A0A077ZM91_TRITR Loading...

Phenylalanine--tRNA ligase alpha subunit

AlphaFold DB (P08312), UniProt , Accession A0A077ZM91, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 327 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	57.1	Low	86.3	Confident	200 Å²	200	66.5 Å²	66.5	99%	0.985	39%	0.39	S	S	*	.				0	-38	0	-73.8	-157.1	-92	0	0	113.5	H3 L4	M1-H3 PolarHBondContact O-N 3.27Å; M1-L4 PolarHBondContact O-N 3.47Å
2	S	70	Confident	87.1	Confident	86 Å²	86	68.4 Å²	68.4	60%	0.601	39%	0.39	S	S	*	.	H	α-helix	trans	-56.2	-43.8	178.8	57.2	0	0	0	0	114.2	L4 A5 E6	S2-L4 VanDerWaalsContact C-N 3.33Å; S2-L4 PolarHBondContact O-N 2.87Å; S2-A5 PolarHBondContact O-N 3.49Å; S2-E6 WeakPolarHBondContact O-CG 3.4Å; S2-E6 PolarHBondContact O-N 3.19Å
3	H	85.9	Confident	87.7	Confident	96 Å²	96	66.8 Å²	66.8	44%	0.444	39%	0.39	S	S	.	.	H	α-helix	trans	-61.6	-35.9	-176.1	-172.2	56.7	0	0	0	114.2	M1 E6 L7	M1-H3 PolarHBondContact O-N 3.27Å; H3-E6 IonicContact ND1-OE2 3.59Å; H3-E6 PolarHBondContact O-N 3.29Å; H3-L7 WeakPolarHBondContact O-CG 3.45Å; H3-L7 PolarHBondContact O-N 2.87Å
4	L	87	Confident	88.3	Confident	22 Å²	22	63.4 Å²	63.4	12%	0.115	37%	0.373	C	S	.	.	H	α-helix	trans	-72.6	-37.7	178.7	-169.4	72.2	0	0	0	111.5	M1 S2 E6 L7 V8 L38 Q41 V59 I60 A63	M1-L4 PolarHBondContact O-N 3.47Å; S2-L4 VanDerWaalsContact C-N 3.33Å; S2-L4 PolarHBondContact O-N 2.87Å; L4-E6 VanDerWaalsContact C-N 3.32Å; L4-L7 PolarHBondContact O-N 3.11Å; L4-V8 WeakPolarHBondContact O-CG2 3.45Å; L4-V8 PolarHBondContact O-N 3.02Å; L4-L38 HydrophobicContact CD1-CD2 3.69Å; L4-Q41 HydrophobicContact CD1-CG 4.29Å; L4-V59 HydrophobicContact CD2-CG1 3.49Å; L4-V59 VanDerWaalsContact CD2-CG1 3.49Å; L4-V59 WeakPolarHBondContact CD2-O 3.26Å; L4-I60 HydrophobicContact CD2-CG1 4.41Å; L4-A63 HydrophobicContact CD1-CB 3.83Å; L4-A63 HydrophobicContact CD2-CB 3.63Å; L4-A63 HydrophobicContact CG-CB 3.69Å
5	A	88.9	Confident	88.8	Confident	65 Å²	65	59.5 Å²	59.5	54%	0.537	35%	0.35	S	S	.	.	H	α-helix	trans	-63.8	-39.2	174.5	0	0	0	0	0	111.4	S2 V8 A9	S2-A5 PolarHBondContact O-N 3.49Å; A5-V8 PolarHBondContact O-N 3.47Å; A5-A9 WeakPolarHBondContact O-CB 3.37Å; A5-A9 PolarHBondContact O-N 3.03Å
6	E	91.7	Very high	89.2	Confident	112 Å²	112	60.9 Å²	60.9	52%	0.523	36%	0.364	S	S	.	.	H	α-helix	trans	-61.8	-45	172.1	-71.1	164.6	-168	0	0	111.8	S2 H3 L4 V8 A9 S10	S2-E6 WeakPolarHBondContact O-CG 3.4Å; S2-E6 PolarHBondContact O-N 3.19Å; H3-E6 IonicContact ND1-OE2 3.59Å; H3-E6 PolarHBondContact O-N 3.29Å; L4-E6 VanDerWaalsContact C-N 3.32Å; E6-V8 PolarHBondContact O-N 3.37Å; E6-A9 PolarHBondContact O-N 3.23Å; E6-S10 WeakPolarHBondContact O-CB 3.45Å; E6-S10 PolarHBondContact O-N 3.01Å; E6-S10 PolarHBondContact O-OG 3.25Å; E6-S10 VanDerWaalsContact O-OG 3.11Å
7	L	91.9	Very high	89.6	Confident	19 Å²	19	66.8 Å²	66.8	10%	0.099	39%	0.387	C	S	.	.	H	α-helix	trans	-61.9	-41.8	176.5	-76.4	174.9	0	0	0	112.5	H3 L4 S10 A11 H37 L38 Q41	H3-L7 WeakPolarHBondContact O-CG 3.45Å; H3-L7 PolarHBondContact O-N 2.87Å; L4-L7 PolarHBondContact O-N 3.11Å; L7-S10 PolarHBondContact O-N 3.45Å; L7-A11 VanDerWaalsContact O-CB 3.28Å; L7-A11 WeakPolarHBondContact O-CB 3.43Å; L7-A11 PolarHBondContact O-N 3.39Å; L7-H37 HydrophobicContact CD1-CB 4.43Å; L7-H37 HydrophobicContact CD2-CB 3.83Å; L7-L38 HydrophobicContact CB-CD2 4.34Å; L7-Q41 HydrophobicContact CD1-CG 4.03Å
8	V	93.4	Very high	89.9	Confident	12 Å²	12	63.3 Å²	63.3	7%	0.073	37%	0.367	C	S	.	.	H	α-helix	trans	-65.7	-40.9	176	172.9	0	0	0	0	111	L4 A5 E6 A11 K12 A63 Q66 V67	L4-V8 WeakPolarHBondContact O-CG2 3.45Å; L4-V8 PolarHBondContact O-N 3.02Å; A5-V8 PolarHBondContact O-N 3.47Å; E6-V8 PolarHBondContact O-N 3.37Å; V8-A11 PolarHBondContact O-N 3.24Å; V8-K12 HydrophobicContact CG1-CD 4.09Å; V8-K12 HydrophobicContact CG1-CG 4.49Å; V8-K12 WeakPolarHBondContact O-CB 3.48Å; V8-K12 WeakPolarHBondContact O-CG 3.48Å; V8-K12 PolarHBondContact O-N 3.5Å; V8-A63 HydrophobicContact CG2-CB 3.49Å; V8-A63 VanDerWaalsContact CG2-CB 3.49Å; V8-Q66 HydrophobicContact CG1-CB 4.34Å; V8-V67 HydrophobicContact CG1-CG2 4.46Å; V8-V67 HydrophobicContact CG2-CG2 4.4Å
9	A	94	Very high	90	Very high	58 Å²	58	64.8 Å²	64.8	48%	0.479	38%	0.381	S	S	.	.	H	α-helix	trans	-63.6	-45.2	176.4	0	0	0	0	0	111.7	A5 E6 K12 A13	A5-A9 WeakPolarHBondContact O-CB 3.37Å; A5-A9 PolarHBondContact O-N 3.03Å; E6-A9 PolarHBondContact O-N 3.23Å; A9-K12 PolarHBondContact O-N 3.5Å; A9-A13 WeakPolarHBondContact O-CB 3.43Å; A9-A13 PolarHBondContact O-N 2.92Å
10	S	94.7	Very high	90.1	Very high	61 Å²	61	65.4 Å²	65.4	43%	0.427	38%	0.383	S	S	.	.	H	α-helix	trans	-63.4	-41.9	175.4	-64.2	0	0	0	0	112.2	E6 L7 A13 A14 Y31	E6-S10 WeakPolarHBondContact O-CB 3.45Å; E6-S10 PolarHBondContact O-N 3.01Å; E6-S10 PolarHBondContact O-OG 3.25Å; E6-S10 VanDerWaalsContact O-OG 3.11Å; L7-S10 PolarHBondContact O-N 3.45Å; S10-A13 PolarHBondContact O-N 3.4Å; S10-A14 WeakPolarHBondContact O-CB 3.33Å; S10-A14 PolarHBondContact O-N 3.44Å; S10-Y31 PolarHBondContact O-OH 2.77Å
11	A	94.5	Very high	90.3	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-60.7	-48.3	174.8	0	0	0	0	0	111.3	L7 V8 A13 A14 I15 Y31 V67	L7-A11 VanDerWaalsContact O-CB 3.28Å; L7-A11 WeakPolarHBondContact O-CB 3.43Å; L7-A11 PolarHBondContact O-N 3.39Å; V8-A11 PolarHBondContact O-N 3.24Å; A11-A13 VanDerWaalsContact C-N 3.3Å; A11-A13 PolarHBondContact O-N 3.29Å; A11-A14 PolarHBondContact O-N 3.42Å; A11-I15 WeakPolarHBondContact O-CB 3.44Å; A11-I15 WeakPolarHBondContact O-CD1 3.43Å; A11-I15 WeakPolarHBondContact O-CG1 3.45Å; A11-I15 PolarHBondContact O-N 2.96Å; A11-Y31 HydrophobicContact CB-CD1 3.49Å; A11-Y31 VanDerWaalsContact CB-CD1 3.49Å; A11-Y31 HydrophobicContact CB-CD2 4.24Å; A11-Y31 HydrophobicContact CB-CE1 3.62Å; A11-Y31 HydrophobicContact CB-CE2 4.38Å; A11-Y31 HydrophobicContact CB-CG 3.81Å; A11-V67 HydrophobicContact CB-CB 4.43Å; A11-V67 HydrophobicContact CB-CG1 3.98Å; A11-V67 HydrophobicContact CB-CG2 3.51Å
12	K	95.6	Very high	92	Very high	90 Å²	90	58.8 Å²	58.8	39%	0.391	36%	0.361	S	S	.	.	H	α-helix	trans	-61.5	-38.1	177.3	-73.9	177.2	-176.7	173	0	111.8	V8 A9 S16 A70	V8-K12 HydrophobicContact CG1-CD 4.09Å; V8-K12 HydrophobicContact CG1-CG 4.49Å; V8-K12 WeakPolarHBondContact O-CB 3.48Å; V8-K12 WeakPolarHBondContact O-CG 3.48Å; V8-K12 PolarHBondContact O-N 3.5Å; A9-K12 PolarHBondContact O-N 3.5Å; K12-S16 WeakPolarHBondContact O-CB 3.45Å; K12-S16 PolarHBondContact O-N 3.03Å; K12-A70 HydrophobicContact CG-CB 4.29Å
13	A	95.6	Very high	93.2	Very high	47 Å²	47	56 Å²	56	39%	0.388	34%	0.343	S	S	.	.	H	α-helix	trans	-65	-46.3	174.2	0	0	0	0	0	112.2	A9 S10 A11 I15 S16 Q17	A9-A13 WeakPolarHBondContact O-CB 3.43Å; A9-A13 PolarHBondContact O-N 2.92Å; S10-A13 PolarHBondContact O-N 3.4Å; A11-A13 VanDerWaalsContact C-N 3.3Å; A11-A13 PolarHBondContact O-N 3.29Å; A13-I15 PolarHBondContact O-N 3.36Å; A13-S16 PolarHBondContact O-N 2.94Å; A13-Q17 WeakPolarHBondContact O-CG 3.4Å; A13-Q17 PolarHBondContact O-N 2.93Å
14	A	95.7	Very high	93.7	Very high	19 Å²	19	51.7 Å²	51.7	16%	0.157	32%	0.323	C	S	.	.	H	α-helix	trans	-63.5	-41.1	177.5	0	0	0	0	0	112.2	S10 A11 S16 Q17 A18 V27 Y31	S10-A14 WeakPolarHBondContact O-CB 3.33Å; S10-A14 PolarHBondContact O-N 3.44Å; A11-A14 PolarHBondContact O-N 3.42Å; A14-S16 VanDerWaalsContact C-N 3.34Å; A14-S16 PolarHBondContact O-N 3.28Å; A14-Q17 PolarHBondContact O-N 3.05Å; A14-A18 PolarHBondContact O-N 3.11Å; A14-A18 VanDerWaalsContact O-N 3.11Å; A14-V27 HydrophobicContact CB-CG1 3.79Å; A14-V27 HydrophobicContact CB-CG2 4.05Å; A14-Y31 HydrophobicContact CB-CE2 3.98Å
15	I	96.8	Very high	94	Very high	6 Å²	6	54 Å²	54	3%	0.031	34%	0.336	C	S	.	.	H	α-helix	trans	-58.6	-46.4	173.5	-70.6	165.1	0	0	0	110.4	A11 A13 Q17 A18 L24 V27 V67 A70 L71 R74	A11-I15 WeakPolarHBondContact O-CB 3.44Å; A11-I15 WeakPolarHBondContact O-CD1 3.43Å; A11-I15 WeakPolarHBondContact O-CG1 3.45Å; A11-I15 PolarHBondContact O-N 2.96Å; A13-I15 PolarHBondContact O-N 3.36Å; I15-Q17 VanDerWaalsContact C-N 3.28Å; I15-Q17 PolarHBondContact O-N 3.48Å; I15-A18 WeakPolarHBondContact O-CB 3.37Å; I15-A18 PolarHBondContact O-N 3.39Å; I15-L24 HydrophobicContact CB-CD1 4.41Å; I15-L24 HydrophobicContact CG1-CD1 4.42Å; I15-L24 HydrophobicContact CG2-CD1 3.97Å; I15-V27 HydrophobicContact CG1-CG1 3.75Å; I15-V67 HydrophobicContact CD1-CG1 4.14Å; I15-A70 HydrophobicContact CD1-CB 3.67Å; I15-A70 HydrophobicContact CG2-CB 4.48Å; I15-L71 HydrophobicContact CD1-CD2 4.04Å; I15-L71 HydrophobicContact CD1-CG 3.72Å; I15-L71 HydrophobicContact CG1-CD2 3.77Å; I15-L71 HydrophobicContact CG1-CG 4.05Å; I15-R74 HydrophobicContact CG2-CB 3.45Å; I15-R74 VanDerWaalsContact CG2-CB 3.45Å; I15-R74 HydrophobicContact CG2-CG 3.74Å; I15-R74 WeakPolarHBondContact O-CG 3.13Å; I15-R74 PolarHBondContact O-NE 3.33Å
16	S	94.8	Very high	94.3	Very high	82 Å²	82	56.2 Å²	56.2	57%	0.573	34%	0.339	S	S	*	.	H	α-helix	trans	-64	-33.2	179	-177.2	0	0	0	0	112.6	K12 A13 A14 R74	K12-S16 WeakPolarHBondContact O-CB 3.45Å; K12-S16 PolarHBondContact O-N 3.03Å; A13-S16 PolarHBondContact O-N 2.94Å; A14-S16 VanDerWaalsContact C-N 3.34Å; A14-S16 PolarHBondContact O-N 3.28Å; S16-R74 PolarHBondContact O-NH2 3.42Å
17	Q	95.2	Very high	94.5	Very high	161 Å²	161	51.6 Å²	51.6	75%	0.752	32%	0.318	S	S	*	.	H	α-helix	trans	-79.8	-15.1	178.3	-70.8	177	9.5	0	0	114.3	A13 A14 I15 S19	A13-Q17 WeakPolarHBondContact O-CG 3.4Å; A13-Q17 PolarHBondContact O-N 2.93Å; A14-Q17 PolarHBondContact O-N 3.05Å; I15-Q17 VanDerWaalsContact C-N 3.28Å; I15-Q17 PolarHBondContact O-N 3.48Å; Q17-S19 PolarHBondContact O-N 3.26Å
18	A	95.3	Very high	94.6	Very high	4 Å²	4	55.8 Å²	55.8	3%	0.033	33%	0.333	C	S	.	.			trans	-62.9	121.4	177	0	0	0	0	0	111	A14 I15 A23 L24 R74	A14-A18 PolarHBondContact O-N 3.11Å; A14-A18 VanDerWaalsContact O-N 3.11Å; I15-A18 WeakPolarHBondContact O-CB 3.37Å; I15-A18 PolarHBondContact O-N 3.39Å; A18-A23 HydrophobicContact CB-CB 4.1Å; A18-L24 HydrophobicContact CB-CB 3.99Å; A18-L24 HydrophobicContact CB-CD1 3.94Å; A18-R74 PolarHBondContact O-NH2 3.41Å
19	S	92.4	Very high	94.7	Very high	91 Å²	91	58.9 Å²	58.9	64%	0.636	35%	0.351	S	S	*	.			trans	-87.1	-20.6	-175.3	52.6	0	0	0	0	114.2	Q17	Q17-S19 PolarHBondContact O-N 3.26Å
20	D	92.3	Very high	94.7	Very high	77 Å²	77	60.5 Å²	60.5	41%	0.412	35%	0.349	S	S	.	.	S	Bend	trans	-151.9	173.1	-179.5	60.2	52.7	0	0	0	110.8	A22 A23 L24	D20-A22 PolarHBondContact O-N 3.23Å; D20-A22 WeakPolarHBondContact OD1-CA 3.28Å; D20-A22 WeakPolarHBondContact OD1-CB 3.34Å; D20-A22 PolarHBondContact OD1-N 2.86Å; D20-A23 PolarHBondContact O-N 3.47Å; D20-A23 PolarHBondContact OD1-N 2.87Å; D20-L24 WeakPolarHBondContact O-CB 3.4Å; D20-L24 PolarHBondContact O-N 3.31Å
21	V	93.4	Very high	94.7	Very high	62 Å²	62	58.4 Å²	58.4	38%	0.376	33%	0.332	S	S	.	.	H	α-helix	trans	-63.1	-29.7	-177.4	-179.9	0	0	0	0	111.8	D25 L78 E79	V21-D25 PolarHBondContact O-N 2.96Å; V21-L78 HydrophobicContact CG2-CB 4.3Å; V21-E79 HydrophobicContact CG2-CG 4.14Å
22	A	94	Very high	94.6	Very high	65 Å²	65	60.1 Å²	60.1	54%	0.537	34%	0.341	S	S	.	.	H	α-helix	trans	-73.7	-42.6	178.4	0	0	0	0	0	111.4	D20 L24 D25 N26	D20-A22 PolarHBondContact O-N 3.23Å; D20-A22 WeakPolarHBondContact OD1-CA 3.28Å; D20-A22 WeakPolarHBondContact OD1-CB 3.34Å; D20-A22 PolarHBondContact OD1-N 2.86Å; A22-L24 VanDerWaalsContact C-N 3.29Å; A22-L24 PolarHBondContact O-N 3.3Å; A22-D25 PolarHBondContact O-N 2.74Å; A22-N26 PolarHBondContact O-N 2.93Å; A22-N26 VanDerWaalsContact O-N 3.09Å; A22-N26 PolarHBondContact O-ND2 3.2Å
23	A	94.7	Very high	94.4	Very high	26 Å²	26	56.5 Å²	56.5	22%	0.215	33%	0.329	C	S	.	.	H	α-helix	trans	-60.8	-40.4	172	0	0	0	0	0	111.2	A18 D20 D25 N26 V27	A18-A23 HydrophobicContact CB-CB 4.1Å; D20-A23 PolarHBondContact O-N 3.47Å; D20-A23 PolarHBondContact OD1-N 2.87Å; A23-D25 VanDerWaalsContact C-N 3.34Å; A23-D25 PolarHBondContact O-N 2.97Å; A23-N26 WeakPolarHBondContact O-CB 3.38Å; A23-N26 PolarHBondContact O-N 3.46Å; A23-V27 WeakPolarHBondContact O-CG2 3.43Å; A23-V27 PolarHBondContact O-N 3.44Å
24	L	95.7	Very high	94	Very high	7 Å²	7	63.9 Å²	63.9	4%	0.037	35%	0.353	C	S	.	.	H	α-helix	trans	-65.5	-36.9	176.3	-169.7	67.3	0	0	0	112.2	I15 A18 D20 A22 N26 V27 R28 L71 R74 K75 L78	I15-L24 HydrophobicContact CB-CD1 4.41Å; I15-L24 HydrophobicContact CG1-CD1 4.42Å; I15-L24 HydrophobicContact CG2-CD1 3.97Å; A18-L24 HydrophobicContact CB-CB 3.99Å; A18-L24 HydrophobicContact CB-CD1 3.94Å; D20-L24 WeakPolarHBondContact O-CB 3.4Å; D20-L24 PolarHBondContact O-N 3.31Å; A22-L24 VanDerWaalsContact C-N 3.29Å; A22-L24 PolarHBondContact O-N 3.3Å; L24-N26 VanDerWaalsContact C-N 3.35Å; L24-V27 PolarHBondContact O-N 3.28Å; L24-R28 PolarHBondContact O-N 3.4Å; L24-L71 HydrophobicContact CD1-CD2 3.67Å; L24-L71 HydrophobicContact CG-CD2 3.94Å; L24-R74 HydrophobicContact CD1-CB 4.05Å; L24-R74 HydrophobicContact CD1-CG 3.74Å; L24-R74 HydrophobicContact CD2-CB 4.2Å; L24-R74 HydrophobicContact CD2-CG 4.17Å; L24-K75 VanDerWaalsContact CD2-CA 3.45Å; L24-K75 HydrophobicContact CD2-CB 3.57Å; L24-K75 HydrophobicContact CD2-CG 4.27Å; L24-L78 HydrophobicContact CB-CD1 4.31Å; L24-L78 HydrophobicContact CD2-CD1 4.22Å
25	D	94.1	Very high	93.7	Very high	70 Å²	70	72 Å²	72	37%	0.374	38%	0.384	S	S	.	.	H	α-helix	trans	-65.8	-37.1	175	-164.9	57.1	0	0	0	112.1	V21 A22 A23 V27 R28 V29	V21-D25 PolarHBondContact O-N 2.96Å; A22-D25 PolarHBondContact O-N 2.74Å; A23-D25 VanDerWaalsContact C-N 3.34Å; A23-D25 PolarHBondContact O-N 2.97Å; D25-V27 VanDerWaalsContact C-N 3.33Å; D25-V27 PolarHBondContact O-N 3.48Å; D25-R28 WeakPolarHBondContact O-CB 3.5Å; D25-R28 PolarHBondContact O-N 3.5Å; D25-R28 IonicContact OD1-CZ 3.59Å; D25-R28 IonicContact OD1-NE 2.9Å; D25-R28 PolarHBondContact OD1-NE 3.04Å; D25-R28 IonicContact OD1-NH2 3.96Å; D25-R28 PolarHBondContact OD1-NH2 3.36Å; D25-R28 IonicContact OD2-NH2 3.8Å; D25-V29 WeakPolarHBondContact O-CG2 3.48Å; D25-V29 PolarHBondContact O-N 3.47Å
