y320 C322	H218-C318 WeakPolarHBondContact CB-SG 2.98Å; A316-C318 PolarHBondContact O-N 2.78Å; C318-Y320 VanDerWaalsContact C-N 3.25Å; C318-Y320 PolarHBondContact O-N 3.3Å; C318-Y320 PolarHBondContact SG-N 3.16Å; C318-Y320 VanDerWaalsContact SG-N 3.39Å; C318-C322 PolarHBondContact O-SG 2.76Å
319	L	45.8	Very low	70	Confident	18 Å²	18	56.9 Å²	56.9	9%	0.094	30%	0.304	C	S	.	.	S	Bend	trans	-64.7	-25.3	-179.8	-55.8	170.9	0	0	0	114	L203 A206 C207 V212	L203-L319 HydrophobicContact CB-CD1 4.39Å; L203-L319 HydrophobicContact CD1-CD1 3.51Å; A206-L319 WeakPolarHBondContact O-CD2 3.3Å; C207-L319 HydrophobicContact CB-CD2 4.28Å; V212-L319 HydrophobicContact CG1-CD1 4.44Å; V212-L319 HydrophobicContact CG2-CD1 4.3Å
320	Y	45	Very low	69.7	Low	89 Å²	89	53.6 Å²	53.6	35%	0.349	28%	0.277	S	S	.	.	S	Bend	trans	-103.5	-36.5	-176.8	-77.2	-81.3	0	0	0	114.2	C209 V212 V213 H218 C318	C209-Y320 HydrophobicContact CB-CE1 4.5Å; C209-Y320 PolarHBondContact O-OH 2.96Å; V212-Y320 VanDerWaalsContact CA-OH 3.29Å; V212-Y320 WeakPolarHBondContact CA-OH 3.41Å; V212-Y320 HydrophobicContact CB-CE2 3.59Å; V212-Y320 VanDerWaalsContact CB-OH 3.27Å; V212-Y320 WeakPolarHBondContact CB-OH 3.44Å; V212-Y320 HydrophobicContact CG1-CE2 3.64Å; V212-Y320 WeakPolarHBondContact O-CE2 3.48Å; V212-Y320 PolarHBondContact O-OH 2.84Å; V213-Y320 PolarHBondContact N-OH 3.49Å; H218-Y320 AromaticContact CD2-CD2 3.66Å; H218-Y320 AromaticContact NE2-CD2 3.76Å; H218-Y320 AromaticContact NE2-CE2 3.91Å; C318-Y320 VanDerWaalsContact C-N 3.25Å; C318-Y320 PolarHBondContact O-N 3.3Å; C318-Y320 PolarHBondContact SG-N 3.16Å; C318-Y320 VanDerWaalsContact SG-N 3.39Å
321	V	48.2	Very low	69.5	Low	55 Å²	55	50.5 Å²	50.5	33%	0.333	27%	0.274	S	S	.	.			trans	-135.9	68.6	-168.8	-165.5	0	0	0	0	109.5	K323 Y326	V321-K323 HydrophobicContact CG1-CB 4.45Å; V321-K323 PolarHBondContact O-N 2.73Å; V321-Y326 HydrophobicContact CG1-CD2 3.16Å; V321-Y326 HydrophobicContact CG1-CE2 3.12Å; V321-Y326 HydrophobicContact CG1-CG 3.93Å
322	C	50.1	Low	69.1	Low	74 Å²	74	51.9 Å²	51.9	50%	0.5	29%	0.285	S	S	.	.			trans	-78.2	54.4	168.8	-84.5	0	0	0	0	111.2	C318	C318-C322 PolarHBondContact O-SG 2.76Å
323	K	54.7	Low	69	Low	110 Å²	110	53.3 Å²	53.3	48%	0.478	29%	0.292	S	S	.	.			trans	-118.2	132.2	179	-66.3	-166.9	176.4	-169.9	0	111.3	V321 E325 Y326	V321-K323 HydrophobicContact CG1-CB 4.45Å; V321-K323 PolarHBondContact O-N 2.73Å; K323-E325 HydrophobicContact CB-CB 4.05Å; K323-E325 HydrophobicContact CB-CG 4.31Å; K323-E325 WeakPolarHBondContact CD-OE2 3.18Å; K323-E325 IonicContact NZ-OE1 3.64Å; K323-E325 IonicContact NZ-OE2 3.8Å; K323-E325 PolarHBondContact O-N 2.96Å; K323-Y326 HydrophobicContact CB-CD2 4.11Å; K323-Y326 HydrophobicContact CB-CE2 4.37Å; K323-Y326 PolarHBondContact O-N 2.78Å
324	T	58.3	Low	69.2	Low	90 Å²	90	58 Å²	58	55%	0.552	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-56.1	-19.6	170.3	50.4	0	0	0	0	112.4	F315 Y326 A327	F315-T324 HydrophobicContact CE1-CG2 4.44Å; T324-Y326 PolarHBondContact O-N 3.09Å; T324-A327 VanDerWaalsContact O-CB 3.27Å; T324-A327 WeakPolarHBondContact O-CB 3.31Å; T324-A327 PolarHBondContact O-N 2.95Å; T324-A327 VanDerWaalsContact O-N 3.11Å
325	E	63	Low	69.6	Low	100 Å²	100	58.4 Å²	58.4	47%	0.467	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-52.9	-28.5	169.8	-67.1	168.7	-161.7	0	0	113.1	R239 K323	R239-E325 PolarHBondContact NH1-O 2.81Å; K323-E325 HydrophobicContact CB-CB 4.05Å; K323-E325 HydrophobicContact CB-CG 4.31Å; K323-E325 WeakPolarHBondContact CD-OE2 3.18Å; K323-E325 IonicContact NZ-OE1 3.64Å; K323-E325 IonicContact NZ-OE2 3.8Å; K323-E325 PolarHBondContact O-N 2.96Å
326	Y	68.5	Low	70.3	Confident	132 Å²	132	58.1 Å²	58.1	52%	0.518	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-105.1	16.2	-178.9	-60.2	-93.1	0	0	0	113.2	V321 K323 T324	V321-Y326 HydrophobicContact CG1-CD2 3.16Å; V321-Y326 HydrophobicContact CG1-CE2 3.12Å; V321-Y326 HydrophobicContact CG1-CG 3.93Å; K323-Y326 HydrophobicContact CB-CD2 4.11Å; K323-Y326 HydrophobicContact CB-CE2 4.37Å; K323-Y326 PolarHBondContact O-N 2.78Å; T324-Y326 PolarHBondContact O-N 3.09Å
327	A	77.5	Confident	71.6	Confident	5 Å²	5	56.6 Å²	56.6	4%	0.041	31%	0.306	C	S	.	.			trans	-64.9	142.7	175.2	0	0	0	0	0	111.4	F305 C313 F314 F315 T324	F305-A327 HydrophobicContact CE1-CB 3.68Å; F305-A327 HydrophobicContact CZ-CB 3.55Å; C313-A327 HydrophobicContact CB-CB 4.44Å; F314-A327 WeakPolarHBondContact O-CA 3.5Å; F315-A327 HydrophobicContact CB-CB 3.99Å; T324-A327 VanDerWaalsContact O-CB 3.27Å; T324-A327 WeakPolarHBondContact O-CB 3.31Å; T324-A327 PolarHBondContact O-N 2.95Å; T324-A327 VanDerWaalsContact O-N 3.11Å
328	V	83.6	Confident	73.4	Confident	14 Å²	14	51 Å²	51	9%	0.085	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	140.4	167	-59.3	0	0	0	0	108.3	L220 P236 C313 F314 L335	L220-V328 HydrophobicContact CD2-CB 4.28Å; L220-V328 HydrophobicContact CD2-CG1 4.05Å; L220-V328 HydrophobicContact CD2-CG2 3.26Å; P236-V328 HydrophobicContact CB-CG1 4.42Å; P236-V328 HydrophobicContact CB-CG2 4.18Å; P236-V328 HydrophobicContact CG-CG1 4.18Å; P236-V328 HydrophobicContact CG-CG2 4.13Å; C313-V328 CarbonylContact C-O 3.49Å; C313-V328 VanDerWaalsContact CA-O 3.24Å; C313-V328 WeakPolarHBondContact CA-O 3.38Å; F314-V328 HydrophobicContact CD1-CG2 3.86Å; F314-V328 HydrophobicContact CE1-CG2 3.45Å; F314-V328 VanDerWaalsContact CE1-CG2 3.45Å; F314-V328 HydrophobicContact CE2-CG2 4.21Å; F314-V328 HydrophobicContact CG-CG2 4.37Å; F314-V328 HydrophobicContact CZ-CG2 3.64Å; F314-V328 PolarHBondContact N-O 2.85Å; F314-V328 PolarHBondContact O-N 3.09Å; V328-L335 HydrophobicContact CB-CD2 4.13Å; V328-L335 HydrophobicContact CG2-CD2 3.71Å
329	C	86.5	Confident	75.3	Confident	48 Å²	48	50.6 Å²	50.6	32%	0.324	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	140.7	-174.3	-62.9	0	0	0	0	109.7	N311 C313	N311-C329 HydrophobicContact CB-CB 4.36Å; C313-C329 HydrophobicContact CB-CB 4.04Å; C313-C329 WeakPolarHBondContact CB-SG 3.2Å; C313-C329 WeakPolarHBondContact SG-CB 3.29Å; C313-C329 CovalentContact SG-SG 2.03Å; C313-C329 PolarHBondContact SG-SG 3.23Å
330	G	85.3	Confident	77.6	Confident	4 Å²	4	50.4 Å²	50.4	4%	0.041	28%	0.279	C	S	.	.			trans	-71.9	168.7	166.4	0	0	0	0	0	112.1	N311 T312 P332 L334	N311-G330 WeakPolarHBondContact CB-O 3.29Å; T312-G330 PolarHBondContact O-N 3.23Å; G330-P332 VanDerWaalsContact C-C 3.41Å; G330-P332 CarbonylContact C-O 3.6Å; G330-P332 VanDerWaalsContact C-O 3.26Å; G330-L334 CarbonylContact C-O 3.27Å; G330-L334 VanDerWaalsContact CA-O 3.23Å; G330-L334 WeakPolarHBondContact CA-O 3.34Å
331	G	84	Confident	80	Confident	58 Å²	58	46.6 Å²	46.6	60%	0.598	27%	0.266	S	S	*	.	S	Bend	trans	-122.4	84.3	171.2	0	0	0	0	0	112.4	L334	G331-L334 PolarHBondContact N-O 3.04Å
332	P	83.4	Confident	82.2	Confident	74 Å²	74	46.5 Å²	46.5	48%	0.481	26%	0.26	S	S	.	.	S	Bend	cis	-79.8	-27.7	-14	30.4	-33.5	0	0	0	113.8	N311 T312 G330	N311-P332 WeakPolarHBondContact OD1-CA 3.31Å; T312-P332 PolarHBondContact N-O 3.2Å; G330-P332 VanDerWaalsContact C-C 3.41Å; G330-P332 CarbonylContact C-O 3.6Å; G330-P332 VanDerWaalsContact C-O 3.26Å
333	D	88.5	Confident	84.2	Confident	52 Å²	52	43.7 Å²	43.7	28%	0.278	24%	0.239	S	C	.	.	S	Bend	trans	-119.1	-15.8	-179.9	-69.2	-53.8	0	0	0	113.8	N286 V287 S288 T312	N286-D333 CarbonylContact C-O 3.55Å; N286-D333 WeakPolarHBondContact CA-O 3.45Å; V287-D333 VanDerWaalsContact CG2-O 3.29Å; V287-D333 WeakPolarHBondContact CG2-O 3.48Å; V287-D333 PolarHBondContact N-O 3.42Å; S288-D333 PolarHBondContact OG-OD1 3.12Å; T312-D333 VanDerWaalsContact CB-OD1 3.31Å; T312-D333 WeakPolarHBondContact CB-OD1 3.43Å; T312-D333 PolarHBondContact OG1-OD1 2.98Å
334	L	92.1	Very high	85.9	Confident	98 Å²	98	38.5 Å²	38.5	51%	0.513	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	127.8	179.8	-71.2	171.9	0	0	0	110.1	N286 G330 G331	N286-L334 HydrophobicContact CB-CD2 4.07Å; G330-L334 CarbonylContact C-O 3.27Å; G330-L334 VanDerWaalsContact CA-O 3.23Å; G330-L334 WeakPolarHBondContact CA-O 3.34Å; G331-L334 PolarHBondContact N-O 3.04Å
335	L	91.7	Very high	87.2	Confident	9 Å²	9	35.4 Å²	35.4	5%	0.047	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	126.3	175.6	-177.3	58.9	0	0	0	109.6	P236 M237 V285 V287 F314 V328	P236-L335 HydrophobicContact CB-CD2 3.6Å; P236-L335 HydrophobicContact CB-CG 4.16Å; M237-L335 HydrophobicContact CB-CD1 4.41Å; V285-L335 PolarHBondContact N-O 3Å; V285-L335 PolarHBondContact O-N 2.88Å; V287-L335 HydrophobicContact CG1-CB 3.56Å; V287-L335 HydrophobicContact CG1-CD2 3.86Å; V287-L335 HydrophobicContact CG1-CG 4.37Å; F314-L335 HydrophobicContact CE1-CD2 3.78Å; F314-L335 HydrophobicContact CZ-CD2 4.23Å; V328-L335 HydrophobicContact CB-CD2 4.13Å; V328-L335 HydrophobicContact CG2-CD2 3.71Å
336	E	92.8	Very high	88.4	Confident	32 Å²	32	33.9 Å²	33.9	15%	0.15	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	148.2	172.1	53.3	174.3	-147.1	0	0	111.5	M237 R242 H259 R284 L485	M237-E336 HydrophobicContact CB-CG 3.77Å; M237-E336 WeakPolarHBondContact CB-O 3.4Å; M237-E336 HydrophobicContact CG-CG 4.21Å; M237-E336 PolarHBondContact N-O 2.78Å; M237-E336 VanDerWaalsContact SD-CD 3.6Å; M237-E336 HydrophobicContact SD-CG 3.56Å; M237-E336 VanDerWaalsContact SD-CG 3.56Å; R242-E336 IonicContact CZ-OE1 2.72Å; R242-E336 IonicContact CZ-OE2 3.75Å; R242-E336 IonicContact NE-OE1 3.51Å; R242-E336 IonicContact NH2-OE1 3.6Å; R242-E336 PolarHBondContact NH2-OE1 3.38Å; R242-E336 IonicContact NH2-OE2 2.82Å; R242-E336 PolarHBondContact NH2-OE2 2.89Å; H259-E336 IonicContact CE1-OE1 2.81Å; H259-E336 PolarHBondContact CE1-OE1 2.91Å; H259-E336 IonicContact NE2-OE1 3.81Å; R284-E336 HydrophobicContact CG-CB 4.38Å; E336-L485 HydrophobicContact CB-CD1 4.27Å; E336-L485 HydrophobicContact CB-CD2 3.96Å
337	G	92.6	Very high	89.3	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.7	174.2	175.7	0	0	0	0	0	112.4	F234 K235 R283	F234-G337 VanDerWaalsContact CE2-CA 3.5Å; K235-G337 CarbonylContact O-C 3.56Å; K235-G337 WeakPolarHBondContact O-CA 3.42Å; R283-G337 PolarHBondContact N-O 3.49Å; R283-G337 PolarHBondContact O-N 2.76Å
338	S	94.6	Very high	89.8	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	134.7	-179.5	60.6	0	0	0	0	110	M233 F234 K235	M233-S338 VanDerWaalsContact O-O 3.12Å; F234-S338 WeakPolarHBondContact CA-O 3.34Å; K235-S338 PolarHBondContact N-O 2.64Å; K235-S338 PolarHBondContact O-N 3.02Å
339	L	94.9	Very high	90.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	107.4	172.3	-70.8	177.3	0	0	0	110	M184 L224 M226 A232 M233 F234 V280 A281 R283	M184-L339 HydrophobicContact CB-CB 4.41Å; M184-L339 HydrophobicContact CB-CD1 4.41Å; M184-L339 WeakPolarHBondContact O-CD1 3.45Å; M184-L339 HydrophobicContact SD-CB 4.49Å; L224-L339 HydrophobicContact CD1-CD2 3.78Å; M226-L339 HydrophobicContact CE-CD1 3.85Å; A232-L339 HydrophobicContact CB-CB 4.17Å; A232-L339 HydrophobicContact CB-CD2 3.97Å; M233-L339 CarbonylContact O-C 3.26Å; M233-L339 WeakPolarHBondContact O-CA 3.27Å; F234-L339 HydrophobicContact CB-CD2 3.67Å; F234-L339 HydrophobicContact CD2-CD2 3.7Å; F234-L339 HydrophobicContact CD2-CG 4.25Å; F234-L339 HydrophobicContact CG-CD2 4.15Å; V280-L339 VanDerWaalsContact CA-O 3.3Å; V280-L339 WeakPolarHBondContact CA-O 3.37Å; A281-L339 PolarHBondContact N-O 3.42Å; A281-L339 PolarHBondContact O-N 3.18Å; R283-L339 HydrophobicContact CB-CD1 3.79Å; R283-L339 HydrophobicContact CB-CG 4.34Å; R283-L339 HydrophobicContact CG-CD1 4.33Å
340	S	95.3	Very high	90.3	Very high	15 Å²	15	34.5 Å²	34.5	11%	0.105	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	127.5	174.5	-48.5	0	0	0	0	110.2	A232 M233 V280 Y342	A232-S340 CarbonylContact C-O 3.58Å; A232-S340 VanDerWaalsContact CA-O 3.31Å; A232-S340 WeakPolarHBondContact CA-O 3.46Å; M233-S340 PolarHBondContact N-O 2.84Å; M233-S340 PolarHBondContact O-N 2.64Å; V280-S340 WeakPolarHBondContact CG2-OG 3.1Å; S340-Y342 PolarHBondContact O-N 3.19Å
341	A	95.3	Very high	90.6	Very high	8 Å²	8	37.5 Å²	37.5	7%	0.066	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	132	177.5	0	0	0	0	0	110.8	F160 L180 M184 P279 L343	F160-A341 HydrophobicContact CE1-CB 4.3Å; L180-A341 HydrophobicContact CD2-CB 3.96Å; M184-A341 HydrophobicContact CE-CB 4.33Å; M184-A341 HydrophobicContact SD-CB 3.84Å; P279-A341 HydrophobicContact CB-CB 4.31Å; P279-A341 WeakPolarHBondContact O-CB 3.46Å; P279-A341 PolarHBondContact O-N 3.15Å; A341-L343 PolarHBondContact O-N 3.28Å
342	Y	92.6	Very high	90.9	Very high	54 Å²	54	39.1 Å²	39.1	21%	0.212	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-66.8	135.9	174.8	-94.4	-106.6	0	0	0	110.6	H161 D195 A223 K231 A232 M233 S340	H161-Y342 PolarHBondContact NE2-O 3.49Å; D195-Y342 VanDerWaalsContact CG-OH 3.32Å; D195-Y342 PolarHBondContact OD2-OH 3.29Å; A223-Y342 HydrophobicContact CB-CE2 4.35Å; A223-Y342 VanDerWaalsContact CB-OH 3.25Å; A223-Y342 WeakPolarHBondContact CB-OH 3.33Å; K231-Y342 HydrophobicContact CB-CD2 3.66Å; K231-Y342 HydrophobicContact CB-CE2 4.26Å; K231-Y342 HydrophobicContact CB-CG 3.8Å; K231-Y342 WeakPolarHBondContact O-CB 3.26Å; K231-Y342 WeakPolarHBondContact O-CD2 3.28Å; K231-Y342 PolarHBondContact O-N 3.01Å; A232-Y342 VanDerWaalsContact C-CE2 3.4Å; M233-Y342 HydrophobicContact CB-CD2 4.36Å; M233-Y342 HydrophobicContact CB-CE2 3.79Å; M233-Y342 VanDerWaalsContact CE-OH 3.3Å; M233-Y342 WeakPolarHBondContact CE-OH 3.26Å; M233-Y342 VanDerWaalsContact N-CE2 3.32Å; S340-Y342 PolarHBondContact O-N 3.19Å
343	L	92.8	Very high	91.2	Very high	14 Å²	14	38.8 Å²	38.8	7%	0.073	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-68.6	162.4	163.3	-69.9	179.7	0	0	0	110.8	F160 I164 L169 P278 A341 F416 L426 L428	F160-L343 HydrophobicContact CE1-CD2 4.33Å; F160-L343 HydrophobicContact CZ-CD2 4.05Å; I164-L343 HydrophobicContact CD1-CD2 4.27Å; L169-L343 HydrophobicContact CD1-CD2 4.43Å; L169-L343 HydrophobicContact CD2-CD2 3.91Å; P278-L343 HydrophobicContact CG-CD1 4.43Å; P278-L343 HydrophobicContact CG-CD2 4.16Å; P278-L343 HydrophobicContact CG-CG 4.16Å; A341-L343 PolarHBondContact O-N 3.28Å; L343-F416 HydrophobicContact CD1-CZ 4.46Å; L343-F416 HydrophobicContact CD2-CZ 4.46Å; L343-L426 HydrophobicContact CD1-CD1 3.96Å; L343-L426 HydrophobicContact CD1-CD2 4.49Å; L343-L428 HydrophobicContact CD1-CD1 4.29Å; L343-L428 HydrophobicContact CD1-CD2 4.1Å
344	P	91.1	Very high	91.2	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.006	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-55	148.3	177.5	-20.6	29.3	0	0	0	111.9	L109 L110 H161 I164 V348 A349	L109-P344 HydrophobicContact CD2-CG 4.26Å; L110-P344 HydrophobicContact CD1-CB 3.75Å; L110-P344 HydrophobicContact CD1-CG 3.64Å; H161-P344 HydrophobicContact CB-CG 4.02Å; I164-P344 HydrophobicContact CD1-CG 3.86Å; P344-V348 HydrophobicContact CB-CG2 4.06Å; P344-A349 HydrophobicContact CB-CB 3.98Å; P344-A349 HydrophobicContact CG-CB 4.5Å
345	G	85.8	Confident	91.1	Very high	25 Å²	25	36 Å²	36	26%	0.258	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-59.7	144.2	-178.5	0	0	0	0	0	112.3	T347 V348 A349	G345-T347 PolarHBondContact O-N 3.06Å; G345-V348 WeakPolarHBondContact O-CG2 3.35Å; G345-V348 PolarHBondContact O-N 3.44Å; G345-A349 PolarHBondContact O-N 3.15Å
346	L	87.8	Confident	91.2	Very high	69 Å²	69	36.2 Å²	36.2	36%	0.361	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-20.5	-178.3	-65.3	173.7	0	0	0	114.3	P350 R351	L346-P350 WeakPolarHBondContact O-CA 3.49Å; L346-P350 WeakPolarHBondContact O-CG 3.37Å; L346-R351 HydrophobicContact CD2-CB 4.11Å; L346-R351 HydrophobicContact CD2-CG 4.19Å
347	T	86.5	Confident	91.2	Very high	106 Å²	106	35.6 Å²	35.6	65%	0.65	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-29.5	175.8	54.9	0	0	0	0	113.5	Y118 G345	Y118-T347 WeakPolarHBondContact CE2-OG1 3.32Å; Y118-T347 VanDerWaalsContact CZ-OG1 3.3Å; Y118-T347 PolarHBondContact OH-OG1 3.13Å; G345-T347 PolarHBondContact O-N 3.06Å
348	V	88.8	Confident	91.3	Very high	39 Å²	39	36.2 Å²	36.2	24%	0.236	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-30.5	179.9	-67.6	0	0	0	0	112.3	L110 L115 Y118 P344 G345	L110-V348 HydrophobicContact CD2-CB 4.08Å; L110-V348 HydrophobicContact CD2-CG2 4.3Å; L115-V348 HydrophobicContact CD1-CG2 4.37Å; Y118-V348 HydrophobicContact CD1-CG1 3.64Å; Y118-V348 HydrophobicContact CD1-CG2 4.38Å; Y118-V348 HydrophobicContact CD2-CG1 3.5Å; Y118-V348 VanDerWaalsContact CD2-CG1 3.5Å; Y118-V348 HydrophobicContact CE1-CG1 3.98Å; Y118-V348 HydrophobicContact CE1-CG2 4.24Å; Y118-V348 HydrophobicContact CE2-CG1 3.87Å; Y118-V348 HydrophobicContact CG-CG1 3.37Å; P344-V348 HydrophobicContact CB-CG2 4.06Å; G345-V348 WeakPolarHBondContact O-CG2 3.35Å; G345-V348 PolarHBondContact O-N 3.44Å
349	A	90.7	Very high	91.1	Very high	3 Å²	3	40.3 Å²	40.3	3%	0.025	23%	0.228	C	C	.	.	S	Bend	trans	-133.2	85.4	174.2	0	0	0	0	0	109.2	L109 L110 P344 G345 F416	L109-A349 HydrophobicContact CD1-CB 4.27Å; L109-A349 HydrophobicContact CD2-CB 3.81Å; L109-A349 HydrophobicContact CG-CB 4.14Å; L110-A349 HydrophobicContact CD2-CB 4.39Å; P344-A349 HydrophobicContact CB-CB 3.98Å; P344-A349 HydrophobicContact CG-CB 4.5Å; G345-A349 PolarHBondContact O-N 3.15Å; A349-F416 HydrophobicContact CB-CD1 4.21Å; A349-F416 HydrophobicContact CB-CE1 4.22Å
350	P	90.5	Very high	90.8	Very high	63 Å²	63	41.3 Å²	41.3	41%	0.409	23%	0.232	S	C	.	.			trans	-61.6	144.5	174.9	-16.5	28.8	0	0	0	110.5	L346 T417	L346-P350 WeakPolarHBondContact O-CA 3.49Å; L346-P350 WeakPolarHBondContact O-CG 3.37Å; P350-T417 HydrophobicContact CB-CG2 4.09Å; P350-T417 PolarHBondContact O-N 3.16Å; P350-T417 VanDerWaalsContact O-N 3.09Å; P350-T417 PolarHBondContact O-OG1 3.22Å
351	R	91.3	Very high	90.3	Very high	68 Å²	68	41.1 Å²	41.1	26%	0.257	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	144	178.3	-61.5	-178.1	-53.7	-131.4	-5.3	109.5	L346 E414 I415 F416	L346-R351 HydrophobicContact CD2-CB 4.11Å; L346-R351 HydrophobicContact CD2-CG 4.19Å; R351-E414 VanDerWaalsContact CD-OE2 3.28Å; R351-E414 WeakPolarHBondContact CD-OE2 3.31Å; R351-E414 IonicContact CZ-OE2 3.44Å; R351-E414 IonicContact NE-OE2 3.71Å; R351-E414 PolarHBondContact NE-OE2 3.26Å; R351-E414 IonicContact NH2-OE2 2.68Å; R351-I415 CarbonylContact C-O 3.39Å; R351-I415 WeakPolarHBondContact CA-O 3.33Å; R351-F416 HydrophobicContact CG-CD1 3.76Å; R351-F416 HydrophobicContact CG-CE1 3.91Å
