A0A093HXJ9_STRCA Loading...

Hexosyltransferase

AlphaFold DB , UniProt , Accession A0A093HXJ9, Species STRCA (Struthio camelus australis), Gene n/a, Length 397 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	51.6	Low	60	Low	248 Å²	248	145.7 Å²	145.7	100%	1.222	71%	0.714	S	S	*	*				0	58.7	0	-69.4	164.5	59.2	0	0	113.1
2	S	56.8	Low	61	Low	90 Å²	90	136.5 Å²	136.5	63%	0.629	68%	0.684	S	S	*	*			trans	-131.2	-19.4	-174.8	-176	0	0	0	0	115.4
3	V	53.9	Low	62.1	Low	104 Å²	104	134.2 Å²	134.2	63%	0.63	67%	0.674	S	S	*	*	H	α-helix	trans	-86.2	-34.5	-172.7	-174.6	0	0	0	0	113.1	R5 R6 R7	V3-R5 PolarHBondContact O-N 3.5Å; V3-R6 PolarHBondContact O-N 3.47Å; V3-R7 PolarHBondContact O-N 3.34Å
4	G	54.8	Low	62.7	Low	57 Å²	57	132 Å²	132	59%	0.588	66%	0.664	S	S	*	*	H	α-helix	trans	-67.2	-35.7	-179.3	0	0	0	0	0	114.1	R7 L8	G4-R7 PolarHBondContact O-N 3.22Å; G4-L8 PolarHBondContact O-N 3.08Å; G4-L8 VanDerWaalsContact O-N 3.08Å
5	R	57	Low	63.4	Low	202 Å²	202	131.1 Å²	131.1	76%	0.762	66%	0.659	S	S	*	*	H	α-helix	trans	-72.7	-29.6	-178.3	-143.7	176	-167.4	178.7	3.8	112.7	V3 K9	V3-R5 PolarHBondContact O-N 3.5Å; R5-K9 WeakPolarHBondContact O-CG 3.22Å; R5-K9 PolarHBondContact O-N 3.45Å
6	R	57.5	Low	64.1	Low	200 Å²	200	131.1 Å²	131.1	76%	0.755	66%	0.658	S	S	*	*	H	α-helix	trans	-73.2	-42	173.4	-96.1	-176.7	176.5	178.7	-0.2	112.1	V3 K9 L10	V3-R6 PolarHBondContact O-N 3.47Å; R6-K9 PolarHBondContact O-N 2.92Å; R6-L10 PolarHBondContact O-N 3.37Å
7	R	60	Low	64.9	Low	191 Å²	191	127.8 Å²	127.8	72%	0.721	65%	0.646	S	S	*	*	H	α-helix	trans	-65.3	-39.7	176.6	-73.9	-171.3	176.7	-173.2	-0.4	112.3	V3 G4 L10 L11	V3-R7 PolarHBondContact O-N 3.34Å; G4-R7 PolarHBondContact O-N 3.22Å; R7-L10 PolarHBondContact O-N 2.96Å; R7-L11 WeakPolarHBondContact O-CB 3.47Å; R7-L11 PolarHBondContact O-N 3.35Å
8	L	62.5	Low	65.1	Low	133 Å²	133	125.9 Å²	125.9	70%	0.696	64%	0.638	S	S	*	*	H	α-helix	trans	-67	-37.6	176.5	-150.7	76.7	0	0	0	112.3	G4 G12	G4-L8 PolarHBondContact O-N 3.08Å; G4-L8 VanDerWaalsContact O-N 3.08Å; L8-G12 PolarHBondContact O-N 3.28Å
9	K	66.1	Low	65.6	Low	147 Å²	147	123.9 Å²	123.9	64%	0.639	63%	0.628	S	S	*	*	H	α-helix	trans	-65.8	-40.4	171.8	-77.9	-175.7	176.7	-168.4	0	112.2	R5 R6 G12 I13	R5-K9 WeakPolarHBondContact O-CG 3.22Å; R5-K9 PolarHBondContact O-N 3.45Å; R6-K9 PolarHBondContact O-N 2.92Å; K9-G12 PolarHBondContact O-N 2.94Å; K9-I13 WeakPolarHBondContact O-CD1 3.35Å; K9-I13 VanDerWaalsContact O-CG1 3.22Å; K9-I13 WeakPolarHBondContact O-CG1 3.44Å; K9-I13 PolarHBondContact O-N 3.42Å
10	L	69.8	Low	66.1	Low	116 Å²	116	124.8 Å²	124.8	61%	0.607	63%	0.628	S	S	*	*	H	α-helix	trans	-65.4	-41.6	177.1	-138.2	89.8	0	0	0	111.5	R6 R7 I13 L14	R6-L10 PolarHBondContact O-N 3.37Å; R7-L10 PolarHBondContact O-N 2.96Å; L10-I13 PolarHBondContact O-N 2.91Å; L10-L14 WeakPolarHBondContact O-CB 3.49Å; L10-L14 PolarHBondContact O-N 2.92Å
11	L	70.5	Confident	66.4	Low	115 Å²	115	123 Å²	123	60%	0.602	62%	0.619	S	S	*	*	H	α-helix	trans	-65.3	-41	176.7	-148.3	89.4	0	0	0	111.5	R7 L14 M15	R7-L11 WeakPolarHBondContact O-CB 3.47Å; R7-L11 PolarHBondContact O-N 3.35Å; L11-L14 PolarHBondContact O-N 2.87Å; L11-M15 PolarHBondContact O-N 2.96Å
12	G	71.9	Confident	67.3	Low	35 Å²	35	118.1 Å²	118.1	36%	0.361	59%	0.588	S	S	.	*	H	α-helix	trans	-63.5	-41.1	174.2	0	0	0	0	0	112.7	L8 K9 M15 M16	L8-G12 PolarHBondContact O-N 3.28Å; K9-G12 PolarHBondContact O-N 2.94Å; G12-M15 PolarHBondContact O-N 2.86Å; G12-M16 WeakPolarHBondContact O-CB 3.27Å; G12-M16 VanDerWaalsContact O-CG 3.22Å; G12-M16 WeakPolarHBondContact O-CG 3.25Å; G12-M16 PolarHBondContact O-N 3.49Å
13	I	74.6	Confident	68	Low	107 Å²	107	117.2 Å²	117.2	55%	0.549	58%	0.579	S	S	.	*	H	α-helix	trans	-64.7	-43.3	174.4	-68.5	163.9	0	0	0	110.5	K9 L10 M16 V17	K9-I13 WeakPolarHBondContact O-CD1 3.35Å; K9-I13 VanDerWaalsContact O-CG1 3.22Å; K9-I13 WeakPolarHBondContact O-CG1 3.44Å; K9-I13 PolarHBondContact O-N 3.42Å; L10-I13 PolarHBondContact O-N 2.91Å; I13-M16 PolarHBondContact O-N 2.9Å; I13-V17 HydrophobicContact CG2-CG2 4.35Å; I13-V17 WeakPolarHBondContact O-CB 3.45Å; I13-V17 VanDerWaalsContact O-CG2 3.27Å; I13-V17 WeakPolarHBondContact O-CG2 3.22Å; I13-V17 PolarHBondContact O-N 3.33Å
14	L	70.8	Confident	68.8	Low	103 Å²	103	116.3 Å²	116.3	54%	0.539	57%	0.57	S	S	.	*	H	α-helix	trans	-65.5	-39.2	178.7	-120.9	122.1	0	0	0	112.6	L10 L11 V17 N18	L10-L14 WeakPolarHBondContact O-CB 3.49Å; L10-L14 PolarHBondContact O-N 2.92Å; L11-L14 PolarHBondContact O-N 2.87Å; L14-V17 PolarHBondContact O-N 3.27Å; L14-N18 WeakPolarHBondContact O-CB 3.45Å; L14-N18 PolarHBondContact O-N 3.46Å; L14-N18 PolarHBondContact O-ND2 3.27Å; L14-N18 VanDerWaalsContact O-ND2 3.09Å
15	M	72.5	Confident	69.3	Low	119 Å²	119	116.9 Å²	116.9	59%	0.586	56%	0.562	S	S	*	*	H	α-helix	trans	-64.7	-43.6	172.7	-87.4	-171.7	72.9	0	0	111.5	L11 G12 V17 N18 I19	L11-M15 PolarHBondContact O-N 2.96Å; G12-M15 PolarHBondContact O-N 2.86Å; M15-V17 VanDerWaalsContact C-N 3.33Å; M15-V17 PolarHBondContact O-N 2.96Å; M15-N18 PolarHBondContact O-N 3.5Å; M15-I19 WeakPolarHBondContact O-CB 3.24Å; M15-I19 VanDerWaalsContact O-CG1 3.25Å; M15-I19 WeakPolarHBondContact O-CG1 3.24Å; M15-I19 PolarHBondContact O-N 3.09Å
16	M	75.4	Confident	69.6	Low	131 Å²	131	111 Å²	111	65%	0.645	54%	0.543	S	S	*	.	H	α-helix	trans	-65	-37.8	178	-71.2	-66.2	-84.1	0	0	111.9	G12 I13 I19 F20	G12-M16 WeakPolarHBondContact O-CB 3.27Å; G12-M16 VanDerWaalsContact O-CG 3.22Å; G12-M16 WeakPolarHBondContact O-CG 3.25Å; G12-M16 PolarHBondContact O-N 3.49Å; I13-M16 PolarHBondContact O-N 2.9Å; M16-I19 PolarHBondContact O-N 3.46Å; M16-F20 VanDerWaalsContact O-CB 3.28Å; M16-F20 WeakPolarHBondContact O-CB 3.5Å; M16-F20 PolarHBondContact O-N 2.85Å
17	V	77.3	Confident	70	Confident	75 Å²	75	105.7 Å²	105.7	46%	0.455	53%	0.532	S	S	.	.	H	α-helix	trans	-65.4	-43.5	173.7	170.9	0	0	0	0	111	I13 L14 M15 F20 I21	I13-V17 HydrophobicContact CG2-CG2 4.35Å; I13-V17 WeakPolarHBondContact O-CB 3.45Å; I13-V17 VanDerWaalsContact O-CG2 3.27Å; I13-V17 WeakPolarHBondContact O-CG2 3.22Å; I13-V17 PolarHBondContact O-N 3.33Å; L14-V17 PolarHBondContact O-N 3.27Å; M15-V17 VanDerWaalsContact C-N 3.33Å; M15-V17 PolarHBondContact O-N 2.96Å; V17-F20 PolarHBondContact O-N 2.82Å; V17-I21 HydrophobicContact CG1-CD1 3.74Å; V17-I21 HydrophobicContact CG1-CG1 4.36Å; V17-I21 WeakPolarHBondContact O-CB 3.46Å; V17-I21 VanDerWaalsContact O-CG1 3.24Å; V17-I21 WeakPolarHBondContact O-CG1 3.28Å; V17-I21 PolarHBondContact O-N 3.25Å
18	N	68.5	Low	69.9	Low	94 Å²	94	100 Å²	100	50%	0.503	52%	0.521	S	S	.	.	H	α-helix	trans	-66.2	-37.9	176.7	-80.9	-46.7	0	0	0	112.7	L14 M15 I21 Y22	L14-N18 WeakPolarHBondContact O-CB 3.45Å; L14-N18 PolarHBondContact O-N 3.46Å; L14-N18 PolarHBondContact O-ND2 3.27Å; L14-N18 VanDerWaalsContact O-ND2 3.09Å; M15-N18 PolarHBondContact O-N 3.5Å; N18-I21 PolarHBondContact O-N 2.83Å; N18-Y22 VanDerWaalsContact O-CB 3.29Å; N18-Y22 WeakPolarHBondContact O-CB 3.29Å; N18-Y22 PolarHBondContact O-N 3.47Å
19	I	74.8	Confident	69.2	Low	87 Å²	87	98.9 Å²	98.9	45%	0.446	51%	0.511	S	S	.	.	H	α-helix	trans	-65.2	-42	173.1	-69.4	165.8	0	0	0	110	M15 M16 Y22 V23	M15-I19 WeakPolarHBondContact O-CB 3.24Å; M15-I19 VanDerWaalsContact O-CG1 3.25Å; M15-I19 WeakPolarHBondContact O-CG1 3.24Å; M15-I19 PolarHBondContact O-N 3.09Å; M16-I19 PolarHBondContact O-N 3.46Å; I19-Y22 PolarHBondContact O-N 2.83Å; I19-V23 HydrophobicContact CG2-CG2 4.34Å; I19-V23 WeakPolarHBondContact O-CB 3.46Å; I19-V23 VanDerWaalsContact O-CG2 3.24Å; I19-V23 WeakPolarHBondContact O-CG2 3.12Å; I19-V23 PolarHBondContact O-N 3.43Å
20	F	74.9	Confident	68.3	Low	142 Å²	142	94.8 Å²	94.8	62%	0.623	50%	0.501	S	S	*	.	H	α-helix	trans	-66.6	-39.9	178.2	-155.2	-102.1	0	0	0	111.8	M16 V17 V23 I24	M16-F20 VanDerWaalsContact O-CB 3.28Å; M16-F20 WeakPolarHBondContact O-CB 3.5Å; M16-F20 PolarHBondContact O-N 2.85Å; V17-F20 PolarHBondContact O-N 2.82Å; F20-V23 PolarHBondContact O-N 2.81Å; F20-I24 HydrophobicContact CD1-CD1 3.54Å; F20-I24 HydrophobicContact CD1-CG1 4.25Å; F20-I24 HydrophobicContact CE1-CD1 3.58Å; F20-I24 HydrophobicContact CE1-CG1 4.3Å; F20-I24 WeakPolarHBondContact O-CB 3.27Å; F20-I24 VanDerWaalsContact O-CG1 3.27Å; F20-I24 WeakPolarHBondContact O-CG1 3.42Å; F20-I24 PolarHBondContact O-N 3.29Å
21	I	72.8	Confident	67	Low	86 Å²	86	91 Å²	91	44%	0.441	49%	0.49	S	S	.	.	H	α-helix	trans	-64.2	-43.9	172.6	-68.8	167.2	0	0	0	110.2	V17 N18 V23 I24 V25	V17-I21 HydrophobicContact CG1-CD1 3.74Å; V17-I21 HydrophobicContact CG1-CG1 4.36Å; V17-I21 WeakPolarHBondContact O-CB 3.46Å; V17-I21 VanDerWaalsContact O-CG1 3.24Å; V17-I21 WeakPolarHBondContact O-CG1 3.28Å; V17-I21 PolarHBondContact O-N 3.25Å; N18-I21 PolarHBondContact O-N 2.83Å; I21-V23 PolarHBondContact O-N 2.79Å; I21-I24 PolarHBondContact O-N 2.79Å; I21-V25 HydrophobicContact CG2-CG2 4.23Å; I21-V25 WeakPolarHBondContact O-CB 3.18Å; I21-V25 VanDerWaalsContact O-CG2 3.24Å; I21-V25 WeakPolarHBondContact O-CG2 3.44Å; I21-V25 PolarHBondContact O-N 2.81Å
22	Y	70.9	Confident	65.6	Low	146 Å²	146	88.5 Å²	88.5	57%	0.573	48%	0.482	S	S	*	.	H	α-helix	trans	-61.6	-44.7	176.6	-178	-99.1	0	0	0	111.3	N18 I19 V25 E26	N18-Y22 VanDerWaalsContact O-CB 3.29Å; N18-Y22 WeakPolarHBondContact O-CB 3.29Å; N18-Y22 PolarHBondContact O-N 3.47Å; I19-Y22 PolarHBondContact O-N 2.83Å; Y22-V25 PolarHBondContact O-N 3.29Å; Y22-E26 WeakPolarHBondContact O-CB 3.38Å; Y22-E26 PolarHBondContact O-N 2.79Å
23	V	71.6	Confident	64.2	Low	71 Å²	71	93.6 Å²	93.6	43%	0.43	50%	0.497	S	S	.	.	H	α-helix	trans	-63.8	-41.3	175	172.2	0	0	0	0	111.1	I19 F20 I21 E26 V27	I19-V23 HydrophobicContact CG2-CG2 4.34Å; I19-V23 WeakPolarHBondContact O-CB 3.46Å; I19-V23 VanDerWaalsContact O-CG2 3.24Å; I19-V23 WeakPolarHBondContact O-CG2 3.12Å; I19-V23 PolarHBondContact O-N 3.43Å; F20-V23 PolarHBondContact O-N 2.81Å; I21-V23 PolarHBondContact O-N 2.79Å; V23-E26 PolarHBondContact O-N 2.66Å; V23-V27 HydrophobicContact CG1-CG2 4.06Å; V23-V27 WeakPolarHBondContact O-CB 3.32Å; V23-V27 WeakPolarHBondContact O-CG2 3.41Å; V23-V27 PolarHBondContact O-N 3.26Å
24	I	69.8	Low	62.4	Low	86 Å²	86	95.8 Å²	95.8	44%	0.441	51%	0.505	S	S	.	.	H	α-helix	trans	-63.9	-43.4	174.8	-73.4	170.7	0	0	0	111	F20 I21 E26 S28	F20-I24 HydrophobicContact CD1-CD1 3.54Å; F20-I24 HydrophobicContact CD1-CG1 4.25Å; F20-I24 HydrophobicContact CE1-CD1 3.58Å; F20-I24 HydrophobicContact CE1-CG1 4.3Å; F20-I24 WeakPolarHBondContact O-CB 3.27Å; F20-I24 VanDerWaalsContact O-CG1 3.27Å; F20-I24 WeakPolarHBondContact O-CG1 3.42Å; F20-I24 PolarHBondContact O-N 3.29Å; I21-I24 PolarHBondContact O-N 2.79Å; I24-E26 VanDerWaalsContact C-N 3.34Å; I24-S28 WeakPolarHBondContact O-CB 3.13Å; I24-S28 PolarHBondContact O-N 3.41Å; I24-S28 PolarHBondContact O-OG 3.5Å
25	V	66	Low	61	Low	69 Å²	69	99.3 Å²	99.3	42%	0.418	52%	0.516	S	S	.	.	H	α-helix	trans	-65.4	-39.8	178.4	168.8	0	0	0	0	110.5	I21 Y22 S28 K29	I21-V25 HydrophobicContact CG2-CG2 4.23Å; I21-V25 WeakPolarHBondContact O-CB 3.18Å; I21-V25 VanDerWaalsContact O-CG2 3.24Å; I21-V25 WeakPolarHBondContact O-CG2 3.44Å; I21-V25 PolarHBondContact O-N 2.81Å; Y22-V25 PolarHBondContact O-N 3.29Å; V25-S28 CarbonylContact O-C 3.42Å; V25-S28 PolarHBondContact O-N 3.46Å; V25-K29 WeakPolarHBondContact O-CB 3.4Å; V25-K29 PolarHBondContact O-N 3.37Å
26	E	63.3	Low	59.5	Low	78 Å²	78	100.7 Å²	100.7	36%	0.364	53%	0.525	S	S	.	.	H	α-helix	trans	-79.6	-31.6	-178.6	-138.9	61.2	176.3	0	0	113	Y22 V23 I24 K29 S30	Y22-E26 WeakPolarHBondContact O-CB 3.38Å; Y22-E26 PolarHBondContact O-N 2.79Å; V23-E26 PolarHBondContact O-N 2.66Å; I24-E26 VanDerWaalsContact C-N 3.34Å; E26-K29 PolarHBondContact O-N 2.87Å; E26-K29 WeakPolarHBondContact OE2-CD 3.24Å; E26-S30 WeakPolarHBondContact O-CB 3.26Å; E26-S30 PolarHBondContact O-N 3.19Å; E26-S30 PolarHBondContact O-OG 2.81Å
27	V	65.6	Low	57.9	Low	88 Å²	88	98.4 Å²	98.4	53%	0.533	53%	0.527	S	S	.	.	H	α-helix	trans	-71.2	-31.9	167.6	173.3	0	0	0	0	111.2	V23 S30 G31	V23-V27 HydrophobicContact CG1-CG2 4.06Å; V23-V27 WeakPolarHBondContact O-CB 3.32Å; V23-V27 WeakPolarHBondContact O-CG2 3.41Å; V23-V27 PolarHBondContact O-N 3.26Å; V27-S30 WeakPolarHBondContact CA-OG 3.24Å; V27-S30 PolarHBondContact O-OG 3.41Å; V27-G31 PolarHBondContact O-N 3.27Å
28	S	57.3	Low	56.2	Low	71 Å²	71	103.2 Å²	103.2	50%	0.497	54%	0.542	S	S	.	.	H	α-helix	trans	-73.9	-34.4	172.9	-60.9	0	0	0	0	111.7	I24 V25 S32	I24-S28 WeakPolarHBondContact O-CB 3.13Å; I24-S28 PolarHBondContact O-N 3.41Å; I24-S28 PolarHBondContact O-OG 3.5Å; V25-S28 CarbonylContact O-C 3.42Å; V25-S28 PolarHBondContact O-N 3.46Å; S28-S32 VanDerWaalsContact O-CB 3.24Å; S28-S32 WeakPolarHBondContact O-CB 3.44Å; S28-S32 PolarHBondContact O-N 3.34Å; S28-S32 PolarHBondContact O-OG 2.78Å
29	K	48.2	Very low	55	Low	110 Å²	110	101.8 Å²	101.8	48%	0.478	55%	0.549	S	S	.	.	H	α-helix	trans	-69.9	-43.1	171.1	-94.4	178	172.5	177.4	0	112.2	V25 E26 S32 Q33	V25-K29 WeakPolarHBondContact O-CB 3.4Å; V25-K29 PolarHBondContact O-N 3.37Å; E26-K29 PolarHBondContact O-N 2.87Å; E26-K29 WeakPolarHBondContact OE2-CD 3.24Å; K29-S32 WeakPolarHBondContact CA-OG 3.4Å; K29-S32 PolarHBondContact O-N 3.02Å; K29-S32 PolarHBondContact O-OG 2.82Å; K29-Q33 VanDerWaalsContact O-CB 3.26Å; K29-Q33 WeakPolarHBondContact O-CB 3.38Å; K29-Q33 WeakPolarHBondContact O-CG 3.4Å; K29-Q33 PolarHBondContact O-N 3.15Å
30	S	47.5	Very low	53.3	Low	62 Å²	62	108.7 Å²	108.7	43%	0.434	57%	0.57	S	S	.	*	H	α-helix	trans	-68.3	-38.5	176	71.4	0	0	0	0	111.7	E26 V27 S32 Q33 E34	E26-S30 WeakPolarHBondContact O-CB 3.26Å; E26-S30 PolarHBondContact O-N 3.19Å; E26-S30 PolarHBondContact O-OG 2.81Å; V27-S30 WeakPolarHBondContact CA-OG 3.24Å; V27-S30 PolarHBondContact O-OG 3.41Å; S30-S32 VanDerWaalsContact C-N 3.31Å; S30-S32 PolarHBondContact O-N 3.02Å; S30-Q33 PolarHBondContact O-N 2.65Å; S30-E34 PolarHBondContact O-N 3.5Å
31	G	42.5	Very low	52	Low	37 Å²	37	107.8 Å²	107.8	38%	0.381	58%	0.576	S	S	.	*	H	α-helix	trans	-69.1	-23.9	174.7	0	0	0	0	0	114.6	V27	V27-G31 PolarHBondContact O-N 3.27Å
32	S	41.1	Very low	51.1	Low	61 Å²	61	110.8 Å²	110.8	43%	0.427	59%	0.591	S	S	.	*	H	α-helix	trans	-94.7	-27.1	175.6	55.7	0	0	0	0	113.5	S28 K29 S30	S28-S32 VanDerWaalsContact O-CB 3.24Å; S28-S32 WeakPolarHBondContact O-CB 3.44Å; S28-S32 PolarHBondContact O-N 3.34Å; S28-S32 PolarHBondContact O-OG 2.78Å; K29-S32 WeakPolarHBondContact CA-OG 3.4Å; K29-S32 PolarHBondContact O-N 3.02Å; K29-S32 PolarHBondContact O-OG 2.82Å; S30-S32 VanDerWaalsContact C-N 3.31Å; S30-S32 PolarHBondContact O-N 3.02Å
33	Q	42.1	Very low	50.3	Low	143 Å²	143	110.2 Å²	110.2	67%	0.668	60%	0.597	S	S	*	*	H	α-helix	trans	-78.6	-33.3	173.9	-78.2	-175.9	-31.5	0	0	112.8	K29 S30 A37	K29-Q33 VanDerWaalsContact O-CB 3.26Å; K29-Q33 WeakPolarHBondContact O-CB 3.38Å; K29-Q33 WeakPolarHBondContact O-CG 3.4Å; K29-Q33 PolarHBondContact O-N 3.15Å; S30-Q33 PolarHBondContact O-N 2.65Å; Q33-A37 WeakPolarHBondContact O-CB 3.43Å
34	E	38.6	Very low	49.3	Very low	153 Å²	153	110.4 Å²	110.4	72%	0.715	60%	0.599	S	S	*	*	H	α-helix	trans	-77	-24.5	175.1	-89.8	-167.1	137.8	0	0	114	S30	S30-E34 PolarHBondContact O-N 3.5Å
35	K	40.5	Very low	48.6	Very low	177 Å²	177	118.6 Å²	118.6	77%	0.77	63%	0.625	S	S	*	*	H	α-helix	trans	-86.3	-17.4	179.6	-74.3	-174.6	179.9	177.2	0	114.5
36	N	41.6	Very low	48	Very low	148 Å²	148	118 Å²	118	79%	0.791	62%	0.624	S	S	*	*	H	α-helix	trans	-107.7	-1.5	179.6	-78.4	-19.3	0	0	0	114.7
37	A	40.6	Very low	47.8	Very low	83 Å²	83	122.8 Å²	122.8	69%	0.686	64%	0.643	S	S	*	*	S	Bend	trans	-105.8	-6.9	178.2	0	0	0	0	0	114.8	Q33	Q33-A37 WeakPolarHBondContact O-CB 3.43Å
38	K	41.7	Very low	47.3	Very low	175 Å²	175	126.5 Å²	126.5	76%	0.761	65%	0.653	S	S	*	*	S	Bend	trans	-96.5	85.6	162.3	-74.5	-179.3	-177.9	172.2	0	107.4	R40	K38-R40 PolarHBondContact O-N 2.91Å
39	G	44.4	Very low	47.2	Very low	64 Å²	64	129.8 Å²	129.8	66%	0.66	65%	0.654	S	S	*	*			trans	-46.5	114	161.9	0	0	0	0	0	106.7	V41	G39-V41 PolarHBondContact O-N 2.77Å
40	R	39.5	Very low	47.7	Very low	232 Å²	232	134.2 Å²	134.2	88%	0.875	67%	0.668	S	S	*	*			trans	-50	113.5	170.5	-94.4	-179.3	173.4	170.4	-1.5	104.3	K38 I42	K38-R40 PolarHBondContact O-N 2.91Å; R40-I42 PolarHBondContact O-N 2.85Å
41	V	46.5	Very low	48.4	Very low	124 Å²	124	140.4 Å²	140.4	75%	0.752	69%	0.687	S	S	*	*			trans	-59	102.4	168.1	179.5	0	0	0	0	103.8	G39 I43	G39-V41 PolarHBondContact O-N 2.77Å; V41-I43 HydrophobicContact CB-CG1 4.43Å; V41-I43 HydrophobicContact CG1-CG1 3.73Å; V41-I43 PolarHBondContact O-N 2.03Å
42	I	54.6	Low	49.5	Very low	149 Å²	149	143.7 Å²	143.7	76%	0.764	69%	0.689	S	S	*	*			trans	-72.3	86.6	173.2	-59.6	176.9	0	0	0	103.5	R40 P44	R40-I42 PolarHBondContact O-N 2.85Å; I42-P44 WeakPolarHBondContact O-CD 3.31Å
43	I	53.9	Low	51	Low	134 Å²	134	145.5 Å²	145.5	69%	0.687	70%	0.697	S	S	*	*			trans	-68.7	113.3	169.1	-57.6	177.4	0	0	0	104.8	V41 R45	V41-I43 HydrophobicContact CB-CG1 4.43Å; V41-I43 HydrophobicContact CG1-CG1 3.73Å; V41-I43 PolarHBondContact O-N 2.03Å; I43-R45 PolarHBondContact O-N 2.96Å
44	P	49.7	Very low	52.6	Low	75 Å²	75	142.4 Å²	142.4	49%	0.487	69%	0.689	S	S	.	*			trans	-57.2	126.1	177.9	-20.9	33.7	0	0	0	108.3	I42 S46	I42-P44 WeakPolarHBondContact O-CD 3.31Å; P44-S46 WeakPolarHBondContact CB-O 2.97Å; P44-S46 PolarHBondContact O-N 3.23Å; P44-S46 VanDerWaalsContact O-N 3.16Å
45	R	55.9	Low	54.8	Low	258 Å²	258	138.8 Å²	138.8	97%	0.974	67%	0.672	S	S	*	*	S	Bend	trans	-62.3	-21.5	178.3	-73.1	-174.7	176.2	-175	-1.1	112.4	I43	I43-R45 PolarHBondContact O-N 2.96Å
46	S	52.9	Low	57.1	Low	57 Å²	57	139.3 Å²	139.3	40%	0.399	68%	0.675	S	S	.	*	S	Bend	trans	-97.2	141	170.4	53.7	0	0	0	0	110.5	P44 F48	P44-S46 WeakPolarHBondContact CB-O 2.97Å; P44-S46 PolarHBondContact O-N 3.23Å; P44-S46 VanDerWaalsContact O-N 3.16Å; S46-F48 PolarHBondContact O-N 2.89Å
47	K	59.1	Low	59.7	Low	177 Å²	177	132.3 Å²	132.3	77%	0.77	64%	0.637	S	S	*	*			trans	-48.7	128.6	166.9	-64.2	-176.2	178.7	-177	0	109.1	W49	K47-W49 WeakPolarHBondContact CB-O 3.01Å; K47-W49 PolarHBondContact O-N 3.14Å
48	F	55.8	Low	62.3	Low	167 Å²	167	128.5 Å²	128.5	73%	0.732	61%	0.605	S	S	*	*	S	Bend	trans	-55.1	-38.8	176.6	-176.6	-93.3	0	0	0	110.5	S46	S46-F48 PolarHBondContact O-N 2.89Å
49	W	55.3	Low	64.9	Low	140 Å²	140	121 Å²	121	53%	0.53	57%	0.572	S	S	.	*	S	Bend	trans	-97.5	114.6	169.3	-53.2	111.5	0	0	0	110.2	K47 I73 L74 L77	K47-W49 WeakPolarHBondContact CB-O 3.01Å; K47-W49 PolarHBondContact O-N 3.14Å; W49-I73 HydrophobicContact CH2-CG2 4.09Å; W49-L74 HydrophobicContact CZ3-CD2 4.48Å; W49-L77 HydrophobicContact CD2-CD1 4.21Å; W49-L77 HydrophobicContact CE3-CD1 3.53Å; W49-L77 HydrophobicContact CH2-CD1 3.63Å; W49-L77 HydrophobicContact CZ2-CD1 4.29Å; W49-L77 HydrophobicContact CZ3-CD1 3.21Å
50	R	58.5	Low	67.3	Low	203 Å²	203	118.8 Å²	118.8	77%	0.766	55%	0.545	S	S	*	.			trans	-90.7	144.9	166.9	-74.5	-177.8	178.9	-177.3	0.2	109.1	Y52	R50-Y52 PolarHBondContact O-N 3.22Å
51	K	61.5	Low	69.9	Low	191 Å²	191	110.9 Å²	110.9	83%	0.83	52%	0.517	S	S	*	.			trans	-57.5	137	170.2	-167	175.3	-177.7	-179.1	0	107.9	T53	K51-T53 PolarHBondContact O-N 2.84Å; K51-T53 PolarHBondContact O-OG1 3.39Å
52	Y	65.2	Low	72.1	Confident	107 Å²	107	105.8 Å²	105.8	42%	0.42	49%	0.485	S	S	.	.			trans	-57.3	113.7	175.3	-178.6	-98.1	0	0	0	109.2	R50 P54 Q64 L68	R50-Y52 PolarHBondContact O-N 3.22Å; Y52-P54 HydrophobicContact CD1-CG 4.45Å; Y52-P54 HydrophobicContact CE1-CG 3.93Å; Y52-Q64 HydrophobicContact CE2-CG 3.88Å; Y52-Q64 VanDerWaalsContact CE2-NE2 3.33Å; Y52-L68 HydrophobicContact CE2-CD1 3.79Å
53	T	72.9	Confident	73.9	Confident	99 Å²	99	99.4 Å²	99.4	61%	0.607	45%	0.452	S	S	*	.			trans	-121.3	117.9	173.6	-49.3	0	0	0	0	106.6	K51 H55 Q64	K51-T53 PolarHBondContact O-N 2.84Å; K51-T53 PolarHBondContact O-OG1 3.39Å; T53-H55 PolarHBondContact O-N 2.92Å; T53-Q64 PolarHBondContact O-NE2 3.14Å
54	P	76.3	Confident	75.6	Confident	77 Å²	77	94.6 Å²	94.6	50%	0.5	43%	0.427	S	S	.	.			trans	-59.5	133.7	175.7	-22.9	32.7	0	0	0	110.6	Y52	Y52-P54 HydrophobicContact CD1-CG 4.45Å; Y52-P54 HydrophobicContact CE1-CG 3.93Å
55	H	85.7	Confident	77.5	Confident	78 Å²	78	95.3 Å²	95.3	36%	0.361	42%	0.422	S	S	.	.			trans	-66.8	149.1	169.6	-77.8	-77	0	0	0	111.3	T53 N60 E297	T53-H55 PolarHBondContact O-N 2.92Å; H55-N60 HydrophobicContact CB-CB 3.47Å; H55-N60 VanDerWaalsContact CB-CB 3.47Å; H55-E297 WeakPolarHBondContact CA-OE1 3.29Å; H55-E297 WeakPolarHBondContact CB-OE1 3.35Å; H55-E297 IonicContact CE1-OE1 3.86Å; H55-E297 IonicContact CG-OE1 2.86Å; H55-E297 IonicContact ND1-OE1 3.11Å; H55-E297 PolarHBondContact ND1-OE1 2.8Å
56	K	88.8	Confident	79	Confident	188 Å²	188	83.6 Å²	83.6	82%	0.817	38%	0.379	S	S	*	.	S	Bend	trans	-83.9	-42.9	179.1	-66.4	-177.1	179.9	-179.1	0	111.7	E297	K56-E297 PolarHBondContact N-OE1 3.01Å; K56-E297 VanDerWaalsContact N-OE1 3.15Å
57	A	95.3	Very high	80.7	Confident	1 Å²	1	83 Å²	83	1%	0.008	37%	0.371	C	S	.	.	S	Bend	trans	-68.9	140.3	179.9	0	0	0	0	0	111.4	W59 N60 K61 E293 S294 E297	A57-W59 PolarHBondContact O-N 3.29Å; A57-N60 HydrophobicContact CB-CB 4.43Å; A57-N60 WeakPolarHBondContact CB-OD1 3.47Å; A57-N60 PolarHBondContact O-N 3.15Å; A57-K61 WeakPolarHBondContact O-CB 3.37Å; A57-K61 PolarHBondContact O-N 3.07Å; A57-E293 VanDerWaalsContact CB-O 3.24Å; A57-E293 WeakPolarHBondContact CB-O 3.28Å; A57-S294 WeakPolarHBondContact CA-O 3.49Å; A57-E297 HydrophobicContact CB-CB 3.86Å; A57-E297 HydrophobicContact CB-CG 3.78Å
58	Y	95.5	Very high	82	Confident	3 Å²	3	75.4 Å²	75.4	1%	0.012	34%	0.339	C	S	.	.	H	α-helix	trans	-59.2	-49.7	-172.2	177.5	-97	0	0	0	112.8	N60 K61 Q62 V102 E105 V106 L120 L123 S294	Y58-N60 VanDerWaalsContact C-N 3.35Å; Y58-N60 PolarHBondContact O-N 3.38Å; Y58-K61 PolarHBondContact O-N 3.09Å; Y58-Q62 HydrophobicContact CD1-CG 4.23Å; Y58-Q62 HydrophobicContact CD2-CG 4.29Å; Y58-Q62 HydrophobicContact CE1-CG 3.83Å; Y58-Q62 HydrophobicContact CE2-CG 3.87Å; Y58-Q62 HydrophobicContact CG-CG 4.45Å; Y58-Q62 WeakPolarHBondContact O-CG 3.31Å; Y58-Q62 PolarHBondContact O-N 3.48Å; Y58-V102 HydrophobicContact CE2-CG2 4.41Å; Y58-V102 WeakPolarHBondContact OH-CG2 3.28Å; Y58-E105 HydrophobicContact CD2-CB 3.87Å; Y58-E105 HydrophobicContact CE2-CB 3.94Å; Y58-E105 VanDerWaalsContact CE2-OE2 3.29Å; Y58-E105 WeakPolarHBondContact CE2-OE2 3.47Å; Y58-V106 HydrophobicContact CD1-CG2 4.31Å; Y58-V106 HydrophobicContact CD2-CG2 3.66Å; Y58-V106 HydrophobicContact CE2-CG2 4.38Å; Y58-V106 HydrophobicContact CG-CG2 3.63Å; Y58-L120 HydrophobicContact CD1-CD2 3.53Å; Y58-L120 HydrophobicContact CE1-CD2 3.83Å; Y58-L120 HydrophobicContact CG-CD2 4.46Å; Y58-L123 HydrophobicContact CE1-CD2 3.81Å; Y58-S294 PolarHBondContact N-O 3.24Å
59	W	96	Very high	83.3	Confident	18 Å²	18	71.6 Å²	71.6	7%	0.068	33%	0.326	C	S	.	.	H	α-helix	trans	-59.8	-46.7	-178.8	-174	95.4	0	0	0	111.1	A57 K61 Q62 Q63 V295 Y296 V326 L327 L328 Y329 M338	A57-W59 PolarHBondContact O-N 3.29Å; W59-K61 VanDerWaalsContact C-N 3.34Å; W59-K61 PolarHBondContact O-N 3.22Å; W59-Q62 PolarHBondContact O-N 2.65Å; W59-Q63 HydrophobicContact CD2-CB 4.49Å; W59-Q63 HydrophobicContact CE3-CB 4.08Å; W59-Q63 HydrophobicContact CH2-CB 3.99Å; W59-Q63 HydrophobicContact CH2-CG 3.76Å; W59-Q63 HydrophobicContact CZ2-CB 4.41Å; W59-Q63 HydrophobicContact CZ2-CG 4.38Å; W59-Q63 HydrophobicContact CZ3-CB 3.8Å; W59-Q63 HydrophobicContact CZ3-CG 3.92Å; W59-Q63 WeakPolarHBondContact O-CB 3.2Å; W59-Q63 PolarHBondContact O-N 3.07Å; W59-V295 WeakPolarHBondContact CB-O 3.43Å; W59-V295 PolarHBondContact N-O 3Å; W59-Y296 HydrophobicContact CB-CD2 4.43Å; W59-Y296 AromaticContact CD2-CD2 3.98Å; W59-Y296 HydrophobicContact CD2-CD2 3.98Å; W59-Y296 HydrophobicContact CD2-CE2 4.31Å; W59-Y296 AromaticContact CE3-CD2 3.5Å; W59-Y296 HydrophobicContact CE3-CD2 3.5Å; W59-Y296 VanDerWaalsContact CE3-CD2 3.5Å; W59-Y296 AromaticContact CE3-CE2 3.53Å; W59-Y296 HydrophobicContact CE3-CE2 3.53Å; W59-Y296 HydrophobicContact CG-CD2 4.38Å; W59-Y296 HydrophobicContact CH2-CE2 4.49Å; W59-Y296 HydrophobicContact CZ3-CD2 4.12Å; W59-Y296 AromaticContact CZ3-CE2 3.65Å; W59-Y296 HydrophobicContact CZ3-CE2 3.65Å; W59-V326 HydrophobicContact CZ2-CG1 4.36Å; W59-L327 HydrophobicContact CZ2-CB 4.29Å; W59-L328 PolarHBondContact NE1-O 2.95Å; W59-Y329 AromaticContact CD1-CD2 3.98Å; W59-Y329 HydrophobicContact CD2-CD2 4.25Å; W59-Y329 AromaticContact CE2-CD2 3.97Å; W59-Y329 HydrophobicContact CG-CD2 4.27Å; W59-Y329 AromaticContact NE1-CD2 3.77Å; W59-M338 HydrophobicContact CH2-CE 3.87Å; W59-M338 HydrophobicContact CH2-SD 3.55Å; W59-M338 VanDerWaalsContact CH2-SD 3.55Å; W59-M338 HydrophobicContact CZ2-CE 4.1Å; W59-M338 HydrophobicContact CZ2-SD 3.51Å; W59-M338 VanDerWaalsContact CZ2-SD 3.51Å; W59-M338 HydrophobicContact CZ3-CE 4.27Å; W59-M338 HydrophobicContact CZ3-SD 4.5Å
60	N	95.8	Very high	84.6	Confident	16 Å²	16	69.8 Å²	69.8	9%	0.086	32%	0.319	C	S	.	.	H	α-helix	trans	-62	-41.9	179.6	-59.9	76.3	0	0	0	111.7	H55 A57 Y58 Q63 Q64 Y296 E297	H55-N60 HydrophobicContact CB-CB 3.47Å; H55-N60 VanDerWaalsContact CB-CB 3.47Å; A57-N60 HydrophobicContact CB-CB 4.43Å; A57-N60 WeakPolarHBondContact CB-OD1 3.47Å; A57-N60 PolarHBondContact O-N 3.15Å; Y58-N60 VanDerWaalsContact C-N 3.35Å; Y58-N60 PolarHBondContact O-N 3.38Å; N60-Q63 PolarHBondContact O-N 3.45Å; N60-Q64 WeakPolarHBondContact O-CB 3.12Å; N60-Q64 PolarHBondContact O-N 3.37Å; N60-Y296 WeakPolarHBondContact OD1-CA 3.39Å; N60-Y296 WeakPolarHBondContact OD1-CD2 3.48Å; N60-E297 HydrophobicContact CB-CG 4.35Å; N60-E297 PolarHBondContact ND2-O 3.28Å; N60-E297 PolarHBondContact OD1-N 3.25Å
61	K	92.9	Very high	85.7	Confident	67 Å²	67	62.8 Å²	62.8	29%	0.291	30%	0.297	S	S	.	.	H	α-helix	trans	-61.9	-46.4	175.8	-174.8	-170.4	-179.3	-166.9	0	111.3	A57 Y58 W59 Q64 K65 E105	A57-K61 WeakPolarHBondContact O-CB 3.37Å; A57-K61 PolarHBondContact O-N 3.07Å; Y58-K61 PolarHBondContact O-N 3.09Å; W59-K61 VanDerWaalsContact C-N 3.34Å; W59-K61 PolarHBondContact O-N 3.22Å; K61-Q64 PolarHBondContact O-N 2.69Å; K61-K65 WeakPolarHBondContact O-CG 3.48Å; K61-K65 PolarHBondContact O-N 3.02Å; K61-K65 VanDerWaalsContact O-N 3.16Å; K61-E105 IonicContact NZ-OE1 2.61Å; K61-E105 PolarHBondContact NZ-OE1 3.38Å
62	Q	92	Very high	86.1	Confident	17 Å²	17	58.5 Å²	58.5	8%	0.079	29%	0.289	C	S	.	.	H	α-helix	trans	-69.2	-38	179.1	-59.5	-47.6	-45.3	0	0	111.7	Y58 W59 Q64 K65 L66 E105 L327	Y58-Q62 HydrophobicContact CD1-CG 4.23Å; Y58-Q62 HydrophobicContact CD2-CG 4.29Å; Y58-Q62 HydrophobicContact CE1-CG 3.83Å; Y58-Q62 HydrophobicContact CE2-CG 3.87Å; Y58-Q62 HydrophobicContact CG-CG 4.45Å; Y58-Q62 WeakPolarHBondContact O-CG 3.31Å; Y58-Q62 PolarHBondContact O-N 3.48Å; W59-Q62 PolarHBondContact O-N 2.65Å; Q62-Q64 VanDerWaalsContact C-N 3.32Å; Q62-Q64 PolarHBondContact O-N 3.48Å; Q62-K65 WeakPolarHBondContact O-CB 3.47Å; Q62-K65 PolarHBondContact O-N 3.32Å; Q62-K65 VanDerWaalsContact OE1-NZ 3.16Å; Q62-L66 PolarHBondContact O-N 2.92Å; Q62-E105 PolarHBondContact NE2-OE2 2.92Å; Q62-L327 VanDerWaalsContact C-CD1 3.43Å; Q62-L327 HydrophobicContact CB-CD1 3.28Å
63	Q	93.5	Very high	86.4	Confident	15 Å²	15	58.5 Å²	58.5	7%	0.07	30%	0.295	C	S	.	.	H	α-helix	trans	-64.8	-38.5	176.1	-177.5	59.9	47.7	0	0	111	W59 N60 K65 L66 D67 Q325 L327	W59-Q63 HydrophobicContact CD2-CB 4.49Å; W59-Q63 HydrophobicContact CE3-CB 4.08Å; W59-Q63 HydrophobicContact CH2-CB 3.99Å; W59-Q63 HydrophobicContact CH2-CG 3.76Å; W59-Q63 HydrophobicContact CZ2-CB 4.41Å; W59-Q63 HydrophobicContact CZ2-CG 4.38Å; W59-Q63 HydrophobicContact CZ3-CB 3.8Å; W59-Q63 HydrophobicContact CZ3-CG 3.92Å; W59-Q63 WeakPolarHBondContact O-CB 3.2Å; W59-Q63 PolarHBondContact O-N 3.07Å; N60-Q63 PolarHBondContact O-N 3.45Å; Q63-K65 PolarHBondContact O-N 2.91Å; Q63-L66 CarbonylContact O-C 3.53Å; Q63-L66 WeakPolarHBondContact O-CB 3.4Å; Q63-L66 PolarHBondContact O-N 3.03Å; Q63-L66 VanDerWaalsContact O-N 3.15Å; Q63-D67 PolarHBondContact NE2-OD1 2.98Å; Q63-D67 VanDerWaalsContact O-CG 3.28Å; Q63-D67 PolarHBondContact O-N 3.01Å; Q63-Q325 PolarHBondContact NE2-O 3.09Å; Q63-L327 HydrophobicContact CB-CD1 4.22Å; Q63-L327 VanDerWaalsContact N-CD1 3.32Å
64	Q	90.3	Very high	86.2	Confident	32 Å²	32	56.9 Å²	56.9	15%	0.15	28%	0.283	C	S	.	.	H	α-helix	trans	-62.3	-41	174.7	-177.1	175.8	40.1	0	0	112.2	Y52 T53 N60 K61 Q62 L66 D67 L68	Y52-Q64 HydrophobicContact CE2-CG 3.88Å; Y52-Q64 VanDerWaalsContact CE2-NE2 3.33Å; T53-Q64 PolarHBondContact O-NE2 3.14Å; N60-Q64 WeakPolarHBondContact O-CB 3.12Å; N60-Q64 PolarHBondContact O-N 3.37Å; K61-Q64 PolarHBondContact O-N 2.69Å; Q62-Q64 VanDerWaalsContact C-N 3.32Å; Q62-Q64 PolarHBondContact O-N 3.48Å; Q64-L66 VanDerWaalsContact C-N 3.32Å; Q64-D67 PolarHBondContact O-N 3.22Å; Q64-L68 WeakPolarHBondContact O-CG 3.45Å; Q64-L68 PolarHBondContact O-N 3.48Å
65	K	88.1	Confident	85.6	Confident	90 Å²	90	54.3 Å²	54.3	39%	0.391	27%	0.268	S	S	.	.	H	α-helix	trans	-60.8	-43	172.1	-67.4	175.5	-174.1	171.4	0	111.2	K61 Q62 Q63 L68 L69 E105	K61-K65 WeakPolarHBondContact O-CG 3.48Å; K61-K65 PolarHBondContact O-N 3.02Å; K61-K65 VanDerWaalsContact O-N 3.16Å; Q62-K65 WeakPolarHBondContact O-CB 3.47Å; Q62-K65 PolarHBondContact O-N 3.32Å; Q62-K65 VanDerWaalsContact OE1-NZ 3.16Å; Q63-K65 PolarHBondContact O-N 2.91Å; K65-L68 PolarHBondContact O-N 3.38Å; K65-L69 PolarHBondContact O-N 3.11Å; K65-L69 VanDerWaalsContact O-N 3.09Å; K65-E105 IonicContact NZ-OE1 3.9Å
66	L	88.4	Confident	84.7	Confident	12 Å²	12	57.3 Å²	57.3	6%	0.063	29%	0.285	C	S	.	.	H	α-helix	trans	-63.4	-43.4	177.3	-163.8	66.2	0	0	0	111.5	Q62 Q63 Q64 L68 L69 Y70 L93 Q325 L327	Q62-L66 PolarHBondContact O-N 2.92Å; Q63-L66 CarbonylContact O-C 3.53Å; Q63-L66 WeakPolarHBondContact O-CB 3.4Å; Q63-L66 PolarHBondContact O-N 3.03Å; Q63-L66 VanDerWaalsContact O-N 3.15Å; Q64-L66 VanDerWaalsContact C-N 3.32Å; L66-L68 VanDerWaalsContact C-N 3.31Å; L66-L68 PolarHBondContact O-N 3.12Å; L66-L69 WeakPolarHBondContact O-CB 3.3Å; L66-L69 PolarHBondContact O-N 3.14Å; L66-Y70 HydrophobicContact CD1-CD2 3.91Å; L66-Y70 HydrophobicContact CD1-CE2 3.54Å; L66-Y70 HydrophobicContact CG-CD2 3.99Å; L66-Y70 HydrophobicContact CG-CE2 4.06Å; L66-Y70 WeakPolarHBondContact O-CD2 3.41Å; L66-Y70 PolarHBondContact O-N 3.38Å; L66-L93 HydrophobicContact CD1-CD1 3.72Å; L66-Q325 VanDerWaalsContact CD2-C 3.48Å; L66-Q325 WeakPolarHBondContact CD2-O 3.3Å; L66-L327 HydrophobicContact CD2-CD2 4.11Å; L66-L327 HydrophobicContact CD2-CG 3.99Å
67	D	89	Confident	83.5	Confident	45 Å²	45	53 Å²	53	24%	0.241	27%	0.271	C	S	.	.	H	α-helix	trans	-63.1	-36.7	177.8	-71.2	-29.4	0	0	0	112.3	Q63 Q64 N71 K342	Q63-D67 PolarHBondContact NE2-OD1 2.98Å; Q63-D67 VanDerWaalsContact O-CG 3.28Å; Q63-D67 PolarHBondContact O-N 3.01Å; Q64-D67 PolarHBondContact O-N 3.22Å; D67-N71 WeakPolarHBondContact O-CB 3.14Å; D67-N71 PolarHBondContact O-N 3.02Å; D67-K342 IonicContact OD1-NZ 2.62Å; D67-K342 PolarHBondContact OD1-NZ 2.89Å
68	L	85.3	Confident	81.8	Confident	18 Å²	18	54.2 Å²	54.2	9%	0.094	28%	0.28	C	S	.	.	H	α-helix	trans	-65.4	-42.4	173.5	-73.1	168.1	0	0	0	111.9	Y52 Q64 K65 L66 Y70 N71 L74 M80	Y52-L68 HydrophobicContact CE2-CD1 3.79Å; Q64-L68 WeakPolarHBondContact O-CG 3.45Å; Q64-L68 PolarHBondContact O-N 3.48Å; K65-L68 PolarHBondContact O-N 3.38Å; L66-L68 VanDerWaalsContact C-N 3.31Å; L66-L68 PolarHBondContact O-N 3.12Å; L68-Y70 PolarHBondContact O-N 2.86Å; L68-N71 PolarHBondContact O-N 3.14Å; L68-L74 HydrophobicContact CD2-CB 3.78Å; L68-M80 HydrophobicContact CD1-SD 3.86Å
69	L	84	Confident	80	Confident	86 Å²	86	61.4 Å²	61.4	45%	0.45	32%	0.318	S	S	.	.	H	α-helix	trans	-62.1	-43	179.1	-177.3	67.9	0	0	0	112	K65 L66	K65-L69 PolarHBondContact O-N 3.11Å; K65-L69 VanDerWaalsContact O-N 3.09Å; L66-L69 WeakPolarHBondContact O-CB 3.3Å; L66-L69 PolarHBondContact O-N 3.14Å
70	Y	82.4	Confident	77.9	Confident	102 Å²	102	64.3 Å²	64.3	40%	0.4	33%	0.334	S	S	.	.	H	α-helix	trans	-89.4	-1.2	-178.2	-74.2	-82.4	0	0	0	113.9	L66 L68 Q325	L66-Y70 HydrophobicContact CD1-CD2 3.91Å; L66-Y70 HydrophobicContact CD1-CE2 3.54Å; L66-Y70 HydrophobicContact CG-CD2 3.99Å; L66-Y70 HydrophobicContact CG-CE2 4.06Å; L66-Y70 WeakPolarHBondContact O-CD2 3.41Å; L66-Y70 PolarHBondContact O-N 3.38Å; L68-Y70 PolarHBondContact O-N 2.86Å; Y70-Q325 HydrophobicContact CD1-CG 3.98Å; Y70-Q325 HydrophobicContact CD2-CG 4.3Å; Y70-Q325 HydrophobicContact CE1-CG 4.27Å; Y70-Q325 HydrophobicContact CG-CG 4Å
71	N	80.6	Confident	75.6	Confident	56 Å²	56	67.8 Å²	67.8	30%	0.299	36%	0.355	S	S	.	.			trans	-128.9	95.7	179.6	-166	-32.5	0	0	0	111.8	D67 L68 I73 L74 A75	D67-N71 WeakPolarHBondContact O-CB 3.14Å; D67-N71 PolarHBondContact O-N 3.02Å; L68-N71 PolarHBondContact O-N 3.14Å; N71-I73 PolarHBondContact O-N 3.5Å; N71-I73 VanDerWaalsContact O-N 3.14Å; N71-I73 WeakPolarHBondContact OD1-CB 3.44Å; N71-I73 PolarHBondContact OD1-N 3.2Å; N71-I73 VanDerWaalsContact OD1-N 3.15Å; N71-L74 HydrophobicContact CB-CB 4.13Å; N71-L74 HydrophobicContact CB-CD1 3.87Å; N71-L74 HydrophobicContact CB-CG 4.02Å; N71-L74 PolarHBondContact O-N 3.17Å; N71-L74 PolarHBondContact OD1-N 3.16Å; N71-A75 PolarHBondContact O-N 3.41Å; N71-A75 VanDerWaalsContact O-N 3.1Å