26	N	94.9	Very high	93.4	Very high	112 Å²	112	71.8 Å²	71.8	60%	0.599	38%	0.384	S	S	*	.	H	α-helix	trans	-59.1	-45	172.9	-68.2	-31.7	0	0	0	111.4	A22 A23 L24 R28 V29 E30	A22-N26 PolarHBondContact O-N 2.93Å; A22-N26 VanDerWaalsContact O-N 3.09Å; A22-N26 PolarHBondContact O-ND2 3.2Å; A23-N26 WeakPolarHBondContact O-CB 3.38Å; A23-N26 PolarHBondContact O-N 3.46Å; L24-N26 VanDerWaalsContact C-N 3.35Å; N26-R28 VanDerWaalsContact C-N 3.35Å; N26-R28 PolarHBondContact O-N 3.01Å; N26-V29 PolarHBondContact O-N 3.18Å; N26-E30 WeakPolarHBondContact O-CB 3.47Å; N26-E30 PolarHBondContact O-N 3.31Å
27	V	95.1	Very high	93.2	Very high	15 Å²	15	71.6 Å²	71.6	9%	0.091	37%	0.374	C	S	.	.	H	α-helix	trans	-62.5	-41.7	175.5	180	0	0	0	0	111	A14 I15 A23 L24 D25 V29 E30 Y31	A14-V27 HydrophobicContact CB-CG1 3.79Å; A14-V27 HydrophobicContact CB-CG2 4.05Å; I15-V27 HydrophobicContact CG1-CG1 3.75Å; A23-V27 WeakPolarHBondContact O-CG2 3.43Å; A23-V27 PolarHBondContact O-N 3.44Å; L24-V27 PolarHBondContact O-N 3.28Å; D25-V27 VanDerWaalsContact C-N 3.33Å; D25-V27 PolarHBondContact O-N 3.48Å; V27-V29 VanDerWaalsContact C-N 3.32Å; V27-V29 PolarHBondContact O-N 3.04Å; V27-E30 PolarHBondContact O-N 3.28Å; V27-Y31 HydrophobicContact CG1-CD2 3.78Å; V27-Y31 HydrophobicContact CG1-CE2 4.05Å; V27-Y31 WeakPolarHBondContact O-CD2 3.38Å; V27-Y31 PolarHBondContact O-N 3.02Å
28	R	95.4	Very high	93	Very high	107 Å²	107	64 Å²	64	40%	0.404	34%	0.338	S	S	.	.	H	α-helix	trans	-58	-45	174.4	-178.1	-172.9	69.6	92	3.5	111.6	L24 D25 N26 L32 G33 L71	L24-R28 PolarHBondContact O-N 3.4Å; D25-R28 WeakPolarHBondContact O-CB 3.5Å; D25-R28 PolarHBondContact O-N 3.5Å; D25-R28 IonicContact OD1-CZ 3.59Å; D25-R28 IonicContact OD1-NE 2.9Å; D25-R28 PolarHBondContact OD1-NE 3.04Å; D25-R28 IonicContact OD1-NH2 3.96Å; D25-R28 PolarHBondContact OD1-NH2 3.36Å; D25-R28 IonicContact OD2-NH2 3.8Å; N26-R28 VanDerWaalsContact C-N 3.35Å; N26-R28 PolarHBondContact O-N 3.01Å; R28-L32 CarbonylContact O-C 3.59Å; R28-L32 WeakPolarHBondContact O-CA 3.36Å; R28-L32 WeakPolarHBondContact O-CB 3.41Å; R28-L32 PolarHBondContact O-N 3.22Å; R28-G33 PolarHBondContact O-N 2.86Å; R28-L71 HydrophobicContact CB-CD1 3.94Å; R28-L71 HydrophobicContact CB-CD2 4.06Å; R28-L71 HydrophobicContact CG-CD1 3.94Å
29	V	94.5	Very high	92.7	Very high	76 Å²	76	65.5 Å²	65.5	46%	0.461	35%	0.347	S	S	.	.	H	α-helix	trans	-65.6	-41.3	179	173.2	0	0	0	0	111.3	D25 N26 V27 G33	D25-V29 WeakPolarHBondContact O-CG2 3.48Å; D25-V29 PolarHBondContact O-N 3.47Å; N26-V29 PolarHBondContact O-N 3.18Å; V27-V29 VanDerWaalsContact C-N 3.32Å; V27-V29 PolarHBondContact O-N 3.04Å; V29-G33 WeakPolarHBondContact O-CA 3.35Å; V29-G33 PolarHBondContact O-N 3.44Å
30	E	94.3	Very high	92.5	Very high	92 Å²	92	65.1 Å²	65.1	43%	0.43	34%	0.337	S	S	.	.	H	α-helix	trans	-64	-41	179.5	-174.1	-176.5	168.7	0	0	113	N26 V27 G36 H37	N26-E30 WeakPolarHBondContact O-CB 3.47Å; N26-E30 PolarHBondContact O-N 3.31Å; V27-E30 PolarHBondContact O-N 3.28Å; E30-G36 CarbonylContact O-C 3.51Å; E30-G36 WeakPolarHBondContact O-CA 3.39Å; E30-H37 PolarHBondContact O-N 3.09Å; E30-H37 IonicContact OE1-NE2 3.77Å
31	Y	93.8	Very high	92.3	Very high	18 Å²	18	63.6 Å²	63.6	7%	0.071	33%	0.328	C	S	.	.	H	α-helix	trans	-97	-39.2	-175.4	-72.7	-88.7	0	0	0	113.7	S10 A11 A14 V27 G36 H37 L38	S10-Y31 PolarHBondContact O-OH 2.77Å; A11-Y31 HydrophobicContact CB-CD1 3.49Å; A11-Y31 VanDerWaalsContact CB-CD1 3.49Å; A11-Y31 HydrophobicContact CB-CD2 4.24Å; A11-Y31 HydrophobicContact CB-CE1 3.62Å; A11-Y31 HydrophobicContact CB-CE2 4.38Å; A11-Y31 HydrophobicContact CB-CG 3.81Å; A14-Y31 HydrophobicContact CB-CE2 3.98Å; V27-Y31 HydrophobicContact CG1-CD2 3.78Å; V27-Y31 HydrophobicContact CG1-CE2 4.05Å; V27-Y31 WeakPolarHBondContact O-CD2 3.38Å; V27-Y31 PolarHBondContact O-N 3.02Å; Y31-G36 CarbonylContact O-C 3.58Å; Y31-H37 HydrophobicContact CD1-CB 4.34Å; Y31-H37 PolarHBondContact O-N 2.98Å; Y31-L38 WeakPolarHBondContact O-CB 3.35Å; Y31-L38 PolarHBondContact O-N 3.22Å
32	L	93	Very high	91.9	Very high	35 Å²	35	63.6 Å²	63.6	18%	0.183	32%	0.324	C	S	.	.	H	α-helix	trans	-113.2	-5.1	-173.6	-61.8	178.9	0	0	0	114.1	R28 L38 T39 K64 V67 Q68 L71	R28-L32 CarbonylContact O-C 3.59Å; R28-L32 WeakPolarHBondContact O-CA 3.36Å; R28-L32 WeakPolarHBondContact O-CB 3.41Å; R28-L32 PolarHBondContact O-N 3.22Å; L32-L38 HydrophobicContact CD2-CB 4.35Å; L32-L38 HydrophobicContact CD2-CD1 3.71Å; L32-T39 PolarHBondContact O-OG1 3.09Å; L32-K64 HydrophobicContact CD2-CB 4.21Å; L32-K64 HydrophobicContact CD2-CG 3.98Å; L32-V67 HydrophobicContact CD1-CG1 4.15Å; L32-V67 HydrophobicContact CD2-CG1 4.35Å; L32-V67 HydrophobicContact CG-CG1 4.12Å; L32-Q68 HydrophobicContact CD1-CB 4.21Å; L32-L71 HydrophobicContact CD1-CD1 3.53Å; L32-L71 HydrophobicContact CG-CD1 4.41Å
33	G	91.8	Very high	91.5	Very high	15 Å²	15	64 Å²	64	16%	0.155	32%	0.32	C	S	.	.	S	Bend	trans	-64.2	176	177.7	0	0	0	0	0	113.4	R28 V29 K35 G36 T39	R28-G33 PolarHBondContact O-N 2.86Å; V29-G33 WeakPolarHBondContact O-CA 3.35Å; V29-G33 PolarHBondContact O-N 3.44Å; G33-K35 PolarHBondContact O-N 3.44Å; G33-K35 VanDerWaalsContact O-N 3.16Å; G33-G36 PolarHBondContact O-N 3.35Å; G33-T39 WeakPolarHBondContact O-CB 3.38Å; G33-T39 PolarHBondContact O-OG1 3.38Å
34	K	87	Confident	91	Very high	202 Å²	202	65.2 Å²	65.2	88%	0.878	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-33	-179.3	-69.3	-175.6	179.3	179.8	0	113.5	T39	K34-T39 WeakPolarHBondContact O-CG2 2.95Å
35	K	89.3	Confident	90.4	Very high	188 Å²	188	66.1 Å²	66.1	82%	0.817	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.6	14.7	175.7	-60.8	-173.3	179	-178.3	0	112.4	G33	G33-K35 PolarHBondContact O-N 3.44Å; G33-K35 VanDerWaalsContact O-N 3.16Å
36	G	90.6	Very high	89.8	Confident	2 Å²	2	72.4 Å²	72.4	2%	0.021	35%	0.348	C	S	.	.	S	Bend	trans	-73.8	158.1	-174.5	0	0	0	0	0	112.6	E30 Y31 G33 L38 T39 L40	E30-G36 CarbonylContact O-C 3.51Å; E30-G36 WeakPolarHBondContact O-CA 3.39Å; Y31-G36 CarbonylContact O-C 3.58Å; G33-G36 PolarHBondContact O-N 3.35Å; G36-L38 VanDerWaalsContact C-N 3.31Å; G36-L38 PolarHBondContact O-N 3.41Å; G36-T39 PolarHBondContact O-N 3.09Å; G36-L40 WeakPolarHBondContact O-CG 3.2Å; G36-L40 PolarHBondContact O-N 3.23Å
37	H	91.5	Very high	89.2	Confident	79 Å²	79	75 Å²	75	37%	0.366	36%	0.357	S	S	.	.	H	α-helix	trans	-53.9	-43	-173.2	-67.9	-64.4	0	0	0	113.4	L7 E30 Y31 Q41	L7-H37 HydrophobicContact CD1-CB 4.43Å; L7-H37 HydrophobicContact CD2-CB 3.83Å; E30-H37 PolarHBondContact O-N 3.09Å; E30-H37 IonicContact OE1-NE2 3.77Å; Y31-H37 HydrophobicContact CD1-CB 4.34Å; Y31-H37 PolarHBondContact O-N 2.98Å; H37-Q41 WeakPolarHBondContact O-CG 3.46Å; H37-Q41 PolarHBondContact O-N 2.94Å
38	L	89.5	Confident	88.6	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-77.1	-26.9	179.5	-64.6	170.5	0	0	0	113	L4 L7 Y31 L32 G36 A63 K64 V67	L4-L38 HydrophobicContact CD1-CD2 3.69Å; L7-L38 HydrophobicContact CB-CD2 4.34Å; Y31-L38 WeakPolarHBondContact O-CB 3.35Å; Y31-L38 PolarHBondContact O-N 3.22Å; L32-L38 HydrophobicContact CD2-CB 4.35Å; L32-L38 HydrophobicContact CD2-CD1 3.71Å; G36-L38 VanDerWaalsContact C-N 3.31Å; G36-L38 PolarHBondContact O-N 3.41Å; L38-A63 HydrophobicContact CD2-CB 4.18Å; L38-K64 HydrophobicContact CB-CG 3.97Å; L38-K64 HydrophobicContact CD1-CG 4.26Å; L38-K64 WeakPolarHBondContact O-CE 3.21Å; L38-V67 HydrophobicContact CD1-CB 3.99Å; L38-V67 HydrophobicContact CD1-CG1 4.27Å; L38-V67 HydrophobicContact CD1-CG2 3.77Å
39	T	88.7	Confident	87.9	Confident	36 Å²	36	75 Å²	75	22%	0.221	37%	0.368	C	S	.	.	H	α-helix	trans	-71.9	-37.3	174.2	-59.2	0	0	0	0	110.9	L32 G33 K34 G36 Q41 M42	L32-T39 PolarHBondContact O-OG1 3.09Å; G33-T39 WeakPolarHBondContact O-CB 3.38Å; G33-T39 PolarHBondContact O-OG1 3.38Å; K34-T39 WeakPolarHBondContact O-CG2 2.95Å; G36-T39 PolarHBondContact O-N 3.09Å; T39-Q41 VanDerWaalsContact C-N 3.3Å; T39-Q41 PolarHBondContact O-N 3.21Å; T39-M42 WeakPolarHBondContact O-CB 3.4Å; T39-M42 PolarHBondContact O-N 3.02Å; T39-M42 VanDerWaalsContact O-N 3.09Å
40	L	89.5	Confident	87.3	Confident	83 Å²	83	75.9 Å²	75.9	44%	0.435	38%	0.375	S	S	.	.	H	α-helix	trans	-63.5	-35.2	174.3	-69.1	171.3	0	0	0	111.9	G36 M42 T43	G36-L40 WeakPolarHBondContact O-CG 3.2Å; G36-L40 PolarHBondContact O-N 3.23Å; L40-M42 PolarHBondContact O-N 3.26Å; L40-T43 WeakPolarHBondContact O-CB 3.42Å; L40-T43 PolarHBondContact O-N 2.94Å; L40-T43 PolarHBondContact O-OG1 2.79Å
41	Q	88.2	Confident	86.8	Confident	45 Å²	45	80.2 Å²	80.2	21%	0.21	40%	0.395	C	S	.	.	H	α-helix	trans	-61.1	-27.2	172.9	-62.8	-57.1	-38.8	0	0	113.2	L4 L7 H37 T39 T43 T44 I60	L4-Q41 HydrophobicContact CD1-CG 4.29Å; L7-Q41 HydrophobicContact CD1-CG 4.03Å; H37-Q41 WeakPolarHBondContact O-CG 3.46Å; H37-Q41 PolarHBondContact O-N 2.94Å; T39-Q41 VanDerWaalsContact C-N 3.3Å; T39-Q41 PolarHBondContact O-N 3.21Å; Q41-T43 PolarHBondContact O-N 2.92Å; Q41-T44 PolarHBondContact O-N 3.01Å; Q41-T44 PolarHBondContact O-OG1 2.94Å; Q41-I60 HydrophobicContact CB-CD1 4.18Å; Q41-I60 HydrophobicContact CB-CG1 4.35Å; Q41-I60 HydrophobicContact CB-CG2 4.33Å; Q41-I60 WeakPolarHBondContact O-CD1 3.39Å
42	M	85.3	Confident	86.3	Confident	62 Å²	62	84.7 Å²	84.7	31%	0.305	42%	0.417	S	S	.	.	H	α-helix	trans	-69.9	-24.2	173.7	-68.8	-68.3	-96.2	0	0	112.6	T39 L40 L45 I60 K64	T39-M42 WeakPolarHBondContact O-CB 3.4Å; T39-M42 PolarHBondContact O-N 3.02Å; T39-M42 VanDerWaalsContact O-N 3.09Å; L40-M42 PolarHBondContact O-N 3.26Å; M42-L45 HydrophobicContact CE-CD1 4.36Å; M42-L45 WeakPolarHBondContact O-CB 3.4Å; M42-L45 HydrophobicContact SD-CD1 3.63Å; M42-I60 HydrophobicContact CG-CG2 3.89Å; M42-I60 HydrophobicContact SD-CB 4.01Å; M42-I60 HydrophobicContact SD-CD1 4.31Å; M42-I60 HydrophobicContact SD-CG2 3.48Å; M42-I60 WeakPolarHBondContact SD-CG2 3.43Å; M42-K64 VanDerWaalsContact CG-NZ 3.28Å
43	T	84.3	Confident	86	Confident	74 Å²	74	88 Å²	88	45%	0.454	43%	0.427	S	S	.	.	H	α-helix	trans	-74	-29.2	179.2	63.9	0	0	0	0	112.2	L40 Q41 L45 R46	L40-T43 WeakPolarHBondContact O-CB 3.42Å; L40-T43 PolarHBondContact O-N 2.94Å; L40-T43 PolarHBondContact O-OG1 2.79Å; Q41-T43 PolarHBondContact O-N 2.92Å; T43-L45 PolarHBondContact O-N 3.25Å; T43-R46 WeakPolarHBondContact O-CB 3.35Å; T43-R46 PolarHBondContact O-N 3.16Å
44	T	84	Confident	85.7	Confident	52 Å²	52	91.6 Å²	91.6	32%	0.319	45%	0.447	S	S	.	.	H	α-helix	trans	-70	-20	176.7	65.5	0	0	0	0	112.6	Q41 R46 E47	Q41-T44 PolarHBondContact O-N 3.01Å; Q41-T44 PolarHBondContact O-OG1 2.94Å; T44-R46 PolarHBondContact O-N 2.94Å; T44-R46 VanDerWaalsContact O-N 3.09Å; T44-E47 WeakPolarHBondContact O-CB 3.41Å; T44-E47 PolarHBondContact O-N 2.61Å
45	L	82.8	Confident	85.7	Confident	26 Å²	26	85.2 Å²	85.2	14%	0.136	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-57.7	-24.6	172	-66.6	175.5	0	0	0	113.2	M42 T43 E47 L48 R53 A56 I60	M42-L45 HydrophobicContact CE-CD1 4.36Å; M42-L45 WeakPolarHBondContact O-CB 3.4Å; M42-L45 HydrophobicContact SD-CD1 3.63Å; T43-L45 PolarHBondContact O-N 3.25Å; L45-E47 PolarHBondContact O-N 3.05Å; L45-L48 HydrophobicContact CD2-CD1 4.07Å; L45-L48 PolarHBondContact O-N 2.97Å; L45-R53 WeakPolarHBondContact O-CG 3.38Å; L45-R53 PolarHBondContact O-NE 2.9Å; L45-R53 VanDerWaalsContact O-NE 3.16Å; L45-A56 HydrophobicContact CD2-CB 3.53Å; L45-I60 HydrophobicContact CD1-CD1 4.14Å; L45-I60 HydrophobicContact CD2-CD1 3.82Å; L45-I60 HydrophobicContact CG-CD1 3.9Å
46	R	83.2	Confident	85.5	Confident	202 Å²	202	77.6 Å²	77.6	76%	0.762	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-65.8	-26.8	176.8	-65.7	-178.2	177.2	-171.7	-1.1	112.3	T43 T44 R53	T43-R46 WeakPolarHBondContact O-CB 3.35Å; T43-R46 PolarHBondContact O-N 3.16Å; T44-R46 PolarHBondContact O-N 2.94Å; T44-R46 VanDerWaalsContact O-N 3.09Å; R46-R53 PolarHBondContact O-NH2 3.22Å
47	E	82.2	Confident	85.5	Confident	167 Å²	167	78 Å²	78	78%	0.78	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-86.4	-15.7	-176.5	-58.5	174.3	173	0	0	112.5	T44 L45	T44-E47 WeakPolarHBondContact O-CB 3.41Å; T44-E47 PolarHBondContact O-N 2.61Å; L45-E47 PolarHBondContact O-N 3.05Å
48	L	81.6	Confident	85.4	Confident	54 Å²	54	77 Å²	77	28%	0.283	41%	0.414	S	S	.	.	S	Bend	trans	-82.9	148.8	-180	-66	174.7	0	0	0	112.6	L45 R53 A56	L45-L48 HydrophobicContact CD2-CD1 4.07Å; L45-L48 PolarHBondContact O-N 2.97Å; L48-R53 HydrophobicContact CB-CG 4.17Å; L48-R53 PolarHBondContact O-NE 3.45Å; L48-R53 PolarHBondContact O-NH2 3.49Å; L48-A56 HydrophobicContact CD1-CB 3.58Å
49	P	81.5	Confident	85.4	Confident	68 Å²	68	79.8 Å²	79.8	44%	0.442	43%	0.431	S	S	.	.			trans	-54.8	145.2	170.5	-23.7	33.2	0	0	0	111.9	E51 E52 R53	P49-E51 PolarHBondContact O-N 3.46Å; P49-E52 PolarHBondContact O-N 2.95Å; P49-R53 WeakPolarHBondContact O-CG 3.34Å; P49-R53 PolarHBondContact O-N 2.92Å
50	P	81.8	Confident	85.5	Confident	93 Å²	93	78.7 Å²	78.7	60%	0.604	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-31.8	-177.2	-28	35.1	0	0	0	115	P54	P50-P54 WeakPolarHBondContact O-CD 3.36Å
51	E	82.9	Confident	85.6	Confident	183 Å²	183	78.6 Å²	78.6	86%	0.855	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-30.1	-179.2	-58.9	-170.2	-179.1	0	0	113.3	P49 P54	P49-E51 PolarHBondContact O-N 3.46Å; E51-P54 WeakPolarHBondContact O-CD 3.37Å