352	L	89.4	Confident	89.4	Confident	91 Å²	91	43.2 Å²	43.2	48%	0.476	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	127.2	174.2	-171.6	73.4	0	0	0	108.3	I354 E414 I415 T417	L352-I354 HydrophobicContact CD2-CD1 3.89Å; L352-I354 HydrophobicContact CD2-CG1 3.76Å; L352-I354 HydrophobicContact CG-CD1 4.5Å; L352-I354 HydrophobicContact CG-CG1 3.95Å; L352-E414 WeakPolarHBondContact O-CA 3.05Å; L352-I415 HydrophobicContact CB-CG1 3.95Å; L352-I415 HydrophobicContact CD2-CD1 4.43Å; L352-I415 PolarHBondContact N-O 3.22Å; L352-I415 PolarHBondContact O-N 3.18Å; L352-T417 HydrophobicContact CB-CG2 4.23Å
353	S	89.3	Confident	88.6	Confident	67 Å²	67	44.4 Å²	44.4	47%	0.469	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	118.8	171.6	-175.7	0	0	0	0	108.7	H412	S353-H412 WeakPolarHBondContact OG-CB 3.48Å
354	I	89.8	Confident	87.7	Confident	23 Å²	23	50.6 Å²	50.6	12%	0.118	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	133	-176.1	-56.9	171.5	0	0	0	108.4	L352 N356 H412 Y413 I415	L352-I354 HydrophobicContact CD2-CD1 3.89Å; L352-I354 HydrophobicContact CD2-CG1 3.76Å; L352-I354 HydrophobicContact CG-CD1 4.5Å; L352-I354 HydrophobicContact CG-CG1 3.95Å; I354-N356 PolarHBondContact O-N 3.01Å; I354-H412 VanDerWaalsContact O-CA 3.26Å; I354-H412 WeakPolarHBondContact O-CA 3.4Å; I354-Y413 HydrophobicContact CB-CD2 4.27Å; I354-Y413 HydrophobicContact CB-CE1 4.26Å; I354-Y413 HydrophobicContact CB-CE2 3.75Å; I354-Y413 HydrophobicContact CD1-CE2 3.84Å; I354-Y413 HydrophobicContact CG1-CE2 4.3Å; I354-Y413 HydrophobicContact CG2-CE1 4.15Å; I354-Y413 HydrophobicContact CG2-CE2 4.16Å; I354-Y413 WeakPolarHBondContact CG2-OH 3.47Å; I354-Y413 PolarHBondContact N-O 3.1Å; I354-Y413 PolarHBondContact O-N 2.84Å; I354-I415 HydrophobicContact CD1-CD1 3.66Å; I354-I415 HydrophobicContact CD1-CG1 4.07Å
355	P	90.7	Very high	86.9	Confident	69 Å²	69	56.1 Å²	56.1	45%	0.448	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	135.8	174.9	27.3	-34.3	0	0	0	110.8	H411	P355-H411 WeakPolarHBondContact CA-O 3.14Å
356	N	92.4	Very high	86.5	Confident	13 Å²	13	56.2 Å²	56.2	7%	0.07	32%	0.317	C	S	.	.			trans	-69.4	130.6	173.5	-173.3	-4.3	0	0	0	109.7	I354 W358 K359 R410 H411 Y413	I354-N356 PolarHBondContact O-N 3.01Å; N356-W358 PolarHBondContact O-N 2.89Å; N356-W358 PolarHBondContact OD1-N 3.34Å; N356-W358 VanDerWaalsContact OD1-N 3.15Å; N356-K359 VanDerWaalsContact O-CB 3.28Å; N356-K359 WeakPolarHBondContact O-CB 3Å; N356-K359 PolarHBondContact O-N 2.74Å; N356-R410 WeakPolarHBondContact CB-O 3.5Å; N356-R410 PolarHBondContact ND2-O 3.3Å; N356-H411 PolarHBondContact N-O 2.91Å; N356-Y413 HydrophobicContact CB-CD1 4.32Å
357	P	93.6	Very high	86.3	Confident	19 Å²	19	62.6 Å²	62.6	12%	0.123	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-30.6	174.7	-25.1	34.9	0	0	0	112.9	K359 Y376 V380 Y386	P357-K359 VanDerWaalsContact C-N 3.31Å; P357-K359 PolarHBondContact O-N 2.91Å; P357-Y376 HydrophobicContact CB-CE1 4.25Å; P357-Y376 PolarHBondContact O-OH 3.38Å; P357-V380 HydrophobicContact CB-CG1 4.32Å; P357-V380 HydrophobicContact CB-CG2 4.16Å; P357-V380 HydrophobicContact CG-CG1 4.28Å; P357-Y386 WeakPolarHBondContact CD-OH 3.3Å; P357-Y386 HydrophobicContact CG-CD2 4.24Å; P357-Y386 HydrophobicContact CG-CE1 4.03Å; P357-Y386 HydrophobicContact CG-CE2 3.47Å; P357-Y386 VanDerWaalsContact CG-CE2 3.47Å; P357-Y386 WeakPolarHBondContact CG-OH 3.25Å
358	W	94.4	Very high	86.5	Confident	14 Å²	14	60.1 Å²	60.1	5%	0.053	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	30.7	173.6	-65.7	-93	0	0	0	112.5	N356 W370 Y376 C377 V380 L392 I395 P447 C451	N356-W358 PolarHBondContact O-N 2.89Å; N356-W358 PolarHBondContact OD1-N 3.34Å; N356-W358 VanDerWaalsContact OD1-N 3.15Å; W358-W370 AromaticContact CD1-CD2 3.74Å; W358-W370 AromaticContact CD1-CE3 3.96Å; W358-W370 AromaticContact CD1-CG 3.62Å; W358-W370 HydrophobicContact CG-CG 4.35Å; W358-Y376 HydrophobicContact CZ2-CD1 4.36Å; W358-Y376 AromaticContact NE1-CD1 3.89Å; W358-C377 HydrophobicContact CZ2-CB 4.04Å; W358-V380 HydrophobicContact CH2-CB 4.31Å; W358-V380 HydrophobicContact CH2-CG1 3.93Å; W358-V380 HydrophobicContact CH2-CG2 4.36Å; W358-V380 HydrophobicContact CZ3-CG1 4.22Å; W358-L392 HydrophobicContact CH2-CD1 3.81Å; W358-L392 HydrophobicContact CZ3-CD1 4.06Å; W358-I395 HydrophobicContact CE3-CG2 4Å; W358-I395 HydrophobicContact CZ3-CG2 3.89Å; W358-P447 HydrophobicContact CB-CG 4.09Å; W358-P447 HydrophobicContact CD2-CB 3.95Å; W358-P447 HydrophobicContact CD2-CG 3.58Å; W358-P447 HydrophobicContact CE3-CB 4.08Å; W358-P447 HydrophobicContact CE3-CG 3.93Å; W358-P447 HydrophobicContact CG-CB 4.48Å; W358-P447 HydrophobicContact CG-CG 3.65Å; W358-P447 HydrophobicContact CH2-CB 4.34Å; W358-P447 HydrophobicContact CZ2-CB 4.19Å; W358-P447 HydrophobicContact CZ3-CB 4.28Å; W358-C451 VanDerWaalsContact CH2-SG 3.57Å; W358-C451 VanDerWaalsContact CZ2-SG 3.57Å
359	K	91	Very high	86.5	Confident	86 Å²	86	64.8 Å²	64.8	37%	0.374	34%	0.336	S	S	.	.			trans	-59.2	149.7	167.5	77.5	179	-169.5	-176.9	0	108.8	N356 P357 E368 W370 H411	N356-K359 VanDerWaalsContact O-CB 3.28Å; N356-K359 WeakPolarHBondContact O-CB 3Å; N356-K359 PolarHBondContact O-N 2.74Å; P357-K359 VanDerWaalsContact C-N 3.31Å; P357-K359 PolarHBondContact O-N 2.91Å; K359-E368 WeakPolarHBondContact O-CG 3.18Å; K359-W370 PolarHBondContact O-NE1 3.25Å; K359-H411 HydrophobicContact CB-CB 4.42Å
360	R	87.6	Confident	86.6	Confident	20 Å²	20	65.4 Å²	65.4	8%	0.075	34%	0.338	C	S	.	.			trans	-91.5	166.8	174.3	-52.4	-166.9	178.1	-132.7	-1.9	111.7	Y252 Y362 W370 M408 S443	Y252-R360 HydrophobicContact CE1-CB 4.32Å; Y252-R360 HydrophobicContact CE2-CB 3.78Å; Y252-R360 HydrophobicContact CE2-CG 4.37Å; Y252-R360 WeakPolarHBondContact OH-CB 3.38Å; R360-Y362 WeakPolarHBondContact O-CD2 3.46Å; R360-Y362 WeakPolarHBondContact O-CE2 3.26Å; R360-W370 HydrophobicContact CG-CZ2 4.18Å; R360-M408 PolarHBondContact NE-O 3.49Å; R360-S443 PolarHBondContact NH1-OG 3.14Å; R360-S443 PolarHBondContact NH2-OG 2.99Å
361	S	84.3	Confident	86.6	Confident	12 Å²	12	66 Å²	66	8%	0.084	34%	0.335	C	S	.	.			trans	-80.4	108.8	175	44.8	0	0	0	0	111.5	Y252 T363 G366 E368	Y252-S361 PolarHBondContact OH-N 3.36Å; Y252-S361 PolarHBondContact OH-O 3.5Å; S361-T363 PolarHBondContact O-N 2.92Å; S361-G366 WeakPolarHBondContact CB-O 3.3Å; S361-G366 VanDerWaalsContact OG-C 3.29Å; S361-G366 PolarHBondContact OG-O 3.19Å; S361-E368 VanDerWaalsContact N-CG 3.35Å
362	Y	77.1	Confident	86.6	Confident	51 Å²	51	67.7 Å²	67.7	20%	0.2	35%	0.353	C	S	.	.			trans	-76.8	37.5	-179.5	-67.7	-90.6	0	0	0	113.7	P215 Y252 F253 R360 D409 H411	P215-Y362 HydrophobicContact CG-CD1 4.21Å; Y252-Y362 HydrophobicContact CD2-CE1 4.33Å; Y252-Y362 HydrophobicContact CE2-CD1 4.09Å; Y252-Y362 AromaticContact CE2-CE1 3.74Å; Y252-Y362 HydrophobicContact CE2-CE1 3.74Å; F253-Y362 HydrophobicContact CB-CD1 3.65Å; F253-Y362 HydrophobicContact CB-CE1 3.93Å; F253-Y362 HydrophobicContact CD1-CD1 4.22Å; F253-Y362 HydrophobicContact CG-CD1 4.21Å; R360-Y362 WeakPolarHBondContact O-CD2 3.46Å; R360-Y362 WeakPolarHBondContact O-CE2 3.26Å; Y362-D409 VanDerWaalsContact CE1-OD1 3.27Å; Y362-D409 WeakPolarHBondContact CE1-OD1 3.4Å; Y362-D409 PolarHBondContact OH-OD1 3.3Å; Y362-H411 HydrophobicContact CE2-CB 3.75Å; Y362-H411 AromaticContact CZ-CG 4Å; Y362-H411 VanDerWaalsContact OH-CB 3.25Å; Y362-H411 WeakPolarHBondContact OH-CB 3.49Å
363	T	75.3	Confident	86.7	Confident	79 Å²	79	66.3 Å²	66.3	49%	0.485	35%	0.346	S	S	.	.	S	Bend	trans	-132	151.3	177.7	60.9	0	0	0	0	109.2	S361 S365 G366	S361-T363 PolarHBondContact O-N 2.92Å; T363-S365 PolarHBondContact O-N 3.14Å; T363-G366 WeakPolarHBondContact OG1-CA 3.4Å; T363-G366 PolarHBondContact OG1-N 2.99Å; T363-G366 VanDerWaalsContact OG1-N 3.14Å
364	F	73.8	Confident	86.6	Confident	145 Å²	145	67.4 Å²	67.4	64%	0.636	35%	0.352	S	S	*	.	S	Bend	trans	-66.9	-23.6	-175.1	-65.4	-69.7	0	0	0	114.2	F251 F253	F251-F364 HydrophobicContact CD1-CD1 4.08Å; F251-F364 AromaticContact CD2-CD1 3.6Å; F251-F364 HydrophobicContact CD2-CD1 3.6Å; F251-F364 AromaticContact CD2-CE1 3.56Å; F251-F364 HydrophobicContact CD2-CE1 3.56Å; F251-F364 AromaticContact CE1-CD1 3.92Å; F251-F364 HydrophobicContact CE1-CD1 3.92Å; F251-F364 AromaticContact CE2-CD1 3.44Å; F251-F364 HydrophobicContact CE2-CD1 3.44Å; F251-F364 VanDerWaalsContact CE2-CD1 3.44Å; F251-F364 AromaticContact CE2-CE1 3.8Å; F251-F364 HydrophobicContact CE2-CE1 3.8Å; F251-F364 AromaticContact CG-CD1 3.93Å; F251-F364 HydrophobicContact CG-CD1 3.93Å; F251-F364 AromaticContact CG-CE1 4Å; F251-F364 HydrophobicContact CG-CE1 4Å; F251-F364 HydrophobicContact CZ-CB 4.45Å; F251-F364 AromaticContact CZ-CD1 3.61Å; F251-F364 HydrophobicContact CZ-CD1 3.61Å; F251-F364 HydrophobicContact CZ-CE1 4.41Å; F253-F364 AromaticContact CE2-CE1 3.94Å; F253-F364 HydrophobicContact CE2-CE1 3.94Å; F253-F364 AromaticContact CE2-CZ 4Å; F253-F364 HydrophobicContact CE2-CZ 4Å; F253-F364 AromaticContact CZ-CD1 3.83Å; F253-F364 HydrophobicContact CZ-CD1 3.83Å; F253-F364 AromaticContact CZ-CE1 3.55Å; F253-F364 HydrophobicContact CZ-CE1 3.55Å; F253-F364 HydrophobicContact CZ-CG 4.46Å; F253-F364 AromaticContact CZ-CZ 3.94Å; F253-F364 HydrophobicContact CZ-CZ 3.94Å
365	S	74.3	Confident	86.6	Confident	116 Å²	116	73 Å²	73	81%	0.811	38%	0.375	S	S	*	.	S	Bend	trans	-117.8	-12	-175.6	55.8	0	0	0	0	114.4	T363	T363-S365 PolarHBondContact O-N 3.14Å
366	G	77.8	Confident	86.8	Confident	28 Å²	28	71.5 Å²	71.5	29%	0.289	36%	0.361	S	S	.	.			trans	-72.3	145.3	-177	0	0	0	0	0	111.6	S361 T363	S361-G366 WeakPolarHBondContact CB-O 3.3Å; S361-G366 VanDerWaalsContact OG-C 3.29Å; S361-G366 PolarHBondContact OG-O 3.19Å; T363-G366 WeakPolarHBondContact OG1-CA 3.4Å; T363-G366 PolarHBondContact OG1-N 2.99Å; T363-G366 VanDerWaalsContact OG1-N 3.14Å
367	R	83.8	Confident	86.8	Confident	203 Å²	203	71 Å²	71	77%	0.766	36%	0.358	S	S	*	.			trans	-121.3	146.7	165.7	-66.5	-174.8	-176.5	-179	0.7	108.7	E371 V372	R367-E371 WeakPolarHBondContact CA-OE2 3.48Å; R367-E371 WeakPolarHBondContact CB-OE2 3.16Å; R367-V372 HydrophobicContact CB-CG2 4.36Å
368	E	89.6	Confident	86.8	Confident	54 Å²	54	73.5 Å²	73.5	25%	0.252	37%	0.371	S	S	.	.			trans	-92.9	158.8	178.1	-70.6	-72.2	166.1	0	0	111.1	K359 S361 W370 E371	K359-E368 WeakPolarHBondContact O-CG 3.18Å; S361-E368 VanDerWaalsContact N-CG 3.35Å; E368-W370 PolarHBondContact O-N 3.23Å; E368-E371 PolarHBondContact N-OE2 2.95Å; E368-E371 WeakPolarHBondContact O-CB 3.31Å; E368-E371 PolarHBondContact O-N 3.39Å
369	E	89.5	Confident	86.7	Confident	137 Å²	137	76.2 Å²	76.2	64%	0.64	39%	0.392	S	S	*	.	H	α-helix	trans	-58	-37.3	-175.8	-68.1	-170.7	162.2	0	0	112.8	E371 V372 N373 Y376	E369-E371 PolarHBondContact O-N 2.84Å; E369-V372 PolarHBondContact O-N 3.46Å; E369-N373 VanDerWaalsContact O-CB 3.27Å; E369-N373 WeakPolarHBondContact O-CB 3.46Å; E369-N373 PolarHBondContact O-N 2.92Å; E369-Y376 HydrophobicContact CB-CD2 4.02Å; E369-Y376 HydrophobicContact CB-CE2 3.89Å
370	W	92.2	Very high	86.8	Confident	15 Å²	15	72.5 Å²	72.5	6%	0.057	38%	0.376	C	S	.	.	H	α-helix	trans	-67.8	-21.6	179.9	71.1	-97.4	0	0	0	113.4	W358 K359 R360 E368 Y376 A446 Q450	W358-W370 AromaticContact CD1-CD2 3.74Å; W358-W370 AromaticContact CD1-CE3 3.96Å; W358-W370 AromaticContact CD1-CG 3.62Å; W358-W370 HydrophobicContact CG-CG 4.35Å; K359-W370 PolarHBondContact O-NE1 3.25Å; R360-W370 HydrophobicContact CG-CZ2 4.18Å; E368-W370 PolarHBondContact O-N 3.23Å; W370-Y376 HydrophobicContact CB-CD1 3.41Å; W370-Y376 VanDerWaalsContact CB-CD1 3.41Å; W370-Y376 HydrophobicContact CB-CD2 4.25Å; W370-Y376 HydrophobicContact CB-CE1 3.75Å; W370-Y376 HydrophobicContact CB-CG 3.68Å; W370-A446 HydrophobicContact CE3-CB 3.57Å; W370-A446 HydrophobicContact CH2-CB 4.49Å; W370-A446 HydrophobicContact CZ3-CB 3.46Å; W370-A446 VanDerWaalsContact CZ3-CB 3.46Å; W370-Q450 PolarHBondContact O-NE2 3.19Å
371	E	90.8	Very high	87	Confident	76 Å²	76	74.7 Å²	74.7	36%	0.355	39%	0.386	S	S	.	.	H	α-helix	trans	-77.7	-29	177.8	-63.5	-177.5	156.9	0	0	111.8	R367 E368 E369	R367-E371 WeakPolarHBondContact CA-OE2 3.48Å; R367-E371 WeakPolarHBondContact CB-OE2 3.16Å; E368-E371 PolarHBondContact N-OE2 2.95Å; E368-E371 WeakPolarHBondContact O-CB 3.31Å; E368-E371 PolarHBondContact O-N 3.39Å; E369-E371 PolarHBondContact O-N 2.84Å
372	V	91.1	Very high	87.3	Confident	104 Å²	104	81.5 Å²	81.5	63%	0.63	42%	0.417	S	S	*	.	H	α-helix	trans	-99.2	-36.7	-176.3	-174.2	0	0	0	0	111.3	R367 E369 P374	R367-V372 HydrophobicContact CB-CG2 4.36Å; E369-V372 PolarHBondContact O-N 3.46Å; V372-P374 WeakPolarHBondContact O-CD 3.33Å
373	N	91.6	Very high	88	Confident	61 Å²	61	81.2 Å²	81.2	33%	0.326	43%	0.425	S	S	.	.			trans	-96	111.9	-175.8	-176.1	-1.8	0	0	0	111.9	E369 F375 Y376	E369-N373 VanDerWaalsContact O-CB 3.27Å; E369-N373 WeakPolarHBondContact O-CB 3.46Å; E369-N373 PolarHBondContact O-N 2.92Å; N373-F375 PolarHBondContact O-N 3.06Å; N373-F375 PolarHBondContact OD1-N 3Å; N373-Y376 WeakPolarHBondContact O-CB 3.41Å; N373-Y376 PolarHBondContact O-N 3.09Å
374	P	87.9	Confident	88.6	Confident	91 Å²	91	84.9 Å²	84.9	59%	0.591	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-19.1	178.1	28.7	-34.3	0	0	0	113.9	V372	V372-P374 WeakPolarHBondContact O-CD 3.33Å
375	F	90.5	Very high	89.3	Confident	139 Å²	139	78.8 Å²	78.8	61%	0.61	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	12.3	179.7	-58.4	-74.9	0	0	0	113.1	N373 C377 D378	N373-F375 PolarHBondContact O-N 3.06Å; N373-F375 PolarHBondContact OD1-N 3Å; F375-C377 PolarHBondContact O-N 3.37Å; F375-C377 VanDerWaalsContact O-N 3.15Å; F375-D378 PolarHBondContact O-N 3.04Å
376	Y	93.5	Very high	90	Very high	39 Å²	39	74.6 Å²	74.6	15%	0.153	37%	0.373	C	S	.	.	H	α-helix	trans	-53.1	-38.9	-177.4	-177.9	-102.2	0	0	0	113.3	P357 W358 E369 W370 N373 D378 S379 V380	P357-Y376 HydrophobicContact CB-CE1 4.25Å; P357-Y376 PolarHBondContact O-OH 3.38Å; W358-Y376 HydrophobicContact CZ2-CD1 4.36Å; W358-Y376 AromaticContact NE1-CD1 3.89Å; E369-Y376 HydrophobicContact CB-CD2 4.02Å; E369-Y376 HydrophobicContact CB-CE2 3.89Å; W370-Y376 HydrophobicContact CB-CD1 3.41Å; W370-Y376 VanDerWaalsContact CB-CD1 3.41Å; W370-Y376 HydrophobicContact CB-CD2 4.25Å; W370-Y376 HydrophobicContact CB-CE1 3.75Å; W370-Y376 HydrophobicContact CB-CG 3.68Å; N373-Y376 WeakPolarHBondContact O-CB 3.41Å; N373-Y376 PolarHBondContact O-N 3.09Å; Y376-D378 PolarHBondContact O-N 2.93Å; Y376-S379 PolarHBondContact O-N 2.96Å; Y376-V380 HydrophobicContact CD1-CG2 3.75Å; Y376-V380 HydrophobicContact CE1-CG2 3.37Å; Y376-V380 WeakPolarHBondContact O-CG2 3.25Å; Y376-V380 PolarHBondContact O-N 3.35Å; Y376-V380 VanDerWaalsContact O-N 3.16Å
377	C	93.6	Very high	90.4	Very high	2 Å²	2	77.3 Å²	77.3	1%	0.014	38%	0.381	C	S	.	.	H	α-helix	trans	-63	-28.2	180	-173.3	0	0	0	0	113.6	W358 F375 S379 V380 K381 Q450 C451	W358-C377 HydrophobicContact CZ2-CB 4.04Å; F375-C377 PolarHBondContact O-N 3.37Å; F375-C377 VanDerWaalsContact O-N 3.15Å; C377-S379 VanDerWaalsContact C-N 3.32Å; C377-S379 PolarHBondContact O-N 3.34Å; C377-V380 PolarHBondContact O-N 3.32Å; C377-K381 WeakPolarHBondContact O-CB 3.34Å; C377-K381 WeakPolarHBondContact O-CG 3.43Å; C377-K381 PolarHBondContact O-N 3.06Å; C377-Q450 HydrophobicContact CB-CB 3.84Å; C377-C451 HydrophobicContact CB-CB 4.07Å; C377-C451 WeakPolarHBondContact CB-SG 3.24Å; C377-C451 WeakPolarHBondContact SG-CA 3.33Å; C377-C451 WeakPolarHBondContact SG-CB 3Å; C377-C451 CovalentContact SG-SG 2.02Å; C377-C451 PolarHBondContact SG-SG 3.2Å
378	D	92.6	Very high	90.1	Very high	71 Å²	71	70.8 Å²	70.8	38%	0.38	37%	0.366	S	S	.	.	H	α-helix	trans	-69.1	-34.4	-179.6	-63	-33.3	0	0	0	111.4	F375 Y376 K381 Q382	F375-D378 PolarHBondContact O-N 3.04Å; Y376-D378 PolarHBondContact O-N 2.93Å; D378-K381 IonicContact OD1-NZ 3.58Å; D378-Q382 WeakPolarHBondContact O-CG 3.27Å
379	S	92.9	Very high	89.7	Confident	71 Å²	71	70.3 Å²	70.3	50%	0.497	38%	0.376	S	S	.	.	H	α-helix	trans	-67.3	-42.8	169.2	-55.3	0	0	0	0	111.6	Y376 C377 K381 Q382 A383	Y376-S379 PolarHBondContact O-N 2.96Å; C377-S379 VanDerWaalsContact C-N 3.32Å; C377-S379 PolarHBondContact O-N 3.34Å; S379-K381 VanDerWaalsContact C-N 3.32Å; S379-K381 PolarHBondContact O-N 3.02Å; S379-Q382 PolarHBondContact O-N 2.78Å; S379-Q382 VanDerWaalsContact O-N 3.09Å; S379-A383 PolarHBondContact O-N 2.85Å
380	V	93.1	Very high	89.5	Confident	8 Å²	8	67.4 Å²	67.4	5%	0.048	37%	0.365	C	S	.	.	H	α-helix	trans	-61.9	-41	178.1	177.6	0	0	0	0	111	P357 W358 Y376 C377 Q382 A383 Y386	P357-V380 HydrophobicContact CB-CG1 4.32Å; P357-V380 HydrophobicContact CB-CG2 4.16Å; P357-V380 HydrophobicContact CG-CG1 4.28Å; W358-V380 HydrophobicContact CH2-CB 4.31Å; W358-V380 HydrophobicContact CH2-CG1 3.93Å; W358-V380 HydrophobicContact CH2-CG2 4.36Å; W358-V380 HydrophobicContact CZ3-CG1 4.22Å; Y376-V380 HydrophobicContact CD1-CG2 3.75Å; Y376-V380 HydrophobicContact CE1-CG2 3.37Å; Y376-V380 WeakPolarHBondContact O-CG2 3.25Å; Y376-V380 PolarHBondContact O-N 3.35Å; Y376-V380 VanDerWaalsContact O-N 3.16Å; C377-V380 PolarHBondContact O-N 3.32Å; V380-Q382 PolarHBondContact O-N 2.89Å; V380-Q382 VanDerWaalsContact O-N 3.13Å; V380-A383 PolarHBondContact O-N 3.43Å; V380-Y386 HydrophobicContact CG1-CD2 3.78Å; V380-Y386 HydrophobicContact CG1-CE2 4.49Å; V380-Y386 HydrophobicContact CG1-CG 3.85Å; V380-Y386 WeakPolarHBondContact O-CB 3.41Å
381	K	91	Very high	89.4	Confident	67 Å²	67	66.7 Å²	66.7	29%	0.291	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-21.2	175.9	-77	171.2	-178.9	170.7	0	113.5	C377 D378 S379 N387 L392 C451	C377-K381 WeakPolarHBondContact O-CB 3.34Å; C377-K381 WeakPolarHBondContact O-CG 3.43Å; C377-K381 PolarHBondContact O-N 3.06Å; D378-K381 IonicContact OD1-NZ 3.58Å; S379-K381 VanDerWaalsContact C-N 3.32Å; S379-K381 PolarHBondContact O-N 3.02Å; K381-N387 WeakPolarHBondContact O-CA 3.01Å; K381-N387 WeakPolarHBondContact O-CB 3.35Å; K381-L392 HydrophobicContact CG-CD2 3.54Å; K381-C451 PolarHBondContact NZ-O 3.45Å