72	P	69.9	Low	73.4	Confident	102 Å²	102	70 Å²	70	66%	0.662	37%	0.374	S	S	*	.	H	α-helix	trans	-63	-24.6	-176.9	22.4	-31.1	0	0	0	113.4	L76	P72-L76 WeakPolarHBondContact O-CB 3.4Å; P72-L76 PolarHBondContact O-N 3.47Å; P72-L76 VanDerWaalsContact O-N 3.1Å
73	I	72.4	Confident	71	Confident	107 Å²	107	76.6 Å²	76.6	55%	0.549	41%	0.405	S	S	.	.	H	α-helix	trans	-69.5	-42.8	175.3	-60.3	171.6	0	0	0	110.1	W49 N71 L76 L77	W49-I73 HydrophobicContact CH2-CG2 4.09Å; N71-I73 PolarHBondContact O-N 3.5Å; N71-I73 VanDerWaalsContact O-N 3.14Å; N71-I73 WeakPolarHBondContact OD1-CB 3.44Å; N71-I73 PolarHBondContact OD1-N 3.2Å; N71-I73 VanDerWaalsContact OD1-N 3.15Å; I73-L76 PolarHBondContact O-N 3.27Å; I73-L77 HydrophobicContact CG2-CD1 4Å; I73-L77 WeakPolarHBondContact O-CD1 3.44Å; I73-L77 VanDerWaalsContact O-CG 3.24Å; I73-L77 WeakPolarHBondContact O-CG 3.29Å; I73-L77 PolarHBondContact O-N 3.44Å
74	L	67.3	Low	68.8	Low	65 Å²	65	81.9 Å²	81.9	34%	0.34	43%	0.43	S	S	.	.	H	α-helix	trans	-68	-38.6	177.7	-66	177.8	0	0	0	111.7	W49 L68 N71 L77 S78	W49-L74 HydrophobicContact CZ3-CD2 4.48Å; L68-L74 HydrophobicContact CD2-CB 3.78Å; N71-L74 HydrophobicContact CB-CB 4.13Å; N71-L74 HydrophobicContact CB-CD1 3.87Å; N71-L74 HydrophobicContact CB-CG 4.02Å; N71-L74 PolarHBondContact O-N 3.17Å; N71-L74 PolarHBondContact OD1-N 3.16Å; L74-L77 PolarHBondContact O-N 3.31Å; L74-S78 PolarHBondContact O-N 3.38Å; L74-S78 VanDerWaalsContact O-N 3.11Å; L74-S78 PolarHBondContact O-OG 3.47Å
75	A	65.2	Low	66.7	Low	23 Å²	23	83.7 Å²	83.7	19%	0.19	44%	0.441	C	S	.	.	H	α-helix	trans	-62.3	-41	176.3	0	0	0	0	0	112.6	N71 L77 S78	N71-A75 PolarHBondContact O-N 3.41Å; N71-A75 VanDerWaalsContact O-N 3.1Å; A75-L77 VanDerWaalsContact C-N 3.31Å; A75-L77 PolarHBondContact O-N 3.34Å; A75-S78 PolarHBondContact O-N 2.85Å; A75-S78 PolarHBondContact O-OG 2.92Å
76	L	65.6	Low	64.5	Low	140 Å²	140	85.3 Å²	85.3	73%	0.733	45%	0.453	S	S	*	.	H	α-helix	trans	-68.2	-32.9	178.1	-165.5	127.2	0	0	0	112.1	P72 I73	P72-L76 WeakPolarHBondContact O-CB 3.4Å; P72-L76 PolarHBondContact O-N 3.47Å; P72-L76 VanDerWaalsContact O-N 3.1Å; I73-L76 PolarHBondContact O-N 3.27Å
77	L	63.8	Low	62.4	Low	97 Å²	97	92.2 Å²	92.2	51%	0.508	49%	0.488	S	S	.	.	H	α-helix	trans	-77.9	-19.6	177.8	-69.1	167.8	0	0	0	113.6	W49 I73 L74 A75	W49-L77 HydrophobicContact CD2-CD1 4.21Å; W49-L77 HydrophobicContact CE3-CD1 3.53Å; W49-L77 HydrophobicContact CH2-CD1 3.63Å; W49-L77 HydrophobicContact CZ2-CD1 4.29Å; W49-L77 HydrophobicContact CZ3-CD1 3.21Å; I73-L77 HydrophobicContact CG2-CD1 4Å; I73-L77 WeakPolarHBondContact O-CD1 3.44Å; I73-L77 VanDerWaalsContact O-CG 3.24Å; I73-L77 WeakPolarHBondContact O-CG 3.29Å; I73-L77 PolarHBondContact O-N 3.44Å; L74-L77 PolarHBondContact O-N 3.31Å; A75-L77 VanDerWaalsContact C-N 3.31Å; A75-L77 PolarHBondContact O-N 3.34Å
78	S	60.3	Low	60.3	Low	28 Å²	28	92.3 Å²	92.3	20%	0.196	49%	0.492	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	1.4	179.1	62.7	0	0	0	0	114.1	L74 A75 M80	L74-S78 PolarHBondContact O-N 3.38Å; L74-S78 VanDerWaalsContact O-N 3.11Å; L74-S78 PolarHBondContact O-OG 3.47Å; A75-S78 PolarHBondContact O-N 2.85Å; A75-S78 PolarHBondContact O-OG 2.92Å; S78-M80 PolarHBondContact O-N 3.23Å; S78-M80 WeakPolarHBondContact OG-CG 3.48Å
79	N	57.6	Low	58.3	Low	153 Å²	153	96.7 Å²	96.7	82%	0.818	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	28.7	-175.8	-88.4	7.2	0	0	0	113.5
80	M	51.6	Low	56.4	Low	80 Å²	80	97.7 Å²	97.7	39%	0.394	53%	0.53	S	S	.	.			trans	-77.9	125.6	174.7	-70.8	-177.3	69.9	0	0	109.5	L68 S78 E84	L68-M80 HydrophobicContact CD1-SD 3.86Å; S78-M80 PolarHBondContact O-N 3.23Å; S78-M80 WeakPolarHBondContact OG-CG 3.48Å; M80-E84 VanDerWaalsContact CE-OE2 3.29Å; M80-E84 WeakPolarHBondContact CE-OE2 3.44Å
81	T	47	Very low	54.7	Low	88 Å²	88	96.4 Å²	96.4	54%	0.54	54%	0.536	S	S	.	.			trans	-65.7	139.1	179.4	43.2	0	0	0	0	110.3	E83 E84	T81-E83 PolarHBondContact O-N 3.36Å; T81-E84 PolarHBondContact O-N 3.39Å
82	V	46.7	Very low	53.3	Low	113 Å²	113	96.5 Å²	96.5	69%	0.685	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-57.3	-17	179.8	178	0	0	0	0	112.7	N85	V82-N85 WeakPolarHBondContact O-CB 3.15Å; V82-N85 PolarHBondContact O-N 3.05Å
83	E	42.4	Very low	52.5	Low	156 Å²	156	93.9 Å²	93.9	73%	0.729	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-72.8	-23.9	179.2	-80.2	176.5	148.8	0	0	115.1	T81 N85	T81-E83 PolarHBondContact O-N 3.36Å; E83-N85 PolarHBondContact O-N 3.12Å
84	E	48.1	Very low	51.9	Low	126 Å²	126	91.7 Å²	91.7	59%	0.589	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-74.3	-14.6	171.8	-76.4	-176.2	158.7	0	0	112.5	M80 T81	M80-E84 VanDerWaalsContact CE-OE2 3.29Å; M80-E84 WeakPolarHBondContact CE-OE2 3.44Å; T81-E84 PolarHBondContact O-N 3.39Å
85	N	45.7	Very low	52.5	Low	71 Å²	71	90.8 Å²	90.8	38%	0.38	51%	0.512	S	S	.	.	G	3₁₀ helix	trans	-79.7	-13.8	-177.5	-66	-36.7	0	0	0	114.3	V82 E83	V82-N85 WeakPolarHBondContact O-CB 3.15Å; V82-N85 PolarHBondContact O-N 3.05Å; E83-N85 PolarHBondContact O-N 3.12Å
86	L	41	Very low	53.5	Low	123 Å²	123	92.3 Å²	92.3	64%	0.644	52%	0.52	S	S	*	.	S	Bend	trans	-93.8	-17.3	-171.9	-79.1	161	0	0	0	114.6	N89	L86-N89 PolarHBondContact O-ND2 3.07Å
87	I	43.8	Very low	54.6	Low	157 Å²	157	91.5 Å²	91.5	81%	0.805	52%	0.517	S	S	*	.	S	Bend	trans	-91.5	-15.6	-177.6	-60.3	173.6	0	0	0	112.2
88	S	45.5	Very low	55.8	Low	47 Å²	47	90 Å²	90	33%	0.329	51%	0.513	S	S	.	.			trans	-100.4	24.7	-177.5	66.6	0	0	0	0	114.5	S90	S88-S90 PolarHBondContact O-N 2.89Å; S88-S90 VanDerWaalsContact O-N 3.16Å
89	N	42.9	Very low	57.3	Low	110 Å²	110	89.4 Å²	89.4	59%	0.588	51%	0.508	S	S	*	.	S	Bend	trans	-65.6	111.6	-178.1	-88	-33.3	0	0	0	111.6	L86 S91	L86-N89 PolarHBondContact O-ND2 3.07Å; N89-S91 PolarHBondContact O-N 3.25Å
90	S	44.8	Very low	58.7	Low	108 Å²	108	86.1 Å²	86.1	76%	0.755	49%	0.494	S	S	*	.	S	Bend	trans	59.9	-26.1	162.9	-165.1	0	0	0	0	119.3	S88	S88-S90 PolarHBondContact O-N 2.89Å; S88-S90 VanDerWaalsContact O-N 3.16Å
91	S	46.9	Very low	60.5	Low	74 Å²	74	90.9 Å²	90.9	52%	0.517	51%	0.508	S	S	.	.	S	Bend	trans	-83.9	-21.9	-173.4	60.7	0	0	0	0	113.5	N89 S95	N89-S91 PolarHBondContact O-N 3.25Å; S91-S95 PolarHBondContact O-N 3.14Å
92	V	51.1	Low	62.6	Low	58 Å²	58	86.7 Å²	86.7	35%	0.352	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-28.6	-176.1	-174.1	0	0	0	0	111.9	S94 R124	V92-S94 VanDerWaalsContact C-N 3.34Å; V92-R124 WeakPolarHBondContact O-CD 3.26Å
93	L	53.3	Low	64.7	Low	48 Å²	48	85.3 Å²	85.3	25%	0.251	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-2.5	-178.4	-137.9	83.6	0	0	0	114.2	L66 R124	L66-L93 HydrophobicContact CD1-CD1 3.72Å; L93-R124 CarbonylContact C-O 3.58Å
94	S	59.9	Low	67	Low	61 Å²	61	81.9 Å²	81.9	43%	0.427	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.2	3.2	-175	67.6	0	0	0	0	114.4	V92 C96	V92-S94 VanDerWaalsContact C-N 3.34Å; S94-C96 PolarHBondContact O-N 3.33Å
95	S	79	Confident	69.1	Low	46 Å²	46	78.9 Å²	78.9	32%	0.322	45%	0.454	S	S	.	.			trans	-65.9	132.5	174	177.5	0	0	0	0	109.7	S91 D97 C125	S91-S95 PolarHBondContact O-N 3.14Å; S95-D97 PolarHBondContact OG-N 3.07Å; S95-C125 PolarHBondContact O-N 3.42Å
96	C	85.9	Confident	71.4	Confident	54 Å²	54	75.7 Å²	75.7	37%	0.365	44%	0.437	S	S	.	.			trans	-108	7.6	175.3	-66.9	0	0	0	0	112.7	S94 C125	S94-C96 PolarHBondContact O-N 3.33Å; C96-C125 HydrophobicContact CB-CB 3.82Å; C96-C125 WeakPolarHBondContact CB-SG 3.43Å; C96-C125 WeakPolarHBondContact SG-CB 3.49Å; C96-C125 CovalentContact SG-SG 2.04Å; C96-C125 PolarHBondContact SG-SG 3.28Å
97	D	88.6	Confident	73.7	Confident	123 Å²	123	75.5 Å²	75.5	66%	0.658	45%	0.446	S	S	*	.	S	Bend	trans	-75	145.3	168.3	-58.1	-48.9	0	0	0	109.3	S95 D99	S95-D97 PolarHBondContact OG-N 3.07Å; D97-D99 PolarHBondContact O-N 3.4Å
98	P	90.8	Very high	76.1	Confident	66 Å²	66	70.2 Å²	70.2	43%	0.429	42%	0.419	S	S	.	.			trans	-62	130.3	177.1	25.1	-32.6	0	0	0	110.3	P100 L121 Y122	P98-P100 WeakPolarHBondContact O-CD 3.29Å; P98-L121 HydrophobicContact CB-CB 4.29Å; P98-L121 HydrophobicContact CB-CD2 4.34Å; P98-Y122 HydrophobicContact CB-CE1 3.98Å; P98-Y122 HydrophobicContact CG-CE1 4.47Å
99	D	89.9	Confident	78.5	Confident	16 Å²	16	69.3 Å²	69.3	9%	0.086	41%	0.409	C	S	.	.			trans	-79.7	104.3	178.8	-174.8	-7.5	0	0	0	111.1	D97 W101 V102 L121 R124	D97-D99 PolarHBondContact O-N 3.4Å; D99-W101 PolarHBondContact O-N 2.73Å; D99-W101 WeakPolarHBondContact OD1-CB 3.4Å; D99-W101 VanDerWaalsContact OD1-CD1 3.22Å; D99-W101 PolarHBondContact OD1-N 2.94Å; D99-V102 HydrophobicContact CB-CG2 3.92Å; D99-V102 WeakPolarHBondContact O-CG2 3.26Å; D99-V102 PolarHBondContact O-N 2.8Å; D99-L121 PolarHBondContact N-O 2.82Å; D99-L121 WeakPolarHBondContact O-CD2 3.32Å; D99-R124 IonicContact OD2-CZ 2.63Å; D99-R124 IonicContact OD2-NE 3.92Å; D99-R124 IonicContact OD2-NH1 2.75Å; D99-R124 PolarHBondContact OD2-NH1 3.11Å; D99-R124 IonicContact OD2-NH2 2.73Å; D99-R124 PolarHBondContact OD2-NH2 3.09Å
100	P	88.6	Confident	80.9	Confident	83 Å²	83	67.7 Å²	67.7	54%	0.539	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-22.8	-175.5	31.4	-36.2	0	0	0	112.4	P98 V102 T103	P98-P100 WeakPolarHBondContact O-CD 3.29Å; P100-V102 PolarHBondContact O-N 2.97Å; P100-T103 PolarHBondContact O-N 3.18Å; P100-T103 PolarHBondContact O-OG1 2.79Å
101	W	87.8	Confident	83.3	Confident	181 Å²	181	68.9 Å²	68.9	69%	0.686	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-25.9	-175.5	-62.1	102.1	0	0	0	112.4	D99 T103 S104 E105	D99-W101 PolarHBondContact O-N 2.73Å; D99-W101 WeakPolarHBondContact OD1-CB 3.4Å; D99-W101 VanDerWaalsContact OD1-CD1 3.22Å; D99-W101 PolarHBondContact OD1-N 2.94Å; W101-T103 PolarHBondContact O-N 2.9Å; W101-T103 VanDerWaalsContact O-N 3.16Å; W101-S104 PolarHBondContact O-N 3.12Å; W101-S104 PolarHBondContact O-OG 3.25Å; W101-E105 PolarHBondContact O-N 3.14Å
102	V	91.4	Very high	85.7	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-51.3	-38.8	175	177.2	0	0	0	0	111.7	Y58 D99 P100 S104 E105 V106 F109 L120	Y58-V102 HydrophobicContact CE2-CG2 4.41Å; Y58-V102 WeakPolarHBondContact OH-CG2 3.28Å; D99-V102 HydrophobicContact CB-CG2 3.92Å; D99-V102 WeakPolarHBondContact O-CG2 3.26Å; D99-V102 PolarHBondContact O-N 2.8Å; P100-V102 PolarHBondContact O-N 2.97Å; V102-S104 PolarHBondContact O-N 3.45Å; V102-E105 PolarHBondContact O-N 3.24Å; V102-V106 HydrophobicContact CG1-CG2 3.83Å; V102-V106 WeakPolarHBondContact O-CB 3.47Å; V102-V106 WeakPolarHBondContact O-CG2 3.26Å; V102-V106 PolarHBondContact O-N 3.48Å; V102-F109 HydrophobicContact CG1-CD2 3.7Å; V102-F109 HydrophobicContact CG1-CE2 3.54Å; V102-L120 HydrophobicContact CG1-CB 3.53Å; V102-L120 HydrophobicContact CG1-CD1 4.23Å; V102-L120 HydrophobicContact CG1-CG 4.41Å
103	T	91.4	Very high	87.8	Confident	83 Å²	83	65.5 Å²	65.5	51%	0.509	39%	0.386	S	S	.	.	H	α-helix	trans	-61.8	-26.4	-178.9	64.8	0	0	0	0	113.1	P100 W101 F109	P100-T103 PolarHBondContact O-N 3.18Å; P100-T103 PolarHBondContact O-OG1 2.79Å; W101-T103 PolarHBondContact O-N 2.9Å; W101-T103 VanDerWaalsContact O-N 3.16Å; T103-F109 HydrophobicContact CG2-CD1 3.93Å; T103-F109 HydrophobicContact CG2-CE1 3.71Å; T103-F109 HydrophobicContact CG2-CZ 4.21Å
104	S	90.5	Very high	89.8	Confident	85 Å²	85	68.6 Å²	68.6	59%	0.594	40%	0.4	S	S	*	.	H	α-helix	trans	-97.6	-29.5	178.4	69.6	0	0	0	0	113.3	W101 V102	W101-S104 PolarHBondContact O-N 3.12Å; W101-S104 PolarHBondContact O-OG 3.25Å; V102-S104 PolarHBondContact O-N 3.45Å
105	E	91.5	Very high	91.5	Very high	62 Å²	62	70.3 Å²	70.3	29%	0.29	40%	0.397	S	S	.	.	H	α-helix	trans	-84.5	-22.7	-178.1	-66.9	-153.3	121.5	0	0	113.4	Y58 K61 Q62 K65 W101 V102	Y58-E105 HydrophobicContact CD2-CB 3.87Å; Y58-E105 HydrophobicContact CE2-CB 3.94Å; Y58-E105 VanDerWaalsContact CE2-OE2 3.29Å; Y58-E105 WeakPolarHBondContact CE2-OE2 3.47Å; K61-E105 IonicContact NZ-OE1 2.61Å; K61-E105 PolarHBondContact NZ-OE1 3.38Å; Q62-E105 PolarHBondContact NE2-OE2 2.92Å; K65-E105 IonicContact NZ-OE1 3.9Å; W101-E105 PolarHBondContact O-N 3.14Å; V102-E105 PolarHBondContact O-N 3.24Å
106	V	93.8	Very high	92.3	Very high	4 Å²	4	68.1 Å²	68.1	2%	0.024	38%	0.381	C	S	.	.	S	Bend	trans	-102.4	106.8	179.6	-178	0	0	0	0	109.3	Y58 V102 D108 F109 L112 L120	Y58-V106 HydrophobicContact CD1-CG2 4.31Å; Y58-V106 HydrophobicContact CD2-CG2 3.66Å; Y58-V106 HydrophobicContact CE2-CG2 4.38Å; Y58-V106 HydrophobicContact CG-CG2 3.63Å; V102-V106 HydrophobicContact CG1-CG2 3.83Å; V102-V106 WeakPolarHBondContact O-CB 3.47Å; V102-V106 WeakPolarHBondContact O-CG2 3.26Å; V102-V106 PolarHBondContact O-N 3.48Å; V106-D108 PolarHBondContact O-N 2.75Å; V106-F109 HydrophobicContact CB-CB 4.08Å; V106-F109 HydrophobicContact CB-CD2 4.37Å; V106-F109 HydrophobicContact CG1-CB 4.23Å; V106-F109 WeakPolarHBondContact O-CB 3.45Å; V106-F109 PolarHBondContact O-N 2.83Å; V106-F109 VanDerWaalsContact O-N 3.09Å; V106-L112 HydrophobicContact CG1-CD1 3.89Å; V106-L120 HydrophobicContact CG1-CD1 4.45Å; V106-L120 HydrophobicContact CG2-CD1 4.22Å
107	S	89.8	Confident	92.8	Very high	120 Å²	120	67.3 Å²	67.3	84%	0.839	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-29.5	-168.8	55.6	0	0	0	0	115.6
108	D	93.7	Very high	93.2	Very high	46 Å²	46	63.9 Å²	63.9	25%	0.246	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.5	20.2	-177.2	68.2	-26.6	0	0	0	113	V106 A110 N111 L112 S294	V106-D108 PolarHBondContact O-N 2.75Å; D108-A110 VanDerWaalsContact C-N 3.27Å; D108-A110 PolarHBondContact O-N 2.91Å; D108-A110 VanDerWaalsContact O-N 3.11Å; D108-N111 WeakPolarHBondContact O-CA 3.38Å; D108-N111 PolarHBondContact O-N 2.84Å; D108-L112 PolarHBondContact O-N 2.98Å; D108-S294 VanDerWaalsContact CG-OG 3.24Å; D108-S294 WeakPolarHBondContact OD1-CB 3.27Å; D108-S294 PolarHBondContact OD1-OG 3.22Å; D108-S294 PolarHBondContact OD2-OG 3.36Å
109	F	95.9	Very high	93.4	Very high	27 Å²	27	61.2 Å²	61.2	12%	0.118	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-47.6	-45.9	-173.6	-175.3	-97.3	0	0	0	113.8	V102 T103 V106 N111 L112 K117 L120 L121	V102-F109 HydrophobicContact CG1-CD2 3.7Å; V102-F109 HydrophobicContact CG1-CE2 3.54Å; T103-F109 HydrophobicContact CG2-CD1 3.93Å; T103-F109 HydrophobicContact CG2-CE1 3.71Å; T103-F109 HydrophobicContact CG2-CZ 4.21Å; V106-F109 HydrophobicContact CB-CB 4.08Å; V106-F109 HydrophobicContact CB-CD2 4.37Å; V106-F109 HydrophobicContact CG1-CB 4.23Å; V106-F109 WeakPolarHBondContact O-CB 3.45Å; V106-F109 PolarHBondContact O-N 2.83Å; V106-F109 VanDerWaalsContact O-N 3.09Å; F109-N111 PolarHBondContact O-N 3.07Å; F109-L112 HydrophobicContact CD2-CD1 4.49Å; F109-L112 WeakPolarHBondContact O-CB 3.35Å; F109-L112 PolarHBondContact O-N 3.23Å; F109-L112 VanDerWaalsContact O-N 3.13Å; F109-K117 HydrophobicContact CE1-CB 4.47Å; F109-K117 HydrophobicContact CE1-CD 4.24Å; F109-K117 HydrophobicContact CE1-CG 4.1Å; F109-K117 HydrophobicContact CE2-CB 4.07Å; F109-K117 HydrophobicContact CE2-CG 4.02Å; F109-K117 HydrophobicContact CZ-CB 3.76Å; F109-K117 HydrophobicContact CZ-CD 4.33Å; F109-K117 HydrophobicContact CZ-CG 3.78Å; F109-K117 WeakPolarHBondContact O-CE 3.31Å; F109-L120 HydrophobicContact CD2-CD1 4.28Å; F109-L120 HydrophobicContact CE2-CD1 4.37Å; F109-L121 HydrophobicContact CZ-CD1 4.33Å; F109-L121 HydrophobicContact CZ-CD2 4.31Å; F109-L121 HydrophobicContact CZ-CG 4.17Å
110	A	95.3	Very high	93.7	Very high	77 Å²	77	60.6 Å²	60.6	64%	0.636	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-59.7	-30.7	-179.3	0	0	0	0	0	113.3	D108 K117	D108-A110 VanDerWaalsContact C-N 3.27Å; D108-A110 PolarHBondContact O-N 2.91Å; D108-A110 VanDerWaalsContact O-N 3.11Å; A110-K117 PolarHBondContact O-NZ 3.39Å
111	N	95.3	Very high	94.1	Very high	132 Å²	132	58.3 Å²	58.3	71%	0.706	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-93.4	-3.5	-177.7	-62.2	-41.9	0	0	0	113.2	D108 F109	D108-N111 WeakPolarHBondContact O-CA 3.38Å; D108-N111 PolarHBondContact O-N 2.84Å; F109-N111 PolarHBondContact O-N 3.07Å
112	L	96	Very high	94.4	Very high	6 Å²	6	54.4 Å²	54.4	3%	0.031	30%	0.3	C	S	.	.	S	Bend	trans	-72.3	145.6	178.3	-66.9	-177.6	0	0	0	110.9	V106 D108 F109 F116 K117 L120 P292 V295	V106-L112 HydrophobicContact CG1-CD1 3.89Å; D108-L112 PolarHBondContact O-N 2.98Å; F109-L112 HydrophobicContact CD2-CD1 4.49Å; F109-L112 WeakPolarHBondContact O-CB 3.35Å; F109-L112 PolarHBondContact O-N 3.23Å; F109-L112 VanDerWaalsContact O-N 3.13Å; L112-F116 HydrophobicContact CB-CB 4.03Å; L112-F116 HydrophobicContact CD1-CB 4.14Å; L112-K117 HydrophobicContact CB-CG 4.32Å; L112-K117 WeakPolarHBondContact O-CE 3.34Å; L112-L120 HydrophobicContact CD1-CD1 3.75Å; L112-P292 HydrophobicContact CD2-CB 4.09Å; L112-P292 HydrophobicContact CD2-CG 3.62Å; L112-V295 HydrophobicContact CD1-CG2 4.28Å
113	P	95.8	Very high	94.5	Very high	55 Å²	55	54.6 Å²	54.6	36%	0.357	30%	0.301	S	S	.	.			trans	-57	147.2	168	-22.4	31.5	0	0	0	111.6	R115 F116 K117	P113-R115 VanDerWaalsContact C-N 3.26Å; P113-R115 HydrophobicContact CB-CG 4.2Å; P113-R115 PolarHBondContact O-N 3.28Å; P113-R115 VanDerWaalsContact O-N 3.12Å; P113-F116 HydrophobicContact CB-CD2 4.13Å; P113-F116 HydrophobicContact CG-CD2 3.99Å; P113-F116 HydrophobicContact CG-CE2 4.36Å; P113-F116 WeakPolarHBondContact O-CB 3.23Å; P113-F116 PolarHBondContact O-N 3.15Å; P113-K117 PolarHBondContact O-N 3.47Å
114	E	94.8	Very high	94.4	Very high	113 Å²	113	54 Å²	54	53%	0.528	29%	0.29	S	S	.	.	H	α-helix	trans	-52.3	-40.2	-175.6	-67.6	-52.6	128.9	0	0	113.9	F116 K117 D118	E114-F116 PolarHBondContact O-N 3.16Å; E114-F116 VanDerWaalsContact O-N 3.08Å; E114-K117 WeakPolarHBondContact O-CB 3.29Å; E114-K117 PolarHBondContact O-N 2.9Å; E114-K117 IonicContact OE1-NZ 3.2Å; E114-K117 PolarHBondContact OE1-NZ 3.06Å; E114-D118 PolarHBondContact O-N 3.49Å
115	R	94.9	Very high	94.4	Very high	98 Å²	98	50.1 Å²	50.1	37%	0.37	26%	0.263	S	S	.	.	H	α-helix	trans	-53.3	-32.9	174.9	64	178.6	-178.1	-168.9	1.7	114.1	P113 F119 F218	P113-R115 VanDerWaalsContact C-N 3.26Å; P113-R115 HydrophobicContact CB-CG 4.2Å; P113-R115 PolarHBondContact O-N 3.28Å; P113-R115 VanDerWaalsContact O-N 3.12Å; R115-F119 VanDerWaalsContact O-CB 3.25Å; R115-F119 WeakPolarHBondContact O-CB 3.46Å; R115-F119 PolarHBondContact O-N 2.87Å; R115-F218 HydrophobicContact CB-CD2 4.08Å; R115-F218 HydrophobicContact CB-CE2 4.13Å; R115-F218 HydrophobicContact CG-CD2 4.17Å; R115-F218 HydrophobicContact CG-CE2 3.69Å; R115-F218 HydrophobicContact CG-CZ 4.08Å; R115-F218 WeakPolarHBondContact O-CD2 3.38Å
116	F	97	Very high	94.4	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-78.8	-39.5	175.8	-78.1	-79.2	0	0	0	111.9	L112 P113 E114 F119 L120 F218 Y290 I291 P292 V295	L112-F116 HydrophobicContact CB-CB 4.03Å; L112-F116 HydrophobicContact CD1-CB 4.14Å; P113-F116 HydrophobicContact CB-CD2 4.13Å; P113-F116 HydrophobicContact CG-CD2 3.99Å; P113-F116 HydrophobicContact CG-CE2 4.36Å; P113-F116 WeakPolarHBondContact O-CB 3.23Å; P113-F116 PolarHBondContact O-N 3.15Å; E114-F116 PolarHBondContact O-N 3.16Å; E114-F116 VanDerWaalsContact O-N 3.08Å; F116-F119 PolarHBondContact O-N 3.38Å; F116-L120 WeakPolarHBondContact O-CB 3.41Å; F116-L120 WeakPolarHBondContact O-CD1 3.11Å; F116-L120 WeakPolarHBondContact O-CG 3.17Å; F116-L120 PolarHBondContact O-N 3.21Å; F116-F218 AromaticContact CD1-CE2 3.63Å; F116-F218 HydrophobicContact CD1-CE2 3.63Å; F116-F218 HydrophobicContact CD1-CZ 4.27Å; F116-F218 AromaticContact CD2-CE2 3.92Å; F116-F218 HydrophobicContact CD2-CE2 3.92Å; F116-F218 HydrophobicContact CD2-CZ 4.29Å; F116-F218 AromaticContact CE1-CE2 3.54Å; F116-F218 HydrophobicContact CE1-CE2 3.54Å; F116-F218 AromaticContact CE1-CZ 3.72Å; F116-F218 HydrophobicContact CE1-CZ 3.72Å; F116-F218 AromaticContact CE2-CE2 3.86Å; F116-F218 HydrophobicContact CE2-CE2 3.86Å; F116-F218 AromaticContact CE2-CZ 3.77Å; F116-F218 HydrophobicContact CE2-CZ 3.77Å; F116-F218 AromaticContact CG-CE2 3.8Å; F116-F218 HydrophobicContact CG-CE2 3.8Å; F116-F218 AromaticContact CZ-CE2 3.66Å; F116-F218 HydrophobicContact CZ-CE2 3.66Å; F116-F218 AromaticContact CZ-CZ 3.44Å; F116-F218 HydrophobicContact CZ-CZ 3.44Å; F116-F218 VanDerWaalsContact CZ-CZ 3.44Å; F116-Y290 AromaticContact CE2-CD1 3.91Å; F116-Y290 HydrophobicContact CE2-CD1 3.91Å; F116-Y290 HydrophobicContact CE2-CE1 4.14Å; F116-Y290 HydrophobicContact CZ-CD1 4.2Å; F116-Y290 HydrophobicContact CZ-CE1 4.5Å; F116-Y290 VanDerWaalsContact CZ-O 3.32Å; F116-Y290 WeakPolarHBondContact CZ-O 3.21Å; F116-I291 HydrophobicContact CE1-CD1 4.06Å; F116-I291 HydrophobicContact CZ-CD1 4.2Å; F116-P292 HydrophobicContact CD1-CG 4.41Å; F116-P292 HydrophobicContact CE1-CG 4.15Å; F116-P292 HydrophobicContact CE2-CG 4.31Å; F116-P292 HydrophobicContact CZ-CG 4.09Å; F116-V295 HydrophobicContact CD1-CG1 4.48Å; F116-V295 HydrophobicContact CD1-CG2 4.03Å; F116-V295 HydrophobicContact CE1-CG1 4.48Å; F116-V295 HydrophobicContact CE1-CG2 4.38Å
117	K	96.9	Very high	94.3	Very high	37 Å²	37	53.1 Å²	53.1	16%	0.161	28%	0.28	C	S	.	.	H	α-helix	trans	-59.4	-51.2	176.3	-63.8	-179.6	-176.6	162.5	0	109.9	F109 A110 L112 P113 E114 F119 L120 L121	F109-K117 HydrophobicContact CE1-CB 4.47Å; F109-K117 HydrophobicContact CE1-CD 4.24Å; F109-K117 HydrophobicContact CE1-CG 4.1Å; F109-K117 HydrophobicContact CE2-CB 4.07Å; F109-K117 HydrophobicContact CE2-CG 4.02Å; F109-K117 HydrophobicContact CZ-CB 3.76Å; F109-K117 HydrophobicContact CZ-CD 4.33Å; F109-K117 HydrophobicContact CZ-CG 3.78Å; F109-K117 WeakPolarHBondContact O-CE 3.31Å; A110-K117 PolarHBondContact O-NZ 3.39Å; L112-K117 HydrophobicContact CB-CG 4.32Å; L112-K117 WeakPolarHBondContact O-CE 3.34Å; P113-K117 PolarHBondContact O-N 3.47Å; E114-K117 WeakPolarHBondContact O-CB 3.29Å; E114-K117 PolarHBondContact O-N 2.9Å; E114-K117 IonicContact OE1-NZ 3.2Å; E114-K117 PolarHBondContact OE1-NZ 3.06Å; K117-F119 PolarHBondContact O-N 2.62Å; K117-L120 PolarHBondContact O-N 2.63Å; K117-L121 WeakPolarHBondContact O-CB 3.19Å; K117-L121 WeakPolarHBondContact O-CG 3.41Å; K117-L121 PolarHBondContact O-N 3.22Å
118	D	95.6	Very high	94.6	Very high	50 Å²	50	50 Å²	50	27%	0.267	25%	0.25	S	S	.	.	H	α-helix	trans	-54.3	-53.1	174.7	-74.9	-10.6	0	0	0	111.2	E114 L120 L121 Y122 R214	E114-D118 PolarHBondContact O-N 3.49Å; D118-L120 VanDerWaalsContact C-N 3.31Å; D118-L120 PolarHBondContact O-N 3.29Å; D118-L121 PolarHBondContact O-N 3.25Å; D118-Y122 VanDerWaalsContact O-CD2 3.27Å; D118-Y122 WeakPolarHBondContact O-CD2 3.3Å; D118-Y122 PolarHBondContact O-N 2.79Å; D118-Y122 VanDerWaalsContact O-N 3.12Å; D118-R214 IonicContact OD2-CZ 3.71Å; D118-R214 IonicContact OD2-NH1 3.39Å; D118-R214 PolarHBondContact OD2-NH1 3.02Å
119	F	96.5	Very high	94.7	Very high	11 Å²	11	50.9 Å²	50.9	5%	0.048	26%	0.26	C	S	.	.	H	α-helix	trans	-58.3	-42	-178.6	177.4	-92.7	0	0	0	113	R115 F116 K117 L123 F218 L328 P330	R115-F119 VanDerWaalsContact O-CB 3.25Å; R115-F119 WeakPolarHBondContact O-CB 3.46Å; R115-F119 PolarHBondContact O-N 2.87Å; F116-F119 PolarHBondContact O-N 3.38Å; K117-F119 PolarHBondContact O-N 2.62Å; F119-L123 HydrophobicContact CE1-CD1 3.7Å; F119-L123 HydrophobicContact CE2-CD1 4.49Å; F119-L123 HydrophobicContact CZ-CD1 3.67Å; F119-L123 WeakPolarHBondContact O-CA 3.45Å; F119-L123 WeakPolarHBondContact O-CB 3.18Å; F119-L123 PolarHBondContact O-N 3.08Å; F119-F218 HydrophobicContact CB-CD2 3.97Å; F119-F218 HydrophobicContact CD2-CB 4.01Å; F119-F218 HydrophobicContact CG-CD2 4.29Å; F119-L328 HydrophobicContact CE2-CB 4.28Å; F119-L328 HydrophobicContact CZ-CB 4.23Å; F119-L328 WeakPolarHBondContact CZ-O 3.46Å; F119-P330 HydrophobicContact CD1-CG 3.88Å; F119-P330 HydrophobicContact CD2-CG 4.4Å; F119-P330 HydrophobicContact CE1-CG 3.59Å; F119-P330 HydrophobicContact CE2-CG 4.14Å; F119-P330 HydrophobicContact CG-CG 4.28Å; F119-P330 VanDerWaalsContact CZ-CD 3.48Å; F119-P330 HydrophobicContact CZ-CG 3.73Å
120	L	96.3	Very high	94.8	Very high	2 Å²	2	52.2 Å²	52.2	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-74	-40.6	-178	-66.6	165.3	0	0	0	112	Y58 V102 V106 F109 L112 F116 K117 D118 Y122 L123 V295	Y58-L120 HydrophobicContact CD1-CD2 3.53Å; Y58-L120 HydrophobicContact CE1-CD2 3.83Å; Y58-L120 HydrophobicContact CG-CD2 4.46Å; V102-L120 HydrophobicContact CG1-CB 3.53Å; V102-L120 HydrophobicContact CG1-CD1 4.23Å; V102-L120 HydrophobicContact CG1-CG 4.41Å; V106-L120 HydrophobicContact CG1-CD1 4.45Å; V106-L120 HydrophobicContact CG2-CD1 4.22Å; F109-L120 HydrophobicContact CD2-CD1 4.28Å; F109-L120 HydrophobicContact CE2-CD1 4.37Å; L112-L120 HydrophobicContact CD1-CD1 3.75Å; F116-L120 WeakPolarHBondContact O-CB 3.41Å; F116-L120 WeakPolarHBondContact O-CD1 3.11Å; F116-L120 WeakPolarHBondContact O-CG 3.17Å; F116-L120 PolarHBondContact O-N 3.21Å; K117-L120 PolarHBondContact O-N 2.63Å; D118-L120 VanDerWaalsContact C-N 3.31Å; D118-L120 PolarHBondContact O-N 3.29Å; L120-Y122 VanDerWaalsContact C-N 3.29Å; L120-Y122 PolarHBondContact O-N 2.92Å; L120-L123 WeakPolarHBondContact O-CB 3.08Å; L120-L123 PolarHBondContact O-N 3.05Å; L120-V295 HydrophobicContact CD1-CG2 4.38Å; L120-V295 HydrophobicContact CD2-CG1 4.5Å
121	L	95.4	Very high	95	Very high	36 Å²	36	52.5 Å²	52.5	19%	0.188	26%	0.259	C	S	.	.	H	α-helix	trans	-61.5	-37.4	178	-73.5	170.1	0	0	0	111.9	P98 D99 F109 K117 D118	P98-L121 HydrophobicContact CB-CB 4.29Å; P98-L121 HydrophobicContact CB-CD2 4.34Å; D99-L121 PolarHBondContact N-O 2.82Å; D99-L121 WeakPolarHBondContact O-CD2 3.32Å; F109-L121 HydrophobicContact CZ-CD1 4.33Å; F109-L121 HydrophobicContact CZ-CD2 4.31Å; F109-L121 HydrophobicContact CZ-CG 4.17Å; K117-L121 WeakPolarHBondContact O-CB 3.19Å; K117-L121 WeakPolarHBondContact O-CG 3.41Å; K117-L121 PolarHBondContact O-N 3.22Å; D118-L121 PolarHBondContact O-N 3.25Å
122	Y	94.9	Very high	95.1	Very high	98 Å²	98	48 Å²	48	38%	0.384	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.4	15.7	-176.7	-60	-72.5	0	0	0	113.8	P98 D118 L120 R124 C125	P98-Y122 HydrophobicContact CB-CE1 3.98Å; P98-Y122 HydrophobicContact CG-CE1 4.47Å; D118-Y122 VanDerWaalsContact O-CD2 3.27Å; D118-Y122 WeakPolarHBondContact O-CD2 3.3Å; D118-Y122 PolarHBondContact O-N 2.79Å; D118-Y122 VanDerWaalsContact O-N 3.12Å; L120-Y122 VanDerWaalsContact C-N 3.29Å; L120-Y122 PolarHBondContact O-N 2.92Å; Y122-R124 PolarHBondContact O-N 3.45Å; Y122-C125 PolarHBondContact O-N 2.87Å
123	L	93.1	Very high	95.2	Very high	4 Å²	4	50.5 Å²	50.5	2%	0.021	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-30.3	-174.7	178.7	62.1	0	0	0	114	Y58 F119 L120 L327 L328	Y58-L123 HydrophobicContact CE1-CD2 3.81Å; F119-L123 HydrophobicContact CE1-CD1 3.7Å; F119-L123 HydrophobicContact CE2-CD1 4.49Å; F119-L123 HydrophobicContact CZ-CD1 3.67Å; F119-L123 WeakPolarHBondContact O-CA 3.45Å; F119-L123 WeakPolarHBondContact O-CB 3.18Å; F119-L123 PolarHBondContact O-N 3.08Å; L120-L123 WeakPolarHBondContact O-CB 3.08Å; L120-L123 PolarHBondContact O-N 3.05Å; L123-L327 HydrophobicContact CD2-CD1 4.49Å; L123-L328 HydrophobicContact CD1-CB 3.98Å; L123-L328 WeakPolarHBondContact CD1-O 3.45Å
124	R	88.7	Confident	95.3	Very high	72 Å²	72	48.8 Å²	48.8	27%	0.272	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-12.9	-176.8	-55.9	-173.4	-169.4	152.6	10	113.4	V92 L93 D99 Y122 R126	V92-R124 WeakPolarHBondContact O-CD 3.26Å; L93-R124 CarbonylContact C-O 3.58Å; D99-R124 IonicContact OD2-CZ 2.63Å; D99-R124 IonicContact OD2-NE 3.92Å; D99-R124 IonicContact OD2-NH1 2.75Å; D99-R124 PolarHBondContact OD2-NH1 3.11Å; D99-R124 IonicContact OD2-NH2 2.73Å; D99-R124 PolarHBondContact OD2-NH2 3.09Å; Y122-R124 PolarHBondContact O-N 3.45Å; R124-R126 PolarHBondContact O-N 2.98Å
125	C	91.8	Very high	95.3	Very high	3 Å²	3	47.4 Å²	47.4	2%	0.02	24%	0.235	C	C	.	.			trans	-79.5	115.4	179.3	-172.8	0	0	0	0	110.7	S95 C96 Y122 Y128	S95-C125 PolarHBondContact O-N 3.42Å; C96-C125 HydrophobicContact CB-CB 3.82Å; C96-C125 WeakPolarHBondContact CB-SG 3.43Å; C96-C125 WeakPolarHBondContact SG-CB 3.49Å; C96-C125 CovalentContact SG-SG 2.04Å; C96-C125 PolarHBondContact SG-SG 3.28Å; Y122-C125 PolarHBondContact O-N 2.87Å; C125-Y128 HydrophobicContact CB-CE2 4.35Å; C125-Y128 VanDerWaalsContact SG-CE2 3.51Å; C125-Y128 PolarHBondContact SG-OH 2.89Å
126	R	91.7	Very high	95.4	Very high	7 Å²	7	48.6 Å²	48.6	3%	0.026	25%	0.249	C	C	.	.			trans	-132.4	-2.6	-176	-64.4	174.3	168.2	-151.1	-13.4	113.9	R124 S323 V326 L327 L328	R124-R126 PolarHBondContact O-N 2.98Å; R126-S323 PolarHBondContact NH1-O 2.71Å; R126-V326 PolarHBondContact NH2-O 3.27Å; R126-L327 VanDerWaalsContact NH2-C 3.29Å; R126-L327 VanDerWaalsContact NH2-CA 3.27Å; R126-L328 HydrophobicContact CG-CD1 4.13Å; R126-L328 HydrophobicContact CG-CD2 4.39Å; R126-L328 HydrophobicContact CG-CG 4.37Å
127	N	91	Very high	95.3	Very high	121 Å²	121	49.6 Å²	49.6	65%	0.647	25%	0.253	S	S	*	.			trans	-109.8	96.7	-174.9	-166.4	9.9	0	0	0	109.1
128	Y	95.5	Very high	95.2	Very high	55 Å²	55	48.7 Å²	48.7	22%	0.216	25%	0.251	C	S	.	.			trans	-119.8	136.4	176.6	-67.4	-86.4	0	0	0	108.7	C125 N212 L222	C125-Y128 HydrophobicContact CB-CE2 4.35Å; C125-Y128 VanDerWaalsContact SG-CE2 3.51Å; C125-Y128 PolarHBondContact SG-OH 2.89Å; Y128-N212 WeakPolarHBondContact CD1-O 3.43Å; Y128-L222 HydrophobicContact CD2-CD1 3.91Å; Y128-L222 HydrophobicContact CD2-CD2 3.57Å; Y128-L222 HydrophobicContact CD2-CG 4.2Å; Y128-L222 HydrophobicContact CE2-CD1 3.97Å; Y128-L222 HydrophobicContact CE2-CD2 3.24Å; Y128-L222 HydrophobicContact CE2-CG 4.19Å
129	S	96.9	Very high	95	Very high	65 Å²	65	53.9 Å²	53.9	46%	0.455	27%	0.271	S	S	.	.			trans	-65.6	141.2	-179.3	50.8	0	0	0	0	111.3	W211 N212	S129-W211 CarbonylContact O-C 3.44Å; S129-W211 WeakPolarHBondContact O-CA 3.43Å; S129-N212 PolarHBondContact O-N 2.74Å; S129-N212 WeakPolarHBondContact OG-CB 3.45Å
130	L	98.1	Very high	94.6	Very high	55 Å²	55	59 Å²	59	29%	0.288	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	114.5	168.6	-176.8	62.8	0	0	0	108.2	M132 D133 L209 W211	L130-M132 VanDerWaalsContact CD1-O 3.25Å; L130-M132 WeakPolarHBondContact CD1-O 3.37Å; L130-D133 HydrophobicContact CD2-CB 3.49Å; L130-D133 VanDerWaalsContact CD2-CB 3.49Å; L130-D133 VanDerWaalsContact CD2-CG 3.42Å; L130-D133 WeakPolarHBondContact CD2-OD1 3.46Å; L130-D133 HydrophobicContact CG-CB 3.98Å; L130-L209 HydrophobicContact CD1-CB 4.36Å; L130-W211 HydrophobicContact CD1-CD2 3.67Å; L130-W211 HydrophobicContact CD1-CE3 4.21Å; L130-W211 HydrophobicContact CD1-CG 3.96Å; L130-W211 HydrophobicContact CD1-CH2 4.45Å; L130-W211 HydrophobicContact CD1-CZ2 3.94Å
131	L	98	Very high	94.4	Very high	83 Å²	83	65.1 Å²	65.1	44%	0.435	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	-34.7	-176	-60	174.6	0	0	0	112.4	L210 N212	L131-L210 WeakPolarHBondContact CA-O 3.3Å; L131-L210 WeakPolarHBondContact CB-O 3.14Å; L131-L210 PolarHBondContact N-O 3.48Å; L131-N212 HydrophobicContact CD1-CB 3.69Å; L131-N212 HydrophobicContact CD2-CB 4Å; L131-N212 HydrophobicContact CG-CB 3.82Å
132	M	98.2	Very high	94.5	Very high	36 Å²	36	63.5 Å²	63.5	18%	0.177	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	117.6	173.1	-56.7	-175.1	-173.3	0	0	108.3	L130 I198 K199 L209 L210	L130-M132 VanDerWaalsContact CD1-O 3.25Å; L130-M132 WeakPolarHBondContact CD1-O 3.37Å; M132-I198 HydrophobicContact CE-CG2 4.12Å; M132-K199 HydrophobicContact CE-CB 3.99Å; M132-L209 WeakPolarHBondContact O-CA 3.41Å; M132-L210 HydrophobicContact CB-CB 3.9Å; M132-L210 HydrophobicContact CE-CD2 3.8Å; M132-L210 HydrophobicContact CG-CB 4.04Å; M132-L210 HydrophobicContact CG-CD2 4.11Å; M132-L210 PolarHBondContact N-O 3.17Å; M132-L210 PolarHBondContact O-N 3.33Å; M132-L210 VanDerWaalsContact O-N 3.11Å; M132-L210 HydrophobicContact SD-CB 4.35Å; M132-L210 HydrophobicContact SD-CD2 3.98Å
133	D	98.3	Very high	94.6	Very high	60 Å²	60	59.9 Å²	59.9	32%	0.321	30%	0.3	S	S	.	.			trans	-116	158	178.6	-170.1	19.6	0	0	0	111	L130 P135 W230	L130-D133 HydrophobicContact CD2-CB 3.49Å; L130-D133 VanDerWaalsContact CD2-CB 3.49Å; L130-D133 VanDerWaalsContact CD2-CG 3.42Å; L130-D133 WeakPolarHBondContact CD2-OD1 3.46Å; L130-D133 HydrophobicContact CG-CB 3.98Å; D133-P135 VanDerWaalsContact C-CD 3.48Å; D133-W230 PolarHBondContact OD1-NE1 3.08Å
134	Q	97.6	Very high	94.9	Very high	19 Å²	19	59.7 Å²	59.7	9%	0.089	30%	0.299	C	S	.	.			trans	-123	68	173.1	-51.6	-57	-28.8	0	0	109.2	N136 K137 S202 Q206 I208 L209	Q134-N136 PolarHBondContact O-N 3.25Å; Q134-K137 HydrophobicContact CB-CB 4.02Å; Q134-K137 WeakPolarHBondContact O-CB 3.47Å; Q134-K137 PolarHBondContact O-N 3.44Å; Q134-S202 PolarHBondContact NE2-OG 2.65Å; Q134-S202 VanDerWaalsContact NE2-OG 3.15Å; Q134-Q206 VanDerWaalsContact OE1-C 3.31Å; Q134-Q206 VanDerWaalsContact OE1-CA 3.24Å; Q134-Q206 PolarHBondContact OE1-O 2.68Å; Q134-I208 WeakPolarHBondContact CG-O 3.44Å; Q134-I208 PolarHBondContact NE2-O 3.42Å; Q134-L209 HydrophobicContact CB-CD2 4.31Å; Q134-L209 HydrophobicContact CG-CD2 4.14Å
135	P	95.4	Very high	95.4	Very high	83 Å²	83	56.2 Å²	56.2	54%	0.539	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-24.4	-168.5	24.7	-35.6	0	0	0	113.2	D133	D133-P135 VanDerWaalsContact C-CD 3.48Å