52	E	83.8	Confident	85.8	Confident	112 Å²	112	81.7 Å²	81.7	52%	0.523	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-19.6	-179.1	-66.4	-177.7	-163.7	0	0	112.9	P49 A55 A56	P49-E52 PolarHBondContact O-N 2.95Å; E52-A55 PolarHBondContact O-N 3.42Å; E52-A56 PolarHBondContact O-N 3.29Å; E52-A56 VanDerWaalsContact O-N 3.07Å
53	R	85.7	Confident	86.2	Confident	106 Å²	106	78.9 Å²	78.9	40%	0.4	43%	0.425	S	S	.	.	H	α-helix	trans	-55.3	-42.5	-178.3	-72.2	178.8	-174.5	168.5	-2.3	114.4	L45 R46 L48 P49 G57	L45-R53 WeakPolarHBondContact O-CG 3.38Å; L45-R53 PolarHBondContact O-NE 2.9Å; L45-R53 VanDerWaalsContact O-NE 3.16Å; R46-R53 PolarHBondContact O-NH2 3.22Å; L48-R53 HydrophobicContact CB-CG 4.17Å; L48-R53 PolarHBondContact O-NE 3.45Å; L48-R53 PolarHBondContact O-NH2 3.49Å; P49-R53 WeakPolarHBondContact O-CG 3.34Å; P49-R53 PolarHBondContact O-N 2.92Å; R53-G57 PolarHBondContact O-N 3.39Å
54	P	86.4	Confident	86.6	Confident	89 Å²	89	77.6 Å²	77.6	58%	0.578	41%	0.413	S	S	*	.	H	α-helix	trans	-64.4	-43.8	-179.7	-22.9	34.8	0	0	0	112.8	P50 E51 G57 A58	P50-P54 WeakPolarHBondContact O-CD 3.36Å; E51-P54 WeakPolarHBondContact O-CD 3.37Å; P54-G57 PolarHBondContact O-N 3.4Å; P54-A58 WeakPolarHBondContact O-CB 3.33Å; P54-A58 PolarHBondContact O-N 3.43Å
55	A	86.8	Confident	87.1	Confident	68 Å²	68	80.6 Å²	80.6	56%	0.562	42%	0.423	S	S	*	.	H	α-helix	trans	-66.7	-46.1	179.7	0	0	0	0	0	111.4	E52 G57 A58 V59	E52-A55 PolarHBondContact O-N 3.42Å; A55-G57 VanDerWaalsContact C-N 3.35Å; A55-G57 PolarHBondContact O-N 2.86Å; A55-A58 PolarHBondContact O-N 2.98Å; A55-V59 WeakPolarHBondContact O-CG2 3.38Å; A55-V59 PolarHBondContact O-N 3.48Å
56	A	86.3	Confident	87.7	Confident	28 Å²	28	82.4 Å²	82.4	23%	0.231	43%	0.431	C	S	.	.	H	α-helix	trans	-64.1	-39.5	176.1	0	0	0	0	0	112.2	L45 L48 E52 V59 I60	L45-A56 HydrophobicContact CD2-CB 3.53Å; L48-A56 HydrophobicContact CD1-CB 3.58Å; E52-A56 PolarHBondContact O-N 3.29Å; E52-A56 VanDerWaalsContact O-N 3.07Å; A56-V59 PolarHBondContact O-N 2.99Å; A56-I60 WeakPolarHBondContact O-CG1 3.45Å; A56-I60 PolarHBondContact O-N 3.4Å; A56-I60 VanDerWaalsContact O-N 3.08Å
57	G	88.9	Confident	88.2	Confident	10 Å²	10	72.8 Å²	72.8	10%	0.103	39%	0.394	C	S	.	.	H	α-helix	trans	-65	-39.8	177	0	0	0	0	0	113.2	R53 P54 A55 I60 N61	R53-G57 PolarHBondContact O-N 3.39Å; P54-G57 PolarHBondContact O-N 3.4Å; A55-G57 VanDerWaalsContact C-N 3.35Å; A55-G57 PolarHBondContact O-N 2.86Å; G57-I60 PolarHBondContact O-N 2.87Å; G57-N61 WeakPolarHBondContact O-CB 3.46Å; G57-N61 VanDerWaalsContact O-CG 3.29Å; G57-N61 PolarHBondContact O-N 2.85Å; G57-N61 PolarHBondContact O-ND2 3.38Å
58	A	89.9	Confident	88.8	Confident	59 Å²	59	68.3 Å²	68.3	49%	0.488	37%	0.373	S	S	.	.	H	α-helix	trans	-60.5	-46.3	175.2	0	0	0	0	0	111.5	P54 A55 I60 N61 E62	P54-A58 WeakPolarHBondContact O-CB 3.33Å; P54-A58 PolarHBondContact O-N 3.43Å; A55-A58 PolarHBondContact O-N 2.98Å; A58-I60 PolarHBondContact O-N 3.21Å; A58-N61 PolarHBondContact O-N 3.35Å; A58-E62 WeakPolarHBondContact O-CB 3.4Å; A58-E62 PolarHBondContact O-N 3.07Å
59	V	90.6	Very high	89.5	Confident	58 Å²	58	71 Å²	71	35%	0.352	38%	0.384	S	S	.	.	H	α-helix	trans	-64	-39.2	179.2	173.4	0	0	0	0	111.8	L4 A55 A56 A63	L4-V59 HydrophobicContact CD2-CG1 3.49Å; L4-V59 VanDerWaalsContact CD2-CG1 3.49Å; L4-V59 WeakPolarHBondContact CD2-O 3.26Å; A55-V59 WeakPolarHBondContact O-CG2 3.38Å; A55-V59 PolarHBondContact O-N 3.48Å; A56-V59 PolarHBondContact O-N 2.99Å; V59-A63 PolarHBondContact O-N 3.11Å; V59-A63 VanDerWaalsContact O-N 3.08Å
60	I	90.5	Very high	90.1	Very high	13 Å²	13	68.9 Å²	68.9	7%	0.067	37%	0.373	C	S	.	.	H	α-helix	trans	-68.8	-40	175.4	-63.5	163.8	0	0	0	111.7	L4 Q41 M42 L45 A56 G57 A58 A63 K64	L4-I60 HydrophobicContact CD2-CG1 4.41Å; Q41-I60 HydrophobicContact CB-CD1 4.18Å; Q41-I60 HydrophobicContact CB-CG1 4.35Å; Q41-I60 HydrophobicContact CB-CG2 4.33Å; Q41-I60 WeakPolarHBondContact O-CD1 3.39Å; M42-I60 HydrophobicContact CG-CG2 3.89Å; M42-I60 HydrophobicContact SD-CB 4.01Å; M42-I60 HydrophobicContact SD-CD1 4.31Å; M42-I60 HydrophobicContact SD-CG2 3.48Å; M42-I60 WeakPolarHBondContact SD-CG2 3.43Å; L45-I60 HydrophobicContact CD1-CD1 4.14Å; L45-I60 HydrophobicContact CD2-CD1 3.82Å; L45-I60 HydrophobicContact CG-CD1 3.9Å; A56-I60 WeakPolarHBondContact O-CG1 3.45Å; A56-I60 PolarHBondContact O-N 3.4Å; A56-I60 VanDerWaalsContact O-N 3.08Å; G57-I60 PolarHBondContact O-N 2.87Å; A58-I60 PolarHBondContact O-N 3.21Å; I60-A63 PolarHBondContact O-N 3.34Å; I60-K64 WeakPolarHBondContact O-CG 3.34Å; I60-K64 PolarHBondContact O-N 3.23Å
61	N	91.4	Very high	90.8	Very high	82 Å²	82	64.8 Å²	64.8	44%	0.439	35%	0.346	S	S	.	.	H	α-helix	trans	-65.4	-40.3	176.8	-75.2	-26.6	0	0	0	111.6	G57 A58 A63 K64 E65	G57-N61 WeakPolarHBondContact O-CB 3.46Å; G57-N61 VanDerWaalsContact O-CG 3.29Å; G57-N61 PolarHBondContact O-N 2.85Å; G57-N61 PolarHBondContact O-ND2 3.38Å; A58-N61 PolarHBondContact O-N 3.35Å; N61-A63 VanDerWaalsContact C-N 3.34Å; N61-A63 PolarHBondContact O-N 3.37Å; N61-K64 PolarHBondContact O-N 2.96Å; N61-E65 WeakPolarHBondContact O-CB 3.41Å; N61-E65 PolarHBondContact O-N 3.34Å
62	E	92.7	Very high	91.4	Very high	110 Å²	110	60.5 Å²	60.5	51%	0.514	33%	0.329	S	S	.	.	H	α-helix	trans	-59.6	-45.1	173.5	-170.5	-173.7	168.5	0	0	111	A58 K64 E65 Q66	A58-E62 WeakPolarHBondContact O-CB 3.4Å; A58-E62 PolarHBondContact O-N 3.07Å; E62-K64 PolarHBondContact O-N 3.47Å; E62-E65 PolarHBondContact O-N 3.08Å; E62-Q66 WeakPolarHBondContact O-CG 3.48Å; E62-Q66 PolarHBondContact O-N 3.48Å
63	A	92.4	Very high	92	Very high	3 Å²	3	57.6 Å²	57.6	3%	0.025	32%	0.324	C	S	.	.	H	α-helix	trans	-61.1	-42.1	175.1	0	0	0	0	0	112.9	L4 V8 L38 V59 I60 N61 Q66 V67	L4-A63 HydrophobicContact CD1-CB 3.83Å; L4-A63 HydrophobicContact CD2-CB 3.63Å; L4-A63 HydrophobicContact CG-CB 3.69Å; V8-A63 HydrophobicContact CG2-CB 3.49Å; V8-A63 VanDerWaalsContact CG2-CB 3.49Å; L38-A63 HydrophobicContact CD2-CB 4.18Å; V59-A63 PolarHBondContact O-N 3.11Å; V59-A63 VanDerWaalsContact O-N 3.08Å; I60-A63 PolarHBondContact O-N 3.34Å; N61-A63 VanDerWaalsContact C-N 3.34Å; N61-A63 PolarHBondContact O-N 3.37Å; A63-Q66 PolarHBondContact O-N 3.45Å; A63-V67 WeakPolarHBondContact O-CG2 3.5Å; A63-V67 PolarHBondContact O-N 3.45Å; A63-V67 VanDerWaalsContact O-N 3.11Å
64	K	93.2	Very high	92.5	Very high	47 Å²	47	55.4 Å²	55.4	20%	0.204	32%	0.316	C	S	.	.	H	α-helix	trans	-62.7	-42.5	174.5	-75.6	-179.6	173.8	-172.5	0	112	L32 L38 M42 I60 N61 E62 V67 Q68	L32-K64 HydrophobicContact CD2-CB 4.21Å; L32-K64 HydrophobicContact CD2-CG 3.98Å; L38-K64 HydrophobicContact CB-CG 3.97Å; L38-K64 HydrophobicContact CD1-CG 4.26Å; L38-K64 WeakPolarHBondContact O-CE 3.21Å; M42-K64 VanDerWaalsContact CG-NZ 3.28Å; I60-K64 WeakPolarHBondContact O-CG 3.34Å; I60-K64 PolarHBondContact O-N 3.23Å; N61-K64 PolarHBondContact O-N 2.96Å; E62-K64 PolarHBondContact O-N 3.47Å; K64-V67 PolarHBondContact O-N 3.39Å; K64-Q68 VanDerWaalsContact O-CB 3.3Å; K64-Q68 WeakPolarHBondContact O-CB 3.33Å; K64-Q68 PolarHBondContact O-N 3.44Å
65	E	94.4	Very high	93	Very high	115 Å²	115	55.6 Å²	55.6	54%	0.537	31%	0.308	S	S	.	.	H	α-helix	trans	-64.4	-45.1	178.3	-172.4	175.2	-180	0	0	111.1	N61 E62 V67 Q68 Q69	N61-E65 WeakPolarHBondContact O-CB 3.41Å; N61-E65 PolarHBondContact O-N 3.34Å; E62-E65 PolarHBondContact O-N 3.08Å; E65-V67 VanDerWaalsContact C-N 3.3Å; E65-V67 PolarHBondContact O-N 3.41Å; E65-Q68 PolarHBondContact O-N 2.87Å; E65-Q69 HydrophobicContact CG-CG 4.28Å; E65-Q69 WeakPolarHBondContact O-CB 3.42Å; E65-Q69 VanDerWaalsContact O-CG 3.27Å; E65-Q69 WeakPolarHBondContact O-CG 3.5Å; E65-Q69 PolarHBondContact O-N 3.33Å; E65-Q69 PolarHBondContact OE1-NE2 3.02Å; E65-Q69 VanDerWaalsContact OE1-NE2 3.12Å
66	Q	94.7	Very high	93.4	Very high	63 Å²	63	55 Å²	55	29%	0.294	30%	0.303	S	S	.	.	H	α-helix	trans	-58	-41.7	175.5	-72.8	-173.6	39.5	0	0	112.4	V8 E62 A63 A70	V8-Q66 HydrophobicContact CG1-CB 4.34Å; E62-Q66 WeakPolarHBondContact O-CG 3.48Å; E62-Q66 PolarHBondContact O-N 3.48Å; A63-Q66 PolarHBondContact O-N 3.45Å; Q66-A70 WeakPolarHBondContact O-CB 3.42Å; Q66-A70 PolarHBondContact O-N 3.08Å; Q66-A70 VanDerWaalsContact O-N 3.07Å
67	V	94.3	Very high	93.9	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-71.6	-39.9	177.4	172.1	0	0	0	0	111.5	V8 A11 I15 L32 L38 A63 K64 E65 A70 L71	V8-V67 HydrophobicContact CG1-CG2 4.46Å; V8-V67 HydrophobicContact CG2-CG2 4.4Å; A11-V67 HydrophobicContact CB-CB 4.43Å; A11-V67 HydrophobicContact CB-CG1 3.98Å; A11-V67 HydrophobicContact CB-CG2 3.51Å; I15-V67 HydrophobicContact CD1-CG1 4.14Å; L32-V67 HydrophobicContact CD1-CG1 4.15Å; L32-V67 HydrophobicContact CD2-CG1 4.35Å; L32-V67 HydrophobicContact CG-CG1 4.12Å; L38-V67 HydrophobicContact CD1-CB 3.99Å; L38-V67 HydrophobicContact CD1-CG1 4.27Å; L38-V67 HydrophobicContact CD1-CG2 3.77Å; A63-V67 WeakPolarHBondContact O-CG2 3.5Å; A63-V67 PolarHBondContact O-N 3.45Å; A63-V67 VanDerWaalsContact O-N 3.11Å; K64-V67 PolarHBondContact O-N 3.39Å; E65-V67 VanDerWaalsContact C-N 3.3Å; E65-V67 PolarHBondContact O-N 3.41Å; V67-A70 PolarHBondContact O-N 3.48Å; V67-L71 HydrophobicContact CG1-CD1 4.1Å; V67-L71 WeakPolarHBondContact O-CB 3.49Å; V67-L71 WeakPolarHBondContact O-CG 3.4Å; V67-L71 PolarHBondContact O-N 3.37Å
68	Q	94.8	Very high	94.2	Very high	73 Å²	73	59.4 Å²	59.4	34%	0.341	32%	0.317	S	S	.	.	H	α-helix	trans	-65.7	-40.5	176.8	-174.3	61.3	67.6	0	0	112.1	L32 K64 E65 L71 N72	L32-Q68 HydrophobicContact CD1-CB 4.21Å; K64-Q68 VanDerWaalsContact O-CB 3.3Å; K64-Q68 WeakPolarHBondContact O-CB 3.33Å; K64-Q68 PolarHBondContact O-N 3.44Å; E65-Q68 PolarHBondContact O-N 2.87Å; Q68-L71 PolarHBondContact O-N 3.16Å; Q68-N72 PolarHBondContact NE2-OD1 2.76Å; Q68-N72 WeakPolarHBondContact O-CB 3.47Å; Q68-N72 PolarHBondContact O-N 3.03Å; Q68-N72 PolarHBondContact O-ND2 3.07Å; Q68-N72 PolarHBondContact O-OD1 3.33Å
69	Q	95.8	Very high	94.4	Very high	110 Å²	110	61.2 Å²	61.2	51%	0.514	32%	0.315	S	S	.	.	H	α-helix	trans	-63.1	-45.2	174	-73.1	176.6	2.2	0	0	110.8	E65 L71 N72 A73	E65-Q69 HydrophobicContact CG-CG 4.28Å; E65-Q69 WeakPolarHBondContact O-CB 3.42Å; E65-Q69 VanDerWaalsContact O-CG 3.27Å; E65-Q69 WeakPolarHBondContact O-CG 3.5Å; E65-Q69 PolarHBondContact O-N 3.33Å; E65-Q69 PolarHBondContact OE1-NE2 3.02Å; E65-Q69 VanDerWaalsContact OE1-NE2 3.12Å; Q69-L71 PolarHBondContact O-N 2.91Å; Q69-N72 PolarHBondContact O-N 3.25Å; Q69-A73 WeakPolarHBondContact O-CB 3.34Å; Q69-A73 PolarHBondContact O-N 2.73Å
70	A	95.6	Very high	94.7	Very high	25 Å²	25	61.2 Å²	61.2	21%	0.207	32%	0.318	C	S	.	.	H	α-helix	trans	-62	-41	175.6	0	0	0	0	0	112.5	K12 I15 Q66 V67 R74	K12-A70 HydrophobicContact CG-CB 4.29Å; I15-A70 HydrophobicContact CD1-CB 3.67Å; I15-A70 HydrophobicContact CG2-CB 4.48Å; Q66-A70 WeakPolarHBondContact O-CB 3.42Å; Q66-A70 PolarHBondContact O-N 3.08Å; Q66-A70 VanDerWaalsContact O-N 3.07Å; V67-A70 PolarHBondContact O-N 3.48Å; A70-R74 WeakPolarHBondContact O-CB 3.32Å; A70-R74 PolarHBondContact O-N 3.4Å
71	L	95.7	Very high	94.9	Very high	7 Å²	7	63.4 Å²	63.4	4%	0.037	34%	0.338	C	S	.	.	H	α-helix	trans	-61.3	-47.3	173.9	-79.2	165.2	0	0	0	111.7	I15 L24 R28 L32 V67 Q68 Q69 R74 K75	I15-L71 HydrophobicContact CD1-CD2 4.04Å; I15-L71 HydrophobicContact CD1-CG 3.72Å; I15-L71 HydrophobicContact CG1-CD2 3.77Å; I15-L71 HydrophobicContact CG1-CG 4.05Å; L24-L71 HydrophobicContact CD1-CD2 3.67Å; L24-L71 HydrophobicContact CG-CD2 3.94Å; R28-L71 HydrophobicContact CB-CD1 3.94Å; R28-L71 HydrophobicContact CB-CD2 4.06Å; R28-L71 HydrophobicContact CG-CD1 3.94Å; L32-L71 HydrophobicContact CD1-CD1 3.53Å; L32-L71 HydrophobicContact CG-CD1 4.41Å; V67-L71 HydrophobicContact CG1-CD1 4.1Å; V67-L71 WeakPolarHBondContact O-CB 3.49Å; V67-L71 WeakPolarHBondContact O-CG 3.4Å; V67-L71 PolarHBondContact O-N 3.37Å; Q68-L71 PolarHBondContact O-N 3.16Å; Q69-L71 PolarHBondContact O-N 2.91Å; L71-R74 PolarHBondContact O-N 3.31Å; L71-K75 VanDerWaalsContact O-CB 3.26Å; L71-K75 WeakPolarHBondContact O-CB 3.34Å; L71-K75 PolarHBondContact O-N 2.72Å
72	N	95.9	Very high	95	Very high	92 Å²	92	62.5 Å²	62.5	49%	0.492	34%	0.342	S	S	.	.	H	α-helix	trans	-64	-43.5	-179.5	-70.5	-11.4	0	0	0	111.7	Q68 Q69 K75 A76	Q68-N72 PolarHBondContact NE2-OD1 2.76Å; Q68-N72 WeakPolarHBondContact O-CB 3.47Å; Q68-N72 PolarHBondContact O-N 3.03Å; Q68-N72 PolarHBondContact O-ND2 3.07Å; Q68-N72 PolarHBondContact O-OD1 3.33Å; Q69-N72 PolarHBondContact O-N 3.25Å; N72-K75 PolarHBondContact O-N 3.35Å; N72-A76 PolarHBondContact O-N 3.44Å
73	A	96.1	Very high	95.1	Very high	52 Å²	52	61.8 Å²	61.8	43%	0.43	34%	0.341	S	S	.	.	H	α-helix	trans	-60.8	-49.5	176.4	0	0	0	0	0	111.2	Q69 K75 A76 E77	Q69-A73 WeakPolarHBondContact O-CB 3.34Å; Q69-A73 PolarHBondContact O-N 2.73Å; A73-K75 VanDerWaalsContact C-N 3.32Å; A73-K75 PolarHBondContact O-N 2.99Å; A73-A76 PolarHBondContact O-N 2.88Å; A73-E77 WeakPolarHBondContact O-CG 3.4Å; A73-E77 PolarHBondContact O-N 3.42Å
74	R	96.2	Very high	95.3	Very high	60 Å²	60	66 Å²	66	23%	0.226	36%	0.363	C	S	.	.	H	α-helix	trans	-64	-36.8	178.7	-174	60.6	174	164.2	2.9	112.8	I15 S16 A18 L24 A70 L71 E77 L78	I15-R74 HydrophobicContact CG2-CB 3.45Å; I15-R74 VanDerWaalsContact CG2-CB 3.45Å; I15-R74 HydrophobicContact CG2-CG 3.74Å; I15-R74 WeakPolarHBondContact O-CG 3.13Å; I15-R74 PolarHBondContact O-NE 3.33Å; S16-R74 PolarHBondContact O-NH2 3.42Å; A18-R74 PolarHBondContact O-NH2 3.41Å; L24-R74 HydrophobicContact CD1-CB 4.05Å; L24-R74 HydrophobicContact CD1-CG 3.74Å; L24-R74 HydrophobicContact CD2-CB 4.2Å; L24-R74 HydrophobicContact CD2-CG 4.17Å; A70-R74 WeakPolarHBondContact O-CB 3.32Å; A70-R74 PolarHBondContact O-N 3.4Å; L71-R74 PolarHBondContact O-N 3.31Å; R74-E77 WeakPolarHBondContact CD-OE2 3.24Å; R74-E77 IonicContact CZ-OE2 2.76Å; R74-E77 IonicContact NH1-OE2 3.82Å; R74-E77 PolarHBondContact NH1-OE2 3.39Å; R74-E77 PolarHBondContact O-N 3.22Å; R74-L78 HydrophobicContact CG-CD1 4.14Å; R74-L78 HydrophobicContact CG-CG 4.49Å; R74-L78 WeakPolarHBondContact O-CG 3.27Å; R74-L78 PolarHBondContact O-N 2.88Å