382	Q	91.8	Very high	89.5	Confident	155 Å²	155	63.4 Å²	63.4	72%	0.724	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-20.1	177.5	-63.8	176	20.2	0	0	112.4	D378 S379 V380	D378-Q382 WeakPolarHBondContact O-CG 3.27Å; S379-Q382 PolarHBondContact O-N 2.78Å; S379-Q382 VanDerWaalsContact O-N 3.09Å; V380-Q382 PolarHBondContact O-N 2.89Å; V380-Q382 VanDerWaalsContact O-N 3.13Å
383	A	91.1	Very high	89.6	Confident	45 Å²	45	59 Å²	59	37%	0.372	32%	0.32	S	S	.	.	S	Bend	trans	-80.2	133.8	-177.9	0	0	0	0	0	112	S379 V380 Y386 N387	S379-A383 PolarHBondContact O-N 2.85Å; V380-A383 PolarHBondContact O-N 3.43Å; A383-Y386 HydrophobicContact CB-CD2 4.5Å; A383-Y386 CarbonylContact O-C 3.59Å; A383-Y386 WeakPolarHBondContact O-CA 3.49Å; A383-Y386 WeakPolarHBondContact O-CB 3.05Å; A383-Y386 PolarHBondContact O-N 3.01Å; A383-N387 PolarHBondContact O-N 3.46Å
384	Y	88.4	Confident	89.6	Confident	155 Å²	155	56.7 Å²	56.7	61%	0.608	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	137.3	167	175.1	-95.5	0	0	0	110	N387 D421	Y384-N387 WeakPolarHBondContact CA-OD1 3.25Å; Y384-D421 WeakPolarHBondContact CE2-OD2 3.23Å; Y384-D421 VanDerWaalsContact CZ-OD2 3.26Å; Y384-D421 PolarHBondContact OH-OD1 2.99Å; Y384-D421 PolarHBondContact OH-OD2 2.94Å
385	P	88.8	Confident	90	Very high	18 Å²	18	52.4 Å²	52.4	12%	0.117	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	cis	-98	24.3	6.3	39.2	-36.8	0	0	0	114.7
386	Y	89.2	Confident	90.2	Very high	27 Å²	27	45.9 Å²	45.9	11%	0.106	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-12	-176.7	-51.8	-63.9	0	0	0	113.7	P357 V380 A383 R391 I395 Y413	P357-Y386 WeakPolarHBondContact CD-OH 3.3Å; P357-Y386 HydrophobicContact CG-CD2 4.24Å; P357-Y386 HydrophobicContact CG-CE1 4.03Å; P357-Y386 HydrophobicContact CG-CE2 3.47Å; P357-Y386 VanDerWaalsContact CG-CE2 3.47Å; P357-Y386 WeakPolarHBondContact CG-OH 3.25Å; V380-Y386 HydrophobicContact CG1-CD2 3.78Å; V380-Y386 HydrophobicContact CG1-CE2 4.49Å; V380-Y386 HydrophobicContact CG1-CG 3.85Å; V380-Y386 WeakPolarHBondContact O-CB 3.41Å; A383-Y386 HydrophobicContact CB-CD2 4.5Å; A383-Y386 CarbonylContact O-C 3.59Å; A383-Y386 WeakPolarHBondContact O-CA 3.49Å; A383-Y386 WeakPolarHBondContact O-CB 3.05Å; A383-Y386 PolarHBondContact O-N 3.01Å; Y386-R391 HydrophobicContact CD1-CG 3.63Å; Y386-R391 HydrophobicContact CE1-CG 3.8Å; Y386-I395 HydrophobicContact CD1-CD1 3.79Å; Y386-I395 HydrophobicContact CE1-CD1 3.32Å; Y386-Y413 WeakPolarHBondContact CE1-OH 3.28Å; Y386-Y413 PolarHBondContact OH-OH 3.39Å
387	N	86.2	Confident	90.3	Very high	86 Å²	86	44 Å²	44	46%	0.46	24%	0.244	S	C	.	.	S	Bend	trans	-75.6	-20	-178.8	65.1	-28.3	0	0	0	114.7	K381 A383 Y384	K381-N387 WeakPolarHBondContact O-CA 3.01Å; K381-N387 WeakPolarHBondContact O-CB 3.35Å; A383-N387 PolarHBondContact O-N 3.46Å; Y384-N387 WeakPolarHBondContact CA-OD1 3.25Å
388	S	76.7	Confident	90.4	Very high	65 Å²	65	44 Å²	44	46%	0.455	24%	0.244	S	C	.	.	S	Bend	trans	-134.4	156	178.9	62	0	0	0	0	111.8
389	G	80.7	Confident	90.6	Very high	45 Å²	45	41 Å²	41	46%	0.464	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	78	-158	172.4	0	0	0	0	0	115.5	E422	G389-E422 WeakPolarHBondContact CA-OE1 3.45Å
390	N	85.8	Confident	90.9	Very high	75 Å²	75	37.6 Å²	37.6	40%	0.401	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	3.5	-177	-68.8	-57.7	0	0	0	114	L392 L393 N394 E422	N390-L392 PolarHBondContact O-N 2.82Å; N390-L393 PolarHBondContact O-N 2.89Å; N390-N394 WeakPolarHBondContact O-CB 3.28Å; N390-N394 PolarHBondContact O-N 3.28Å; N390-N394 PolarHBondContact O-ND2 2.83Å; N390-E422 PolarHBondContact N-OE2 3.41Å
391	R	89.8	Confident	91.1	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-59.7	-49.6	-170.6	-177.8	66.1	73.2	-148.9	6.6	112.4	Y386 L393 N394 I395 G420 D421 G423	Y386-R391 HydrophobicContact CD1-CG 3.63Å; Y386-R391 HydrophobicContact CE1-CG 3.8Å; R391-L393 PolarHBondContact O-N 2.86Å; R391-N394 WeakPolarHBondContact O-CB 3.46Å; R391-N394 PolarHBondContact O-N 2.9Å; R391-I395 PolarHBondContact O-N 3.02Å; R391-G420 PolarHBondContact NH2-O 2.98Å; R391-D421 PolarHBondContact NE-O 2.72Å; R391-D421 VanDerWaalsContact NH2-C 3.27Å; R391-D421 VanDerWaalsContact NH2-CA 3.25Å; R391-D421 PolarHBondContact NH2-O 2.96Å; R391-G423 PolarHBondContact NH1-O 2.76Å
392	L	92.5	Very high	91.4	Very high	8 Å²	8	34.2 Å²	34.2	4%	0.042	19%	0.189	C	C	.	.	H	α-helix	trans	-65.4	-39.6	-179.6	-176.5	53	0	0	0	111.8	W358 K381 N390 N394 I395 I396 M453	W358-L392 HydrophobicContact CH2-CD1 3.81Å; W358-L392 HydrophobicContact CZ3-CD1 4.06Å; K381-L392 HydrophobicContact CG-CD2 3.54Å; N390-L392 PolarHBondContact O-N 2.82Å; L392-N394 VanDerWaalsContact C-N 3.32Å; L392-N394 PolarHBondContact O-N 2.69Å; L392-I395 PolarHBondContact O-N 2.9Å; L392-I396 WeakPolarHBondContact O-CG1 3.44Å; L392-I396 PolarHBondContact O-N 3.48Å; L392-M453 HydrophobicContact CB-CE 4.49Å; L392-M453 HydrophobicContact CD2-CE 3.34Å; L392-M453 HydrophobicContact CG-CE 3.74Å
393	L	93	Very high	91.7	Very high	12 Å²	12	26.9 Å²	26.9	6%	0.063	16%	0.155	C	C	.	.	H	α-helix	trans	-64	-37	174	-67	172.6	0	0	0	112.2	N390 R391 I395 I396 D397 M453 K455 T522	N390-L393 PolarHBondContact O-N 2.89Å; R391-L393 PolarHBondContact O-N 2.86Å; L393-I395 VanDerWaalsContact C-N 3.34Å; L393-I396 PolarHBondContact O-N 2.81Å; L393-D397 PolarHBondContact O-N 2.96Å; L393-M453 HydrophobicContact CD2-CB 3.94Å; L393-K455 HydrophobicContact CB-CG 4.08Å; L393-K455 HydrophobicContact CD1-CG 4.25Å; L393-T522 HydrophobicContact CD1-CG2 3.87Å
394	N	93.3	Very high	92	Very high	11 Å²	11	24.8 Å²	24.8	6%	0.059	14%	0.137	C	C	.	.	H	α-helix	trans	-66.1	-36.5	174.9	-67.7	-22.5	0	0	0	111.8	N390 R391 L392 I396 D397 M398 L425 K455	N390-N394 WeakPolarHBondContact O-CB 3.28Å; N390-N394 PolarHBondContact O-N 3.28Å; N390-N394 PolarHBondContact O-ND2 2.83Å; R391-N394 WeakPolarHBondContact O-CB 3.46Å; R391-N394 PolarHBondContact O-N 2.9Å; L392-N394 VanDerWaalsContact C-N 3.32Å; L392-N394 PolarHBondContact O-N 2.69Å; N394-I396 VanDerWaalsContact C-N 3.31Å; N394-D397 PolarHBondContact O-N 3.02Å; N394-M398 PolarHBondContact O-N 2.55Å; N394-L425 HydrophobicContact CB-CD1 3.53Å; N394-L425 HydrophobicContact CB-CG 3.72Å; N394-K455 PolarHBondContact OD1-NZ 2.95Å
395	I	94.8	Very high	92.4	Very high	2 Å²	2	17.4 Å²	17.4	1%	0.01	11%	0.108	C	C	.	.	H	α-helix	trans	-64.9	-37.9	173.3	-71.5	176.3	0	0	0	110.7	W358 Y386 R391 L392 L393 M398 S399 Y413 L425	W358-I395 HydrophobicContact CE3-CG2 4Å; W358-I395 HydrophobicContact CZ3-CG2 3.89Å; Y386-I395 HydrophobicContact CD1-CD1 3.79Å; Y386-I395 HydrophobicContact CE1-CD1 3.32Å; R391-I395 PolarHBondContact O-N 3.02Å; L392-I395 PolarHBondContact O-N 2.9Å; L393-I395 VanDerWaalsContact C-N 3.34Å; I395-M398 WeakPolarHBondContact O-CB 3.44Å; I395-M398 PolarHBondContact O-N 3.18Å; I395-S399 WeakPolarHBondContact O-CB 3.49Å; I395-S399 PolarHBondContact O-N 2.89Å; I395-Y413 HydrophobicContact CD1-CE1 4.13Å; I395-L425 HydrophobicContact CG1-CD1 3.83Å
396	I	95.5	Very high	92.7	Very high	1 Å²	1	17.6 Å²	17.6	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-66.9	-42.6	176.7	-64.4	168.6	0	0	0	111	L392 L393 N394 M398 S399 I400 L448 C451 M453	L392-I396 WeakPolarHBondContact O-CG1 3.44Å; L392-I396 PolarHBondContact O-N 3.48Å; L393-I396 PolarHBondContact O-N 2.81Å; N394-I396 VanDerWaalsContact C-N 3.31Å; I396-M398 VanDerWaalsContact C-N 3.27Å; I396-M398 PolarHBondContact O-N 3.16Å; I396-S399 PolarHBondContact O-N 3.11Å; I396-I400 HydrophobicContact CG2-CD1 4.12Å; I396-I400 WeakPolarHBondContact O-CG1 3.36Å; I396-I400 PolarHBondContact O-N 2.82Å; I396-L448 HydrophobicContact CG2-CB 4.23Å; I396-L448 HydrophobicContact CG2-CD1 3.69Å; I396-C451 HydrophobicContact CD1-CB 4.03Å; I396-M453 HydrophobicContact CD1-CB 3.94Å; I396-M453 WeakPolarHBondContact CD1-O 3.44Å; I396-M453 WeakPolarHBondContact CG2-O 3.42Å
397	D	95.8	Very high	92.9	Very high	1 Å²	1	16.4 Å²	16.4	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-55.9	-44.4	171.3	-72.5	-23.8	0	0	0	111.1	F274 R276 L393 N394 I400 F401 K455 T458	F274-D397 HydrophobicContact CE1-CB 3.97Å; F274-D397 HydrophobicContact CE2-CB 4.41Å; F274-D397 HydrophobicContact CZ-CB 3.86Å; R276-D397 IonicContact CZ-OD2 2.74Å; R276-D397 IonicContact NH1-OD2 3.8Å; R276-D397 IonicContact NH2-OD2 3.51Å; R276-D397 PolarHBondContact NH2-OD2 2.77Å; L393-D397 PolarHBondContact O-N 2.96Å; N394-D397 PolarHBondContact O-N 3.02Å; D397-I400 PolarHBondContact O-N 3.08Å; D397-F401 PolarHBondContact O-N 2.73Å; D397-K455 WeakPolarHBondContact OD2-CD 3.42Å; D397-K455 WeakPolarHBondContact OD2-CE 3.38Å; D397-K455 IonicContact OD2-NZ 3.74Å; D397-K455 PolarHBondContact OD2-NZ 2.94Å; D397-T458 WeakPolarHBondContact OD1-CB 3.37Å; D397-T458 WeakPolarHBondContact OD1-CG2 3.35Å; D397-T458 PolarHBondContact OD1-OG1 3.36Å
398	M	96.2	Very high	93.1	Very high	2 Å²	2	14.6 Å²	14.6	1%	0.01	10%	0.098	C	C	.	.	H	α-helix	trans	-64.9	-40.5	178	-173.9	175.4	67.6	0	0	112.1	N394 I395 I396 F401 D402 R410 Y413	N394-M398 PolarHBondContact O-N 2.55Å; I395-M398 WeakPolarHBondContact O-CB 3.44Å; I395-M398 PolarHBondContact O-N 3.18Å; I396-M398 VanDerWaalsContact C-N 3.27Å; I396-M398 PolarHBondContact O-N 3.16Å; M398-F401 WeakPolarHBondContact O-CB 3.41Å; M398-F401 PolarHBondContact O-N 2.78Å; M398-D402 WeakPolarHBondContact O-CB 3.49Å; M398-D402 VanDerWaalsContact O-CG 3.32Å; M398-D402 PolarHBondContact O-N 3.37Å; M398-R410 HydrophobicContact CE-CG 3.85Å; M398-R410 HydrophobicContact SD-CG 4.04Å; M398-Y413 HydrophobicContact CE-CD1 4.15Å; M398-Y413 HydrophobicContact CE-CG 4.42Å
399	S	96.9	Very high	93.7	Very high	7 Å²	7	12.3 Å²	12.3	5%	0.049	8%	0.081	C	C	.	.	H	α-helix	trans	-64.5	-38.8	175.3	166.6	0	0	0	0	112.3	I395 I396 D402 F403 I444	I395-S399 WeakPolarHBondContact O-CB 3.49Å; I395-S399 PolarHBondContact O-N 2.89Å; I396-S399 PolarHBondContact O-N 3.11Å; S399-D402 PolarHBondContact O-N 2.79Å; S399-F403 VanDerWaalsContact O-CB 3.32Å; S399-F403 WeakPolarHBondContact O-CB 3.48Å; S399-F403 PolarHBondContact O-N 2.81Å; S399-I444 PolarHBondContact OG-O 3.44Å
400	I	97.6	Very high	94.2	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-63.8	-45.8	173.5	-69	167.3	0	0	0	110.1	I396 D397 F403 L404 L445 L448 I454 T458 L462 V504	I396-I400 HydrophobicContact CG2-CD1 4.12Å; I396-I400 WeakPolarHBondContact O-CG1 3.36Å; I396-I400 PolarHBondContact O-N 2.82Å; D397-I400 PolarHBondContact O-N 3.08Å; I400-F403 PolarHBondContact O-N 2.81Å; I400-L404 HydrophobicContact CG2-CD1 4.22Å; I400-L404 WeakPolarHBondContact O-CG 2.84Å; I400-L404 PolarHBondContact O-N 3.43Å; I400-L445 HydrophobicContact CG1-CD2 4.49Å; I400-L448 HydrophobicContact CD1-CD2 4.4Å; I400-L448 HydrophobicContact CG1-CD2 4.22Å; I400-I454 HydrophobicContact CD1-CD1 3.66Å; I400-I454 HydrophobicContact CD1-CG1 4.24Å; I400-T458 HydrophobicContact CD1-CG2 4.29Å; I400-L462 HydrophobicContact CD1-CD1 4.27Å; I400-L462 HydrophobicContact CG2-CD1 4.16Å; I400-L462 HydrophobicContact CG2-CD2 4.23Å; I400-V504 HydrophobicContact CD1-CG1 4.28Å; I400-V504 HydrophobicContact CG1-CG1 4.07Å; I400-V504 HydrophobicContact CG2-CG1 4.1Å; I400-V504 HydrophobicContact CG2-CG2 4.41Å
401	F	97.9	Very high	94.4	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-58.4	-50.5	175.8	177.4	-104.2	0	0	0	111.8	A265 L268 D269 L272 F274 V277 D397 M398 F403 L404 I405 H427	A265-F401 HydrophobicContact CB-CZ 3.83Å; A265-F401 WeakPolarHBondContact O-CE2 3.32Å; A265-F401 WeakPolarHBondContact O-CZ 3.37Å; L268-F401 HydrophobicContact CB-CE2 4.26Å; L268-F401 HydrophobicContact CD2-CD2 4.22Å; L268-F401 HydrophobicContact CD2-CE2 4.1Å; L268-F401 HydrophobicContact CG-CD2 4.4Å; L268-F401 HydrophobicContact CG-CE2 4.17Å; D269-F401 HydrophobicContact CB-CE2 3.83Å; D269-F401 HydrophobicContact CB-CZ 4.25Å; L272-F401 HydrophobicContact CD1-CD2 4.14Å; F274-F401 HydrophobicContact CD2-CB 4.42Å; F274-F401 HydrophobicContact CD2-CD2 4.48Å; F274-F401 HydrophobicContact CE2-CB 4.07Å; V277-F401 HydrophobicContact CG2-CE1 4.37Å; V277-F401 HydrophobicContact CG2-CZ 3.92Å; D397-F401 PolarHBondContact O-N 2.73Å; M398-F401 WeakPolarHBondContact O-CB 3.41Å; M398-F401 PolarHBondContact O-N 2.78Å; F401-F403 VanDerWaalsContact C-N 3.31Å; F401-F403 PolarHBondContact O-N 2.85Å; F401-L404 PolarHBondContact O-N 2.79Å; F401-I405 HydrophobicContact CD1-CD1 4.3Å; F401-I405 HydrophobicContact CE1-CD1 3.87Å; F401-I405 HydrophobicContact CZ-CD1 4.35Å; F401-I405 PolarHBondContact O-N 3.46Å; F401-I405 VanDerWaalsContact O-N 3.14Å; F401-H427 AromaticContact CD1-ND1 3.85Å; F401-H427 HydrophobicContact CE1-CB 4.35Å
402	D	97.3	Very high	94.4	Very high	4 Å²	4	12.3 Å²	12.3	2%	0.021	7%	0.065	C	C	.	.	H	α-helix	trans	-61.1	-38.7	179	-77.2	-25.9	0	0	0	112.1	M398 S399 I405 G406 N407 R410 I444	M398-D402 WeakPolarHBondContact O-CB 3.49Å; M398-D402 VanDerWaalsContact O-CG 3.32Å; M398-D402 PolarHBondContact O-N 3.37Å; S399-D402 PolarHBondContact O-N 2.79Å; D402-I405 WeakPolarHBondContact O-CG1 3.48Å; D402-G406 CarbonylContact O-C 3.58Å; D402-G406 VanDerWaalsContact O-CA 3.31Å; D402-G406 WeakPolarHBondContact O-CA 3.29Å; D402-G406 PolarHBondContact O-N 2.69Å; D402-N407 HydrophobicContact CB-CB 4.45Å; D402-N407 PolarHBondContact O-N 3.4Å; D402-R410 IonicContact OD1-CZ 3.89Å; D402-R410 VanDerWaalsContact OD1-CZ 3.3Å; D402-R410 IonicContact OD1-NE 3.55Å; D402-R410 PolarHBondContact OD1-NE 3.21Å; D402-R410 IonicContact OD1-NH2 3.6Å; D402-R410 PolarHBondContact OD1-NH2 2.96Å; D402-R410 WeakPolarHBondContact OD2-CB 3.33Å; D402-R410 VanDerWaalsContact OD2-CG 3.29Å; D402-R410 WeakPolarHBondContact OD2-CG 3.29Å; D402-R410 IonicContact OD2-CZ 3.26Å; D402-R410 IonicContact OD2-NE 2.76Å; D402-R410 PolarHBondContact OD2-NE 2.85Å; D402-R410 IonicContact OD2-NH2 3.54Å; D402-I444 HydrophobicContact CB-CG2 3.71Å
403	F	97.9	Very high	94.3	Very high	1 Å²	1	12.1 Å²	12.1	0%	0.004	6%	0.064	C	C	.	.	H	α-helix	trans	-67.5	-40.4	176.5	176.1	-104.9	0	0	0	112.4	S399 I400 F401 I405 G406 D440 E441 M442 I444 L445 R500 K503 V504	S399-F403 VanDerWaalsContact O-CB 3.32Å; S399-F403 WeakPolarHBondContact O-CB 3.48Å; S399-F403 PolarHBondContact O-N 2.81Å; I400-F403 PolarHBondContact O-N 2.81Å; F401-F403 VanDerWaalsContact C-N 3.31Å; F401-F403 PolarHBondContact O-N 2.85Å; F403-I405 VanDerWaalsContact C-N 3.34Å; F403-I405 PolarHBondContact O-N 2.87Å; F403-G406 PolarHBondContact O-N 2.72Å; F403-D440 HydrophobicContact CZ-CB 4.42Å; F403-E441 VanDerWaalsContact CD2-O 3.29Å; F403-E441 WeakPolarHBondContact CD2-O 3.23Å; F403-E441 WeakPolarHBondContact CE2-O 3.19Å; F403-M442 HydrophobicContact CE2-SD 3.91Å; F403-M442 HydrophobicContact CZ-SD 3.82Å; F403-I444 HydrophobicContact CB-CB 4.17Å; F403-I444 HydrophobicContact CB-CG2 3.94Å; F403-I444 HydrophobicContact CD2-CB 4.22Å; F403-L445 HydrophobicContact CB-CD2 3.56Å; F403-L445 HydrophobicContact CB-CG 3.77Å; F403-L445 HydrophobicContact CD1-CD1 3.61Å; F403-L445 HydrophobicContact CD1-CD2 3.93Å; F403-L445 HydrophobicContact CD1-CG 3.77Å; F403-L445 HydrophobicContact CD2-CD1 3.96Å; F403-L445 HydrophobicContact CD2-CD2 4.38Å; F403-L445 HydrophobicContact CD2-CG 3.62Å; F403-L445 HydrophobicContact CE1-CD1 3.59Å; F403-L445 HydrophobicContact CE1-CG 4.22Å; F403-L445 HydrophobicContact CE2-CD1 3.95Å; F403-L445 HydrophobicContact CE2-CG 4.09Å; F403-L445 HydrophobicContact CG-CD1 3.77Å; F403-L445 HydrophobicContact CG-CD2 3.7Å; F403-L445 HydrophobicContact CG-CG 3.42Å; F403-L445 VanDerWaalsContact CG-CG 3.42Å; F403-L445 HydrophobicContact CZ-CD1 3.76Å; F403-L445 HydrophobicContact CZ-CG 4.36Å; F403-R500 HydrophobicContact CD1-CB 4.2Å; F403-R500 HydrophobicContact CE1-CB 3.72Å; F403-R500 HydrophobicContact CE1-CG 4.11Å; F403-R500 WeakPolarHBondContact CE1-O 3.29Å; F403-R500 HydrophobicContact CZ-CB 4.38Å; F403-R500 HydrophobicContact CZ-CG 4.3Å; F403-K503 HydrophobicContact CE1-CB 4.03Å; F403-K503 HydrophobicContact CZ-CB 4.01Å; F403-K503 HydrophobicContact CZ-CD 4.13Å; F403-V504 HydrophobicContact CD1-CG2 3.5Å; F403-V504 VanDerWaalsContact CD1-CG2 3.5Å; F403-V504 HydrophobicContact CE1-CG2 3.8Å
404	L	97.8	Very high	94.2	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-61.5	-44.3	177.9	-72.4	170.8	0	0	0	111	L268 L272 I400 F401 L472 L497 R500 L501	L268-L404 HydrophobicContact CD2-CB 3.97Å; L272-L404 HydrophobicContact CD1-CD1 3.8Å; L272-L404 HydrophobicContact CD2-CD1 4.37Å; I400-L404 HydrophobicContact CG2-CD1 4.22Å; I400-L404 WeakPolarHBondContact O-CG 2.84Å; I400-L404 PolarHBondContact O-N 3.43Å; F401-L404 PolarHBondContact O-N 2.79Å; L404-L472 HydrophobicContact CD2-CD2 4.44Å; L404-L497 HydrophobicContact CB-CD2 4.23Å; L404-L497 WeakPolarHBondContact O-CD2 3.38Å; L404-R500 HydrophobicContact CD2-CB 3.93Å; L404-R500 WeakPolarHBondContact O-CD 3.26Å; L404-R500 PolarHBondContact O-NH1 2.92Å; L404-L501 HydrophobicContact CD2-CB 4.15Å
405	I	96.6	Very high	94.2	Very high	1 Å²	1	13.4 Å²	13.4	1%	0.005	7%	0.07	C	C	.	.	H	α-helix	trans	-79.6	-20.2	176.6	69.2	178.4	0	0	0	112.7	L268 F401 D402 F403 N407 N430 F434 R500	L268-I405 HydrophobicContact CD2-CG2 3.43Å; L268-I405 VanDerWaalsContact CD2-CG2 3.43Å; F401-I405 HydrophobicContact CD1-CD1 4.3Å; F401-I405 HydrophobicContact CE1-CD1 3.87Å; F401-I405 HydrophobicContact CZ-CD1 4.35Å; F401-I405 PolarHBondContact O-N 3.46Å; F401-I405 VanDerWaalsContact O-N 3.14Å; D402-I405 WeakPolarHBondContact O-CG1 3.48Å; F403-I405 VanDerWaalsContact C-N 3.34Å; F403-I405 PolarHBondContact O-N 2.87Å; I405-N407 HydrophobicContact CD1-CB 3.55Å; I405-N407 HydrophobicContact CG1-CB 3.62Å; I405-N430 HydrophobicContact CD1-CB 4.29Å; I405-F434 HydrophobicContact CB-CD2 4.1Å; I405-F434 HydrophobicContact CB-CE2 3.7Å; I405-F434 HydrophobicContact CB-CZ 4.05Å; I405-F434 HydrophobicContact CG2-CD2 4.35Å; I405-F434 HydrophobicContact CG2-CE2 3.47Å; I405-F434 VanDerWaalsContact CG2-CE2 3.47Å; I405-F434 HydrophobicContact CG2-CZ 3.65Å; I405-F434 PolarHBondContact O-N 3.07Å; I405-R500 VanDerWaalsContact C-NH1 3.34Å; I405-R500 PolarHBondContact O-NH1 2.92Å