136	N	95.4	Very high	95.7	Very high	123 Å²	123	56.1 Å²	56.1	66%	0.658	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-2	178.4	-67.3	-50.6	0	0	0	113.9	Q134 C138 K139	Q134-N136 PolarHBondContact O-N 3.25Å; N136-C138 VanDerWaalsContact C-N 3.27Å; N136-C138 PolarHBondContact O-N 2.92Å; N136-K139 WeakPolarHBondContact O-CB 3.42Å; N136-K139 PolarHBondContact O-N 3.41Å
137	K	95.9	Very high	96	Very high	21 Å²	21	55.8 Å²	55.8	9%	0.091	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-39.6	-173.4	-176.6	61	63.8	179.9	0	112.4	Q134 E168 K177 R178 V179 Q206 W230	Q134-K137 HydrophobicContact CB-CB 4.02Å; Q134-K137 WeakPolarHBondContact O-CB 3.47Å; Q134-K137 PolarHBondContact O-N 3.44Å; K137-E168 IonicContact NZ-OE1 3.29Å; K137-E168 PolarHBondContact NZ-OE1 3.3Å; K137-K177 HydrophobicContact CD-CB 3.99Å; K137-K177 HydrophobicContact CD-CD 4.18Å; K137-K177 HydrophobicContact CD-CG 4.33Å; K137-K177 HydrophobicContact CG-CB 4.34Å; K137-R178 VanDerWaalsContact CE-O 3.28Å; K137-R178 WeakPolarHBondContact CE-O 3.23Å; K137-R178 PolarHBondContact NZ-O 2.85Å; K137-V179 HydrophobicContact CD-CG1 4.35Å; K137-V179 HydrophobicContact CG-CG1 3.8Å; K137-Q206 WeakPolarHBondContact CE-O 3.45Å; K137-Q206 PolarHBondContact NZ-O 3.47Å; K137-W230 HydrophobicContact CB-CH2 4.37Å; K137-W230 HydrophobicContact CB-CZ2 4.43Å; K137-W230 HydrophobicContact CG-CH2 4.46Å
138	C	95.4	Very high	96.4	Very high	19 Å²	19	50 Å²	50	13%	0.128	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109	22.4	-179.8	-55.9	0	0	0	0	113.5	N136 H140 P142 S234 C235	N136-C138 VanDerWaalsContact C-N 3.27Å; N136-C138 PolarHBondContact O-N 2.92Å; C138-H140 CarbonylContact C-O 3.55Å; C138-H140 CarbonylContact O-C 3.58Å; C138-H140 PolarHBondContact O-N 3.16Å; C138-P142 HydrophobicContact CB-CG 4.14Å; C138-S234 WeakPolarHBondContact CB-O 3.33Å; C138-C235 HydrophobicContact CB-CB 3.67Å; C138-C235 WeakPolarHBondContact CB-SG 3.25Å; C138-C235 WeakPolarHBondContact SG-CB 3.4Å; C138-C235 CovalentContact SG-SG 2.03Å; C138-C235 PolarHBondContact SG-SG 3.17Å
139	K	89.8	Confident	96.6	Very high	158 Å²	158	48.1 Å²	48.1	69%	0.687	25%	0.246	S	C	*	.	S	Bend	trans	-56.1	-35.6	174	-174.8	178	-179.2	179.6	0	111.8	N136	N136-K139 WeakPolarHBondContact O-CB 3.42Å; N136-K139 PolarHBondContact O-N 3.41Å
140	H	89.3	Confident	96.7	Very high	120 Å²	120	45.1 Å²	45.1	56%	0.556	23%	0.225	S	C	*	.	S	Bend	trans	-100.8	129.7	163.9	-61.8	-68.2	0	0	0	108.6	C138 P142	C138-H140 CarbonylContact C-O 3.55Å; C138-H140 CarbonylContact O-C 3.58Å; C138-H140 PolarHBondContact O-N 3.16Å; H140-P142 WeakPolarHBondContact O-CD 3.27Å; H140-P142 VanDerWaalsContact O-N 3.09Å
141	K	92.6	Very high	96.7	Very high	130 Å²	130	44.7 Å²	44.7	57%	0.565	22%	0.222	S	C	*	.			trans	-58.3	109.2	-175.8	-57.6	-173.7	178.2	-143.2	0	110.1	D237	K141-D237 HydrophobicContact CB-CB 4.31Å; K141-D237 HydrophobicContact CD-CB 3.78Å; K141-D237 WeakPolarHBondContact CE-OD2 3.36Å; K141-D237 HydrophobicContact CG-CB 3.76Å; K141-D237 IonicContact NZ-OD1 2.83Å; K141-D237 PolarHBondContact NZ-OD1 3.49Å; K141-D237 IonicContact NZ-OD2 3.71Å; K141-D237 PolarHBondContact NZ-OD2 3Å
142	P	96.5	Very high	96.7	Very high	1 Å²	1	41 Å²	41	1%	0.006	20%	0.203	C	C	.	.			trans	-71.7	138.8	-178.6	-14.6	30.2	0	0	0	110.4	C138 H140 K177 V238 Q239	C138-P142 HydrophobicContact CB-CG 4.14Å; H140-P142 WeakPolarHBondContact O-CD 3.27Å; H140-P142 VanDerWaalsContact O-N 3.09Å; P142-K177 HydrophobicContact CB-CB 4.22Å; P142-K177 HydrophobicContact CB-CG 4.02Å; P142-K177 HydrophobicContact CG-CB 4.19Å; P142-K177 HydrophobicContact CG-CG 3.88Å; P142-V238 HydrophobicContact CB-CG2 4.25Å; P142-Q239 PolarHBondContact O-N 2.75Å; P142-Q239 VanDerWaalsContact O-N 3.09Å
143	F	97.9	Very high	96.7	Very high	22 Å²	22	41.3 Å²	41.3	10%	0.096	21%	0.208	C	C	.	.	S	Bend	trans	-69.1	-42.2	165.4	179.9	-100.6	0	0	0	110.2	V174 T175 Q239 F240 L256 L259 K260	F143-V174 HydrophobicContact CD1-CG1 4.25Å; F143-T175 WeakPolarHBondContact CA-O 3.28Å; F143-T175 WeakPolarHBondContact CB-O 3.38Å; F143-T175 PolarHBondContact N-O 2.9Å; F143-Q239 HydrophobicContact CD2-CB 4.43Å; F143-Q239 WeakPolarHBondContact O-CB 3.28Å; F143-F240 HydrophobicContact CE1-CD2 4.31Å; F143-F240 HydrophobicContact CE2-CD2 4.08Å; F143-F240 AromaticContact CE2-CE2 3.84Å; F143-F240 HydrophobicContact CE2-CE2 3.84Å; F143-F240 AromaticContact CZ-CD2 3.97Å; F143-F240 HydrophobicContact CZ-CD2 3.97Å; F143-F240 AromaticContact CZ-CE2 3.85Å; F143-F240 HydrophobicContact CZ-CE2 3.85Å; F143-F240 PolarHBondContact O-N 3.3Å; F143-L256 HydrophobicContact CD1-CD2 3.74Å; F143-L256 HydrophobicContact CE1-CD2 3.82Å; F143-L259 HydrophobicContact CE1-CB 3.92Å; F143-L259 HydrophobicContact CE1-CD1 3.98Å; F143-L259 HydrophobicContact CZ-CB 3.83Å; F143-K260 HydrophobicContact CZ-CG 4.32Å
144	L	98.6	Very high	96.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	126.7	177.1	178.6	62.6	0	0	0	110.3	L146 T175 V176 K177 F240 F242 T252 I255 L256 L259 L310	L144-L146 HydrophobicContact CD1-CD2 4.41Å; L144-L146 HydrophobicContact CD2-CD2 3.69Å; L144-L146 HydrophobicContact CG-CD2 3.85Å; L144-T175 PolarHBondContact N-O 2.68Å; L144-T175 VanDerWaalsContact N-O 3.08Å; L144-V176 HydrophobicContact CB-CG1 4.41Å; L144-V176 HydrophobicContact CB-CG2 4.24Å; L144-V176 HydrophobicContact CD2-CG1 4.36Å; L144-V176 HydrophobicContact CG-CG1 4.44Å; L144-V176 VanDerWaalsContact O-CA 3.32Å; L144-V176 WeakPolarHBondContact O-CA 3.43Å; L144-K177 PolarHBondContact O-N 2.89Å; L144-F240 CarbonylContact C-O 3.59Å; L144-F240 WeakPolarHBondContact CA-O 3.33Å; L144-F240 HydrophobicContact CD1-CB 4.05Å; L144-F242 HydrophobicContact CD1-CB 4.11Å; L144-T252 HydrophobicContact CD2-CG2 4.29Å; L144-I255 HydrophobicContact CD2-CG2 3.9Å; L144-L256 HydrophobicContact CB-CD2 4.34Å; L144-L256 HydrophobicContact CD2-CD2 4.04Å; L144-L259 HydrophobicContact CD1-CD1 4.18Å; L144-L310 HydrophobicContact CD1-CD1 3.94Å
145	L	98.8	Very high	96.8	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	120.5	166.2	179.7	68	0	0	0	109.3	K177 V179 F227 W230 V231 V238 F240 I241 F242	L145-K177 HydrophobicContact CD1-CB 4.11Å; L145-V179 HydrophobicContact CD1-CG1 4.41Å; L145-V179 HydrophobicContact CD1-CG2 4.16Å; L145-F227 HydrophobicContact CD2-CE2 4.11Å; L145-F227 HydrophobicContact CD2-CZ 4.05Å; L145-W230 HydrophobicContact CD2-CZ3 3.99Å; L145-V231 HydrophobicContact CD2-CG2 4.35Å; L145-V238 HydrophobicContact CB-CG2 3.68Å; L145-F240 PolarHBondContact N-O 3.21Å; L145-I241 HydrophobicContact CB-CG1 4.37Å; L145-I241 WeakPolarHBondContact O-CA 3.42Å; L145-F242 PolarHBondContact O-N 3.48Å
146	L	98.9	Very high	96.9	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	112.9	169	-52.4	179.9	0	0	0	108	L144 I148 V176 K177 R178 V179 F242	L144-L146 HydrophobicContact CD1-CD2 4.41Å; L144-L146 HydrophobicContact CD2-CD2 3.69Å; L144-L146 HydrophobicContact CG-CD2 3.85Å; L146-I148 HydrophobicContact CB-CD1 3.68Å; L146-I148 WeakPolarHBondContact O-CD1 3.23Å; L146-V176 HydrophobicContact CD1-CG1 3.89Å; L146-V176 HydrophobicContact CG-CG1 3.9Å; L146-K177 PolarHBondContact N-O 3.13Å; L146-R178 HydrophobicContact CB-CB 4.4Å; L146-R178 HydrophobicContact CB-CG 4.32Å; L146-R178 CarbonylContact O-C 3.53Å; L146-R178 WeakPolarHBondContact O-CA 3.33Å; L146-V179 PolarHBondContact O-N 3.31Å; L146-F242 HydrophobicContact CD2-CB 3.84Å; L146-F242 HydrophobicContact CD2-CD1 4.03Å; L146-F242 HydrophobicContact CD2-CG 4.26Å
147	A	98.8	Very high	97.1	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	108.4	176.6	0	0	0	0	0	110.4	V179 L181 F227 I241 F242 K243 G244	A147-V179 WeakPolarHBondContact CA-O 3.08Å; A147-V179 HydrophobicContact CB-CG2 4.12Å; A147-L181 HydrophobicContact CB-CD1 4.25Å; A147-F227 HydrophobicContact CB-CD2 4.32Å; A147-F227 HydrophobicContact CB-CE1 3.89Å; A147-F227 HydrophobicContact CB-CE2 3.53Å; A147-F227 HydrophobicContact CB-CZ 3.28Å; A147-I241 HydrophobicContact CB-CG2 4.38Å; A147-F242 PolarHBondContact N-O 3.1Å; A147-K243 VanDerWaalsContact O-CA 3.29Å; A147-K243 WeakPolarHBondContact O-CA 3.34Å; A147-G244 PolarHBondContact O-N 2.98Å; A147-G244 VanDerWaalsContact O-N 3.07Å
148	I	98.9	Very high	97.2	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	119.8	-170.2	-60.4	75.2	0	0	0	109.8	L146 S150 I161 W165 R178 V179 F180 L181 G244 D246	L146-I148 HydrophobicContact CB-CD1 3.68Å; L146-I148 WeakPolarHBondContact O-CD1 3.23Å; I148-S150 PolarHBondContact O-N 3.3Å; I148-I161 HydrophobicContact CG2-CD1 4.06Å; I148-W165 HydrophobicContact CD1-CH2 4.43Å; I148-W165 HydrophobicContact CD1-CZ3 4.4Å; I148-W165 HydrophobicContact CG1-CH2 3.68Å; I148-W165 HydrophobicContact CG1-CZ3 4.13Å; I148-R178 HydrophobicContact CD1-CG 3.76Å; I148-V179 PolarHBondContact N-O 2.82Å; I148-F180 HydrophobicContact CB-CD1 3.61Å; I148-F180 HydrophobicContact CB-CE1 3.83Å; I148-F180 HydrophobicContact CG1-CD1 4.4Å; I148-F180 HydrophobicContact CG1-CE1 4.19Å; I148-F180 HydrophobicContact CG2-CD1 3.82Å; I148-F180 HydrophobicContact CG2-CE1 3.89Å; I148-F180 CarbonylContact O-C 3.53Å; I148-F180 VanDerWaalsContact O-CA 3.32Å; I148-F180 WeakPolarHBondContact O-CA 3.33Å; I148-L181 PolarHBondContact O-N 2.98Å; I148-G244 CarbonylContact C-O 3.56Å; I148-G244 WeakPolarHBondContact CA-O 3.28Å; I148-D246 HydrophobicContact CG2-CB 3.8Å
149	K	98.8	Very high	97.4	Very high	15 Å²	15	40.3 Å²	40.3	7%	0.065	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	125.6	170.8	-66.8	-179.2	-79	163.8	0	109.3	L220 K223 G244 D245 D246 D332	K149-L220 HydrophobicContact CD-CD2 4.37Å; K149-K223 HydrophobicContact CB-CD 4.23Å; K149-K223 HydrophobicContact CD-CD 4.45Å; K149-K223 HydrophobicContact CG-CD 3.9Å; K149-G244 PolarHBondContact N-O 3.38Å; K149-D245 WeakPolarHBondContact CE-OD1 3.32Å; K149-D245 IonicContact NZ-OD1 3.7Å; K149-D245 PolarHBondContact NZ-OD1 3.35Å; K149-D246 WeakPolarHBondContact O-CB 3.29Å; K149-D246 PolarHBondContact O-N 3.3Å; K149-D332 IonicContact NZ-OD2 3.48Å; K149-D332 PolarHBondContact NZ-OD2 2.55Å
150	S	98.7	Very high	97.8	Very high	3 Å²	3	32.9 Å²	32.9	2%	0.021	16%	0.156	C	C	.	.			trans	-141.8	171.7	177.5	-163.5	0	0	0	0	111.3	I148 R158 L181 K223 D246	I148-S150 PolarHBondContact O-N 3.3Å; S150-R158 PolarHBondContact OG-NH1 2.95Å; S150-R158 VanDerWaalsContact OG-NH1 3.09Å; S150-L181 PolarHBondContact N-O 2.96Å; S150-L181 VanDerWaalsContact N-O 3.09Å; S150-L181 VanDerWaalsContact O-O 3.12Å; S150-K223 PolarHBondContact O-NZ 3.42Å; S150-D246 VanDerWaalsContact CA-OD2 3.29Å; S150-D246 WeakPolarHBondContact CA-OD2 3.5Å; S150-D246 VanDerWaalsContact CB-OD2 3.3Å; S150-D246 WeakPolarHBondContact CB-OD2 3.29Å; S150-D246 PolarHBondContact OG-OD2 3.14Å
151	L	98.4	Very high	98.3	Very high	45 Å²	45	27.2 Å²	27.2	24%	0.236	13%	0.13	C	C	.	.			trans	-119.5	151.1	172.2	-70.8	173.4	0	0	0	109.4	P153 H154 R158 T185 D215	L151-P153 VanDerWaalsContact C-N 3.3Å; L151-P153 VanDerWaalsContact O-N 3.09Å; L151-H154 WeakPolarHBondContact O-CB 3.38Å; L151-H154 PolarHBondContact O-N 2.84Å; L151-R158 PolarHBondContact O-NH1 3.34Å; L151-T185 HydrophobicContact CD2-CG2 4.18Å; L151-D215 HydrophobicContact CD2-CB 3.9Å; L151-D215 VanDerWaalsContact CD2-CG 3.42Å
152	T	98.2	Very high	98.6	Very high	6 Å²	6	22 Å²	22	4%	0.037	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-43.3	-47.5	-179.5	-44.3	0	0	0	0	114	H154 F155 R158 T185 L194 I198	T152-H154 VanDerWaalsContact C-N 3.28Å; T152-H154 PolarHBondContact O-N 3.49Å; T152-F155 WeakPolarHBondContact O-CE2 2.95Å; T152-F155 WeakPolarHBondContact O-CZ 3.33Å; T152-R158 PolarHBondContact O-NH2 3.24Å; T152-T185 WeakPolarHBondContact CB-OG1 3.47Å; T152-T185 PolarHBondContact OG1-OG1 2.88Å; T152-L194 HydrophobicContact CG2-CB 3.94Å; T152-I198 HydrophobicContact CG2-CB 3.96Å; T152-I198 HydrophobicContact CG2-CG1 4.29Å; T152-I198 HydrophobicContact CG2-CG2 4.15Å
153	P	98.1	Very high	98.7	Very high	42 Å²	42	27 Å²	27	27%	0.273	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-13.9	-176.1	-16.9	32.5	0	0	0	115.5	L151 F155 F191 L194	L151-P153 VanDerWaalsContact C-N 3.3Å; L151-P153 VanDerWaalsContact O-N 3.09Å; P153-F155 WeakPolarHBondContact O-CD2 3.31Å; P153-F155 PolarHBondContact O-N 3.47Å; P153-F191 HydrophobicContact CG-CD1 3.82Å; P153-F191 HydrophobicContact CG-CE1 3.99Å; P153-L194 HydrophobicContact CB-CD1 3.88Å; P153-L194 HydrophobicContact CG-CD1 3.92Å
154	H	98.6	Very high	98.7	Very high	41 Å²	41	26 Å²	26	19%	0.19	13%	0.125	C	C	.	.			trans	-79.9	45.7	-173	-64.7	179.8	0	0	0	113.9	L151 T152 D156 R157 R158 D246	L151-H154 WeakPolarHBondContact O-CB 3.38Å; L151-H154 PolarHBondContact O-N 2.84Å; T152-H154 VanDerWaalsContact C-N 3.28Å; T152-H154 PolarHBondContact O-N 3.49Å; H154-D156 VanDerWaalsContact C-N 3.31Å; H154-D156 PolarHBondContact O-N 3.3Å; H154-R157 HydrophobicContact CB-CB 4.21Å; H154-R157 HydrophobicContact CB-CG 4.29Å; H154-R157 PolarHBondContact O-N 2.97Å; H154-R158 WeakPolarHBondContact O-CG 3.49Å; H154-R158 PolarHBondContact O-N 2.97Å; H154-R158 VanDerWaalsContact O-N 3.08Å; H154-R158 PolarHBondContact O-NH1 3.43Å; H154-D246 WeakPolarHBondContact CB-OD2 3.49Å; H154-D246 IonicContact CE1-OD2 3.77Å; H154-D246 IonicContact CG-OD2 2.85Å; H154-D246 IonicContact ND1-OD1 3.08Å; H154-D246 PolarHBondContact ND1-OD1 3.11Å; H154-D246 IonicContact ND1-OD2 3.96Å; H154-D246 PolarHBondContact ND1-OD2 3.48Å
155	F	98.8	Very high	98.7	Very high	45 Å²	45	26 Å²	26	20%	0.197	13%	0.126	C	C	.	.	H	α-helix	trans	-59.4	-41.1	179.7	-64.4	-79.2	0	0	0	112.5	T152 P153 R158 Q159 L194 M197 I198 E201	T152-F155 WeakPolarHBondContact O-CE2 2.95Å; T152-F155 WeakPolarHBondContact O-CZ 3.33Å; P153-F155 WeakPolarHBondContact O-CD2 3.31Å; P153-F155 PolarHBondContact O-N 3.47Å; F155-R158 PolarHBondContact O-N 3.29Å; F155-Q159 VanDerWaalsContact O-CB 3.26Å; F155-Q159 WeakPolarHBondContact O-CB 3.24Å; F155-Q159 PolarHBondContact O-N 3.1Å; F155-L194 HydrophobicContact CE2-CB 4.39Å; F155-L194 HydrophobicContact CE2-CD1 4.07Å; F155-L194 HydrophobicContact CE2-CD2 4.35Å; F155-L194 HydrophobicContact CZ-CB 4.38Å; F155-M197 HydrophobicContact CD2-CE 4.45Å; F155-M197 HydrophobicContact CE1-CB 4.04Å; F155-M197 HydrophobicContact CE2-CB 4.3Å; F155-M197 HydrophobicContact CE2-CE 4.18Å; F155-M197 HydrophobicContact CZ-CB 3.58Å; F155-M197 HydrophobicContact CZ-CE 4.43Å; F155-I198 HydrophobicContact CE1-CD1 4.33Å; F155-E201 WeakPolarHBondContact CD1-OE2 3.29Å; F155-E201 HydrophobicContact CE1-CB 4.32Å; F155-E201 WeakPolarHBondContact CE1-OE2 3.4Å
156	D	98.8	Very high	98.7	Very high	89 Å²	89	26 Å²	26	48%	0.476	13%	0.126	S	C	.	.	H	α-helix	trans	-64.1	-43.8	179.7	63.3	-28	0	0	0	112.4	H154 Q159 A160 P380	H154-D156 VanDerWaalsContact C-N 3.31Å; H154-D156 PolarHBondContact O-N 3.3Å; D156-Q159 PolarHBondContact O-N 3.47Å; D156-A160 WeakPolarHBondContact O-CB 3.45Å; D156-A160 PolarHBondContact O-N 3.19Å; D156-P380 HydrophobicContact CB-CG 4.29Å
157	R	98.9	Very high	98.6	Very high	71 Å²	71	32.2 Å²	32.2	27%	0.268	15%	0.152	S	C	.	.	H	α-helix	trans	-63.1	-51	175.6	-61	-174.3	-175.6	-166.4	-4.2	110.8	H154 Q159 A160 I161 D246 P380	H154-R157 HydrophobicContact CB-CB 4.21Å; H154-R157 HydrophobicContact CB-CG 4.29Å; H154-R157 PolarHBondContact O-N 2.97Å; R157-Q159 VanDerWaalsContact C-N 3.31Å; R157-Q159 PolarHBondContact O-N 3.5Å; R157-A160 PolarHBondContact O-N 3.03Å; R157-I161 VanDerWaalsContact O-CG1 3.23Å; R157-I161 WeakPolarHBondContact O-CG1 3.43Å; R157-I161 PolarHBondContact O-N 3.2Å; R157-D246 HydrophobicContact CB-CB 4.16Å; R157-D246 VanDerWaalsContact CD-CG 3.48Å; R157-D246 WeakPolarHBondContact CD-OD1 3.43Å; R157-D246 IonicContact CZ-OD1 2.84Å; R157-D246 IonicContact NE-OD1 2.71Å; R157-D246 IonicContact NH1-OD1 3.23Å; R157-D246 PolarHBondContact NH1-OD1 3.1Å; R157-P380 HydrophobicContact CG-CG 4.01Å
158	R	98.9	Very high	98.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-57.1	-47.9	178	-69.7	-166.1	-67.4	-80.2	4	110.6	S150 L151 T152 H154 F155 A160 I161 R162 F180 E201	S150-R158 PolarHBondContact OG-NH1 2.95Å; S150-R158 VanDerWaalsContact OG-NH1 3.09Å; L151-R158 PolarHBondContact O-NH1 3.34Å; T152-R158 PolarHBondContact O-NH2 3.24Å; H154-R158 WeakPolarHBondContact O-CG 3.49Å; H154-R158 PolarHBondContact O-N 2.97Å; H154-R158 VanDerWaalsContact O-N 3.08Å; H154-R158 PolarHBondContact O-NH1 3.43Å; F155-R158 PolarHBondContact O-N 3.29Å; R158-A160 PolarHBondContact O-N 2.95Å; R158-I161 WeakPolarHBondContact O-CB 3.48Å; R158-I161 PolarHBondContact O-N 2.8Å; R158-R162 VanDerWaalsContact O-CG 3.32Å; R158-R162 WeakPolarHBondContact O-CG 3.42Å; R158-R162 PolarHBondContact O-N 3.34Å; R158-F180 HydrophobicContact CB-CD1 4.36Å; R158-F180 HydrophobicContact CB-CD2 4.39Å; R158-F180 HydrophobicContact CB-CE1 3.95Å; R158-F180 HydrophobicContact CB-CE2 3.95Å; R158-F180 HydrophobicContact CB-CZ 3.72Å; R158-F180 HydrophobicContact CG-CD1 3.6Å; R158-F180 HydrophobicContact CG-CD2 4.16Å; R158-F180 HydrophobicContact CG-CE1 3.63Å; R158-F180 HydrophobicContact CG-CE2 4.15Å; R158-F180 HydrophobicContact CG-CG 3.89Å; R158-F180 HydrophobicContact CG-CZ 3.9Å; R158-E201 IonicContact CZ-OE1 3.91Å; R158-E201 IonicContact CZ-OE2 2.97Å; R158-E201 VanDerWaalsContact CZ-OE2 3.29Å; R158-E201 VanDerWaalsContact NE-CD 3.34Å; R158-E201 IonicContact NE-OE1 3.77Å; R158-E201 PolarHBondContact NE-OE1 3.41Å; R158-E201 IonicContact NE-OE2 3.38Å; R158-E201 PolarHBondContact NE-OE2 3.23Å; R158-E201 VanDerWaalsContact NE-OE2 3.08Å; R158-E201 IonicContact NH2-OE1 2.74Å; R158-E201 IonicContact NH2-OE2 2.68Å; R158-E201 PolarHBondContact NH2-OE2 3.08Å
159	Q	98.9	Very high	98.3	Very high	59 Å²	59	37.1 Å²	37.1	28%	0.276	18%	0.177	S	C	.	.	H	α-helix	trans	-61.9	-45.4	-179.7	-171.7	58.8	22	0	0	112.7	F155 D156 R157 I161 R162 E163	F155-Q159 VanDerWaalsContact O-CB 3.26Å; F155-Q159 WeakPolarHBondContact O-CB 3.24Å; F155-Q159 PolarHBondContact O-N 3.1Å; D156-Q159 PolarHBondContact O-N 3.47Å; R157-Q159 VanDerWaalsContact C-N 3.31Å; R157-Q159 PolarHBondContact O-N 3.5Å; Q159-I161 VanDerWaalsContact C-N 3.27Å; Q159-I161 PolarHBondContact O-N 3.34Å; Q159-R162 WeakPolarHBondContact O-CB 3.2Å; Q159-R162 PolarHBondContact O-N 3.31Å; Q159-R162 VanDerWaalsContact O-N 3.07Å; Q159-R162 VanDerWaalsContact OE1-NH1 3.16Å; Q159-E163 PolarHBondContact NE2-OE1 3.07Å; Q159-E163 WeakPolarHBondContact O-CG 3.46Å; Q159-E163 PolarHBondContact O-N 3.47Å
160	A	98.9	Very high	98	Very high	2 Å²	2	41.8 Å²	41.8	2%	0.017	20%	0.198	C	C	.	.	H	α-helix	trans	-60.3	-38.1	175.3	0	0	0	0	0	112.3	D156 R157 R158 E163 S164 P380 I384	D156-A160 WeakPolarHBondContact O-CB 3.45Å; D156-A160 PolarHBondContact O-N 3.19Å; R157-A160 PolarHBondContact O-N 3.03Å; R158-A160 PolarHBondContact O-N 2.95Å; A160-E163 PolarHBondContact O-N 3.41Å; A160-S164 VanDerWaalsContact O-CB 3.24Å; A160-S164 WeakPolarHBondContact O-CB 3.3Å; A160-S164 PolarHBondContact O-N 3.01Å; A160-S164 PolarHBondContact O-OG 2.88Å; A160-P380 HydrophobicContact CB-CB 3.59Å; A160-I384 HydrophobicContact CB-CD1 3.88Å; A160-I384 HydrophobicContact CB-CG1 3.97Å
161	I	98.9	Very high	97.5	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-63.1	-42.5	173.9	-66.9	170.3	0	0	0	110.8	I148 R157 R158 Q159 E163 S164 W165 G166 F180 D246 M383	I148-I161 HydrophobicContact CG2-CD1 4.06Å; R157-I161 VanDerWaalsContact O-CG1 3.23Å; R157-I161 WeakPolarHBondContact O-CG1 3.43Å; R157-I161 PolarHBondContact O-N 3.2Å; R158-I161 WeakPolarHBondContact O-CB 3.48Å; R158-I161 PolarHBondContact O-N 2.8Å; Q159-I161 VanDerWaalsContact C-N 3.27Å; Q159-I161 PolarHBondContact O-N 3.34Å; I161-E163 VanDerWaalsContact C-N 3.3Å; I161-E163 PolarHBondContact O-N 3.05Å; I161-S164 PolarHBondContact O-N 2.95Å; I161-W165 HydrophobicContact CB-CZ2 4.18Å; I161-W165 HydrophobicContact CD1-CH2 4.01Å; I161-W165 HydrophobicContact CD1-CZ2 3.49Å; I161-W165 VanDerWaalsContact CD1-CZ2 3.49Å; I161-W165 HydrophobicContact CG1-CH2 4.18Å; I161-W165 HydrophobicContact CG1-CZ2 3.42Å; I161-W165 VanDerWaalsContact CG1-CZ2 3.42Å; I161-W165 HydrophobicContact CG2-CD2 4.19Å; I161-W165 HydrophobicContact CG2-CE3 4.17Å; I161-W165 HydrophobicContact CG2-CH2 3.73Å; I161-W165 HydrophobicContact CG2-CZ2 3.74Å; I161-W165 HydrophobicContact CG2-CZ3 3.94Å; I161-G166 WeakPolarHBondContact O-CA 3.2Å; I161-G166 PolarHBondContact O-N 3.03Å; I161-F180 HydrophobicContact CB-CE1 4.32Å; I161-F180 HydrophobicContact CB-CZ 4.12Å; I161-F180 HydrophobicContact CD1-CE1 4.08Å; I161-F180 HydrophobicContact CG2-CE1 4.14Å; I161-F180 HydrophobicContact CG2-CZ 3.98Å; I161-D246 HydrophobicContact CD1-CB 3.98Å; I161-M383 HydrophobicContact CG1-SD 3.9Å
162	R	98.8	Very high	96.9	Very high	20 Å²	20	46.7 Å²	46.7	8%	0.075	25%	0.248	C	C	.	.	H	α-helix	trans	-60	-40.4	176.2	-58.6	-168.3	-179	95.2	5.5	112.5	R158 Q159 S164 F180 E201 H205 D207	R158-R162 VanDerWaalsContact O-CG 3.32Å; R158-R162 WeakPolarHBondContact O-CG 3.42Å; R158-R162 PolarHBondContact O-N 3.34Å; Q159-R162 WeakPolarHBondContact O-CB 3.2Å; Q159-R162 PolarHBondContact O-N 3.31Å; Q159-R162 VanDerWaalsContact O-N 3.07Å; Q159-R162 VanDerWaalsContact OE1-NH1 3.16Å; R162-S164 VanDerWaalsContact C-N 3.34Å; R162-F180 HydrophobicContact CG-CE2 4.24Å; R162-F180 HydrophobicContact CG-CZ 4.43Å; R162-E201 IonicContact CZ-OE1 3.25Å; R162-E201 VanDerWaalsContact CZ-OE1 3.23Å; R162-E201 IonicContact NH1-OE1 3.15Å; R162-E201 PolarHBondContact NH1-OE1 3.02Å; R162-E201 IonicContact NH2-OE1 3.63Å; R162-E201 PolarHBondContact NH2-OE1 2.77Å; R162-H205 VanDerWaalsContact NE-CG 3.35Å; R162-D207 IonicContact CZ-OD1 2.75Å; R162-D207 IonicContact CZ-OD2 3.74Å; R162-D207 IonicContact NE-OD1 3.09Å; R162-D207 PolarHBondContact NE-OD1 3.47Å; R162-D207 IonicContact NE-OD2 3.81Å; R162-D207 PolarHBondContact NE-OD2 2.88Å; R162-D207 IonicContact NH2-OD1 2.74Å; R162-D207 PolarHBondContact NH2-OD1 3.24Å; R162-D207 IonicContact NH2-OD2 2.69Å
163	E	98.4	Very high	96.2	Very high	108 Å²	108	54 Å²	54	51%	0.505	29%	0.287	S	S	.	.	H	α-helix	trans	-82.2	-12.5	-176.9	-69.2	177.1	-168.9	0	0	113.6	Q159 A160 I161	Q159-E163 PolarHBondContact NE2-OE1 3.07Å; Q159-E163 WeakPolarHBondContact O-CG 3.46Å; Q159-E163 PolarHBondContact O-N 3.47Å; A160-E163 PolarHBondContact O-N 3.41Å; I161-E163 VanDerWaalsContact C-N 3.3Å; I161-E163 PolarHBondContact O-N 3.05Å
164	S	98.6	Very high	95.9	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.5	-122.1	-176.2	68.4	0	0	0	0	112.2	A160 I161 R162 G166 K167	A160-S164 VanDerWaalsContact O-CB 3.24Å; A160-S164 WeakPolarHBondContact O-CB 3.3Å; A160-S164 PolarHBondContact O-N 3.01Å; A160-S164 PolarHBondContact O-OG 2.88Å; I161-S164 PolarHBondContact O-N 2.95Å; R162-S164 VanDerWaalsContact C-N 3.34Å; S164-G166 PolarHBondContact O-N 2.94Å; S164-K167 WeakPolarHBondContact O-CB 3.09Å; S164-K167 PolarHBondContact O-N 2.97Å
165	W	98.4	Very high	95.8	Very high	1 Å²	1	51.7 Å²	51.7	0%	0.004	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-23.1	-170.6	59	-99.2	0	0	0	114.3	I148 I161 K167 F242 V248 F249 V250 T252 W387	I148-W165 HydrophobicContact CD1-CH2 4.43Å; I148-W165 HydrophobicContact CD1-CZ3 4.4Å; I148-W165 HydrophobicContact CG1-CH2 3.68Å; I148-W165 HydrophobicContact CG1-CZ3 4.13Å; I161-W165 HydrophobicContact CB-CZ2 4.18Å; I161-W165 HydrophobicContact CD1-CH2 4.01Å; I161-W165 HydrophobicContact CD1-CZ2 3.49Å; I161-W165 VanDerWaalsContact CD1-CZ2 3.49Å; I161-W165 HydrophobicContact CG1-CH2 4.18Å; I161-W165 HydrophobicContact CG1-CZ2 3.42Å; I161-W165 VanDerWaalsContact CG1-CZ2 3.42Å; I161-W165 HydrophobicContact CG2-CD2 4.19Å; I161-W165 HydrophobicContact CG2-CE3 4.17Å; I161-W165 HydrophobicContact CG2-CH2 3.73Å; I161-W165 HydrophobicContact CG2-CZ2 3.74Å; I161-W165 HydrophobicContact CG2-CZ3 3.94Å; W165-K167 VanDerWaalsContact C-N 3.28Å; W165-K167 PolarHBondContact O-N 2.91Å; W165-F242 HydrophobicContact CH2-CE1 4.48Å; W165-F242 HydrophobicContact CZ3-CE1 4.29Å; W165-V248 HydrophobicContact CZ2-CG2 4.29Å; W165-V248 WeakPolarHBondContact CZ2-O 3.32Å; W165-V248 PolarHBondContact NE1-O 3.05Å; W165-V248 VanDerWaalsContact NE1-O 3.14Å; W165-F249 HydrophobicContact CB-CE2 4.36Å; W165-F249 AromaticContact CD1-CD2 3.81Å; W165-V250 HydrophobicContact CB-CB 4.32Å; W165-V250 WeakPolarHBondContact CB-O 3.5Å; W165-V250 HydrophobicContact CD2-CB 3.71Å; W165-V250 HydrophobicContact CD2-CG2 3.84Å; W165-V250 HydrophobicContact CE3-CB 3.6Å; W165-V250 HydrophobicContact CE3-CG1 4.44Å; W165-V250 HydrophobicContact CE3-CG2 3.67Å; W165-V250 HydrophobicContact CG-CB 4.07Å; W165-V250 HydrophobicContact CH2-CG2 3.84Å; W165-V250 HydrophobicContact CZ2-CG2 3.99Å; W165-V250 HydrophobicContact CZ3-CB 4.13Å; W165-V250 HydrophobicContact CZ3-CG2 3.68Å; W165-T252 WeakPolarHBondContact O-CB 3.41Å; W165-T252 PolarHBondContact O-OG1 3.06Å; W165-W387 HydrophobicContact CB-CE3 3.82Å; W165-W387 HydrophobicContact CB-CZ3 3.92Å
166	G	98.4	Very high	95.8	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-6	-178.9	0	0	0	0	0	113.9	I161 S164 E168 R178	I161-G166 WeakPolarHBondContact O-CA 3.2Å; I161-G166 PolarHBondContact O-N 3.03Å; S164-G166 PolarHBondContact O-N 2.94Å; G166-E168 PolarHBondContact O-N 3.38Å; G166-R178 WeakPolarHBondContact O-CD 3.44Å; G166-R178 PolarHBondContact O-NH1 3.35Å
167	K	97.1	Very high	95.7	Very high	129 Å²	129	47 Å²	47	56%	0.561	25%	0.25	S	C	*	.			trans	-50.4	132.9	-172	-169.7	173.5	-177.3	177.5	0	112.2	S164 W165	S164-K167 WeakPolarHBondContact O-CB 3.09Å; S164-K167 PolarHBondContact O-N 2.97Å; W165-K167 VanDerWaalsContact C-N 3.28Å; W165-K167 PolarHBondContact O-N 2.91Å
168	E	97.1	Very high	95.7	Very high	57 Å²	57	44.4 Å²	44.4	27%	0.266	24%	0.24	S	C	.	.			trans	-70.2	142.4	175.6	-64.8	-159.2	170.7	0	0	110.1	K137 G166 V176 K177 R178	K137-E168 IonicContact NZ-OE1 3.29Å; K137-E168 PolarHBondContact NZ-OE1 3.3Å; G166-E168 PolarHBondContact O-N 3.38Å; E168-V176 VanDerWaalsContact CA-O 3.32Å; E168-V176 WeakPolarHBondContact CA-O 3.45Å; E168-V176 WeakPolarHBondContact CB-O 3.35Å; E168-K177 HydrophobicContact CG-CD 4.5Å; E168-K177 VanDerWaalsContact OE2-CD 3.23Å; E168-K177 WeakPolarHBondContact OE2-CD 3.24Å; E168-K177 IonicContact OE2-NZ 2.68Å; E168-K177 PolarHBondContact OE2-NZ 3.36Å; E168-R178 HydrophobicContact CG-CB 4.26Å; E168-R178 PolarHBondContact OE1-N 2.88Å
169	I	95.3	Very high	95.7	Very high	47 Å²	47	44.4 Å²	44.4	24%	0.241	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	133.2	-177.2	-56.8	175.3	0	0	0	108.2	T175 V176 L256	I169-T175 CarbonylContact O-C 3.55Å; I169-T175 WeakPolarHBondContact O-CA 3.47Å; I169-V176 HydrophobicContact CB-CB 3.96Å; I169-V176 HydrophobicContact CB-CG2 3.98Å; I169-V176 HydrophobicContact CD1-CG2 4.08Å; I169-V176 HydrophobicContact CG1-CB 4.25Å; I169-V176 HydrophobicContact CG1-CG2 4.29Å; I169-V176 PolarHBondContact N-O 3.36Å; I169-V176 PolarHBondContact O-N 3.09Å; I169-L256 HydrophobicContact CD1-CD1 4.21Å
170	Q	92.3	Very high	95.7	Very high	112 Å²	112	41.6 Å²	41.6	52%	0.523	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	88.7	170.7	-169.7	76.7	37.9	0	0	107.3	T175	Q170-T175 PolarHBondContact NE2-OG1 3.1Å; Q170-T175 VanDerWaalsContact NE2-OG1 3.1Å; Q170-T175 VanDerWaalsContact OE1-CG2 3.32Å
171	S	88.7	Confident	95.7	Very high	81 Å²	81	41.5 Å²	41.5	57%	0.566	23%	0.226	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-141.8	114.1	-176.8	-170.8	0	0	0	0	111.2	D173 V174	S171-D173 PolarHBondContact O-N 3.03Å; S171-V174 PolarHBondContact N-O 2.87Å; S171-V174 PolarHBondContact O-N 3.09Å
172	G	85.3	Confident	95.7	Very high	71 Å²	71	41.5 Å²	41.5	73%	0.732	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.2	-130	-173.8	0	0	0	0	0	111.5	V174	G172-V174 VanDerWaalsContact C-N 3.26Å; G172-V174 PolarHBondContact O-N 3.19Å
173	D	82.8	Confident	95.7	Very high	160 Å²	160	40.5 Å²	40.5	86%	0.856	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-4.1	178.1	-59.5	-35.6	0	0	0	113.6	S171	S171-D173 PolarHBondContact O-N 3.03Å
174	V	91.6	Very high	95.7	Very high	24 Å²	24	38.3 Å²	38.3	15%	0.145	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	106.7	-179.3	-176.3	0	0	0	0	109.6	F143 S171 G172 V176 L256	F143-V174 HydrophobicContact CD1-CG1 4.25Å; S171-V174 PolarHBondContact N-O 2.87Å; S171-V174 PolarHBondContact O-N 3.09Å; G172-V174 VanDerWaalsContact C-N 3.26Å; G172-V174 PolarHBondContact O-N 3.19Å; V174-V176 HydrophobicContact CG1-CG2 4.27Å; V174-L256 HydrophobicContact CG1-CD1 4.28Å; V174-L256 HydrophobicContact CG1-CD2 3.92Å
175	T	96.6	Very high	95.5	Very high	9 Å²	9	39 Å²	39	6%	0.055	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	120	172	-60.8	0	0	0	0	109.9	F143 L144 I169 Q170 K177	F143-T175 WeakPolarHBondContact CA-O 3.28Å; F143-T175 WeakPolarHBondContact CB-O 3.38Å; F143-T175 PolarHBondContact N-O 2.9Å; L144-T175 PolarHBondContact N-O 2.68Å; L144-T175 VanDerWaalsContact N-O 3.08Å; I169-T175 CarbonylContact O-C 3.55Å; I169-T175 WeakPolarHBondContact O-CA 3.47Å; Q170-T175 PolarHBondContact NE2-OG1 3.1Å; Q170-T175 VanDerWaalsContact NE2-OG1 3.1Å; Q170-T175 VanDerWaalsContact OE1-CG2 3.32Å; T175-K177 HydrophobicContact CG2-CD 4.37Å; T175-K177 HydrophobicContact CG2-CG 4.11Å
176	V	98.2	Very high	95.3	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	122.9	174.1	-175.3	0	0	0	0	109	L144 L146 E168 I169 V174 L256	L144-V176 HydrophobicContact CB-CG1 4.41Å; L144-V176 HydrophobicContact CB-CG2 4.24Å; L144-V176 HydrophobicContact CD2-CG1 4.36Å; L144-V176 HydrophobicContact CG-CG1 4.44Å; L144-V176 VanDerWaalsContact O-CA 3.32Å; L144-V176 WeakPolarHBondContact O-CA 3.43Å; L146-V176 HydrophobicContact CD1-CG1 3.89Å; L146-V176 HydrophobicContact CG-CG1 3.9Å; E168-V176 VanDerWaalsContact CA-O 3.32Å; E168-V176 WeakPolarHBondContact CA-O 3.45Å; E168-V176 WeakPolarHBondContact CB-O 3.35Å; I169-V176 HydrophobicContact CB-CB 3.96Å; I169-V176 HydrophobicContact CB-CG2 3.98Å; I169-V176 HydrophobicContact CD1-CG2 4.08Å; I169-V176 HydrophobicContact CG1-CB 4.25Å; I169-V176 HydrophobicContact CG1-CG2 4.29Å; I169-V176 PolarHBondContact N-O 3.36Å; I169-V176 PolarHBondContact O-N 3.09Å; V174-V176 HydrophobicContact CG1-CG2 4.27Å; V176-L256 HydrophobicContact CG2-CD1 4.19Å; V176-L256 HydrophobicContact CG2-CD2 3.97Å
177	K	98.3	Very high	94.9	Very high	35 Å²	35	44.3 Å²	44.3	15%	0.152	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	154.3	178	-68.7	-53.5	-168.9	-170.7	0	110.8	K137 P142 L144 L145 L146 E168 T175	K137-K177 HydrophobicContact CD-CB 3.99Å; K137-K177 HydrophobicContact CD-CD 4.18Å; K137-K177 HydrophobicContact CD-CG 4.33Å; K137-K177 HydrophobicContact CG-CB 4.34Å; P142-K177 HydrophobicContact CB-CB 4.22Å; P142-K177 HydrophobicContact CB-CG 4.02Å; P142-K177 HydrophobicContact CG-CB 4.19Å; P142-K177 HydrophobicContact CG-CG 3.88Å; L144-K177 PolarHBondContact O-N 2.89Å; L145-K177 HydrophobicContact CD1-CB 4.11Å; L146-K177 PolarHBondContact N-O 3.13Å; E168-K177 HydrophobicContact CG-CD 4.5Å; E168-K177 VanDerWaalsContact OE2-CD 3.23Å; E168-K177 WeakPolarHBondContact OE2-CD 3.24Å; E168-K177 IonicContact OE2-NZ 2.68Å; E168-K177 PolarHBondContact OE2-NZ 3.36Å; T175-K177 HydrophobicContact CG2-CD 4.37Å; T175-K177 HydrophobicContact CG2-CG 4.11Å
178	R	98.6	Very high	94.7	Very high	17 Å²	17	45.4 Å²	45.4	6%	0.064	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	140.9	-178.3	-175.4	-178.8	61.3	-98	-6.9	111.4	K137 L146 I148 G166 E168 F180 D207	K137-R178 VanDerWaalsContact CE-O 3.28Å; K137-R178 WeakPolarHBondContact CE-O 3.23Å; K137-R178 PolarHBondContact NZ-O 2.85Å; L146-R178 HydrophobicContact CB-CB 4.4Å; L146-R178 HydrophobicContact CB-CG 4.32Å; L146-R178 CarbonylContact O-C 3.53Å; L146-R178 WeakPolarHBondContact O-CA 3.33Å; I148-R178 HydrophobicContact CD1-CG 3.76Å; G166-R178 WeakPolarHBondContact O-CD 3.44Å; G166-R178 PolarHBondContact O-NH1 3.35Å; E168-R178 HydrophobicContact CG-CB 4.26Å; E168-R178 PolarHBondContact OE1-N 2.88Å; R178-F180 HydrophobicContact CG-CE2 4.45Å; R178-D207 IonicContact CZ-OD2 2.89Å; R178-D207 IonicContact NE-OD2 3.31Å; R178-D207 PolarHBondContact NE-OD2 2.95Å; R178-D207 IonicContact NH2-OD2 2.95Å; R178-D207 PolarHBondContact NH2-OD2 2.8Å
179	V	98.9	Very high	94.5	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	142.2	167.2	-65	0	0	0	0	110.6	K137 L145 L146 A147 I148 L181 D207 L209 F227 W230	K137-V179 HydrophobicContact CD-CG1 4.35Å; K137-V179 HydrophobicContact CG-CG1 3.8Å; L145-V179 HydrophobicContact CD1-CG1 4.41Å; L145-V179 HydrophobicContact CD1-CG2 4.16Å; L146-V179 PolarHBondContact O-N 3.31Å; A147-V179 WeakPolarHBondContact CA-O 3.08Å; A147-V179 HydrophobicContact CB-CG2 4.12Å; I148-V179 PolarHBondContact N-O 2.82Å; V179-L181 HydrophobicContact CG2-CD2 4.1Å; V179-D207 CarbonylContact C-O 3.56Å; V179-D207 WeakPolarHBondContact CA-O 3.49Å; V179-L209 HydrophobicContact CB-CD1 3.98Å; V179-L209 HydrophobicContact CB-CG 4.18Å; V179-L209 HydrophobicContact CG1-CD1 4.13Å; V179-L209 HydrophobicContact CG1-CG 4.3Å; V179-L209 HydrophobicContact CG2-CD1 4.08Å; V179-F227 HydrophobicContact CG2-CE2 4.31Å; V179-W230 HydrophobicContact CG1-CH2 4.15Å