75	K	96.2	Very high	95.4	Very high	92 Å²	92	66.8 Å²	66.8	40%	0.4	38%	0.378	S	S	.	.	H	α-helix	trans	-61.3	-47.5	175.4	-173.2	178.1	171.5	-178.4	0	110.9	L24 L71 N72 A73 E77 L78 E79	L24-K75 VanDerWaalsContact CD2-CA 3.45Å; L24-K75 HydrophobicContact CD2-CB 3.57Å; L24-K75 HydrophobicContact CD2-CG 4.27Å; L71-K75 VanDerWaalsContact O-CB 3.26Å; L71-K75 WeakPolarHBondContact O-CB 3.34Å; L71-K75 PolarHBondContact O-N 2.72Å; N72-K75 PolarHBondContact O-N 3.35Å; A73-K75 VanDerWaalsContact C-N 3.32Å; A73-K75 PolarHBondContact O-N 2.99Å; K75-E77 VanDerWaalsContact C-N 3.33Å; K75-E77 PolarHBondContact O-N 3.46Å; K75-L78 PolarHBondContact O-N 2.88Å; K75-E79 WeakPolarHBondContact CE-OE1 3.3Å; K75-E79 HydrophobicContact CG-CG 4.4Å; K75-E79 IonicContact NZ-OE1 3.83Å; K75-E79 WeakPolarHBondContact O-CB 3.37Å; K75-E79 WeakPolarHBondContact O-CG 3.43Å; K75-E79 PolarHBondContact O-N 3.39Å
76	A	95.7	Very high	95.5	Very high	57 Å²	57	68.9 Å²	68.9	47%	0.471	38%	0.381	S	S	.	.	H	α-helix	trans	-61.6	-40.1	177.5	0	0	0	0	0	112.2	N72 A73 S80	N72-A76 PolarHBondContact O-N 3.44Å; A73-A76 PolarHBondContact O-N 2.88Å; A76-S80 VanDerWaalsContact O-CB 3.24Å; A76-S80 WeakPolarHBondContact O-CB 3.42Å; A76-S80 PolarHBondContact O-N 2.95Å
77	E	95.9	Very high	95.6	Very high	107 Å²	107	70.2 Å²	70.2	50%	0.5	39%	0.39	S	S	.	.	H	α-helix	trans	-60.2	-49.8	173.6	-72.2	173.2	-171.9	0	0	112.2	A73 R74 K75 S80 A81	A73-E77 WeakPolarHBondContact O-CG 3.4Å; A73-E77 PolarHBondContact O-N 3.42Å; R74-E77 WeakPolarHBondContact CD-OE2 3.24Å; R74-E77 IonicContact CZ-OE2 2.76Å; R74-E77 IonicContact NH1-OE2 3.82Å; R74-E77 PolarHBondContact NH1-OE2 3.39Å; R74-E77 PolarHBondContact O-N 3.22Å; K75-E77 VanDerWaalsContact C-N 3.33Å; K75-E77 PolarHBondContact O-N 3.46Å; E77-S80 PolarHBondContact O-N 3.03Å; E77-A81 WeakPolarHBondContact O-CB 3.46Å; E77-A81 PolarHBondContact O-N 3.24Å
78	L	95.5	Very high	95.7	Very high	23 Å²	23	73.4 Å²	73.4	12%	0.12	42%	0.417	C	S	.	.	H	α-helix	trans	-66.3	-40.8	-178.6	-70.4	172.5	0	0	0	112.1	V21 L24 R74 K75 A81 A82	V21-L78 HydrophobicContact CG2-CB 4.3Å; L24-L78 HydrophobicContact CB-CD1 4.31Å; L24-L78 HydrophobicContact CD2-CD1 4.22Å; R74-L78 HydrophobicContact CG-CD1 4.14Å; R74-L78 HydrophobicContact CG-CG 4.49Å; R74-L78 WeakPolarHBondContact O-CG 3.27Å; R74-L78 PolarHBondContact O-N 2.88Å; K75-L78 PolarHBondContact O-N 2.88Å; L78-A81 PolarHBondContact O-N 3.36Å; L78-A82 WeakPolarHBondContact O-CB 3.45Å; L78-A82 PolarHBondContact O-N 3.29Å
79	E	95.5	Very high	95.8	Very high	96 Å²	96	74.2 Å²	74.2	45%	0.449	44%	0.435	S	S	.	.	H	α-helix	trans	-65.1	-41.9	175.5	-73.6	176.9	165.2	0	0	111.5	V21 K75 A82 L83	V21-E79 HydrophobicContact CG2-CG 4.14Å; K75-E79 WeakPolarHBondContact CE-OE1 3.3Å; K75-E79 HydrophobicContact CG-CG 4.4Å; K75-E79 IonicContact NZ-OE1 3.83Å; K75-E79 WeakPolarHBondContact O-CB 3.37Å; K75-E79 WeakPolarHBondContact O-CG 3.43Å; K75-E79 PolarHBondContact O-N 3.39Å; E79-A82 PolarHBondContact O-N 2.92Å; E79-L83 WeakPolarHBondContact O-CB 3.47Å; E79-L83 PolarHBondContact O-N 2.81Å
80	S	95.7	Very high	95.9	Very high	59 Å²	59	74.2 Å²	74.2	41%	0.413	44%	0.436	S	S	.	.	H	α-helix	trans	-65.2	-42.6	175.3	-175	0	0	0	0	112	A76 E77 L83 N84	A76-S80 VanDerWaalsContact O-CB 3.24Å; A76-S80 WeakPolarHBondContact O-CB 3.42Å; A76-S80 PolarHBondContact O-N 2.95Å; E77-S80 PolarHBondContact O-N 3.03Å; S80-L83 PolarHBondContact O-N 3.45Å; S80-N84 WeakPolarHBondContact O-CB 3.47Å; S80-N84 VanDerWaalsContact O-CG 3.27Å; S80-N84 PolarHBondContact O-N 3.46Å; S80-N84 PolarHBondContact O-ND2 2.88Å
81	A	95	Very high	95.9	Very high	58 Å²	58	78.1 Å²	78.1	48%	0.479	46%	0.457	S	S	.	.	H	α-helix	trans	-62.7	-43.6	176.3	0	0	0	0	0	112	E77 L78 N84 A85	E77-A81 WeakPolarHBondContact O-CB 3.46Å; E77-A81 PolarHBondContact O-N 3.24Å; L78-A81 PolarHBondContact O-N 3.36Å; A81-N84 PolarHBondContact O-N 3.05Å; A81-A85 WeakPolarHBondContact O-CB 3.42Å; A81-A85 PolarHBondContact O-N 2.93Å
82	A	94.2	Very high	95.9	Very high	64 Å²	64	84 Å²	84	53%	0.529	49%	0.487	S	S	.	.	H	α-helix	trans	-63.5	-41.9	176	0	0	0	0	0	112.2	L78 E79 R86	L78-A82 WeakPolarHBondContact O-CB 3.45Å; L78-A82 PolarHBondContact O-N 3.29Å; E79-A82 PolarHBondContact O-N 2.92Å; A82-R86 WeakPolarHBondContact O-CB 3.46Å; A82-R86 PolarHBondContact O-N 2.89Å
83	L	94.9	Very high	95.9	Very high	95 Å²	95	83.8 Å²	83.8	50%	0.497	49%	0.486	S	S	.	.	H	α-helix	trans	-62.9	-48	175	178.3	62.3	0	0	0	111.6	E79 S80 A85 R86 L87	E79-L83 WeakPolarHBondContact O-CB 3.47Å; E79-L83 PolarHBondContact O-N 2.81Å; S80-L83 PolarHBondContact O-N 3.45Å; L83-A85 VanDerWaalsContact C-N 3.34Å; L83-A85 PolarHBondContact O-N 3.25Å; L83-R86 WeakPolarHBondContact O-CB 3.46Å; L83-R86 PolarHBondContact O-N 3.25Å; L83-L87 HydrophobicContact CD1-CD1 4.25Å; L83-L87 HydrophobicContact CD1-CG 4.26Å; L83-L87 HydrophobicContact CG-CD1 4.04Å; L83-L87 HydrophobicContact CG-CG 4.45Å; L83-L87 WeakPolarHBondContact O-CG 3.41Å; L83-L87 PolarHBondContact O-N 2.94Å
84	N	96.2	Very high	95.9	Very high	91 Å²	91	87.6 Å²	87.6	49%	0.487	50%	0.503	S	S	.	.	H	α-helix	trans	-63.8	-39.4	179.6	-72.8	-28.9	0	0	0	112	S80 A81 R86 L87 A88	S80-N84 WeakPolarHBondContact O-CB 3.47Å; S80-N84 VanDerWaalsContact O-CG 3.27Å; S80-N84 PolarHBondContact O-N 3.46Å; S80-N84 PolarHBondContact O-ND2 2.88Å; A81-N84 PolarHBondContact O-N 3.05Å; N84-R86 VanDerWaalsContact C-N 3.34Å; N84-L87 PolarHBondContact O-N 3.45Å; N84-A88 VanDerWaalsContact O-CB 3.32Å; N84-A88 WeakPolarHBondContact O-CB 3.36Å; N84-A88 PolarHBondContact O-N 3.4Å
85	A	95.6	Very high	95.9	Very high	63 Å²	63	89.3 Å²	89.3	52%	0.521	53%	0.525	S	S	.	.	H	α-helix	trans	-62.6	-41.1	174.3	0	0	0	0	0	111.8	A81 L83 A88 A89	A81-A85 WeakPolarHBondContact O-CB 3.42Å; A81-A85 PolarHBondContact O-N 2.93Å; L83-A85 VanDerWaalsContact C-N 3.34Å; L83-A85 PolarHBondContact O-N 3.25Å; A85-A88 PolarHBondContact O-N 2.86Å; A85-A89 WeakPolarHBondContact O-CB 3.42Å; A85-A89 PolarHBondContact O-N 3.29Å
86	R	96.3	Very high	95.9	Very high	159 Å²	159	90.5 Å²	90.5	60%	0.6	54%	0.535	S	S	*	.	H	α-helix	trans	-63.4	-47.9	174.3	-177.4	178.7	178.2	-179.2	-1.7	111.9	A82 L83 N84 A88 A89 E90	A82-R86 WeakPolarHBondContact O-CB 3.46Å; A82-R86 PolarHBondContact O-N 2.89Å; L83-R86 WeakPolarHBondContact O-CB 3.46Å; L83-R86 PolarHBondContact O-N 3.25Å; N84-R86 VanDerWaalsContact C-N 3.34Å; R86-A88 VanDerWaalsContact C-N 3.32Å; R86-A88 PolarHBondContact O-N 2.96Å; R86-A89 PolarHBondContact O-N 2.89Å; R86-E90 HydrophobicContact CG-CG 4.41Å; R86-E90 WeakPolarHBondContact CG-OE1 3.49Å; R86-E90 IonicContact CZ-OE1 2.68Å; R86-E90 IonicContact NE-OE1 2.83Å; R86-E90 PolarHBondContact NE-OE1 3.2Å; R86-E90 IonicContact NE-OE2 2.76Å; R86-E90 IonicContact NH2-OE1 3.82Å; R86-E90 PolarHBondContact NH2-OE1 3.04Å; R86-E90 WeakPolarHBondContact O-CB 3.42Å; R86-E90 WeakPolarHBondContact O-CG 2.89Å; R86-E90 PolarHBondContact O-N 2.88Å
87	L	96.5	Very high	95.8	Very high	91 Å²	91	93.5 Å²	93.5	48%	0.476	55%	0.549	S	S	.	.	H	α-helix	trans	-61.4	-40.6	178	-69.6	172.4	0	0	0	111.8	L83 N84 E90 T91	L83-L87 HydrophobicContact CD1-CD1 4.25Å; L83-L87 HydrophobicContact CD1-CG 4.26Å; L83-L87 HydrophobicContact CG-CD1 4.04Å; L83-L87 HydrophobicContact CG-CG 4.45Å; L83-L87 WeakPolarHBondContact O-CG 3.41Å; L83-L87 PolarHBondContact O-N 2.94Å; N84-L87 PolarHBondContact O-N 3.45Å; L87-E90 CarbonylContact O-C 3.47Å; L87-E90 PolarHBondContact O-N 3.23Å; L87-T91 PolarHBondContact O-N 2.96Å; L87-T91 PolarHBondContact O-OG1 2.91Å
88	A	96.3	Very high	95.7	Very high	68 Å²	68	90.5 Å²	90.5	56%	0.562	55%	0.547	S	S	*	.	H	α-helix	trans	-65.1	-40.2	175.4	0	0	0	0	0	112.3	N84 A85 R86 T91	N84-A88 VanDerWaalsContact O-CB 3.32Å; N84-A88 WeakPolarHBondContact O-CB 3.36Å; N84-A88 PolarHBondContact O-N 3.4Å; A85-A88 PolarHBondContact O-N 2.86Å; R86-A88 VanDerWaalsContact C-N 3.32Å; R86-A88 PolarHBondContact O-N 2.96Å; A88-T91 WeakPolarHBondContact O-CB 3.27Å; A88-T91 PolarHBondContact O-N 2.91Å; A88-T91 PolarHBondContact O-OG1 3.34Å
89	A	97.1	Very high	95.6	Very high	89 Å²	89	101.8 Å²	101.8	74%	0.736	59%	0.588	S	S	*	*	H	α-helix	trans	-69.7	-33.1	176.5	0	0	0	0	0	113.1	A85 R86 T91	A85-A89 WeakPolarHBondContact O-CB 3.42Å; A85-A89 PolarHBondContact O-N 3.29Å; R86-A89 PolarHBondContact O-N 2.89Å; A89-T91 VanDerWaalsContact C-N 3.31Å
90	E	96.9	Very high	95.3	Very high	111 Å²	111	107.4 Å²	107.4	52%	0.519	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.9	5.2	176.3	-65.8	176.9	-174.9	0	0	112.6	R86 L87 I92	R86-E90 HydrophobicContact CG-CG 4.41Å; R86-E90 WeakPolarHBondContact CG-OE1 3.49Å; R86-E90 IonicContact CZ-OE1 2.68Å; R86-E90 IonicContact NE-OE1 2.83Å; R86-E90 PolarHBondContact NE-OE1 3.2Å; R86-E90 IonicContact NE-OE2 2.76Å; R86-E90 IonicContact NH2-OE1 3.82Å; R86-E90 PolarHBondContact NH2-OE1 3.04Å; R86-E90 WeakPolarHBondContact O-CB 3.42Å; R86-E90 WeakPolarHBondContact O-CG 2.89Å; R86-E90 PolarHBondContact O-N 2.88Å; L87-E90 CarbonylContact O-C 3.47Å; L87-E90 PolarHBondContact O-N 3.23Å; E90-I92 PolarHBondContact O-N 2.81Å
91	T	96	Very high	95.1	Very high	106 Å²	106	112.1 Å²	112.1	65%	0.65	62%	0.624	S	S	*	*			trans	-68.3	124.6	176.8	-66.2	0	0	0	0	109.7	L87 A88 A89	L87-T91 PolarHBondContact O-N 2.96Å; L87-T91 PolarHBondContact O-OG1 2.91Å; A88-T91 WeakPolarHBondContact O-CB 3.27Å; A88-T91 PolarHBondContact O-N 2.91Å; A88-T91 PolarHBondContact O-OG1 3.34Å; A89-T91 VanDerWaalsContact C-N 3.31Å
92	I	95.3	Very high	94.7	Very high	132 Å²	132	116 Å²	116	68%	0.677	63%	0.632	S	S	*	*			trans	-111.9	157.9	176.7	57.8	167.5	0	0	0	110.3	E90 V94	E90-I92 PolarHBondContact O-N 2.81Å; I92-V94 HydrophobicContact CG1-CG1 4.26Å; I92-V94 PolarHBondContact O-N 3.12Å
93	D	96.4	Very high	94.4	Very high	87 Å²	87	119.3 Å²	119.3	47%	0.465	64%	0.641	S	S	.	*			trans	-76.1	100.4	168.1	-179.4	2.2	0	0	0	110	S95 L96	D93-S95 VanDerWaalsContact CG-OG 3.31Å; D93-S95 PolarHBondContact O-N 3.32Å; D93-S95 WeakPolarHBondContact OD1-CA 3.48Å; D93-S95 VanDerWaalsContact OD1-CB 3.27Å; D93-S95 WeakPolarHBondContact OD1-CB 3.34Å; D93-S95 PolarHBondContact OD1-N 2.6Å; D93-S95 PolarHBondContact OD1-OG 3.24Å; D93-S95 PolarHBondContact OD2-OG 2.88Å; D93-L96 HydrophobicContact CB-CD1 4.02Å; D93-L96 HydrophobicContact CB-CG 3.92Å; D93-L96 PolarHBondContact O-N 3.17Å
94	V	95.7	Very high	94.2	Very high	131 Å²	131	117.9 Å²	117.9	79%	0.794	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	-7.4	178.7	-61.6	0	0	0	0	113.7	I92	I92-V94 HydrophobicContact CG1-CG1 4.26Å; I92-V94 PolarHBondContact O-N 3.12Å
95	S	96.6	Very high	94	Very high	96 Å²	96	115.9 Å²	115.9	67%	0.671	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-12.4	176.2	79	0	0	0	0	113.4	D93	D93-S95 VanDerWaalsContact CG-OG 3.31Å; D93-S95 PolarHBondContact O-N 3.32Å; D93-S95 WeakPolarHBondContact OD1-CA 3.48Å; D93-S95 VanDerWaalsContact OD1-CB 3.27Å; D93-S95 WeakPolarHBondContact OD1-CB 3.34Å; D93-S95 PolarHBondContact OD1-N 2.6Å; D93-S95 PolarHBondContact OD1-OG 3.24Å; D93-S95 PolarHBondContact OD2-OG 2.88Å
96	L	96.1	Very high	94.1	Very high	117 Å²	117	117.4 Å²	117.4	61%	0.613	65%	0.649	S	S	*	*	S	Bend	trans	-60.9	139.4	177.9	-71.7	174.9	0	0	0	111.1	D93 G98	D93-L96 HydrophobicContact CB-CD1 4.02Å; D93-L96 HydrophobicContact CB-CG 3.92Å; D93-L96 PolarHBondContact O-N 3.17Å; L96-G98 PolarHBondContact O-N 2.66Å; L96-G98 VanDerWaalsContact O-N 3.09Å
97	P	94	Very high	94.1	Very high	120 Å²	120	112 Å²	112	78%	0.779	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-55.8	119.7	172	-24.3	33.5	0	0	0	110.8
98	G	93.5	Very high	94.1	Very high	44 Å²	44	107.7 Å²	107.7	45%	0.454	61%	0.608	S	S	.	*	P	Polyproline II helix	trans	-59.5	153.3	174.7	0	0	0	0	0	111.6	L96 R100	L96-G98 PolarHBondContact O-N 2.66Å; L96-G98 VanDerWaalsContact O-N 3.09Å; G98-R100 WeakPolarHBondContact O-CG 3.41Å; G98-R100 PolarHBondContact O-N 3.15Å; G98-R100 VanDerWaalsContact O-N 3.16Å
99	R	94.4	Very high	94.1	Very high	261 Å²	261	104.5 Å²	104.5	99%	0.985	58%	0.582	S	S	*	*			trans	-65.6	114.4	170.4	-63.3	-179.3	-169.8	170	3.4	108.3
100	R	89.5	Confident	94.1	Very high	214 Å²	214	102.9 Å²	102.9	81%	0.808	56%	0.562	S	S	*	*			trans	-127.6	149.9	-173.7	-67.7	172.4	-169.9	-158.7	2.7	110.7	G98	G98-R100 WeakPolarHBondContact O-CG 3.41Å; G98-R100 PolarHBondContact O-N 3.15Å; G98-R100 VanDerWaalsContact O-N 3.16Å
101	I	91.2	Very high	94.1	Very high	158 Å²	158	102.3 Å²	102.3	81%	0.81	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-86.9	131.8	160.7	-59	174.5	0	0	0	105.8	N103	I101-N103 PolarHBondContact O-N 3.09Å
102	E	86.2	Confident	94.2	Very high	138 Å²	138	97.3 Å²	97.3	65%	0.645	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-63.1	131.5	177.1	-72.9	-161.6	-178.1	0	0	109.9	G104 K324 K327	E102-G104 PolarHBondContact O-N 3.11Å; E102-K324 IonicContact OE1-NZ 3.91Å; E102-K324 IonicContact OE2-NZ 3.82Å; E102-K324 PolarHBondContact OE2-NZ 3.39Å; E102-K324 VanDerWaalsContact OE2-NZ 3.07Å; E102-K327 IonicContact OE2-NZ 3.17Å
103	N	87	Confident	94.3	Very high	135 Å²	135	92 Å²	92	72%	0.722	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-64.2	132	170.2	-68.4	-15.3	0	0	0	109.2	I101 K327	I101-N103 PolarHBondContact O-N 3.09Å; N103-K327 WeakPolarHBondContact O-CE 3.43Å; N103-K327 PolarHBondContact O-NZ 3.26Å