406	G	95.3	Very high	94.1	Very high	21 Å²	21	13.4 Å²	13.4	22%	0.216	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.6	29.2	-175.2	0	0	0	0	0	113.7	D402 F403	D402-G406 CarbonylContact O-C 3.58Å; D402-G406 VanDerWaalsContact O-CA 3.31Å; D402-G406 WeakPolarHBondContact O-CA 3.29Å; D402-G406 PolarHBondContact O-N 2.69Å; F403-G406 PolarHBondContact O-N 2.72Å
407	N	93.8	Very high	93.9	Very high	3 Å²	3	16.5 Å²	16.5	2%	0.016	9%	0.088	C	C	.	.			trans	-85.1	115.2	179.4	-178.8	17.9	0	0	0	110.7	D402 I405 D409 R410	D402-N407 HydrophobicContact CB-CB 4.45Å; D402-N407 PolarHBondContact O-N 3.4Å; I405-N407 HydrophobicContact CD1-CB 3.55Å; I405-N407 HydrophobicContact CG1-CB 3.62Å; N407-D409 PolarHBondContact OD1-N 2.91Å; N407-D409 VanDerWaalsContact OD1-N 3.08Å; N407-R410 PolarHBondContact ND2-NH2 3.25Å; N407-R410 VanDerWaalsContact ND2-NH2 3.18Å
408	M	90.5	Very high	93.7	Very high	47 Å²	47	21 Å²	21	23%	0.232	11%	0.108	C	C	.	.			trans	-98	-7.3	179.8	-64.9	165.1	70.1	0	0	113.3	Y252 R360 R410 E441 I444	Y252-M408 HydrophobicContact CD1-CE 4.02Å; Y252-M408 HydrophobicContact CG-CB 4.27Å; Y252-M408 HydrophobicContact CG-CE 4.26Å; R360-M408 PolarHBondContact NE-O 3.49Å; M408-R410 PolarHBondContact O-N 3.03Å; M408-E441 HydrophobicContact CE-CG 3.87Å; M408-E441 HydrophobicContact CG-CB 4.5Å; M408-E441 HydrophobicContact CG-CG 4.05Å; M408-E441 HydrophobicContact SD-CB 4.24Å; M408-E441 HydrophobicContact SD-CG 3.77Å; M408-I444 HydrophobicContact CG-CD1 3.73Å; M408-I444 HydrophobicContact CG-CG1 3.89Å
409	D	89.2	Confident	93.4	Very high	18 Å²	18	21.8 Å²	21.8	10%	0.096	11%	0.111	C	C	.	.			trans	-96.6	24.3	-168.4	-160.8	53.1	0	0	0	113.2	Y362 N407 H411 R432	Y362-D409 VanDerWaalsContact CE1-OD1 3.27Å; Y362-D409 WeakPolarHBondContact CE1-OD1 3.4Å; Y362-D409 PolarHBondContact OH-OD1 3.3Å; N407-D409 PolarHBondContact OD1-N 2.91Å; N407-D409 VanDerWaalsContact OD1-N 3.08Å; D409-H411 VanDerWaalsContact C-N 3.27Å; D409-H411 PolarHBondContact O-N 2.84Å; D409-H411 PolarHBondContact O-ND1 3.26Å; D409-H411 IonicContact OD2-CE1 2.75Å; D409-R432 HydrophobicContact CB-CB 4.37Å; D409-R432 HydrophobicContact CB-CG 4.45Å; D409-R432 VanDerWaalsContact CG-NE 3.31Å; D409-R432 IonicContact OD1-NE 3.68Å; D409-R432 WeakPolarHBondContact OD2-CD 3.37Å; D409-R432 IonicContact OD2-CZ 3.9Å; D409-R432 IonicContact OD2-NE 2.77Å; D409-R432 PolarHBondContact OD2-NE 2.97Å
410	R	91	Very high	92.9	Very high	18 Å²	18	22.8 Å²	22.8	7%	0.068	12%	0.123	C	C	.	.			trans	-78.6	69.6	178.3	-167.7	72.3	62.9	-160.5	1.2	111.7	N356 M398 D402 N407 M408 L428 N430	N356-R410 WeakPolarHBondContact CB-O 3.5Å; N356-R410 PolarHBondContact ND2-O 3.3Å; M398-R410 HydrophobicContact CE-CG 3.85Å; M398-R410 HydrophobicContact SD-CG 4.04Å; D402-R410 IonicContact OD1-CZ 3.89Å; D402-R410 VanDerWaalsContact OD1-CZ 3.3Å; D402-R410 IonicContact OD1-NE 3.55Å; D402-R410 PolarHBondContact OD1-NE 3.21Å; D402-R410 IonicContact OD1-NH2 3.6Å; D402-R410 PolarHBondContact OD1-NH2 2.96Å; D402-R410 WeakPolarHBondContact OD2-CB 3.33Å; D402-R410 VanDerWaalsContact OD2-CG 3.29Å; D402-R410 WeakPolarHBondContact OD2-CG 3.29Å; D402-R410 IonicContact OD2-CZ 3.26Å; D402-R410 IonicContact OD2-NE 2.76Å; D402-R410 PolarHBondContact OD2-NE 2.85Å; D402-R410 IonicContact OD2-NH2 3.54Å; N407-R410 PolarHBondContact ND2-NH2 3.25Å; N407-R410 VanDerWaalsContact ND2-NH2 3.18Å; M408-R410 PolarHBondContact O-N 3.03Å; R410-L428 PolarHBondContact NH1-O 2.89Å; R410-N430 PolarHBondContact NH2-OD1 3.36Å
411	H	89.2	Confident	92.3	Very high	42 Å²	42	25.3 Å²	25.3	19%	0.194	14%	0.137	C	C	.	.			trans	-80.4	-29.8	178.5	47.5	-56.4	0	0	0	114.3	S216 P355 N356 K359 Y362 D409	S216-H411 PolarHBondContact OG-CE1 3.44Å; S216-H411 PolarHBondContact OG-NE2 2.87Å; P355-H411 WeakPolarHBondContact CA-O 3.14Å; N356-H411 PolarHBondContact N-O 2.91Å; K359-H411 HydrophobicContact CB-CB 4.42Å; Y362-H411 HydrophobicContact CE2-CB 3.75Å; Y362-H411 AromaticContact CZ-CG 4Å; Y362-H411 VanDerWaalsContact OH-CB 3.25Å; Y362-H411 WeakPolarHBondContact OH-CB 3.49Å; D409-H411 VanDerWaalsContact C-N 3.27Å; D409-H411 PolarHBondContact O-N 2.84Å; D409-H411 PolarHBondContact O-ND1 3.26Å; D409-H411 IonicContact OD2-CE1 2.75Å
412	H	89.9	Confident	91.5	Very high	60 Å²	60	28.3 Å²	28.3	28%	0.278	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	159.4	175.1	-59.5	79.7	0	0	0	109.9	S353 I354	S353-H412 WeakPolarHBondContact OG-CB 3.48Å; I354-H412 VanDerWaalsContact O-CA 3.26Å; I354-H412 WeakPolarHBondContact O-CA 3.4Å
413	Y	91.6	Very high	90.8	Very high	4 Å²	4	28.1 Å²	28.1	2%	0.016	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	152.5	165.8	59.5	-95.5	0	0	0	108.9	I354 N356 Y386 I395 M398 I415 L425	I354-Y413 HydrophobicContact CB-CD2 4.27Å; I354-Y413 HydrophobicContact CB-CE1 4.26Å; I354-Y413 HydrophobicContact CB-CE2 3.75Å; I354-Y413 HydrophobicContact CD1-CE2 3.84Å; I354-Y413 HydrophobicContact CG1-CE2 4.3Å; I354-Y413 HydrophobicContact CG2-CE1 4.15Å; I354-Y413 HydrophobicContact CG2-CE2 4.16Å; I354-Y413 WeakPolarHBondContact CG2-OH 3.47Å; I354-Y413 PolarHBondContact N-O 3.1Å; I354-Y413 PolarHBondContact O-N 2.84Å; N356-Y413 HydrophobicContact CB-CD1 4.32Å; Y386-Y413 WeakPolarHBondContact CE1-OH 3.28Å; Y386-Y413 PolarHBondContact OH-OH 3.39Å; I395-Y413 HydrophobicContact CD1-CE1 4.13Å; M398-Y413 HydrophobicContact CE-CD1 4.15Å; M398-Y413 HydrophobicContact CE-CG 4.42Å; Y413-I415 HydrophobicContact CD2-CG2 4.16Å; Y413-I415 HydrophobicContact CE2-CG2 4.21Å; Y413-L425 HydrophobicContact CD2-CD2 3.43Å; Y413-L425 VanDerWaalsContact CD2-CD2 3.43Å; Y413-L425 HydrophobicContact CE2-CD2 3.53Å; Y413-L425 HydrophobicContact CG-CD2 4.28Å
414	E	91.1	Very high	90.4	Very high	46 Å²	46	28.4 Å²	28.4	22%	0.215	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	146.7	179.3	-70.5	-170.9	-147.7	0	0	111.7	R351 L352 L426 L428	R351-E414 VanDerWaalsContact CD-OE2 3.28Å; R351-E414 WeakPolarHBondContact CD-OE2 3.31Å; R351-E414 IonicContact CZ-OE2 3.44Å; R351-E414 IonicContact NE-OE2 3.71Å; R351-E414 PolarHBondContact NE-OE2 3.26Å; R351-E414 IonicContact NH2-OE2 2.68Å; L352-E414 WeakPolarHBondContact O-CA 3.05Å; E414-L426 HydrophobicContact CB-CB 4.17Å; E414-L426 HydrophobicContact CB-CD1 3.94Å; E414-L426 WeakPolarHBondContact O-CB 3.17Å; E414-L426 WeakPolarHBondContact O-CG 3.27Å; E414-L426 PolarHBondContact O-N 3.22Å; E414-L428 HydrophobicContact CB-CD1 4.29Å; E414-L428 HydrophobicContact CG-CD1 4.29Å
415	I	92.6	Very high	90.2	Very high	4 Å²	4	28.4 Å²	28.4	2%	0.021	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	152.9	172	65.1	170.1	0	0	0	110.3	R351 L352 I354 Y413 L425	R351-I415 CarbonylContact C-O 3.39Å; R351-I415 WeakPolarHBondContact CA-O 3.33Å; L352-I415 HydrophobicContact CB-CG1 3.95Å; L352-I415 HydrophobicContact CD2-CD1 4.43Å; L352-I415 PolarHBondContact N-O 3.22Å; L352-I415 PolarHBondContact O-N 3.18Å; I354-I415 HydrophobicContact CD1-CD1 3.66Å; I354-I415 HydrophobicContact CD1-CG1 4.07Å; Y413-I415 HydrophobicContact CD2-CG2 4.16Å; Y413-I415 HydrophobicContact CE2-CG2 4.21Å; I415-L425 HydrophobicContact CG2-CD2 3.62Å
416	F	93.3	Very high	90.1	Very high	1 Å²	1	28.4 Å²	28.4	0%	0.004	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	126.1	168.4	-67.4	-67.9	0	0	0	110.2	L109 I164 L169 L343 A349 R351 K418 F419 L426	L109-F416 HydrophobicContact CD1-CB 3.73Å; L109-F416 HydrophobicContact CD1-CD1 3.72Å; L109-F416 HydrophobicContact CD1-CD2 4.2Å; L109-F416 HydrophobicContact CD1-CE1 4.38Å; L109-F416 HydrophobicContact CD1-CG 3.62Å; L109-F416 HydrophobicContact CD2-CD1 3.76Å; L109-F416 HydrophobicContact CD2-CD2 4.3Å; L109-F416 HydrophobicContact CD2-CE1 3.53Å; L109-F416 HydrophobicContact CD2-CE2 4.08Å; L109-F416 HydrophobicContact CD2-CG 4.14Å; L109-F416 HydrophobicContact CD2-CZ 3.7Å; L109-F416 HydrophobicContact CG-CD1 4.4Å; I164-F416 HydrophobicContact CD1-CZ 4.35Å; I164-F416 HydrophobicContact CG2-CD2 4.41Å; I164-F416 HydrophobicContact CG2-CE2 3.73Å; I164-F416 HydrophobicContact CG2-CZ 4.19Å; L169-F416 HydrophobicContact CD2-CE2 3.87Å; L169-F416 HydrophobicContact CD2-CZ 4.16Å; L343-F416 HydrophobicContact CD1-CZ 4.46Å; L343-F416 HydrophobicContact CD2-CZ 4.46Å; A349-F416 HydrophobicContact CB-CD1 4.21Å; A349-F416 HydrophobicContact CB-CE1 4.22Å; R351-F416 HydrophobicContact CG-CD1 3.76Å; R351-F416 HydrophobicContact CG-CE1 3.91Å; F416-K418 PolarHBondContact O-N 3.29Å; F416-F419 HydrophobicContact CB-CD2 3.82Å; F416-F419 HydrophobicContact CB-CE2 4.24Å; F416-F419 HydrophobicContact CD2-CD2 4.13Å; F416-F419 AromaticContact CD2-CE2 3.99Å; F416-F419 HydrophobicContact CD2-CE2 3.99Å; F416-F419 HydrophobicContact CG-CD2 4.41Å; F416-F419 HydrophobicContact CG-CE2 4.43Å; F416-F419 PolarHBondContact O-N 3.32Å; F416-F419 VanDerWaalsContact O-N 3.14Å; F416-L426 HydrophobicContact CD2-CD1 4.49Å; F416-L426 HydrophobicContact CE1-CD1 4.44Å; F416-L426 HydrophobicContact CE2-CD1 4.09Å; F416-L426 HydrophobicContact CE2-CD2 3.79Å; F416-L426 HydrophobicContact CE2-CG 4.38Å; F416-L426 HydrophobicContact CZ-CD1 4.06Å; F416-L426 HydrophobicContact CZ-CD2 4.23Å
417	T	91.3	Very high	90	Very high	66 Å²	66	27.4 Å²	27.4	41%	0.405	14%	0.141	S	C	.	.	G	3₁₀ helix	trans	-59.4	-33.6	-177.7	56	0	0	0	0	112.4	P350 L352 F419 G420	P350-T417 HydrophobicContact CB-CG2 4.09Å; P350-T417 PolarHBondContact O-N 3.16Å; P350-T417 VanDerWaalsContact O-N 3.09Å; P350-T417 PolarHBondContact O-OG1 3.22Å; L352-T417 HydrophobicContact CB-CG2 4.23Å; T417-F419 PolarHBondContact O-N 2.89Å; T417-G420 PolarHBondContact O-N 2.87Å; T417-G420 VanDerWaalsContact O-N 3.15Å
418	K	91.1	Very high	89.9	Confident	95 Å²	95	28.8 Å²	28.8	41%	0.413	15%	0.148	S	C	.	.	G	3₁₀ helix	trans	-57.5	-34.7	179.2	-170.4	-179.9	-175.2	-175.8	0	113.5	K108 L109 F416	K108-K418 PolarHBondContact O-NZ 3.31Å; L109-K418 HydrophobicContact CD1-CB 4.22Å; L109-K418 HydrophobicContact CD1-CD 4.41Å; L109-K418 WeakPolarHBondContact O-CD 3.41Å; L109-K418 PolarHBondContact O-NZ 3.08Å; F416-K418 PolarHBondContact O-N 3.29Å
419	F	88.9	Confident	89.7	Confident	19 Å²	19	31.2 Å²	31.2	8%	0.083	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-89.8	-7.7	-177.1	-58.6	-41.6	0	0	0	113.4	E107 L109 N165 R166 F416 T417 G423	E107-F419 WeakPolarHBondContact O-CE1 3.33Å; L109-F419 HydrophobicContact CB-CE2 4.26Å; L109-F419 HydrophobicContact CB-CZ 3.8Å; L109-F419 HydrophobicContact CD1-CE2 3.99Å; L109-F419 HydrophobicContact CD1-CZ 4.06Å; N165-F419 WeakPolarHBondContact O-CE2 3.3Å; R166-F419 HydrophobicContact CB-CD1 4Å; R166-F419 HydrophobicContact CB-CE1 4.04Å; R166-F419 HydrophobicContact CB-CG 4.29Å; R166-F419 HydrophobicContact CB-CZ 4.36Å; R166-F419 HydrophobicContact CG-CB 4.4Å; R166-F419 HydrophobicContact CG-CD1 4.22Å; R166-F419 HydrophobicContact CG-CG 4.24Å; F416-F419 HydrophobicContact CB-CD2 3.82Å; F416-F419 HydrophobicContact CB-CE2 4.24Å; F416-F419 HydrophobicContact CD2-CD2 4.13Å; F416-F419 AromaticContact CD2-CE2 3.99Å; F416-F419 HydrophobicContact CD2-CE2 3.99Å; F416-F419 HydrophobicContact CG-CD2 4.41Å; F416-F419 HydrophobicContact CG-CE2 4.43Å; F416-F419 PolarHBondContact O-N 3.32Å; F416-F419 VanDerWaalsContact O-N 3.14Å; T417-F419 PolarHBondContact O-N 2.89Å; F419-G423 PolarHBondContact O-N 3.16Å
420	G	86.8	Confident	89.9	Confident	29 Å²	29	30.4 Å²	30.4	30%	0.299	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	57.3	-146.2	-179.9	0	0	0	0	0	113.7	R391 T417 E422 G423	R391-G420 PolarHBondContact NH2-O 2.98Å; T417-G420 PolarHBondContact O-N 2.87Å; T417-G420 VanDerWaalsContact O-N 3.15Å; G420-E422 PolarHBondContact O-N 3.18Å; G420-G423 PolarHBondContact O-N 3.26Å
421	D	84.7	Confident	89.8	Confident	53 Å²	53	29.6 Å²	29.6	28%	0.283	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-68.8	-21.5	-173.4	-63.6	-35.6	0	0	0	114.3	Y384 R391	Y384-D421 WeakPolarHBondContact CE2-OD2 3.23Å; Y384-D421 VanDerWaalsContact CZ-OD2 3.26Å; Y384-D421 PolarHBondContact OH-OD1 2.99Å; Y384-D421 PolarHBondContact OH-OD2 2.94Å; R391-D421 PolarHBondContact NE-O 2.72Å; R391-D421 VanDerWaalsContact NH2-C 3.27Å; R391-D421 VanDerWaalsContact NH2-CA 3.25Å; R391-D421 PolarHBondContact NH2-O 2.96Å
422	E	82	Confident	89.8	Confident	63 Å²	63	28.1 Å²	28.1	29%	0.294	15%	0.147	S	C	.	.	G	3₁₀ helix	trans	-97	9.4	179.5	-62.4	-66.3	171.9	0	0	113	G389 N390 G420	G389-E422 WeakPolarHBondContact CA-OE1 3.45Å; N390-E422 PolarHBondContact N-OE2 3.41Å; G420-E422 PolarHBondContact O-N 3.18Å
423	G	82.9	Confident	89.9	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.134	C	C	.	.	S	Bend	trans	-73.3	152.1	174.1	0	0	0	0	0	112.9	R391 F419 G420	R391-G423 PolarHBondContact NH1-O 2.76Å; F419-G423 PolarHBondContact O-N 3.16Å; G420-G423 PolarHBondContact O-N 3.26Å
424	L	89	Confident	90	Very high	6 Å²	6	25.3 Å²	25.3	3%	0.031	14%	0.135	C	C	.	.	P	Polyproline II helix	trans	-57.1	150.6	170.6	72.3	96.7	0	0	0	112.3	N165 R166 L169 R276 L426	N165-L424 VanDerWaalsContact O-CD2 3.23Å; N165-L424 WeakPolarHBondContact O-CD2 3.45Å; R166-L424 PolarHBondContact O-N 3.02Å; L169-L424 HydrophobicContact CG-CD1 4.45Å; R276-L424 HydrophobicContact CG-CD1 4.32Å; L424-L426 HydrophobicContact CD1-CD2 3.54Å; L424-L426 HydrophobicContact CD1-CG 4.19Å
425	L	93.3	Very high	89.9	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.127	C	C	.	.	P	Polyproline II helix	trans	-87.3	131.5	171.6	-61.4	-174	0	0	0	109.9	R276 N394 I395 Y413 I415	R276-L425 WeakPolarHBondContact CB-O 3.3Å; R276-L425 VanDerWaalsContact CD-O 3.3Å; R276-L425 WeakPolarHBondContact CD-O 3.46Å; R276-L425 VanDerWaalsContact CG-O 3.31Å; R276-L425 WeakPolarHBondContact CG-O 3.29Å; N394-L425 HydrophobicContact CB-CD1 3.53Å; N394-L425 HydrophobicContact CB-CG 3.72Å; I395-L425 HydrophobicContact CG1-CD1 3.83Å; Y413-L425 HydrophobicContact CD2-CD2 3.43Å; Y413-L425 VanDerWaalsContact CD2-CD2 3.43Å; Y413-L425 HydrophobicContact CE2-CD2 3.53Å; Y413-L425 HydrophobicContact CG-CD2 4.28Å; I415-L425 HydrophobicContact CG2-CD2 3.62Å
426	L	94.1	Very high	89.9	Confident	1 Å²	1	25.8 Å²	25.8	1%	0.005	14%	0.137	C	C	.	.	B	Isolated β-bridge	trans	-85.2	123.8	175.6	-61.4	172.6	0	0	0	110.1	L169 L343 E414 F416 L424 L428	L169-L426 HydrophobicContact CD1-CD2 3.9Å; L169-L426 HydrophobicContact CD2-CD2 3.59Å; L169-L426 HydrophobicContact CG-CD2 3.9Å; L343-L426 HydrophobicContact CD1-CD1 3.96Å; L343-L426 HydrophobicContact CD1-CD2 4.49Å; E414-L426 HydrophobicContact CB-CB 4.17Å; E414-L426 HydrophobicContact CB-CD1 3.94Å; E414-L426 WeakPolarHBondContact O-CB 3.17Å; E414-L426 WeakPolarHBondContact O-CG 3.27Å; E414-L426 PolarHBondContact O-N 3.22Å; F416-L426 HydrophobicContact CD2-CD1 4.49Å; F416-L426 HydrophobicContact CE1-CD1 4.44Å; F416-L426 HydrophobicContact CE2-CD1 4.09Å; F416-L426 HydrophobicContact CE2-CD2 3.79Å; F416-L426 HydrophobicContact CE2-CG 4.38Å; F416-L426 HydrophobicContact CZ-CD1 4.06Å; F416-L426 HydrophobicContact CZ-CD2 4.23Å; L424-L426 HydrophobicContact CD1-CD2 3.54Å; L424-L426 HydrophobicContact CD1-CG 4.19Å; L426-L428 HydrophobicContact CB-CD1 4.3Å; L426-L428 HydrophobicContact CB-CD2 4.37Å; L426-L428 HydrophobicContact CB-CG 3.95Å; L426-L428 PolarHBondContact O-N 2.79Å
427	H	94.6	Very high	89.9	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.145	C	C	.	.			trans	-91.2	74.2	177	-63.7	176.6	0	0	0	109.2	D269 R276 V277 F401 N430	D269-H427 IonicContact OD1-ND1 3.99Å; D269-H427 PolarHBondContact OD1-ND1 3.22Å; R276-H427 HydrophobicContact CB-CB 4.31Å; R276-H427 WeakPolarHBondContact CD-NE2 3.32Å; R276-H427 PolarHBondContact O-N 2.84Å; V277-H427 HydrophobicContact CG2-CB 3.54Å; F401-H427 AromaticContact CD1-ND1 3.85Å; F401-H427 HydrophobicContact CE1-CB 4.35Å; H427-N430 PolarHBondContact O-ND2 3.18Å
428	L	91.2	Very high	90.1	Very high	32 Å²	32	28.3 Å²	28.3	17%	0.168	15%	0.154	C	C	.	.			trans	-93	161.2	-179.6	-55.7	-177.9	0	0	0	111.8	P278 L343 R410 E414 L426	P278-L428 HydrophobicContact CG-CD2 3.51Å; L343-L428 HydrophobicContact CD1-CD1 4.29Å; L343-L428 HydrophobicContact CD1-CD2 4.1Å; R410-L428 PolarHBondContact NH1-O 2.89Å; E414-L428 HydrophobicContact CB-CD1 4.29Å; E414-L428 HydrophobicContact CG-CD1 4.29Å; L426-L428 HydrophobicContact CB-CD1 4.3Å; L426-L428 HydrophobicContact CB-CD2 4.37Å; L426-L428 HydrophobicContact CB-CG 3.95Å; L426-L428 PolarHBondContact O-N 2.79Å
429	D	87.1	Confident	90.3	Very high	99 Å²	99	28 Å²	28	53%	0.529	15%	0.154	S	C	.	.			trans	53.5	65.9	175.1	-67.9	-42.7	0	0	0	114.1	K235 E262	K235-D429 IonicContact NZ-OD1 3.11Å; K235-D429 PolarHBondContact NZ-OD1 2.67Å; E262-D429 WeakPolarHBondContact OE1-CA 3.06Å
430	N	93.2	Very high	90.6	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.005	15%	0.153	C	C	.	.			trans	-94.8	7	-179.8	-51.1	-67.5	0	0	0	112.8	A261 E262 A265 I405 R410 H427 R432 G433	A261-N430 WeakPolarHBondContact CB-O 3.36Å; E262-N430 VanDerWaalsContact CD-N 3.35Å; E262-N430 PolarHBondContact OE1-N 2.95Å; E262-N430 WeakPolarHBondContact OE2-CB 3.37Å; E262-N430 PolarHBondContact OE2-N 2.89Å; E262-N430 VanDerWaalsContact OE2-N 3.09Å; A265-N430 HydrophobicContact CB-CB 3.42Å; A265-N430 VanDerWaalsContact CB-CB 3.42Å; I405-N430 HydrophobicContact CD1-CB 4.29Å; R410-N430 PolarHBondContact NH2-OD1 3.36Å; H427-N430 PolarHBondContact O-ND2 3.18Å; N430-R432 PolarHBondContact O-N 3.32Å; N430-R432 VanDerWaalsContact O-N 3.09Å; N430-G433 PolarHBondContact O-N 3.34Å
431	A	88.5	Confident	90.9	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.008	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-17.8	-173.1	0	0	0	0	0	115.5	K235 Q257 R258 E262 G433	K235-A431 HydrophobicContact CD-CB 4.23Å; Q257-A431 HydrophobicContact CB-CB 3.58Å; Q257-A431 HydrophobicContact CG-CB 3.69Å; R258-A431 PolarHBondContact N-O 2.98Å; E262-A431 HydrophobicContact CG-CB 3.84Å; E262-A431 WeakPolarHBondContact OE1-CB 3.39Å; E262-A431 PolarHBondContact OE1-N 3.47Å; A431-G433 VanDerWaalsContact C-N 3.31Å