180	F	98.9	Very high	94.5	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	135.1	169.1	-64	-77.8	0	0	0	109.8	I148 R158 I161 R162 R178 L182 D207 I208 L209	I148-F180 HydrophobicContact CB-CD1 3.61Å; I148-F180 HydrophobicContact CB-CE1 3.83Å; I148-F180 HydrophobicContact CG1-CD1 4.4Å; I148-F180 HydrophobicContact CG1-CE1 4.19Å; I148-F180 HydrophobicContact CG2-CD1 3.82Å; I148-F180 HydrophobicContact CG2-CE1 3.89Å; I148-F180 CarbonylContact O-C 3.53Å; I148-F180 VanDerWaalsContact O-CA 3.32Å; I148-F180 WeakPolarHBondContact O-CA 3.33Å; R158-F180 HydrophobicContact CB-CD1 4.36Å; R158-F180 HydrophobicContact CB-CD2 4.39Å; R158-F180 HydrophobicContact CB-CE1 3.95Å; R158-F180 HydrophobicContact CB-CE2 3.95Å; R158-F180 HydrophobicContact CB-CZ 3.72Å; R158-F180 HydrophobicContact CG-CD1 3.6Å; R158-F180 HydrophobicContact CG-CD2 4.16Å; R158-F180 HydrophobicContact CG-CE1 3.63Å; R158-F180 HydrophobicContact CG-CE2 4.15Å; R158-F180 HydrophobicContact CG-CG 3.89Å; R158-F180 HydrophobicContact CG-CZ 3.9Å; I161-F180 HydrophobicContact CB-CE1 4.32Å; I161-F180 HydrophobicContact CB-CZ 4.12Å; I161-F180 HydrophobicContact CD1-CE1 4.08Å; I161-F180 HydrophobicContact CG2-CE1 4.14Å; I161-F180 HydrophobicContact CG2-CZ 3.98Å; R162-F180 HydrophobicContact CG-CE2 4.24Å; R162-F180 HydrophobicContact CG-CZ 4.43Å; R178-F180 HydrophobicContact CG-CE2 4.45Å; F180-L182 HydrophobicContact CB-CD1 3.66Å; F180-D207 HydrophobicContact CD2-CB 4.48Å; F180-D207 WeakPolarHBondContact CE2-OD2 3.36Å; F180-D207 PolarHBondContact N-O 3.1Å; F180-I208 HydrophobicContact CB-CD1 3.89Å; F180-I208 HydrophobicContact CD2-CD1 3.94Å; F180-I208 HydrophobicContact CG-CD1 4.29Å; F180-L209 PolarHBondContact O-N 3.43Å
181	L	98.9	Very high	94.6	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	111.6	-174.9	-48.7	179.5	0	0	0	110.2	A147 I148 S150 V179 L209 W211 K223 F227	A147-L181 HydrophobicContact CB-CD1 4.25Å; I148-L181 PolarHBondContact O-N 2.98Å; S150-L181 PolarHBondContact N-O 2.96Å; S150-L181 VanDerWaalsContact N-O 3.09Å; S150-L181 VanDerWaalsContact O-O 3.12Å; V179-L181 HydrophobicContact CG2-CD2 4.1Å; L181-L209 HydrophobicContact CD2-CB 4.47Å; L181-L209 HydrophobicContact CD2-CD1 4.01Å; L181-W211 HydrophobicContact CB-CZ3 4.42Å; L181-W211 HydrophobicContact CD2-CH2 4.07Å; L181-W211 HydrophobicContact CD2-CZ3 4.09Å; L181-K223 HydrophobicContact CB-CD 3.94Å; L181-K223 HydrophobicContact CB-CG 3.97Å; L181-K223 WeakPolarHBondContact O-CE 3.35Å; L181-K223 PolarHBondContact O-NZ 2.8Å; L181-F227 HydrophobicContact CD1-CB 3.86Å; L181-F227 HydrophobicContact CD1-CD1 4.26Å; L181-F227 HydrophobicContact CD1-CD2 3.91Å; L181-F227 HydrophobicContact CD1-CG 3.72Å; L181-F227 HydrophobicContact CD2-CB 4.3Å; L181-F227 HydrophobicContact CD2-CD2 3.49Å; L181-F227 VanDerWaalsContact CD2-CD2 3.49Å; L181-F227 HydrophobicContact CD2-CE2 4.15Å; L181-F227 HydrophobicContact CD2-CG 4.1Å; L181-F227 HydrophobicContact CG-CD2 4.34Å
182	L	98.8	Very high	94.9	Very high	0 Å²	0	47 Å²	47	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	149.1	-176.1	-72.6	71.7	0	0	0	111.4	F180 I198 I208 L209 L210 W211	F180-L182 HydrophobicContact CB-CD1 3.66Å; L182-I198 HydrophobicContact CD2-CD1 3.69Å; L182-I198 HydrophobicContact CD2-CG1 4.15Å; L182-I208 HydrophobicContact CD1-CD1 4.46Å; L182-I208 HydrophobicContact CD1-CG2 4.34Å; L182-I208 HydrophobicContact CD2-CG2 4.4Å; L182-L209 PolarHBondContact N-O 3.29Å; L182-L210 HydrophobicContact CB-CD1 3.51Å; L182-L210 HydrophobicContact CD2-CD1 4.46Å; L182-L210 WeakPolarHBondContact O-CA 3.45Å; L182-W211 PolarHBondContact O-N 2.87Å
183	G	98.4	Very high	95.4	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	-175	156.6	0	0	0	0	0	111.2	L210 Y213 D215	G183-L210 WeakPolarHBondContact O-CD1 3.41Å; G183-Y213 CarbonylContact C-O 3.48Å; G183-D215 PolarHBondContact N-OD2 3.19Å
184	Q	97.6	Very high	96.1	Very high	61 Å²	61	43.7 Å²	43.7	29%	0.285	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	138.8	175	-68	-67.5	-13.5	0	0	111.5	P186 Y213 D215	Q184-P186 WeakPolarHBondContact O-CD 3.48Å; Q184-Y213 WeakPolarHBondContact CB-O 3.47Å; Q184-Y213 PolarHBondContact N-O 2.93Å; Q184-D215 WeakPolarHBondContact O-CB 3.24Å; Q184-D215 PolarHBondContact O-N 2.03Å
185	T	95.7	Very high	96.2	Very high	14 Å²	14	45.8 Å²	45.8	9%	0.086	25%	0.249	C	C	.	.			trans	-115.1	83.6	171.4	51	0	0	0	0	107.6	L151 T152 F191	L151-T185 HydrophobicContact CD2-CG2 4.18Å; T152-T185 WeakPolarHBondContact CB-OG1 3.47Å; T152-T185 PolarHBondContact OG1-OG1 2.88Å; T185-F191 HydrophobicContact CG2-CD1 4.3Å; T185-F191 HydrophobicContact CG2-CD2 4.35Å; T185-F191 HydrophobicContact CG2-CE1 4.21Å; T185-F191 HydrophobicContact CG2-CE2 4.26Å; T185-F191 HydrophobicContact CG2-CG 4.37Å; T185-F191 HydrophobicContact CG2-CZ 4.18Å; T185-F191 WeakPolarHBondContact O-CB 3.35Å
186	P	93.5	Very high	96.3	Very high	25 Å²	25	47.8 Å²	47.8	16%	0.162	27%	0.272	C	S	.	.			trans	-86.5	162.5	-162.5	41.4	-42	0	0	0	111.4	Q184 E188 D189 R214	Q184-P186 WeakPolarHBondContact O-CD 3.48Å; P186-E188 WeakPolarHBondContact CB-OE2 3.35Å; P186-E188 PolarHBondContact O-N 3.07Å; P186-D189 PolarHBondContact O-N 2.82Å; P186-D189 VanDerWaalsContact O-N 3.09Å; P186-R214 HydrophobicContact CG-CG 4.09Å
187	P	91.4	Very high	96.3	Very high	88 Å²	88	52.9 Å²	52.9	57%	0.571	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-61.7	-26.3	-175.2	-23.9	35.2	0	0	0	114.4	D189 N190	P187-D189 PolarHBondContact O-N 2.79Å; P187-D189 VanDerWaalsContact O-N 3.17Å; P187-N190 WeakPolarHBondContact O-CA 3.32Å; P187-N190 PolarHBondContact O-N 3.06Å
188	E	92.4	Very high	96.3	Very high	152 Å²	152	51.4 Å²	51.4	71%	0.71	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-61.3	-22.9	177.1	-59.2	76	-166.6	0	0	112.2	P186 N190	P186-E188 WeakPolarHBondContact CB-OE2 3.35Å; P186-E188 PolarHBondContact O-N 3.07Å; E188-N190 VanDerWaalsContact C-N 3.34Å
189	D	93.1	Very high	96.2	Very high	39 Å²	39	56.2 Å²	56.2	21%	0.209	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-92.9	9.6	174.9	-73.8	-25.6	0	0	0	113.4	P186 P187 F191 R214	P186-D189 PolarHBondContact O-N 2.82Å; P186-D189 VanDerWaalsContact O-N 3.09Å; P187-D189 PolarHBondContact O-N 2.79Å; P187-D189 VanDerWaalsContact O-N 3.17Å; D189-F191 VanDerWaalsContact C-N 3.29Å; D189-F191 HydrophobicContact CB-CD2 3.56Å; D189-F191 HydrophobicContact CB-CE2 3.76Å; D189-F191 PolarHBondContact O-N 3.2Å; D189-R214 VanDerWaalsContact CG-NE 3.32Å; D189-R214 IonicContact OD1-CZ 3.67Å; D189-R214 VanDerWaalsContact OD1-CZ 3.25Å; D189-R214 IonicContact OD1-NE 2.88Å; D189-R214 PolarHBondContact OD1-NE 2.83Å; D189-R214 VanDerWaalsContact OD1-NE 3.15Å; D189-R214 IonicContact OD1-NH2 2.84Å; D189-R214 PolarHBondContact OD1-NH2 2.95Å; D189-R214 WeakPolarHBondContact OD2-CG 3.23Å; D189-R214 IonicContact OD2-CZ 2.8Å; D189-R214 IonicContact OD2-NE 2.73Å; D189-R214 PolarHBondContact OD2-NE 2.73Å; D189-R214 IonicContact OD2-NH2 3.39Å
190	N	94.4	Very high	96.2	Very high	153 Å²	153	62.9 Å²	62.9	82%	0.818	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	26.7	-176.3	-47.1	-77.9	0	0	0	114.1	P187 E188	P187-N190 WeakPolarHBondContact O-CA 3.32Å; P187-N190 PolarHBondContact O-N 3.06Å; E188-N190 VanDerWaalsContact C-N 3.34Å
191	F	94.5	Very high	96.2	Very high	60 Å²	60	63.3 Å²	63.3	26%	0.263	34%	0.343	S	S	.	.			trans	-81.4	142.5	169.6	-73.6	-82.1	0	0	0	111.2	P153 T185 D189	P153-F191 HydrophobicContact CG-CD1 3.82Å; P153-F191 HydrophobicContact CG-CE1 3.99Å; T185-F191 HydrophobicContact CG2-CD1 4.3Å; T185-F191 HydrophobicContact CG2-CD2 4.35Å; T185-F191 HydrophobicContact CG2-CE1 4.21Å; T185-F191 HydrophobicContact CG2-CE2 4.26Å; T185-F191 HydrophobicContact CG2-CG 4.37Å; T185-F191 HydrophobicContact CG2-CZ 4.18Å; T185-F191 WeakPolarHBondContact O-CB 3.35Å; D189-F191 VanDerWaalsContact C-N 3.29Å; D189-F191 HydrophobicContact CB-CD2 3.56Å; D189-F191 HydrophobicContact CB-CE2 3.76Å; D189-F191 PolarHBondContact O-N 3.2Å
192	P	95.4	Very high	96.2	Very high	79 Å²	79	64 Å²	64	51%	0.513	35%	0.347	S	S	.	.			trans	-67.6	151.5	169.6	29.5	-33.8	0	0	0	110.6	L194	P192-L194 HydrophobicContact CB-CG 4.44Å; P192-L194 HydrophobicContact CG-CD1 3.89Å; P192-L194 HydrophobicContact CG-CD2 4.49Å; P192-L194 HydrophobicContact CG-CG 4.03Å; P192-L194 PolarHBondContact O-N 2.87Å; P192-L194 VanDerWaalsContact O-N 3.1Å
193	D	95.5	Very high	96.2	Very high	130 Å²	130	69.9 Å²	69.9	70%	0.695	38%	0.375	S	S	*	.			trans	-70.1	108.1	171.5	-177.9	8.8	0	0	0	110.2	S195	D193-S195 WeakPolarHBondContact OD1-CB 3.5Å; D193-S195 PolarHBondContact OD1-N 2.64Å; D193-S195 PolarHBondContact OD1-OG 3.42Å
194	L	96.9	Very high	96.2	Very high	31 Å²	31	73.5 Å²	73.5	16%	0.162	40%	0.397	C	S	.	.			trans	-116.1	14.9	178.5	-63.2	168.2	0	0	0	111.6	T152 P153 F155 P192 G196 M197 I198	T152-L194 HydrophobicContact CG2-CB 3.94Å; P153-L194 HydrophobicContact CB-CD1 3.88Å; P153-L194 HydrophobicContact CG-CD1 3.92Å; F155-L194 HydrophobicContact CE2-CB 4.39Å; F155-L194 HydrophobicContact CE2-CD1 4.07Å; F155-L194 HydrophobicContact CE2-CD2 4.35Å; F155-L194 HydrophobicContact CZ-CB 4.38Å; P192-L194 HydrophobicContact CB-CG 4.44Å; P192-L194 HydrophobicContact CG-CD1 3.89Å; P192-L194 HydrophobicContact CG-CD2 4.49Å; P192-L194 HydrophobicContact CG-CG 4.03Å; P192-L194 PolarHBondContact O-N 2.87Å; P192-L194 VanDerWaalsContact O-N 3.1Å; L194-G196 VanDerWaalsContact C-N 3.34Å; L194-G196 PolarHBondContact O-N 3.28Å; L194-M197 HydrophobicContact CD2-SD 3.65Å; L194-M197 PolarHBondContact O-N 3.24Å; L194-M197 VanDerWaalsContact O-N 3.09Å; L194-I198 PolarHBondContact O-N 2.97Å
195	S	94.9	Very high	96.2	Very high	68 Å²	68	73.7 Å²	73.7	48%	0.476	40%	0.398	S	S	.	.	H	α-helix	trans	-58.3	-41.5	-174.6	60.4	0	0	0	0	113	D193 I198 K199	D193-S195 WeakPolarHBondContact OD1-CB 3.5Å; D193-S195 PolarHBondContact OD1-N 2.64Å; D193-S195 PolarHBondContact OD1-OG 3.42Å; S195-I198 VanDerWaalsContact O-CG2 3.26Å; S195-I198 WeakPolarHBondContact O-CG2 3.46Å; S195-K199 WeakPolarHBondContact O-CB 2.98Å; S195-K199 PolarHBondContact O-N 3.14Å; S195-K199 VanDerWaalsContact O-N 3.1Å
196	G	97.1	Very high	96.3	Very high	52 Å²	52	79 Å²	79	54%	0.536	42%	0.422	S	S	.	.	H	α-helix	trans	-64	-41.6	174.8	0	0	0	0	0	112.8	L194 K199 F200	L194-G196 VanDerWaalsContact C-N 3.34Å; L194-G196 PolarHBondContact O-N 3.28Å; G196-K199 PolarHBondContact O-N 2.6Å; G196-F200 PolarHBondContact O-N 2.88Å
197	M	98.3	Very high	96.6	Very high	107 Å²	107	77.8 Å²	77.8	53%	0.527	41%	0.414	S	S	.	.	H	α-helix	trans	-69.3	-43.2	-179.5	-66.7	-178.5	68.3	0	0	112.1	F155 L194 K199 F200 E201	F155-M197 HydrophobicContact CD2-CE 4.45Å; F155-M197 HydrophobicContact CE1-CB 4.04Å; F155-M197 HydrophobicContact CE2-CB 4.3Å; F155-M197 HydrophobicContact CE2-CE 4.18Å; F155-M197 HydrophobicContact CZ-CB 3.58Å; F155-M197 HydrophobicContact CZ-CE 4.43Å; L194-M197 HydrophobicContact CD2-SD 3.65Å; L194-M197 PolarHBondContact O-N 3.24Å; L194-M197 VanDerWaalsContact O-N 3.09Å; M197-K199 VanDerWaalsContact C-N 3.33Å; M197-K199 PolarHBondContact O-N 3.31Å; M197-F200 PolarHBondContact O-N 3.35Å; M197-E201 WeakPolarHBondContact O-CB 3.01Å; M197-E201 PolarHBondContact O-N 3.4Å
198	I	98.3	Very high	96.9	Very high	4 Å²	4	73.6 Å²	73.6	2%	0.021	39%	0.387	C	S	.	.	H	α-helix	trans	-68.1	-34.2	177.9	-169.3	60.1	0	0	0	111.9	M132 T152 F155 L182 L194 S195 E201 S202 I208	M132-I198 HydrophobicContact CE-CG2 4.12Å; T152-I198 HydrophobicContact CG2-CB 3.96Å; T152-I198 HydrophobicContact CG2-CG1 4.29Å; T152-I198 HydrophobicContact CG2-CG2 4.15Å; F155-I198 HydrophobicContact CE1-CD1 4.33Å; L182-I198 HydrophobicContact CD2-CD1 3.69Å; L182-I198 HydrophobicContact CD2-CG1 4.15Å; L194-I198 PolarHBondContact O-N 2.97Å; S195-I198 VanDerWaalsContact O-CG2 3.26Å; S195-I198 WeakPolarHBondContact O-CG2 3.46Å; I198-E201 WeakPolarHBondContact CD1-OE2 3.32Å; I198-E201 PolarHBondContact O-N 3.38Å; I198-S202 WeakPolarHBondContact O-CB 3.43Å; I198-S202 PolarHBondContact O-N 2.78Å; I198-I208 HydrophobicContact CD1-CD1 4.31Å; I198-I208 HydrophobicContact CD1-CG1 4.31Å; I198-I208 HydrophobicContact CD1-CG2 4.22Å; I198-I208 HydrophobicContact CG1-CG2 4.45Å
199	K	98.3	Very high	97.2	Very high	118 Å²	118	66.3 Å²	66.3	51%	0.513	35%	0.353	S	S	.	.	H	α-helix	trans	-63.6	-45.7	172.7	-175.9	178	179.7	179.7	0	111.4	M132 S195 G196 M197 S202 Q203	M132-K199 HydrophobicContact CE-CB 3.99Å; S195-K199 WeakPolarHBondContact O-CB 2.98Å; S195-K199 PolarHBondContact O-N 3.14Å; S195-K199 VanDerWaalsContact O-N 3.1Å; G196-K199 PolarHBondContact O-N 2.6Å; M197-K199 VanDerWaalsContact C-N 3.33Å; M197-K199 PolarHBondContact O-N 3.31Å; K199-S202 PolarHBondContact O-N 3.39Å; K199-Q203 VanDerWaalsContact O-CG 3.31Å; K199-Q203 WeakPolarHBondContact O-CG 3.14Å; K199-Q203 PolarHBondContact O-N 3.2Å
200	F	98.6	Very high	97.5	Very high	139 Å²	139	64.7 Å²	64.7	61%	0.61	34%	0.344	S	S	*	.	H	α-helix	trans	-60	-49.6	175.2	178.2	-100.1	0	0	0	111.1	G196 M197 S202 Q203 T204	G196-F200 PolarHBondContact O-N 2.88Å; M197-F200 PolarHBondContact O-N 3.35Å; F200-S202 VanDerWaalsContact C-N 3.33Å; F200-S202 PolarHBondContact O-N 2.95Å; F200-Q203 PolarHBondContact O-N 3.33Å; F200-Q203 VanDerWaalsContact O-N 3.13Å; F200-T204 PolarHBondContact O-N 3.15Å; F200-T204 PolarHBondContact O-OG1 3.01Å; F200-T204 VanDerWaalsContact O-OG1 3.04Å
201	E	98.8	Very high	97.7	Very high	10 Å²	10	57.9 Å²	57.9	5%	0.047	31%	0.307	C	S	.	.	H	α-helix	trans	-56	-45.8	177.2	-172.5	-172.6	-172.8	0	0	112.2	F155 R158 R162 M197 I198 Q203 T204 H205	F155-E201 WeakPolarHBondContact CD1-OE2 3.29Å; F155-E201 HydrophobicContact CE1-CB 4.32Å; F155-E201 WeakPolarHBondContact CE1-OE2 3.4Å; R158-E201 IonicContact CZ-OE1 3.91Å; R158-E201 IonicContact CZ-OE2 2.97Å; R158-E201 VanDerWaalsContact CZ-OE2 3.29Å; R158-E201 VanDerWaalsContact NE-CD 3.34Å; R158-E201 IonicContact NE-OE1 3.77Å; R158-E201 PolarHBondContact NE-OE1 3.41Å; R158-E201 IonicContact NE-OE2 3.38Å; R158-E201 PolarHBondContact NE-OE2 3.23Å; R158-E201 VanDerWaalsContact NE-OE2 3.08Å; R158-E201 IonicContact NH2-OE1 2.74Å; R158-E201 IonicContact NH2-OE2 2.68Å; R158-E201 PolarHBondContact NH2-OE2 3.08Å; R162-E201 IonicContact CZ-OE1 3.25Å; R162-E201 VanDerWaalsContact CZ-OE1 3.23Å; R162-E201 IonicContact NH1-OE1 3.15Å; R162-E201 PolarHBondContact NH1-OE1 3.02Å; R162-E201 IonicContact NH2-OE1 3.63Å; R162-E201 PolarHBondContact NH2-OE1 2.77Å; M197-E201 WeakPolarHBondContact O-CB 3.01Å; M197-E201 PolarHBondContact O-N 3.4Å; I198-E201 WeakPolarHBondContact CD1-OE2 3.32Å; I198-E201 PolarHBondContact O-N 3.38Å; E201-Q203 VanDerWaalsContact C-N 3.35Å; E201-Q203 PolarHBondContact O-N 3.03Å; E201-T204 PolarHBondContact O-N 3.43Å; E201-H205 PolarHBondContact O-CD2 3.35Å; E201-H205 PolarHBondContact O-N 3.06Å
202	S	98.6	Very high	97.9	Very high	13 Å²	13	58.8 Å²	58.8	9%	0.091	32%	0.315	C	S	.	.	H	α-helix	trans	-61.1	-41.8	177.3	178.2	0	0	0	0	112.2	Q134 I198 K199 F200 Q206	Q134-S202 PolarHBondContact NE2-OG 2.65Å; Q134-S202 VanDerWaalsContact NE2-OG 3.15Å; I198-S202 WeakPolarHBondContact O-CB 3.43Å; I198-S202 PolarHBondContact O-N 2.78Å; K199-S202 PolarHBondContact O-N 3.39Å; F200-S202 VanDerWaalsContact C-N 3.33Å; F200-S202 PolarHBondContact O-N 2.95Å; S202-Q206 VanDerWaalsContact O-CA 3.27Å; S202-Q206 WeakPolarHBondContact O-CA 3.37Å; S202-Q206 PolarHBondContact O-N 3.34Å
203	Q	98.2	Very high	97.9	Very high	124 Å²	124	55.2 Å²	55.2	58%	0.579	29%	0.291	S	S	*	.	H	α-helix	trans	-67.8	-38.4	177.6	-72.7	174.3	-19	0	0	112.2	K199 F200 E201	K199-Q203 VanDerWaalsContact O-CG 3.31Å; K199-Q203 WeakPolarHBondContact O-CG 3.14Å; K199-Q203 PolarHBondContact O-N 3.2Å; F200-Q203 PolarHBondContact O-N 3.33Å; F200-Q203 VanDerWaalsContact O-N 3.13Å; E201-Q203 VanDerWaalsContact C-N 3.35Å; E201-Q203 PolarHBondContact O-N 3.03Å
204	T	98.4	Very high	98	Very high	76 Å²	76	53.7 Å²	53.7	47%	0.466	28%	0.275	S	S	.	.	H	α-helix	trans	-73.1	-44.7	-179.3	-58.2	0	0	0	0	112.5	F200 E201	F200-T204 PolarHBondContact O-N 3.15Å; F200-T204 PolarHBondContact O-OG1 3.01Å; F200-T204 VanDerWaalsContact O-OG1 3.04Å; E201-T204 PolarHBondContact O-N 3.43Å
205	H	98.4	Very high	98	Very high	66 Å²	66	52.6 Å²	52.6	31%	0.306	27%	0.27	S	S	.	.	H	α-helix	trans	-104.8	-15.5	-170.5	-62	-67.6	0	0	0	114.7	R162 E201 D207	R162-H205 VanDerWaalsContact NE-CG 3.35Å; E201-H205 PolarHBondContact O-CD2 3.35Å; E201-H205 PolarHBondContact O-N 3.06Å; H205-D207 WeakPolarHBondContact CB-OD1 3.16Å; H205-D207 PolarHBondContact O-N 2.9Å; H205-D207 VanDerWaalsContact O-N 3.15Å
206	Q	98.3	Very high	98.1	Very high	124 Å²	124	51.3 Å²	51.3	58%	0.579	26%	0.259	S	S	*	.	S	Bend	trans	51.5	38.3	177.1	-57.2	-175.3	-40.4	0	0	113.3	Q134 K137 S202	Q134-Q206 VanDerWaalsContact OE1-C 3.31Å; Q134-Q206 VanDerWaalsContact OE1-CA 3.24Å; Q134-Q206 PolarHBondContact OE1-O 2.68Å; K137-Q206 WeakPolarHBondContact CE-O 3.45Å; K137-Q206 PolarHBondContact NZ-O 3.47Å; S202-Q206 VanDerWaalsContact O-CA 3.27Å; S202-Q206 WeakPolarHBondContact O-CA 3.37Å; S202-Q206 PolarHBondContact O-N 3.34Å
207	D	98.6	Very high	98.1	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.246	C	C	.	.			trans	-135.7	17.4	-175.3	65.7	4.1	0	0	0	113.6	R162 R178 V179 F180 H205	R162-D207 IonicContact CZ-OD1 2.75Å; R162-D207 IonicContact CZ-OD2 3.74Å; R162-D207 IonicContact NE-OD1 3.09Å; R162-D207 PolarHBondContact NE-OD1 3.47Å; R162-D207 IonicContact NE-OD2 3.81Å; R162-D207 PolarHBondContact NE-OD2 2.88Å; R162-D207 IonicContact NH2-OD1 2.74Å; R162-D207 PolarHBondContact NH2-OD1 3.24Å; R162-D207 IonicContact NH2-OD2 2.69Å; R178-D207 IonicContact CZ-OD2 2.89Å; R178-D207 IonicContact NE-OD2 3.31Å; R178-D207 PolarHBondContact NE-OD2 2.95Å; R178-D207 IonicContact NH2-OD2 2.95Å; R178-D207 PolarHBondContact NH2-OD2 2.8Å; V179-D207 CarbonylContact C-O 3.56Å; V179-D207 WeakPolarHBondContact CA-O 3.49Å; F180-D207 HydrophobicContact CD2-CB 4.48Å; F180-D207 WeakPolarHBondContact CE2-OD2 3.36Å; F180-D207 PolarHBondContact N-O 3.1Å; H205-D207 WeakPolarHBondContact CB-OD1 3.16Å; H205-D207 PolarHBondContact O-N 2.9Å; H205-D207 VanDerWaalsContact O-N 3.15Å
208	I	98.9	Very high	98	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	127.5	178	-57	-58.8	0	0	0	110.2	Q134 F180 L182 I198 L210	Q134-I208 WeakPolarHBondContact CG-O 3.44Å; Q134-I208 PolarHBondContact NE2-O 3.42Å; F180-I208 HydrophobicContact CB-CD1 3.89Å; F180-I208 HydrophobicContact CD2-CD1 3.94Å; F180-I208 HydrophobicContact CG-CD1 4.29Å; L182-I208 HydrophobicContact CD1-CD1 4.46Å; L182-I208 HydrophobicContact CD1-CG2 4.34Å; L182-I208 HydrophobicContact CD2-CG2 4.4Å; I198-I208 HydrophobicContact CD1-CD1 4.31Å; I198-I208 HydrophobicContact CD1-CG1 4.31Å; I198-I208 HydrophobicContact CD1-CG2 4.22Å; I198-I208 HydrophobicContact CG1-CG2 4.45Å; I208-L210 HydrophobicContact CG2-CB 4.33Å
209	L	98.9	Very high	98	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	117	163.8	-59.2	178.1	0	0	0	108.5	L130 M132 Q134 V179 F180 L181 L182 W211 W230	L130-L209 HydrophobicContact CD1-CB 4.36Å; M132-L209 WeakPolarHBondContact O-CA 3.41Å; Q134-L209 HydrophobicContact CB-CD2 4.31Å; Q134-L209 HydrophobicContact CG-CD2 4.14Å; V179-L209 HydrophobicContact CB-CD1 3.98Å; V179-L209 HydrophobicContact CB-CG 4.18Å; V179-L209 HydrophobicContact CG1-CD1 4.13Å; V179-L209 HydrophobicContact CG1-CG 4.3Å; V179-L209 HydrophobicContact CG2-CD1 4.08Å; F180-L209 PolarHBondContact O-N 3.43Å; L181-L209 HydrophobicContact CD2-CB 4.47Å; L181-L209 HydrophobicContact CD2-CD1 4.01Å; L182-L209 PolarHBondContact N-O 3.29Å; L209-W211 HydrophobicContact CB-CE3 4.28Å; L209-W211 HydrophobicContact CB-CH2 3.53Å; L209-W211 HydrophobicContact CB-CZ2 4.4Å; L209-W211 HydrophobicContact CB-CZ3 3.44Å; L209-W211 VanDerWaalsContact CB-CZ3 3.44Å; L209-W211 HydrophobicContact CD1-CH2 3.77Å; L209-W211 HydrophobicContact CD1-CZ3 4.47Å; L209-W211 HydrophobicContact CG-CH2 4.27Å; L209-W230 HydrophobicContact CD1-CD2 3.58Å; L209-W230 HydrophobicContact CD1-CE3 3.93Å; L209-W230 HydrophobicContact CD1-CG 4Å; L209-W230 HydrophobicContact CD1-CH2 4.31Å; L209-W230 HydrophobicContact CD1-CZ2 3.99Å; L209-W230 HydrophobicContact CD1-CZ3 4.28Å; L209-W230 HydrophobicContact CD2-CZ2 4.12Å
210	L	98.8	Very high	97.9	Very high	5 Å²	5	43.8 Å²	43.8	3%	0.026	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	117.3	-176.7	-178.9	71.4	0	0	0	110.3	L131 M132 L182 G183 I208	L131-L210 WeakPolarHBondContact CA-O 3.3Å; L131-L210 WeakPolarHBondContact CB-O 3.14Å; L131-L210 PolarHBondContact N-O 3.48Å; M132-L210 HydrophobicContact CB-CB 3.9Å; M132-L210 HydrophobicContact CE-CD2 3.8Å; M132-L210 HydrophobicContact CG-CB 4.04Å; M132-L210 HydrophobicContact CG-CD2 4.11Å; M132-L210 PolarHBondContact N-O 3.17Å; M132-L210 PolarHBondContact O-N 3.33Å; M132-L210 VanDerWaalsContact O-N 3.11Å; M132-L210 HydrophobicContact SD-CB 4.35Å; M132-L210 HydrophobicContact SD-CD2 3.98Å; L182-L210 HydrophobicContact CB-CD1 3.51Å; L182-L210 HydrophobicContact CD2-CD1 4.46Å; L182-L210 WeakPolarHBondContact O-CA 3.45Å; G183-L210 WeakPolarHBondContact O-CD1 3.41Å; I208-L210 HydrophobicContact CG2-CB 4.33Å
211	W	98.7	Very high	97.9	Very high	10 Å²	10	37.1 Å²	37.1	4%	0.038	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	155.4	175.5	-68.1	-98.2	0	0	0	112.5	S129 L130 L181 L182 L209 Y213 L226 W230	S129-W211 CarbonylContact O-C 3.44Å; S129-W211 WeakPolarHBondContact O-CA 3.43Å; L130-W211 HydrophobicContact CD1-CD2 3.67Å; L130-W211 HydrophobicContact CD1-CE3 4.21Å; L130-W211 HydrophobicContact CD1-CG 3.96Å; L130-W211 HydrophobicContact CD1-CH2 4.45Å; L130-W211 HydrophobicContact CD1-CZ2 3.94Å; L181-W211 HydrophobicContact CB-CZ3 4.42Å; L181-W211 HydrophobicContact CD2-CH2 4.07Å; L181-W211 HydrophobicContact CD2-CZ3 4.09Å; L182-W211 PolarHBondContact O-N 2.87Å; L209-W211 HydrophobicContact CB-CE3 4.28Å; L209-W211 HydrophobicContact CB-CH2 3.53Å; L209-W211 HydrophobicContact CB-CZ2 4.4Å; L209-W211 HydrophobicContact CB-CZ3 3.44Å; L209-W211 VanDerWaalsContact CB-CZ3 3.44Å; L209-W211 HydrophobicContact CD1-CH2 3.77Å; L209-W211 HydrophobicContact CD1-CZ3 4.47Å; L209-W211 HydrophobicContact CG-CH2 4.27Å; W211-Y213 HydrophobicContact CB-CD1 3.63Å; W211-Y213 HydrophobicContact CB-CE1 3.81Å; W211-Y213 PolarHBondContact O-N 3.13Å; W211-L226 HydrophobicContact CB-CD1 3.87Å; W211-L226 HydrophobicContact CD2-CB 4.08Å; W211-L226 HydrophobicContact CD2-CD1 4.34Å; W211-L226 HydrophobicContact CG-CB 4.25Å; W211-L226 HydrophobicContact CG-CD1 3.8Å; W211-L226 HydrophobicContact CG-CG 4.45Å; W211-L226 HydrophobicContact CZ2-CB 4.2Å; W211-L226 WeakPolarHBondContact CZ2-O 3.49Å; W211-W230 HydrophobicContact CZ2-CB 3.89Å; W211-W230 HydrophobicContact CZ2-CG 4.37Å
212	N	97.5	Very high	97.8	Very high	79 Å²	79	36.8 Å²	36.8	42%	0.422	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	49.2	-177	-162.8	30.7	0	0	0	114.3	Y128 S129 L131	Y128-N212 WeakPolarHBondContact CD1-O 3.43Å; S129-N212 PolarHBondContact O-N 2.74Å; S129-N212 WeakPolarHBondContact OG-CB 3.45Å; L131-N212 HydrophobicContact CD1-CB 3.69Å; L131-N212 HydrophobicContact CD2-CB 4Å; L131-N212 HydrophobicContact CG-CB 3.82Å
213	Y	97	Very high	97.8	Very high	3 Å²	3	36.3 Å²	36.3	1%	0.012	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	154.4	172.7	74.9	-81.7	0	0	0	110.5	G183 Q184 W211 D215 N219 L222 K223 L226	G183-Y213 CarbonylContact C-O 3.48Å; Q184-Y213 WeakPolarHBondContact CB-O 3.47Å; Q184-Y213 PolarHBondContact N-O 2.93Å; W211-Y213 HydrophobicContact CB-CD1 3.63Å; W211-Y213 HydrophobicContact CB-CE1 3.81Å; W211-Y213 PolarHBondContact O-N 3.13Å; Y213-D215 HydrophobicContact CE2-CB 4.34Å; Y213-D215 PolarHBondContact O-N 3.23Å; Y213-N219 HydrophobicContact CD2-CB 3.99Å; Y213-N219 HydrophobicContact CE2-CB 3.95Å; Y213-L222 HydrophobicContact CD1-CD2 4.35Å; Y213-L222 HydrophobicContact CD2-CD2 3.65Å; Y213-L222 HydrophobicContact CD2-CG 4.42Å; Y213-L222 HydrophobicContact CE2-CD2 4.43Å; Y213-L222 HydrophobicContact CG-CD2 3.62Å; Y213-L222 HydrophobicContact CG-CG 4.39Å; Y213-K223 VanDerWaalsContact OH-CB 3.25Å; Y213-K223 WeakPolarHBondContact OH-CB 3.44Å; Y213-K223 WeakPolarHBondContact OH-CE 3.11Å; Y213-K223 WeakPolarHBondContact OH-CG 3.39Å; Y213-L226 HydrophobicContact CD1-CD1 3.6Å; Y213-L226 HydrophobicContact CE1-CD1 3.83Å; Y213-L226 HydrophobicContact CG-CD1 4.43Å
214	R	97.3	Very high	97.8	Very high	99 Å²	99	30.5 Å²	30.5	37%	0.374	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	113.5	176.4	-173	-173.9	171.2	-158.4	1.9	110.5	D118 P186 D189 T216 N219	D118-R214 IonicContact OD2-CZ 3.71Å; D118-R214 IonicContact OD2-NH1 3.39Å; D118-R214 PolarHBondContact OD2-NH1 3.02Å; P186-R214 HydrophobicContact CG-CG 4.09Å; D189-R214 VanDerWaalsContact CG-NE 3.32Å; D189-R214 IonicContact OD1-CZ 3.67Å; D189-R214 VanDerWaalsContact OD1-CZ 3.25Å; D189-R214 IonicContact OD1-NE 2.88Å; D189-R214 PolarHBondContact OD1-NE 2.83Å; D189-R214 VanDerWaalsContact OD1-NE 3.15Å; D189-R214 IonicContact OD1-NH2 2.84Å; D189-R214 PolarHBondContact OD1-NH2 2.95Å; D189-R214 WeakPolarHBondContact OD2-CG 3.23Å; D189-R214 IonicContact OD2-CZ 2.8Å; D189-R214 IonicContact OD2-NE 2.73Å; D189-R214 PolarHBondContact OD2-NE 2.73Å; D189-R214 IonicContact OD2-NH2 3.39Å; R214-T216 HydrophobicContact CG-CG2 3.85Å; R214-T216 PolarHBondContact O-N 3.41Å; R214-T216 VanDerWaalsContact O-N 3.11Å; R214-N219 PolarHBondContact O-ND2 2.63Å
215	D	97.6	Very high	97.8	Very high	8 Å²	8	26.9 Å²	26.9	4%	0.043	13%	0.127	C	C	.	.			trans	-78.4	93.9	-175.1	-156.1	-22.4	0	0	0	111.1	L151 G183 Q184 Y213 K223	L151-D215 HydrophobicContact CD2-CB 3.9Å; L151-D215 VanDerWaalsContact CD2-CG 3.42Å; G183-D215 PolarHBondContact N-OD2 3.19Å; Q184-D215 WeakPolarHBondContact O-CB 3.24Å; Q184-D215 PolarHBondContact O-N 2.03Å; Y213-D215 HydrophobicContact CE2-CB 4.34Å; Y213-D215 PolarHBondContact O-N 3.23Å; D215-K223 WeakPolarHBondContact OD1-CE 3.47Å; D215-K223 IonicContact OD1-NZ 3.35Å; D215-K223 PolarHBondContact OD1-NZ 2.92Å; D215-K223 VanDerWaalsContact OD2-CE 3.28Å; D215-K223 WeakPolarHBondContact OD2-CE 3.42Å; D215-K223 IonicContact OD2-NZ 2.88Å; D215-K223 PolarHBondContact OD2-NZ 2.87Å
216	T	96.7	Very high	97.8	Very high	40 Å²	40	24 Å²	24	25%	0.245	11%	0.114	C	C	.	.			trans	-124.1	163.7	178.3	72.2	0	0	0	0	110.4	R214 F218 N219 L220	R214-T216 HydrophobicContact CG-CG2 3.85Å; R214-T216 PolarHBondContact O-N 3.41Å; R214-T216 VanDerWaalsContact O-N 3.11Å; T216-F218 VanDerWaalsContact C-N 3.27Å; T216-F218 PolarHBondContact O-N 2.94Å; T216-N219 CarbonylContact O-C 3.57Å; T216-N219 PolarHBondContact O-N 3.31Å; T216-N219 PolarHBondContact OG1-N 2.98Å; T216-N219 PolarHBondContact OG1-ND2 3.26Å; T216-L220 PolarHBondContact O-N 2.78Å
217	F	95.5	Very high	97.8	Very high	59 Å²	59	18 Å²	18	26%	0.259	9%	0.086	S	C	.	.	G	3₁₀ helix	trans	-54.8	-39.9	178.1	-179.3	-99.5	0	0	0	113.1	N219 L220 Y289	F217-N219 VanDerWaalsContact C-N 3.31Å; F217-N219 PolarHBondContact O-N 2.84Å; F217-L220 HydrophobicContact CD2-CD1 3.68Å; F217-L220 HydrophobicContact CE2-CD1 3.84Å; F217-L220 WeakPolarHBondContact O-CB 3.48Å; F217-L220 VanDerWaalsContact O-CG 3.32Å; F217-L220 WeakPolarHBondContact O-CG 3.1Å; F217-L220 PolarHBondContact O-N 2.9Å; F217-Y289 AromaticContact CE1-CD1 3.94Å; F217-Y289 HydrophobicContact CE1-CD1 3.94Å; F217-Y289 HydrophobicContact CE1-CE1 4.14Å; F217-Y289 HydrophobicContact CE2-CD1 4.38Å; F217-Y289 AromaticContact CE2-CE1 3.75Å; F217-Y289 HydrophobicContact CE2-CE1 3.75Å; F217-Y289 AromaticContact CZ-CD1 3.47Å; F217-Y289 HydrophobicContact CZ-CD1 3.47Å; F217-Y289 VanDerWaalsContact CZ-CD1 3.47Å; F217-Y289 AromaticContact CZ-CE1 3.26Å; F217-Y289 HydrophobicContact CZ-CE1 3.26Å
218	F	96.9	Very high	97.8	Very high	6 Å²	6	18.2 Å²	18.2	3%	0.026	9%	0.087	C	C	.	.	G	3₁₀ helix	trans	-76.5	-17.3	178.4	-77.7	7.4	0	0	0	113.7	R115 F116 F119 T216 P330	R115-F218 HydrophobicContact CB-CD2 4.08Å; R115-F218 HydrophobicContact CB-CE2 4.13Å; R115-F218 HydrophobicContact CG-CD2 4.17Å; R115-F218 HydrophobicContact CG-CE2 3.69Å; R115-F218 HydrophobicContact CG-CZ 4.08Å; R115-F218 WeakPolarHBondContact O-CD2 3.38Å; F116-F218 AromaticContact CD1-CE2 3.63Å; F116-F218 HydrophobicContact CD1-CE2 3.63Å; F116-F218 HydrophobicContact CD1-CZ 4.27Å; F116-F218 AromaticContact CD2-CE2 3.92Å; F116-F218 HydrophobicContact CD2-CE2 3.92Å; F116-F218 HydrophobicContact CD2-CZ 4.29Å; F116-F218 AromaticContact CE1-CE2 3.54Å; F116-F218 HydrophobicContact CE1-CE2 3.54Å; F116-F218 AromaticContact CE1-CZ 3.72Å; F116-F218 HydrophobicContact CE1-CZ 3.72Å; F116-F218 AromaticContact CE2-CE2 3.86Å; F116-F218 HydrophobicContact CE2-CE2 3.86Å; F116-F218 AromaticContact CE2-CZ 3.77Å; F116-F218 HydrophobicContact CE2-CZ 3.77Å; F116-F218 AromaticContact CG-CE2 3.8Å; F116-F218 HydrophobicContact CG-CE2 3.8Å; F116-F218 AromaticContact CZ-CE2 3.66Å; F116-F218 HydrophobicContact CZ-CE2 3.66Å; F116-F218 AromaticContact CZ-CZ 3.44Å; F116-F218 HydrophobicContact CZ-CZ 3.44Å; F116-F218 VanDerWaalsContact CZ-CZ 3.44Å; F119-F218 HydrophobicContact CB-CD2 3.97Å; F119-F218 HydrophobicContact CD2-CB 4.01Å; F119-F218 HydrophobicContact CG-CD2 4.29Å; T216-F218 VanDerWaalsContact C-N 3.27Å; T216-F218 PolarHBondContact O-N 2.94Å; F218-P330 HydrophobicContact CB-CB 4.42Å; F218-P330 HydrophobicContact CD1-CB 3.65Å; F218-P330 WeakPolarHBondContact CD1-O 3.48Å; F218-P330 HydrophobicContact CD2-CB 3.9Å; F218-P330 HydrophobicContact CD2-CG 4.43Å; F218-P330 HydrophobicContact CE1-CB 3.76Å; F218-P330 HydrophobicContact CE2-CB 3.98Å; F218-P330 HydrophobicContact CE2-CG 4.43Å; F218-P330 HydrophobicContact CG-CB 3.75Å; F218-P330 HydrophobicContact CZ-CB 3.92Å
219	N	97.9	Very high	97.8	Very high	34 Å²	34	21.3 Å²	21.3	18%	0.182	10%	0.101	C	C	.	.	G	3₁₀ helix	trans	-91.5	4.7	174	-71.8	-18.7	0	0	0	113.1	Y213 R214 T216 F217 T221 L222 K223	Y213-N219 HydrophobicContact CD2-CB 3.99Å; Y213-N219 HydrophobicContact CE2-CB 3.95Å; R214-N219 PolarHBondContact O-ND2 2.63Å; T216-N219 CarbonylContact O-C 3.57Å; T216-N219 PolarHBondContact O-N 3.31Å; T216-N219 PolarHBondContact OG1-N 2.98Å; T216-N219 PolarHBondContact OG1-ND2 3.26Å; F217-N219 VanDerWaalsContact C-N 3.31Å; F217-N219 PolarHBondContact O-N 2.84Å; N219-T221 PolarHBondContact O-N 2.77Å; N219-L222 HydrophobicContact CB-CB 4.45Å; N219-L222 WeakPolarHBondContact O-CA 3.48Å; N219-L222 VanDerWaalsContact O-CB 3.32Å; N219-L222 WeakPolarHBondContact O-CB 3.24Å; N219-L222 PolarHBondContact O-N 2.72Å; N219-K223 PolarHBondContact O-N 3.34Å
220	L	97.6	Very high	97.8	Very high	24 Å²	24	21.7 Å²	21.7	13%	0.126	10%	0.102	C	C	.	.	H	α-helix	trans	-60.5	-30.1	172.3	-69.8	178.2	0	0	0	112.4	K149 T216 F217 L222 K223 E224 D332	K149-L220 HydrophobicContact CD-CD2 4.37Å; T216-L220 PolarHBondContact O-N 2.78Å; F217-L220 HydrophobicContact CD2-CD1 3.68Å; F217-L220 HydrophobicContact CE2-CD1 3.84Å; F217-L220 WeakPolarHBondContact O-CB 3.48Å; F217-L220 VanDerWaalsContact O-CG 3.32Å; F217-L220 WeakPolarHBondContact O-CG 3.1Å; F217-L220 PolarHBondContact O-N 2.9Å; L220-L222 VanDerWaalsContact C-N 3.34Å; L220-K223 HydrophobicContact CD2-CD 4.21Å; L220-K223 VanDerWaalsContact O-CB 3.29Å; L220-K223 WeakPolarHBondContact O-CB 3.45Å; L220-K223 PolarHBondContact O-N 3.1Å; L220-E224 PolarHBondContact O-N 3.46Å; L220-D332 HydrophobicContact CB-CB 3.76Å
221	T	97.3	Very high	97.8	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-66.8	-37.7	172.6	-61.6	0	0	0	0	112	N219 K223 E224 V225 L328 Y329 D332 Y335	N219-T221 PolarHBondContact O-N 2.77Å; T221-K223 VanDerWaalsContact C-N 3.34Å; T221-E224 WeakPolarHBondContact O-CB 3.39Å; T221-E224 PolarHBondContact O-N 3.21Å; T221-V225 WeakPolarHBondContact O-CG2 3.36Å; T221-V225 PolarHBondContact O-N 3.4Å; T221-L328 HydrophobicContact CG2-CB 4.09Å; T221-L328 HydrophobicContact CG2-CD2 3.8Å; T221-Y329 VanDerWaalsContact CB-O 3.23Å; T221-Y329 WeakPolarHBondContact CB-O 3.41Å; T221-Y329 PolarHBondContact OG1-O 3.44Å; T221-D332 VanDerWaalsContact OG1-CA 3.25Å; T221-D332 WeakPolarHBondContact OG1-CA 3.48Å; T221-D332 PolarHBondContact OG1-N 3Å; T221-Y335 HydrophobicContact CG2-CD1 3.4Å; T221-Y335 HydrophobicContact CG2-CD2 3.51Å; T221-Y335 HydrophobicContact CG2-CE1 3.84Å; T221-Y335 HydrophobicContact CG2-CE2 3.95Å; T221-Y335 HydrophobicContact CG2-CG 3.19Å