104	G	91.7	Very high	94.3	Very high	65 Å²	65	91.2 Å²	91.2	67%	0.67	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-68.3	173.9	164.3	0	0	0	0	0	111.2	E102	E102-G104 PolarHBondContact O-N 3.11Å
105	G	92.9	Very high	94.4	Very high	48 Å²	48	88.2 Å²	88.2	50%	0.495	47%	0.468	S	S	.	.			trans	-149.8	154.1	172.7	0	0	0	0	0	109.8
106	L	95.8	Very high	94.4	Very high	96 Å²	96	83.7 Å²	83.7	50%	0.503	44%	0.436	S	S	.	.			trans	-77	150.3	174.1	-68.1	173.5	0	0	0	110.4	T110 R111	L106-T110 HydrophobicContact CD2-CG2 4.31Å; L106-R111 HydrophobicContact CB-CG 3.71Å; L106-R111 HydrophobicContact CD1-CG 4.42Å
107	H	97	Very high	94.5	Very high	45 Å²	45	80.7 Å²	80.7	21%	0.208	42%	0.419	C	S	.	.			trans	-60.3	140.1	171.2	-170.1	-90.2	0	0	0	109.7	V109 T110 R111 F315 L323	H107-V109 WeakPolarHBondContact ND1-CB 3.23Å; H107-V109 PolarHBondContact ND1-N 2.97Å; H107-V109 PolarHBondContact O-N 2.78Å; H107-V109 VanDerWaalsContact O-N 3.16Å; H107-T110 WeakPolarHBondContact O-CA 3.43Å; H107-T110 WeakPolarHBondContact O-CB 3.49Å; H107-T110 PolarHBondContact O-N 3.16Å; H107-R111 PolarHBondContact O-N 2.78Å; H107-F315 AromaticContact CE1-CD1 3.96Å; H107-F315 PolarHBondContact NE2-O 3.35Å; H107-L323 WeakPolarHBondContact CD2-CD2 3.33Å
108	P	96.9	Very high	94.7	Very high	0 Å²	0	78.2 Å²	78.2	0%	0	40%	0.404	C	S	.	.	H	α-helix	trans	-58	-31.2	-176.9	21.3	-35.1	0	0	0	113.9	T112 T303 Y307 F315 F322 F326	P108-T112 PolarHBondContact O-N 3.13Å; P108-T112 VanDerWaalsContact O-N 3.08Å; P108-T112 PolarHBondContact O-OG1 3.21Å; P108-T303 HydrophobicContact CB-CG2 3.82Å; P108-Y307 HydrophobicContact CB-CD2 4.25Å; P108-Y307 HydrophobicContact CB-CE2 4.08Å; P108-F315 HydrophobicContact CB-CE1 4.17Å; P108-F315 HydrophobicContact CG-CD1 3.71Å; P108-F315 HydrophobicContact CG-CE1 3.68Å; P108-F322 HydrophobicContact CG-CE1 4.16Å; P108-F322 HydrophobicContact CG-CZ 4.42Å; P108-F326 HydrophobicContact CB-CB 4.38Å; P108-F326 HydrophobicContact CB-CD1 3.89Å; P108-F326 HydrophobicContact CB-CD2 4.01Å; P108-F326 HydrophobicContact CB-CE1 4.15Å; P108-F326 HydrophobicContact CB-CE2 4.26Å; P108-F326 HydrophobicContact CB-CG 3.82Å; P108-F326 HydrophobicContact CB-CZ 4.32Å; P108-F326 HydrophobicContact CG-CD2 3.82Å; P108-F326 HydrophobicContact CG-CE2 3.95Å; P108-F326 HydrophobicContact CG-CG 4.15Å; P108-F326 HydrophobicContact CG-CZ 4.38Å
109	V	96.8	Very high	94.9	Very high	2 Å²	2	77.1 Å²	77.1	1%	0.012	39%	0.387	C	S	.	.	H	α-helix	trans	-66.6	-43.8	172.5	177.8	0	0	0	0	111	H107 R111 T112 I113 H207 M299 E300 T303 F315	H107-V109 WeakPolarHBondContact ND1-CB 3.23Å; H107-V109 PolarHBondContact ND1-N 2.97Å; H107-V109 PolarHBondContact O-N 2.78Å; H107-V109 VanDerWaalsContact O-N 3.16Å; V109-R111 PolarHBondContact O-N 3.07Å; V109-T112 WeakPolarHBondContact O-CA 3.15Å; V109-T112 WeakPolarHBondContact O-CB 3.24Å; V109-T112 PolarHBondContact O-N 3.13Å; V109-T112 VanDerWaalsContact O-N 3.08Å; V109-I113 HydrophobicContact CG1-CD1 4.04Å; V109-I113 WeakPolarHBondContact O-CG1 3.35Å; V109-I113 PolarHBondContact O-N 2.98Å; V109-H207 HydrophobicContact CG1-CB 4.16Å; V109-M299 HydrophobicContact CG1-CB 3.97Å; V109-E300 HydrophobicContact CG2-CG 4.37Å; V109-T303 HydrophobicContact CG2-CG2 4.39Å; V109-F315 HydrophobicContact CG2-CB 4.37Å; V109-F315 HydrophobicContact CG2-CD1 4.14Å; V109-F315 HydrophobicContact CG2-CD2 4.41Å; V109-F315 HydrophobicContact CG2-CG 4.06Å
110	T	97	Very high	95.1	Very high	54 Å²	54	64.7 Å²	64.7	33%	0.331	34%	0.34	S	S	.	.	H	α-helix	trans	-60.4	-45.7	174.8	-51.9	0	0	0	0	111.2	L106 H107 T112 I113 D114	L106-T110 HydrophobicContact CD2-CG2 4.31Å; H107-T110 WeakPolarHBondContact O-CA 3.43Å; H107-T110 WeakPolarHBondContact O-CB 3.49Å; H107-T110 PolarHBondContact O-N 3.16Å; T110-T112 PolarHBondContact O-N 3.38Å; T110-I113 PolarHBondContact O-N 3.29Å; T110-I113 VanDerWaalsContact O-N 3.13Å; T110-D114 VanDerWaalsContact O-CG 3.23Å; T110-D114 PolarHBondContact O-N 2.91Å
111	R	96.6	Very high	95.5	Very high	99 Å²	99	56.3 Å²	56.3	37%	0.374	32%	0.32	S	S	.	.	H	α-helix	trans	-58.3	-33.8	175.1	-65.2	-172.6	68.7	159.2	2.2	112.7	L106 H107 V109 R115 F326	L106-R111 HydrophobicContact CB-CG 3.71Å; L106-R111 HydrophobicContact CD1-CG 4.42Å; H107-R111 PolarHBondContact O-N 2.78Å; V109-R111 PolarHBondContact O-N 3.07Å; R111-R115 WeakPolarHBondContact O-CB 3.35Å; R111-R115 PolarHBondContact O-N 3.04Å; R111-F326 PolarHBondContact NH1-O 2.97Å
112	T	97.2	Very high	95.8	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.006	32%	0.316	C	S	.	.	H	α-helix	trans	-70.9	-46.7	177.3	-59.3	0	0	0	0	110.5	P108 V109 T110 R115 I116 F234 L302 T303	P108-T112 PolarHBondContact O-N 3.13Å; P108-T112 VanDerWaalsContact O-N 3.08Å; P108-T112 PolarHBondContact O-OG1 3.21Å; V109-T112 WeakPolarHBondContact O-CA 3.15Å; V109-T112 WeakPolarHBondContact O-CB 3.24Å; V109-T112 PolarHBondContact O-N 3.13Å; V109-T112 VanDerWaalsContact O-N 3.08Å; T110-T112 PolarHBondContact O-N 3.38Å; T112-R115 PolarHBondContact O-N 3.39Å; T112-I116 HydrophobicContact CG2-CD1 3.85Å; T112-I116 VanDerWaalsContact O-CG1 3.24Å; T112-I116 WeakPolarHBondContact O-CG1 3.39Å; T112-I116 PolarHBondContact O-N 2.66Å; T112-I116 VanDerWaalsContact O-N 3.08Å; T112-F234 HydrophobicContact CG2-CE2 3.91Å; T112-F234 HydrophobicContact CG2-CZ 3.79Å; T112-L302 HydrophobicContact CG2-CB 4.24Å; T112-T303 VanDerWaalsContact CB-OG1 3.25Å; T112-T303 WeakPolarHBondContact CB-OG1 3.49Å; T112-T303 WeakPolarHBondContact CG2-OG1 3.37Å; T112-T303 PolarHBondContact OG1-OG1 2.88Å
113	I	97.7	Very high	96.2	Very high	21 Å²	21	53.3 Å²	53.3	11%	0.108	31%	0.305	C	S	.	.	H	α-helix	trans	-56.7	-54.5	174.5	-67.9	165.7	0	0	0	110.1	V109 T110 R115 I116 E117 P190 H207 M209 M299	V109-I113 HydrophobicContact CG1-CD1 4.04Å; V109-I113 WeakPolarHBondContact O-CG1 3.35Å; V109-I113 PolarHBondContact O-N 2.98Å; T110-I113 PolarHBondContact O-N 3.29Å; T110-I113 VanDerWaalsContact O-N 3.13Å; I113-R115 PolarHBondContact O-N 3.16Å; I113-I116 PolarHBondContact O-N 3.43Å; I113-E117 HydrophobicContact CG2-CG 4.08Å; I113-E117 WeakPolarHBondContact CG2-OE1 3.33Å; I113-E117 WeakPolarHBondContact O-CG 3.49Å; I113-E117 PolarHBondContact O-N 2.9Å; I113-P190 HydrophobicContact CG2-CB 4.11Å; I113-H207 HydrophobicContact CD1-CB 4.44Å; I113-M209 HydrophobicContact CG2-CE 3.99Å; I113-M299 HydrophobicContact CD1-CG 4.28Å; I113-M299 HydrophobicContact CG1-CB 4.46Å; I113-M299 HydrophobicContact CG1-CG 3.78Å; I113-M299 HydrophobicContact CG1-SD 3.64Å
114	D	97.3	Very high	96.7	Very high	70 Å²	70	49.1 Å²	49.1	37%	0.374	29%	0.293	S	S	.	.	H	α-helix	trans	-55.5	-40.1	-178.7	-64.2	-11.7	0	0	0	112	T110 S118	T110-D114 VanDerWaalsContact O-CG 3.23Å; T110-D114 PolarHBondContact O-N 2.91Å; D114-S118 WeakPolarHBondContact O-CB 3.45Å; D114-S118 PolarHBondContact O-N 2.92Å
115	R	97.2	Very high	97	Very high	69 Å²	69	46.8 Å²	46.8	26%	0.26	27%	0.265	S	S	.	.	H	α-helix	trans	-65.5	-45	177.8	-177.3	-179.7	-179.6	95.5	-3.9	111.8	R111 T112 I113 S118 F119 N233 F234 E236 R306	R111-R115 WeakPolarHBondContact O-CB 3.35Å; R111-R115 PolarHBondContact O-N 3.04Å; T112-R115 PolarHBondContact O-N 3.39Å; I113-R115 PolarHBondContact O-N 3.16Å; R115-S118 PolarHBondContact O-N 3.25Å; R115-F119 PolarHBondContact O-N 3.08Å; R115-F119 VanDerWaalsContact O-N 3.14Å; R115-N233 PolarHBondContact NH2-O 2.82Å; R115-F234 HydrophobicContact CG-CD2 4.41Å; R115-E236 IonicContact CZ-OE1 2.69Å; R115-E236 IonicContact NH1-OE1 3.72Å; R115-E236 PolarHBondContact NH1-OE1 2.94Å; R115-E236 VanDerWaalsContact NH1-OE1 3.09Å; R115-E236 VanDerWaalsContact NH2-CG 3.32Å; R115-E236 IonicContact NH2-OE1 2.75Å; R115-E236 PolarHBondContact NH2-OE1 3.14Å; R115-R306 VanDerWaalsContact NE-NH1 3.16Å
116	I	97.6	Very high	97.3	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-69.2	-41.2	-179.3	-60.3	168.2	0	0	0	109.6	T112 I113 S118 F119 F120 M209 F230 F234 M297 M299 L302	T112-I116 HydrophobicContact CG2-CD1 3.85Å; T112-I116 VanDerWaalsContact O-CG1 3.24Å; T112-I116 WeakPolarHBondContact O-CG1 3.39Å; T112-I116 PolarHBondContact O-N 2.66Å; T112-I116 VanDerWaalsContact O-N 3.08Å; I113-I116 PolarHBondContact O-N 3.43Å; I116-S118 VanDerWaalsContact C-N 3.34Å; I116-S118 PolarHBondContact O-N 3.32Å; I116-F119 PolarHBondContact O-N 3.04Å; I116-F120 HydrophobicContact CG2-CD2 3.62Å; I116-F120 HydrophobicContact CG2-CE2 3.69Å; I116-F120 WeakPolarHBondContact O-CD2 3.38Å; I116-F120 PolarHBondContact O-N 2.87Å; I116-M209 HydrophobicContact CB-CE 4.02Å; I116-M209 HydrophobicContact CB-SD 3.97Å; I116-M209 HydrophobicContact CG2-CE 3.99Å; I116-M209 HydrophobicContact CG2-SD 3.25Å; I116-M209 WeakPolarHBondContact CG2-SD 3.37Å; I116-F230 HydrophobicContact CB-CE2 4.27Å; I116-F230 HydrophobicContact CD1-CZ 4.14Å; I116-F230 HydrophobicContact CG1-CE2 3.85Å; I116-F230 HydrophobicContact CG1-CZ 3.92Å; I116-F230 HydrophobicContact CG2-CE2 3.75Å; I116-F230 HydrophobicContact CG2-CZ 4.04Å; I116-F234 HydrophobicContact CD1-CD2 4.45Å; I116-F234 HydrophobicContact CD1-CE2 4.06Å; I116-F234 HydrophobicContact CG1-CD2 3.86Å; I116-F234 HydrophobicContact CG1-CE2 3.79Å; I116-M297 HydrophobicContact CD1-SD 4.14Å; I116-M297 HydrophobicContact CG2-SD 4.4Å; I116-M299 HydrophobicContact CD1-CE 3.69Å; I116-M299 HydrophobicContact CD1-SD 3.76Å; I116-L302 HydrophobicContact CD1-CD1 3.79Å
117	E	97.9	Very high	97.4	Very high	55 Å²	55	47.5 Å²	47.5	26%	0.257	26%	0.264	S	S	.	.	H	α-helix	trans	-57.6	-44.9	173	-71.9	-172.9	177.2	0	0	112	I113 F119 F120 G121 V127 I188 P190 M209	I113-E117 HydrophobicContact CG2-CG 4.08Å; I113-E117 WeakPolarHBondContact CG2-OE1 3.33Å; I113-E117 WeakPolarHBondContact O-CG 3.49Å; I113-E117 PolarHBondContact O-N 2.9Å; E117-F119 PolarHBondContact O-N 3.49Å; E117-F120 PolarHBondContact O-N 3.34Å; E117-G121 WeakPolarHBondContact O-CA 3.34Å; E117-G121 PolarHBondContact O-N 3.1Å; E117-V127 HydrophobicContact CG-CG2 4.03Å; E117-I188 HydrophobicContact CB-CD1 4.15Å; E117-I188 HydrophobicContact CG-CD1 3.82Å; E117-P190 VanDerWaalsContact OE1-CG 3.25Å; E117-P190 WeakPolarHBondContact OE1-CG 3.49Å; E117-M209 HydrophobicContact CG-CE 3.72Å
118	S	97.6	Very high	97.4	Very high	67 Å²	67	46 Å²	46	47%	0.469	26%	0.26	S	S	.	.	H	α-helix	trans	-58.6	-47.4	176.3	-168.3	0	0	0	0	111.8	D114 R115 I116 G121 E122	D114-S118 WeakPolarHBondContact O-CB 3.45Å; D114-S118 PolarHBondContact O-N 2.92Å; R115-S118 PolarHBondContact O-N 3.25Å; I116-S118 VanDerWaalsContact C-N 3.34Å; I116-S118 PolarHBondContact O-N 3.32Å; S118-G121 PolarHBondContact O-N 3.27Å; S118-E122 WeakPolarHBondContact O-CG 3.33Å; S118-E122 PolarHBondContact O-N 2.85Å
119	F	98	Very high	97.4	Very high	21 Å²	21	51.6 Å²	51.6	9%	0.092	29%	0.294	C	S	.	.	H	α-helix	trans	-61.1	-50.2	-179.7	176.5	-91.7	0	0	0	112.1	R115 I116 E117 G121 E122 L123 D229 F230 N233	R115-F119 PolarHBondContact O-N 3.08Å; R115-F119 VanDerWaalsContact O-N 3.14Å; I116-F119 PolarHBondContact O-N 3.04Å; E117-F119 PolarHBondContact O-N 3.49Å; F119-G121 VanDerWaalsContact C-N 3.34Å; F119-E122 PolarHBondContact O-N 3.41Å; F119-L123 HydrophobicContact CD1-CD1 4.15Å; F119-L123 HydrophobicContact CE1-CD1 3.43Å; F119-L123 VanDerWaalsContact CE1-CD1 3.43Å; F119-L123 HydrophobicContact CE1-CG 4.33Å; F119-L123 HydrophobicContact CZ-CD1 3.84Å; F119-L123 PolarHBondContact O-N 3.06Å; F119-D229 HydrophobicContact CZ-CB 4.4Å; F119-F230 HydrophobicContact CD1-CB 4.17Å; F119-F230 AromaticContact CD1-CD2 3.66Å; F119-F230 HydrophobicContact CD1-CD2 3.66Å; F119-F230 HydrophobicContact CD1-CG 4.37Å; F119-F230 HydrophobicContact CE1-CB 3.54Å; F119-F230 AromaticContact CE1-CD2 3.96Å; F119-F230 HydrophobicContact CE1-CD2 3.96Å; F119-F230 HydrophobicContact CE1-CG 4.23Å; F119-F230 HydrophobicContact CG-CD2 4.18Å; F119-F230 VanDerWaalsContact CZ-CA 3.4Å; F119-F230 HydrophobicContact CZ-CB 3.95Å; F119-N233 HydrophobicContact CD2-CB 3.76Å; F119-N233 VanDerWaalsContact CD2-CG 3.43Å; F119-N233 WeakPolarHBondContact CD2-OD1 3.28Å; F119-N233 HydrophobicContact CE2-CB 3.56Å
120	F	98.1	Very high	97.4	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-72.2	-30.5	-179.4	-79	-72.7	0	0	0	112.3	I116 E117 E122 L123 G124 F125 I188 T226 F230 F295 M297	I116-F120 HydrophobicContact CG2-CD2 3.62Å; I116-F120 HydrophobicContact CG2-CE2 3.69Å; I116-F120 WeakPolarHBondContact O-CD2 3.38Å; I116-F120 PolarHBondContact O-N 2.87Å; E117-F120 PolarHBondContact O-N 3.34Å; F120-E122 VanDerWaalsContact C-N 3.33Å; F120-E122 PolarHBondContact O-N 3.17Å; F120-L123 HydrophobicContact CD1-CD1 4.28Å; F120-L123 CarbonylContact O-C 3.58Å; F120-L123 WeakPolarHBondContact O-CA 3.34Å; F120-L123 WeakPolarHBondContact O-CB 3.47Å; F120-L123 PolarHBondContact O-N 3.16Å; F120-L123 VanDerWaalsContact O-N 3.1Å; F120-G124 PolarHBondContact O-N 3.3Å; F120-F125 HydrophobicContact CB-CB 4Å; F120-F125 HydrophobicContact CB-CD2 4.33Å; F120-F125 HydrophobicContact CB-CG 4.16Å; F120-F125 HydrophobicContact CD1-CD1 4.44Å; F120-F125 AromaticContact CD1-CD2 3.96Å; F120-F125 HydrophobicContact CD1-CD2 3.96Å; F120-F125 HydrophobicContact CD1-CE2 4.02Å; F120-F125 HydrophobicContact CD1-CG 4.19Å; F120-F125 HydrophobicContact CD1-CZ 4.31Å; F120-F125 WeakPolarHBondContact O-CB 3.4Å; F120-F125 WeakPolarHBondContact O-CD2 3.47Å; F120-F125 PolarHBondContact O-N 3.16Å; F120-I188 HydrophobicContact CB-CD1 4.05Å; F120-I188 HydrophobicContact CB-CG2 3.92Å; F120-I188 HydrophobicContact CD1-CG2 4.35Å; F120-I188 HydrophobicContact CD2-CG2 4.15Å; F120-I188 HydrophobicContact CG-CG2 3.89Å; F120-T226 HydrophobicContact CE1-CG2 3.84Å; F120-F230 AromaticContact CE2-CD2 3.78Å; F120-F230 HydrophobicContact CE2-CD2 3.78Å; F120-F230 HydrophobicContact CE2-CE2 4.05Å; F120-F230 HydrophobicContact CE2-CG 4.11Å; F120-F230 HydrophobicContact CZ-CB 4.27Å; F120-F230 HydrophobicContact CZ-CD2 4.16Å; F120-F230 HydrophobicContact CZ-CG 4.06Å; F120-F295 HydrophobicContact CD1-CZ 4.1Å; F120-F295 AromaticContact CE1-CE1 3.92Å; F120-F295 HydrophobicContact CE1-CE1 3.92Å; F120-F295 HydrophobicContact CE1-CE2 4.18Å; F120-F295 AromaticContact CE1-CZ 3.31Å; F120-F295 HydrophobicContact CE1-CZ 3.31Å; F120-F295 HydrophobicContact CE2-CE2 4.01Å; F120-F295 AromaticContact CE2-CZ 3.93Å; F120-F295 HydrophobicContact CE2-CZ 3.93Å; F120-F295 HydrophobicContact CZ-CE1 4.09Å; F120-F295 AromaticContact CZ-CE2 3.61Å; F120-F295 HydrophobicContact CZ-CE2 3.61Å; F120-F295 AromaticContact CZ-CZ 3.22Å; F120-F295 HydrophobicContact CZ-CZ 3.22Å; F120-M297 HydrophobicContact CE2-CE 4.42Å