432	R	88.7	Confident	91.4	Very high	10 Å²	10	30.2 Å²	30.2	4%	0.038	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	9.7	174.2	-65.8	177.6	-172.2	-97.2	0.3	113.3	S216 H219 Y252 F253 D255 Q257 D409 N430	S216-R432 PolarHBondContact O-NH2 2.78Å; H219-R432 PolarHBondContact NE2-NH2 2.56Å; Y252-R432 PolarHBondContact O-NH1 2.83Å; F253-R432 PolarHBondContact O-NH1 3.32Å; F253-R432 PolarHBondContact O-NH2 2.98Å; D255-R432 PolarHBondContact O-NH1 2.93Å; Q257-R432 HydrophobicContact CG-CG 4.2Å; D409-R432 HydrophobicContact CB-CB 4.37Å; D409-R432 HydrophobicContact CB-CG 4.45Å; D409-R432 VanDerWaalsContact CG-NE 3.31Å; D409-R432 IonicContact OD1-NE 3.68Å; D409-R432 WeakPolarHBondContact OD2-CD 3.37Å; D409-R432 IonicContact OD2-CZ 3.9Å; D409-R432 IonicContact OD2-NE 2.77Å; D409-R432 PolarHBondContact OD2-NE 2.97Å; N430-R432 PolarHBondContact O-N 3.32Å; N430-R432 VanDerWaalsContact O-N 3.09Å
433	G	91.8	Very high	92	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.152	C	C	.	.	S	Bend	trans	-76.1	168.9	167	0	0	0	0	0	111.9	A261 N430 A431 G435	A261-G433 WeakPolarHBondContact CB-O 3.18Å; N430-G433 PolarHBondContact O-N 3.34Å; A431-G433 VanDerWaalsContact C-N 3.31Å; G433-G435 PolarHBondContact O-N 3.22Å; G433-G435 VanDerWaalsContact O-N 3.11Å
434	F	93.6	Very high	92.6	Very high	5 Å²	5	29.3 Å²	29.3	2%	0.022	16%	0.156	C	C	.	.	S	Bend	trans	52.4	34.1	174.4	-58.6	-82.8	0	0	0	114.2	A261 A264 I405 L489 H493 L497	A261-F434 HydrophobicContact CB-CB 4.47Å; A261-F434 HydrophobicContact CB-CD2 4.06Å; A264-F434 HydrophobicContact CB-CD2 4.02Å; A264-F434 HydrophobicContact CB-CE2 3.49Å; A264-F434 VanDerWaalsContact CB-CE2 3.49Å; A264-F434 HydrophobicContact CB-CZ 3.88Å; I405-F434 HydrophobicContact CB-CD2 4.1Å; I405-F434 HydrophobicContact CB-CE2 3.7Å; I405-F434 HydrophobicContact CB-CZ 4.05Å; I405-F434 HydrophobicContact CG2-CD2 4.35Å; I405-F434 HydrophobicContact CG2-CE2 3.47Å; I405-F434 VanDerWaalsContact CG2-CE2 3.47Å; I405-F434 HydrophobicContact CG2-CZ 3.65Å; I405-F434 PolarHBondContact O-N 3.07Å; F434-L489 HydrophobicContact CB-CD2 4.08Å; F434-L489 HydrophobicContact CD1-CD1 3.93Å; F434-L489 HydrophobicContact CD1-CD2 3.72Å; F434-L489 HydrophobicContact CD2-CD2 4.23Å; F434-L489 HydrophobicContact CE1-CD1 3.52Å; F434-L489 HydrophobicContact CE1-CD2 4.16Å; F434-L489 HydrophobicContact CG-CD2 3.75Å; F434-L489 HydrophobicContact CZ-CD1 3.86Å; F434-H493 HydrophobicContact CD1-CB 4.23Å; F434-H493 AromaticContact CD1-ND1 3.88Å; F434-H493 PolarHBondContact O-CE1 3.43Å; F434-H493 PolarHBondContact O-NE2 2.98Å; F434-L497 HydrophobicContact CE1-CD1 4.35Å; F434-L497 HydrophobicContact CE1-CD2 3.95Å; F434-L497 HydrophobicContact CE1-CG 4.28Å; F434-L497 HydrophobicContact CZ-CD2 4.24Å
435	G	90.1	Very high	92.9	Very high	5 Å²	5	29.1 Å²	29.1	5%	0.052	15%	0.154	C	C	.	.	S	Bend	trans	-81.7	-33.5	176.5	0	0	0	0	0	114.3	E245 T246 R258 G433	E245-G435 CarbonylContact C-O 3.47Å; E245-G435 VanDerWaalsContact CA-O 3.31Å; E245-G435 WeakPolarHBondContact CA-O 3.43Å; T246-G435 PolarHBondContact N-O 3.35Å; R258-G435 PolarHBondContact NH2-O 3.38Å; G433-G435 PolarHBondContact O-N 3.22Å; G433-G435 VanDerWaalsContact O-N 3.11Å
436	K	92.3	Very high	93	Very high	56 Å²	56	29.5 Å²	29.5	24%	0.243	16%	0.158	C	C	.	.			trans	-132	123.1	-178.8	-66.8	173.1	173.5	170.9	0	109	E245 T246 P247 H439 R500	E245-K436 VanDerWaalsContact OE2-CA 3.3Å; E245-K436 WeakPolarHBondContact OE2-CA 2.93Å; T246-K436 WeakPolarHBondContact O-CE 3.47Å; P247-K436 VanDerWaalsContact O-CE 3.28Å; P247-K436 WeakPolarHBondContact O-CE 3.14Å; P247-K436 PolarHBondContact O-NZ 2.8Å; K436-H439 HydrophobicContact CB-CB 4.16Å; K436-H439 HydrophobicContact CD-CB 4.34Å; K436-R500 PolarHBondContact O-NH2 3.02Å
437	H	93.9	Very high	93.1	Very high	36 Å²	36	29.8 Å²	29.8	17%	0.167	16%	0.159	C	C	.	.	S	Bend	trans	-97.2	-23.6	173.9	57.2	70.3	0	0	0	112.4	E245 P492 H493 A496 R499	E245-H437 VanDerWaalsContact CD-CE1 3.46Å; E245-H437 IonicContact OE1-CD2 3.31Å; E245-H437 IonicContact OE1-CE1 2.67Å; E245-H437 PolarHBondContact OE1-CE1 3.02Å; E245-H437 IonicContact OE1-CG 3.36Å; E245-H437 IonicContact OE1-ND1 3.42Å; E245-H437 PolarHBondContact OE1-ND1 3.17Å; E245-H437 IonicContact OE1-NE2 3.42Å; E245-H437 PolarHBondContact OE1-NE2 3.38Å; E245-H437 IonicContact OE2-CG 2.68Å; E245-H437 PolarHBondContact OE2-N 3.31Å; E245-H437 IonicContact OE2-ND1 3.72Å; H437-P492 HydrophobicContact CB-CB 4Å; H437-P492 VanDerWaalsContact CG-CB 3.49Å; H437-P492 WeakPolarHBondContact ND1-CB 3.45Å; H437-H493 AromaticContact CD2-CD2 3.99Å; H437-H493 AromaticContact CD2-NE2 3.67Å; H437-A496 HydrophobicContact CB-CB 4.38Å; H437-R499 PolarHBondContact O-NH2 3.42Å
438	S	94.5	Very high	93.2	Very high	84 Å²	84	29.8 Å²	29.8	59%	0.587	16%	0.16	S	C	*	.	S	Bend	trans	-80.3	-23.6	179.3	58.4	0	0	0	0	113	E245	E245-S438 VanDerWaalsContact CD-OG 3.3Å; E245-S438 WeakPolarHBondContact OE1-CB 3.37Å; E245-S438 PolarHBondContact OE1-OG 3.33Å; E245-S438 PolarHBondContact OE2-N 2.95Å; E245-S438 VanDerWaalsContact OE2-N 3.08Å; E245-S438 PolarHBondContact OE2-OG 2.81Å
439	H	94.3	Very high	93.3	Very high	88 Å²	88	30.7 Å²	30.7	41%	0.407	17%	0.168	S	C	.	.			trans	-108.1	145.2	-178.9	-174.6	62.4	0	0	0	112.8	K436 E441 R500	K436-H439 HydrophobicContact CB-CB 4.16Å; K436-H439 HydrophobicContact CD-CB 4.34Å; H439-E441 IonicContact CD2-OE2 3.92Å; H439-E441 IonicContact CE1-OE2 3.94Å; H439-E441 IonicContact NE2-OE2 3.91Å; H439-E441 PolarHBondContact NE2-OE2 2.63Å; H439-R500 PolarHBondContact O-NH2 3.24Å
440	D	95.7	Very high	93.6	Very high	12 Å²	12	27.6 Å²	27.6	6%	0.064	15%	0.151	C	C	.	.			trans	-126.2	112.8	172.7	-58.1	-38.2	0	0	0	110	F403 M442 R499 R500 K503	F403-D440 HydrophobicContact CZ-CB 4.42Å; D440-M442 PolarHBondContact O-N 3.33Å; D440-M442 VanDerWaalsContact O-N 3.16Å; D440-R499 IonicContact OD1-CZ 2.8Å; D440-R499 IonicContact OD1-NE 3.58Å; D440-R499 IonicContact OD1-NH2 3.09Å; D440-R499 PolarHBondContact OD1-NH2 2.97Å; D440-R499 IonicContact OD2-CZ 3.86Å; D440-R499 IonicContact OD2-NE 2.88Å; D440-R499 PolarHBondContact OD2-NE 2.97Å; D440-R499 IonicContact OD2-NH2 3.56Å; D440-R499 PolarHBondContact OD2-NH2 2.79Å; D440-R500 HydrophobicContact CB-CG 4.37Å; D440-R500 VanDerWaalsContact OD1-CG 3.23Å; D440-R500 WeakPolarHBondContact OD1-CG 3.13Å; D440-R500 IonicContact OD1-CZ 2.69Å; D440-R500 IonicContact OD1-NE 3.01Å; D440-R500 PolarHBondContact OD1-NE 2.55Å; D440-R500 IonicContact OD1-NH2 3.82Å; D440-K503 HydrophobicContact CB-CD 4.21Å; D440-K503 VanDerWaalsContact CB-NZ 3.34Å; D440-K503 WeakPolarHBondContact OD2-CE 3.48Å; D440-K503 IonicContact OD2-NZ 3.43Å; D440-K503 PolarHBondContact OD2-NZ 3.37Å
441	E	94.5	Very high	93.7	Very high	50 Å²	50	27.6 Å²	27.6	23%	0.234	15%	0.151	C	C	.	.			trans	-83.7	95.3	-173.2	-174.4	53.9	-123.5	0	0	112	F403 M408 H439 S443 I444	F403-E441 VanDerWaalsContact CD2-O 3.29Å; F403-E441 WeakPolarHBondContact CD2-O 3.23Å; F403-E441 WeakPolarHBondContact CE2-O 3.19Å; M408-E441 HydrophobicContact CE-CG 3.87Å; M408-E441 HydrophobicContact CG-CB 4.5Å; M408-E441 HydrophobicContact CG-CG 4.05Å; M408-E441 HydrophobicContact SD-CB 4.24Å; M408-E441 HydrophobicContact SD-CG 3.77Å; H439-E441 IonicContact CD2-OE2 3.92Å; H439-E441 IonicContact CE1-OE2 3.94Å; H439-E441 IonicContact NE2-OE2 3.91Å; H439-E441 PolarHBondContact NE2-OE2 2.63Å; E441-S443 VanDerWaalsContact CD-OG 3.25Å; E441-S443 VanDerWaalsContact CG-OG 3.25Å; E441-S443 WeakPolarHBondContact CG-OG 3.46Å; E441-S443 PolarHBondContact O-N 3.11Å; E441-S443 WeakPolarHBondContact OE1-CB 3.32Å; E441-S443 PolarHBondContact OE1-N 3.3Å; E441-S443 PolarHBondContact OE1-OG 3.42Å; E441-I444 HydrophobicContact CB-CD1 3.89Å; E441-I444 HydrophobicContact CB-CG1 4.17Å; E441-I444 HydrophobicContact CG-CD1 4.23Å; E441-I444 HydrophobicContact CG-CG1 4.02Å; E441-I444 PolarHBondContact O-N 2.89Å
442	M	95.1	Very high	94	Very high	85 Å²	85	27.7 Å²	27.7	42%	0.419	15%	0.151	S	C	.	.	G	3₁₀ helix	trans	-63.9	-23.5	-176.4	-67.5	-58.6	-56.9	0	0	113.7	F403 D440 I444 L445 K503 V507	F403-M442 HydrophobicContact CE2-SD 3.91Å; F403-M442 HydrophobicContact CZ-SD 3.82Å; D440-M442 PolarHBondContact O-N 3.33Å; D440-M442 VanDerWaalsContact O-N 3.16Å; M442-I444 PolarHBondContact O-N 3.02Å; M442-L445 HydrophobicContact CE-CD1 4.1Å; M442-L445 PolarHBondContact O-N 2.9Å; M442-K503 HydrophobicContact SD-CB 4.47Å; M442-K503 HydrophobicContact SD-CD 3.94Å; M442-V507 HydrophobicContact CE-CG2 4.07Å
443	S	93.7	Very high	94.2	Very high	31 Å²	31	29 Å²	29	22%	0.217	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-63.1	-23.3	178.1	60.6	0	0	0	0	113.1	R360 E441 L445 A446	R360-S443 PolarHBondContact NH1-OG 3.14Å; R360-S443 PolarHBondContact NH2-OG 2.99Å; E441-S443 VanDerWaalsContact CD-OG 3.25Å; E441-S443 VanDerWaalsContact CG-OG 3.25Å; E441-S443 WeakPolarHBondContact CG-OG 3.46Å; E441-S443 PolarHBondContact O-N 3.11Å; E441-S443 WeakPolarHBondContact OE1-CB 3.32Å; E441-S443 PolarHBondContact OE1-N 3.3Å; E441-S443 PolarHBondContact OE1-OG 3.42Å; S443-L445 VanDerWaalsContact C-N 3.25Å; S443-L445 PolarHBondContact O-N 3.31Å; S443-A446 WeakPolarHBondContact O-CB 3.43Å; S443-A446 PolarHBondContact O-N 3.5Å; S443-A446 VanDerWaalsContact O-N 3.13Å
444	I	95.7	Very high	94.4	Very high	14 Å²	14	29.1 Å²	29.1	7%	0.072	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-65.8	-29.6	174.5	-53.9	168.1	0	0	0	111.5	S399 D402 F403 M408 E441 M442 A446 P447	S399-I444 PolarHBondContact OG-O 3.44Å; D402-I444 HydrophobicContact CB-CG2 3.71Å; F403-I444 HydrophobicContact CB-CB 4.17Å; F403-I444 HydrophobicContact CB-CG2 3.94Å; F403-I444 HydrophobicContact CD2-CB 4.22Å; M408-I444 HydrophobicContact CG-CD1 3.73Å; M408-I444 HydrophobicContact CG-CG1 3.89Å; E441-I444 HydrophobicContact CB-CD1 3.89Å; E441-I444 HydrophobicContact CB-CG1 4.17Å; E441-I444 HydrophobicContact CG-CD1 4.23Å; E441-I444 HydrophobicContact CG-CG1 4.02Å; E441-I444 PolarHBondContact O-N 2.89Å; M442-I444 PolarHBondContact O-N 3.02Å; I444-A446 PolarHBondContact O-N 2.85Å; I444-P447 VanDerWaalsContact O-CD 3.3Å; I444-P447 WeakPolarHBondContact O-CD 3.17Å
445	L	96.2	Very high	94.4	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.005	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-83.1	8.7	176	-70.2	-179.7	0	0	0	113.6	I400 F403 M442 S443 P447 L448 S449 V504 V507	I400-L445 HydrophobicContact CG1-CD2 4.49Å; F403-L445 HydrophobicContact CB-CD2 3.56Å; F403-L445 HydrophobicContact CB-CG 3.77Å; F403-L445 HydrophobicContact CD1-CD1 3.61Å; F403-L445 HydrophobicContact CD1-CD2 3.93Å; F403-L445 HydrophobicContact CD1-CG 3.77Å; F403-L445 HydrophobicContact CD2-CD1 3.96Å; F403-L445 HydrophobicContact CD2-CD2 4.38Å; F403-L445 HydrophobicContact CD2-CG 3.62Å; F403-L445 HydrophobicContact CE1-CD1 3.59Å; F403-L445 HydrophobicContact CE1-CG 4.22Å; F403-L445 HydrophobicContact CE2-CD1 3.95Å; F403-L445 HydrophobicContact CE2-CG 4.09Å; F403-L445 HydrophobicContact CG-CD1 3.77Å; F403-L445 HydrophobicContact CG-CD2 3.7Å; F403-L445 HydrophobicContact CG-CG 3.42Å; F403-L445 VanDerWaalsContact CG-CG 3.42Å; F403-L445 HydrophobicContact CZ-CD1 3.76Å; F403-L445 HydrophobicContact CZ-CG 4.36Å; M442-L445 HydrophobicContact CE-CD1 4.1Å; M442-L445 PolarHBondContact O-N 2.9Å; S443-L445 VanDerWaalsContact C-N 3.25Å; S443-L445 PolarHBondContact O-N 3.31Å; L445-P447 VanDerWaalsContact C-CD 3.44Å; L445-P447 VanDerWaalsContact C-N 3.34Å; L445-L448 HydrophobicContact CD2-CD2 4.2Å; L445-L448 PolarHBondContact O-N 3.44Å; L445-L448 VanDerWaalsContact O-N 3.14Å; L445-S449 PolarHBondContact O-N 3.12Å; L445-S449 PolarHBondContact O-OG 3.4Å; L445-V504 HydrophobicContact CD1-CG2 4.09Å; L445-V504 HydrophobicContact CD2-CG2 4.17Å; L445-V507 HydrophobicContact CD1-CG2 4.15Å
446	A	95.1	Very high	94.5	Very high	8 Å²	8	34 Å²	34	7%	0.066	18%	0.176	C	C	.	.	H	α-helix	trans	-50.4	-46.8	175.6	0	0	0	0	0	112.9	W370 S443 I444 L448 S449 Q450	W370-A446 HydrophobicContact CE3-CB 3.57Å; W370-A446 HydrophobicContact CH2-CB 4.49Å; W370-A446 HydrophobicContact CZ3-CB 3.46Å; W370-A446 VanDerWaalsContact CZ3-CB 3.46Å; S443-A446 WeakPolarHBondContact O-CB 3.43Å; S443-A446 PolarHBondContact O-N 3.5Å; S443-A446 VanDerWaalsContact O-N 3.13Å; I444-A446 PolarHBondContact O-N 2.85Å; A446-L448 PolarHBondContact O-N 2.74Å; A446-S449 WeakPolarHBondContact CA-OG 3.31Å; A446-S449 PolarHBondContact O-N 3.2Å; A446-S449 PolarHBondContact O-OG 3.07Å; A446-S449 VanDerWaalsContact O-OG 3.07Å; A446-Q450 VanDerWaalsContact O-CB 3.29Å; A446-Q450 WeakPolarHBondContact O-CB 3.31Å; A446-Q450 VanDerWaalsContact O-CG 3.3Å; A446-Q450 WeakPolarHBondContact O-CG 3.45Å; A446-Q450 PolarHBondContact O-N 3.39Å
447	P	95.6	Very high	94.5	Very high	7 Å²	7	31.8 Å²	31.8	5%	0.045	17%	0.168	C	C	.	.	H	α-helix	trans	-56.9	-45.5	177.2	-21.7	31.2	0	0	0	112.9	W358 I444 L445 C451	W358-P447 HydrophobicContact CB-CG 4.09Å; W358-P447 HydrophobicContact CD2-CB 3.95Å; W358-P447 HydrophobicContact CD2-CG 3.58Å; W358-P447 HydrophobicContact CE3-CB 4.08Å; W358-P447 HydrophobicContact CE3-CG 3.93Å; W358-P447 HydrophobicContact CG-CB 4.48Å; W358-P447 HydrophobicContact CG-CG 3.65Å; W358-P447 HydrophobicContact CH2-CB 4.34Å; W358-P447 HydrophobicContact CZ2-CB 4.19Å; W358-P447 HydrophobicContact CZ3-CB 4.28Å; I444-P447 VanDerWaalsContact O-CD 3.3Å; I444-P447 WeakPolarHBondContact O-CD 3.17Å; L445-P447 VanDerWaalsContact C-CD 3.44Å; L445-P447 VanDerWaalsContact C-N 3.34Å; P447-C451 WeakPolarHBondContact O-CB 3.42Å; P447-C451 PolarHBondContact O-N 3.02Å; P447-C451 PolarHBondContact O-SG 2.65Å
448	L	95.7	Very high	94.5	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-65.8	-44.4	178.5	178.3	64.5	0	0	0	111.9	I396 I400 L445 A446 C452 I454 V504 V507 V508	I396-L448 HydrophobicContact CG2-CB 4.23Å; I396-L448 HydrophobicContact CG2-CD1 3.69Å; I400-L448 HydrophobicContact CD1-CD2 4.4Å; I400-L448 HydrophobicContact CG1-CD2 4.22Å; L445-L448 HydrophobicContact CD2-CD2 4.2Å; L445-L448 PolarHBondContact O-N 3.44Å; L445-L448 VanDerWaalsContact O-N 3.14Å; A446-L448 PolarHBondContact O-N 2.74Å; L448-C452 VanDerWaalsContact O-CA 3.27Å; L448-C452 WeakPolarHBondContact O-CA 3.4Å; L448-C452 PolarHBondContact O-N 2.91Å; L448-I454 HydrophobicContact CD1-CB 4.39Å; L448-V504 HydrophobicContact CD2-CG1 4.05Å; L448-V507 HydrophobicContact CD2-CB 4.25Å; L448-V507 HydrophobicContact CD2-CG1 3.89Å; L448-V507 HydrophobicContact CG-CG1 3.93Å; L448-V508 HydrophobicContact CD1-CG2 4.27Å; L448-V508 HydrophobicContact CD2-CG2 4.07Å
449	S	94.5	Very high	94.6	Very high	50 Å²	50	26.6 Å²	26.6	35%	0.35	14%	0.135	S	C	.	.	H	α-helix	trans	-73.6	-32.3	-176.1	68.3	0	0	0	0	114	L445 A446 C452	L445-S449 PolarHBondContact O-N 3.12Å; L445-S449 PolarHBondContact O-OG 3.4Å; A446-S449 WeakPolarHBondContact CA-OG 3.31Å; A446-S449 PolarHBondContact O-N 3.2Å; A446-S449 PolarHBondContact O-OG 3.07Å; A446-S449 VanDerWaalsContact O-OG 3.07Å; S449-C452 PolarHBondContact O-SG 2.7Å
450	Q	93.9	Very high	94.6	Very high	34 Å²	34	24.7 Å²	24.7	16%	0.159	13%	0.127	C	C	.	.	H	α-helix	trans	-80.9	-51.9	177.3	-68.7	176.9	-8.1	0	0	110.4	W370 C377 A446	W370-Q450 PolarHBondContact O-NE2 3.19Å; C377-Q450 HydrophobicContact CB-CB 3.84Å; A446-Q450 VanDerWaalsContact O-CB 3.29Å; A446-Q450 WeakPolarHBondContact O-CB 3.31Å; A446-Q450 VanDerWaalsContact O-CG 3.3Å; A446-Q450 WeakPolarHBondContact O-CG 3.45Å; A446-Q450 PolarHBondContact O-N 3.39Å
451	C	94.1	Very high	94.6	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.014	13%	0.129	C	C	.	.	H	α-helix	trans	-74.2	-30.9	-175.8	-57.1	0	0	0	0	113.2	W358 C377 K381 I396 P447 M453	W358-C451 VanDerWaalsContact CH2-SG 3.57Å; W358-C451 VanDerWaalsContact CZ2-SG 3.57Å; C377-C451 HydrophobicContact CB-CB 4.07Å; C377-C451 WeakPolarHBondContact CB-SG 3.24Å; C377-C451 WeakPolarHBondContact SG-CA 3.33Å; C377-C451 WeakPolarHBondContact SG-CB 3Å; C377-C451 CovalentContact SG-SG 2.02Å; C377-C451 PolarHBondContact SG-SG 3.2Å; K381-C451 PolarHBondContact NZ-O 3.45Å; I396-C451 HydrophobicContact CD1-CB 4.03Å; P447-C451 WeakPolarHBondContact O-CB 3.42Å; P447-C451 PolarHBondContact O-N 3.02Å; P447-C451 PolarHBondContact O-SG 2.65Å; C451-M453 VanDerWaalsContact C-N 3.31Å; C451-M453 WeakPolarHBondContact O-CG 3.28Å; C451-M453 PolarHBondContact O-N 2.95Å
452	C	95	Very high	94.6	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.014	12%	0.117	C	C	.	.			trans	48.6	48.7	-175.9	-80.2	0	0	0	0	113.5	L448 S449 C511 R514 L515 V520	L448-C452 VanDerWaalsContact O-CA 3.27Å; L448-C452 WeakPolarHBondContact O-CA 3.4Å; L448-C452 PolarHBondContact O-N 2.91Å; S449-C452 PolarHBondContact O-SG 2.7Å; C452-C511 WeakPolarHBondContact CA-SG 3.18Å; C452-C511 HydrophobicContact CB-CB 3.55Å; C452-C511 WeakPolarHBondContact CB-SG 3.39Å; C452-C511 WeakPolarHBondContact SG-CB 3.19Å; C452-C511 CovalentContact SG-SG 2.05Å; C452-C511 PolarHBondContact SG-SG 2.85Å; C452-R514 PolarHBondContact SG-NH2 2.96Å; C452-L515 HydrophobicContact CB-CD1 3.59Å; C452-V520 WeakPolarHBondContact O-CA 3.36Å; C452-V520 WeakPolarHBondContact O-CG1 3.45Å; C452-V520 WeakPolarHBondContact O-CG2 3.23Å
453	M	93.3	Very high	94.7	Very high	39 Å²	39	22.9 Å²	22.9	19%	0.192	12%	0.117	C	C	.	.			trans	-129.3	147.3	173	-59.5	-174.2	-54.1	0	0	109.3	L392 L393 I396 C451 V520	L392-M453 HydrophobicContact CB-CE 4.49Å; L392-M453 HydrophobicContact CD2-CE 3.34Å; L392-M453 HydrophobicContact CG-CE 3.74Å; L393-M453 HydrophobicContact CD2-CB 3.94Å; I396-M453 HydrophobicContact CD1-CB 3.94Å; I396-M453 WeakPolarHBondContact CD1-O 3.44Å; I396-M453 WeakPolarHBondContact CG2-O 3.42Å; C451-M453 VanDerWaalsContact C-N 3.31Å; C451-M453 WeakPolarHBondContact O-CG 3.28Å; C451-M453 PolarHBondContact O-N 2.95Å; M453-V520 CarbonylContact C-O 3.39Å; M453-V520 VanDerWaalsContact CA-O 3.31Å; M453-V520 WeakPolarHBondContact CA-O 3.2Å