222	L	97.7	Very high	97.7	Very high	2 Å²	2	23.2 Å²	23.2	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-65.3	-40.4	173.1	176.7	66.4	0	0	0	110.9	Y128 Y213 N219 L220 E224 V225 L226 L328	Y128-L222 HydrophobicContact CD2-CD1 3.91Å; Y128-L222 HydrophobicContact CD2-CD2 3.57Å; Y128-L222 HydrophobicContact CD2-CG 4.2Å; Y128-L222 HydrophobicContact CE2-CD1 3.97Å; Y128-L222 HydrophobicContact CE2-CD2 3.24Å; Y128-L222 HydrophobicContact CE2-CG 4.19Å; Y213-L222 HydrophobicContact CD1-CD2 4.35Å; Y213-L222 HydrophobicContact CD2-CD2 3.65Å; Y213-L222 HydrophobicContact CD2-CG 4.42Å; Y213-L222 HydrophobicContact CE2-CD2 4.43Å; Y213-L222 HydrophobicContact CG-CD2 3.62Å; Y213-L222 HydrophobicContact CG-CG 4.39Å; N219-L222 HydrophobicContact CB-CB 4.45Å; N219-L222 WeakPolarHBondContact O-CA 3.48Å; N219-L222 VanDerWaalsContact O-CB 3.32Å; N219-L222 WeakPolarHBondContact O-CB 3.24Å; N219-L222 PolarHBondContact O-N 2.72Å; L220-L222 VanDerWaalsContact C-N 3.34Å; L222-E224 VanDerWaalsContact C-N 3.25Å; L222-E224 PolarHBondContact O-N 2.88Å; L222-V225 PolarHBondContact O-N 2.85Å; L222-L226 HydrophobicContact CD1-CD1 4.09Å; L222-L226 HydrophobicContact CD1-CG 4.1Å; L222-L226 HydrophobicContact CD2-CD1 4.48Å; L222-L226 HydrophobicContact CG-CD1 3.85Å; L222-L226 HydrophobicContact CG-CG 4.31Å; L222-L226 WeakPolarHBondContact O-CB 3.41Å; L222-L226 VanDerWaalsContact O-CG 3.29Å; L222-L226 WeakPolarHBondContact O-CG 3.42Å; L222-L226 PolarHBondContact O-N 3.46Å; L222-L328 HydrophobicContact CB-CD1 4.5Å
223	K	98.6	Very high	97.7	Very high	3 Å²	3	23.8 Å²	23.8	1%	0.013	13%	0.125	C	C	.	.	H	α-helix	trans	-54.3	-42.9	171.1	-169.9	176	-73.5	-173.5	0	111.3	K149 S150 L181 Y213 D215 N219 L220 T221 F227	K149-K223 HydrophobicContact CB-CD 4.23Å; K149-K223 HydrophobicContact CD-CD 4.45Å; K149-K223 HydrophobicContact CG-CD 3.9Å; S150-K223 PolarHBondContact O-NZ 3.42Å; L181-K223 HydrophobicContact CB-CD 3.94Å; L181-K223 HydrophobicContact CB-CG 3.97Å; L181-K223 WeakPolarHBondContact O-CE 3.35Å; L181-K223 PolarHBondContact O-NZ 2.8Å; Y213-K223 VanDerWaalsContact OH-CB 3.25Å; Y213-K223 WeakPolarHBondContact OH-CB 3.44Å; Y213-K223 WeakPolarHBondContact OH-CE 3.11Å; Y213-K223 WeakPolarHBondContact OH-CG 3.39Å; D215-K223 WeakPolarHBondContact OD1-CE 3.47Å; D215-K223 IonicContact OD1-NZ 3.35Å; D215-K223 PolarHBondContact OD1-NZ 2.92Å; D215-K223 VanDerWaalsContact OD2-CE 3.28Å; D215-K223 WeakPolarHBondContact OD2-CE 3.42Å; D215-K223 IonicContact OD2-NZ 2.88Å; D215-K223 PolarHBondContact OD2-NZ 2.87Å; N219-K223 PolarHBondContact O-N 3.34Å; L220-K223 HydrophobicContact CD2-CD 4.21Å; L220-K223 VanDerWaalsContact O-CB 3.29Å; L220-K223 WeakPolarHBondContact O-CB 3.45Å; L220-K223 PolarHBondContact O-N 3.1Å; T221-K223 VanDerWaalsContact C-N 3.34Å; K223-F227 VanDerWaalsContact O-CB 3.28Å; K223-F227 WeakPolarHBondContact O-CB 3.26Å; K223-F227 PolarHBondContact O-N 2.84Å
224	E	97.8	Very high	97.7	Very high	2 Å²	2	25.6 Å²	25.6	1%	0.009	14%	0.138	C	C	.	.	H	α-helix	trans	-63.3	-49.7	176	177.8	64.2	172.5	0	0	112.5	L220 T221 L222 L226 F227 L228 K243	L220-E224 PolarHBondContact O-N 3.46Å; T221-E224 WeakPolarHBondContact O-CB 3.39Å; T221-E224 PolarHBondContact O-N 3.21Å; L222-E224 VanDerWaalsContact C-N 3.25Å; L222-E224 PolarHBondContact O-N 2.88Å; E224-L226 PolarHBondContact O-N 2.73Å; E224-F227 PolarHBondContact O-N 2.83Å; E224-L228 HydrophobicContact CG-CD1 4.07Å; E224-L228 HydrophobicContact CG-CG 4.49Å; E224-L228 WeakPolarHBondContact O-CG 3.46Å; E224-L228 PolarHBondContact O-N 3.24Å; E224-K243 VanDerWaalsContact CD-NZ 3.28Å; E224-K243 IonicContact OE1-NZ 3.86Å; E224-K243 WeakPolarHBondContact OE2-CD 3.45Å; E224-K243 WeakPolarHBondContact OE2-CE 3.03Å; E224-K243 IonicContact OE2-NZ 3.35Å; E224-K243 PolarHBondContact OE2-NZ 2.81Å
225	V	98.1	Very high	97.7	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-61.3	-44.6	-179.9	172.9	0	0	0	0	111.3	T221 L222 F227 L228 K229 L328 Y335	T221-V225 WeakPolarHBondContact O-CG2 3.36Å; T221-V225 PolarHBondContact O-N 3.4Å; L222-V225 PolarHBondContact O-N 2.85Å; V225-F227 VanDerWaalsContact C-N 3.32Å; V225-F227 PolarHBondContact O-N 3.05Å; V225-L228 PolarHBondContact O-N 3.48Å; V225-K229 HydrophobicContact CG1-CD 4.34Å; V225-K229 WeakPolarHBondContact O-CG 3.03Å; V225-K229 PolarHBondContact O-N 3.2Å; V225-L328 HydrophobicContact CG2-CD2 3.79Å; V225-Y335 HydrophobicContact CG2-CE1 3.7Å; V225-Y335 WeakPolarHBondContact CG2-OH 3.46Å
226	L	98.5	Very high	97.7	Very high	5 Å²	5	22.7 Å²	22.7	3%	0.026	14%	0.136	C	C	.	.	H	α-helix	trans	-64.8	-37.5	178.4	-69.5	171.4	0	0	0	111.9	W211 Y213 L222 E224 K229 W230	W211-L226 HydrophobicContact CB-CD1 3.87Å; W211-L226 HydrophobicContact CD2-CB 4.08Å; W211-L226 HydrophobicContact CD2-CD1 4.34Å; W211-L226 HydrophobicContact CG-CB 4.25Å; W211-L226 HydrophobicContact CG-CD1 3.8Å; W211-L226 HydrophobicContact CG-CG 4.45Å; W211-L226 HydrophobicContact CZ2-CB 4.2Å; W211-L226 WeakPolarHBondContact CZ2-O 3.49Å; Y213-L226 HydrophobicContact CD1-CD1 3.6Å; Y213-L226 HydrophobicContact CE1-CD1 3.83Å; Y213-L226 HydrophobicContact CG-CD1 4.43Å; L222-L226 HydrophobicContact CD1-CD1 4.09Å; L222-L226 HydrophobicContact CD1-CG 4.1Å; L222-L226 HydrophobicContact CD2-CD1 4.48Å; L222-L226 HydrophobicContact CG-CD1 3.85Å; L222-L226 HydrophobicContact CG-CG 4.31Å; L222-L226 WeakPolarHBondContact O-CB 3.41Å; L222-L226 VanDerWaalsContact O-CG 3.29Å; L222-L226 WeakPolarHBondContact O-CG 3.42Å; L222-L226 PolarHBondContact O-N 3.46Å; E224-L226 PolarHBondContact O-N 2.73Å; L226-K229 PolarHBondContact O-N 2.75Å; L226-W230 PolarHBondContact O-N 3.49Å
227	F	98.7	Very high	97.6	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-65.6	-47.3	174.3	170.3	-112.6	0	0	0	112.3	L145 A147 V179 L181 K223 E224 V225 K229 W230 V231 I241 Y311	L145-F227 HydrophobicContact CD2-CE2 4.11Å; L145-F227 HydrophobicContact CD2-CZ 4.05Å; A147-F227 HydrophobicContact CB-CD2 4.32Å; A147-F227 HydrophobicContact CB-CE1 3.89Å; A147-F227 HydrophobicContact CB-CE2 3.53Å; A147-F227 HydrophobicContact CB-CZ 3.28Å; V179-F227 HydrophobicContact CG2-CE2 4.31Å; L181-F227 HydrophobicContact CD1-CB 3.86Å; L181-F227 HydrophobicContact CD1-CD1 4.26Å; L181-F227 HydrophobicContact CD1-CD2 3.91Å; L181-F227 HydrophobicContact CD1-CG 3.72Å; L181-F227 HydrophobicContact CD2-CB 4.3Å; L181-F227 HydrophobicContact CD2-CD2 3.49Å; L181-F227 VanDerWaalsContact CD2-CD2 3.49Å; L181-F227 HydrophobicContact CD2-CE2 4.15Å; L181-F227 HydrophobicContact CD2-CG 4.1Å; L181-F227 HydrophobicContact CG-CD2 4.34Å; K223-F227 VanDerWaalsContact O-CB 3.28Å; K223-F227 WeakPolarHBondContact O-CB 3.26Å; K223-F227 PolarHBondContact O-N 2.84Å; E224-F227 PolarHBondContact O-N 2.83Å; V225-F227 VanDerWaalsContact C-N 3.32Å; V225-F227 PolarHBondContact O-N 3.05Å; F227-K229 VanDerWaalsContact C-N 3.28Å; F227-K229 PolarHBondContact O-N 3.04Å; F227-W230 HydrophobicContact CD2-CE3 4.49Å; F227-W230 HydrophobicContact CE2-CE3 4.29Å; F227-W230 WeakPolarHBondContact O-CB 3.42Å; F227-W230 PolarHBondContact O-N 3.21Å; F227-W230 VanDerWaalsContact O-N 3.09Å; F227-V231 HydrophobicContact CD1-CG2 4.48Å; F227-V231 HydrophobicContact CD2-CG2 4.14Å; F227-V231 HydrophobicContact CE1-CG2 3.93Å; F227-V231 HydrophobicContact CE2-CG2 3.56Å; F227-V231 HydrophobicContact CZ-CG2 3.43Å; F227-V231 VanDerWaalsContact CZ-CG2 3.43Å; F227-V231 WeakPolarHBondContact O-CG2 3.4Å; F227-V231 PolarHBondContact O-N 3.49Å; F227-I241 HydrophobicContact CE1-CG2 4.06Å; F227-I241 HydrophobicContact CZ-CD1 4.38Å; F227-I241 HydrophobicContact CZ-CG2 3.9Å; F227-Y311 WeakPolarHBondContact CE1-OH 3.21Å
228	L	98.6	Very high	97.8	Very high	3 Å²	3	22.9 Å²	22.9	2%	0.016	14%	0.139	C	C	.	.	H	α-helix	trans	-60.3	-38.3	176.8	-70.9	173.5	0	0	0	111.9	E224 V225 V231 S232 A316 L319 N320	E224-L228 HydrophobicContact CG-CD1 4.07Å; E224-L228 HydrophobicContact CG-CG 4.49Å; E224-L228 WeakPolarHBondContact O-CG 3.46Å; E224-L228 PolarHBondContact O-N 3.24Å; V225-L228 PolarHBondContact O-N 3.48Å; L228-V231 PolarHBondContact O-N 2.8Å; L228-S232 PolarHBondContact O-N 3.41Å; L228-A316 HydrophobicContact CD2-CB 4.21Å; L228-L319 HydrophobicContact CD1-CB 3.93Å; L228-L319 HydrophobicContact CD2-CB 4.24Å; L228-N320 HydrophobicContact CB-CB 4.03Å
229	K	98	Very high	97.8	Very high	66 Å²	66	27.5 Å²	27.5	29%	0.287	16%	0.16	S	C	.	.	H	α-helix	trans	-61.1	-45.6	172.1	-75.2	178.6	179.4	-176.2	0	111.8	V225 L226 F227 S232 S233 N320	V225-K229 HydrophobicContact CG1-CD 4.34Å; V225-K229 WeakPolarHBondContact O-CG 3.03Å; V225-K229 PolarHBondContact O-N 3.2Å; L226-K229 PolarHBondContact O-N 2.75Å; F227-K229 VanDerWaalsContact C-N 3.28Å; F227-K229 PolarHBondContact O-N 3.04Å; K229-S232 WeakPolarHBondContact O-CB 3.23Å; K229-S232 PolarHBondContact O-N 2.98Å; K229-S233 PolarHBondContact O-N 3.07Å; K229-S233 PolarHBondContact O-OG 3.03Å; K229-N320 WeakPolarHBondContact CA-OD1 3.28Å; K229-N320 VanDerWaalsContact CG-OD1 3.29Å; K229-N320 WeakPolarHBondContact CG-OD1 3.35Å; K229-N320 PolarHBondContact N-OD1 2.66Å
230	W	98.6	Very high	97.8	Very high	7 Å²	7	26.4 Å²	26.4	3%	0.027	15%	0.154	C	C	.	.	H	α-helix	trans	-64.5	-39.2	176.8	179.4	93.1	0	0	0	112.6	D133 K137 L145 V179 L209 W211 L226 F227 S232 S233 S234 C235	D133-W230 PolarHBondContact OD1-NE1 3.08Å; K137-W230 HydrophobicContact CB-CH2 4.37Å; K137-W230 HydrophobicContact CB-CZ2 4.43Å; K137-W230 HydrophobicContact CG-CH2 4.46Å; L145-W230 HydrophobicContact CD2-CZ3 3.99Å; V179-W230 HydrophobicContact CG1-CH2 4.15Å; L209-W230 HydrophobicContact CD1-CD2 3.58Å; L209-W230 HydrophobicContact CD1-CE3 3.93Å; L209-W230 HydrophobicContact CD1-CG 4Å; L209-W230 HydrophobicContact CD1-CH2 4.31Å; L209-W230 HydrophobicContact CD1-CZ2 3.99Å; L209-W230 HydrophobicContact CD1-CZ3 4.28Å; L209-W230 HydrophobicContact CD2-CZ2 4.12Å; W211-W230 HydrophobicContact CZ2-CB 3.89Å; W211-W230 HydrophobicContact CZ2-CG 4.37Å; L226-W230 PolarHBondContact O-N 3.49Å; F227-W230 HydrophobicContact CD2-CE3 4.49Å; F227-W230 HydrophobicContact CE2-CE3 4.29Å; F227-W230 WeakPolarHBondContact O-CB 3.42Å; F227-W230 PolarHBondContact O-N 3.21Å; F227-W230 VanDerWaalsContact O-N 3.09Å; W230-S232 VanDerWaalsContact C-N 3.32Å; W230-S232 PolarHBondContact O-N 3.39Å; W230-S233 PolarHBondContact O-N 2.96Å; W230-S233 PolarHBondContact O-OG 3.46Å; W230-S234 WeakPolarHBondContact O-CA 3.04Å; W230-S234 VanDerWaalsContact O-CB 3.29Å; W230-S234 WeakPolarHBondContact O-CB 3.08Å; W230-S234 PolarHBondContact O-N 2.76Å; W230-C235 HydrophobicContact CE3-CB 4.31Å; W230-C235 HydrophobicContact CH2-CB 4.02Å; W230-C235 HydrophobicContact CZ3-CB 3.66Å
231	V	98.4	Very high	97.9	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-59.1	-47.9	172.6	171.1	0	0	0	0	109.7	L145 F227 L228 S233 C235 A236 V238 I241 A316	L145-V231 HydrophobicContact CD2-CG2 4.35Å; F227-V231 HydrophobicContact CD1-CG2 4.48Å; F227-V231 HydrophobicContact CD2-CG2 4.14Å; F227-V231 HydrophobicContact CE1-CG2 3.93Å; F227-V231 HydrophobicContact CE2-CG2 3.56Å; F227-V231 HydrophobicContact CZ-CG2 3.43Å; F227-V231 VanDerWaalsContact CZ-CG2 3.43Å; F227-V231 WeakPolarHBondContact O-CG2 3.4Å; F227-V231 PolarHBondContact O-N 3.49Å; L228-V231 PolarHBondContact O-N 2.8Å; V231-S233 VanDerWaalsContact C-N 3.31Å; V231-S233 PolarHBondContact O-N 3.34Å; V231-C235 CarbonylContact O-C 3.53Å; V231-C235 WeakPolarHBondContact O-CA 3.16Å; V231-C235 PolarHBondContact O-N 3.31Å; V231-A236 WeakPolarHBondContact O-CA 3.47Å; V231-A236 PolarHBondContact O-N 2.89Å; V231-V238 HydrophobicContact CG1-CG1 4.16Å; V231-I241 HydrophobicContact CG1-CD1 3.91Å; V231-I241 HydrophobicContact CG2-CD1 3.94Å; V231-A316 HydrophobicContact CG1-CB 4.16Å
232	S	97.7	Very high	98	Very high	47 Å²	47	25.3 Å²	25.3	33%	0.329	15%	0.148	S	C	.	.	H	α-helix	trans	-62.1	-33.9	179.6	-171.8	0	0	0	0	113.8	L228 K229 W230 N320	L228-S232 PolarHBondContact O-N 3.41Å; K229-S232 WeakPolarHBondContact O-CB 3.23Å; K229-S232 PolarHBondContact O-N 2.98Å; W230-S232 VanDerWaalsContact C-N 3.32Å; W230-S232 PolarHBondContact O-N 3.39Å; S232-N320 WeakPolarHBondContact CB-ND2 3.45Å
233	S	96.8	Very high	98	Very high	92 Å²	92	25.2 Å²	25.2	64%	0.643	15%	0.148	S	C	*	.	H	α-helix	trans	-90.1	-34.8	-178	63.6	0	0	0	0	113.8	K229 W230 V231	K229-S233 PolarHBondContact O-N 3.07Å; K229-S233 PolarHBondContact O-OG 3.03Å; W230-S233 PolarHBondContact O-N 2.96Å; W230-S233 PolarHBondContact O-OG 3.46Å; V231-S233 VanDerWaalsContact C-N 3.31Å; V231-S233 PolarHBondContact O-N 3.34Å
234	S	97.1	Very high	98	Very high	40 Å²	40	25.1 Å²	25.1	28%	0.28	15%	0.148	S	C	.	.	H	α-helix	trans	-124.2	-12.1	-162.8	-52.2	0	0	0	0	113.4	C138 W230	C138-S234 WeakPolarHBondContact CB-O 3.33Å; W230-S234 WeakPolarHBondContact O-CA 3.04Å; W230-S234 VanDerWaalsContact O-CB 3.29Å; W230-S234 WeakPolarHBondContact O-CB 3.08Å; W230-S234 PolarHBondContact O-N 2.76Å
235	C	97.9	Very high	98	Very high	4 Å²	4	26.8 Å²	26.8	3%	0.027	16%	0.156	C	C	.	.			trans	-146.1	33.5	-175.9	-156.6	0	0	0	0	113.3	C138 W230 V231 D237 V238	C138-C235 HydrophobicContact CB-CB 3.67Å; C138-C235 WeakPolarHBondContact CB-SG 3.25Å; C138-C235 WeakPolarHBondContact SG-CB 3.4Å; C138-C235 CovalentContact SG-SG 2.03Å; C138-C235 PolarHBondContact SG-SG 3.17Å; W230-C235 HydrophobicContact CE3-CB 4.31Å; W230-C235 HydrophobicContact CH2-CB 4.02Å; W230-C235 HydrophobicContact CZ3-CB 3.66Å; V231-C235 CarbonylContact O-C 3.53Å; V231-C235 WeakPolarHBondContact O-CA 3.16Å; V231-C235 PolarHBondContact O-N 3.31Å; C235-D237 PolarHBondContact O-N 3.48Å; C235-D237 VanDerWaalsContact O-N 3.13Å; C235-V238 WeakPolarHBondContact O-CB 3.43Å; C235-V238 VanDerWaalsContact O-CG1 3.24Å; C235-V238 WeakPolarHBondContact O-CG1 3.36Å; C235-V238 PolarHBondContact O-N 2.94Å
236	A	96.9	Very high	98	Very high	43 Å²	43	27.1 Å²	27.1	36%	0.355	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-22.1	-168.6	0	0	0	0	0	114.6	V231 L317	V231-A236 WeakPolarHBondContact O-CA 3.47Å; V231-A236 PolarHBondContact O-N 2.89Å; A236-L317 HydrophobicContact CB-CD2 4.19Å
237	D	96.2	Very high	98	Very high	97 Å²	97	28.5 Å²	28.5	52%	0.519	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	5.5	-178.3	-82.2	-49.9	0	0	0	114.1	K141 C235	K141-D237 HydrophobicContact CB-CB 4.31Å; K141-D237 HydrophobicContact CD-CB 3.78Å; K141-D237 WeakPolarHBondContact CE-OD2 3.36Å; K141-D237 HydrophobicContact CG-CB 3.76Å; K141-D237 IonicContact NZ-OD1 2.83Å; K141-D237 PolarHBondContact NZ-OD1 3.49Å; K141-D237 IonicContact NZ-OD2 3.71Å; K141-D237 PolarHBondContact NZ-OD2 3Å; C235-D237 PolarHBondContact O-N 3.48Å; C235-D237 VanDerWaalsContact O-N 3.13Å
238	V	97.8	Very high	98	Very high	6 Å²	6	28.5 Å²	28.5	4%	0.036	17%	0.166	C	C	.	.			trans	-62.1	137.3	177.5	65.2	0	0	0	0	110.9	P142 L145 V231 C235 F240 I241 G313	P142-V238 HydrophobicContact CB-CG2 4.25Å; L145-V238 HydrophobicContact CB-CG2 3.68Å; V231-V238 HydrophobicContact CG1-CG1 4.16Å; C235-V238 WeakPolarHBondContact O-CB 3.43Å; C235-V238 VanDerWaalsContact O-CG1 3.24Å; C235-V238 WeakPolarHBondContact O-CG1 3.36Å; C235-V238 PolarHBondContact O-N 2.94Å; V238-F240 VanDerWaalsContact CG2-O 3.23Å; V238-F240 WeakPolarHBondContact CG2-O 3.34Å; V238-I241 HydrophobicContact CG1-CD1 3.84Å; V238-I241 HydrophobicContact CG1-CG1 3.84Å; V238-I241 HydrophobicContact CG2-CG1 4.18Å; V238-G313 WeakPolarHBondContact O-CA 3.45Å
239	Q	97.6	Very high	98	Very high	103 Å²	103	28.4 Å²	28.4	48%	0.481	17%	0.165	S	C	.	.	S	Bend	trans	-80.4	-46.1	179.2	-63.1	-171.8	35.9	0	0	112.5	P142 F143 S312 G313	P142-Q239 PolarHBondContact O-N 2.75Å; P142-Q239 VanDerWaalsContact O-N 3.09Å; F143-Q239 HydrophobicContact CD2-CB 4.43Å; F143-Q239 WeakPolarHBondContact O-CB 3.28Å; Q239-S312 WeakPolarHBondContact O-CA 3.41Å; Q239-G313 PolarHBondContact O-N 3.47Å
240	F	98.7	Very high	98	Very high	11 Å²	11	25.2 Å²	25.2	5%	0.048	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	150.2	-180	-58.9	-76.2	0	0	0	111.9	F143 L144 L145 V238 L259 L262 A267 L270 Y311	F143-F240 HydrophobicContact CE1-CD2 4.31Å; F143-F240 HydrophobicContact CE2-CD2 4.08Å; F143-F240 AromaticContact CE2-CE2 3.84Å; F143-F240 HydrophobicContact CE2-CE2 3.84Å; F143-F240 AromaticContact CZ-CD2 3.97Å; F143-F240 HydrophobicContact CZ-CD2 3.97Å; F143-F240 AromaticContact CZ-CE2 3.85Å; F143-F240 HydrophobicContact CZ-CE2 3.85Å; F143-F240 PolarHBondContact O-N 3.3Å; L144-F240 CarbonylContact C-O 3.59Å; L144-F240 WeakPolarHBondContact CA-O 3.33Å; L144-F240 HydrophobicContact CD1-CB 4.05Å; L145-F240 PolarHBondContact N-O 3.21Å; V238-F240 VanDerWaalsContact CG2-O 3.23Å; V238-F240 WeakPolarHBondContact CG2-O 3.34Å; F240-L259 HydrophobicContact CB-CD1 3.8Å; F240-L259 HydrophobicContact CB-CD2 4.19Å; F240-L259 HydrophobicContact CD1-CD2 3.47Å; F240-L259 VanDerWaalsContact CD1-CD2 3.47Å; F240-L259 HydrophobicContact CD2-CB 4.3Å; F240-L259 HydrophobicContact CD2-CD1 3.8Å; F240-L259 HydrophobicContact CD2-CD2 3.89Å; F240-L259 HydrophobicContact CD2-CG 4.21Å; F240-L259 HydrophobicContact CE1-CD2 3.7Å; F240-L259 HydrophobicContact CE2-CB 4.23Å; F240-L259 HydrophobicContact CE2-CD2 4.09Å; F240-L259 HydrophobicContact CG-CD1 3.79Å; F240-L259 HydrophobicContact CG-CD2 3.57Å; F240-L259 HydrophobicContact CG-CG 4.22Å; F240-L259 HydrophobicContact CZ-CD2 3.99Å; F240-L262 HydrophobicContact CE1-CD1 4.36Å; F240-L262 HydrophobicContact CZ-CD1 4.49Å; F240-A267 HydrophobicContact CE1-CB 4.12Å; F240-A267 HydrophobicContact CZ-CB 3.85Å; F240-L270 HydrophobicContact CD1-CD2 3.86Å; F240-L270 HydrophobicContact CE1-CD2 3.87Å; F240-Y311 CarbonylContact C-O 3.29Å; F240-Y311 WeakPolarHBondContact CA-O 3.28Å
241	I	98.9	Very high	98	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	124.4	177.6	-55.2	-178.6	0	0	0	108.1	L145 A147 F227 V231 V238 L310 Y311 A316	L145-I241 HydrophobicContact CB-CG1 4.37Å; L145-I241 WeakPolarHBondContact O-CA 3.42Å; A147-I241 HydrophobicContact CB-CG2 4.38Å; F227-I241 HydrophobicContact CE1-CG2 4.06Å; F227-I241 HydrophobicContact CZ-CD1 4.38Å; F227-I241 HydrophobicContact CZ-CG2 3.9Å; V231-I241 HydrophobicContact CG1-CD1 3.91Å; V231-I241 HydrophobicContact CG2-CD1 3.94Å; V238-I241 HydrophobicContact CG1-CD1 3.84Å; V238-I241 HydrophobicContact CG1-CG1 3.84Å; V238-I241 HydrophobicContact CG2-CG1 4.18Å; I241-L310 WeakPolarHBondContact O-CA 3.48Å; I241-Y311 HydrophobicContact CB-CD2 4.26Å; I241-Y311 HydrophobicContact CB-CE1 4.13Å; I241-Y311 HydrophobicContact CB-CE2 3.83Å; I241-Y311 HydrophobicContact CD1-CE2 3.91Å; I241-Y311 HydrophobicContact CG1-CE2 4.32Å; I241-Y311 HydrophobicContact CG2-CE1 3.98Å; I241-Y311 HydrophobicContact CG2-CE2 4.17Å; I241-Y311 PolarHBondContact N-O 3.02Å; I241-Y311 WeakPolarHBondContact O-CD1 3.5Å; I241-Y311 PolarHBondContact O-N 3.15Å; I241-A316 HydrophobicContact CD1-CB 3.63Å
242	F	98.8	Very high	98	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	120.9	161.2	170.7	-94.3	0	0	0	107.8	L144 L145 L146 A147 W165 V250 I255 L310 F353 L374	L144-F242 HydrophobicContact CD1-CB 4.11Å; L145-F242 PolarHBondContact O-N 3.48Å; L146-F242 HydrophobicContact CD2-CB 3.84Å; L146-F242 HydrophobicContact CD2-CD1 4.03Å; L146-F242 HydrophobicContact CD2-CG 4.26Å; A147-F242 PolarHBondContact N-O 3.1Å; W165-F242 HydrophobicContact CH2-CE1 4.48Å; W165-F242 HydrophobicContact CZ3-CE1 4.29Å; F242-V250 HydrophobicContact CE1-CG2 3.75Å; F242-V250 HydrophobicContact CE2-CG1 4.37Å; F242-V250 HydrophobicContact CE2-CG2 4.35Å; F242-V250 HydrophobicContact CZ-CG1 4.27Å; F242-V250 HydrophobicContact CZ-CG2 3.54Å; F242-I255 HydrophobicContact CD2-CD1 3.87Å; F242-I255 HydrophobicContact CE2-CD1 4.3Å; F242-I255 HydrophobicContact CG-CD1 4.38Å; F242-L310 HydrophobicContact CB-CD1 3.9Å; F242-F353 HydrophobicContact CE2-CE1 4.28Å; F242-L374 HydrophobicContact CE2-CD1 4Å; F242-L374 HydrophobicContact CZ-CD1 3.7Å
243	K	98.5	Very high	97.9	Very high	1 Å²	1	26.6 Å²	26.6	0%	0.004	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	131.9	170.2	-178.1	-175.6	164.4	-158.2	0	109	A147 E224 G308 F309 Y311 D332	A147-K243 VanDerWaalsContact O-CA 3.29Å; A147-K243 WeakPolarHBondContact O-CA 3.34Å; E224-K243 VanDerWaalsContact CD-NZ 3.28Å; E224-K243 IonicContact OE1-NZ 3.86Å; E224-K243 WeakPolarHBondContact OE2-CD 3.45Å; E224-K243 WeakPolarHBondContact OE2-CE 3.03Å; E224-K243 IonicContact OE2-NZ 3.35Å; E224-K243 PolarHBondContact OE2-NZ 2.81Å; K243-G308 CarbonylContact O-C 3.57Å; K243-G308 WeakPolarHBondContact O-CA 2.89Å; K243-F309 HydrophobicContact CB-CD2 4.31Å; K243-F309 HydrophobicContact CB-CE2 3.97Å; K243-F309 HydrophobicContact CB-CZ 4.45Å; K243-F309 HydrophobicContact CD-CE2 3.88Å; K243-F309 HydrophobicContact CD-CZ 3.73Å; K243-F309 HydrophobicContact CG-CE2 4.41Å; K243-F309 HydrophobicContact CG-CZ 4.43Å; K243-F309 PolarHBondContact N-O 3.34Å; K243-F309 PolarHBondContact O-N 3.41Å; K243-Y311 HydrophobicContact CB-CE1 3.98Å; K243-D332 IonicContact NZ-OD2 2.74Å
244	G	97.8	Very high	97.9	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.01	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	175.8	178.5	0	0	0	0	0	114.5	A147 I148 K149 G307	A147-G244 PolarHBondContact O-N 2.98Å; A147-G244 VanDerWaalsContact O-N 3.07Å; I148-G244 CarbonylContact C-O 3.56Å; I148-G244 WeakPolarHBondContact CA-O 3.28Å; K149-G244 PolarHBondContact N-O 3.38Å; G244-G307 CarbonylContact C-O 3.56Å; G244-G307 WeakPolarHBondContact CA-O 3.43Å
245	D	98.4	Very high	97.9	Very high	36 Å²	36	22.8 Å²	22.8	19%	0.193	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	165.1	173.5	-65.7	-37	0	0	0	111.3	K149 D247 V248 G307	K149-D245 WeakPolarHBondContact CE-OD1 3.32Å; K149-D245 IonicContact NZ-OD1 3.7Å; K149-D245 PolarHBondContact NZ-OD1 3.35Å; D245-D247 VanDerWaalsContact C-N 3.3Å; D245-D247 VanDerWaalsContact CB-OD1 3.28Å; D245-D247 WeakPolarHBondContact CB-OD1 3.41Å; D245-V248 HydrophobicContact CB-CG1 4.45Å; D245-V248 WeakPolarHBondContact O-CG2 3.46Å; D245-G307 PolarHBondContact N-O 3.15Å; D245-G307 WeakPolarHBondContact OD2-CA 3.37Å
246	D	98.6	Very high	97.9	Very high	7 Å²	7	23 Å²	23	4%	0.037	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	5.6	178.5	66.7	13.3	0	0	0	114.4	I148 K149 S150 H154 R157 I161 M383	I148-D246 HydrophobicContact CG2-CB 3.8Å; K149-D246 WeakPolarHBondContact O-CB 3.29Å; K149-D246 PolarHBondContact O-N 3.3Å; S150-D246 VanDerWaalsContact CA-OD2 3.29Å; S150-D246 WeakPolarHBondContact CA-OD2 3.5Å; S150-D246 VanDerWaalsContact CB-OD2 3.3Å; S150-D246 WeakPolarHBondContact CB-OD2 3.29Å; S150-D246 PolarHBondContact OG-OD2 3.14Å; H154-D246 WeakPolarHBondContact CB-OD2 3.49Å; H154-D246 IonicContact CE1-OD2 3.77Å; H154-D246 IonicContact CG-OD2 2.85Å; H154-D246 IonicContact ND1-OD1 3.08Å; H154-D246 PolarHBondContact ND1-OD1 3.11Å; H154-D246 IonicContact ND1-OD2 3.96Å; H154-D246 PolarHBondContact ND1-OD2 3.48Å; R157-D246 HydrophobicContact CB-CB 4.16Å; R157-D246 VanDerWaalsContact CD-CG 3.48Å; R157-D246 WeakPolarHBondContact CD-OD1 3.43Å; R157-D246 IonicContact CZ-OD1 2.84Å; R157-D246 IonicContact NE-OD1 2.71Å; R157-D246 IonicContact NH1-OD1 3.23Å; R157-D246 PolarHBondContact NH1-OD1 3.1Å; I161-D246 HydrophobicContact CD1-CB 3.98Å; D246-M383 VanDerWaalsContact O-CE 3.28Å; D246-M383 WeakPolarHBondContact O-CE 3.49Å
247	D	98.3	Very high	97.8	Very high	35 Å²	35	25.3 Å²	25.3	19%	0.187	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.2	18.7	178.4	68.4	-14.1	0	0	0	113.4	D245 H376 S377 R378	D245-D247 VanDerWaalsContact C-N 3.3Å; D245-D247 VanDerWaalsContact CB-OD1 3.28Å; D245-D247 WeakPolarHBondContact CB-OD1 3.41Å; D247-H376 IonicContact OD1-CD2 2.83Å; D247-H376 PolarHBondContact OD1-CD2 3.5Å; D247-H376 IonicContact OD1-NE2 2.73Å; D247-H376 PolarHBondContact OD1-NE2 3.1Å; D247-H376 IonicContact OD2-CD2 2.75Å; D247-H376 IonicContact OD2-CE1 3.27Å; D247-H376 IonicContact OD2-NE2 3.92Å; D247-H376 PolarHBondContact OD2-NE2 2.96Å; D247-S377 CarbonylContact O-C 3.6Å; D247-S377 WeakPolarHBondContact O-CA 3.17Å; D247-S377 VanDerWaalsContact O-CB 3.3Å; D247-S377 WeakPolarHBondContact O-CB 3.28Å; D247-R378 PolarHBondContact O-N 3.37Å
248	V	98.4	Very high	97.9	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	152.8	175.4	-58.9	0	0	0	0	111.7	W165 D245 V250 L374 V375 H376 M383	W165-V248 HydrophobicContact CZ2-CG2 4.29Å; W165-V248 WeakPolarHBondContact CZ2-O 3.32Å; W165-V248 PolarHBondContact NE1-O 3.05Å; W165-V248 VanDerWaalsContact NE1-O 3.14Å; D245-V248 HydrophobicContact CB-CG1 4.45Å; D245-V248 WeakPolarHBondContact O-CG2 3.46Å; V248-V250 HydrophobicContact CG2-CG2 3.85Å; V248-L374 HydrophobicContact CB-CD1 3.86Å; V248-L374 HydrophobicContact CB-CG 4.08Å; V248-L374 HydrophobicContact CG1-CD1 4.02Å; V248-L374 HydrophobicContact CG1-CD2 4.48Å; V248-L374 HydrophobicContact CG1-CG 4.33Å; V248-L374 HydrophobicContact CG2-CD1 3.68Å; V248-L374 HydrophobicContact CG2-CG 4.37Å; V248-V375 WeakPolarHBondContact CA-O 3.46Å; V248-H376 HydrophobicContact CG1-CB 4.02Å; V248-M383 WeakPolarHBondContact O-CE 3.42Å
249	F	98.5	Very high	97.9	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	133.6	161.3	174.2	-91.2	0	0	0	109.5	W165 N251 Y369 L372 L374 V375 R378 M383 I386 W387 L390	W165-F249 HydrophobicContact CB-CE2 4.36Å; W165-F249 AromaticContact CD1-CD2 3.81Å; F249-N251 HydrophobicContact CE1-CB 4.26Å; F249-Y369 HydrophobicContact CD1-CD1 4.15Å; F249-Y369 HydrophobicContact CE1-CD1 4.42Å; F249-L372 HydrophobicContact CD1-CD1 4.4Å; F249-L374 CarbonylContact O-C 3.55Å; F249-L374 VanDerWaalsContact O-CA 3.29Å; F249-L374 WeakPolarHBondContact O-CA 3.27Å; F249-V375 HydrophobicContact CB-CG1 3.9Å; F249-V375 HydrophobicContact CD1-CG1 4.2Å; F249-V375 PolarHBondContact N-O 2.96Å; F249-V375 PolarHBondContact O-N 2.61Å; F249-R378 HydrophobicContact CB-CB 4.2Å; F249-R378 HydrophobicContact CB-CG 3.77Å; F249-M383 HydrophobicContact CD2-CB 4.43Å; F249-I386 HydrophobicContact CB-CD1 4.49Å; F249-I386 HydrophobicContact CD1-CG2 3.92Å; F249-I386 HydrophobicContact CD2-CB 4.04Å; F249-I386 HydrophobicContact CD2-CD1 4.48Å; F249-I386 HydrophobicContact CD2-CG2 3.94Å; F249-I386 HydrophobicContact CE1-CG2 3.59Å; F249-I386 HydrophobicContact CE2-CB 3.93Å; F249-I386 HydrophobicContact CE2-CG2 3.61Å; F249-I386 HydrophobicContact CG-CB 4.47Å; F249-I386 HydrophobicContact CG-CD1 4.31Å; F249-I386 HydrophobicContact CG-CG2 4.1Å; F249-I386 HydrophobicContact CZ-CB 4.28Å; F249-I386 HydrophobicContact CZ-CG2 3.45Å; F249-I386 VanDerWaalsContact CZ-CG2 3.45Å; F249-W387 HydrophobicContact CE2-CB 4.14Å; F249-W387 HydrophobicContact CE2-CE3 4.2Å; F249-W387 HydrophobicContact CZ-CE3 4.16Å; F249-L390 HydrophobicContact CE1-CD1 3.88Å; F249-L390 HydrophobicContact CZ-CD1 3.58Å
250	V	98.6	Very high	97.8	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	131.6	178.9	-173.2	0	0	0	0	109.2	W165 F242 V248 T252 I255 M373 L374	W165-V250 HydrophobicContact CB-CB 4.32Å; W165-V250 WeakPolarHBondContact CB-O 3.5Å; W165-V250 HydrophobicContact CD2-CB 3.71Å; W165-V250 HydrophobicContact CD2-CG2 3.84Å; W165-V250 HydrophobicContact CE3-CB 3.6Å; W165-V250 HydrophobicContact CE3-CG1 4.44Å; W165-V250 HydrophobicContact CE3-CG2 3.67Å; W165-V250 HydrophobicContact CG-CB 4.07Å; W165-V250 HydrophobicContact CH2-CG2 3.84Å; W165-V250 HydrophobicContact CZ2-CG2 3.99Å; W165-V250 HydrophobicContact CZ3-CB 4.13Å; W165-V250 HydrophobicContact CZ3-CG2 3.68Å; F242-V250 HydrophobicContact CE1-CG2 3.75Å; F242-V250 HydrophobicContact CE2-CG1 4.37Å; F242-V250 HydrophobicContact CE2-CG2 4.35Å; F242-V250 HydrophobicContact CZ-CG1 4.27Å; F242-V250 HydrophobicContact CZ-CG2 3.54Å; V248-V250 HydrophobicContact CG2-CG2 3.85Å; V250-T252 PolarHBondContact O-N 3.4Å; V250-I255 HydrophobicContact CG1-CD1 3.36Å; V250-I255 HydrophobicContact CG1-CG1 4.42Å; V250-M373 WeakPolarHBondContact CA-O 3.22Å; V250-M373 WeakPolarHBondContact CG1-O 3.4Å; V250-L374 HydrophobicContact CG2-CD1 4.32Å
251	N	98.1	Very high	97.7	Very high	10 Å²	10	26.7 Å²	26.7	5%	0.053	14%	0.138	C	C	.	.			trans	-88.8	85.3	168	-173	-16.8	0	0	0	108.9	F249 H253 Q254 I255 Y369 T370 L372 M373	F249-N251 HydrophobicContact CE1-CB 4.26Å; N251-H253 PolarHBondContact O-N 3.36Å; N251-H253 PolarHBondContact OD1-N 3.19Å; N251-Q254 HydrophobicContact CB-CB 3.96Å; N251-Q254 PolarHBondContact O-N 3.05Å; N251-Q254 VanDerWaalsContact O-N 3.12Å; N251-Q254 PolarHBondContact OD1-N 3.37Å; N251-Q254 VanDerWaalsContact OD1-N 3.14Å; N251-I255 PolarHBondContact O-N 2.79Å; N251-I255 VanDerWaalsContact O-N 3.07Å; N251-Y369 PolarHBondContact ND2-O 3.08Å; N251-T370 PolarHBondContact ND2-O 2.9Å; N251-L372 HydrophobicContact CB-CD1 4.42Å; N251-L372 VanDerWaalsContact CB-O 3.26Å; N251-L372 WeakPolarHBondContact CB-O 3.37Å; N251-M373 PolarHBondContact N-O 2.8Å
252	T	97.9	Very high	97.6	Very high	1 Å²	1	28 Å²	28	1%	0.006	15%	0.145	C	C	.	.	H	α-helix	trans	-61.7	-29.7	-176.2	-52.6	0	0	0	0	112.5	L144 W165 V250 I255 L256	L144-T252 HydrophobicContact CD2-CG2 4.29Å; W165-T252 WeakPolarHBondContact O-CB 3.41Å; W165-T252 PolarHBondContact O-OG1 3.06Å; V250-T252 PolarHBondContact O-N 3.4Å; T252-I255 PolarHBondContact O-N 3.48Å; T252-L256 HydrophobicContact CG2-CD1 4.44Å; T252-L256 VanDerWaalsContact O-CG 3.26Å; T252-L256 WeakPolarHBondContact O-CG 3.26Å; T252-L256 PolarHBondContact O-N 3.15Å
253	H	95.4	Very high	97.4	Very high	72 Å²	72	31.4 Å²	31.4	33%	0.333	17%	0.169	S	C	.	.	H	α-helix	trans	-64.6	-47.5	173.6	-65.5	-61.9	0	0	0	111.6	N251 I255 L256 D257 W387 Q391	N251-H253 PolarHBondContact O-N 3.36Å; N251-H253 PolarHBondContact OD1-N 3.19Å; H253-I255 VanDerWaalsContact C-N 3.27Å; H253-I255 PolarHBondContact O-N 3.43Å; H253-L256 PolarHBondContact O-N 3.48Å; H253-L256 VanDerWaalsContact O-N 3.11Å; H253-D257 PolarHBondContact O-N 2.88Å; H253-W387 AromaticContact CD2-CH2 3.51Å; H253-W387 AromaticContact CD2-CZ3 3.99Å; H253-W387 AromaticContact NE2-CH2 3.31Å; H253-W387 VanDerWaalsContact NE2-CH2 3.31Å; H253-W387 WeakPolarHBondContact NE2-CH2 3.4Å; H253-W387 AromaticContact NE2-CZ2 3.66Å; H253-Q391 PolarHBondContact CD2-NE2 3.42Å; H253-Q391 PolarHBondContact NE2-NE2 3.31Å
254	Q	96.9	Very high	97.1	Very high	52 Å²	52	40.5 Å²	40.5	24%	0.243	21%	0.208	C	C	.	.	H	α-helix	trans	-61.8	-35.1	176.8	-173.1	59	58	0	0	112.5	N251 Y258 T370 M373	N251-Q254 HydrophobicContact CB-CB 3.96Å; N251-Q254 PolarHBondContact O-N 3.05Å; N251-Q254 VanDerWaalsContact O-N 3.12Å; N251-Q254 PolarHBondContact OD1-N 3.37Å; N251-Q254 VanDerWaalsContact OD1-N 3.14Å; Q254-Y258 WeakPolarHBondContact O-CB 3.43Å; Q254-Y258 PolarHBondContact O-N 3.35Å; Q254-T370 PolarHBondContact OE1-O 3.15Å; Q254-M373 HydrophobicContact CB-SD 4.33Å; Q254-M373 HydrophobicContact CG-CE 3.86Å; Q254-M373 HydrophobicContact CG-SD 3.85Å
255	I	98.1	Very high	96.8	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-63.5	-49.5	172.1	-72.3	-179.4	0	0	0	110.8	L144 F242 V250 N251 T252 H253 D257 Y258 L259 L310 M373	L144-I255 HydrophobicContact CD2-CG2 3.9Å; F242-I255 HydrophobicContact CD2-CD1 3.87Å; F242-I255 HydrophobicContact CE2-CD1 4.3Å; F242-I255 HydrophobicContact CG-CD1 4.38Å; V250-I255 HydrophobicContact CG1-CD1 3.36Å; V250-I255 HydrophobicContact CG1-CG1 4.42Å; N251-I255 PolarHBondContact O-N 2.79Å; N251-I255 VanDerWaalsContact O-N 3.07Å; T252-I255 PolarHBondContact O-N 3.48Å; H253-I255 VanDerWaalsContact C-N 3.27Å; H253-I255 PolarHBondContact O-N 3.43Å; I255-D257 VanDerWaalsContact C-N 3.32Å; I255-D257 PolarHBondContact O-N 2.93Å; I255-Y258 PolarHBondContact O-N 3.41Å; I255-L259 HydrophobicContact CG2-CD1 3.85Å; I255-L259 HydrophobicContact CG2-CG 4.29Å; I255-L259 VanDerWaalsContact O-CG 3.32Å; I255-L259 WeakPolarHBondContact O-CG 3.43Å; I255-L259 PolarHBondContact O-N 3.34Å; I255-L310 HydrophobicContact CG2-CD1 4.01Å; I255-L310 HydrophobicContact CG2-CD2 3.98Å; I255-M373 HydrophobicContact CB-SD 4.33Å; I255-M373 HydrophobicContact CG1-CB 4.41Å; I255-M373 HydrophobicContact CG1-SD 3.57Å; I255-M373 VanDerWaalsContact CG1-SD 3.57Å
256	L	97.1	Very high	96.5	Very high	9 Å²	9	49.4 Å²	49.4	5%	0.047	25%	0.252	C	S	.	.	H	α-helix	trans	-61.2	-42.1	-178.8	-71.1	171.9	0	0	0	111.8	F143 L144 I169 V174 V176 T252 H253 L259 K260	F143-L256 HydrophobicContact CD1-CD2 3.74Å; F143-L256 HydrophobicContact CE1-CD2 3.82Å; L144-L256 HydrophobicContact CB-CD2 4.34Å; L144-L256 HydrophobicContact CD2-CD2 4.04Å; I169-L256 HydrophobicContact CD1-CD1 4.21Å; V174-L256 HydrophobicContact CG1-CD1 4.28Å; V174-L256 HydrophobicContact CG1-CD2 3.92Å; V176-L256 HydrophobicContact CG2-CD1 4.19Å; V176-L256 HydrophobicContact CG2-CD2 3.97Å; T252-L256 HydrophobicContact CG2-CD1 4.44Å; T252-L256 VanDerWaalsContact O-CG 3.26Å; T252-L256 WeakPolarHBondContact O-CG 3.26Å; T252-L256 PolarHBondContact O-N 3.15Å; H253-L256 PolarHBondContact O-N 3.48Å; H253-L256 VanDerWaalsContact O-N 3.11Å; L256-L259 PolarHBondContact O-N 3.24Å; L256-K260 VanDerWaalsContact O-CG 3.29Å; L256-K260 WeakPolarHBondContact O-CG 3.07Å; L256-K260 PolarHBondContact O-N 3.21Å
257	D	96.1	Very high	96.3	Very high	91 Å²	91	50 Å²	50	49%	0.487	26%	0.257	S	S	.	.	H	α-helix	trans	-65.9	-41	178.1	-68.5	-18.8	0	0	0	111.6	H253 I255 K260 S261	H253-D257 PolarHBondContact O-N 2.88Å; I255-D257 VanDerWaalsContact C-N 3.32Å; I255-D257 PolarHBondContact O-N 2.93Å; D257-K260 PolarHBondContact O-N 2.99Å; D257-S261 PolarHBondContact O-N 2.86Å; D257-S261 VanDerWaalsContact O-N 3.15Å