121	G	97.8	Very high	97.5	Very high	38 Å²	38	53 Å²	53	39%	0.392	31%	0.309	S	S	.	.	H	α-helix	trans	-59.4	-42	171.2	0	0	0	0	0	112.3	E117 S118 F119 L123 G124	E117-G121 WeakPolarHBondContact O-CA 3.34Å; E117-G121 PolarHBondContact O-N 3.1Å; S118-G121 PolarHBondContact O-N 3.27Å; F119-G121 VanDerWaalsContact C-N 3.34Å; G121-L123 PolarHBondContact O-N 2.99Å; G121-G124 PolarHBondContact O-N 3.3Å
122	E	97.1	Very high	97.6	Very high	155 Å²	155	51.6 Å²	51.6	72%	0.724	31%	0.307	S	S	*	.	H	α-helix	trans	-64.2	-28	173.7	-72.4	174.7	-162.7	0	0	112.9	S118 F119 F120 G124	S118-E122 WeakPolarHBondContact O-CG 3.33Å; S118-E122 PolarHBondContact O-N 2.85Å; F119-E122 PolarHBondContact O-N 3.41Å; F120-E122 VanDerWaalsContact C-N 3.33Å; F120-E122 PolarHBondContact O-N 3.17Å; E122-G124 VanDerWaalsContact C-N 3.25Å; E122-G124 PolarHBondContact O-N 2.86Å
123	L	95.8	Very high	97.6	Very high	79 Å²	79	56 Å²	56	41%	0.414	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	1.4	172.3	-63.7	-179.7	0	0	0	113.7	F119 F120 G121 F125 T226	F119-L123 HydrophobicContact CD1-CD1 4.15Å; F119-L123 HydrophobicContact CE1-CD1 3.43Å; F119-L123 VanDerWaalsContact CE1-CD1 3.43Å; F119-L123 HydrophobicContact CE1-CG 4.33Å; F119-L123 HydrophobicContact CZ-CD1 3.84Å; F119-L123 PolarHBondContact O-N 3.06Å; F120-L123 HydrophobicContact CD1-CD1 4.28Å; F120-L123 CarbonylContact O-C 3.58Å; F120-L123 WeakPolarHBondContact O-CA 3.34Å; F120-L123 WeakPolarHBondContact O-CB 3.47Å; F120-L123 PolarHBondContact O-N 3.16Å; F120-L123 VanDerWaalsContact O-N 3.1Å; G121-L123 PolarHBondContact O-N 2.99Å; L123-F125 HydrophobicContact CB-CD2 3.97Å; L123-F125 HydrophobicContact CB-CE2 4.17Å; L123-T226 HydrophobicContact CD1-CG2 4.18Å
124	G	96.9	Very high	97.6	Very high	46 Å²	46	55.1 Å²	55.1	47%	0.474	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.3	20	178.1	0	0	0	0	0	114.9	F120 G121 E122	F120-G124 PolarHBondContact O-N 3.3Å; G121-G124 PolarHBondContact O-N 3.3Å; E122-G124 VanDerWaalsContact C-N 3.25Å; E122-G124 PolarHBondContact O-N 2.86Å
125	F	98	Very high	97.6	Very high	17 Å²	17	54.2 Å²	54.2	8%	0.075	32%	0.319	C	S	.	.			trans	-80.5	149.9	168.7	-70.8	-113.5	0	0	0	110.4	F120 L123 R186 I187 I188 I213	F120-F125 HydrophobicContact CB-CB 4Å; F120-F125 HydrophobicContact CB-CD2 4.33Å; F120-F125 HydrophobicContact CB-CG 4.16Å; F120-F125 HydrophobicContact CD1-CD1 4.44Å; F120-F125 AromaticContact CD1-CD2 3.96Å; F120-F125 HydrophobicContact CD1-CD2 3.96Å; F120-F125 HydrophobicContact CD1-CE2 4.02Å; F120-F125 HydrophobicContact CD1-CG 4.19Å; F120-F125 HydrophobicContact CD1-CZ 4.31Å; F120-F125 WeakPolarHBondContact O-CB 3.4Å; F120-F125 WeakPolarHBondContact O-CD2 3.47Å; F120-F125 PolarHBondContact O-N 3.16Å; L123-F125 HydrophobicContact CB-CD2 3.97Å; L123-F125 HydrophobicContact CB-CE2 4.17Å; F125-R186 WeakPolarHBondContact CA-O 3.48Å; F125-R186 HydrophobicContact CD1-CB 4.09Å; F125-R186 HydrophobicContact CD2-CB 4.46Å; F125-R186 HydrophobicContact CE1-CB 4.36Å; F125-R186 HydrophobicContact CG-CB 4.14Å; F125-I187 WeakPolarHBondContact CD1-O 3.37Å; F125-I188 HydrophobicContact CB-CG2 4.39Å; F125-I188 HydrophobicContact CD1-CG2 3.97Å; F125-I188 HydrophobicContact CG-CG2 4.43Å; F125-I213 HydrophobicContact CZ-CB 4.43Å
126	T	98.1	Very high	97.6	Very high	87 Å²	87	52.8 Å²	52.8	53%	0.534	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	153	170.1	58.5	0	0	0	0	111.1	R186 I187 I188	T126-R186 PolarHBondContact N-O 2.96Å; T126-R186 PolarHBondContact OG1-O 3.05Å; T126-I187 CarbonylContact O-C 3.59Å; T126-I187 WeakPolarHBondContact O-CA 3.4Å; T126-I188 PolarHBondContact O-N 3.26Å
127	V	98.3	Very high	97.5	Very high	71 Å²	71	56.1 Å²	56.1	43%	0.43	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	125	175.6	-179.6	0	0	0	0	109.2	E117 T129 I188 P190	E117-V127 HydrophobicContact CG-CG2 4.03Å; V127-T129 HydrophobicContact CG1-CG2 4.4Å; V127-I188 CarbonylContact C-O 3.44Å; V127-I188 WeakPolarHBondContact CA-O 3.42Å; V127-I188 HydrophobicContact CG2-CD1 3.96Å; V127-I188 HydrophobicContact CG2-CG1 4Å; V127-P190 HydrophobicContact CG1-CG 3.87Å
128	A	98	Very high	97.5	Very high	15 Å²	15	54.4 Å²	54.4	12%	0.124	32%	0.322	C	S	.	.			trans	-112.7	140.5	172.8	0	0	0	0	0	109.9	V173 I187 I188 A189	A128-V173 HydrophobicContact CB-CG1 3.65Å; A128-I187 HydrophobicContact CB-CB 4.12Å; A128-I187 HydrophobicContact CB-CD1 3.92Å; A128-I187 HydrophobicContact CB-CG2 4.25Å; A128-I188 PolarHBondContact N-O 3.03Å; A128-A189 WeakPolarHBondContact O-CA 3.5Å
129	T	97.3	Very high	97.5	Very high	117 Å²	117	51.2 Å²	51.2	72%	0.718	30%	0.3	S	S	*	.			trans	-127.2	159.9	178.5	60.6	0	0	0	0	110.3	V127	V127-T129 HydrophobicContact CG1-CG2 4.4Å
130	G	96.6	Very high	97.5	Very high	28 Å²	28	50.2 Å²	50.2	29%	0.289	30%	0.296	S	S	.	.			trans	-161.4	179.3	176.4	0	0	0	0	0	112.1	R167	G130-R167 PolarHBondContact O-NH1 3.05Å
131	P	97.8	Very high	97.4	Very high	58 Å²	58	53.2 Å²	53.2	38%	0.377	31%	0.312	S	S	.	.			trans	-68	151	-170.3	31.6	-36.9	0	0	0	111.9	I133 R167	P131-I133 WeakPolarHBondContact CB-O 3.39Å; P131-R167 WeakPolarHBondContact O-CD 3.4Å; P131-R167 PolarHBondContact O-NH1 3.16Å
132	E	98.3	Very high	97.4	Very high	69 Å²	69	51.4 Å²	51.4	32%	0.322	29%	0.293	S	S	.	.	S	Bend	trans	-81.4	-31.1	172.5	-71.9	175.2	-179.5	0	0	111.9	R167 R192 Y194	E132-R167 PolarHBondContact O-N 3.19Å; E132-R192 WeakPolarHBondContact OE1-CD 3.33Å; E132-Y194 HydrophobicContact CB-CE2 4.12Å; E132-Y194 VanDerWaalsContact CD-OH 3.31Å; E132-Y194 HydrophobicContact CG-CE2 4.32Å; E132-Y194 PolarHBondContact OE2-OH 2.95Å
133	I	98.2	Very high	97.4	Very high	92 Å²	92	44.2 Å²	44.2	47%	0.472	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	116	168.5	-57.3	175.9	0	0	0	107.2	P131 F160 L165 L166	P131-I133 WeakPolarHBondContact CB-O 3.39Å; I133-F160 HydrophobicContact CB-CE2 4.47Å; I133-F160 HydrophobicContact CD1-CE2 4.17Å; I133-F160 HydrophobicContact CD1-CZ 4.13Å; I133-F160 HydrophobicContact CG1-CE2 3.88Å; I133-F160 HydrophobicContact CG1-CZ 4.17Å; I133-F160 HydrophobicContact CG2-CD2 4.16Å; I133-F160 HydrophobicContact CG2-CE2 3.97Å; I133-L165 CarbonylContact C-O 3.19Å; I133-L165 WeakPolarHBondContact CA-O 3.1Å; I133-L166 HydrophobicContact CG1-CD2 4.1Å
134	E	97.7	Very high	97.5	Very high	4 Å²	4	42.7 Å²	42.7	2%	0.019	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	161.6	179.3	-93.5	-66.7	-167.7	0	0	112.2	H138 N139 R164 L165 R167 R176	E134-H138 WeakPolarHBondContact OE2-CB 3.24Å; E134-H138 IonicContact OE2-CG 2.73Å; E134-N139 HydrophobicContact CB-CB 4.19Å; E134-R164 WeakPolarHBondContact O-CA 3.46Å; E134-L165 PolarHBondContact N-O 3.34Å; E134-L165 PolarHBondContact O-N 3.08Å; E134-R167 HydrophobicContact CB-CB 4.15Å; E134-R167 HydrophobicContact CG-CB 4.07Å; E134-R176 IonicContact OE1-CZ 2.83Å; E134-R176 IonicContact OE1-NE 3.43Å; E134-R176 PolarHBondContact OE1-NE 3.25Å; E134-R176 IonicContact OE1-NH2 3.71Å; E134-R176 PolarHBondContact OE1-NH2 2.71Å; E134-R176 IonicContact OE2-CZ 3.28Å; E134-R176 IonicContact OE2-NE 3.65Å; E134-R176 IonicContact OE2-NH2 3.64Å; E134-R176 PolarHBondContact OE2-NH2 2.83Å
135	D	97.4	Very high	97.5	Very high	50 Å²	50	41 Å²	41	27%	0.267	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	158	164.8	63.6	49.6	0	0	0	111.6	Y137 H138 N139 T163 R176	D135-Y137 PolarHBondContact O-N 3Å; D135-Y137 WeakPolarHBondContact OD1-CB 3.43Å; D135-Y137 PolarHBondContact OD1-N 2.81Å; D135-H138 PolarHBondContact O-N 3.3Å; D135-H138 WeakPolarHBondContact OD1-CB 3.26Å; D135-H138 IonicContact OD1-CE1 2.62Å; D135-H138 IonicContact OD1-CG 2.83Å; D135-H138 PolarHBondContact OD1-N 3.47Å; D135-H138 IonicContact OD1-ND1 3.15Å; D135-H138 PolarHBondContact OD1-ND1 3.37Å; D135-H138 IonicContact OD2-CE1 3.81Å; D135-H138 PolarHBondContact OD2-CE1 3.01Å; D135-H138 IonicContact OD2-ND1 2.71Å; D135-H138 PolarHBondContact OD2-ND1 3.08Å; D135-N139 WeakPolarHBondContact O-CB 3.49Å; D135-N139 PolarHBondContact O-N 2.81Å; D135-T163 CarbonylContact C-O 3.5Å; D135-T163 VanDerWaalsContact CA-O 3.25Å; D135-T163 WeakPolarHBondContact CA-O 3.31Å; D135-R176 IonicContact OD2-NH2 2.85Å
136	D	96.1	Very high	97.3	Very high	40 Å²	40	42.2 Å²	42.2	21%	0.214	24%	0.241	C	C	.	.	H	α-helix	trans	-59.3	-33.7	179.2	64.2	-26.2	0	0	0	112.9	F140 D141 W159 T163 L165	D136-F140 WeakPolarHBondContact O-CA 3.34Å; D136-F140 WeakPolarHBondContact O-CB 3.22Å; D136-F140 PolarHBondContact O-N 3.41Å; D136-D141 PolarHBondContact O-N 2.74Å; D136-D141 VanDerWaalsContact O-N 3.17Å; D136-W159 HydrophobicContact CB-CH2 3.95Å; D136-W159 HydrophobicContact CB-CZ3 4.08Å; D136-T163 PolarHBondContact N-O 2.83Å; D136-L165 HydrophobicContact CB-CD2 4.41Å
137	Y	97.2	Very high	97	Very high	70 Å²	70	40.9 Å²	40.9	28%	0.275	25%	0.245	S	C	.	.	H	α-helix	trans	-62.7	-51.5	176.9	173.3	-86.4	0	0	0	112.2	D135 D141 A142 I175 K179 N282	D135-Y137 PolarHBondContact O-N 3Å; D135-Y137 WeakPolarHBondContact OD1-CB 3.43Å; D135-Y137 PolarHBondContact OD1-N 2.81Å; Y137-D141 HydrophobicContact CD2-CB 4.01Å; Y137-D141 PolarHBondContact O-N 3.14Å; Y137-A142 HydrophobicContact CD1-CB 4.3Å; Y137-A142 HydrophobicContact CE1-CB 3.79Å; Y137-A142 HydrophobicContact CE2-CB 4.38Å; Y137-A142 VanDerWaalsContact O-CB 3.24Å; Y137-A142 WeakPolarHBondContact O-CB 3.46Å; Y137-A142 PolarHBondContact O-N 3.04Å; Y137-I175 HydrophobicContact CE1-CG2 4.47Å; Y137-K179 VanDerWaalsContact CZ-NZ 3.32Å; Y137-K179 VanDerWaalsContact OH-CE 3.29Å; Y137-K179 WeakPolarHBondContact OH-CE 3.28Å; Y137-K179 PolarHBondContact OH-NZ 2.79Å; Y137-N282 PolarHBondContact OH-O 2.71Å
138	H	98	Very high	96.7	Very high	19 Å²	19	45.5 Å²	45.5	9%	0.088	26%	0.261	C	S	.	.	H	α-helix	trans	-74.8	-33.8	-177.7	-68.3	91.2	0	0	0	112.1	E134 D135 R176	E134-H138 WeakPolarHBondContact OE2-CB 3.24Å; E134-H138 IonicContact OE2-CG 2.73Å; D135-H138 PolarHBondContact O-N 3.3Å; D135-H138 WeakPolarHBondContact OD1-CB 3.26Å; D135-H138 IonicContact OD1-CE1 2.62Å; D135-H138 IonicContact OD1-CG 2.83Å; D135-H138 PolarHBondContact OD1-N 3.47Å; D135-H138 IonicContact OD1-ND1 3.15Å; D135-H138 PolarHBondContact OD1-ND1 3.37Å; D135-H138 IonicContact OD2-CE1 3.81Å; D135-H138 PolarHBondContact OD2-CE1 3.01Å; D135-H138 IonicContact OD2-ND1 2.71Å; D135-H138 PolarHBondContact OD2-ND1 3.08Å; H138-R176 PolarHBondContact ND1-NH2 3.01Å
139	N	97.4	Very high	96.4	Very high	0 Å²	0	47 Å²	47	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-81.2	-24.7	179.6	-163.7	82.8	0	0	0	113.4	E134 D135 L143 L165 R167 T168 Q169	E134-N139 HydrophobicContact CB-CB 4.19Å; D135-N139 WeakPolarHBondContact O-CB 3.49Å; D135-N139 PolarHBondContact O-N 2.81Å; N139-L143 WeakPolarHBondContact O-CD1 3.34Å; N139-L165 HydrophobicContact CB-CD1 4.02Å; N139-L165 HydrophobicContact CB-CD2 4.37Å; N139-L165 WeakPolarHBondContact ND2-CD1 3.3Å; N139-R167 WeakPolarHBondContact OD1-CA 3.29Å; N139-T168 PolarHBondContact ND2-OG1 3.11Å; N139-T168 PolarHBondContact OD1-N 3Å; N139-Q169 PolarHBondContact O-NE2 2.89Å
140	F	97.4	Very high	96.1	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-136.7	-59.6	-175.3	-57.3	-65.7	0	0	0	115.7	D136 A142 L143 N144 I145 A151 R152 T157 W159 L165 T168	D136-F140 WeakPolarHBondContact O-CA 3.34Å; D136-F140 WeakPolarHBondContact O-CB 3.22Å; D136-F140 PolarHBondContact O-N 3.41Å; F140-A142 PolarHBondContact O-N 3.01Å; F140-L143 CarbonylContact O-C 3.53Å; F140-L143 WeakPolarHBondContact O-CA 3.31Å; F140-L143 WeakPolarHBondContact O-CB 3.4Å; F140-L143 PolarHBondContact O-N 2.76Å; F140-N144 PolarHBondContact O-N 3.47Å; F140-I145 HydrophobicContact CB-CB 4.07Å; F140-I145 HydrophobicContact CB-CG2 4.28Å; F140-I145 HydrophobicContact CD1-CB 4.36Å; F140-I145 HydrophobicContact CD1-CD1 3.74Å; F140-I145 HydrophobicContact CD1-CG2 4.02Å; F140-I145 WeakPolarHBondContact O-CB 3.34Å; F140-I145 PolarHBondContact O-N 3.16Å; F140-A151 HydrophobicContact CE1-CB 4.33Å; F140-R152 VanDerWaalsContact CB-CZ 3.41Å; F140-R152 HydrophobicContact CD1-CG 4.11Å; F140-R152 HydrophobicContact CD2-CG 3.92Å; F140-R152 HydrophobicContact CE1-CG 4.22Å; F140-R152 HydrophobicContact CE2-CG 4.01Å; F140-R152 HydrophobicContact CG-CG 3.96Å; F140-R152 HydrophobicContact CZ-CG 4.16Å; F140-T157 HydrophobicContact CZ-CG2 4.37Å; F140-W159 HydrophobicContact CD2-CH2 4.33Å; F140-W159 HydrophobicContact CD2-CZ2 4.49Å; F140-W159 HydrophobicContact CE2-CH2 4.02Å; F140-W159 AromaticContact CE2-CZ2 3.83Å; F140-W159 HydrophobicContact CE2-CZ2 3.83Å; F140-L165 HydrophobicContact CE2-CD1 3.65Å; F140-L165 HydrophobicContact CE2-CD2 4.41Å; F140-L165 HydrophobicContact CZ-CD1 4.08Å; F140-T168 HydrophobicContact CZ-CG2 4.35Å