454	I	95.3	Very high	94.8	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.005	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	146.9	175.1	-167.5	169.4	0	0	0	109.9	I400 L448 T458 L459 L462 V508 V520 I521 T522	I400-I454 HydrophobicContact CD1-CD1 3.66Å; I400-I454 HydrophobicContact CD1-CG1 4.24Å; L448-I454 HydrophobicContact CD1-CB 4.39Å; I454-T458 HydrophobicContact CD1-CG2 4.45Å; I454-L459 HydrophobicContact CD1-CB 4.17Å; I454-L459 HydrophobicContact CD1-CD1 4.45Å; I454-L459 HydrophobicContact CG2-CB 4.32Å; I454-L459 HydrophobicContact CG2-CD2 4.28Å; I454-L462 HydrophobicContact CD1-CD1 4.24Å; I454-V508 HydrophobicContact CD1-CG2 3.87Å; I454-V508 HydrophobicContact CG2-CG1 4.21Å; I454-V520 HydrophobicContact CG2-CG1 4.36Å; I454-V520 PolarHBondContact N-O 2.95Å; I454-I521 HydrophobicContact CG2-CG1 4.42Å; I454-I521 WeakPolarHBondContact O-CA 3.28Å; I454-T522 PolarHBondContact O-N 3.45Å
455	K	93.7	Very high	94.8	Very high	18 Å²	18	21 Å²	21	8%	0.078	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	140.6	171.6	-68.7	-179.3	-174.7	164.2	0	111.1	L393 N394 D397 S457 T458 L459 D524	L393-K455 HydrophobicContact CB-CG 4.08Å; L393-K455 HydrophobicContact CD1-CG 4.25Å; N394-K455 PolarHBondContact OD1-NZ 2.95Å; D397-K455 WeakPolarHBondContact OD2-CD 3.42Å; D397-K455 WeakPolarHBondContact OD2-CE 3.38Å; D397-K455 IonicContact OD2-NZ 3.74Å; D397-K455 PolarHBondContact OD2-NZ 2.94Å; K455-S457 VanDerWaalsContact C-N 3.3Å; K455-S457 PolarHBondContact O-N 3.41Å; K455-T458 PolarHBondContact O-N 2.96Å; K455-L459 PolarHBondContact O-N 3.22Å; K455-D524 HydrophobicContact CB-CB 4.47Å; K455-D524 HydrophobicContact CD-CB 4.46Å; K455-D524 HydrophobicContact CG-CB 4.38Å
456	R	93.1	Very high	94.7	Very high	94 Å²	94	22.4 Å²	22.4	36%	0.355	12%	0.116	S	C	.	.	H	α-helix	trans	-60.7	-40.8	175	-169.6	176	-179.4	112.4	-0.3	111.4	L459 L460 I521 T522 D524 F525	R456-L459 PolarHBondContact O-N 3.06Å; R456-L460 HydrophobicContact CG-CD1 3.96Å; R456-L460 HydrophobicContact CG-CG 4.39Å; R456-L460 WeakPolarHBondContact O-CB 3.34Å; R456-L460 VanDerWaalsContact O-CG 3.27Å; R456-L460 WeakPolarHBondContact O-CG 3.33Å; R456-L460 PolarHBondContact O-N 3.17Å; R456-I521 HydrophobicContact CB-CG2 3.72Å; R456-I521 HydrophobicContact CG-CG2 3.96Å; R456-T522 WeakPolarHBondContact CB-O 3.49Å; R456-T522 PolarHBondContact N-O 3.35Å; R456-D524 PolarHBondContact N-OD1 2.7Å; R456-F525 HydrophobicContact CB-CE1 4.28Å; R456-F525 HydrophobicContact CG-CE1 4.26Å
457	S	91.8	Very high	94.6	Very high	10 Å²	10	29 Å²	29	7%	0.07	14%	0.139	C	C	.	.	H	α-helix	trans	-62.6	-48	179.1	72.1	0	0	0	0	111.7	K455 L459 L460 R461 D524	K455-S457 VanDerWaalsContact C-N 3.3Å; K455-S457 PolarHBondContact O-N 3.41Å; S457-L459 PolarHBondContact O-N 3.33Å; S457-L460 PolarHBondContact O-N 3.38Å; S457-R461 VanDerWaalsContact CB-NH1 3.33Å; S457-R461 WeakPolarHBondContact O-CG 3.21Å; S457-R461 PolarHBondContact O-N 3.14Å; S457-R461 PolarHBondContact OG-NH1 2.75Å; S457-D524 WeakPolarHBondContact CB-OD2 3.5Å; S457-D524 PolarHBondContact N-OD1 3.36Å; S457-D524 PolarHBondContact OG-OD2 2.88Å
458	T	94.1	Very high	94.3	Very high	3 Å²	3	33.1 Å²	33.1	2%	0.018	17%	0.166	C	C	.	.	H	α-helix	trans	-58.3	-50.1	176.8	-54.8	0	0	0	0	110.8	F274 D397 I400 I454 K455 L460 R461 L462	F274-T458 HydrophobicContact CE1-CG2 3.92Å; F274-T458 HydrophobicContact CZ-CG2 3.86Å; D397-T458 WeakPolarHBondContact OD1-CB 3.37Å; D397-T458 WeakPolarHBondContact OD1-CG2 3.35Å; D397-T458 PolarHBondContact OD1-OG1 3.36Å; I400-T458 HydrophobicContact CD1-CG2 4.29Å; I454-T458 HydrophobicContact CD1-CG2 4.45Å; K455-T458 PolarHBondContact O-N 2.96Å; T458-L460 PolarHBondContact O-N 3.12Å; T458-R461 PolarHBondContact O-N 3.27Å; T458-L462 HydrophobicContact CG2-CD1 3.94Å; T458-L462 HydrophobicContact CG2-CG 4.3Å; T458-L462 VanDerWaalsContact O-CG 3.25Å; T458-L462 WeakPolarHBondContact O-CG 3.34Å; T458-L462 PolarHBondContact O-N 3.31Å
459	L	95.4	Very high	94	Very high	9 Å²	9	37.2 Å²	37.2	5%	0.047	18%	0.181	C	C	.	.	H	α-helix	trans	-60.2	-43.7	-179.6	-179.4	59	0	0	0	112.9	I454 K455 R456 S457 R461 L462 Q463 L505 V508 I521	I454-L459 HydrophobicContact CD1-CB 4.17Å; I454-L459 HydrophobicContact CD1-CD1 4.45Å; I454-L459 HydrophobicContact CG2-CB 4.32Å; I454-L459 HydrophobicContact CG2-CD2 4.28Å; K455-L459 PolarHBondContact O-N 3.22Å; R456-L459 PolarHBondContact O-N 3.06Å; S457-L459 PolarHBondContact O-N 3.33Å; L459-R461 PolarHBondContact O-N 3.43Å; L459-L462 PolarHBondContact O-N 2.88Å; L459-Q463 HydrophobicContact CD1-CG 4.27Å; L459-Q463 WeakPolarHBondContact O-CB 3.32Å; L459-Q463 VanDerWaalsContact O-CG 3.3Å; L459-Q463 WeakPolarHBondContact O-CG 3.41Å; L459-Q463 PolarHBondContact O-N 2.78Å; L459-L505 HydrophobicContact CD1-CD2 3.95Å; L459-V508 HydrophobicContact CD1-CB 4.41Å; L459-V508 HydrophobicContact CD1-CG1 3.89Å; L459-V508 HydrophobicContact CD1-CG2 4.4Å; L459-V508 HydrophobicContact CD2-CG1 4.13Å; L459-I521 HydrophobicContact CD2-CD1 3.52Å; L459-I521 HydrophobicContact CD2-CG1 3.95Å
460	L	95.1	Very high	93.9	Very high	47 Å²	47	36.2 Å²	36.2	25%	0.246	17%	0.171	C	C	.	.	H	α-helix	trans	-64.7	-39.5	179.1	-71.4	171.3	0	0	0	112	L95 R456 S457 T458 Q463 L464 F525	L95-L460 HydrophobicContact CD1-CB 3.99Å; L95-L460 HydrophobicContact CD2-CB 4.06Å; L95-L460 HydrophobicContact CD2-CD1 4.01Å; R456-L460 HydrophobicContact CG-CD1 3.96Å; R456-L460 HydrophobicContact CG-CG 4.39Å; R456-L460 WeakPolarHBondContact O-CB 3.34Å; R456-L460 VanDerWaalsContact O-CG 3.27Å; R456-L460 WeakPolarHBondContact O-CG 3.33Å; R456-L460 PolarHBondContact O-N 3.17Å; S457-L460 PolarHBondContact O-N 3.38Å; T458-L460 PolarHBondContact O-N 3.12Å; L460-Q463 PolarHBondContact O-N 3.21Å; L460-L464 WeakPolarHBondContact O-CB 3.46Å; L460-L464 PolarHBondContact O-N 3.44Å; L460-F525 HydrophobicContact CD1-CE1 4.27Å; L460-F525 HydrophobicContact CD1-CZ 3.78Å
461	R	94.9	Very high	93.9	Very high	24 Å²	24	39.8 Å²	39.8	9%	0.091	18%	0.183	C	C	.	.	H	α-helix	trans	-65.2	-44.4	174.8	-68.7	179.6	-169.1	118.9	-11.5	111.6	Y96 L272 D273 S457 T458 L459 Q463 L464 L465	Y96-R461 HydrophobicContact CE2-CG 4.48Å; L272-R461 VanDerWaalsContact O-CD 3.31Å; L272-R461 WeakPolarHBondContact O-CD 3.25Å; D273-R461 IonicContact OD2-CZ 2.66Å; D273-R461 IonicContact OD2-NE 2.94Å; D273-R461 IonicContact OD2-NH2 2.6Å; D273-R461 PolarHBondContact OD2-NH2 2.69Å; S457-R461 VanDerWaalsContact CB-NH1 3.33Å; S457-R461 WeakPolarHBondContact O-CG 3.21Å; S457-R461 PolarHBondContact O-N 3.14Å; S457-R461 PolarHBondContact OG-NH1 2.75Å; T458-R461 PolarHBondContact O-N 3.27Å; L459-R461 PolarHBondContact O-N 3.43Å; R461-Q463 VanDerWaalsContact C-N 3.32Å; R461-Q463 PolarHBondContact O-N 3.46Å; R461-L464 WeakPolarHBondContact O-CB 3.41Å; R461-L464 PolarHBondContact O-N 3.41Å; R461-L464 VanDerWaalsContact O-N 3.16Å; R461-L465 WeakPolarHBondContact O-CG 3.4Å; R461-L465 PolarHBondContact O-N 3.39Å
462	L	96.1	Very high	94	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61	-40.7	176.3	-66.4	172.1	0	0	0	112	L272 I400 I454 T458 L459 L465 A466 L501 V504 L505	L272-L462 HydrophobicContact CD2-CD2 3.83Å; I400-L462 HydrophobicContact CD1-CD1 4.27Å; I400-L462 HydrophobicContact CG2-CD1 4.16Å; I400-L462 HydrophobicContact CG2-CD2 4.23Å; I454-L462 HydrophobicContact CD1-CD1 4.24Å; T458-L462 HydrophobicContact CG2-CD1 3.94Å; T458-L462 HydrophobicContact CG2-CG 4.3Å; T458-L462 VanDerWaalsContact O-CG 3.25Å; T458-L462 WeakPolarHBondContact O-CG 3.34Å; T458-L462 PolarHBondContact O-N 3.31Å; L459-L462 PolarHBondContact O-N 2.88Å; L462-L465 PolarHBondContact O-N 3.13Å; L462-A466 PolarHBondContact O-N 3.41Å; L462-L501 HydrophobicContact CB-CD1 3.86Å; L462-L501 HydrophobicContact CD2-CD1 3.44Å; L462-L501 VanDerWaalsContact CD2-CD1 3.44Å; L462-L501 HydrophobicContact CG-CD1 4.19Å; L462-V504 HydrophobicContact CD1-CG1 4Å; L462-L505 HydrophobicContact CB-CD2 3.97Å
463	Q	96.1	Very high	94	Very high	86 Å²	86	39.7 Å²	39.7	40%	0.402	18%	0.182	S	C	.	.	H	α-helix	trans	-66.8	-36	175.4	-74	175	-14.2	0	0	112.5	L459 L460 R461 L505	L459-Q463 HydrophobicContact CD1-CG 4.27Å; L459-Q463 WeakPolarHBondContact O-CB 3.32Å; L459-Q463 VanDerWaalsContact O-CG 3.3Å; L459-Q463 WeakPolarHBondContact O-CG 3.41Å; L459-Q463 PolarHBondContact O-N 2.78Å; L460-Q463 PolarHBondContact O-N 3.21Å; R461-Q463 VanDerWaalsContact C-N 3.32Å; R461-Q463 PolarHBondContact O-N 3.46Å; Q463-L505 HydrophobicContact CG-CD2 3.89Å
464	L	95.4	Very high	94.1	Very high	5 Å²	5	39.5 Å²	39.5	3%	0.026	18%	0.182	C	C	.	.	H	α-helix	trans	-64.9	-48.5	174.8	-175.5	71	0	0	0	110.8	L90 H93 L95 Y96 L460 R461 A466 R467 F470	L90-L464 HydrophobicContact CD1-CD2 3.8Å; H93-L464 HydrophobicContact CB-CD2 4.33Å; L95-L464 HydrophobicContact CD1-CB 4.43Å; L95-L464 HydrophobicContact CD1-CD2 4.31Å; Y96-L464 HydrophobicContact CE2-CD2 3.93Å; L460-L464 WeakPolarHBondContact O-CB 3.46Å; L460-L464 PolarHBondContact O-N 3.44Å; R461-L464 WeakPolarHBondContact O-CB 3.41Å; R461-L464 PolarHBondContact O-N 3.41Å; R461-L464 VanDerWaalsContact O-N 3.16Å; L464-A466 PolarHBondContact O-N 2.98Å; L464-R467 VanDerWaalsContact O-CB 3.32Å; L464-R467 WeakPolarHBondContact O-CB 3.32Å; L464-R467 PolarHBondContact O-N 2.9Å; L464-F470 HydrophobicContact CD1-CD2 3.5Å; L464-F470 HydrophobicContact CD1-CE2 3.71Å; L464-F470 HydrophobicContact CD1-CG 4.24Å; L464-F470 HydrophobicContact CG-CB 4.31Å; L464-F470 HydrophobicContact CG-CD2 3.89Å; L464-F470 HydrophobicContact CG-CE2 4.45Å; L464-F470 HydrophobicContact CG-CG 4.14Å
465	L	95.4	Very high	94.1	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-65.7	-16.6	-179.2	-69.7	167.3	0	0	0	113.7	L90 I271 L272 R461 L462 F470 R471 L472 V475 L501	L90-L465 HydrophobicContact CD1-CD2 3.87Å; L90-L465 HydrophobicContact CD2-CD2 3.93Å; I271-L465 HydrophobicContact CG2-CD1 4.16Å; I271-L465 HydrophobicContact CG2-CD2 3.82Å; L272-L465 HydrophobicContact CD2-CD1 3.68Å; R461-L465 WeakPolarHBondContact O-CG 3.4Å; R461-L465 PolarHBondContact O-N 3.39Å; L462-L465 PolarHBondContact O-N 3.13Å; L465-F470 WeakPolarHBondContact CA-O 3.4Å; L465-R471 WeakPolarHBondContact O-CA 3.41Å; L465-L472 HydrophobicContact CB-CB 4.38Å; L465-L472 HydrophobicContact CD1-CD1 4.35Å; L465-L472 HydrophobicContact CD2-CD1 4.38Å; L465-L472 PolarHBondContact O-N 3.48Å; L465-L472 VanDerWaalsContact O-N 3.08Å; L465-V475 HydrophobicContact CD2-CG2 3.99Å; L465-L501 HydrophobicContact CB-CD2 3.89Å
466	A	94.7	Very high	94.3	Very high	30 Å²	30	38.6 Å²	38.6	25%	0.248	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-12.3	173.3	0	0	0	0	0	113.4	L462 L464 L501 L505	L462-A466 PolarHBondContact O-N 3.41Å; L464-A466 PolarHBondContact O-N 2.98Å; A466-L501 HydrophobicContact CB-CD2 4.07Å; A466-L505 HydrophobicContact CB-CD1 3.68Å
467	R	93.5	Very high	94.4	Very high	148 Å²	148	38.1 Å²	38.1	56%	0.558	18%	0.176	S	C	*	.	S	Bend	trans	-79.6	146.5	-179.7	-61.5	-176.9	-177.5	-170.2	-2.7	110.8	L464 R469 F470 R471	L464-R467 VanDerWaalsContact O-CB 3.32Å; L464-R467 WeakPolarHBondContact O-CB 3.32Å; L464-R467 PolarHBondContact O-N 2.9Å; R467-R469 VanDerWaalsContact C-N 3.25Å; R467-R469 PolarHBondContact O-N 3.26Å; R467-R469 VanDerWaalsContact O-N 3.16Å; R467-F470 CarbonylContact O-C 3.51Å; R467-F470 PolarHBondContact O-N 3.42Å; R467-R471 WeakPolarHBondContact O-CA 3.48Å; R467-R471 PolarHBondContact O-N 3.11Å
468	P	89.7	Confident	94.6	Very high	93 Å²	93	40.7 Å²	40.7	60%	0.604	19%	0.187	S	C	*	.	G	3₁₀ helix	trans	-54.6	-37.2	179.6	-26.9	34.6	0	0	0	114.5	F470	P468-F470 VanDerWaalsContact C-N 3.27Å; P468-F470 PolarHBondContact O-N 2.98Å
469	R	89.2	Confident	94.6	Very high	86 Å²	86	40.8 Å²	40.8	33%	0.325	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-66.5	-23.8	179.2	-78.3	-176.9	152.1	-176.9	-15.8	114.5	E79 V80 R467	E79-R469 VanDerWaalsContact CB-CZ 3.49Å; E79-R469 IonicContact OE1-NH1 3.5Å; E79-R469 PolarHBondContact OE1-NH1 2.9Å; E79-R469 IonicContact OE2-CZ 3.3Å; E79-R469 IonicContact OE2-NE 3.83Å; E79-R469 IonicContact OE2-NH1 2.66Å; E79-R469 PolarHBondContact OE2-NH1 3.5Å; V80-R469 PolarHBondContact O-NH2 3.48Å; R467-R469 VanDerWaalsContact C-N 3.25Å; R467-R469 PolarHBondContact O-N 3.26Å; R467-R469 VanDerWaalsContact O-N 3.16Å
470	F	92.5	Very high	94.5	Very high	30 Å²	30	40.7 Å²	40.7	13%	0.132	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-130.6	29	-176.4	-57.3	-75.7	0	0	0	111.5	R89 L90 L464 L465 R467 P468 L472	R89-F470 HydrophobicContact CB-CE1 3.95Å; L90-F470 HydrophobicContact CB-CD1 4.19Å; L90-F470 HydrophobicContact CD1-CB 4.25Å; L90-F470 HydrophobicContact CD1-CD1 4.02Å; L90-F470 HydrophobicContact CD1-CG 4.37Å; L464-F470 HydrophobicContact CD1-CD2 3.5Å; L464-F470 HydrophobicContact CD1-CE2 3.71Å; L464-F470 HydrophobicContact CD1-CG 4.24Å; L464-F470 HydrophobicContact CG-CB 4.31Å; L464-F470 HydrophobicContact CG-CD2 3.89Å; L464-F470 HydrophobicContact CG-CE2 4.45Å; L464-F470 HydrophobicContact CG-CG 4.14Å; L465-F470 WeakPolarHBondContact CA-O 3.4Å; R467-F470 CarbonylContact O-C 3.51Å; R467-F470 PolarHBondContact O-N 3.42Å; P468-F470 VanDerWaalsContact C-N 3.27Å; P468-F470 PolarHBondContact O-N 2.98Å; F470-L472 PolarHBondContact O-N 3.11Å
471	R	94.4	Very high	94.5	Very high	109 Å²	109	42.3 Å²	42.3	41%	0.411	20%	0.196	S	C	.	.			trans	-53.4	130.5	-172.4	-175.5	-179.1	-72	178.1	-1.6	110.6	L465 R467 S473 D474 V475 D498	L465-R471 WeakPolarHBondContact O-CA 3.41Å; R467-R471 WeakPolarHBondContact O-CA 3.48Å; R467-R471 PolarHBondContact O-N 3.11Å; R471-S473 VanDerWaalsContact C-N 3.32Å; R471-S473 WeakPolarHBondContact CD-OG 3.07Å; R471-S473 WeakPolarHBondContact CG-OG 3.49Å; R471-S473 PolarHBondContact O-N 2.83Å; R471-D474 HydrophobicContact CB-CB 4.44Å; R471-D474 PolarHBondContact O-N 2.87Å; R471-D474 VanDerWaalsContact O-N 3.07Å; R471-V475 PolarHBondContact O-N 3.33Å; R471-V475 VanDerWaalsContact O-N 3.13Å; R471-D498 WeakPolarHBondContact CD-OD2 3.43Å; R471-D498 WeakPolarHBondContact CG-OD2 3.43Å
472	L	95.5	Very high	94.1	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-55.6	-43.8	-173.7	178.8	58	0	0	0	112.6	L268 I271 L404 L465 F470 D474 V475 M476 L497 D498 L501	L268-L472 HydrophobicContact CD1-CD1 3.85Å; L268-L472 HydrophobicContact CD1-CD2 4.35Å; I271-L472 HydrophobicContact CG2-CD1 3.89Å; L404-L472 HydrophobicContact CD2-CD2 4.44Å; L465-L472 HydrophobicContact CB-CB 4.38Å; L465-L472 HydrophobicContact CD1-CD1 4.35Å; L465-L472 HydrophobicContact CD2-CD1 4.38Å; L465-L472 PolarHBondContact O-N 3.48Å; L465-L472 VanDerWaalsContact O-N 3.08Å; F470-L472 PolarHBondContact O-N 3.11Å; L472-D474 PolarHBondContact O-N 2.89Å; L472-V475 HydrophobicContact CD1-CG2 4.25Å; L472-V475 VanDerWaalsContact O-CG2 3.23Å; L472-V475 WeakPolarHBondContact O-CG2 3.12Å; L472-M476 HydrophobicContact CD1-CG 4.39Å; L472-M476 WeakPolarHBondContact O-CB 3.38Å; L472-M476 PolarHBondContact O-N 3.16Å; L472-L497 HydrophobicContact CD2-CB 3.9Å; L472-L497 HydrophobicContact CG-CB 4.2Å; L472-D498 WeakPolarHBondContact CB-OD1 3.49Å; L472-D498 PolarHBondContact N-OD1 2.03Å; L472-L501 HydrophobicContact CB-CD2 4.09Å; L472-L501 HydrophobicContact CD2-CB 4.35Å; L472-L501 HydrophobicContact CD2-CD2 4.17Å
473	S	95.7	Very high	94	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.014	22%	0.224	C	C	.	.	H	α-helix	trans	-58.3	-43	176.1	54.5	0	0	0	0	113.5	R471 R477 L494 D498	R471-S473 VanDerWaalsContact C-N 3.32Å; R471-S473 WeakPolarHBondContact CD-OG 3.07Å; R471-S473 WeakPolarHBondContact CG-OG 3.49Å; R471-S473 PolarHBondContact O-N 2.83Å; S473-R477 WeakPolarHBondContact O-CB 3.31Å; S473-R477 PolarHBondContact O-N 3.31Å; S473-L494 WeakPolarHBondContact CB-O 3.27Å; S473-D498 WeakPolarHBondContact CB-OD2 3.27Å; S473-D498 PolarHBondContact N-OD1 2.63Å; S473-D498 PolarHBondContact OG-OD2 3.4Å
474	D	95.3	Very high	93.8	Very high	35 Å²	35	43.2 Å²	43.2	19%	0.187	22%	0.224	C	C	.	.	H	α-helix	trans	-67.9	-46	-178.9	-63.9	-25.7	0	0	0	111.5	K86 R471 L472 M476 R477 E478	K86-D474 HydrophobicContact CD-CB 3.71Å; K86-D474 IonicContact NZ-OD2 3.33Å; K86-D474 PolarHBondContact NZ-OD2 3.39Å; R471-D474 HydrophobicContact CB-CB 4.44Å; R471-D474 PolarHBondContact O-N 2.87Å; R471-D474 VanDerWaalsContact O-N 3.07Å; L472-D474 PolarHBondContact O-N 2.89Å; D474-M476 VanDerWaalsContact C-N 3.34Å; D474-M476 PolarHBondContact O-N 3.11Å; D474-R477 WeakPolarHBondContact O-CB 3.25Å; D474-R477 PolarHBondContact O-N 3.17Å; D474-E478 PolarHBondContact O-N 3.01Å
475	V	95.6	Very high	93.7	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-69.1	-33	178.7	-62.4	0	0	0	0	112	K86 L87 L90 I271 L465 R471 L472 S479	K86-V475 HydrophobicContact CB-CG1 4.09Å; L87-V475 HydrophobicContact CD1-CB 4.36Å; L90-V475 HydrophobicContact CD2-CB 4.42Å; L90-V475 HydrophobicContact CD2-CG1 4.32Å; L90-V475 HydrophobicContact CD2-CG2 4.4Å; I271-V475 HydrophobicContact CD1-CB 4.46Å; I271-V475 HydrophobicContact CD1-CG2 4.15Å; I271-V475 HydrophobicContact CG2-CG2 3.88Å; L465-V475 HydrophobicContact CD2-CG2 3.99Å; R471-V475 PolarHBondContact O-N 3.33Å; R471-V475 VanDerWaalsContact O-N 3.13Å; L472-V475 HydrophobicContact CD1-CG2 4.25Å; L472-V475 VanDerWaalsContact O-CG2 3.23Å; L472-V475 WeakPolarHBondContact O-CG2 3.12Å; V475-S479 WeakPolarHBondContact O-CB 3.39Å; V475-S479 PolarHBondContact O-N 3.02Å
476	M	96	Very high	93.5	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-68.2	-42.8	173.4	-101.4	-57.6	-76.2	0	0	111.8	A264 H267 L268 I271 L472 D474 S479 L480 L489 L494 L497	A264-M476 HydrophobicContact CB-CE 4.12Å; H267-M476 HydrophobicContact CB-CE 4.04Å; H267-M476 HydrophobicContact CB-SD 3.74Å; L268-M476 HydrophobicContact CB-SD 4.23Å; L268-M476 HydrophobicContact CD1-CG 4.42Å; I271-M476 HydrophobicContact CD1-CB 4.3Å; I271-M476 HydrophobicContact CD1-CG 3.66Å; I271-M476 HydrophobicContact CD1-SD 3.46Å; I271-M476 WeakPolarHBondContact CD1-SD 3.03Å; L472-M476 HydrophobicContact CD1-CG 4.39Å; L472-M476 WeakPolarHBondContact O-CB 3.38Å; L472-M476 PolarHBondContact O-N 3.16Å; D474-M476 VanDerWaalsContact C-N 3.34Å; D474-M476 PolarHBondContact O-N 3.11Å; M476-S479 PolarHBondContact O-N 3.21Å; M476-L480 HydrophobicContact CE-CD1 3.35Å; M476-L480 HydrophobicContact CE-CD2 4Å; M476-L480 HydrophobicContact CE-CG 3.59Å; M476-L480 WeakPolarHBondContact O-CB 3.4Å; M476-L480 VanDerWaalsContact O-CG 3.3Å; M476-L480 WeakPolarHBondContact O-CG 3.46Å; M476-L480 PolarHBondContact O-N 3.26Å; M476-L480 HydrophobicContact SD-CG 4.47Å; M476-L489 HydrophobicContact CE-CD1 4.07Å; M476-L494 HydrophobicContact CB-CD2 3.94Å; M476-L497 HydrophobicContact CB-CD1 4.34Å; M476-L497 HydrophobicContact CG-CD1 4Å