258	Y	97.7	Very high	96.1	Very high	32 Å²	32	54.1 Å²	54.1	13%	0.125	27%	0.274	C	S	.	.	H	α-helix	trans	-60.8	-48.2	173.5	173.2	-94.3	0	0	0	112.1	Q254 I255 K260 S261 L262 L270 I272 L310 H350 M373	Q254-Y258 WeakPolarHBondContact O-CB 3.43Å; Q254-Y258 PolarHBondContact O-N 3.35Å; I255-Y258 PolarHBondContact O-N 3.41Å; Y258-K260 VanDerWaalsContact C-N 3.32Å; Y258-K260 PolarHBondContact O-N 2.93Å; Y258-S261 WeakPolarHBondContact O-CB 3.39Å; Y258-S261 PolarHBondContact O-N 3.44Å; Y258-S261 PolarHBondContact O-OG 2.63Å; Y258-L262 HydrophobicContact CE1-CD1 4.02Å; Y258-L262 HydrophobicContact CE1-CD2 4Å; Y258-L262 HydrophobicContact CE1-CG 4.27Å; Y258-L262 HydrophobicContact CE2-CD2 4.38Å; Y258-L262 PolarHBondContact O-N 3.34Å; Y258-L270 HydrophobicContact CE1-CD1 4.24Å; Y258-I272 HydrophobicContact CD1-CD1 4.1Å; Y258-I272 HydrophobicContact CE1-CD1 3.38Å; Y258-L310 HydrophobicContact CD1-CD2 4.2Å; Y258-L310 HydrophobicContact CE1-CD2 4.44Å; Y258-H350 AromaticContact CD2-NE2 3.98Å; Y258-H350 AromaticContact CE2-CD2 3.89Å; Y258-H350 AromaticContact CE2-NE2 3.8Å; Y258-M373 VanDerWaalsContact CB-CE 3.41Å; Y258-M373 HydrophobicContact CD1-CE 4.44Å; Y258-M373 HydrophobicContact CD2-CE 4Å; Y258-M373 HydrophobicContact CG-CE 3.7Å
259	L	97.4	Very high	95.9	Very high	5 Å²	5	57.7 Å²	57.7	3%	0.026	29%	0.293	C	S	.	.	H	α-helix	trans	-60.8	-40.6	-179.7	-71.6	175.2	0	0	0	112.2	F143 L144 F240 I255 L256 S261 L262 L270 L310	F143-L259 HydrophobicContact CE1-CB 3.92Å; F143-L259 HydrophobicContact CE1-CD1 3.98Å; F143-L259 HydrophobicContact CZ-CB 3.83Å; L144-L259 HydrophobicContact CD1-CD1 4.18Å; F240-L259 HydrophobicContact CB-CD1 3.8Å; F240-L259 HydrophobicContact CB-CD2 4.19Å; F240-L259 HydrophobicContact CD1-CD2 3.47Å; F240-L259 VanDerWaalsContact CD1-CD2 3.47Å; F240-L259 HydrophobicContact CD2-CB 4.3Å; F240-L259 HydrophobicContact CD2-CD1 3.8Å; F240-L259 HydrophobicContact CD2-CD2 3.89Å; F240-L259 HydrophobicContact CD2-CG 4.21Å; F240-L259 HydrophobicContact CE1-CD2 3.7Å; F240-L259 HydrophobicContact CE2-CB 4.23Å; F240-L259 HydrophobicContact CE2-CD2 4.09Å; F240-L259 HydrophobicContact CG-CD1 3.79Å; F240-L259 HydrophobicContact CG-CD2 3.57Å; F240-L259 HydrophobicContact CG-CG 4.22Å; F240-L259 HydrophobicContact CZ-CD2 3.99Å; I255-L259 HydrophobicContact CG2-CD1 3.85Å; I255-L259 HydrophobicContact CG2-CG 4.29Å; I255-L259 VanDerWaalsContact O-CG 3.32Å; I255-L259 WeakPolarHBondContact O-CG 3.43Å; I255-L259 PolarHBondContact O-N 3.34Å; L256-L259 PolarHBondContact O-N 3.24Å; L259-S261 VanDerWaalsContact C-N 3.25Å; L259-S261 PolarHBondContact O-N 3.47Å; L259-L262 HydrophobicContact CD2-CD1 3.97Å; L259-L262 WeakPolarHBondContact O-CB 3.35Å; L259-L262 PolarHBondContact O-N 3.32Å; L259-L270 HydrophobicContact CD2-CD2 3.63Å; L259-L310 HydrophobicContact CD1-CD1 4.32Å; L259-L310 HydrophobicContact CD1-CD2 4.4Å; L259-L310 HydrophobicContact CD2-CD2 3.67Å; L259-L310 HydrophobicContact CD2-CG 4.26Å; L259-L310 HydrophobicContact CG-CD2 4.03Å
260	K	95.6	Very high	95.9	Very high	120 Å²	120	57.9 Å²	57.9	52%	0.522	29%	0.294	S	S	.	.	H	α-helix	trans	-66.7	-25.7	176.2	-71.1	170.3	-174.6	172.5	0	113.3	F143 L256 D257 Y258 L262	F143-K260 HydrophobicContact CZ-CG 4.32Å; L256-K260 VanDerWaalsContact O-CG 3.29Å; L256-K260 WeakPolarHBondContact O-CG 3.07Å; L256-K260 PolarHBondContact O-N 3.21Å; D257-K260 PolarHBondContact O-N 2.99Å; Y258-K260 VanDerWaalsContact C-N 3.32Å; Y258-K260 PolarHBondContact O-N 2.93Å; K260-L262 VanDerWaalsContact C-N 3.31Å
261	S	96.3	Very high	95.9	Very high	88 Å²	88	58.3 Å²	58.3	62%	0.615	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-10.5	178.1	78.5	0	0	0	0	114	D257 Y258 L259	D257-S261 PolarHBondContact O-N 2.86Å; D257-S261 VanDerWaalsContact O-N 3.15Å; Y258-S261 WeakPolarHBondContact O-CB 3.39Å; Y258-S261 PolarHBondContact O-N 3.44Å; Y258-S261 PolarHBondContact O-OG 2.63Å; L259-S261 VanDerWaalsContact C-N 3.25Å; L259-S261 PolarHBondContact O-N 3.47Å
262	L	96.6	Very high	95.9	Very high	28 Å²	28	57.9 Å²	57.9	15%	0.147	29%	0.293	C	S	.	.	S	Bend	trans	-73.7	137.7	-176.6	-65.1	176.5	0	0	0	112.1	F240 Y258 L259 K260 K266 A267 L270	F240-L262 HydrophobicContact CE1-CD1 4.36Å; F240-L262 HydrophobicContact CZ-CD1 4.49Å; Y258-L262 HydrophobicContact CE1-CD1 4.02Å; Y258-L262 HydrophobicContact CE1-CD2 4Å; Y258-L262 HydrophobicContact CE1-CG 4.27Å; Y258-L262 HydrophobicContact CE2-CD2 4.38Å; Y258-L262 PolarHBondContact O-N 3.34Å; L259-L262 HydrophobicContact CD2-CD1 3.97Å; L259-L262 WeakPolarHBondContact O-CB 3.35Å; L259-L262 PolarHBondContact O-N 3.32Å; K260-L262 VanDerWaalsContact C-N 3.31Å; L262-K266 HydrophobicContact CD2-CD 3.93Å; L262-K266 HydrophobicContact CD2-CG 4.18Å; L262-A267 HydrophobicContact CB-CB 4.33Å; L262-L270 HydrophobicContact CD1-CD1 3.94Å; L262-L270 HydrophobicContact CD1-CD2 3.71Å; L262-L270 HydrophobicContact CD1-CG 4.34Å
263	S	95.9	Very high	95.9	Very high	72 Å²	72	57.9 Å²	57.9	50%	0.503	29%	0.293	S	S	.	.			trans	-64	150.6	162.5	61.8	0	0	0	0	110.7	D265 K266 A267	S263-D265 VanDerWaalsContact C-N 3.28Å; S263-D265 PolarHBondContact O-N 2.99Å; S263-K266 PolarHBondContact O-N 2.99Å; S263-K266 VanDerWaalsContact O-N 3.14Å; S263-K266 VanDerWaalsContact OG-CB 3.31Å; S263-K266 WeakPolarHBondContact OG-CB 3.47Å; S263-K266 PolarHBondContact OG-N 3.25Å; S263-A267 PolarHBondContact O-N 3.15Å
264	K	91.4	Very high	96	Very high	191 Å²	191	55.3 Å²	55.3	83%	0.83	28%	0.282	S	S	*	.	H	α-helix	trans	-52	-42.3	177.5	-67	-173.9	178.7	-177.9	0	113.6	A267 K268	K264-A267 PolarHBondContact O-N 3.45Å; K264-K268 PolarHBondContact O-N 3.33Å
265	D	90.7	Very high	96	Very high	145 Å²	145	53.1 Å²	53.1	78%	0.775	27%	0.272	S	S	*	.	H	α-helix	trans	-65	-46.2	-179.3	-60.9	-28.4	0	0	0	111.5	S263 A267 K268	S263-D265 VanDerWaalsContact C-N 3.28Å; S263-D265 PolarHBondContact O-N 2.99Å; D265-A267 VanDerWaalsContact C-N 3.32Å; D265-A267 PolarHBondContact O-N 3.41Å; D265-K268 PolarHBondContact O-N 2.82Å
266	K	92.6	Very high	95.9	Very high	79 Å²	79	55.7 Å²	55.7	34%	0.343	29%	0.286	S	S	.	.	H	α-helix	trans	-65.8	-33.6	176.1	-168	169.5	-175.5	167.7	0	112.9	L262 S263 K268 L270 E348	L262-K266 HydrophobicContact CD2-CD 3.93Å; L262-K266 HydrophobicContact CD2-CG 4.18Å; S263-K266 PolarHBondContact O-N 2.99Å; S263-K266 VanDerWaalsContact O-N 3.14Å; S263-K266 VanDerWaalsContact OG-CB 3.31Å; S263-K266 WeakPolarHBondContact OG-CB 3.47Å; S263-K266 PolarHBondContact OG-N 3.25Å; K266-K268 VanDerWaalsContact C-N 3.32Å; K266-K268 PolarHBondContact O-N 3.26Å; K266-L270 PolarHBondContact O-N 3.42Å; K266-E348 VanDerWaalsContact CE-OE2 3.28Å; K266-E348 WeakPolarHBondContact CE-OE2 3.21Å; K266-E348 IonicContact NZ-OE2 2.75Å; K266-E348 PolarHBondContact NZ-OE2 3.35Å
267	A	94.7	Very high	95.8	Very high	19 Å²	19	61.7 Å²	61.7	16%	0.157	31%	0.311	C	S	.	.	H	α-helix	trans	-64.7	-36	179.3	0	0	0	0	0	112.5	F240 L262 S263 K264 D265 L270 S312	F240-A267 HydrophobicContact CE1-CB 4.12Å; F240-A267 HydrophobicContact CZ-CB 3.85Å; L262-A267 HydrophobicContact CB-CB 4.33Å; S263-A267 PolarHBondContact O-N 3.15Å; K264-A267 PolarHBondContact O-N 3.45Å; D265-A267 VanDerWaalsContact C-N 3.32Å; D265-A267 PolarHBondContact O-N 3.41Å; A267-L270 PolarHBondContact O-N 3.11Å; A267-S312 WeakPolarHBondContact O-CB 3.29Å
268	K	93.2	Very high	95.7	Very high	123 Å²	123	65.2 Å²	65.2	54%	0.535	33%	0.33	S	S	.	.	H	α-helix	trans	-63.8	-44.3	-174.3	-172.3	175.9	-177.4	179.8	0	113.6	K264 D265 K266 S312 D314	K264-K268 PolarHBondContact O-N 3.33Å; D265-K268 PolarHBondContact O-N 2.82Å; K266-K268 VanDerWaalsContact C-N 3.32Å; K266-K268 PolarHBondContact O-N 3.26Å; K268-S312 WeakPolarHBondContact O-CB 3.33Å; K268-S312 PolarHBondContact O-OG 3.34Å; K268-D314 HydrophobicContact CG-CB 4.47Å
269	D	94.3	Very high	95.5	Very high	74 Å²	74	64.7 Å²	64.7	40%	0.396	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	20.8	-177.9	-67.5	-28.6	0	0	0	112.7	F271 R318	D269-F271 PolarHBondContact O-N 2.68Å; D269-R318 IonicContact OD1-CZ 2.93Å; D269-R318 IonicContact OD1-NH1 2.69Å; D269-R318 PolarHBondContact OD1-NH1 3.35Å
270	L	98.4	Very high	95.4	Very high	5 Å²	5	65.9 Å²	65.9	3%	0.026	35%	0.345	C	S	.	.			trans	-58.7	125	-177.7	-176.6	73.8	0	0	0	110.6	F240 Y258 L259 L262 K266 A267 I272 L310 Y311 S312 L315	F240-L270 HydrophobicContact CD1-CD2 3.86Å; F240-L270 HydrophobicContact CE1-CD2 3.87Å; Y258-L270 HydrophobicContact CE1-CD1 4.24Å; L259-L270 HydrophobicContact CD2-CD2 3.63Å; L262-L270 HydrophobicContact CD1-CD1 3.94Å; L262-L270 HydrophobicContact CD1-CD2 3.71Å; L262-L270 HydrophobicContact CD1-CG 4.34Å; K266-L270 PolarHBondContact O-N 3.42Å; A267-L270 PolarHBondContact O-N 3.11Å; L270-I272 HydrophobicContact CD1-CG1 4.47Å; L270-I272 HydrophobicContact CD1-CG2 3.75Å; L270-L310 HydrophobicContact CD2-CD2 4.34Å; L270-L310 HydrophobicContact CD2-CG 4.31Å; L270-Y311 CarbonylContact O-C 3.03Å; L270-Y311 WeakPolarHBondContact O-CA 3.37Å; L270-Y311 WeakPolarHBondContact O-CB 3.39Å; L270-S312 PolarHBondContact O-N 2.56Å; L270-L315 WeakPolarHBondContact O-CD2 3.23Å
271	F	98.6	Very high	95.5	Very high	9 Å²	9	60.9 Å²	60.9	4%	0.039	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	110.6	160.9	-162.8	-65.7	0	0	0	108.7	D269 A304 F309 L310 Y311 L315 L319 T336 L340 P347 E348	D269-F271 PolarHBondContact O-N 2.68Å; F271-A304 HydrophobicContact CE1-CB 3.9Å; F271-F309 HydrophobicContact CE1-CB 4.09Å; F271-F309 HydrophobicContact CE1-CD2 4.02Å; F271-F309 HydrophobicContact CE1-CG 4.08Å; F271-F309 HydrophobicContact CE2-CD2 4.19Å; F271-F309 HydrophobicContact CE2-CE2 4.3Å; F271-F309 HydrophobicContact CZ-CB 4.46Å; F271-F309 AromaticContact CZ-CD2 3.52Å; F271-F309 HydrophobicContact CZ-CD2 3.52Å; F271-F309 AromaticContact CZ-CE2 3.77Å; F271-F309 HydrophobicContact CZ-CE2 3.77Å; F271-F309 AromaticContact CZ-CG 3.99Å; F271-F309 HydrophobicContact CZ-CG 3.99Å; F271-F309 HydrophobicContact CZ-CZ 4.42Å; F271-L310 CarbonylContact C-O 3.53Å; F271-L310 WeakPolarHBondContact CA-O 3.35Å; F271-Y311 HydrophobicContact CD2-CG 4.17Å; F271-Y311 HydrophobicContact CE2-CD1 4.3Å; F271-Y311 HydrophobicContact CE2-CG 4.3Å; F271-L315 HydrophobicContact CB-CD2 3.71Å; F271-L315 HydrophobicContact CD2-CD2 3.78Å; F271-L315 HydrophobicContact CG-CD2 4.25Å; F271-L319 HydrophobicContact CD2-CD1 4.44Å; F271-L319 HydrophobicContact CE2-CD1 4.18Å; F271-T336 HydrophobicContact CE2-CG2 3.78Å; F271-T336 HydrophobicContact CZ-CG2 3.67Å; F271-L340 HydrophobicContact CD1-CD1 3.96Å; F271-L340 HydrophobicContact CD2-CD1 3.78Å; F271-L340 HydrophobicContact CD2-CD2 3.79Å; F271-L340 HydrophobicContact CD2-CG 4.27Å; F271-L340 HydrophobicContact CE1-CD1 3.97Å; F271-L340 HydrophobicContact CE2-CD1 3.79Å; F271-L340 HydrophobicContact CE2-CD2 4.27Å; F271-L340 HydrophobicContact CE2-CG 4.33Å; F271-L340 HydrophobicContact CG-CD1 3.86Å; F271-L340 HydrophobicContact CG-CD2 4.25Å; F271-L340 HydrophobicContact CZ-CD1 3.89Å; F271-P347 HydrophobicContact CD1-CB 3.43Å; F271-P347 VanDerWaalsContact CD1-CB 3.43Å; F271-P347 HydrophobicContact CE1-CB 3.89Å; F271-P347 HydrophobicContact CG-CB 4.27Å; F271-E348 PolarHBondContact O-N 2.75Å
272	I	98.5	Very high	95.5	Very high	1 Å²	1	61 Å²	61	1%	0.005	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	150.9	-178.4	64.5	165.2	0	0	0	112.7	Y258 L270 F309 L310 E348 H350 F353	Y258-I272 HydrophobicContact CD1-CD1 4.1Å; Y258-I272 HydrophobicContact CE1-CD1 3.38Å; L270-I272 HydrophobicContact CD1-CG1 4.47Å; L270-I272 HydrophobicContact CD1-CG2 3.75Å; I272-F309 WeakPolarHBondContact O-CA 3.45Å; I272-F309 VanDerWaalsContact O-CB 3.28Å; I272-F309 WeakPolarHBondContact O-CB 3.39Å; I272-L310 HydrophobicContact CD1-CB 4.4Å; I272-L310 HydrophobicContact CD1-CD2 4.06Å; I272-L310 HydrophobicContact CG1-CB 3.86Å; I272-L310 HydrophobicContact CG1-CD2 4.31Å; I272-L310 PolarHBondContact N-O 2.74Å; I272-L310 PolarHBondContact O-N 3.26Å; I272-E348 VanDerWaalsContact CA-O 3.26Å; I272-E348 WeakPolarHBondContact CA-O 3.48Å; I272-E348 HydrophobicContact CG2-CB 3.88Å; I272-H350 HydrophobicContact CB-CB 4.15Å; I272-H350 HydrophobicContact CD1-CB 4.06Å; I272-F353 HydrophobicContact CD1-CE2 3.93Å; I272-F353 HydrophobicContact CD1-CZ 4.5Å; I272-F353 HydrophobicContact CG1-CE2 4.12Å; I272-F353 HydrophobicContact CG1-CZ 4.39Å
273	G	98.3	Very high	95.5	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.5	-159.9	172.8	0	0	0	0	0	111.4	V275 E348 K349 H350	G273-V275 PolarHBondContact O-N 3Å; G273-E348 PolarHBondContact N-O 2.75Å; G273-K349 WeakPolarHBondContact O-CA 3.17Å; G273-H350 PolarHBondContact O-N 3.27Å
274	D	97.8	Very high	95.5	Very high	18 Å²	18	65.5 Å²	65.5	10%	0.096	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	95.7	165.2	-171.8	25.4	0	0	0	109.9	A304 G305 K349 F353 T355	D274-A304 WeakPolarHBondContact O-CA 3.44Å; D274-G305 PolarHBondContact O-N 3.36Å; D274-K349 WeakPolarHBondContact OD1-CE 3.1Å; D274-K349 IonicContact OD1-NZ 2.8Å; D274-K349 PolarHBondContact OD1-NZ 3Å; D274-F353 HydrophobicContact CB-CB 4.07Å; D274-T355 HydrophobicContact CB-CG2 3.69Å; D274-T355 PolarHBondContact OD2-OG1 3.12Å
275	V	97.7	Very high	95.6	Very high	7 Å²	7	63.9 Å²	63.9	4%	0.042	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	127.2	-174.8	178.2	0	0	0	0	111	G273 K277 P302 Y303 A304 P347 E348 K349	G273-V275 PolarHBondContact O-N 3Å; V275-K277 HydrophobicContact CG1-CG 4.18Å; V275-P302 HydrophobicContact CG1-CB 4.32Å; V275-Y303 WeakPolarHBondContact CA-O 3.39Å; V275-A304 HydrophobicContact CG2-CB 4.18Å; V275-P347 HydrophobicContact CG1-CG 3.91Å; V275-P347 HydrophobicContact CG2-CB 3.71Å; V275-P347 HydrophobicContact CG2-CG 3.87Å; V275-E348 VanDerWaalsContact CG2-C 3.48Å; V275-E348 WeakPolarHBondContact CG2-O 3.21Å; V275-K349 HydrophobicContact CB-CB 4.04Å; V275-K349 HydrophobicContact CG2-CB 4.36Å
276	I	95.1	Very high	95.7	Very high	54 Å²	54	65.7 Å²	65.7	28%	0.277	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	131.7	172.5	-55.7	173.9	0	0	0	107.8	A279 P302 Y303	I276-A279 HydrophobicContact CG2-CB 3.75Å; I276-P302 WeakPolarHBondContact O-CA 3.34Å; I276-Y303 HydrophobicContact CB-CE1 4.23Å; I276-Y303 HydrophobicContact CB-CE2 4.49Å; I276-Y303 HydrophobicContact CD1-CE2 3.93Å; I276-Y303 HydrophobicContact CG2-CE1 4.4Å; I276-Y303 PolarHBondContact N-O 3.5Å; I276-Y303 PolarHBondContact O-N 2.91Å
277	K	95.2	Very high	95.7	Very high	135 Å²	135	65.2 Å²	65.2	59%	0.587	32%	0.32	S	S	*	.			trans	-120.7	159.6	176.6	-62.4	-173.8	-179.9	-175.4	0	109.5	V275 A279 P302	V275-K277 HydrophobicContact CG1-CG 4.18Å; K277-A279 PolarHBondContact O-N 2.96Å; K277-A279 VanDerWaalsContact O-N 3.09Å; K277-P302 HydrophobicContact CG-CB 4.26Å; K277-P302 HydrophobicContact CG-CG 4.47Å
278	D	93.5	Very high	95.6	Very high	165 Å²	165	70 Å²	70	88%	0.882	34%	0.337	S	S	*	.	S	Bend	trans	55.5	29.1	175.5	-49.6	-51	0	0	0	113.5
279	A	94.2	Very high	95.7	Very high	20 Å²	20	68.5 Å²	68.5	17%	0.165	33%	0.329	C	S	.	.			trans	-86.7	162.7	178.5	0	0	0	0	0	111.8	I276 K277 Y300 Y303	I276-A279 HydrophobicContact CG2-CB 3.75Å; K277-A279 PolarHBondContact O-N 2.96Å; K277-A279 VanDerWaalsContact O-N 3.09Å; A279-Y300 HydrophobicContact CB-CD2 4.32Å; A279-Y300 PolarHBondContact O-N 2.82Å; A279-Y303 HydrophobicContact CB-CE1 4.06Å
280	G	95.8	Very high	95.8	Very high	30 Å²	30	65.9 Å²	65.9	31%	0.309	31%	0.313	S	S	.	.			trans	-148	170.5	173.6	0	0	0	0	0	111.8	H282	G280-H282 PolarHBondContact O-N 3.37Å
281	P	96.9	Very high	95.8	Very high	16 Å²	16	65.7 Å²	65.7	10%	0.104	31%	0.312	C	S	.	.			trans	-58.8	131.6	177.1	24.9	-36.3	0	0	0	112	R283 I291 Y296 G298 Y300	P281-R283 PolarHBondContact O-N 3.47Å; P281-I291 HydrophobicContact CB-CB 3.84Å; P281-I291 HydrophobicContact CB-CG1 4.44Å; P281-I291 HydrophobicContact CB-CG2 4.3Å; P281-Y296 HydrophobicContact CB-CD1 4.38Å; P281-Y296 HydrophobicContact CG-CD1 4Å; P281-Y296 HydrophobicContact CG-CE1 4.41Å; P281-G298 VanDerWaalsContact CD-O 3.26Å; P281-G298 WeakPolarHBondContact CD-O 3.29Å; P281-Y300 WeakPolarHBondContact CA-OH 3.44Å; P281-Y300 HydrophobicContact CB-CE1 4.33Å
282	H	96.4	Very high	95.7	Very high	91 Å²	91	65.4 Å²	65.4	42%	0.421	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-68.7	126.4	170.4	-68	-69.1	0	0	0	110	G280 L287 Y290 I291	G280-H282 PolarHBondContact O-N 3.37Å; H282-L287 HydrophobicContact CB-CB 4.45Å; H282-L287 HydrophobicContact CB-CD1 3.85Å; H282-Y290 CarbonylContact O-C 3.59Å; H282-Y290 WeakPolarHBondContact O-CA 3.47Å; H282-Y290 WeakPolarHBondContact O-CD2 3.49Å; H282-I291 PolarHBondContact O-N 3.39Å
283	R	96.2	Very high	95.6	Very high	86 Å²	86	72.1 Å²	72.1	33%	0.325	34%	0.342	S	S	.	.			trans	-98.5	-6.1	-176.9	-56.1	-51.7	-167.1	-177.7	4.7	114.4	P281 K285 Y290 I291 P292 Y296	P281-R283 PolarHBondContact O-N 3.47Å; R283-K285 PolarHBondContact O-N 3.47Å; R283-Y290 VanDerWaalsContact O-CE2 3.23Å; R283-Y290 WeakPolarHBondContact O-CE2 3.42Å; R283-I291 WeakPolarHBondContact CD-O 3.42Å; R283-I291 PolarHBondContact NH1-O 3.23Å; R283-P292 VanDerWaalsContact NH1-C 3.26Å; R283-P292 PolarHBondContact NH1-O 2.93Å; R283-P292 VanDerWaalsContact NH1-O 3.1Å; R283-Y296 VanDerWaalsContact CZ-O 3.31Å; R283-Y296 PolarHBondContact NH1-O 2.85Å; R283-Y296 PolarHBondContact NH2-O 3.26Å
284	E	95.4	Very high	95.5	Very high	108 Å²	108	73 Å²	73	51%	0.505	35%	0.349	S	S	.	.			trans	-82.6	118	176.6	-177	178.1	-177.7	0	0	110.9	K286 L287 Y290	E284-K286 HydrophobicContact CG-CB 4.38Å; E284-K286 PolarHBondContact O-N 2.8Å; E284-L287 HydrophobicContact CB-CD1 3.84Å; E284-L287 HydrophobicContact CB-CG 3.98Å; E284-L287 HydrophobicContact CG-CG 4.32Å; E284-L287 WeakPolarHBondContact O-CB 3.33Å; E284-L287 PolarHBondContact O-N 3.09Å; E284-Y290 WeakPolarHBondContact O-CB 3.38Å; E284-Y290 WeakPolarHBondContact O-CD2 3.27Å
285	K	93.7	Very high	95.4	Very high	156 Å²	156	72.1 Å²	72.1	68%	0.678	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-25.4	-175	-67.7	-175.9	178.8	-174.9	0	114.9	R283 Y290	R283-K285 PolarHBondContact O-N 3.47Å; K285-Y290 HydrophobicContact CG-CD2 4.41Å; K285-Y290 HydrophobicContact CG-CE1 4.02Å; K285-Y290 HydrophobicContact CG-CE2 3.87Å
286	K	92.7	Very high	95.4	Very high	184 Å²	184	72.5 Å²	72.5	80%	0.8	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-17.7	-178.5	-64	-179.7	-179.2	176.6	0	113.2	E284	E284-K286 HydrophobicContact CG-CB 4.38Å; E284-K286 PolarHBondContact O-N 2.8Å
287	L	93.9	Very high	95.4	Very high	69 Å²	69	72.5 Å²	72.5	36%	0.361	34%	0.343	S	S	.	.	S	Bend	trans	-76.5	142.1	-177.7	-63.9	177.2	0	0	0	111	H282 E284 Y289 Y290	H282-L287 HydrophobicContact CB-CB 4.45Å; H282-L287 HydrophobicContact CB-CD1 3.85Å; E284-L287 HydrophobicContact CB-CD1 3.84Å; E284-L287 HydrophobicContact CB-CG 3.98Å; E284-L287 HydrophobicContact CG-CG 4.32Å; E284-L287 WeakPolarHBondContact O-CB 3.33Å; E284-L287 PolarHBondContact O-N 3.09Å; L287-Y289 PolarHBondContact O-N 3.02Å; L287-Y290 VanDerWaalsContact O-CB 3.28Å; L287-Y290 WeakPolarHBondContact O-CB 3.39Å; L287-Y290 PolarHBondContact O-N 2.89Å
288	K	91.9	Very high	95.4	Very high	120 Å²	120	68.5 Å²	68.5	52%	0.522	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-43.7	178.3	-179.3	-177.7	175.4	-166.7	0	111.9
289	Y	94.6	Very high	95.5	Very high	91 Å²	91	65 Å²	65	36%	0.357	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	26.3	-177.1	-52	-67.9	0	0	0	113	F217 L287 I291 I331	F217-Y289 AromaticContact CE1-CD1 3.94Å; F217-Y289 HydrophobicContact CE1-CD1 3.94Å; F217-Y289 HydrophobicContact CE1-CE1 4.14Å; F217-Y289 HydrophobicContact CE2-CD1 4.38Å; F217-Y289 AromaticContact CE2-CE1 3.75Å; F217-Y289 HydrophobicContact CE2-CE1 3.75Å; F217-Y289 AromaticContact CZ-CD1 3.47Å; F217-Y289 HydrophobicContact CZ-CD1 3.47Å; F217-Y289 VanDerWaalsContact CZ-CD1 3.47Å; F217-Y289 AromaticContact CZ-CE1 3.26Å; F217-Y289 HydrophobicContact CZ-CE1 3.26Å; L287-Y289 PolarHBondContact O-N 3.02Å; Y289-I291 PolarHBondContact O-N 3.29Å; Y289-I331 HydrophobicContact CD1-CD1 4.46Å
290	Y	97.4	Very high	95.7	Very high	19 Å²	19	64.7 Å²	64.7	8%	0.075	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-53.8	135.7	172.2	167.8	-115.9	0	0	0	110.8	F116 H282 R283 E284 K285 L287 P292	F116-Y290 AromaticContact CE2-CD1 3.91Å; F116-Y290 HydrophobicContact CE2-CD1 3.91Å; F116-Y290 HydrophobicContact CE2-CE1 4.14Å; F116-Y290 HydrophobicContact CZ-CD1 4.2Å; F116-Y290 HydrophobicContact CZ-CE1 4.5Å; F116-Y290 VanDerWaalsContact CZ-O 3.32Å; F116-Y290 WeakPolarHBondContact CZ-O 3.21Å; H282-Y290 CarbonylContact O-C 3.59Å; H282-Y290 WeakPolarHBondContact O-CA 3.47Å; H282-Y290 WeakPolarHBondContact O-CD2 3.49Å; R283-Y290 VanDerWaalsContact O-CE2 3.23Å; R283-Y290 WeakPolarHBondContact O-CE2 3.42Å; E284-Y290 WeakPolarHBondContact O-CB 3.38Å; E284-Y290 WeakPolarHBondContact O-CD2 3.27Å; K285-Y290 HydrophobicContact CG-CD2 4.41Å; K285-Y290 HydrophobicContact CG-CE1 4.02Å; K285-Y290 HydrophobicContact CG-CE2 3.87Å; L287-Y290 VanDerWaalsContact O-CB 3.28Å; L287-Y290 WeakPolarHBondContact O-CB 3.39Å; L287-Y290 PolarHBondContact O-N 2.89Å; Y290-P292 HydrophobicContact CE1-CG 3.67Å
291	I	97.9	Very high	95.8	Very high	1 Å²	1	63.7 Å²	63.7	1%	0.005	31%	0.312	C	S	.	.			trans	-135.1	121.5	170.6	-57.7	-68.3	0	0	0	109.1	F116 P281 H282 R283 Y289 V295 P330 I331	F116-I291 HydrophobicContact CE1-CD1 4.06Å; F116-I291 HydrophobicContact CZ-CD1 4.2Å; P281-I291 HydrophobicContact CB-CB 3.84Å; P281-I291 HydrophobicContact CB-CG1 4.44Å; P281-I291 HydrophobicContact CB-CG2 4.3Å; H282-I291 PolarHBondContact O-N 3.39Å; R283-I291 WeakPolarHBondContact CD-O 3.42Å; R283-I291 PolarHBondContact NH1-O 3.23Å; Y289-I291 PolarHBondContact O-N 3.29Å; I291-V295 HydrophobicContact CG2-CB 4.31Å; I291-V295 HydrophobicContact CG2-CG1 4.32Å; I291-P330 HydrophobicContact CD1-CB 3.88Å; I291-P330 HydrophobicContact CD1-CG 3.99Å; I291-I331 HydrophobicContact CD1-CD1 4.26Å; I291-I331 HydrophobicContact CD1-CG1 4.39Å; I291-I331 HydrophobicContact CG1-CD1 4.14Å
292	P	96.9	Very high	95.8	Very high	2 Å²	2	65 Å²	65	1%	0.013	32%	0.321	C	S	.	.			trans	-62.8	150.3	176.5	-16	24.2	0	0	0	113	L112 F116 R283 Y290 S294 V295 Y296	L112-P292 HydrophobicContact CD2-CB 4.09Å; L112-P292 HydrophobicContact CD2-CG 3.62Å; F116-P292 HydrophobicContact CD1-CG 4.41Å; F116-P292 HydrophobicContact CE1-CG 4.15Å; F116-P292 HydrophobicContact CE2-CG 4.31Å; F116-P292 HydrophobicContact CZ-CG 4.09Å; R283-P292 VanDerWaalsContact NH1-C 3.26Å; R283-P292 PolarHBondContact NH1-O 2.93Å; R283-P292 VanDerWaalsContact NH1-O 3.1Å; Y290-P292 HydrophobicContact CE1-CG 3.67Å; P292-S294 VanDerWaalsContact C-N 3.26Å; P292-S294 PolarHBondContact O-N 3.01Å; P292-V295 HydrophobicContact CB-CB 4.38Å; P292-V295 HydrophobicContact CB-CG2 3.96Å; P292-V295 HydrophobicContact CG-CB 4.4Å; P292-V295 HydrophobicContact CG-CG2 3.74Å; P292-V295 PolarHBondContact O-N 2.91Å; P292-V295 VanDerWaalsContact O-N 3.15Å; P292-Y296 PolarHBondContact O-N 2.91Å; P292-Y296 VanDerWaalsContact O-N 3.15Å
293	E	96.1	Very high	95.9	Very high	142 Å²	142	62.1 Å²	62.1	66%	0.664	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-33	174.1	-70.5	-171.3	169	0	0	112.6	A57 V295	A57-E293 VanDerWaalsContact CB-O 3.24Å; A57-E293 WeakPolarHBondContact CB-O 3.28Å; E293-V295 PolarHBondContact O-N 2.86Å
294	S	96	Very high	96	Very high	19 Å²	19	58.2 Å²	58.2	13%	0.133	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-24.2	175	56.2	0	0	0	0	113.5	A57 Y58 D108 P292	A57-S294 WeakPolarHBondContact CA-O 3.49Å; Y58-S294 PolarHBondContact N-O 3.24Å; D108-S294 VanDerWaalsContact CG-OG 3.24Å; D108-S294 WeakPolarHBondContact OD1-CB 3.27Å; D108-S294 PolarHBondContact OD1-OG 3.22Å; D108-S294 PolarHBondContact OD2-OG 3.36Å; P292-S294 VanDerWaalsContact C-N 3.26Å; P292-S294 PolarHBondContact O-N 3.01Å
295	V	96.6	Very high	95.7	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-50.7	179.7	177.2	0	0	0	0	110.6	W59 L112 F116 L120 I291 P292 E293	W59-V295 WeakPolarHBondContact CB-O 3.43Å; W59-V295 PolarHBondContact N-O 3Å; L112-V295 HydrophobicContact CD1-CG2 4.28Å; F116-V295 HydrophobicContact CD1-CG1 4.48Å; F116-V295 HydrophobicContact CD1-CG2 4.03Å; F116-V295 HydrophobicContact CE1-CG1 4.48Å; F116-V295 HydrophobicContact CE1-CG2 4.38Å; L120-V295 HydrophobicContact CD1-CG2 4.38Å; L120-V295 HydrophobicContact CD2-CG1 4.5Å; I291-V295 HydrophobicContact CG2-CB 4.31Å; I291-V295 HydrophobicContact CG2-CG1 4.32Å; P292-V295 HydrophobicContact CB-CB 4.38Å; P292-V295 HydrophobicContact CB-CG2 3.96Å; P292-V295 HydrophobicContact CG-CB 4.4Å; P292-V295 HydrophobicContact CG-CG2 3.74Å; P292-V295 PolarHBondContact O-N 2.91Å; P292-V295 VanDerWaalsContact O-N 3.15Å; E293-V295 PolarHBondContact O-N 2.86Å
296	Y	97.4	Very high	95.1	Very high	14 Å²	14	47.3 Å²	47.3	6%	0.055	25%	0.253	C	S	.	.			trans	-142.9	136.3	-178.4	-177.8	-93.1	0	0	0	112.3	W59 N60 P281 R283 P292 S299 Y300 Y329 M338	W59-Y296 HydrophobicContact CB-CD2 4.43Å; W59-Y296 AromaticContact CD2-CD2 3.98Å; W59-Y296 HydrophobicContact CD2-CD2 3.98Å; W59-Y296 HydrophobicContact CD2-CE2 4.31Å; W59-Y296 AromaticContact CE3-CD2 3.5Å; W59-Y296 HydrophobicContact CE3-CD2 3.5Å; W59-Y296 VanDerWaalsContact CE3-CD2 3.5Å; W59-Y296 AromaticContact CE3-CE2 3.53Å; W59-Y296 HydrophobicContact CE3-CE2 3.53Å; W59-Y296 HydrophobicContact CG-CD2 4.38Å; W59-Y296 HydrophobicContact CH2-CE2 4.49Å; W59-Y296 HydrophobicContact CZ3-CD2 4.12Å; W59-Y296 AromaticContact CZ3-CE2 3.65Å; W59-Y296 HydrophobicContact CZ3-CE2 3.65Å; N60-Y296 WeakPolarHBondContact OD1-CA 3.39Å; N60-Y296 WeakPolarHBondContact OD1-CD2 3.48Å; P281-Y296 HydrophobicContact CB-CD1 4.38Å; P281-Y296 HydrophobicContact CG-CD1 4Å; P281-Y296 HydrophobicContact CG-CE1 4.41Å; R283-Y296 VanDerWaalsContact CZ-O 3.31Å; R283-Y296 PolarHBondContact NH1-O 2.85Å; R283-Y296 PolarHBondContact NH2-O 3.26Å; P292-Y296 PolarHBondContact O-N 2.91Å; P292-Y296 VanDerWaalsContact O-N 3.15Å; Y296-S299 PolarHBondContact OH-O 3.44Å; Y296-S299 VanDerWaalsContact OH-O 3.1Å; Y296-Y300 HydrophobicContact CD1-CD1 4.49Å; Y296-Y300 AromaticContact CD1-CE1 3.87Å; Y296-Y300 HydrophobicContact CD1-CE1 3.87Å; Y296-Y300 AromaticContact CE1-CD1 3.7Å; Y296-Y300 HydrophobicContact CE1-CD1 3.7Å; Y296-Y300 AromaticContact CE1-CE1 3.52Å; Y296-Y300 HydrophobicContact CE1-CE1 3.52Å; Y296-Y329 HydrophobicContact CD2-CD2 4.42Å; Y296-Y329 AromaticContact CD2-CE2 3.6Å; Y296-Y329 HydrophobicContact CD2-CE2 3.6Å; Y296-Y329 HydrophobicContact CE2-CE2 4.22Å; Y296-Y329 AromaticContact CG-CE2 3.77Å; Y296-Y329 HydrophobicContact CG-CE2 3.77Å; Y296-M338 HydrophobicContact CD2-CE 4.44Å; Y296-M338 HydrophobicContact CE2-CE 3.64Å
297	E	95.1	Very high	95	Very high	54 Å²	54	38.6 Å²	38.6	25%	0.252	22%	0.216	S	C	.	.			trans	-121.6	156.8	173.3	71.5	-175.8	-175.8	0	0	112.3	H55 K56 A57 N60	H55-E297 WeakPolarHBondContact CA-OE1 3.29Å; H55-E297 WeakPolarHBondContact CB-OE1 3.35Å; H55-E297 IonicContact CE1-OE1 3.86Å; H55-E297 IonicContact CG-OE1 2.86Å; H55-E297 IonicContact ND1-OE1 3.11Å; H55-E297 PolarHBondContact ND1-OE1 2.8Å; K56-E297 PolarHBondContact N-OE1 3.01Å; K56-E297 VanDerWaalsContact N-OE1 3.15Å; A57-E297 HydrophobicContact CB-CB 3.86Å; A57-E297 HydrophobicContact CB-CG 3.78Å; N60-E297 HydrophobicContact CB-CG 4.35Å; N60-E297 PolarHBondContact ND2-O 3.28Å; N60-E297 PolarHBondContact OD1-N 3.25Å
298	G	94.4	Very high	95.1	Very high	51 Å²	51	35.5 Å²	35.5	53%	0.526	20%	0.2	S	C	.	.	S	Bend	trans	94.1	-169.4	-178.3	0	0	0	0	0	114.1	P281	P281-G298 VanDerWaalsContact CD-O 3.26Å; P281-G298 WeakPolarHBondContact CD-O 3.29Å
299	S	96.3	Very high	95.4	Very high	92 Å²	92	29.9 Å²	29.9	64%	0.643	18%	0.176	S	C	*	.	P	Polyproline II helix	trans	-101	152.4	-178.7	-58.4	0	0	0	0	110.9	Y296	Y296-S299 PolarHBondContact OH-O 3.44Å; Y296-S299 VanDerWaalsContact OH-O 3.1Å
300	Y	97.8	Very high	95.6	Very high	14 Å²	14	25.6 Å²	25.6	6%	0.055	16%	0.159	C	C	.	.	P	Polyproline II helix	trans	-75.1	146.3	173.8	-64.7	-29.8	0	0	0	111.7	A279 P281 Y296 Y303 Y329 V334	A279-Y300 HydrophobicContact CB-CD2 4.32Å; A279-Y300 PolarHBondContact O-N 2.82Å; P281-Y300 WeakPolarHBondContact CA-OH 3.44Å; P281-Y300 HydrophobicContact CB-CE1 4.33Å; Y296-Y300 HydrophobicContact CD1-CD1 4.49Å; Y296-Y300 AromaticContact CD1-CE1 3.87Å; Y296-Y300 HydrophobicContact CD1-CE1 3.87Å; Y296-Y300 AromaticContact CE1-CD1 3.7Å; Y296-Y300 HydrophobicContact CE1-CD1 3.7Å; Y296-Y300 AromaticContact CE1-CE1 3.52Å; Y296-Y300 HydrophobicContact CE1-CE1 3.52Å; Y300-Y303 HydrophobicContact CD2-CE1 4.1Å; Y300-Y329 AromaticContact CE1-CE1 3.84Å; Y300-Y329 HydrophobicContact CE1-CE1 3.84Å; Y300-Y329 AromaticContact CE1-CZ 3.68Å; Y300-Y329 WeakPolarHBondContact CE1-OH 3.44Å; Y300-Y329 AromaticContact CZ-CE1 3.94Å; Y300-Y329 PolarHBondContact OH-OH 2.86Å; Y300-V334 HydrophobicContact CD1-CG1 3.59Å; Y300-V334 HydrophobicContact CD2-CG1 4.25Å; Y300-V334 HydrophobicContact CD2-CG2 3.84Å; Y300-V334 HydrophobicContact CE1-CG1 3.83Å; Y300-V334 HydrophobicContact CE2-CG1 4.44Å; Y300-V334 HydrophobicContact CE2-CG2 3.86Å; Y300-V334 HydrophobicContact CG-CG1 3.81Å; Y300-V334 HydrophobicContact CG-CG2 4.22Å
301	P	97.5	Very high	95.7	Very high	8 Å²	8	24.7 Å²	24.7	5%	0.052	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-64.9	162.4	166.2	30.7	-34.7	0	0	0	109.9	Y303 M338 Q341	P301-Y303 WeakPolarHBondContact O-CD1 3.39Å; P301-Y303 PolarHBondContact O-N 3.04Å; P301-M338 HydrophobicContact CG-CB 4.45Å; P301-M338 HydrophobicContact CG-CG 3.85Å; P301-Q341 HydrophobicContact CB-CB 4.07Å; P301-Q341 HydrophobicContact CB-CG 4.47Å
302	P	98	Very high	95.7	Very high	45 Å²	45	24.8 Å²	24.8	29%	0.292	16%	0.156	S	C	.	.	P	Polyproline II helix	trans	-54.9	129.6	168.5	-25.3	35.7	0	0	0	111.3	V275 I276 K277 P347	V275-P302 HydrophobicContact CG1-CB 4.32Å; I276-P302 WeakPolarHBondContact O-CA 3.34Å; K277-P302 HydrophobicContact CG-CB 4.26Å; K277-P302 HydrophobicContact CG-CG 4.47Å; P302-P347 HydrophobicContact CB-CG 4.39Å; P302-P347 WeakPolarHBondContact O-CD 3.07Å
303	Y	98.1	Very high	95.8	Very high	30 Å²	30	24.7 Å²	24.7	12%	0.118	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	151	179.6	68.8	-87.2	0	0	0	110.6	V275 I276 A279 Y300 P301 D333 V334	V275-Y303 WeakPolarHBondContact CA-O 3.39Å; I276-Y303 HydrophobicContact CB-CE1 4.23Å; I276-Y303 HydrophobicContact CB-CE2 4.49Å; I276-Y303 HydrophobicContact CD1-CE2 3.93Å; I276-Y303 HydrophobicContact CG2-CE1 4.4Å; I276-Y303 PolarHBondContact N-O 3.5Å; I276-Y303 PolarHBondContact O-N 2.91Å; A279-Y303 HydrophobicContact CB-CE1 4.06Å; Y300-Y303 HydrophobicContact CD2-CE1 4.1Å; P301-Y303 WeakPolarHBondContact O-CD1 3.39Å; P301-Y303 PolarHBondContact O-N 3.04Å; Y303-D333 WeakPolarHBondContact CB-O 3.38Å; Y303-D333 HydrophobicContact CD2-CB 3.82Å; Y303-D333 HydrophobicContact CE2-CB 4.18Å; Y303-V334 HydrophobicContact CD1-CG2 4.08Å; Y303-V334 HydrophobicContact CD2-CG2 4.32Å; Y303-V334 HydrophobicContact CE1-CG2 3.87Å; Y303-V334 HydrophobicContact CE2-CG2 4.11Å; Y303-V334 HydrophobicContact CG-CG2 4.31Å
304	A	97.6	Very high	95.8	Very high	3 Å²	3	22 Å²	22	3%	0.025	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	133.8	167.5	0	0	0	0	0	108.7	F271 D274 V275 F309 D333	F271-A304 HydrophobicContact CE1-CB 3.9Å; D274-A304 WeakPolarHBondContact O-CA 3.44Å; V275-A304 HydrophobicContact CG2-CB 4.18Å; A304-F309 HydrophobicContact CB-CB 4Å; A304-F309 HydrophobicContact CB-CD1 4.28Å; A304-F309 HydrophobicContact CB-CG 4.41Å; A304-D333 WeakPolarHBondContact O-CB 3.49Å
305	G	90.8	Very high	95.9	Very high	2 Å²	2	21.1 Å²	21.1	2%	0.021	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	-175.5	177.7	0	0	0	0	0	114	D274 D333 T355	D274-G305 PolarHBondContact O-N 3.36Å; G305-D333 VanDerWaalsContact CA-CG 3.48Å; G305-D333 WeakPolarHBondContact CA-OD2 3.24Å; G305-T355 WeakPolarHBondContact O-CG2 3.43Å
306	G	80.3	Confident	96	Very high	33 Å²	33	21.1 Å²	21.1	34%	0.34	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	87.3	19.6	167.2	0	0	0	0	0	116.8	D333 T355	G306-D333 PolarHBondContact N-OD2 3.42Å; G306-T355 VanDerWaalsContact O-CB 3.23Å; G306-T355 WeakPolarHBondContact O-CB 3.16Å; G306-T355 WeakPolarHBondContact O-CG2 3.29Å
307	G	90	Very high	96.1	Very high	2 Å²	2	22.7 Å²	22.7	2%	0.021	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	147.8	-26.8	169	0	0	0	0	0	114.8	G244 D245	G244-G307 CarbonylContact C-O 3.56Å; G244-G307 WeakPolarHBondContact CA-O 3.43Å; D245-G307 PolarHBondContact N-O 3.15Å; D245-G307 WeakPolarHBondContact OD2-CA 3.37Å
308	G	96.9	Very high	96.2	Very high	4 Å²	4	23.9 Å²	23.9	4%	0.041	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.1	166.2	173.6	0	0	0	0	0	114.8	K243 F353	K243-G308 CarbonylContact O-C 3.57Å; K243-G308 WeakPolarHBondContact O-CA 2.89Å; G308-F353 VanDerWaalsContact O-CD1 3.27Å; G308-F353 WeakPolarHBondContact O-CD1 3.43Å; G308-F353 WeakPolarHBondContact O-CE1 3.23Å