141	D	96.7	Very high	95.7	Very high	63 Å²	63	45.4 Å²	45.4	34%	0.337	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-60.7	-46.9	-169.2	-65.4	-33.2	0	0	0	112.2	D136 Y137 L143 N144 R152	D136-D141 PolarHBondContact O-N 2.74Å; D136-D141 VanDerWaalsContact O-N 3.17Å; Y137-D141 HydrophobicContact CD2-CB 4.01Å; Y137-D141 PolarHBondContact O-N 3.14Å; D141-L143 PolarHBondContact O-N 2.88Å; D141-N144 PolarHBondContact O-N 2.99Å; D141-R152 IonicContact OD1-CZ 3.29Å; D141-R152 VanDerWaalsContact OD1-CZ 3.26Å; D141-R152 IonicContact OD1-NH1 2.9Å; D141-R152 PolarHBondContact OD1-NH1 3.05Å; D141-R152 IonicContact OD1-NH2 3Å; D141-R152 PolarHBondContact OD1-NH2 2.76Å
142	A	97.4	Very high	95.4	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-62.1	-26.2	179.7	0	0	0	0	0	112.2	Y137 F140 N144 I175 N282	Y137-A142 HydrophobicContact CD1-CB 4.3Å; Y137-A142 HydrophobicContact CE1-CB 3.79Å; Y137-A142 HydrophobicContact CE2-CB 4.38Å; Y137-A142 VanDerWaalsContact O-CB 3.24Å; Y137-A142 WeakPolarHBondContact O-CB 3.46Å; Y137-A142 PolarHBondContact O-N 3.04Å; F140-A142 PolarHBondContact O-N 3.01Å; A142-N144 VanDerWaalsContact C-N 3.27Å; A142-N144 PolarHBondContact O-N 2.91Å; A142-I175 HydrophobicContact CB-CB 4.44Å; A142-I175 HydrophobicContact CB-CD1 3.83Å; A142-I175 HydrophobicContact CB-CG1 3.87Å; A142-I175 HydrophobicContact CB-CG2 3.71Å; A142-N282 PolarHBondContact O-ND2 3.45Å
143	L	97.8	Very high	95	Very high	4 Å²	4	42.5 Å²	42.5	2%	0.021	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-88.7	15.7	177.4	-65.3	168.5	0	0	0	113.1	N139 F140 D141 I145 I175 F250 V279	N139-L143 WeakPolarHBondContact O-CD1 3.34Å; F140-L143 CarbonylContact O-C 3.53Å; F140-L143 WeakPolarHBondContact O-CA 3.31Å; F140-L143 WeakPolarHBondContact O-CB 3.4Å; F140-L143 PolarHBondContact O-N 2.76Å; D141-L143 PolarHBondContact O-N 2.88Å; L143-I145 HydrophobicContact CB-CD1 4.17Å; L143-I145 HydrophobicContact CB-CG1 4.21Å; L143-I145 PolarHBondContact O-N 2.77Å; L143-I145 VanDerWaalsContact O-N 3.13Å; L143-I175 HydrophobicContact CD2-CD1 3.77Å; L143-I175 HydrophobicContact CD2-CG1 3.96Å; L143-I175 HydrophobicContact CG-CD1 4.25Å; L143-I175 HydrophobicContact CG-CG1 4.16Å; L143-F250 HydrophobicContact CB-CB 4.11Å; L143-F250 HydrophobicContact CB-CD1 4.18Å; L143-F250 HydrophobicContact CD2-CB 4.15Å; L143-F250 WeakPolarHBondContact O-CA 3.48Å; L143-F250 WeakPolarHBondContact O-CB 3.13Å; L143-V279 HydrophobicContact CD2-CG1 4.43Å
144	N	97.4	Very high	94.3	Very high	47 Å²	47	44.2 Å²	44.2	25%	0.251	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	22.6	176.8	-168.8	65.3	0	0	0	112.9	F140 D141 A142 P249 N278 V279	F140-N144 PolarHBondContact O-N 3.47Å; D141-N144 PolarHBondContact O-N 2.99Å; A142-N144 VanDerWaalsContact C-N 3.27Å; A142-N144 PolarHBondContact O-N 2.91Å; N144-P249 WeakPolarHBondContact CB-O 3.18Å; N144-P249 PolarHBondContact ND2-O 3.29Å; N144-N278 HydrophobicContact CB-CB 4.37Å; N144-N278 WeakPolarHBondContact OD1-CB 3.34Å; N144-N278 PolarHBondContact OD1-ND2 3.08Å; N144-V279 HydrophobicContact CB-CG2 3.98Å
145	I	96.6	Very high	93.6	Very high	9 Å²	9	49.8 Å²	49.8	5%	0.046	28%	0.276	C	S	.	.			trans	-85.5	122.9	174.9	-61	174.7	0	0	0	107.4	F140 L143 H149 R152 P249 F250	F140-I145 HydrophobicContact CB-CB 4.07Å; F140-I145 HydrophobicContact CB-CG2 4.28Å; F140-I145 HydrophobicContact CD1-CB 4.36Å; F140-I145 HydrophobicContact CD1-CD1 3.74Å; F140-I145 HydrophobicContact CD1-CG2 4.02Å; F140-I145 WeakPolarHBondContact O-CB 3.34Å; F140-I145 PolarHBondContact O-N 3.16Å; L143-I145 HydrophobicContact CB-CD1 4.17Å; L143-I145 HydrophobicContact CB-CG1 4.21Å; L143-I145 PolarHBondContact O-N 2.77Å; L143-I145 VanDerWaalsContact O-N 3.13Å; I145-H149 HydrophobicContact CG2-CB 3.53Å; I145-R152 PolarHBondContact O-NH2 3.41Å; I145-P249 HydrophobicContact CG1-CB 3.81Å; I145-P249 HydrophobicContact CG1-CG 4.04Å; I145-F250 HydrophobicContact CD1-CD1 4.12Å; I145-F250 HydrophobicContact CD1-CE1 4.23Å; I145-F250 HydrophobicContact CG1-CD1 4.34Å
146	P	94.2	Very high	93.2	Very high	44 Å²	44	49.8 Å²	49.8	29%	0.286	28%	0.276	S	S	.	.			trans	-75.5	158.8	-178	29.2	-34.2	0	0	0	112.9	H148 H149 R152	P146-H148 PolarHBondContact O-N 2.84Å; P146-H148 VanDerWaalsContact O-N 3.14Å; P146-H149 HydrophobicContact CG-CB 4.1Å; P146-H149 WeakPolarHBondContact O-CB 3.49Å; P146-H149 PolarHBondContact O-N 3.08Å; P146-R152 WeakPolarHBondContact O-CD 3.48Å; P146-R152 PolarHBondContact O-NE 3.45Å; P146-R152 VanDerWaalsContact O-NE 3.14Å
147	G	91.4	Very high	93.1	Very high	59 Å²	59	48 Å²	48	61%	0.608	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-23.6	-179.9	0	0	0	0	0	115.6
148	H	91.8	Very high	93	Very high	167 Å²	167	47.7 Å²	47.7	77%	0.773	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	9.8	178	59.3	-91.6	0	0	0	113.3	P146	P146-H148 PolarHBondContact O-N 2.84Å; P146-H148 VanDerWaalsContact O-N 3.14Å
149	H	91.3	Very high	92.9	Very high	46 Å²	46	50 Å²	50	21%	0.213	28%	0.275	C	S	.	.			trans	-68.8	136.6	179.9	-168.1	-83.4	0	0	0	110.9	I145 P146 A151 R152	I145-H149 HydrophobicContact CG2-CB 3.53Å; P146-H149 HydrophobicContact CG-CB 4.1Å; P146-H149 WeakPolarHBondContact O-CB 3.49Å; P146-H149 PolarHBondContact O-N 3.08Å; H149-A151 VanDerWaalsContact C-N 3.26Å; H149-A151 VanDerWaalsContact ND1-CB 3.33Å; H149-A151 WeakPolarHBondContact ND1-CB 3.18Å; H149-A151 PolarHBondContact ND1-N 3.07Å; H149-A151 VanDerWaalsContact ND1-N 3.18Å; H149-A151 PolarHBondContact O-N 3.1Å; H149-A151 VanDerWaalsContact O-N 3.17Å; H149-R152 WeakPolarHBondContact O-CB 3.39Å; H149-R152 PolarHBondContact O-N 2.9Å
150	P	90.9	Very high	92.8	Very high	86 Å²	86	55.5 Å²	55.5	56%	0.558	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-51.4	-42.2	-178.3	-29	35	0	0	0	113.9	R152 A153	P150-R152 PolarHBondContact O-N 2.94Å; P150-A153 WeakPolarHBondContact O-CB 3.25Å; P150-A153 PolarHBondContact O-N 3.38Å
151	A	89.1	Confident	92.6	Very high	27 Å²	27	58.2 Å²	58.2	22%	0.223	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-57.1	-17.3	177.6	0	0	0	0	0	115.4	F140 H149 A153 T157	F140-A151 HydrophobicContact CE1-CB 4.33Å; H149-A151 VanDerWaalsContact C-N 3.26Å; H149-A151 VanDerWaalsContact ND1-CB 3.33Å; H149-A151 WeakPolarHBondContact ND1-CB 3.18Å; H149-A151 PolarHBondContact ND1-N 3.07Å; H149-A151 VanDerWaalsContact ND1-N 3.18Å; H149-A151 PolarHBondContact O-N 3.1Å; H149-A151 VanDerWaalsContact O-N 3.17Å; A151-A153 VanDerWaalsContact C-N 3.34Å; A151-T157 PolarHBondContact O-OG1 2.88Å
152	R	91.6	Very high	92.4	Very high	34 Å²	34	61.3 Å²	61.3	13%	0.128	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-83.7	-9.5	174.2	-66.1	-168.9	-179.1	-148.7	1.7	113.3	F140 D141 I145 P146 H149 P150 W159	F140-R152 VanDerWaalsContact CB-CZ 3.41Å; F140-R152 HydrophobicContact CD1-CG 4.11Å; F140-R152 HydrophobicContact CD2-CG 3.92Å; F140-R152 HydrophobicContact CE1-CG 4.22Å; F140-R152 HydrophobicContact CE2-CG 4.01Å; F140-R152 HydrophobicContact CG-CG 3.96Å; F140-R152 HydrophobicContact CZ-CG 4.16Å; D141-R152 IonicContact OD1-CZ 3.29Å; D141-R152 VanDerWaalsContact OD1-CZ 3.26Å; D141-R152 IonicContact OD1-NH1 2.9Å; D141-R152 PolarHBondContact OD1-NH1 3.05Å; D141-R152 IonicContact OD1-NH2 3Å; D141-R152 PolarHBondContact OD1-NH2 2.76Å; I145-R152 PolarHBondContact O-NH2 3.41Å; P146-R152 WeakPolarHBondContact O-CD 3.48Å; P146-R152 PolarHBondContact O-NE 3.45Å; P146-R152 VanDerWaalsContact O-NE 3.14Å; H149-R152 WeakPolarHBondContact O-CB 3.39Å; H149-R152 PolarHBondContact O-N 2.9Å; P150-R152 PolarHBondContact O-N 2.94Å; R152-W159 HydrophobicContact CB-CZ2 4.48Å; R152-W159 PolarHBondContact O-NE1 3.04Å
153	A	88.9	Confident	92.2	Very high	31 Å²	31	64.3 Å²	64.3	26%	0.256	35%	0.353	S	S	.	.	S	Bend	trans	-73.6	149.3	-177.5	0	0	0	0	0	112.1	P150 A151 H155 D156 T157	P150-A153 WeakPolarHBondContact O-CB 3.25Å; P150-A153 PolarHBondContact O-N 3.38Å; A151-A153 VanDerWaalsContact C-N 3.34Å; A153-H155 WeakPolarHBondContact CB-CE1 3.49Å; A153-H155 VanDerWaalsContact CB-ND1 3.32Å; A153-H155 WeakPolarHBondContact CB-ND1 3.33Å; A153-H155 PolarHBondContact O-N 2.68Å; A153-D156 PolarHBondContact O-N 2.9Å; A153-T157 PolarHBondContact O-N 3.42Å; A153-T157 VanDerWaalsContact O-N 3.16Å
154	D	83.4	Confident	92.2	Very high	129 Å²	129	70.5 Å²	70.5	69%	0.69	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-18.5	-177.9	-61.6	-15.2	0	0	0	114.3	W159	D154-W159 VanDerWaalsContact OD1-CD1 3.27Å
155	H	84	Confident	92.2	Very high	121 Å²	121	68.3 Å²	68.3	56%	0.56	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-18.5	176.9	64.1	-89.7	0	0	0	113.2	A153 N196	A153-H155 WeakPolarHBondContact CB-CE1 3.49Å; A153-H155 VanDerWaalsContact CB-ND1 3.32Å; A153-H155 WeakPolarHBondContact CB-ND1 3.33Å; A153-H155 PolarHBondContact O-N 2.68Å; H155-N196 VanDerWaalsContact O-CB 3.31Å; H155-N196 WeakPolarHBondContact O-CB 3.47Å; H155-N196 PolarHBondContact O-ND2 2.94Å
156	D	88.7	Confident	92.3	Very high	50 Å²	50	69.4 Å²	69.4	27%	0.267	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105	-37.4	179.4	-70.5	-21.8	0	0	0	111.9	A153 N196	A153-D156 PolarHBondContact O-N 2.9Å; D156-N196 PolarHBondContact O-N 2.83Å; D156-N196 VanDerWaalsContact O-N 3.11Å
157	T	93.6	Very high	92.5	Very high	2 Å²	2	67.9 Å²	67.9	1%	0.012	36%	0.359	C	S	.	.	S	Bend	trans	-115.2	135	-169.9	-67.8	0	0	0	0	112.3	F140 A151 A153 W159 L165 T168	F140-T157 HydrophobicContact CZ-CG2 4.37Å; A151-T157 PolarHBondContact O-OG1 2.88Å; A153-T157 PolarHBondContact O-N 3.42Å; A153-T157 VanDerWaalsContact O-N 3.16Å; T157-W159 HydrophobicContact CG2-CD2 4.32Å; T157-W159 HydrophobicContact CG2-CG 4.38Å; T157-W159 HydrophobicContact CG2-CZ2 4.37Å; T157-W159 VanDerWaalsContact O-CD1 3.31Å; T157-W159 PolarHBondContact O-N 3.09Å; T157-L165 HydrophobicContact CG2-CB 3.87Å; T157-L165 HydrophobicContact CG2-CD1 3.46Å; T157-L165 VanDerWaalsContact CG2-CD1 3.46Å; T157-L165 HydrophobicContact CG2-CG 4.3Å; T157-T168 HydrophobicContact CG2-CG2 4.04Å; T157-T168 VanDerWaalsContact OG1-CG2 3.23Å; T157-T168 WeakPolarHBondContact OG1-CG2 3.44Å
158	F	95.5	Very high	92.7	Very high	64 Å²	64	65.4 Å²	65.4	28%	0.281	33%	0.332	S	S	.	.			trans	-81	99.8	173.3	-63.1	-69.5	0	0	0	111.6	L165 L166 R195 N196 P204	F158-L165 CarbonylContact O-C 3.46Å; F158-L165 VanDerWaalsContact O-CA 3.26Å; F158-L165 WeakPolarHBondContact O-CA 3.19Å; F158-L165 WeakPolarHBondContact O-CB 3.36Å; F158-L166 HydrophobicContact CB-CB 4.19Å; F158-L166 HydrophobicContact CB-CD1 4Å; F158-L166 HydrophobicContact CB-CG 4.31Å; F158-L166 HydrophobicContact CD2-CD1 4.22Å; F158-L166 HydrophobicContact CG-CD1 4.34Å; F158-L166 PolarHBondContact O-N 3.19Å; F158-R195 VanDerWaalsContact CE2-O 3.3Å; F158-R195 WeakPolarHBondContact CE2-O 3.48Å; F158-N196 HydrophobicContact CE1-CB 4.05Å; F158-N196 HydrophobicContact CE2-CB 4.39Å; F158-N196 HydrophobicContact CZ-CB 3.87Å; F158-P204 HydrophobicContact CE2-CB 4.32Å; F158-P204 HydrophobicContact CZ-CB 4.23Å
159	W	95.3	Very high	92.9	Very high	67 Å²	67	58.4 Å²	58.4	25%	0.254	30%	0.3	S	S	.	.	B	Isolated β-bridge	trans	-87.6	140.5	175.2	-66.1	96.8	0	0	0	112.5	D136 F140 R152 D154 T157 L165	D136-W159 HydrophobicContact CB-CH2 3.95Å; D136-W159 HydrophobicContact CB-CZ3 4.08Å; F140-W159 HydrophobicContact CD2-CH2 4.33Å; F140-W159 HydrophobicContact CD2-CZ2 4.49Å; F140-W159 HydrophobicContact CE2-CH2 4.02Å; F140-W159 AromaticContact CE2-CZ2 3.83Å; F140-W159 HydrophobicContact CE2-CZ2 3.83Å; R152-W159 HydrophobicContact CB-CZ2 4.48Å; R152-W159 PolarHBondContact O-NE1 3.04Å; D154-W159 VanDerWaalsContact OD1-CD1 3.27Å; T157-W159 HydrophobicContact CG2-CD2 4.32Å; T157-W159 HydrophobicContact CG2-CG 4.38Å; T157-W159 HydrophobicContact CG2-CZ2 4.37Å; T157-W159 VanDerWaalsContact O-CD1 3.31Å; T157-W159 PolarHBondContact O-N 3.09Å; W159-L165 HydrophobicContact CD2-CB 4.07Å; W159-L165 HydrophobicContact CE3-CB 3.84Å; W159-L165 HydrophobicContact CE3-CD2 4.11Å; W159-L165 HydrophobicContact CH2-CD2 3.89Å; W159-L165 HydrophobicContact CZ3-CB 4.22Å; W159-L165 HydrophobicContact CZ3-CD2 3.59Å; W159-L165 HydrophobicContact CZ3-CG 4.44Å
160	F	95.4	Very high	93.3	Very high	115 Å²	115	56.3 Å²	56.3	50%	0.504	29%	0.29	S	S	.	.	S	Bend	trans	-93.6	-38.1	169.5	-67.6	-79.6	0	0	0	111.9	I133 R164 L166	I133-F160 HydrophobicContact CB-CE2 4.47Å; I133-F160 HydrophobicContact CD1-CE2 4.17Å; I133-F160 HydrophobicContact CD1-CZ 4.13Å; I133-F160 HydrophobicContact CG1-CE2 3.88Å; I133-F160 HydrophobicContact CG1-CZ 4.17Å; I133-F160 HydrophobicContact CG2-CD2 4.16Å; I133-F160 HydrophobicContact CG2-CE2 3.97Å; F160-R164 HydrophobicContact CB-CB 4.26Å; F160-R164 HydrophobicContact CD2-CB 4.49Å; F160-R164 PolarHBondContact N-O 2.82Å; F160-L166 HydrophobicContact CE2-CD2 3.87Å; F160-L166 HydrophobicContact CE2-CG 3.79Å; F160-L166 HydrophobicContact CZ-CD2 3.86Å; F160-L166 HydrophobicContact CZ-CG 3.91Å
161	D	94.4	Very high	93.6	Very high	57 Å²	57	52.3 Å²	52.3	31%	0.305	26%	0.264	S	S	.	.	S	Bend	trans	-156.5	-162.9	175	59.8	36.2	0	0	0	109.3	T163 R164	D161-T163 PolarHBondContact O-N 3.47Å; D161-T163 PolarHBondContact OD1-N 3.14Å; D161-T163 PolarHBondContact OD1-OG1 3.27Å; D161-R164 PolarHBondContact N-O 3.13Å; D161-R164 WeakPolarHBondContact OD1-CB 3.46Å; D161-R164 PolarHBondContact OD1-N 2.88Å; D161-R164 IonicContact OD1-NE 3.73Å; D161-R164 IonicContact OD2-CZ 2.75Å; D161-R164 IonicContact OD2-NE 3.44Å; D161-R164 PolarHBondContact OD2-NE 3.3Å; D161-R164 IonicContact OD2-NH2 3.85Å; D161-R164 PolarHBondContact OD2-NH2 2.81Å