477	R	95.9	Very high	93.4	Very high	84 Å²	84	53.9 Å²	53.9	32%	0.317	27%	0.268	S	S	.	.	H	α-helix	trans	-56.1	-54.9	176	-172.2	-169.8	-49.3	-127.8	-11.3	110.7	S473 D474 S479 L480 D481 E491 L494	S473-R477 WeakPolarHBondContact O-CB 3.31Å; S473-R477 PolarHBondContact O-N 3.31Å; D474-R477 WeakPolarHBondContact O-CB 3.25Å; D474-R477 PolarHBondContact O-N 3.17Å; R477-S479 VanDerWaalsContact C-N 3.3Å; R477-S479 PolarHBondContact O-N 3.08Å; R477-L480 PolarHBondContact O-N 2.88Å; R477-L480 VanDerWaalsContact O-N 3.13Å; R477-D481 PolarHBondContact O-N 3.39Å; R477-E491 IonicContact CZ-OE1 3.87Å; R477-E491 IonicContact CZ-OE2 3.32Å; R477-E491 IonicContact NE-OE1 2.85Å; R477-E491 IonicContact NH1-OE1 2.8Å; R477-E491 PolarHBondContact NH1-OE1 3.49Å; R477-E491 IonicContact NH1-OE2 3.42Å; R477-E491 PolarHBondContact NH1-OE2 2.89Å; R477-E491 IonicContact NH2-OE1 3.97Å; R477-E491 PolarHBondContact NH2-OE1 3.5Å; R477-E491 IonicContact NH2-OE2 2.89Å; R477-E491 PolarHBondContact NH2-OE2 3.13Å; R477-L494 HydrophobicContact CB-CD1 4.07Å; R477-L494 HydrophobicContact CG-CD1 4.25Å
478	E	95.3	Very high	93.4	Very high	64 Å²	64	47 Å²	47	30%	0.299	24%	0.243	S	C	.	.	H	α-helix	trans	-61.1	-38.2	-180	-175.1	174.1	-173	0	0	112.5	S85 K86 L87 D474	S85-E478 WeakPolarHBondContact CA-OE1 3.44Å; S85-E478 WeakPolarHBondContact CB-OE1 3.34Å; S85-E478 VanDerWaalsContact OG-CD 3.26Å; S85-E478 PolarHBondContact OG-OE1 2.66Å; S85-E478 PolarHBondContact OG-OE2 3.26Å; K86-E478 PolarHBondContact N-OE2 3.5Å; L87-E478 HydrophobicContact CB-CB 4.36Å; L87-E478 HydrophobicContact CB-CG 3.99Å; L87-E478 WeakPolarHBondContact CB-OE2 3.27Å; L87-E478 HydrophobicContact CD2-CG 4.38Å; L87-E478 PolarHBondContact N-OE2 3.37Å; D474-E478 PolarHBondContact O-N 3.01Å
479	S	93.9	Very high	93.6	Very high	5 Å²	5	43.1 Å²	43.1	4%	0.035	22%	0.217	C	C	.	.	H	α-helix	trans	-67.6	-38	176.9	-175.6	0	0	0	0	112.4	H267 R270 V475 M476 R477	H267-S479 PolarHBondContact CE1-O 2.87Å; H267-S479 PolarHBondContact ND1-O 3.41Å; H267-S479 PolarHBondContact ND1-OG 3.34Å; R270-S479 PolarHBondContact NH2-OG 2.88Å; V475-S479 WeakPolarHBondContact O-CB 3.39Å; V475-S479 PolarHBondContact O-N 3.02Å; M476-S479 PolarHBondContact O-N 3.21Å; R477-S479 VanDerWaalsContact C-N 3.3Å; R477-S479 PolarHBondContact O-N 3.08Å
480	L	95	Very high	93.8	Very high	7 Å²	7	40.4 Å²	40.4	4%	0.037	21%	0.21	C	C	.	.	H	α-helix	trans	-79.4	-24	179.7	-74.4	176.7	0	0	0	113.4	I263 H267 M476 R477 G482 D483 V488 L489	I263-L480 HydrophobicContact CG2-CD2 4.24Å; H267-L480 HydrophobicContact CB-CD2 3.99Å; M476-L480 HydrophobicContact CE-CD1 3.35Å; M476-L480 HydrophobicContact CE-CD2 4Å; M476-L480 HydrophobicContact CE-CG 3.59Å; M476-L480 WeakPolarHBondContact O-CB 3.4Å; M476-L480 VanDerWaalsContact O-CG 3.3Å; M476-L480 WeakPolarHBondContact O-CG 3.46Å; M476-L480 PolarHBondContact O-N 3.26Å; M476-L480 HydrophobicContact SD-CG 4.47Å; R477-L480 PolarHBondContact O-N 2.88Å; R477-L480 VanDerWaalsContact O-N 3.13Å; L480-G482 PolarHBondContact O-N 3.26Å; L480-G482 VanDerWaalsContact O-N 3.12Å; L480-D483 WeakPolarHBondContact O-CB 3.32Å; L480-D483 PolarHBondContact O-N 2.9Å; L480-V488 HydrophobicContact CD1-CB 4.2Å; L480-V488 HydrophobicContact CD2-CB 3.99Å; L480-V488 HydrophobicContact CD2-CG1 4.14Å; L480-V488 HydrophobicContact CD2-CG2 4.19Å; L480-V488 HydrophobicContact CG-CB 4.5Å; L480-L489 HydrophobicContact CD1-CB 4.11Å; L480-L489 HydrophobicContact CD1-CD1 3.9Å; L480-L489 HydrophobicContact CD1-CG 3.84Å
481	D	93.4	Very high	94	Very high	80 Å²	80	43.2 Å²	43.2	43%	0.428	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-19.2	179.7	-77.5	-21.9	0	0	0	113.4	R477 D483	R477-D481 PolarHBondContact O-N 3.39Å; D481-D483 VanDerWaalsContact C-N 3.34Å
482	G	87.8	Confident	94	Very high	64 Å²	64	40.5 Å²	40.5	66%	0.66	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-8.6	172.8	0	0	0	0	0	115.1	L480	L480-G482 PolarHBondContact O-N 3.26Å; L480-G482 VanDerWaalsContact O-N 3.12Å
483	D	93.8	Very high	94.1	Very high	4 Å²	4	40.8 Å²	40.8	2%	0.021	22%	0.221	C	C	.	.	S	Bend	trans	-85.9	139.2	177.4	-165.8	-84.9	0	0	0	111.3	G282 L480 D481 L485 R486 V488	G282-D483 WeakPolarHBondContact CA-OD1 3.38Å; G282-D483 PolarHBondContact N-OD1 3.31Å; G282-D483 PolarHBondContact N-OD2 3.12Å; L480-D483 WeakPolarHBondContact O-CB 3.32Å; L480-D483 PolarHBondContact O-N 2.9Å; D481-D483 VanDerWaalsContact C-N 3.34Å; D483-L485 PolarHBondContact O-N 3.35Å; D483-L485 WeakPolarHBondContact OD1-CB 3.27Å; D483-L485 PolarHBondContact OD1-N 3.43Å; D483-R486 WeakPolarHBondContact O-CB 3.29Å; D483-R486 PolarHBondContact O-N 3.1Å; D483-V488 HydrophobicContact CB-CG2 3.95Å
484	P	92.8	Very high	94.1	Very high	61 Å²	61	40.9 Å²	40.9	40%	0.396	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-18.5	-179.2	27.5	-38.4	0	0	0	113.9	Q185 G282 R486	Q185-P484 HydrophobicContact CG-CG 3.95Å; G282-P484 WeakPolarHBondContact O-CG 3.27Å; P484-R486 PolarHBondContact O-N 3.25Å
485	L	92.3	Very high	94.2	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.01	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	21.4	175.9	-60.1	-174.9	0	0	0	113.2	R242 I263 G282 R284 E336 D483 P487 V488	R242-L485 PolarHBondContact NH1-O 2.89Å; I263-L485 HydrophobicContact CD1-CD1 3.99Å; G282-L485 VanDerWaalsContact CA-CD1 3.43Å; R284-L485 HydrophobicContact CG-CD2 3.79Å; E336-L485 HydrophobicContact CB-CD1 4.27Å; E336-L485 HydrophobicContact CB-CD2 3.96Å; D483-L485 PolarHBondContact O-N 3.35Å; D483-L485 WeakPolarHBondContact OD1-CB 3.27Å; D483-L485 PolarHBondContact OD1-N 3.43Å; L485-P487 CarbonylContact O-C 3.58Å; L485-P487 VanDerWaalsContact O-C 3.27Å; L485-V488 HydrophobicContact CB-CG2 4.48Å
486	R	90.5	Very high	94.2	Very high	172 Å²	172	43.9 Å²	43.9	65%	0.649	24%	0.237	S	C	*	.			trans	-57.1	138.2	176	65.6	-175.5	-174.7	174.4	1.5	112.5	D483 P484	D483-R486 WeakPolarHBondContact O-CB 3.29Å; D483-R486 PolarHBondContact O-N 3.1Å; P484-R486 PolarHBondContact O-N 3.25Å
487	P	92.9	Very high	94.3	Very high	85 Å²	85	43.9 Å²	43.9	55%	0.552	24%	0.237	S	C	*	.	S	Bend	cis	-75.4	127.4	-9	30.6	-33.2	0	0	0	112.1	R242 L485	R242-P487 PolarHBondContact NH1-O 3.48Å; L485-P487 CarbonylContact O-C 3.58Å; L485-P487 VanDerWaalsContact O-C 3.27Å
488	V	93.4	Very high	94.4	Very high	3 Å²	3	41.1 Å²	41.1	2%	0.018	23%	0.229	C	C	.	.	S	Bend	trans	-73	-43.3	178.5	178.9	0	0	0	0	111.5	N260 I263 L480 D483 L485	N260-V488 HydrophobicContact CB-CG1 4.18Å; N260-V488 WeakPolarHBondContact CB-O 3.04Å; N260-V488 VanDerWaalsContact CG-O 3.27Å; N260-V488 PolarHBondContact OD1-O 3.13Å; I263-V488 HydrophobicContact CB-CG1 3.93Å; I263-V488 HydrophobicContact CD1-CG1 4.42Å; I263-V488 HydrophobicContact CG2-CG1 3.94Å; I263-V488 HydrophobicContact CG2-CG2 4.16Å; L480-V488 HydrophobicContact CD1-CB 4.2Å; L480-V488 HydrophobicContact CD2-CB 3.99Å; L480-V488 HydrophobicContact CD2-CG1 4.14Å; L480-V488 HydrophobicContact CD2-CG2 4.19Å; L480-V488 HydrophobicContact CG-CB 4.5Å; D483-V488 HydrophobicContact CB-CG2 3.95Å; L485-V488 HydrophobicContact CB-CG2 4.48Å
489	L	94.4	Very high	94.5	Very high	12 Å²	12	42.3 Å²	42.3	6%	0.063	23%	0.231	C	C	.	.	S	Bend	trans	-114.8	145.5	174.4	-66.9	-177.5	0	0	0	110.1	A264 F434 M476 L480 H493 L494	A264-L489 HydrophobicContact CB-CD1 3.72Å; A264-L489 HydrophobicContact CB-CD2 3.84Å; A264-L489 HydrophobicContact CB-CG 3.78Å; F434-L489 HydrophobicContact CB-CD2 4.08Å; F434-L489 HydrophobicContact CD1-CD1 3.93Å; F434-L489 HydrophobicContact CD1-CD2 3.72Å; F434-L489 HydrophobicContact CD2-CD2 4.23Å; F434-L489 HydrophobicContact CE1-CD1 3.52Å; F434-L489 HydrophobicContact CE1-CD2 4.16Å; F434-L489 HydrophobicContact CG-CD2 3.75Å; F434-L489 HydrophobicContact CZ-CD1 3.86Å; M476-L489 HydrophobicContact CE-CD1 4.07Å; L480-L489 HydrophobicContact CD1-CB 4.11Å; L480-L489 HydrophobicContact CD1-CD1 3.9Å; L480-L489 HydrophobicContact CD1-CG 3.84Å; L489-H493 HydrophobicContact CB-CB 4.33Å; L489-H493 HydrophobicContact CD2-CB 4.46Å; L489-L494 HydrophobicContact CB-CD2 4.36Å; L489-L494 HydrophobicContact CB-CG 4.45Å; L489-L494 HydrophobicContact CD1-CD2 4.19Å
490	T	94.3	Very high	94.7	Very high	30 Å²	30	42.3 Å²	42.3	18%	0.184	23%	0.23	C	C	.	.			trans	-78.6	158.8	172.2	62.3	0	0	0	0	111.3	R242 P492 H493 L494	R242-T490 HydrophobicContact CB-CG2 4.05Å; R242-T490 VanDerWaalsContact O-CG2 3.32Å; R242-T490 WeakPolarHBondContact O-CG2 3.36Å; T490-P492 VanDerWaalsContact C-CD 3.49Å; T490-H493 PolarHBondContact O-N 2.81Å; T490-H493 PolarHBondContact OG1-CD2 3.48Å; T490-H493 VanDerWaalsContact OG1-CD2 3.29Å; T490-L494 PolarHBondContact O-N 2.94Å
491	E	95	Very high	94.8	Very high	88 Å²	88	42 Å²	42	41%	0.411	23%	0.228	S	C	.	.	H	α-helix	trans	-52	-43.5	178.6	-71.6	-65.4	145.6	0	0	113.9	R477 H493 L494 L495	R477-E491 IonicContact CZ-OE1 3.87Å; R477-E491 IonicContact CZ-OE2 3.32Å; R477-E491 IonicContact NE-OE1 2.85Å; R477-E491 IonicContact NH1-OE1 2.8Å; R477-E491 PolarHBondContact NH1-OE1 3.49Å; R477-E491 IonicContact NH1-OE2 3.42Å; R477-E491 PolarHBondContact NH1-OE2 2.89Å; R477-E491 IonicContact NH2-OE1 3.97Å; R477-E491 PolarHBondContact NH2-OE1 3.5Å; R477-E491 IonicContact NH2-OE2 2.89Å; R477-E491 PolarHBondContact NH2-OE2 3.13Å; E491-H493 VanDerWaalsContact C-N 3.29Å; E491-H493 PolarHBondContact O-N 2.85Å; E491-L494 PolarHBondContact O-N 2.68Å; E491-L494 VanDerWaalsContact O-N 3.13Å; E491-L495 WeakPolarHBondContact O-CG 3.38Å; E491-L495 PolarHBondContact O-N 3.01Å
492	P	96.2	Very high	95	Very high	53 Å²	53	42 Å²	42	34%	0.344	23%	0.226	S	C	.	.	H	α-helix	trans	-57.8	-37.7	176	-27.4	36.7	0	0	0	114.1	H437 T490 L495 A496	H437-P492 HydrophobicContact CB-CB 4Å; H437-P492 VanDerWaalsContact CG-CB 3.49Å; H437-P492 WeakPolarHBondContact ND1-CB 3.45Å; T490-P492 VanDerWaalsContact C-CD 3.49Å; P492-L495 PolarHBondContact O-N 3.31Å; P492-A496 WeakPolarHBondContact O-CB 3.28Å; P492-A496 PolarHBondContact O-N 3.48Å
493	H	95.8	Very high	95.5	Very high	5 Å²	5	41.3 Å²	41.3	2%	0.023	21%	0.205	C	C	.	.	H	α-helix	trans	-68.1	-38.9	176.4	-79.9	-69.4	0	0	0	112	F434 H437 L489 T490 E491 A496 L497	F434-H493 HydrophobicContact CD1-CB 4.23Å; F434-H493 AromaticContact CD1-ND1 3.88Å; F434-H493 PolarHBondContact O-CE1 3.43Å; F434-H493 PolarHBondContact O-NE2 2.98Å; H437-H493 AromaticContact CD2-CD2 3.99Å; H437-H493 AromaticContact CD2-NE2 3.67Å; L489-H493 HydrophobicContact CB-CB 4.33Å; L489-H493 HydrophobicContact CD2-CB 4.46Å; T490-H493 PolarHBondContact O-N 2.81Å; T490-H493 PolarHBondContact OG1-CD2 3.48Å; T490-H493 VanDerWaalsContact OG1-CD2 3.29Å; E491-H493 VanDerWaalsContact C-N 3.29Å; E491-H493 PolarHBondContact O-N 2.85Å; H493-A496 WeakPolarHBondContact O-CB 3.33Å; H493-A496 PolarHBondContact O-N 3.06Å; H493-L497 PolarHBondContact O-N 2.8Å; H493-L497 VanDerWaalsContact O-N 3.15Å
494	L	96.4	Very high	95.7	Very high	5 Å²	5	41.1 Å²	41.1	3%	0.026	20%	0.204	C	C	.	.	H	α-helix	trans	-62.8	-45.3	175.7	-65.8	173.6	0	0	0	111	S473 M476 R477 L489 T490 E491 A496 L497	S473-L494 WeakPolarHBondContact CB-O 3.27Å; M476-L494 HydrophobicContact CB-CD2 3.94Å; R477-L494 HydrophobicContact CB-CD1 4.07Å; R477-L494 HydrophobicContact CG-CD1 4.25Å; L489-L494 HydrophobicContact CB-CD2 4.36Å; L489-L494 HydrophobicContact CB-CG 4.45Å; L489-L494 HydrophobicContact CD1-CD2 4.19Å; T490-L494 PolarHBondContact O-N 2.94Å; E491-L494 PolarHBondContact O-N 2.68Å; E491-L494 VanDerWaalsContact O-N 3.13Å; L494-A496 VanDerWaalsContact C-N 3.31Å; L494-A496 PolarHBondContact O-N 3.04Å; L494-L497 WeakPolarHBondContact O-CB 3.36Å; L494-L497 PolarHBondContact O-N 3Å
495	L	96.7	Very high	95.9	Very high	98 Å²	98	39 Å²	39	51%	0.513	19%	0.189	S	C	.	.	H	α-helix	trans	-66.1	-33.4	176.2	-63.4	177.7	0	0	0	112.5	E491 P492 L497 D498 R499	E491-L495 WeakPolarHBondContact O-CG 3.38Å; E491-L495 PolarHBondContact O-N 3.01Å; P492-L495 PolarHBondContact O-N 3.31Å; L495-L497 VanDerWaalsContact C-N 3.29Å; L495-L497 PolarHBondContact O-N 2.88Å; L495-D498 PolarHBondContact O-N 3.2Å; L495-R499 PolarHBondContact O-N 3.09Å; L495-R499 VanDerWaalsContact O-N 3.16Å
496	A	97	Very high	96.1	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-63.1	-34.4	174.5	0	0	0	0	0	112.1	H437 P492 H493 L494 D498 R499 R500	H437-A496 HydrophobicContact CB-CB 4.38Å; P492-A496 WeakPolarHBondContact O-CB 3.28Å; P492-A496 PolarHBondContact O-N 3.48Å; H493-A496 WeakPolarHBondContact O-CB 3.33Å; H493-A496 PolarHBondContact O-N 3.06Å; L494-A496 VanDerWaalsContact C-N 3.31Å; L494-A496 PolarHBondContact O-N 3.04Å; A496-D498 PolarHBondContact O-N 2.59Å; A496-R499 PolarHBondContact O-N 2.89Å; A496-R500 WeakPolarHBondContact O-CB 3.25Å; A496-R500 WeakPolarHBondContact O-CD 3.28Å; A496-R500 WeakPolarHBondContact O-CG 3.43Å; A496-R500 PolarHBondContact O-N 2.85Å
497	L	97.6	Very high	96.4	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-60	-45.4	175.5	-70.1	172.8	0	0	0	111.8	L268 L404 F434 L472 M476 H493 L494 L495 R500 L501	L268-L497 HydrophobicContact CD2-CD2 4.29Å; L404-L497 HydrophobicContact CB-CD2 4.23Å; L404-L497 WeakPolarHBondContact O-CD2 3.38Å; F434-L497 HydrophobicContact CE1-CD1 4.35Å; F434-L497 HydrophobicContact CE1-CD2 3.95Å; F434-L497 HydrophobicContact CE1-CG 4.28Å; F434-L497 HydrophobicContact CZ-CD2 4.24Å; L472-L497 HydrophobicContact CD2-CB 3.9Å; L472-L497 HydrophobicContact CG-CB 4.2Å; M476-L497 HydrophobicContact CB-CD1 4.34Å; M476-L497 HydrophobicContact CG-CD1 4Å; H493-L497 PolarHBondContact O-N 2.8Å; H493-L497 VanDerWaalsContact O-N 3.15Å; L494-L497 WeakPolarHBondContact O-CB 3.36Å; L494-L497 PolarHBondContact O-N 3Å; L495-L497 VanDerWaalsContact C-N 3.29Å; L495-L497 PolarHBondContact O-N 2.88Å; L497-R500 PolarHBondContact O-N 2.95Å; L497-L501 VanDerWaalsContact O-CB 3.31Å; L497-L501 WeakPolarHBondContact O-CB 3.47Å; L497-L501 PolarHBondContact O-N 3.11Å
498	D	97.1	Very high	96.6	Very high	26 Å²	26	33.8 Å²	33.8	14%	0.139	16%	0.16	C	C	.	.	H	α-helix	trans	-63.2	-44.3	177.3	-67.9	-24.9	0	0	0	111.1	R471 L472 S473 L495 A496 R500 L501 Q502	R471-D498 WeakPolarHBondContact CD-OD2 3.43Å; R471-D498 WeakPolarHBondContact CG-OD2 3.43Å; L472-D498 WeakPolarHBondContact CB-OD1 3.49Å; L472-D498 PolarHBondContact N-OD1 2.03Å; S473-D498 WeakPolarHBondContact CB-OD2 3.27Å; S473-D498 PolarHBondContact N-OD1 2.63Å; S473-D498 PolarHBondContact OG-OD2 3.4Å; L495-D498 PolarHBondContact O-N 3.2Å; A496-D498 PolarHBondContact O-N 2.59Å; D498-R500 VanDerWaalsContact C-N 3.35Å; D498-R500 PolarHBondContact O-N 2.76Å; D498-L501 PolarHBondContact O-N 3.26Å; D498-Q502 WeakPolarHBondContact O-CG 3.44Å; D498-Q502 PolarHBondContact O-N 2.75Å
499	R	97.6	Very high	96.7	Very high	88 Å²	88	38.5 Å²	38.5	33%	0.332	18%	0.182	S	C	.	.	H	α-helix	trans	-60.5	-44.2	177.6	-174.1	179.9	67.3	-125.6	-2.8	111.7	H437 D440 L495 A496 Q502 K503	H437-R499 PolarHBondContact O-NH2 3.42Å; D440-R499 IonicContact OD1-CZ 2.8Å; D440-R499 IonicContact OD1-NE 3.58Å; D440-R499 IonicContact OD1-NH2 3.09Å; D440-R499 PolarHBondContact OD1-NH2 2.97Å; D440-R499 IonicContact OD2-CZ 3.86Å; D440-R499 IonicContact OD2-NE 2.88Å; D440-R499 PolarHBondContact OD2-NE 2.97Å; D440-R499 IonicContact OD2-NH2 3.56Å; D440-R499 PolarHBondContact OD2-NH2 2.79Å; L495-R499 PolarHBondContact O-N 3.09Å; L495-R499 VanDerWaalsContact O-N 3.16Å; A496-R499 PolarHBondContact O-N 2.89Å; R499-Q502 PolarHBondContact O-N 3.45Å; R499-K503 PolarHBondContact O-N 3.25Å
500	R	98.1	Very high	96.8	Very high	5 Å²	5	47 Å²	47	2%	0.019	21%	0.213	C	C	.	.	H	α-helix	trans	-66.5	-43.9	177.3	-71.3	168.1	-176.1	-177.2	-0.4	111.1	F403 L404 I405 K436 H439 D440 A496 L497 D498 Q502 K503 V504	F403-R500 HydrophobicContact CD1-CB 4.2Å; F403-R500 HydrophobicContact CE1-CB 3.72Å; F403-R500 HydrophobicContact CE1-CG 4.11Å; F403-R500 WeakPolarHBondContact CE1-O 3.29Å; F403-R500 HydrophobicContact CZ-CB 4.38Å; F403-R500 HydrophobicContact CZ-CG 4.3Å; L404-R500 HydrophobicContact CD2-CB 3.93Å; L404-R500 WeakPolarHBondContact O-CD 3.26Å; L404-R500 PolarHBondContact O-NH1 2.92Å; I405-R500 VanDerWaalsContact C-NH1 3.34Å; I405-R500 PolarHBondContact O-NH1 2.92Å; K436-R500 PolarHBondContact O-NH2 3.02Å; H439-R500 PolarHBondContact O-NH2 3.24Å; D440-R500 HydrophobicContact CB-CG 4.37Å; D440-R500 VanDerWaalsContact OD1-CG 3.23Å; D440-R500 WeakPolarHBondContact OD1-CG 3.13Å; D440-R500 IonicContact OD1-CZ 2.69Å; D440-R500 IonicContact OD1-NE 3.01Å; D440-R500 PolarHBondContact OD1-NE 2.55Å; D440-R500 IonicContact OD1-NH2 3.82Å; A496-R500 WeakPolarHBondContact O-CB 3.25Å; A496-R500 WeakPolarHBondContact O-CD 3.28Å; A496-R500 WeakPolarHBondContact O-CG 3.43Å; A496-R500 PolarHBondContact O-N 2.85Å; L497-R500 PolarHBondContact O-N 2.95Å; D498-R500 VanDerWaalsContact C-N 3.35Å; D498-R500 PolarHBondContact O-N 2.76Å; R500-Q502 VanDerWaalsContact C-N 3.27Å; R500-Q502 PolarHBondContact O-N 3.44Å; R500-K503 WeakPolarHBondContact O-CA 3.29Å; R500-K503 WeakPolarHBondContact O-CB 3.39Å; R500-K503 PolarHBondContact O-N 2.82Å; R500-V504 PolarHBondContact O-N 3.25Å
501	L	97.7	Very high	96.9	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-54.7	-44.8	174.9	178.4	61.2	0	0	0	111.6	L404 L462 L465 A466 L472 L497 D498 K503 V504 L505	L404-L501 HydrophobicContact CD2-CB 4.15Å; L462-L501 HydrophobicContact CB-CD1 3.86Å; L462-L501 HydrophobicContact CD2-CD1 3.44Å; L462-L501 VanDerWaalsContact CD2-CD1 3.44Å; L462-L501 HydrophobicContact CG-CD1 4.19Å; L465-L501 HydrophobicContact CB-CD2 3.89Å; A466-L501 HydrophobicContact CB-CD2 4.07Å; L472-L501 HydrophobicContact CB-CD2 4.09Å; L472-L501 HydrophobicContact CD2-CB 4.35Å; L472-L501 HydrophobicContact CD2-CD2 4.17Å; L497-L501 VanDerWaalsContact O-CB 3.31Å; L497-L501 WeakPolarHBondContact O-CB 3.47Å; L497-L501 PolarHBondContact O-N 3.11Å; D498-L501 PolarHBondContact O-N 3.26Å; L501-K503 VanDerWaalsContact C-N 3.29Å; L501-K503 PolarHBondContact O-N 3.41Å; L501-V504 WeakPolarHBondContact O-CB 3.42Å; L501-V504 PolarHBondContact O-N 3.26Å; L501-L505 WeakPolarHBondContact O-CG 3.36Å; L501-L505 PolarHBondContact O-N 2.9Å