309	F	98.5	Very high	96.4	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.009	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	160.1	-179.9	43.1	-98.5	0	0	0	110.7	K243 F271 I272 A304 Y311 D333 T336	K243-F309 HydrophobicContact CB-CD2 4.31Å; K243-F309 HydrophobicContact CB-CE2 3.97Å; K243-F309 HydrophobicContact CB-CZ 4.45Å; K243-F309 HydrophobicContact CD-CE2 3.88Å; K243-F309 HydrophobicContact CD-CZ 3.73Å; K243-F309 HydrophobicContact CG-CE2 4.41Å; K243-F309 HydrophobicContact CG-CZ 4.43Å; K243-F309 PolarHBondContact N-O 3.34Å; K243-F309 PolarHBondContact O-N 3.41Å; F271-F309 HydrophobicContact CE1-CB 4.09Å; F271-F309 HydrophobicContact CE1-CD2 4.02Å; F271-F309 HydrophobicContact CE1-CG 4.08Å; F271-F309 HydrophobicContact CE2-CD2 4.19Å; F271-F309 HydrophobicContact CE2-CE2 4.3Å; F271-F309 HydrophobicContact CZ-CB 4.46Å; F271-F309 AromaticContact CZ-CD2 3.52Å; F271-F309 HydrophobicContact CZ-CD2 3.52Å; F271-F309 AromaticContact CZ-CE2 3.77Å; F271-F309 HydrophobicContact CZ-CE2 3.77Å; F271-F309 AromaticContact CZ-CG 3.99Å; F271-F309 HydrophobicContact CZ-CG 3.99Å; F271-F309 HydrophobicContact CZ-CZ 4.42Å; I272-F309 WeakPolarHBondContact O-CA 3.45Å; I272-F309 VanDerWaalsContact O-CB 3.28Å; I272-F309 WeakPolarHBondContact O-CB 3.39Å; A304-F309 HydrophobicContact CB-CB 4Å; A304-F309 HydrophobicContact CB-CD1 4.28Å; A304-F309 HydrophobicContact CB-CG 4.41Å; F309-Y311 AromaticContact CD2-CD1 3.76Å; F309-Y311 HydrophobicContact CD2-CD1 3.76Å; F309-Y311 AromaticContact CD2-CE1 3.76Å; F309-Y311 HydrophobicContact CD2-CE1 3.76Å; F309-Y311 HydrophobicContact CE2-CD1 4.14Å; F309-Y311 AromaticContact CE2-CE1 3.74Å; F309-Y311 HydrophobicContact CE2-CE1 3.74Å; F309-D333 WeakPolarHBondContact CE1-OD1 3.29Å; F309-T336 HydrophobicContact CE2-CG2 4.38Å; F309-T336 HydrophobicContact CZ-CG2 4.29Å
310	L	98.7	Very high	96.5	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	131.9	-174.8	-179.2	73.8	0	0	0	110	L144 I241 F242 I255 Y258 L259 L270 F271 I272 F353	L144-L310 HydrophobicContact CD1-CD1 3.94Å; I241-L310 WeakPolarHBondContact O-CA 3.48Å; F242-L310 HydrophobicContact CB-CD1 3.9Å; I255-L310 HydrophobicContact CG2-CD1 4.01Å; I255-L310 HydrophobicContact CG2-CD2 3.98Å; Y258-L310 HydrophobicContact CD1-CD2 4.2Å; Y258-L310 HydrophobicContact CE1-CD2 4.44Å; L259-L310 HydrophobicContact CD1-CD1 4.32Å; L259-L310 HydrophobicContact CD1-CD2 4.4Å; L259-L310 HydrophobicContact CD2-CD2 3.67Å; L259-L310 HydrophobicContact CD2-CG 4.26Å; L259-L310 HydrophobicContact CG-CD2 4.03Å; L270-L310 HydrophobicContact CD2-CD2 4.34Å; L270-L310 HydrophobicContact CD2-CG 4.31Å; F271-L310 CarbonylContact C-O 3.53Å; F271-L310 WeakPolarHBondContact CA-O 3.35Å; I272-L310 HydrophobicContact CD1-CB 4.4Å; I272-L310 HydrophobicContact CD1-CD2 4.06Å; I272-L310 HydrophobicContact CG1-CB 3.86Å; I272-L310 HydrophobicContact CG1-CD2 4.31Å; I272-L310 PolarHBondContact N-O 2.74Å; I272-L310 PolarHBondContact O-N 3.26Å; L310-F353 HydrophobicContact CB-CZ 4.06Å
311	Y	98.8	Very high	96.4	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	167.9	-177.4	57.5	-80.9	0	0	0	112.7	F227 F240 I241 K243 L270 F271 F309 A316	F227-Y311 WeakPolarHBondContact CE1-OH 3.21Å; F240-Y311 CarbonylContact C-O 3.29Å; F240-Y311 WeakPolarHBondContact CA-O 3.28Å; I241-Y311 HydrophobicContact CB-CD2 4.26Å; I241-Y311 HydrophobicContact CB-CE1 4.13Å; I241-Y311 HydrophobicContact CB-CE2 3.83Å; I241-Y311 HydrophobicContact CD1-CE2 3.91Å; I241-Y311 HydrophobicContact CG1-CE2 4.32Å; I241-Y311 HydrophobicContact CG2-CE1 3.98Å; I241-Y311 HydrophobicContact CG2-CE2 4.17Å; I241-Y311 PolarHBondContact N-O 3.02Å; I241-Y311 WeakPolarHBondContact O-CD1 3.5Å; I241-Y311 PolarHBondContact O-N 3.15Å; K243-Y311 HydrophobicContact CB-CE1 3.98Å; L270-Y311 CarbonylContact O-C 3.03Å; L270-Y311 WeakPolarHBondContact O-CA 3.37Å; L270-Y311 WeakPolarHBondContact O-CB 3.39Å; F271-Y311 HydrophobicContact CD2-CG 4.17Å; F271-Y311 HydrophobicContact CE2-CD1 4.3Å; F271-Y311 HydrophobicContact CE2-CG 4.3Å; F309-Y311 AromaticContact CD2-CD1 3.76Å; F309-Y311 HydrophobicContact CD2-CD1 3.76Å; F309-Y311 AromaticContact CD2-CE1 3.76Å; F309-Y311 HydrophobicContact CD2-CE1 3.76Å; F309-Y311 HydrophobicContact CE2-CD1 4.14Å; F309-Y311 AromaticContact CE2-CE1 3.74Å; F309-Y311 HydrophobicContact CE2-CE1 3.74Å; Y311-A316 HydrophobicContact CD2-CB 4.17Å; Y311-A316 HydrophobicContact CE2-CB 3.68Å
312	S	98.6	Very high	96.3	Very high	3 Å²	3	21.9 Å²	21.9	2%	0.021	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	153.6	178.9	71.9	0	0	0	0	112.6	Q239 A267 K268 L270 D314 L315 A316	Q239-S312 WeakPolarHBondContact O-CA 3.41Å; A267-S312 WeakPolarHBondContact O-CB 3.29Å; K268-S312 WeakPolarHBondContact O-CB 3.33Å; K268-S312 PolarHBondContact O-OG 3.34Å; L270-S312 PolarHBondContact O-N 2.56Å; S312-D314 VanDerWaalsContact C-N 3.34Å; S312-L315 PolarHBondContact O-N 2.88Å; S312-L315 WeakPolarHBondContact OG-CB 3.25Å; S312-L315 PolarHBondContact OG-N 2.76Å; S312-A316 PolarHBondContact O-N 2.93Å
313	G	98.2	Very high	96.2	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-64.7	-37.4	172.2	0	0	0	0	0	112.9	V238 Q239 L315 A316 L317	V238-G313 WeakPolarHBondContact O-CA 3.45Å; Q239-G313 PolarHBondContact O-N 3.47Å; G313-L315 VanDerWaalsContact C-N 3.28Å; G313-L315 PolarHBondContact O-N 3.37Å; G313-A316 WeakPolarHBondContact O-CA 3.36Å; G313-A316 WeakPolarHBondContact O-CB 3.39Å; G313-A316 PolarHBondContact O-N 3.25Å; G313-L317 PolarHBondContact O-N 3.28Å; G313-L317 VanDerWaalsContact O-N 3.07Å
314	D	97.1	Very high	95.9	Very high	86 Å²	86	21.1 Å²	21.1	46%	0.46	12%	0.118	S	C	.	.	H	α-helix	trans	-56.5	-43.2	173.7	-77.2	-19.2	0	0	0	111.8	K268 S312 L317 R318	K268-D314 HydrophobicContact CG-CB 4.47Å; S312-D314 VanDerWaalsContact C-N 3.34Å; D314-L317 PolarHBondContact O-N 3.36Å; D314-R318 PolarHBondContact O-N 3.29Å
315	L	98.3	Very high	95.7	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-69.4	-34.9	175.6	-177.1	57.1	0	0	0	111.5	L270 F271 S312 G313 L317 R318 L319 L340 L343 L345	L270-L315 WeakPolarHBondContact O-CD2 3.23Å; F271-L315 HydrophobicContact CB-CD2 3.71Å; F271-L315 HydrophobicContact CD2-CD2 3.78Å; F271-L315 HydrophobicContact CG-CD2 4.25Å; S312-L315 PolarHBondContact O-N 2.88Å; S312-L315 WeakPolarHBondContact OG-CB 3.25Å; S312-L315 PolarHBondContact OG-N 2.76Å; G313-L315 VanDerWaalsContact C-N 3.28Å; G313-L315 PolarHBondContact O-N 3.37Å; L315-L317 VanDerWaalsContact C-N 3.32Å; L315-L317 PolarHBondContact O-N 3.28Å; L315-R318 HydrophobicContact CD1-CB 4.47Å; L315-R318 PolarHBondContact O-N 2.92Å; L315-L319 HydrophobicContact CD1-CG 4.29Å; L315-L319 HydrophobicContact CG-CD1 4.08Å; L315-L319 HydrophobicContact CG-CG 4.23Å; L315-L319 WeakPolarHBondContact O-CB 3Å; L315-L319 VanDerWaalsContact O-CG 3.3Å; L315-L319 WeakPolarHBondContact O-CG 3.27Å; L315-L319 PolarHBondContact O-N 2.7Å; L315-L340 HydrophobicContact CD1-CD2 4.28Å; L315-L340 HydrophobicContact CD2-CD2 4.03Å; L315-L343 HydrophobicContact CD1-CD1 3.95Å; L315-L345 HydrophobicContact CD1-CD1 3.49Å; L315-L345 VanDerWaalsContact CD1-CD1 3.49Å
316	A	98.5	Very high	95.9	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-57.6	-43.2	174.6	0	0	0	0	0	112.2	L228 V231 I241 Y311 S312 G313 R318 L319 N320	L228-A316 HydrophobicContact CD2-CB 4.21Å; V231-A316 HydrophobicContact CG1-CB 4.16Å; I241-A316 HydrophobicContact CD1-CB 3.63Å; Y311-A316 HydrophobicContact CD2-CB 4.17Å; Y311-A316 HydrophobicContact CE2-CB 3.68Å; S312-A316 PolarHBondContact O-N 2.93Å; G313-A316 WeakPolarHBondContact O-CA 3.36Å; G313-A316 WeakPolarHBondContact O-CB 3.39Å; G313-A316 PolarHBondContact O-N 3.25Å; A316-R318 VanDerWaalsContact C-N 3.35Å; A316-R318 PolarHBondContact O-N 2.83Å; A316-L319 PolarHBondContact O-N 3.15Å; A316-N320 PolarHBondContact O-N 2.91Å
317	L	98.2	Very high	96.7	Very high	47 Å²	47	23.1 Å²	23.1	25%	0.246	12%	0.117	C	C	.	.	H	α-helix	trans	-64.7	-39.3	176.8	-61.1	-178.9	0	0	0	112	A236 G313 D314 L315 N320 N321	A236-L317 HydrophobicContact CB-CD2 4.19Å; G313-L317 PolarHBondContact O-N 3.28Å; G313-L317 VanDerWaalsContact O-N 3.07Å; D314-L317 PolarHBondContact O-N 3.36Å; L315-L317 VanDerWaalsContact C-N 3.32Å; L315-L317 PolarHBondContact O-N 3.28Å; L317-N320 WeakPolarHBondContact O-CB 3.49Å; L317-N320 PolarHBondContact O-N 2.9Å; L317-N321 PolarHBondContact O-N 3.09Å
318	R	98.1	Very high	97	Very high	79 Å²	79	23.3 Å²	23.3	30%	0.298	12%	0.118	S	C	.	.	H	α-helix	trans	-68.4	-38.2	175.1	-69.3	167.2	58.5	-164.8	2.6	112.1	D269 D314 L315 A316 N321 A322 L343	D269-R318 IonicContact OD1-CZ 2.93Å; D269-R318 IonicContact OD1-NH1 2.69Å; D269-R318 PolarHBondContact OD1-NH1 3.35Å; D314-R318 PolarHBondContact O-N 3.29Å; L315-R318 HydrophobicContact CD1-CB 4.47Å; L315-R318 PolarHBondContact O-N 2.92Å; A316-R318 VanDerWaalsContact C-N 3.35Å; A316-R318 PolarHBondContact O-N 2.83Å; R318-N321 PolarHBondContact O-N 2.83Å; R318-A322 WeakPolarHBondContact O-CB 3.29Å; R318-A322 PolarHBondContact O-N 3.09Å; R318-L343 HydrophobicContact CB-CD1 3.85Å; R318-L343 HydrophobicContact CB-CD2 4.22Å
319	L	98.5	Very high	97.1	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-64.2	-41	174.4	-75.1	170.4	0	0	0	111.1	L228 F271 L315 A316 N321 A322 S323 C339 L340 L343	L228-L319 HydrophobicContact CD1-CB 3.93Å; L228-L319 HydrophobicContact CD2-CB 4.24Å; F271-L319 HydrophobicContact CD2-CD1 4.44Å; F271-L319 HydrophobicContact CE2-CD1 4.18Å; L315-L319 HydrophobicContact CD1-CG 4.29Å; L315-L319 HydrophobicContact CG-CD1 4.08Å; L315-L319 HydrophobicContact CG-CG 4.23Å; L315-L319 WeakPolarHBondContact O-CB 3Å; L315-L319 VanDerWaalsContact O-CG 3.3Å; L315-L319 WeakPolarHBondContact O-CG 3.27Å; L315-L319 PolarHBondContact O-N 2.7Å; A316-L319 PolarHBondContact O-N 3.15Å; L319-N321 VanDerWaalsContact C-N 3.34Å; L319-N321 PolarHBondContact O-N 3.37Å; L319-A322 PolarHBondContact O-N 2.71Å; L319-S323 WeakPolarHBondContact O-CB 3.32Å; L319-S323 PolarHBondContact O-N 2.84Å; L319-C339 HydrophobicContact CD2-CB 3.66Å; L319-L340 HydrophobicContact CD2-CD2 3.99Å; L319-L340 HydrophobicContact CD2-CG 4.16Å; L319-L343 HydrophobicContact CD2-CD1 3.96Å; L319-L343 HydrophobicContact CG-CD1 4.27Å
320	N	97.8	Very high	97	Very high	15 Å²	15	23 Å²	23	8%	0.08	12%	0.116	C	C	.	.	H	α-helix	trans	-55.4	-49.1	172.7	-176.4	56.2	0	0	0	111	L228 K229 S232 A316 L317 A322 S323	L228-N320 HydrophobicContact CB-CB 4.03Å; K229-N320 WeakPolarHBondContact CA-OD1 3.28Å; K229-N320 VanDerWaalsContact CG-OD1 3.29Å; K229-N320 WeakPolarHBondContact CG-OD1 3.35Å; K229-N320 PolarHBondContact N-OD1 2.66Å; S232-N320 WeakPolarHBondContact CB-ND2 3.45Å; A316-N320 PolarHBondContact O-N 2.91Å; L317-N320 WeakPolarHBondContact O-CB 3.49Å; L317-N320 PolarHBondContact O-N 2.9Å; N320-A322 PolarHBondContact O-N 3.08Å; N320-S323 WeakPolarHBondContact O-CB 3.32Å; N320-S323 PolarHBondContact O-N 3.41Å; N320-S323 PolarHBondContact O-OG 2.74Å
321	N	95.9	Very high	97	Very high	103 Å²	103	23.6 Å²	23.6	55%	0.551	12%	0.119	S	C	*	.	H	α-helix	trans	-66	-37.5	178	-69	-7.5	0	0	0	113.1	L317 R318 L319 S323	L317-N321 PolarHBondContact O-N 3.09Å; R318-N321 PolarHBondContact O-N 2.83Å; L319-N321 VanDerWaalsContact C-N 3.34Å; L319-N321 PolarHBondContact O-N 3.37Å; N321-S323 VanDerWaalsContact C-N 3.27Å; N321-S323 PolarHBondContact O-N 3.4Å
322	A	96.2	Very high	96.9	Very high	4 Å²	4	23.8 Å²	23.8	3%	0.033	12%	0.12	C	C	.	.	H	α-helix	trans	-67.9	-29.3	175.9	0	0	0	0	0	112.3	R318 L319 N320 D324 Q325 V326 C339 L343	R318-A322 WeakPolarHBondContact O-CB 3.29Å; R318-A322 PolarHBondContact O-N 3.09Å; L319-A322 PolarHBondContact O-N 2.71Å; N320-A322 PolarHBondContact O-N 3.08Å; A322-D324 PolarHBondContact O-N 2.86Å; A322-Q325 PolarHBondContact O-N 2.9Å; A322-V326 PolarHBondContact O-N 3.16Å; A322-C339 HydrophobicContact CB-CB 4.38Å; A322-L343 HydrophobicContact CB-CD1 4.33Å; A322-L343 HydrophobicContact CB-CD2 3.96Å; A322-L343 HydrophobicContact CB-CG 3.94Å
323	S	95.6	Very high	96.8	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-60.6	-31.7	-176.7	80.9	0	0	0	0	112.8	R126 L319 N320 N321 Q325 V326 Y335	R126-S323 PolarHBondContact NH1-O 2.71Å; L319-S323 WeakPolarHBondContact O-CB 3.32Å; L319-S323 PolarHBondContact O-N 2.84Å; N320-S323 WeakPolarHBondContact O-CB 3.32Å; N320-S323 PolarHBondContact O-N 3.41Å; N320-S323 PolarHBondContact O-OG 2.74Å; N321-S323 VanDerWaalsContact C-N 3.27Å; N321-S323 PolarHBondContact O-N 3.4Å; S323-Q325 PolarHBondContact O-N 3.18Å; S323-V326 PolarHBondContact O-N 3Å; S323-Y335 VanDerWaalsContact CA-OH 3.27Å; S323-Y335 WeakPolarHBondContact CA-OH 3.47Å; S323-Y335 VanDerWaalsContact CB-OH 3.27Å; S323-Y335 WeakPolarHBondContact CB-OH 3.25Å; S323-Y335 PolarHBondContact O-OH 2.92Å; S323-Y335 VanDerWaalsContact O-OH 3.11Å
324	D	91.2	Very high	96.8	Very high	60 Å²	60	24.6 Å²	24.6	32%	0.321	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-20.2	175.5	-70.6	-27.9	0	0	0	113	A322	A322-D324 PolarHBondContact O-N 2.86Å
325	Q	93.6	Very high	96.9	Very high	63 Å²	63	20.6 Å²	20.6	29%	0.294	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	2.7	-179.1	-55.8	-178.8	30.3	0	0	113.6	Q63 L66 Y70 A322 S323 K342	Q63-Q325 PolarHBondContact NE2-O 3.09Å; L66-Q325 VanDerWaalsContact CD2-C 3.48Å; L66-Q325 WeakPolarHBondContact CD2-O 3.3Å; Y70-Q325 HydrophobicContact CD1-CG 3.98Å; Y70-Q325 HydrophobicContact CD2-CG 4.3Å; Y70-Q325 HydrophobicContact CE1-CG 4.27Å; Y70-Q325 HydrophobicContact CG-CG 4Å; A322-Q325 PolarHBondContact O-N 2.9Å; S323-Q325 PolarHBondContact O-N 3.18Å; Q325-K342 VanDerWaalsContact OE1-CE 3.24Å
326	V	95.9	Very high	96.9	Very high	4 Å²	4	20.7 Å²	20.7	2%	0.024	10%	0.103	C	C	.	.	S	Bend	trans	-126.8	121	178.7	-178	0	0	0	0	108.4	W59 R126 A322 S323 Y335 M338 K342	W59-V326 HydrophobicContact CZ2-CG1 4.36Å; R126-V326 PolarHBondContact NH2-O 3.27Å; A322-V326 PolarHBondContact O-N 3.16Å; S323-V326 PolarHBondContact O-N 3Å; V326-Y335 HydrophobicContact CB-CE2 4.04Å; V326-Y335 HydrophobicContact CG1-CD2 4.02Å; V326-Y335 HydrophobicContact CG1-CE2 3.69Å; V326-Y335 WeakPolarHBondContact O-CE2 3.32Å; V326-Y335 PolarHBondContact O-OH 2.95Å; V326-M338 HydrophobicContact CG1-CB 3.82Å; V326-K342 HydrophobicContact CG2-CB 4.05Å; V326-K342 HydrophobicContact CG2-CG 4.15Å
327	L	95.6	Very high	96.9	Very high	12 Å²	12	20.8 Å²	20.8	6%	0.063	10%	0.104	C	C	.	.			trans	-60.5	147.5	177.1	-71	175.9	0	0	0	111.6	W59 Q62 Q63 L66 L123 R126 Y335	W59-L327 HydrophobicContact CZ2-CB 4.29Å; Q62-L327 VanDerWaalsContact C-CD1 3.43Å; Q62-L327 HydrophobicContact CB-CD1 3.28Å; Q63-L327 HydrophobicContact CB-CD1 4.22Å; Q63-L327 VanDerWaalsContact N-CD1 3.32Å; L66-L327 HydrophobicContact CD2-CD2 4.11Å; L66-L327 HydrophobicContact CD2-CG 3.99Å; L123-L327 HydrophobicContact CD2-CD1 4.49Å; R126-L327 VanDerWaalsContact NH2-C 3.29Å; R126-L327 VanDerWaalsContact NH2-CA 3.27Å; L327-Y335 WeakPolarHBondContact O-CD2 3.36Å; L327-Y335 WeakPolarHBondContact O-CE2 3.28Å
328	L	97.1	Very high	96.9	Very high	6 Å²	6	19 Å²	19	3%	0.031	9%	0.094	C	C	.	.			trans	-58.7	149.5	178.3	-56.2	175.7	0	0	0	108.1	W59 F119 L123 R126 T221 L222 V225	W59-L328 PolarHBondContact NE1-O 2.95Å; F119-L328 HydrophobicContact CE2-CB 4.28Å; F119-L328 HydrophobicContact CZ-CB 4.23Å; F119-L328 WeakPolarHBondContact CZ-O 3.46Å; L123-L328 HydrophobicContact CD1-CB 3.98Å; L123-L328 WeakPolarHBondContact CD1-O 3.45Å; R126-L328 HydrophobicContact CG-CD1 4.13Å; R126-L328 HydrophobicContact CG-CD2 4.39Å; R126-L328 HydrophobicContact CG-CG 4.37Å; T221-L328 HydrophobicContact CG2-CB 4.09Å; T221-L328 HydrophobicContact CG2-CD2 3.8Å; L222-L328 HydrophobicContact CB-CD1 4.5Å; V225-L328 HydrophobicContact CG2-CD2 3.79Å
329	Y	98.1	Very high	96.9	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.081	C	C	.	.			trans	-127.6	147.6	178.6	-166.6	-108.4	0	0	0	109.6	W59 T221 Y296 Y300 I331 V334 M338	W59-Y329 AromaticContact CD1-CD2 3.98Å; W59-Y329 HydrophobicContact CD2-CD2 4.25Å; W59-Y329 AromaticContact CE2-CD2 3.97Å; W59-Y329 HydrophobicContact CG-CD2 4.27Å; W59-Y329 AromaticContact NE1-CD2 3.77Å; T221-Y329 VanDerWaalsContact CB-O 3.23Å; T221-Y329 WeakPolarHBondContact CB-O 3.41Å; T221-Y329 PolarHBondContact OG1-O 3.44Å; Y296-Y329 HydrophobicContact CD2-CD2 4.42Å; Y296-Y329 AromaticContact CD2-CE2 3.6Å; Y296-Y329 HydrophobicContact CD2-CE2 3.6Å; Y296-Y329 HydrophobicContact CE2-CE2 4.22Å; Y296-Y329 AromaticContact CG-CE2 3.77Å; Y296-Y329 HydrophobicContact CG-CE2 3.77Å; Y300-Y329 AromaticContact CE1-CE1 3.84Å; Y300-Y329 HydrophobicContact CE1-CE1 3.84Å; Y300-Y329 AromaticContact CE1-CZ 3.68Å; Y300-Y329 WeakPolarHBondContact CE1-OH 3.44Å; Y300-Y329 AromaticContact CZ-CE1 3.94Å; Y300-Y329 PolarHBondContact OH-OH 2.86Å; Y329-I331 HydrophobicContact CD1-CB 4.05Å; Y329-I331 HydrophobicContact CD1-CG1 4.49Å; Y329-I331 HydrophobicContact CE1-CB 4.11Å; Y329-I331 HydrophobicContact CE1-CD1 4.24Å; Y329-I331 HydrophobicContact CE1-CG1 4.16Å; Y329-I331 PolarHBondContact O-N 2.91Å; Y329-V334 HydrophobicContact CD1-CB 3.93Å; Y329-V334 HydrophobicContact CD1-CG1 3.74Å; Y329-V334 HydrophobicContact CE1-CB 4.06Å; Y329-V334 HydrophobicContact CE1-CG1 3.7Å; Y329-M338 HydrophobicContact CD1-CE 4.24Å; Y329-M338 HydrophobicContact CD2-CE 3.89Å; Y329-M338 HydrophobicContact CD2-SD 4.42Å; Y329-M338 HydrophobicContact CE1-CE 4.43Å; Y329-M338 HydrophobicContact CE2-CE 4.11Å; Y329-M338 HydrophobicContact CG-CE 3.98Å; Y329-M338 HydrophobicContact CG-SD 4.2Å
330	P	97.6	Very high	96.9	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.081	C	C	.	.	S	Bend	trans	-64.5	-9.7	-176.4	-26.2	36.4	0	0	0	115.9	F119 F218 I291	F119-P330 HydrophobicContact CD1-CG 3.88Å; F119-P330 HydrophobicContact CD2-CG 4.4Å; F119-P330 HydrophobicContact CE1-CG 3.59Å; F119-P330 HydrophobicContact CE2-CG 4.14Å; F119-P330 HydrophobicContact CG-CG 4.28Å; F119-P330 VanDerWaalsContact CZ-CD 3.48Å; F119-P330 HydrophobicContact CZ-CG 3.73Å; F218-P330 HydrophobicContact CB-CB 4.42Å; F218-P330 HydrophobicContact CD1-CB 3.65Å; F218-P330 WeakPolarHBondContact CD1-O 3.48Å; F218-P330 HydrophobicContact CD2-CB 3.9Å; F218-P330 HydrophobicContact CD2-CG 4.43Å; F218-P330 HydrophobicContact CE1-CB 3.76Å; F218-P330 HydrophobicContact CE2-CB 3.98Å; F218-P330 HydrophobicContact CE2-CG 4.43Å; F218-P330 HydrophobicContact CG-CB 3.75Å; F218-P330 HydrophobicContact CZ-CB 3.92Å; I291-P330 HydrophobicContact CD1-CB 3.88Å; I291-P330 HydrophobicContact CD1-CG 3.99Å
331	I	97.8	Very high	96.9	Very high	12 Å²	12	20.4 Å²	20.4	6%	0.062	10%	0.104	C	C	.	.	S	Bend	trans	-124.7	115.4	-178.9	-51.6	175.4	0	0	0	108	Y289 I291 Y329 V334 Y335	Y289-I331 HydrophobicContact CD1-CD1 4.46Å; I291-I331 HydrophobicContact CD1-CD1 4.26Å; I291-I331 HydrophobicContact CD1-CG1 4.39Å; I291-I331 HydrophobicContact CG1-CD1 4.14Å; Y329-I331 HydrophobicContact CD1-CB 4.05Å; Y329-I331 HydrophobicContact CD1-CG1 4.49Å; Y329-I331 HydrophobicContact CE1-CB 4.11Å; Y329-I331 HydrophobicContact CE1-CD1 4.24Å; Y329-I331 HydrophobicContact CE1-CG1 4.16Å; Y329-I331 PolarHBondContact O-N 2.91Å; I331-V334 HydrophobicContact CB-CB 4.13Å; I331-V334 HydrophobicContact CB-CG2 4.05Å; I331-V334 HydrophobicContact CD1-CG2 4.5Å; I331-V334 HydrophobicContact CG2-CB 4.23Å; I331-V334 HydrophobicContact CG2-CG2 3.79Å; I331-V334 PolarHBondContact O-N 2.98Å; I331-Y335 PolarHBondContact O-N 3.06Å
332	D	97.3	Very high	96.9	Very high	5 Å²	5	19.2 Å²	19.2	3%	0.027	9%	0.094	C	C	.	.	H	α-helix	trans	-66.6	-40.8	-171.3	64.2	-38.2	0	0	0	113.6	K149 L220 T221 K243 V334 Y335 T336	K149-D332 IonicContact NZ-OD2 3.48Å; K149-D332 PolarHBondContact NZ-OD2 2.55Å; L220-D332 HydrophobicContact CB-CB 3.76Å; T221-D332 VanDerWaalsContact OG1-CA 3.25Å; T221-D332 WeakPolarHBondContact OG1-CA 3.48Å; T221-D332 PolarHBondContact OG1-N 3Å; K243-D332 IonicContact NZ-OD2 2.74Å; D332-V334 VanDerWaalsContact C-N 3.32Å; D332-V334 PolarHBondContact O-N 3.46Å; D332-Y335 WeakPolarHBondContact O-CB 3.42Å; D332-Y335 PolarHBondContact O-N 3.11Å; D332-T336 PolarHBondContact O-N 3.15Å; D332-T336 PolarHBondContact O-OG1 3.11Å
333	D	97.1	Very high	96.9	Very high	20 Å²	20	21.3 Å²	21.3	11%	0.107	10%	0.104	C	C	.	.	H	α-helix	trans	-62.8	-41.9	177.4	-66.7	-17.5	0	0	0	111	Y303 A304 G305 G306 F309 T336 G337	Y303-D333 WeakPolarHBondContact CB-O 3.38Å; Y303-D333 HydrophobicContact CD2-CB 3.82Å; Y303-D333 HydrophobicContact CE2-CB 4.18Å; A304-D333 WeakPolarHBondContact O-CB 3.49Å; G305-D333 VanDerWaalsContact CA-CG 3.48Å; G305-D333 WeakPolarHBondContact CA-OD2 3.24Å; G306-D333 PolarHBondContact N-OD2 3.42Å; F309-D333 WeakPolarHBondContact CE1-OD1 3.29Å; D333-T336 PolarHBondContact O-N 3.25Å; D333-G337 PolarHBondContact O-N 2.77Å; D333-G337 VanDerWaalsContact O-N 3.09Å
334	V	98.1	Very high	96.9	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-66.9	-42.9	176.6	174.8	0	0	0	0	110.9	Y300 Y303 Y329 I331 D332 T336 G337 M338	Y300-V334 HydrophobicContact CD1-CG1 3.59Å; Y300-V334 HydrophobicContact CD2-CG1 4.25Å; Y300-V334 HydrophobicContact CD2-CG2 3.84Å; Y300-V334 HydrophobicContact CE1-CG1 3.83Å; Y300-V334 HydrophobicContact CE2-CG1 4.44Å; Y300-V334 HydrophobicContact CE2-CG2 3.86Å; Y300-V334 HydrophobicContact CG-CG1 3.81Å; Y300-V334 HydrophobicContact CG-CG2 4.22Å; Y303-V334 HydrophobicContact CD1-CG2 4.08Å; Y303-V334 HydrophobicContact CD2-CG2 4.32Å; Y303-V334 HydrophobicContact CE1-CG2 3.87Å; Y303-V334 HydrophobicContact CE2-CG2 4.11Å; Y303-V334 HydrophobicContact CG-CG2 4.31Å; Y329-V334 HydrophobicContact CD1-CB 3.93Å; Y329-V334 HydrophobicContact CD1-CG1 3.74Å; Y329-V334 HydrophobicContact CE1-CB 4.06Å; Y329-V334 HydrophobicContact CE1-CG1 3.7Å; I331-V334 HydrophobicContact CB-CB 4.13Å; I331-V334 HydrophobicContact CB-CG2 4.05Å; I331-V334 HydrophobicContact CD1-CG2 4.5Å; I331-V334 HydrophobicContact CG2-CB 4.23Å; I331-V334 HydrophobicContact CG2-CG2 3.79Å; I331-V334 PolarHBondContact O-N 2.98Å; D332-V334 VanDerWaalsContact C-N 3.32Å; D332-V334 PolarHBondContact O-N 3.46Å; V334-T336 VanDerWaalsContact C-N 3.3Å; V334-T336 PolarHBondContact O-N 2.96Å; V334-G337 CarbonylContact O-C 3.58Å; V334-G337 WeakPolarHBondContact O-CA 3Å; V334-G337 PolarHBondContact O-N 3.46Å; V334-G337 VanDerWaalsContact O-N 3.13Å; V334-M338 HydrophobicContact CG1-CE 3.75Å; V334-M338 HydrophobicContact CG1-SD 4.44Å; V334-M338 WeakPolarHBondContact O-CG 3.47Å; V334-M338 PolarHBondContact O-N 3.46Å
335	Y	98.4	Very high	97.2	Very high	1 Å²	1	24 Å²	24	0%	0.004	14%	0.135	C	C	.	.	H	α-helix	trans	-56.7	-45.1	174.5	175.7	-100.8	0	0	0	111.8	T221 V225 S323 V326 L327 I331 D332 G337 M338 C339	T221-Y335 HydrophobicContact CG2-CD1 3.4Å; T221-Y335 HydrophobicContact CG2-CD2 3.51Å; T221-Y335 HydrophobicContact CG2-CE1 3.84Å; T221-Y335 HydrophobicContact CG2-CE2 3.95Å; T221-Y335 HydrophobicContact CG2-CG 3.19Å; V225-Y335 HydrophobicContact CG2-CE1 3.7Å; V225-Y335 WeakPolarHBondContact CG2-OH 3.46Å; S323-Y335 VanDerWaalsContact CA-OH 3.27Å; S323-Y335 WeakPolarHBondContact CA-OH 3.47Å; S323-Y335 VanDerWaalsContact CB-OH 3.27Å; S323-Y335 WeakPolarHBondContact CB-OH 3.25Å; S323-Y335 PolarHBondContact O-OH 2.92Å; S323-Y335 VanDerWaalsContact O-OH 3.11Å; V326-Y335 HydrophobicContact CB-CE2 4.04Å; V326-Y335 HydrophobicContact CG1-CD2 4.02Å; V326-Y335 HydrophobicContact CG1-CE2 3.69Å; V326-Y335 WeakPolarHBondContact O-CE2 3.32Å; V326-Y335 PolarHBondContact O-OH 2.95Å; L327-Y335 WeakPolarHBondContact O-CD2 3.36Å; L327-Y335 WeakPolarHBondContact O-CE2 3.28Å; I331-Y335 PolarHBondContact O-N 3.06Å; D332-Y335 WeakPolarHBondContact O-CB 3.42Å; D332-Y335 PolarHBondContact O-N 3.11Å; Y335-G337 VanDerWaalsContact C-N 3.27Å; Y335-G337 PolarHBondContact O-N 2.9Å; Y335-M338 WeakPolarHBondContact O-CA 3.25Å; Y335-M338 WeakPolarHBondContact O-CB 2.77Å; Y335-M338 PolarHBondContact O-N 3.01Å; Y335-C339 PolarHBondContact O-N 3.13Å
336	T	98.3	Very high	97.3	Very high	3 Å²	3	24 Å²	24	2%	0.018	15%	0.146	C	C	.	.	H	α-helix	trans	-60.6	-40.3	177.6	-51.1	0	0	0	0	110.7	F271 F309 D332 D333 V334 C339 L340	F271-T336 HydrophobicContact CE2-CG2 3.78Å; F271-T336 HydrophobicContact CZ-CG2 3.67Å; F309-T336 HydrophobicContact CE2-CG2 4.38Å; F309-T336 HydrophobicContact CZ-CG2 4.29Å; D332-T336 PolarHBondContact O-N 3.15Å; D332-T336 PolarHBondContact O-OG1 3.11Å; D333-T336 PolarHBondContact O-N 3.25Å; V334-T336 VanDerWaalsContact C-N 3.3Å; V334-T336 PolarHBondContact O-N 2.96Å; T336-C339 PolarHBondContact O-N 3.24Å; T336-L340 WeakPolarHBondContact O-CG 3.41Å; T336-L340 PolarHBondContact O-N 3.34Å
337	G	98.3	Very high	97.4	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.01	15%	0.147	C	C	.	.	H	α-helix	trans	-61.4	-38.9	171.1	0	0	0	0	0	114	D333 V334 Y335 L340 Q341	D333-G337 PolarHBondContact O-N 2.77Å; D333-G337 VanDerWaalsContact O-N 3.09Å; V334-G337 CarbonylContact O-C 3.58Å; V334-G337 WeakPolarHBondContact O-CA 3Å; V334-G337 PolarHBondContact O-N 3.46Å; V334-G337 VanDerWaalsContact O-N 3.13Å; Y335-G337 VanDerWaalsContact C-N 3.27Å; Y335-G337 PolarHBondContact O-N 2.9Å; G337-L340 PolarHBondContact O-N 3.3Å; G337-Q341 WeakPolarHBondContact O-CB 3.33Å; G337-Q341 PolarHBondContact O-N 2.92Å
338	M	98.5	Very high	97.5	Very high	10 Å²	10	28.4 Å²	28.4	5%	0.049	17%	0.166	C	C	.	.	H	α-helix	trans	-63.8	-41.3	174.2	-66.1	169	172.1	0	0	111.5	W59 Y296 P301 V326 Y329 V334 Y335 Q341 K342	W59-M338 HydrophobicContact CH2-CE 3.87Å; W59-M338 HydrophobicContact CH2-SD 3.55Å; W59-M338 VanDerWaalsContact CH2-SD 3.55Å; W59-M338 HydrophobicContact CZ2-CE 4.1Å; W59-M338 HydrophobicContact CZ2-SD 3.51Å; W59-M338 VanDerWaalsContact CZ2-SD 3.51Å; W59-M338 HydrophobicContact CZ3-CE 4.27Å; W59-M338 HydrophobicContact CZ3-SD 4.5Å; Y296-M338 HydrophobicContact CD2-CE 4.44Å; Y296-M338 HydrophobicContact CE2-CE 3.64Å; P301-M338 HydrophobicContact CG-CB 4.45Å; P301-M338 HydrophobicContact CG-CG 3.85Å; V326-M338 HydrophobicContact CG1-CB 3.82Å; Y329-M338 HydrophobicContact CD1-CE 4.24Å; Y329-M338 HydrophobicContact CD2-CE 3.89Å; Y329-M338 HydrophobicContact CD2-SD 4.42Å; Y329-M338 HydrophobicContact CE1-CE 4.43Å; Y329-M338 HydrophobicContact CE2-CE 4.11Å; Y329-M338 HydrophobicContact CG-CE 3.98Å; Y329-M338 HydrophobicContact CG-SD 4.2Å; V334-M338 HydrophobicContact CG1-CE 3.75Å; V334-M338 HydrophobicContact CG1-SD 4.44Å; V334-M338 WeakPolarHBondContact O-CG 3.47Å; V334-M338 PolarHBondContact O-N 3.46Å; Y335-M338 WeakPolarHBondContact O-CA 3.25Å; Y335-M338 WeakPolarHBondContact O-CB 2.77Å; Y335-M338 PolarHBondContact O-N 3.01Å; M338-Q341 PolarHBondContact O-N 3.43Å; M338-K342 PolarHBondContact O-N 2.69Å
339	C	98.4	Very high	97.5	Very high	3 Å²	3	34.3 Å²	34.3	2%	0.02	19%	0.192	C	C	.	.	H	α-helix	trans	-63.9	-43.1	174.3	-68	0	0	0	0	112.2	L319 A322 Y335 T336 Q341 K342 L343	L319-C339 HydrophobicContact CD2-CB 3.66Å; A322-C339 HydrophobicContact CB-CB 4.38Å; Y335-C339 PolarHBondContact O-N 3.13Å; T336-C339 PolarHBondContact O-N 3.24Å; C339-Q341 VanDerWaalsContact C-N 3.34Å; C339-Q341 PolarHBondContact O-N 3.41Å; C339-K342 WeakPolarHBondContact O-CB 3.41Å; C339-K342 PolarHBondContact O-N 3.23Å; C339-L343 WeakPolarHBondContact O-CG 3.38Å; C339-L343 PolarHBondContact O-N 3.04Å; C339-L343 VanDerWaalsContact O-N 3.1Å
340	L	98.4	Very high	97.5	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-59.9	-44.8	174.2	-72.6	170.9	0	0	0	111.6	F271 L315 L319 T336 G337 K342 L343 G344 L345 P347	F271-L340 HydrophobicContact CD1-CD1 3.96Å; F271-L340 HydrophobicContact CD2-CD1 3.78Å; F271-L340 HydrophobicContact CD2-CD2 3.79Å; F271-L340 HydrophobicContact CD2-CG 4.27Å; F271-L340 HydrophobicContact CE1-CD1 3.97Å; F271-L340 HydrophobicContact CE2-CD1 3.79Å; F271-L340 HydrophobicContact CE2-CD2 4.27Å; F271-L340 HydrophobicContact CE2-CG 4.33Å; F271-L340 HydrophobicContact CG-CD1 3.86Å; F271-L340 HydrophobicContact CG-CD2 4.25Å; F271-L340 HydrophobicContact CZ-CD1 3.89Å; L315-L340 HydrophobicContact CD1-CD2 4.28Å; L315-L340 HydrophobicContact CD2-CD2 4.03Å; L319-L340 HydrophobicContact CD2-CD2 3.99Å; L319-L340 HydrophobicContact CD2-CG 4.16Å; T336-L340 WeakPolarHBondContact O-CG 3.41Å; T336-L340 PolarHBondContact O-N 3.34Å; G337-L340 PolarHBondContact O-N 3.3Å; L340-K342 VanDerWaalsContact C-N 3.31Å; L340-K342 PolarHBondContact O-N 2.98Å; L340-L343 CarbonylContact O-C 3.49Å; L340-L343 WeakPolarHBondContact O-CA 3.43Å; L340-L343 WeakPolarHBondContact O-CB 3.33Å; L340-L343 PolarHBondContact O-N 2.98Å; L340-L343 VanDerWaalsContact O-N 3.08Å; L340-G344 PolarHBondContact O-N 3.29Å; L340-L345 CarbonylContact C-O 3.59Å; L340-L345 VanDerWaalsContact C-O 3.29Å; L340-L345 HydrophobicContact CD2-CB 4.28Å; L340-L345 PolarHBondContact O-N 3.41Å; L340-L345 VanDerWaalsContact O-O 3.1Å; L340-P347 HydrophobicContact CD1-CB 4.01Å; L340-P347 HydrophobicContact CD1-CG 4.13Å
341	Q	97.6	Very high	97.4	Very high	120 Å²	120	44.9 Å²	44.9	56%	0.561	24%	0.239	S	C	*	.	H	α-helix	trans	-60.4	-41.2	176.5	-176.6	-179.5	48.8	0	0	111.7	P301 G337 M338 C339 L343 G344	P301-Q341 HydrophobicContact CB-CB 4.07Å; P301-Q341 HydrophobicContact CB-CG 4.47Å; G337-Q341 WeakPolarHBondContact O-CB 3.33Å; G337-Q341 PolarHBondContact O-N 2.92Å; M338-Q341 PolarHBondContact O-N 3.43Å; C339-Q341 VanDerWaalsContact C-N 3.34Å; C339-Q341 PolarHBondContact O-N 3.41Å; Q341-L343 PolarHBondContact O-N 2.89Å; Q341-G344 PolarHBondContact O-N 2.89Å
342	K	95.8	Very high	97.4	Very high	77 Å²	77	44.6 Å²	44.6	34%	0.335	24%	0.239	S	C	.	.	H	α-helix	trans	-60.6	-34.1	175.6	-170	69.6	170.2	-172.2	0	112	D67 Q325 V326 M338 C339 L340 G344	D67-K342 IonicContact OD1-NZ 2.62Å; D67-K342 PolarHBondContact OD1-NZ 2.89Å; Q325-K342 VanDerWaalsContact OE1-CE 3.24Å; V326-K342 HydrophobicContact CG2-CB 4.05Å; V326-K342 HydrophobicContact CG2-CG 4.15Å; M338-K342 PolarHBondContact O-N 2.69Å; C339-K342 WeakPolarHBondContact O-CB 3.41Å; C339-K342 PolarHBondContact O-N 3.23Å; L340-K342 VanDerWaalsContact C-N 3.31Å; L340-K342 PolarHBondContact O-N 2.98Å; K342-G344 PolarHBondContact O-N 3.23Å
343	L	96.3	Very high	97.4	Very high	48 Å²	48	44.6 Å²	44.6	25%	0.251	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-1.1	174.1	-66.1	175.5	0	0	0	114	L315 R318 L319 A322 C339 L340 Q341 L345	L315-L343 HydrophobicContact CD1-CD1 3.95Å; R318-L343 HydrophobicContact CB-CD1 3.85Å; R318-L343 HydrophobicContact CB-CD2 4.22Å; L319-L343 HydrophobicContact CD2-CD1 3.96Å; L319-L343 HydrophobicContact CG-CD1 4.27Å; A322-L343 HydrophobicContact CB-CD1 4.33Å; A322-L343 HydrophobicContact CB-CD2 3.96Å; A322-L343 HydrophobicContact CB-CG 3.94Å; C339-L343 WeakPolarHBondContact O-CG 3.38Å; C339-L343 PolarHBondContact O-N 3.04Å; C339-L343 VanDerWaalsContact O-N 3.1Å; L340-L343 CarbonylContact O-C 3.49Å; L340-L343 WeakPolarHBondContact O-CA 3.43Å; L340-L343 WeakPolarHBondContact O-CB 3.33Å; L340-L343 PolarHBondContact O-N 2.98Å; L340-L343 VanDerWaalsContact O-N 3.08Å; Q341-L343 PolarHBondContact O-N 2.89Å; L343-L345 VanDerWaalsContact C-N 3.25Å; L343-L345 HydrophobicContact CB-CD1 4.33Å; L343-L345 HydrophobicContact CB-CG 4.28Å; L343-L345 PolarHBondContact O-N 3.16Å
344	G	96.7	Very high	97.4	Very high	69 Å²	69	47.6 Å²	47.6	71%	0.711	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.4	19.7	-174.6	0	0	0	0	0	113.7	L340 Q341 K342	L340-G344 PolarHBondContact O-N 3.29Å; Q341-G344 PolarHBondContact O-N 2.89Å; K342-G344 PolarHBondContact O-N 3.23Å
345	L	96.6	Very high	97.2	Very high	47 Å²	47	48 Å²	48	25%	0.246	25%	0.253	C	S	.	.			trans	-109	162.3	-179.7	-63.7	178.7	0	0	0	111.2	L315 L340 L343	L315-L345 HydrophobicContact CD1-CD1 3.49Å; L315-L345 VanDerWaalsContact CD1-CD1 3.49Å; L340-L345 CarbonylContact C-O 3.59Å; L340-L345 VanDerWaalsContact C-O 3.29Å; L340-L345 HydrophobicContact CD2-CB 4.28Å; L340-L345 PolarHBondContact O-N 3.41Å; L340-L345 VanDerWaalsContact O-O 3.1Å; L343-L345 VanDerWaalsContact C-N 3.25Å; L343-L345 HydrophobicContact CB-CD1 4.33Å; L343-L345 HydrophobicContact CB-CG 4.28Å; L343-L345 PolarHBondContact O-N 3.16Å
346	A	95.7	Very high	96.9	Very high	65 Å²	65	56.2 Å²	56.2	54%	0.537	29%	0.289	S	S	.	.			trans	-137.7	142.8	170.3	0	0	0	0	0	109.4
347	P	97.7	Very high	96.6	Very high	7 Å²	7	57.5 Å²	57.5	5%	0.045	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-69.7	148.1	178	31.8	-36.4	0	0	0	111.4	F271 V275 P302 L340	F271-P347 HydrophobicContact CD1-CB 3.43Å; F271-P347 VanDerWaalsContact CD1-CB 3.43Å; F271-P347 HydrophobicContact CE1-CB 3.89Å; F271-P347 HydrophobicContact CG-CB 4.27Å; V275-P347 HydrophobicContact CG1-CG 3.91Å; V275-P347 HydrophobicContact CG2-CB 3.71Å; V275-P347 HydrophobicContact CG2-CG 3.87Å; P302-P347 HydrophobicContact CB-CG 4.39Å; P302-P347 WeakPolarHBondContact O-CD 3.07Å; L340-P347 HydrophobicContact CD1-CB 4.01Å; L340-P347 HydrophobicContact CD1-CG 4.13Å
348	E	98	Very high	96.3	Very high	100 Å²	100	58.5 Å²	58.5	47%	0.467	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	132.8	177.4	-82.2	-176.3	-153.9	0	0	111.6	K266 F271 I272 G273 V275 H350	K266-E348 VanDerWaalsContact CE-OE2 3.28Å; K266-E348 WeakPolarHBondContact CE-OE2 3.21Å; K266-E348 IonicContact NZ-OE2 2.75Å; K266-E348 PolarHBondContact NZ-OE2 3.35Å; F271-E348 PolarHBondContact O-N 2.75Å; I272-E348 VanDerWaalsContact CA-O 3.26Å; I272-E348 WeakPolarHBondContact CA-O 3.48Å; I272-E348 HydrophobicContact CG2-CB 3.88Å; G273-E348 PolarHBondContact N-O 2.75Å; V275-E348 VanDerWaalsContact CG2-C 3.48Å; V275-E348 WeakPolarHBondContact CG2-O 3.21Å; E348-H350 PolarHBondContact O-N 2.74Å
349	K	97.7	Very high	95.9	Very high	131 Å²	131	63.5 Å²	63.5	57%	0.57	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.7	129.2	177	-173.9	167.3	-177.9	119.9	0	110.6	G273 D274 V275	G273-K349 WeakPolarHBondContact O-CA 3.17Å; D274-K349 WeakPolarHBondContact OD1-CE 3.1Å; D274-K349 IonicContact OD1-NZ 2.8Å; D274-K349 PolarHBondContact OD1-NZ 3Å; V275-K349 HydrophobicContact CB-CB 4.04Å; V275-K349 HydrophobicContact CG2-CB 4.36Å
350	H	97.5	Very high	95.5	Very high	44 Å²	44	70.5 Å²	70.5	20%	0.204	36%	0.356	C	S	.	.			trans	-121.6	121.5	172.3	-171.3	-80.8	0	0	0	111.3	Y258 I272 G273 E348 G352 F353	Y258-H350 AromaticContact CD2-NE2 3.98Å; Y258-H350 AromaticContact CE2-CD2 3.89Å; Y258-H350 AromaticContact CE2-NE2 3.8Å; I272-H350 HydrophobicContact CB-CB 4.15Å; I272-H350 HydrophobicContact CD1-CB 4.06Å; G273-H350 PolarHBondContact O-N 3.27Å; E348-H350 PolarHBondContact O-N 2.74Å; H350-G352 PolarHBondContact ND1-N 2.96Å; H350-G352 VanDerWaalsContact ND1-N 3.14Å; H350-G352 PolarHBondContact O-N 3.03Å; H350-F353 HydrophobicContact CB-CD2 3.87Å; H350-F353 HydrophobicContact CB-CE2 4.11Å; H350-F353 AromaticContact ND1-CD2 3.95Å; H350-F353 PolarHBondContact O-N 3.19Å; H350-F353 VanDerWaalsContact O-N 3.12Å
351	K	95.9	Very high	95.1	Very high	178 Å²	178	77 Å²	77	77%	0.774	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-18.4	-172.5	-66.8	-175.6	179.9	179.1	0	114.7	F353 K354	K351-F353 VanDerWaalsContact C-N 3.27Å; K351-K354 WeakPolarHBondContact O-CE 3.47Å; K351-K354 PolarHBondContact O-NZ 3.47Å; K351-K354 VanDerWaalsContact O-NZ 3.09Å
352	G	96.8	Very high	94.8	Very high	6 Å²	6	76 Å²	76	6%	0.062	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-13	176.9	0	0	0	0	0	114.3	H350 K354 M373 L374	H350-G352 PolarHBondContact ND1-N 2.96Å; H350-G352 VanDerWaalsContact ND1-N 3.14Å; H350-G352 PolarHBondContact O-N 3.03Å; G352-K354 PolarHBondContact O-N 3.05Å; G352-M373 PolarHBondContact O-N 3.27Å; G352-L374 PolarHBondContact O-N 2.74Å
353	F	97.9	Very high	94.5	Very high	5 Å²	5	77.1 Å²	77.1	2%	0.022	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	106.9	172.9	-71.5	-103.2	0	0	0	109	F242 I272 D274 G308 L310 H350 K351 M373 L374	F242-F353 HydrophobicContact CE2-CE1 4.28Å; I272-F353 HydrophobicContact CD1-CE2 3.93Å; I272-F353 HydrophobicContact CD1-CZ 4.5Å; I272-F353 HydrophobicContact CG1-CE2 4.12Å; I272-F353 HydrophobicContact CG1-CZ 4.39Å; D274-F353 HydrophobicContact CB-CB 4.07Å; G308-F353 VanDerWaalsContact O-CD1 3.27Å; G308-F353 WeakPolarHBondContact O-CD1 3.43Å; G308-F353 WeakPolarHBondContact O-CE1 3.23Å; L310-F353 HydrophobicContact CB-CZ 4.06Å; H350-F353 HydrophobicContact CB-CD2 3.87Å; H350-F353 HydrophobicContact CB-CE2 4.11Å; H350-F353 AromaticContact ND1-CD2 3.95Å; H350-F353 PolarHBondContact O-N 3.19Å; H350-F353 VanDerWaalsContact O-N 3.12Å; K351-F353 VanDerWaalsContact C-N 3.27Å; F353-M373 HydrophobicContact CD2-CB 3.98Å; F353-M373 HydrophobicContact CD2-CG 4.19Å; F353-M373 HydrophobicContact CE2-CB 3.82Å; F353-M373 HydrophobicContact CE2-CG 3.88Å; F353-M373 HydrophobicContact CG-CB 4.44Å; F353-M373 HydrophobicContact CZ-CB 4.15Å; F353-L374 HydrophobicContact CD1-CB 4.05Å; F353-L374 HydrophobicContact CD1-CD2 4.4Å; F353-L374 HydrophobicContact CE1-CB 4.44Å
354	K	96.6	Very high	94.2	Very high	83 Å²	83	81.4 Å²	81.4	36%	0.361	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	73.5	-177.4	-59	-59.4	-171.1	-173	0	110.8	K351 G352 F356 D357 I358 L372 L374 V375 H376	K351-K354 WeakPolarHBondContact O-CE 3.47Å; K351-K354 PolarHBondContact O-NZ 3.47Å; K351-K354 VanDerWaalsContact O-NZ 3.09Å; G352-K354 PolarHBondContact O-N 3.05Å; K354-F356 VanDerWaalsContact C-N 3.29Å; K354-F356 PolarHBondContact O-N 2.93Å; K354-D357 PolarHBondContact O-N 3.22Å; K354-I358 HydrophobicContact CB-CG2 4.28Å; K354-I358 HydrophobicContact CG-CG2 4.02Å; K354-L372 HydrophobicContact CG-CB 4.33Å; K354-L374 WeakPolarHBondContact CB-O 3.35Å; K354-L374 PolarHBondContact N-O 3.42Å; K354-V375 HydrophobicContact CB-CB 4.15Å; K354-V375 HydrophobicContact CB-CG2 4.01Å; K354-V375 CarbonylContact O-C 3.54Å; K354-V375 VanDerWaalsContact O-CA 3.29Å; K354-V375 WeakPolarHBondContact O-CA 3.29Å; K354-H376 PolarHBondContact O-N 3.49Å
355	T	93.6	Very high	94.1	Very high	8 Å²	8	81.7 Å²	81.7	5%	0.049	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-15	-175.5	54.2	0	0	0	0	113.6	D274 G305 G306 L374	D274-T355 HydrophobicContact CB-CG2 3.69Å; D274-T355 PolarHBondContact OD2-OG1 3.12Å; G305-T355 WeakPolarHBondContact O-CG2 3.43Å; G306-T355 VanDerWaalsContact O-CB 3.23Å; G306-T355 WeakPolarHBondContact O-CB 3.16Å; G306-T355 WeakPolarHBondContact O-CG2 3.29Å; T355-L374 HydrophobicContact CG2-CD2 4.15Å
356	F	92.1	Very high	94	Very high	174 Å²	174	80.3 Å²	80.3	76%	0.763	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.9	33.2	173.3	-64.6	-85.4	0	0	0	111.7	K354	K354-F356 VanDerWaalsContact C-N 3.29Å; K354-F356 PolarHBondContact O-N 2.93Å
357	D	92.6	Very high	93.9	Very high	30 Å²	30	78.8 Å²	78.8	16%	0.16	36%	0.364	C	S	.	.			trans	59.3	179.4	-174.9	-149.4	-14	0	0	0	114.3	K354 R363 V375 H376 R378	K354-D357 PolarHBondContact O-N 3.22Å; D357-R363 IonicContact OD1-NE 2.76Å; D357-R363 IonicContact OD2-CZ 3.71Å; D357-R363 IonicContact OD2-NE 2.83Å; D357-R363 PolarHBondContact OD2-NE 2.95Å; D357-R363 IonicContact OD2-NH2 3.68Å; D357-R363 PolarHBondContact OD2-NH2 3.29Å; D357-V375 WeakPolarHBondContact OD1-CG2 3.49Å; D357-H376 VanDerWaalsContact CA-O 3.23Å; D357-H376 WeakPolarHBondContact CA-O 3.45Å; D357-H376 WeakPolarHBondContact CB-O 3.19Å; D357-H376 PolarHBondContact N-O 2.85Å; D357-H376 VanDerWaalsContact N-O 3.16Å; D357-R378 VanDerWaalsContact CG-NH1 3.3Å; D357-R378 IonicContact OD1-CZ 3.86Å; D357-R378 VanDerWaalsContact OD1-CZ 3.27Å; D357-R378 IonicContact OD1-NH1 3.41Å; D357-R378 PolarHBondContact OD1-NH1 3.04Å; D357-R378 IonicContact OD1-NH2 2.7Å; D357-R378 PolarHBondContact OD1-NH2 3.09Å; D357-R378 IonicContact OD2-NH1 3.54Å; D357-R378 PolarHBondContact OD2-NH1 3.45Å
358	I	92.3	Very high	93.7	Very high	22 Å²	22	80 Å²	80	11%	0.113	37%	0.373	C	S	.	.			trans	-96.9	158.3	164.1	59.7	176.5	0	0	0	109.8	K354 E360 R363 Y369 L372 V375	K354-I358 HydrophobicContact CB-CG2 4.28Å; K354-I358 HydrophobicContact CG-CG2 4.02Å; I358-E360 PolarHBondContact O-N 2.92Å; I358-R363 HydrophobicContact CG1-CG 4Å; I358-Y369 HydrophobicContact CD1-CD2 4.46Å; I358-Y369 HydrophobicContact CD1-CE1 4.28Å; I358-Y369 HydrophobicContact CD1-CE2 3.81Å; I358-L372 HydrophobicContact CG2-CD2 4.27Å; I358-V375 HydrophobicContact CG2-CG2 4.36Å
359	E	90.6	Very high	93.6	Very high	114 Å²	114	75.5 Å²	75.5	53%	0.533	35%	0.352	S	S	.	.			trans	-55	142.5	178.1	-59.2	174.6	-134.3	0	0	111.1	K361 Y362 R363	E359-K361 HydrophobicContact CB-CG 4.36Å; E359-K361 PolarHBondContact O-N 3.18Å; E359-K361 VanDerWaalsContact O-N 3.14Å; E359-K361 WeakPolarHBondContact OE2-CE 3.43Å; E359-K361 IonicContact OE2-NZ 3.46Å; E359-K361 PolarHBondContact OE2-NZ 3.36Å; E359-Y362 HydrophobicContact CB-CD2 3.79Å; E359-Y362 HydrophobicContact CB-CE2 4.29Å; E359-Y362 HydrophobicContact CG-CD2 4.3Å; E359-Y362 HydrophobicContact CG-CE2 4.47Å; E359-Y362 WeakPolarHBondContact O-CA 3.46Å; E359-Y362 WeakPolarHBondContact O-CB 3.48Å; E359-Y362 PolarHBondContact O-N 3.48Å; E359-R363 PolarHBondContact O-N 3.37Å
360	E	89.6	Confident	93.4	Very high	150 Å²	150	70.8 Å²	70.8	70%	0.701	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-54.3	-40.5	-172.8	-173.1	169.3	-161.8	0	0	113.1	I358 Y362 R363	I358-E360 PolarHBondContact O-N 2.92Å; E360-Y362 PolarHBondContact O-N 2.83Å; E360-Y362 VanDerWaalsContact O-N 3.12Å; E360-R363 WeakPolarHBondContact O-CB 3.35Å; E360-R363 PolarHBondContact O-N 3.31Å; E360-R363 VanDerWaalsContact O-N 3.11Å
361	K	90.5	Very high	93	Very high	138 Å²	138	74.8 Å²	74.8	60%	0.6	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-60.5	-22.4	177.4	73.6	-167.2	-168.9	-149.3	0	114	E359	E359-K361 HydrophobicContact CB-CG 4.36Å; E359-K361 PolarHBondContact O-N 3.18Å; E359-K361 VanDerWaalsContact O-N 3.14Å; E359-K361 WeakPolarHBondContact OE2-CE 3.43Å; E359-K361 IonicContact OE2-NZ 3.46Å; E359-K361 PolarHBondContact OE2-NZ 3.36Å
362	Y	90.6	Very high	93	Very high	99 Å²	99	66.6 Å²	66.6	39%	0.388	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-98.2	-11.6	-179.7	-63.4	-48.3	0	0	0	113.3	E359 E360 N364 N365 S368	E359-Y362 HydrophobicContact CB-CD2 3.79Å; E359-Y362 HydrophobicContact CB-CE2 4.29Å; E359-Y362 HydrophobicContact CG-CD2 4.3Å; E359-Y362 HydrophobicContact CG-CE2 4.47Å; E359-Y362 WeakPolarHBondContact O-CA 3.46Å; E359-Y362 WeakPolarHBondContact O-CB 3.48Å; E359-Y362 PolarHBondContact O-N 3.48Å; E360-Y362 PolarHBondContact O-N 2.83Å; E360-Y362 VanDerWaalsContact O-N 3.12Å; Y362-N364 VanDerWaalsContact C-N 3.27Å; Y362-N364 PolarHBondContact O-N 3.01Å; Y362-N365 PolarHBondContact O-N 2.76Å; Y362-S368 WeakPolarHBondContact CB-OG 3.48Å; Y362-S368 PolarHBondContact O-OG 3.38Å
363	R	90.3	Very high	93	Very high	102 Å²	102	66.4 Å²	66.4	39%	0.385	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-34.4	-175.7	-73.8	-178.3	175.9	162.6	-3.3	114.3	D357 I358 E359 E360 Y369	D357-R363 IonicContact OD1-NE 2.76Å; D357-R363 IonicContact OD2-CZ 3.71Å; D357-R363 IonicContact OD2-NE 2.83Å; D357-R363 PolarHBondContact OD2-NE 2.95Å; D357-R363 IonicContact OD2-NH2 3.68Å; D357-R363 PolarHBondContact OD2-NH2 3.29Å; I358-R363 HydrophobicContact CG1-CG 4Å; E359-R363 PolarHBondContact O-N 3.37Å; E360-R363 WeakPolarHBondContact O-CB 3.35Å; E360-R363 PolarHBondContact O-N 3.31Å; E360-R363 VanDerWaalsContact O-N 3.11Å; R363-Y369 VanDerWaalsContact O-CE2 3.29Å; R363-Y369 WeakPolarHBondContact O-CE2 3.15Å; R363-Y369 PolarHBondContact O-OH 3.12Å
364	N	89.9	Confident	93	Very high	138 Å²	138	66.2 Å²	66.2	74%	0.738	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-12.1	179.7	-67.4	-36	0	0	0	113.4	Y362 I366	Y362-N364 VanDerWaalsContact C-N 3.27Å; Y362-N364 PolarHBondContact O-N 3.01Å; N364-I366 PolarHBondContact O-N 3.23Å
365	N	92.8	Very high	93.1	Very high	74 Å²	74	62.2 Å²	62.2	40%	0.396	30%	0.301	S	S	.	.			trans	-87.7	108.2	177.5	-176.8	-8.5	0	0	0	109.8	Y362 C367 S368 Y369	Y362-N365 PolarHBondContact O-N 2.76Å; N365-C367 PolarHBondContact O-N 3.13Å; N365-C367 VanDerWaalsContact OD1-CB 3.28Å; N365-C367 WeakPolarHBondContact OD1-CB 3.08Å; N365-C367 PolarHBondContact OD1-N 3.32Å; N365-S368 VanDerWaalsContact O-CB 3.3Å; N365-S368 WeakPolarHBondContact O-CB 3.41Å; N365-S368 PolarHBondContact O-N 2.87Å; N365-S368 PolarHBondContact O-OG 2.97Å; N365-Y369 WeakPolarHBondContact O-CD2 3.33Å
366	I	94.8	Very high	93.2	Very high	18 Å²	18	64.3 Å²	64.3	9%	0.092	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-61.5	-28.3	-178.3	-169	64.2	0	0	0	113	N364 S368 Y369 I386 R389 L390 L395	N364-I366 PolarHBondContact O-N 3.23Å; I366-S368 PolarHBondContact O-N 3.11Å; I366-S368 VanDerWaalsContact O-N 3.14Å; I366-Y369 HydrophobicContact CD1-CD2 4.33Å; I366-Y369 WeakPolarHBondContact O-CB 3.16Å; I366-Y369 PolarHBondContact O-N 2.86Å; I366-I386 HydrophobicContact CD1-CG2 3.99Å; I366-R389 HydrophobicContact CB-CB 4.48Å; I366-R389 HydrophobicContact CD1-CB 3.69Å; I366-R389 HydrophobicContact CG1-CB 3.71Å; I366-L390 HydrophobicContact CD1-CD2 4.12Å; I366-L390 HydrophobicContact CD1-CG 3.87Å; I366-L390 HydrophobicContact CG1-CD2 4.01Å; I366-L390 HydrophobicContact CG1-CG 4.19Å; I366-L395 HydrophobicContact CG1-CD2 4.31Å; I366-L395 HydrophobicContact CG2-CD1 3.35Å; I366-L395 HydrophobicContact CG2-CD2 4.31Å; I366-L395 HydrophobicContact CG2-CG 4.49Å
367	C	93.6	Very high	93.4	Very high	33 Å²	33	58.8 Å²	58.8	22%	0.223	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-64.7	-17.8	175.7	-59.4	0	0	0	0	113.4	N365 Y369 T370 C397	N365-C367 PolarHBondContact O-N 3.13Å; N365-C367 VanDerWaalsContact OD1-CB 3.28Å; N365-C367 WeakPolarHBondContact OD1-CB 3.08Å; N365-C367 PolarHBondContact OD1-N 3.32Å; C367-Y369 PolarHBondContact O-N 3.2Å; C367-T370 PolarHBondContact O-OG1 2.74Å; C367-C397 WeakPolarHBondContact CA-SG 3.44Å; C367-C397 HydrophobicContact CB-CB 3.59Å; C367-C397 WeakPolarHBondContact CB-SG 3.15Å; C367-C397 WeakPolarHBondContact SG-CA 3.35Å; C367-C397 WeakPolarHBondContact SG-CB 3.17Å; C367-C397 CovalentContact SG-SG 2.03Å; C367-C397 PolarHBondContact SG-SG 2.89Å
368	S	94.3	Very high	93.6	Very high	32 Å²	32	58 Å²	58	22%	0.224	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-72.2	-17.1	173.2	-54.3	0	0	0	0	112.1	Y362 N365 I366 L372	Y362-S368 WeakPolarHBondContact CB-OG 3.48Å; Y362-S368 PolarHBondContact O-OG 3.38Å; N365-S368 VanDerWaalsContact O-CB 3.3Å; N365-S368 WeakPolarHBondContact O-CB 3.41Å; N365-S368 PolarHBondContact O-N 2.87Å; N365-S368 PolarHBondContact O-OG 2.97Å; I366-S368 PolarHBondContact O-N 3.11Å; I366-S368 VanDerWaalsContact O-N 3.14Å; S368-L372 WeakPolarHBondContact O-CD2 3.4Å
369	Y	95.6	Very high	93.9	Very high	7 Å²	7	63.5 Å²	63.5	3%	0.027	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-12.1	-177.8	-61.4	-100.2	0	0	0	113.6	F249 N251 I358 R363 N365 I366 C367 L372 V375 R378 I386	F249-Y369 HydrophobicContact CD1-CD1 4.15Å; F249-Y369 HydrophobicContact CE1-CD1 4.42Å; N251-Y369 PolarHBondContact ND2-O 3.08Å; I358-Y369 HydrophobicContact CD1-CD2 4.46Å; I358-Y369 HydrophobicContact CD1-CE1 4.28Å; I358-Y369 HydrophobicContact CD1-CE2 3.81Å; R363-Y369 VanDerWaalsContact O-CE2 3.29Å; R363-Y369 WeakPolarHBondContact O-CE2 3.15Å; R363-Y369 PolarHBondContact O-OH 3.12Å; N365-Y369 WeakPolarHBondContact O-CD2 3.33Å; I366-Y369 HydrophobicContact CD1-CD2 4.33Å; I366-Y369 WeakPolarHBondContact O-CB 3.16Å; I366-Y369 PolarHBondContact O-N 2.86Å; C367-Y369 PolarHBondContact O-N 3.2Å; Y369-L372 HydrophobicContact CD1-CD2 4Å; Y369-L372 HydrophobicContact CG-CD2 4.33Å; Y369-V375 HydrophobicContact CD1-CG1 4.12Å; Y369-V375 HydrophobicContact CE1-CG1 3.85Å; Y369-R378 PolarHBondContact OH-NE 2.85Å; Y369-R378 PolarHBondContact OH-NH2 3.31Å; Y369-I386 HydrophobicContact CD1-CD1 4.13Å; Y369-I386 HydrophobicContact CD1-CG1 4.46Å; Y369-I386 HydrophobicContact CD1-CG2 3.69Å; Y369-I386 HydrophobicContact CE1-CD1 3.53Å; Y369-I386 HydrophobicContact CE1-CG1 4.15Å; Y369-I386 HydrophobicContact CE1-CG2 4.21Å; Y369-I386 HydrophobicContact CG-CG2 3.89Å
370	T	93.2	Very high	94.3	Very high	31 Å²	31	58.8 Å²	58.8	19%	0.19	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-39.2	-177.5	54.9	0	0	0	0	112.1	N251 Q254 C367 L390 L395	N251-T370 PolarHBondContact ND2-O 2.9Å; Q254-T370 PolarHBondContact OE1-O 3.15Å; C367-T370 PolarHBondContact O-OG1 2.74Å; T370-L390 HydrophobicContact CG2-CD2 3.66Å; T370-L395 HydrophobicContact CG2-CD2 4.29Å
371	N	89.7	Confident	94.7	Very high	129 Å²	129	58.1 Å²	58.1	69%	0.69	29%	0.287	S	S	*	.	S	Bend	trans	-101.3	1	-173.5	-66.2	-45.9	0	0	0	114.8
372	L	95.3	Very high	95.1	Very high	5 Å²	5	55.5 Å²	55.5	3%	0.026	28%	0.277	C	S	.	.			trans	-90.1	155.3	174.1	63.3	78.6	0	0	0	110.7	F249 N251 K354 I358 S368 Y369 V375	F249-L372 HydrophobicContact CD1-CD1 4.4Å; N251-L372 HydrophobicContact CB-CD1 4.42Å; N251-L372 VanDerWaalsContact CB-O 3.26Å; N251-L372 WeakPolarHBondContact CB-O 3.37Å; K354-L372 HydrophobicContact CG-CB 4.33Å; I358-L372 HydrophobicContact CG2-CD2 4.27Å; S368-L372 WeakPolarHBondContact O-CD2 3.4Å; Y369-L372 HydrophobicContact CD1-CD2 4Å; Y369-L372 HydrophobicContact CG-CD2 4.33Å; L372-V375 HydrophobicContact CD1-CB 4.46Å; L372-V375 HydrophobicContact CD1-CG1 4.42Å; L372-V375 HydrophobicContact CD2-CB 4.09Å; L372-V375 HydrophobicContact CD2-CG1 4.32Å
373	M	97.5	Very high	95.5	Very high	3 Å²	3	50.8 Å²	50.8	2%	0.015	26%	0.258	C	S	.	.	S	Bend	trans	-87.7	-45.2	171.5	-65.7	-66.3	173.4	0	0	110.3	V250 N251 Q254 I255 Y258 G352 F353	V250-M373 WeakPolarHBondContact CA-O 3.22Å; V250-M373 WeakPolarHBondContact CG1-O 3.4Å; N251-M373 PolarHBondContact N-O 2.8Å; Q254-M373 HydrophobicContact CB-SD 4.33Å; Q254-M373 HydrophobicContact CG-CE 3.86Å; Q254-M373 HydrophobicContact CG-SD 3.85Å; I255-M373 HydrophobicContact CB-SD 4.33Å; I255-M373 HydrophobicContact CG1-CB 4.41Å; I255-M373 HydrophobicContact CG1-SD 3.57Å; I255-M373 VanDerWaalsContact CG1-SD 3.57Å; Y258-M373 VanDerWaalsContact CB-CE 3.41Å; Y258-M373 HydrophobicContact CD1-CE 4.44Å; Y258-M373 HydrophobicContact CD2-CE 4Å; Y258-M373 HydrophobicContact CG-CE 3.7Å; G352-M373 PolarHBondContact O-N 3.27Å; F353-M373 HydrophobicContact CD2-CB 3.98Å; F353-M373 HydrophobicContact CD2-CG 4.19Å; F353-M373 HydrophobicContact CE2-CB 3.82Å; F353-M373 HydrophobicContact CE2-CG 3.88Å; F353-M373 HydrophobicContact CG-CB 4.44Å; F353-M373 HydrophobicContact CZ-CB 4.15Å
374	L	97.9	Very high	95.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	147.4	-173.7	166.2	146.5	0	0	0	110.1	F242 V248 F249 V250 G352 F353 K354 T355	F242-L374 HydrophobicContact CE2-CD1 4Å; F242-L374 HydrophobicContact CZ-CD1 3.7Å; V248-L374 HydrophobicContact CB-CD1 3.86Å; V248-L374 HydrophobicContact CB-CG 4.08Å; V248-L374 HydrophobicContact CG1-CD1 4.02Å; V248-L374 HydrophobicContact CG1-CD2 4.48Å; V248-L374 HydrophobicContact CG1-CG 4.33Å; V248-L374 HydrophobicContact CG2-CD1 3.68Å; V248-L374 HydrophobicContact CG2-CG 4.37Å; F249-L374 CarbonylContact O-C 3.55Å; F249-L374 VanDerWaalsContact O-CA 3.29Å; F249-L374 WeakPolarHBondContact O-CA 3.27Å; V250-L374 HydrophobicContact CG2-CD1 4.32Å; G352-L374 PolarHBondContact O-N 2.74Å; F353-L374 HydrophobicContact CD1-CB 4.05Å; F353-L374 HydrophobicContact CD1-CD2 4.4Å; F353-L374 HydrophobicContact CE1-CB 4.44Å; K354-L374 WeakPolarHBondContact CB-O 3.35Å; K354-L374 PolarHBondContact N-O 3.42Å; T355-L374 HydrophobicContact CG2-CD2 4.15Å
375	V	97.8	Very high	96.2	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	132.2	167.5	63.7	0	0	0	0	111.7	V248 F249 K354 D357 I358 Y369 L372 R378	V248-V375 WeakPolarHBondContact CA-O 3.46Å; F249-V375 HydrophobicContact CB-CG1 3.9Å; F249-V375 HydrophobicContact CD1-CG1 4.2Å; F249-V375 PolarHBondContact N-O 2.96Å; F249-V375 PolarHBondContact O-N 2.61Å; K354-V375 HydrophobicContact CB-CB 4.15Å; K354-V375 HydrophobicContact CB-CG2 4.01Å; K354-V375 CarbonylContact O-C 3.54Å; K354-V375 VanDerWaalsContact O-CA 3.29Å; K354-V375 WeakPolarHBondContact O-CA 3.29Å; D357-V375 WeakPolarHBondContact OD1-CG2 3.49Å; I358-V375 HydrophobicContact CG2-CG2 4.36Å; Y369-V375 HydrophobicContact CD1-CG1 4.12Å; Y369-V375 HydrophobicContact CE1-CG1 3.85Å; L372-V375 HydrophobicContact CD1-CB 4.46Å; L372-V375 HydrophobicContact CD1-CG1 4.42Å; L372-V375 HydrophobicContact CD2-CB 4.09Å; L372-V375 HydrophobicContact CD2-CG1 4.32Å; V375-R378 HydrophobicContact CG1-CG 4.33Å
376	H	96.7	Very high	96.4	Very high	51 Å²	51	45.2 Å²	45.2	24%	0.236	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	138.2	174.4	-176.9	-87.8	0	0	0	110.1	D247 V248 K354 D357	D247-H376 IonicContact OD1-CD2 2.83Å; D247-H376 PolarHBondContact OD1-CD2 3.5Å; D247-H376 IonicContact OD1-NE2 2.73Å; D247-H376 PolarHBondContact OD1-NE2 3.1Å; D247-H376 IonicContact OD2-CD2 2.75Å; D247-H376 IonicContact OD2-CE1 3.27Å; D247-H376 IonicContact OD2-NE2 3.92Å; D247-H376 PolarHBondContact OD2-NE2 2.96Å; V248-H376 HydrophobicContact CG1-CB 4.02Å; K354-H376 PolarHBondContact O-N 3.49Å; D357-H376 VanDerWaalsContact CA-O 3.23Å; D357-H376 WeakPolarHBondContact CA-O 3.45Å; D357-H376 WeakPolarHBondContact CB-O 3.19Å; D357-H376 PolarHBondContact N-O 2.85Å; D357-H376 VanDerWaalsContact N-O 3.16Å
377	S	96.2	Very high	96.6	Very high	59 Å²	59	45.8 Å²	45.8	41%	0.413	23%	0.23	S	C	.	.			cis	-108.3	159.4	-14.4	60.4	0	0	0	0	111.2	D247	D247-S377 CarbonylContact O-C 3.6Å; D247-S377 WeakPolarHBondContact O-CA 3.17Å; D247-S377 VanDerWaalsContact O-CB 3.3Å; D247-S377 WeakPolarHBondContact O-CB 3.28Å
378	R	97.6	Very high	96.7	Very high	13 Å²	13	48.5 Å²	48.5	5%	0.049	25%	0.246	C	C	.	.			trans	-134.3	139.9	173.7	-66.4	-62.9	-179.7	-85.9	1.5	110.2	D247 F249 D357 Y369 V375 E382 M383 I386	D247-R378 PolarHBondContact O-N 3.37Å; F249-R378 HydrophobicContact CB-CB 4.2Å; F249-R378 HydrophobicContact CB-CG 3.77Å; D357-R378 VanDerWaalsContact CG-NH1 3.3Å; D357-R378 IonicContact OD1-CZ 3.86Å; D357-R378 VanDerWaalsContact OD1-CZ 3.27Å; D357-R378 IonicContact OD1-NH1 3.41Å; D357-R378 PolarHBondContact OD1-NH1 3.04Å; D357-R378 IonicContact OD1-NH2 2.7Å; D357-R378 PolarHBondContact OD1-NH2 3.09Å; D357-R378 IonicContact OD2-NH1 3.54Å; D357-R378 PolarHBondContact OD2-NH1 3.45Å; Y369-R378 PolarHBondContact OH-NE 2.85Å; Y369-R378 PolarHBondContact OH-NH2 3.31Å; V375-R378 HydrophobicContact CG1-CG 4.33Å; R378-E382 WeakPolarHBondContact CA-OE2 3.43Å; R378-E382 HydrophobicContact CB-CB 4.16Å; R378-M383 HydrophobicContact CB-CE 4.47Å; R378-M383 HydrophobicContact CB-CG 3.91Å; R378-M383 WeakPolarHBondContact O-CE 3.49Å; R378-I386 HydrophobicContact CG-CD1 3.99Å
379	K	98.3	Very high	96.8	Very high	138 Å²	138	52.7 Å²	52.7	60%	0.6	26%	0.257	S	S	*	.			trans	-73	159.3	171	-67.1	179.9	-178.9	177.4	0	110.7	Q381 E382 M383	K379-Q381 VanDerWaalsContact C-N 3.31Å; K379-Q381 PolarHBondContact O-N 3.04Å; K379-E382 HydrophobicContact CB-CG 4.19Å; K379-E382 PolarHBondContact N-OE2 3.09Å; K379-E382 WeakPolarHBondContact O-CA 3.22Å; K379-E382 WeakPolarHBondContact O-CB 3.48Å; K379-E382 PolarHBondContact O-N 3.35Å; K379-M383 WeakPolarHBondContact O-CG 3.39Å; K379-M383 PolarHBondContact O-N 3.3Å
380	P	98.6	Very high	96.8	Very high	15 Å²	15	53.8 Å²	53.8	10%	0.097	26%	0.263	C	S	.	.	H	α-helix	trans	-48.1	-47.9	178.1	-30.5	36.4	0	0	0	114	D156 R157 A160 E382 M383 I384	D156-P380 HydrophobicContact CB-CG 4.29Å; R157-P380 HydrophobicContact CG-CG 4.01Å; A160-P380 HydrophobicContact CB-CB 3.59Å; P380-E382 VanDerWaalsContact C-N 3.31Å; P380-E382 PolarHBondContact O-N 3.47Å; P380-M383 PolarHBondContact O-N 3.39Å; P380-I384 PolarHBondContact O-N 3.05Å
381	Q	98.4	Very high	96.7	Very high	135 Å²	135	56.4 Å²	56.4	63%	0.631	27%	0.273	S	S	*	.	H	α-helix	trans	-67.2	-32.7	-179.8	-58.2	84.1	-1.5	0	0	112.5	K379 K385	K379-Q381 VanDerWaalsContact C-N 3.31Å; K379-Q381 PolarHBondContact O-N 3.04Å; Q381-K385 VanDerWaalsContact O-CB 3.24Å; Q381-K385 WeakPolarHBondContact O-CB 3.4Å; Q381-K385 PolarHBondContact O-N 3.33Å
382	E	97.9	Very high	96.8	Very high	83 Å²	83	53.9 Å²	53.9	39%	0.388	26%	0.26	S	S	.	.	H	α-helix	trans	-70.3	-40.7	177.1	-63.2	173.8	148.3	0	0	110.7	R378 K379 P380 I384 K385 I386	R378-E382 WeakPolarHBondContact CA-OE2 3.43Å; R378-E382 HydrophobicContact CB-CB 4.16Å; K379-E382 HydrophobicContact CB-CG 4.19Å; K379-E382 PolarHBondContact N-OE2 3.09Å; K379-E382 WeakPolarHBondContact O-CA 3.22Å; K379-E382 WeakPolarHBondContact O-CB 3.48Å; K379-E382 PolarHBondContact O-N 3.35Å; P380-E382 VanDerWaalsContact C-N 3.31Å; P380-E382 PolarHBondContact O-N 3.47Å; E382-I384 PolarHBondContact O-N 3.1Å; E382-K385 PolarHBondContact O-N 3.35Å; E382-I386 WeakPolarHBondContact O-CB 3.34Å; E382-I386 WeakPolarHBondContact O-CD1 3.31Å; E382-I386 WeakPolarHBondContact O-CG1 3.37Å; E382-I386 PolarHBondContact O-N 2.73Å
383	M	98.5	Very high	96.5	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-58	-49.5	175.8	-63.2	-179.3	-172.4	0	0	111.4	I161 D246 V248 F249 R378 K379 P380 I386 W387	I161-M383 HydrophobicContact CG1-SD 3.9Å; D246-M383 VanDerWaalsContact O-CE 3.28Å; D246-M383 WeakPolarHBondContact O-CE 3.49Å; V248-M383 WeakPolarHBondContact O-CE 3.42Å; F249-M383 HydrophobicContact CD2-CB 4.43Å; R378-M383 HydrophobicContact CB-CE 4.47Å; R378-M383 HydrophobicContact CB-CG 3.91Å; R378-M383 WeakPolarHBondContact O-CE 3.49Å; K379-M383 WeakPolarHBondContact O-CG 3.39Å; K379-M383 PolarHBondContact O-N 3.3Å; P380-M383 PolarHBondContact O-N 3.39Å; M383-I386 PolarHBondContact O-N 3.43Å; M383-W387 VanDerWaalsContact O-CB 3.31Å; M383-W387 WeakPolarHBondContact O-CB 3.43Å; M383-W387 PolarHBondContact O-N 2.97Å
384	I	98.4	Very high	96.2	Very high	55 Å²	55	67 Å²	67	28%	0.282	33%	0.33	S	S	.	.	H	α-helix	trans	-61.7	-47.4	177.5	-63.9	168.8	0	0	0	110.1	A160 P380 E382 I386 W387 T388	A160-I384 HydrophobicContact CB-CD1 3.88Å; A160-I384 HydrophobicContact CB-CG1 3.97Å; P380-I384 PolarHBondContact O-N 3.05Å; E382-I384 PolarHBondContact O-N 3.1Å; I384-I386 PolarHBondContact O-N 2.75Å; I384-W387 PolarHBondContact O-N 2.72Å; I384-T388 WeakPolarHBondContact O-CB 3.41Å; I384-T388 PolarHBondContact O-N 3.21Å; I384-T388 PolarHBondContact O-OG1 3.43Å
385	K	97.4	Very high	95.8	Very high	128 Å²	128	69.6 Å²	69.6	56%	0.557	34%	0.344	S	S	*	.	H	α-helix	trans	-61	-45.9	-179.5	-177.9	179.6	179.5	-178.8	0	112.5	Q381 E382 R389	Q381-K385 VanDerWaalsContact O-CB 3.24Å; Q381-K385 WeakPolarHBondContact O-CB 3.4Å; Q381-K385 PolarHBondContact O-N 3.33Å; E382-K385 PolarHBondContact O-N 3.35Å; K385-R389 VanDerWaalsContact O-CG 3.3Å; K385-R389 WeakPolarHBondContact O-CG 3.35Å; K385-R389 PolarHBondContact O-N 3.25Å; K385-R389 VanDerWaalsContact O-N 3.15Å
386	I	97.4	Very high	95.3	Very high	14 Å²	14	76.6 Å²	76.6	7%	0.072	38%	0.382	C	S	.	.	H	α-helix	trans	-62.9	-47.4	178.1	-66.7	160.2	0	0	0	109.1	F249 I366 Y369 R378 E382 M383 I384 R389 L390	F249-I386 HydrophobicContact CB-CD1 4.49Å; F249-I386 HydrophobicContact CD1-CG2 3.92Å; F249-I386 HydrophobicContact CD2-CB 4.04Å; F249-I386 HydrophobicContact CD2-CD1 4.48Å; F249-I386 HydrophobicContact CD2-CG2 3.94Å; F249-I386 HydrophobicContact CE1-CG2 3.59Å; F249-I386 HydrophobicContact CE2-CB 3.93Å; F249-I386 HydrophobicContact CE2-CG2 3.61Å; F249-I386 HydrophobicContact CG-CB 4.47Å; F249-I386 HydrophobicContact CG-CD1 4.31Å; F249-I386 HydrophobicContact CG-CG2 4.1Å; F249-I386 HydrophobicContact CZ-CB 4.28Å; F249-I386 HydrophobicContact CZ-CG2 3.45Å; F249-I386 VanDerWaalsContact CZ-CG2 3.45Å; I366-I386 HydrophobicContact CD1-CG2 3.99Å; Y369-I386 HydrophobicContact CD1-CD1 4.13Å; Y369-I386 HydrophobicContact CD1-CG1 4.46Å; Y369-I386 HydrophobicContact CD1-CG2 3.69Å; Y369-I386 HydrophobicContact CE1-CD1 3.53Å; Y369-I386 HydrophobicContact CE1-CG1 4.15Å; Y369-I386 HydrophobicContact CE1-CG2 4.21Å; Y369-I386 HydrophobicContact CG-CG2 3.89Å; R378-I386 HydrophobicContact CG-CD1 3.99Å; E382-I386 WeakPolarHBondContact O-CB 3.34Å; E382-I386 WeakPolarHBondContact O-CD1 3.31Å; E382-I386 WeakPolarHBondContact O-CG1 3.37Å; E382-I386 PolarHBondContact O-N 2.73Å; M383-I386 PolarHBondContact O-N 3.43Å; I384-I386 PolarHBondContact O-N 2.75Å; I386-R389 PolarHBondContact O-N 3.48Å; I386-L390 HydrophobicContact CG2-CD1 4.03Å; I386-L390 HydrophobicContact CG2-CG 4.45Å; I386-L390 PolarHBondContact O-N 2.04Å
387	W	97.5	Very high	94.9	Very high	30 Å²	30	79.3 Å²	79.3	11%	0.114	41%	0.405	C	S	.	.	H	α-helix	trans	-57.3	-53.4	178.7	-174.3	-104.7	0	0	0	112	W165 F249 H253 M383 I384 R389 L390 Q391	W165-W387 HydrophobicContact CB-CE3 3.82Å; W165-W387 HydrophobicContact CB-CZ3 3.92Å; F249-W387 HydrophobicContact CE2-CB 4.14Å; F249-W387 HydrophobicContact CE2-CE3 4.2Å; F249-W387 HydrophobicContact CZ-CE3 4.16Å; H253-W387 AromaticContact CD2-CH2 3.51Å; H253-W387 AromaticContact CD2-CZ3 3.99Å; H253-W387 AromaticContact NE2-CH2 3.31Å; H253-W387 VanDerWaalsContact NE2-CH2 3.31Å; H253-W387 WeakPolarHBondContact NE2-CH2 3.4Å; H253-W387 AromaticContact NE2-CZ2 3.66Å; M383-W387 VanDerWaalsContact O-CB 3.31Å; M383-W387 WeakPolarHBondContact O-CB 3.43Å; M383-W387 PolarHBondContact O-N 2.97Å; I384-W387 PolarHBondContact O-N 2.72Å; W387-R389 VanDerWaalsContact C-N 3.26Å; W387-R389 PolarHBondContact O-N 3.27Å; W387-L390 PolarHBondContact O-N 3.38Å; W387-L390 VanDerWaalsContact O-N 3.07Å; W387-Q391 WeakPolarHBondContact O-CG 3.01Å; W387-Q391 PolarHBondContact O-N 3.16Å; W387-Q391 VanDerWaalsContact O-N 3.16Å
388	T	96.6	Very high	94.8	Very high	90 Å²	90	80.3 Å²	80.3	55%	0.552	41%	0.405	S	S	*	.	H	α-helix	trans	-56.6	-39.9	179.9	-59.4	0	0	0	0	112.3	I384 Q391	I384-T388 WeakPolarHBondContact O-CB 3.41Å; I384-T388 PolarHBondContact O-N 3.21Å; I384-T388 PolarHBondContact O-OG1 3.43Å; T388-Q391 PolarHBondContact O-N 2.75Å
389	R	96.1	Very high	94.7	Very high	121 Å²	121	83.8 Å²	83.8	46%	0.457	42%	0.423	S	S	.	.	H	α-helix	trans	-73.1	-31.4	178.6	-66.4	-179	101	-169.1	6.8	113.2	I366 K385 I386 W387 Q391 D392	I366-R389 HydrophobicContact CB-CB 4.48Å; I366-R389 HydrophobicContact CD1-CB 3.69Å; I366-R389 HydrophobicContact CG1-CB 3.71Å; K385-R389 VanDerWaalsContact O-CG 3.3Å; K385-R389 WeakPolarHBondContact O-CG 3.35Å; K385-R389 PolarHBondContact O-N 3.25Å; K385-R389 VanDerWaalsContact O-N 3.15Å; I386-R389 PolarHBondContact O-N 3.48Å; W387-R389 VanDerWaalsContact C-N 3.26Å; W387-R389 PolarHBondContact O-N 3.27Å; R389-Q391 PolarHBondContact O-N 2.93Å; R389-D392 WeakPolarHBondContact O-CB 3.26Å; R389-D392 PolarHBondContact O-N 3.36Å
390	L	95.2	Very high	94.5	Very high	29 Å²	29	80.8 Å²	80.8	15%	0.152	41%	0.414	C	S	.	.	H	α-helix	trans	-69.4	-23.9	173.9	-77.9	173.7	0	0	0	112.9	F249 I366 T370 I386 W387 D392 L395	F249-L390 HydrophobicContact CE1-CD1 3.88Å; F249-L390 HydrophobicContact CZ-CD1 3.58Å; I366-L390 HydrophobicContact CD1-CD2 4.12Å; I366-L390 HydrophobicContact CD1-CG 3.87Å; I366-L390 HydrophobicContact CG1-CD2 4.01Å; I366-L390 HydrophobicContact CG1-CG 4.19Å; T370-L390 HydrophobicContact CG2-CD2 3.66Å; I386-L390 HydrophobicContact CG2-CD1 4.03Å; I386-L390 HydrophobicContact CG2-CG 4.45Å; I386-L390 PolarHBondContact O-N 2.04Å; W387-L390 PolarHBondContact O-N 3.38Å; W387-L390 VanDerWaalsContact O-N 3.07Å; L390-D392 VanDerWaalsContact C-N 3.33Å; L390-L395 HydrophobicContact CD2-CD2 4.3Å
391	Q	91.5	Very high	94.2	Very high	86 Å²	86	84.7 Å²	84.7	40%	0.402	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-3.1	177.4	-58.6	-60.5	-44	0	0	113.3	H253 W387 T388 R389 P393	H253-Q391 PolarHBondContact CD2-NE2 3.42Å; H253-Q391 PolarHBondContact NE2-NE2 3.31Å; W387-Q391 WeakPolarHBondContact O-CG 3.01Å; W387-Q391 PolarHBondContact O-N 3.16Å; W387-Q391 VanDerWaalsContact O-N 3.16Å; T388-Q391 PolarHBondContact O-N 2.75Å; R389-Q391 PolarHBondContact O-N 2.93Å; Q391-P393 VanDerWaalsContact O-CD 3.29Å; Q391-P393 WeakPolarHBondContact O-CD 3.34Å
392	D	93	Very high	93.9	Very high	77 Å²	77	81.6 Å²	81.6	41%	0.412	42%	0.42	S	S	.	.			trans	-67.3	115.5	179.9	-174.6	-11	0	0	0	109.7	R389 L390 H394 L395	R389-D392 WeakPolarHBondContact O-CB 3.26Å; R389-D392 PolarHBondContact O-N 3.36Å; L390-D392 VanDerWaalsContact C-N 3.33Å; D392-H394 PolarHBondContact O-N 3.09Å; D392-H394 VanDerWaalsContact O-N 3.14Å; D392-H394 WeakPolarHBondContact OD1-CB 3.42Å; D392-H394 IonicContact OD1-CD2 3.71Å; D392-H394 IonicContact OD1-CG 3.89Å; D392-H394 PolarHBondContact OD1-N 3.17Å; D392-L395 HydrophobicContact CB-CB 4.28Å; D392-L395 WeakPolarHBondContact O-CB 3.19Å; D392-L395 PolarHBondContact O-N 3.21Å
393	P	88.6	Confident	93.7	Very high	119 Å²	119	81.5 Å²	81.5	77%	0.773	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-15.8	179.9	28.7	-35.9	0	0	0	112.9	Q391	Q391-P393 VanDerWaalsContact O-CD 3.29Å; Q391-P393 WeakPolarHBondContact O-CD 3.34Å
394	H	90.3	Very high	93.3	Very high	163 Å²	163	87.3 Å²	87.3	76%	0.755	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	3.2	174.5	-58	-63.2	0	0	0	113	D392 N396	D392-H394 PolarHBondContact O-N 3.09Å; D392-H394 VanDerWaalsContact O-N 3.14Å; D392-H394 WeakPolarHBondContact OD1-CB 3.42Å; D392-H394 IonicContact OD1-CD2 3.71Å; D392-H394 IonicContact OD1-CG 3.89Å; D392-H394 PolarHBondContact OD1-N 3.17Å; H394-N396 PolarHBondContact O-N 2.65Å
395	L	90.1	Very high	92.9	Very high	55 Å²	55	89.8 Å²	89.8	29%	0.288	47%	0.465	S	S	.	.			trans	-62.9	121.4	175.5	178.7	59	0	0	0	110.3	I366 T370 L390 D392	I366-L395 HydrophobicContact CG1-CD2 4.31Å; I366-L395 HydrophobicContact CG2-CD1 3.35Å; I366-L395 HydrophobicContact CG2-CD2 4.31Å; I366-L395 HydrophobicContact CG2-CG 4.49Å; T370-L395 HydrophobicContact CG2-CD2 4.29Å; L390-L395 HydrophobicContact CD2-CD2 4.3Å; D392-L395 HydrophobicContact CB-CB 4.28Å; D392-L395 WeakPolarHBondContact O-CB 3.19Å; D392-L395 PolarHBondContact O-N 3.21Å
396	N	87.3	Confident	92.6	Very high	147 Å²	147	86.6 Å²	86.6	79%	0.786	46%	0.458	S	S	*	.			trans	-116.2	116.4	175.8	-167.7	9.5	0	0	0	110.5	H394	H394-N396 PolarHBondContact O-N 2.65Å
397	C	87.3	Confident	92.1	Very high	108 Å²	108	93.2 Å²	93.2	73%	0.73	49%	0.493	S	S	*	.			trans	-136.5	0	177.9	-58.1	0	0	0	0	107.1	C367	C367-C397 WeakPolarHBondContact CA-SG 3.44Å; C367-C397 HydrophobicContact CB-CB 3.59Å; C367-C397 WeakPolarHBondContact CB-SG 3.15Å; C367-C397 WeakPolarHBondContact SG-CA 3.35Å; C367-C397 WeakPolarHBondContact SG-CB 3.17Å; C367-C397 CovalentContact SG-SG 2.03Å; C367-C397 PolarHBondContact SG-SG 2.89Å

Retrieved 397 of 397 residues in 808.4 ms (Link to these results)

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