502	Q	97.5	Very high	96.9	Very high	81 Å²	81	43.5 Å²	43.5	38%	0.379	20%	0.198	S	C	.	.	H	α-helix	trans	-63.6	-32.5	175.3	-67.5	-62	-22.2	0	0	113.1	D498 R499 R500 R506	D498-Q502 WeakPolarHBondContact O-CG 3.44Å; D498-Q502 PolarHBondContact O-N 2.75Å; R499-Q502 PolarHBondContact O-N 3.45Å; R500-Q502 VanDerWaalsContact C-N 3.27Å; R500-Q502 PolarHBondContact O-N 3.44Å; Q502-R506 WeakPolarHBondContact O-CB 3.28Å; Q502-R506 VanDerWaalsContact O-CG 3.3Å; Q502-R506 WeakPolarHBondContact O-CG 3.37Å; Q502-R506 PolarHBondContact O-N 3.33Å; Q502-R506 VanDerWaalsContact O-N 3.11Å; Q502-R506 PolarHBondContact O-NE 3.36Å
503	K	97.8	Very high	96.9	Very high	49 Å²	49	50.7 Å²	50.7	21%	0.213	22%	0.218	C	C	.	.	H	α-helix	trans	-69.1	-42	174.3	-71.9	177.4	171.6	-177	0	111.2	F403 D440 M442 R499 R500 L501 L505 R506 V507	F403-K503 HydrophobicContact CE1-CB 4.03Å; F403-K503 HydrophobicContact CZ-CB 4.01Å; F403-K503 HydrophobicContact CZ-CD 4.13Å; D440-K503 HydrophobicContact CB-CD 4.21Å; D440-K503 VanDerWaalsContact CB-NZ 3.34Å; D440-K503 WeakPolarHBondContact OD2-CE 3.48Å; D440-K503 IonicContact OD2-NZ 3.43Å; D440-K503 PolarHBondContact OD2-NZ 3.37Å; M442-K503 HydrophobicContact SD-CB 4.47Å; M442-K503 HydrophobicContact SD-CD 3.94Å; R499-K503 PolarHBondContact O-N 3.25Å; R500-K503 WeakPolarHBondContact O-CA 3.29Å; R500-K503 WeakPolarHBondContact O-CB 3.39Å; R500-K503 PolarHBondContact O-N 2.82Å; L501-K503 VanDerWaalsContact C-N 3.29Å; L501-K503 PolarHBondContact O-N 3.41Å; K503-L505 PolarHBondContact O-N 3.35Å; K503-R506 PolarHBondContact O-N 3.04Å; K503-V507 WeakPolarHBondContact O-CG2 3.48Å; K503-V507 PolarHBondContact O-N 3.41Å
504	V	97.8	Very high	96.8	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-57.5	-50.9	174.6	177.6	0	0	0	0	110.5	I400 F403 L445 L448 L462 R500 L501 R506 V507 V508	I400-V504 HydrophobicContact CD1-CG1 4.28Å; I400-V504 HydrophobicContact CG1-CG1 4.07Å; I400-V504 HydrophobicContact CG2-CG1 4.1Å; I400-V504 HydrophobicContact CG2-CG2 4.41Å; F403-V504 HydrophobicContact CD1-CG2 3.5Å; F403-V504 VanDerWaalsContact CD1-CG2 3.5Å; F403-V504 HydrophobicContact CE1-CG2 3.8Å; L445-V504 HydrophobicContact CD1-CG2 4.09Å; L445-V504 HydrophobicContact CD2-CG2 4.17Å; L448-V504 HydrophobicContact CD2-CG1 4.05Å; L462-V504 HydrophobicContact CD1-CG1 4Å; R500-V504 PolarHBondContact O-N 3.25Å; L501-V504 WeakPolarHBondContact O-CB 3.42Å; L501-V504 PolarHBondContact O-N 3.26Å; V504-R506 VanDerWaalsContact C-N 3.3Å; V504-R506 PolarHBondContact O-N 3.44Å; V504-V507 PolarHBondContact O-N 2.93Å; V504-V507 VanDerWaalsContact O-N 3.1Å; V504-V508 WeakPolarHBondContact O-CG2 3.36Å; V504-V508 PolarHBondContact O-N 3.17Å
505	L	97.3	Very high	96.6	Very high	16 Å²	16	62 Å²	62	8%	0.084	27%	0.266	C	S	.	.	H	α-helix	trans	-60.3	-39	179.2	-67.7	176.8	0	0	0	112.3	L459 L462 Q463 A466 L501 K503 V508 Q509	L459-L505 HydrophobicContact CD1-CD2 3.95Å; L462-L505 HydrophobicContact CB-CD2 3.97Å; Q463-L505 HydrophobicContact CG-CD2 3.89Å; A466-L505 HydrophobicContact CB-CD1 3.68Å; L501-L505 WeakPolarHBondContact O-CG 3.36Å; L501-L505 PolarHBondContact O-N 2.9Å; K503-L505 PolarHBondContact O-N 3.35Å; L505-V508 PolarHBondContact O-N 3.02Å; L505-Q509 VanDerWaalsContact O-CG 3.29Å; L505-Q509 WeakPolarHBondContact O-CG 3.4Å; L505-Q509 PolarHBondContact O-N 2.77Å
506	R	97.3	Very high	96.4	Very high	129 Å²	129	58.9 Å²	58.9	49%	0.487	26%	0.258	S	S	.	.	H	α-helix	trans	-63.7	-38.5	174.7	-79.9	178.5	-82.8	165.6	-13.9	112.9	Q502 K503 V504 Q509 R510	Q502-R506 WeakPolarHBondContact O-CB 3.28Å; Q502-R506 VanDerWaalsContact O-CG 3.3Å; Q502-R506 WeakPolarHBondContact O-CG 3.37Å; Q502-R506 PolarHBondContact O-N 3.33Å; Q502-R506 VanDerWaalsContact O-N 3.11Å; Q502-R506 PolarHBondContact O-NE 3.36Å; K503-R506 PolarHBondContact O-N 3.04Å; V504-R506 VanDerWaalsContact C-N 3.3Å; V504-R506 PolarHBondContact O-N 3.44Å; R506-Q509 PolarHBondContact O-N 3.44Å; R506-R510 PolarHBondContact O-N 3.34Å
507	V	96.7	Very high	96.1	Very high	15 Å²	15	64.1 Å²	64.1	9%	0.091	28%	0.283	C	S	.	.	H	α-helix	trans	-64.4	-45.2	174.6	173.5	0	0	0	0	110.4	M442 L445 L448 K503 V504 Q509 R510 C511	M442-V507 HydrophobicContact CE-CG2 4.07Å; L445-V507 HydrophobicContact CD1-CG2 4.15Å; L448-V507 HydrophobicContact CD2-CB 4.25Å; L448-V507 HydrophobicContact CD2-CG1 3.89Å; L448-V507 HydrophobicContact CG-CG1 3.93Å; K503-V507 WeakPolarHBondContact O-CG2 3.48Å; K503-V507 PolarHBondContact O-N 3.41Å; V504-V507 PolarHBondContact O-N 2.93Å; V504-V507 VanDerWaalsContact O-N 3.1Å; V507-Q509 PolarHBondContact O-N 3.27Å; V507-R510 WeakPolarHBondContact O-CB 3.36Å; V507-R510 PolarHBondContact O-N 2.96Å; V507-C511 PolarHBondContact O-N 2.89Å
508	V	96.6	Very high	95.7	Very high	5 Å²	5	71 Å²	71	3%	0.03	32%	0.32	C	S	.	.	H	α-helix	trans	-60.4	-45.3	176	178.7	0	0	0	0	111.2	L448 I454 L459 V504 L505 R510 C511 V512	L448-V508 HydrophobicContact CD1-CG2 4.27Å; L448-V508 HydrophobicContact CD2-CG2 4.07Å; I454-V508 HydrophobicContact CD1-CG2 3.87Å; I454-V508 HydrophobicContact CG2-CG1 4.21Å; L459-V508 HydrophobicContact CD1-CB 4.41Å; L459-V508 HydrophobicContact CD1-CG1 3.89Å; L459-V508 HydrophobicContact CD1-CG2 4.4Å; L459-V508 HydrophobicContact CD2-CG1 4.13Å; V504-V508 WeakPolarHBondContact O-CG2 3.36Å; V504-V508 PolarHBondContact O-N 3.17Å; L505-V508 PolarHBondContact O-N 3.02Å; V508-R510 VanDerWaalsContact C-N 3.28Å; V508-R510 PolarHBondContact O-N 3.22Å; V508-C511 WeakPolarHBondContact O-CB 3.45Å; V508-C511 PolarHBondContact O-N 3.32Å; V508-C511 VanDerWaalsContact O-N 3.13Å; V508-V512 HydrophobicContact CG1-CG2 4.26Å; V508-V512 WeakPolarHBondContact O-CG2 3.36Å; V508-V512 PolarHBondContact O-N 3.05Å
509	Q	96.3	Very high	95.3	Very high	103 Å²	103	76.5 Å²	76.5	48%	0.481	34%	0.344	S	S	.	.	H	α-helix	trans	-58.4	-40.4	176.5	-74.4	171.2	-2.2	0	0	112.1	L505 R506 V507 V512 R513	L505-Q509 VanDerWaalsContact O-CG 3.29Å; L505-Q509 WeakPolarHBondContact O-CG 3.4Å; L505-Q509 PolarHBondContact O-N 2.77Å; R506-Q509 PolarHBondContact O-N 3.44Å; V507-Q509 PolarHBondContact O-N 3.27Å; Q509-V512 PolarHBondContact O-N 3.42Å; Q509-R513 WeakPolarHBondContact O-CG 3.44Å; Q509-R513 PolarHBondContact O-N 3.29Å
510	R	96.1	Very high	95.1	Very high	190 Å²	190	72.4 Å²	72.4	72%	0.717	33%	0.329	S	S	*	.	H	α-helix	trans	-63.6	-43.3	175.5	-171.6	-177.2	-64.1	175.7	-1.9	111.6	R506 V507 V508 R513 R514	R506-R510 PolarHBondContact O-N 3.34Å; V507-R510 WeakPolarHBondContact O-CB 3.36Å; V507-R510 PolarHBondContact O-N 2.96Å; V508-R510 VanDerWaalsContact C-N 3.28Å; V508-R510 PolarHBondContact O-N 3.22Å; R510-R513 PolarHBondContact O-N 2.83Å; R510-R514 WeakPolarHBondContact O-CB 3.44Å; R510-R514 PolarHBondContact O-N 2.97Å; R510-R514 VanDerWaalsContact O-N 3.17Å
511	C	95.4	Very high	94.8	Very high	5 Å²	5	73.1 Å²	73.1	3%	0.034	33%	0.333	C	S	.	.	H	α-helix	trans	-60.6	-47.1	174.6	-75.1	0	0	0	0	111.9	C452 V507 V508 R513 R514 L515 V520	C452-C511 WeakPolarHBondContact CA-SG 3.18Å; C452-C511 HydrophobicContact CB-CB 3.55Å; C452-C511 WeakPolarHBondContact CB-SG 3.39Å; C452-C511 WeakPolarHBondContact SG-CB 3.19Å; C452-C511 CovalentContact SG-SG 2.05Å; C452-C511 PolarHBondContact SG-SG 2.85Å; V507-C511 PolarHBondContact O-N 2.89Å; V508-C511 WeakPolarHBondContact O-CB 3.45Å; V508-C511 PolarHBondContact O-N 3.32Å; V508-C511 VanDerWaalsContact O-N 3.13Å; C511-R513 PolarHBondContact O-N 3.45Å; C511-R514 PolarHBondContact O-N 2.87Å; C511-R514 VanDerWaalsContact O-N 3.09Å; C511-L515 PolarHBondContact O-N 2.64Å; C511-V520 HydrophobicContact CB-CG1 4.02Å; C511-V520 HydrophobicContact CB-CG2 4.07Å
512	V	95.7	Very high	94.4	Very high	39 Å²	39	75.6 Å²	75.6	24%	0.236	35%	0.348	C	S	.	.	H	α-helix	trans	-62.1	-41.2	179.4	171.8	0	0	0	0	111.6	V508 Q509 R514 G516 Q517 V520	V508-V512 HydrophobicContact CG1-CG2 4.26Å; V508-V512 WeakPolarHBondContact O-CG2 3.36Å; V508-V512 PolarHBondContact O-N 3.05Å; Q509-V512 PolarHBondContact O-N 3.42Å; V512-R514 VanDerWaalsContact C-N 3.25Å; V512-R514 PolarHBondContact O-N 2.76Å; V512-G516 VanDerWaalsContact O-CA 3.24Å; V512-G516 WeakPolarHBondContact O-CA 3.34Å; V512-G516 PolarHBondContact O-N 2.87Å; V512-Q517 HydrophobicContact CG1-CB 4.19Å; V512-V520 HydrophobicContact CG2-CB 4.05Å; V512-V520 HydrophobicContact CG2-CG1 3.88Å; V512-V520 HydrophobicContact CG2-CG2 4.4Å
513	R	95.5	Very high	93.9	Very high	204 Å²	204	79.4 Å²	79.4	77%	0.77	36%	0.363	S	S	*	.	H	α-helix	trans	-63.9	-30	175.3	-72.7	177	-170.8	174.7	3.3	113	Q509 R510 C511	Q509-R513 WeakPolarHBondContact O-CG 3.44Å; Q509-R513 PolarHBondContact O-N 3.29Å; R510-R513 PolarHBondContact O-N 2.83Å; C511-R513 PolarHBondContact O-N 3.45Å
514	R	94.2	Very high	93	Very high	162 Å²	162	80 Å²	80	61%	0.611	37%	0.369	S	S	*	.	H	α-helix	trans	-85.1	-42.7	-177	-174.3	174.2	68.2	177.9	1.6	113.3	C452 R510 C511 V512	C452-R514 PolarHBondContact SG-NH2 2.96Å; R510-R514 WeakPolarHBondContact O-CB 3.44Å; R510-R514 PolarHBondContact O-N 2.97Å; R510-R514 VanDerWaalsContact O-N 3.17Å; C511-R514 PolarHBondContact O-N 2.87Å; C511-R514 VanDerWaalsContact O-N 3.09Å; V512-R514 VanDerWaalsContact C-N 3.25Å; V512-R514 PolarHBondContact O-N 2.76Å
515	L	92.5	Very high	91.7	Very high	85 Å²	85	82.2 Å²	82.2	45%	0.445	38%	0.379	S	S	.	.	H	α-helix	trans	-114.8	-7.6	-169.8	-61	177	0	0	0	113.9	C452 C511 Q519 V520	C452-L515 HydrophobicContact CB-CD1 3.59Å; C511-L515 PolarHBondContact O-N 2.64Å; L515-Q519 HydrophobicContact CB-CB 4.38Å; L515-V520 HydrophobicContact CB-CG2 3.99Å
516	G	92.5	Very high	89.6	Confident	34 Å²	34	87.7 Å²	87.7	35%	0.351	41%	0.413	S	S	.	.			trans	86.4	160.7	-173	0	0	0	0	0	113.1	V512 V520	V512-G516 VanDerWaalsContact O-CA 3.24Å; V512-G516 WeakPolarHBondContact O-CA 3.34Å; V512-G516 PolarHBondContact O-N 2.87Å; G516-V520 VanDerWaalsContact O-CG2 3.3Å; G516-V520 WeakPolarHBondContact O-CG2 3.27Å
517	Q	91.3	Very high	87.2	Confident	109 Å²	109	89.9 Å²	89.9	51%	0.509	43%	0.426	S	S	.	.	H	α-helix	trans	-69	-40.3	-173.5	-170.8	173.3	-14.7	0	0	112.9	V512 Q519 V520 I521	V512-Q517 HydrophobicContact CG1-CB 4.19Å; Q517-Q519 VanDerWaalsContact C-N 3.33Å; Q517-Q519 PolarHBondContact O-N 2.88Å; Q517-V520 PolarHBondContact O-N 3.47Å; Q517-I521 HydrophobicContact CG-CD1 3.51Å; Q517-I521 HydrophobicContact CG-CG1 4.22Å; Q517-I521 WeakPolarHBondContact O-CB 3.19Å; Q517-I521 PolarHBondContact O-N 2.98Å
518	D	89.4	Confident	84.3	Confident	146 Å²	146	95.1 Å²	95.1	78%	0.781	46%	0.46	S	S	*	.	H	α-helix	trans	-71.5	-27.8	-173.7	-63.2	-41.1	0	0	0	113.2
519	Q	88.9	Confident	81.2	Confident	141 Å²	141	99.9 Å²	99.9	66%	0.659	49%	0.494	S	S	*	.	H	α-helix	trans	-79.9	-29.8	176.5	-65.9	-65.4	-7.9	0	0	112.5	L515 Q517	L515-Q519 HydrophobicContact CB-CB 4.38Å; Q517-Q519 VanDerWaalsContact C-N 3.33Å; Q517-Q519 PolarHBondContact O-N 2.88Å
520	V	91.6	Very high	78.4	Confident	1 Å²	1	103.9 Å²	103.9	1%	0.006	51%	0.512	C	S	.	.	H	α-helix	trans	-89.5	-37.7	-176.2	176.5	0	0	0	0	111.7	C452 M453 I454 C511 V512 L515 G516 Q517	C452-V520 WeakPolarHBondContact O-CA 3.36Å; C452-V520 WeakPolarHBondContact O-CG1 3.45Å; C452-V520 WeakPolarHBondContact O-CG2 3.23Å; M453-V520 CarbonylContact C-O 3.39Å; M453-V520 VanDerWaalsContact CA-O 3.31Å; M453-V520 WeakPolarHBondContact CA-O 3.2Å; I454-V520 HydrophobicContact CG2-CG1 4.36Å; I454-V520 PolarHBondContact N-O 2.95Å; C511-V520 HydrophobicContact CB-CG1 4.02Å; C511-V520 HydrophobicContact CB-CG2 4.07Å; V512-V520 HydrophobicContact CG2-CB 4.05Å; V512-V520 HydrophobicContact CG2-CG1 3.88Å; V512-V520 HydrophobicContact CG2-CG2 4.4Å; L515-V520 HydrophobicContact CB-CG2 3.99Å; G516-V520 VanDerWaalsContact O-CG2 3.3Å; G516-V520 WeakPolarHBondContact O-CG2 3.27Å; Q517-V520 PolarHBondContact O-N 3.47Å
521	I	92.9	Very high	75.3	Confident	20 Å²	20	100.3 Å²	100.3	10%	0.103	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	102.8	-172.8	-54.9	178.8	0	0	0	110.2	I454 R456 L459 Q517	I454-I521 HydrophobicContact CG2-CG1 4.42Å; I454-I521 WeakPolarHBondContact O-CA 3.28Å; R456-I521 HydrophobicContact CB-CG2 3.72Å; R456-I521 HydrophobicContact CG-CG2 3.96Å; L459-I521 HydrophobicContact CD2-CD1 3.52Å; L459-I521 HydrophobicContact CD2-CG1 3.95Å; Q517-I521 HydrophobicContact CG-CD1 3.51Å; Q517-I521 HydrophobicContact CG-CG1 4.22Å; Q517-I521 WeakPolarHBondContact O-CB 3.19Å; Q517-I521 PolarHBondContact O-N 2.98Å
522	T	89.6	Confident	72.3	Confident	53 Å²	53	105.8 Å²	105.8	33%	0.325	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	127.7	174.7	-45.9	0	0	0	0	110.5	L393 I454 R456 D524	L393-T522 HydrophobicContact CD1-CG2 3.87Å; I454-T522 PolarHBondContact O-N 3.45Å; R456-T522 WeakPolarHBondContact CB-O 3.49Å; R456-T522 PolarHBondContact N-O 3.35Å; T522-D524 PolarHBondContact O-N 2.88Å
523	K	85.7	Confident	69.3	Low	161 Å²	161	113 Å²	113	70%	0.7	58%	0.578	S	S	*	*			trans	-76.1	120.2	175.9	-66.2	177.5	-175.7	170.5	0	109.7
524	D	80.4	Confident	66.3	Low	62 Å²	62	114.5 Å²	114.5	33%	0.332	58%	0.584	S	S	.	*			trans	-118	-5.4	-175	62.7	-46.3	0	0	0	114.1	K455 R456 S457 T522	K455-D524 HydrophobicContact CB-CB 4.47Å; K455-D524 HydrophobicContact CD-CB 4.46Å; K455-D524 HydrophobicContact CG-CB 4.38Å; R456-D524 PolarHBondContact N-OD1 2.7Å; S457-D524 WeakPolarHBondContact CB-OD2 3.5Å; S457-D524 PolarHBondContact N-OD1 3.36Å; S457-D524 PolarHBondContact OG-OD2 2.88Å; T522-D524 PolarHBondContact O-N 2.88Å
525	F	69.4	Low	63.3	Low	47 Å²	47	111.2 Å²	111.2	21%	0.206	59%	0.592	C	S	.	*			trans	-142.4	144.8	173.2	64.7	-81.7	0	0	0	111.2	I98 R456 L460	I98-F525 HydrophobicContact CD1-CD1 4.4Å; I98-F525 HydrophobicContact CD1-CD2 3.84Å; I98-F525 HydrophobicContact CD1-CE1 4.39Å; I98-F525 HydrophobicContact CD1-CE2 3.81Å; I98-F525 HydrophobicContact CD1-CG 4.14Å; I98-F525 HydrophobicContact CD1-CZ 4.09Å; I98-F525 HydrophobicContact CG2-CB 4.16Å; I98-F525 HydrophobicContact CG2-CD2 4.35Å; I98-F525 HydrophobicContact CG2-CG 4.41Å; R456-F525 HydrophobicContact CB-CE1 4.28Å; R456-F525 HydrophobicContact CG-CE1 4.26Å; L460-F525 HydrophobicContact CD1-CE1 4.27Å; L460-F525 HydrophobicContact CD1-CZ 3.78Å
526	T	52.7	Low	60.4	Low	130 Å²	130	113.5 Å²	113.5	80%	0.798	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-89.6	130.2	167.5	40.9	0	0	0	0	108.6
527	K	47	Very low	57.7	Low	176 Å²	176	120.8 Å²	120.8	77%	0.765	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-61.5	134.4	165.1	-76	-176.1	175.6	-174.5	0	107.1	S529	K527-S529 PolarHBondContact O-N 3.5Å
528	P	37	Very low	54.8	Low	125 Å²	125	127.2 Å²	127.2	81%	0.812	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-58	117.1	167.1	23.3	-29.6	0	0	0	107.1	E530	P528-E530 PolarHBondContact O-N 2.96Å
529	S	31.7	Very low	52.2	Low	104 Å²	104	128.4 Å²	128.4	73%	0.727	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-60.7	128.6	172.6	53.5	0	0	0	0	108	K527 T531	K527-S529 PolarHBondContact O-N 3.5Å; S529-T531 PolarHBondContact O-N 2.9Å
530	E	37.4	Very low	49.8	Very low	187 Å²	187	129.7 Å²	129.7	87%	0.874	67%	0.666	S	S	*	*	S	Bend	trans	-54	111.7	162.8	-74.5	176.1	160.5	0	0	107.9	P528	P528-E530 PolarHBondContact O-N 2.96Å
531	T	30.3	Very low	47.3	Very low	116 Å²	116	136.6 Å²	136.6	71%	0.712	70%	0.703	S	S	*	*			trans	48.2	121.6	164.6	14	0	0	0	0	118.3	S529 Q533	S529-T531 PolarHBondContact O-N 2.9Å; T531-Q533 PolarHBondContact O-N 2.94Å; T531-Q533 VanDerWaalsContact O-N 3.1Å
532	P	32	Very low	44.6	Very low	119 Å²	119	150.6 Å²	150.6	77%	0.773	75%	0.754	S	S	*	*			trans	-63.8	116.8	158	2.8	11.4	0	0	0	107.4	R534	P532-R534 PolarHBondContact O-N 3.47Å
533	Q	33.1	Very low	42.3	Very low	190 Å²	190	155.5 Å²	155.5	89%	0.888	78%	0.776	S	S	*	*			trans	-50.9	119.3	165.9	-75.4	177.6	-17.6	0	0	107.7	T531 A535	T531-Q533 PolarHBondContact O-N 2.94Å; T531-Q533 VanDerWaalsContact O-N 3.1Å; Q533-A535 PolarHBondContact O-N 3.1Å
534	R	31.9	Very low	40	Very low	237 Å²	237	155.2 Å²	155.2	89%	0.894	78%	0.78	S	S	*	*			trans	-53.4	105.3	166.7	-94.4	179.5	171.3	177.7	-3.3	107.1	P532 T536	P532-R534 PolarHBondContact O-N 3.47Å; R534-T536 VanDerWaalsContact C-N 3.28Å; R534-T536 PolarHBondContact O-N 3.36Å
535	A	31.8	Very low	37.8	Very low	93 Å²	93	160.3 Å²	160.3	77%	0.769	81%	0.805	S	S	*	*			trans	-66.1	96.4	160	0	0	0	0	0	106.7	Q533 Q537	Q533-A535 PolarHBondContact O-N 3.1Å; A535-Q537 PolarHBondContact O-N 3.43Å
536	T	32.7	Very low	35.9	Very low	133 Å²	133	167 Å²	167	82%	0.816	84%	0.84	S	S	*	*			trans	-56.5	105.9	162	31.8	0	0	0	0	107.9	R534 R538	R534-T536 VanDerWaalsContact C-N 3.28Å; R534-T536 PolarHBondContact O-N 3.36Å; T536-R538 PolarHBondContact O-N 3.4Å
537	Q	33.9	Very low	34.9	Very low	186 Å²	186	169.3 Å²	169.3	87%	0.869	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-61.5	119.6	162.6	-76	179.4	-19.4	0	0	107.3	A535 E539	A535-Q537 PolarHBondContact O-N 3.43Å; Q537-E539 PolarHBondContact O-N 3.28Å
538	R	31.4	Very low	34.1	Very low	244 Å²	244	168.9 Å²	168.9	92%	0.921	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-66.2	123.6	162.6	-82.4	179.1	171	178.3	-3.8	107.3	T536 D540	T536-R538 PolarHBondContact O-N 3.4Å; R538-D540 PolarHBondContact O-N 3.2Å
539	E	34.6	Very low	33.9	Very low	171 Å²	171	172 Å²	172	80%	0.799	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-59.8	118.7	164.7	-70.5	172	145	0	0	108.8	Q537	Q537-E539 PolarHBondContact O-N 3.28Å
540	D	38.7	Very low	34	Very low	169 Å²	169	177.2 Å²	177.2	90%	0.904	86%	0.86	S	S	*	*			trans	-78.7	107.9	152.5	-95.7	-23	0	0	0	106.6	R538	R538-D540 PolarHBondContact O-N 3.2Å
541	N	39.4	Very low	33.7	Very low	145 Å²	145	176.4 Å²	176.4	78%	0.775	86%	0.859	S	S	*	*			trans	-107.6	133.7	163.9	-101.9	-20.6	0	0	0	109.7
542	R	35	Very low	34.1	Very low	314 Å²	314	181.9 Å²	181.9	100%	1.185	87%	0.872	S	S	*	*			trans	-70.2	0	174.7	-149.8	-179.1	-158.9	178.2	4.2	111.9

Retrieved 542 of 542 residues in 323.9 ms (Link to these results)

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