162	T	91.7	Very high	94	Very high	128 Å²	128	51.2 Å²	51.2	79%	0.785	26%	0.255	S	S	*	.	S	Bend	trans	-65.6	-17.2	-176.8	52.3	0	0	0	0	115.1
163	T	94	Very high	94.3	Very high	64 Å²	64	49.8 Å²	49.8	39%	0.393	25%	0.25	S	S	.	.	S	Bend	trans	-129.2	-17.2	-176	60.3	0	0	0	0	114.1	D135 D136 D161	D135-T163 CarbonylContact C-O 3.5Å; D135-T163 VanDerWaalsContact CA-O 3.25Å; D135-T163 WeakPolarHBondContact CA-O 3.31Å; D136-T163 PolarHBondContact N-O 2.83Å; D161-T163 PolarHBondContact O-N 3.47Å; D161-T163 PolarHBondContact OD1-N 3.14Å; D161-T163 PolarHBondContact OD1-OG1 3.27Å
164	R	97	Very high	94.8	Very high	134 Å²	134	48.9 Å²	48.9	51%	0.506	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	136.5	-176.7	-62.7	-178.2	-66.4	167.4	2	111.8	E134 F160 D161	E134-R164 WeakPolarHBondContact O-CA 3.46Å; F160-R164 HydrophobicContact CB-CB 4.26Å; F160-R164 HydrophobicContact CD2-CB 4.49Å; F160-R164 PolarHBondContact N-O 2.82Å; D161-R164 PolarHBondContact N-O 3.13Å; D161-R164 WeakPolarHBondContact OD1-CB 3.46Å; D161-R164 PolarHBondContact OD1-N 2.88Å; D161-R164 IonicContact OD1-NE 3.73Å; D161-R164 IonicContact OD2-CZ 2.75Å; D161-R164 IonicContact OD2-NE 3.44Å; D161-R164 PolarHBondContact OD2-NE 3.3Å; D161-R164 IonicContact OD2-NH2 3.85Å; D161-R164 PolarHBondContact OD2-NH2 2.81Å
165	L	97.6	Very high	95.5	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	166.3	-178.8	61.6	145.8	0	0	0	111.8	I133 E134 D136 N139 F140 T157 F158 W159	I133-L165 CarbonylContact C-O 3.19Å; I133-L165 WeakPolarHBondContact CA-O 3.1Å; E134-L165 PolarHBondContact N-O 3.34Å; E134-L165 PolarHBondContact O-N 3.08Å; D136-L165 HydrophobicContact CB-CD2 4.41Å; N139-L165 HydrophobicContact CB-CD1 4.02Å; N139-L165 HydrophobicContact CB-CD2 4.37Å; N139-L165 WeakPolarHBondContact ND2-CD1 3.3Å; F140-L165 HydrophobicContact CE2-CD1 3.65Å; F140-L165 HydrophobicContact CE2-CD2 4.41Å; F140-L165 HydrophobicContact CZ-CD1 4.08Å; T157-L165 HydrophobicContact CG2-CB 3.87Å; T157-L165 HydrophobicContact CG2-CD1 3.46Å; T157-L165 VanDerWaalsContact CG2-CD1 3.46Å; T157-L165 HydrophobicContact CG2-CG 4.3Å; F158-L165 CarbonylContact O-C 3.46Å; F158-L165 VanDerWaalsContact O-CA 3.26Å; F158-L165 WeakPolarHBondContact O-CA 3.19Å; F158-L165 WeakPolarHBondContact O-CB 3.36Å; W159-L165 HydrophobicContact CD2-CB 4.07Å; W159-L165 HydrophobicContact CE3-CB 3.84Å; W159-L165 HydrophobicContact CE3-CD2 4.11Å; W159-L165 HydrophobicContact CH2-CD2 3.89Å; W159-L165 HydrophobicContact CZ3-CB 4.22Å; W159-L165 HydrophobicContact CZ3-CD2 3.59Å; W159-L165 HydrophobicContact CZ3-CG 4.44Å
166	L	98	Very high	96.1	Very high	33 Å²	33	41.2 Å²	41.2	17%	0.173	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	129.7	159.3	-68.9	174.8	0	0	0	109.2	I133 F158 F160 T168 Y194	I133-L166 HydrophobicContact CG1-CD2 4.1Å; F158-L166 HydrophobicContact CB-CB 4.19Å; F158-L166 HydrophobicContact CB-CD1 4Å; F158-L166 HydrophobicContact CB-CG 4.31Å; F158-L166 HydrophobicContact CD2-CD1 4.22Å; F158-L166 HydrophobicContact CG-CD1 4.34Å; F158-L166 PolarHBondContact O-N 3.19Å; F160-L166 HydrophobicContact CE2-CD2 3.87Å; F160-L166 HydrophobicContact CE2-CG 3.79Å; F160-L166 HydrophobicContact CZ-CD2 3.86Å; F160-L166 HydrophobicContact CZ-CG 3.91Å; L166-T168 PolarHBondContact O-N 3.2Å; L166-Y194 HydrophobicContact CB-CD2 3.69Å; L166-Y194 HydrophobicContact CB-CE2 4.44Å; L166-Y194 HydrophobicContact CB-CG 3.82Å; L166-Y194 HydrophobicContact CD1-CD1 3.84Å; L166-Y194 HydrophobicContact CD1-CD2 4.29Å; L166-Y194 HydrophobicContact CD1-CE1 4.24Å; L166-Y194 HydrophobicContact CD1-CG 3.86Å; L166-Y194 HydrophobicContact CD2-CD2 4.29Å; L166-Y194 HydrophobicContact CD2-CE2 4.22Å; L166-Y194 HydrophobicContact CG-CD2 4.32Å; L166-Y194 HydrophobicContact CG-CG 4.33Å
167	R	97.7	Very high	96.6	Very high	11 Å²	11	39.8 Å²	39.8	4%	0.042	19%	0.19	C	C	.	.			trans	-59.1	135.6	-175.7	71.7	-178.3	178.4	-156.6	-3.5	112.3	G130 P131 E132 E134 N139 Q169 R192 V193 Y194	G130-R167 PolarHBondContact O-NH1 3.05Å; P131-R167 WeakPolarHBondContact O-CD 3.4Å; P131-R167 PolarHBondContact O-NH1 3.16Å; E132-R167 PolarHBondContact O-N 3.19Å; E134-R167 HydrophobicContact CB-CB 4.15Å; E134-R167 HydrophobicContact CG-CB 4.07Å; N139-R167 WeakPolarHBondContact OD1-CA 3.29Å; R167-Q169 WeakPolarHBondContact CB-O 3.45Å; R167-Q169 WeakPolarHBondContact CD-O 3.43Å; R167-R192 VanDerWaalsContact CZ-O 3.23Å; R167-R192 PolarHBondContact NE-O 3.47Å; R167-R192 PolarHBondContact NH2-O 3.43Å; R167-V193 HydrophobicContact CG-CG1 4.38Å; R167-Y194 PolarHBondContact O-N 2.83Å
168	T	96.7	Very high	96.8	Very high	7 Å²	7	39.8 Å²	39.8	4%	0.043	19%	0.19	C	C	.	.	S	Bend	trans	-89.1	-15.8	178.8	53.3	0	0	0	0	113	N139 F140 T157 L166	N139-T168 PolarHBondContact ND2-OG1 3.11Å; N139-T168 PolarHBondContact OD1-N 3Å; F140-T168 HydrophobicContact CZ-CG2 4.35Å; T157-T168 HydrophobicContact CG2-CG2 4.04Å; T157-T168 VanDerWaalsContact OG1-CG2 3.23Å; T157-T168 WeakPolarHBondContact OG1-CG2 3.44Å; L166-T168 PolarHBondContact O-N 3.2Å
169	Q	96.9	Very high	96.9	Very high	21 Å²	21	41.5 Å²	41.5	10%	0.098	20%	0.197	C	C	.	.	S	Bend	trans	-151.2	164.8	179.1	53.3	-102.6	10	0	0	109.8	N139 R167 S171 E210	N139-Q169 PolarHBondContact O-NE2 2.89Å; R167-Q169 WeakPolarHBondContact CB-O 3.45Å; R167-Q169 WeakPolarHBondContact CD-O 3.43Å; Q169-S171 VanDerWaalsContact C-N 3.26Å; Q169-S171 WeakPolarHBondContact CG-OG 3.45Å; Q169-S171 PolarHBondContact O-N 2.97Å; Q169-E210 VanDerWaalsContact CB-OE1 3.26Å; Q169-E210 WeakPolarHBondContact CB-OE1 3.45Å
170	T	98.2	Very high	96.9	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.006	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	2.8	176.2	54.3	0	0	0	0	112.8	G172 V173 A189 V193 E210	T170-G172 PolarHBondContact O-N 2.74Å; T170-G172 VanDerWaalsContact O-N 3.12Å; T170-V173 VanDerWaalsContact O-CB 3.25Å; T170-V173 WeakPolarHBondContact O-CB 3.24Å; T170-V173 WeakPolarHBondContact O-CG2 3.28Å; T170-V173 PolarHBondContact O-N 2.84Å; T170-A189 WeakPolarHBondContact CB-O 3.25Å; T170-A189 PolarHBondContact OG1-O 2.86Å; T170-V193 HydrophobicContact CG2-CG1 3.83Å; T170-E210 PolarHBondContact N-OE1 2.83Å; T170-E210 WeakPolarHBondContact OG1-CB 3.43Å; T170-E210 VanDerWaalsContact OG1-CG 3.29Å; T170-E210 WeakPolarHBondContact OG1-CG 3.32Å; T170-E210 PolarHBondContact OG1-OE1 2.82Å; T170-E210 VanDerWaalsContact OG1-OE1 3.08Å
171	S	97.9	Very high	96.9	Very high	3 Å²	3	41.1 Å²	41.1	2%	0.021	22%	0.215	C	C	.	.	H	α-helix	trans	-59.7	-23.7	-177.2	-50.1	0	0	0	0	114.2	Q169 V173 Q174 I175 E210	Q169-S171 VanDerWaalsContact C-N 3.26Å; Q169-S171 WeakPolarHBondContact CG-OG 3.45Å; Q169-S171 PolarHBondContact O-N 2.97Å; S171-V173 PolarHBondContact O-N 3.25Å; S171-Q174 WeakPolarHBondContact O-CA 3.33Å; S171-Q174 VanDerWaalsContact O-CB 3.3Å; S171-Q174 WeakPolarHBondContact O-CB 3.45Å; S171-Q174 PolarHBondContact O-N 2.66Å; S171-I175 PolarHBondContact O-N 3.44Å; S171-E210 WeakPolarHBondContact CA-OE2 3.23Å; S171-E210 WeakPolarHBondContact CB-OE2 3.46Å; S171-E210 PolarHBondContact N-OE2 3.44Å; S171-E210 PolarHBondContact OG-OE1 2.9Å; S171-E210 PolarHBondContact OG-OE2 2.85Å
172	G	97.8	Very high	96.9	Very high	3 Å²	3	44 Å²	44	3%	0.031	23%	0.227	C	C	.	.	H	α-helix	trans	-57.4	-34.2	171.6	0	0	0	0	0	112.6	T170 Q174 I175 R176	T170-G172 PolarHBondContact O-N 2.74Å; T170-G172 VanDerWaalsContact O-N 3.12Å; G172-Q174 VanDerWaalsContact C-N 3.35Å; G172-Q174 PolarHBondContact O-N 2.75Å; G172-I175 PolarHBondContact O-N 2.8Å; G172-R176 VanDerWaalsContact O-CG 3.27Å; G172-R176 WeakPolarHBondContact O-CG 3.33Å; G172-R176 PolarHBondContact O-N 3.44Å
173	V	98.2	Very high	97.2	Very high	5 Å²	5	38.5 Å²	38.5	3%	0.03	19%	0.193	C	C	.	.	H	α-helix	trans	-62.4	-43.6	173.1	-174.4	0	0	0	0	110.6	A128 T170 S171 R176 T177 A189	A128-V173 HydrophobicContact CB-CG1 3.65Å; T170-V173 VanDerWaalsContact O-CB 3.25Å; T170-V173 WeakPolarHBondContact O-CB 3.24Å; T170-V173 WeakPolarHBondContact O-CG2 3.28Å; T170-V173 PolarHBondContact O-N 2.84Å; S171-V173 PolarHBondContact O-N 3.25Å; V173-R176 PolarHBondContact O-N 3.21Å; V173-T177 WeakPolarHBondContact O-CB 3.4Å; V173-T177 PolarHBondContact O-N 2.9Å; V173-T177 PolarHBondContact O-OG1 2.88Å; V173-A189 HydrophobicContact CB-CB 3.94Å; V173-A189 HydrophobicContact CG1-CB 3.99Å; V173-A189 HydrophobicContact CG2-CB 4.38Å
174	Q	98.1	Very high	97.3	Very high	11 Å²	11	39.6 Å²	39.6	5%	0.051	20%	0.202	C	C	.	.	H	α-helix	trans	-62.7	-44.2	178.4	-63.2	173.9	22.2	0	0	112.2	S171 G172 R176 T177 M178 I187 E210 L212	S171-Q174 WeakPolarHBondContact O-CA 3.33Å; S171-Q174 VanDerWaalsContact O-CB 3.3Å; S171-Q174 WeakPolarHBondContact O-CB 3.45Å; S171-Q174 PolarHBondContact O-N 2.66Å; G172-Q174 VanDerWaalsContact C-N 3.35Å; G172-Q174 PolarHBondContact O-N 2.75Å; Q174-R176 PolarHBondContact O-N 2.84Å; Q174-T177 PolarHBondContact O-N 3.21Å; Q174-M178 WeakPolarHBondContact O-CG 3.42Å; Q174-M178 PolarHBondContact O-N 2.56Å; Q174-I187 HydrophobicContact CG-CD1 4.15Å; Q174-E210 PolarHBondContact NE2-OE2 2.91Å; Q174-L212 HydrophobicContact CB-CD2 3.97Å; Q174-L212 HydrophobicContact CG-CB 4.03Å; Q174-L212 HydrophobicContact CG-CD2 4.28Å
175	I	98.2	Very high	97.4	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-59.3	-47.3	175.1	-63.1	-57.4	0	0	0	110.5	Y137 A142 L143 S171 G172 T177 M178 K179 V279 V283	Y137-I175 HydrophobicContact CE1-CG2 4.47Å; A142-I175 HydrophobicContact CB-CB 4.44Å; A142-I175 HydrophobicContact CB-CD1 3.83Å; A142-I175 HydrophobicContact CB-CG1 3.87Å; A142-I175 HydrophobicContact CB-CG2 3.71Å; L143-I175 HydrophobicContact CD2-CD1 3.77Å; L143-I175 HydrophobicContact CD2-CG1 3.96Å; L143-I175 HydrophobicContact CG-CD1 4.25Å; L143-I175 HydrophobicContact CG-CG1 4.16Å; S171-I175 PolarHBondContact O-N 3.44Å; G172-I175 PolarHBondContact O-N 2.8Å; I175-T177 VanDerWaalsContact C-N 3.34Å; I175-T177 PolarHBondContact O-N 2.98Å; I175-M178 HydrophobicContact CD1-CE 3.81Å; I175-M178 PolarHBondContact O-N 2.75Å; I175-K179 HydrophobicContact CG2-CD 4.48Å; I175-K179 WeakPolarHBondContact O-CG 3.32Å; I175-K179 PolarHBondContact O-N 2.87Å; I175-V279 HydrophobicContact CD1-CG1 3.88Å; I175-V283 HydrophobicContact CD1-CG1 4.12Å; I175-V283 HydrophobicContact CG2-CG1 3.91Å
176	R	98.2	Very high	97.4	Very high	89 Å²	89	38 Å²	38	34%	0.336	20%	0.196	S	C	.	.	H	α-helix	trans	-61.6	-41.9	178.1	-70.2	172.9	-174.6	-70.6	-2.4	111.6	E134 D135 H138 G172 V173 Q174 K179 A180	E134-R176 IonicContact OE1-CZ 2.83Å; E134-R176 IonicContact OE1-NE 3.43Å; E134-R176 PolarHBondContact OE1-NE 3.25Å; E134-R176 IonicContact OE1-NH2 3.71Å; E134-R176 PolarHBondContact OE1-NH2 2.71Å; E134-R176 IonicContact OE2-CZ 3.28Å; E134-R176 IonicContact OE2-NE 3.65Å; E134-R176 IonicContact OE2-NH2 3.64Å; E134-R176 PolarHBondContact OE2-NH2 2.83Å; D135-R176 IonicContact OD2-NH2 2.85Å; H138-R176 PolarHBondContact ND1-NH2 3.01Å; G172-R176 VanDerWaalsContact O-CG 3.27Å; G172-R176 WeakPolarHBondContact O-CG 3.33Å; G172-R176 PolarHBondContact O-N 3.44Å; V173-R176 PolarHBondContact O-N 3.21Å; Q174-R176 PolarHBondContact O-N 2.84Å; R176-K179 PolarHBondContact O-N 2.83Å; R176-A180 WeakPolarHBondContact O-CB 3.38Å; R176-A180 PolarHBondContact O-N 3.36Å; R176-A180 VanDerWaalsContact O-N 3.1Å
177	T	97.9	Very high	97.4	Very high	21 Å²	21	36.6 Å²	36.6	13%	0.129	19%	0.188	C	C	.	.	H	α-helix	trans	-62	-50.5	175.3	-62.3	0	0	0	0	111.5	V173 Q174 I175 K179 A180 Q181 I185 I187	V173-T177 WeakPolarHBondContact O-CB 3.4Å; V173-T177 PolarHBondContact O-N 2.9Å; V173-T177 PolarHBondContact O-OG1 2.88Å; Q174-T177 PolarHBondContact O-N 3.21Å; I175-T177 VanDerWaalsContact C-N 3.34Å; I175-T177 PolarHBondContact O-N 2.98Å; T177-K179 PolarHBondContact O-N 2.93Å; T177-A180 PolarHBondContact O-N 3.4Å; T177-Q181 HydrophobicContact CG2-CG 4.15Å; T177-Q181 WeakPolarHBondContact O-CG 3.46Å; T177-Q181 PolarHBondContact O-N 2.91Å; T177-I185 HydrophobicContact CG2-CG2 3.97Å; T177-I187 HydrophobicContact CG2-CD1 3.78Å; T177-I187 HydrophobicContact CG2-CG1 4.48Å; T177-I187 HydrophobicContact CG2-CG2 4.06Å; T177-I187 WeakPolarHBondContact OG1-CD1 3.26Å
178	M	97.9	Very high	97.5	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-63	-29.5	179.7	-69.5	-171.9	-71.6	0	0	113.3	Q174 I175 Q181 I185 L212 V214 V279 L280 V283 I285	Q174-M178 WeakPolarHBondContact O-CG 3.42Å; Q174-M178 PolarHBondContact O-N 2.56Å; I175-M178 HydrophobicContact CD1-CE 3.81Å; I175-M178 PolarHBondContact O-N 2.75Å; M178-Q181 VanDerWaalsContact O-O 3.11Å; M178-I185 HydrophobicContact CB-CD1 4.23Å; M178-I185 HydrophobicContact CG-CD1 3.75Å; M178-L212 HydrophobicContact CE-CD2 4.18Å; M178-L212 HydrophobicContact CG-CD2 3.76Å; M178-L212 HydrophobicContact SD-CD2 3.75Å; M178-V214 HydrophobicContact SD-CG2 4.09Å; M178-V279 HydrophobicContact CE-CG1 4.11Å; M178-L280 HydrophobicContact SD-CD2 4.08Å; M178-V283 HydrophobicContact CB-CB 3.95Å; M178-V283 HydrophobicContact CB-CG1 4.27Å; M178-V283 HydrophobicContact CB-CG2 3.6Å; M178-V283 HydrophobicContact CE-CG1 4.4Å; M178-V283 HydrophobicContact CE-CG2 4.13Å; M178-V283 HydrophobicContact CG-CG2 4.38Å; M178-V283 HydrophobicContact SD-CG2 3.99Å; M178-I285 HydrophobicContact CB-CD1 3.91Å; M178-I285 HydrophobicContact CG-CD1 4Å; M178-I285 HydrophobicContact SD-CD1 4.06Å
179	K	96.9	Very high	97.5	Very high	99 Å²	99	35.8 Å²	35.8	43%	0.43	19%	0.185	S	C	.	.	H	α-helix	trans	-72.5	-29.9	171.7	-75.4	-174.8	173.4	-170.3	0	113.5	Y137 I175 R176 T177 V283	Y137-K179 VanDerWaalsContact CZ-NZ 3.32Å; Y137-K179 VanDerWaalsContact OH-CE 3.29Å; Y137-K179 WeakPolarHBondContact OH-CE 3.28Å; Y137-K179 PolarHBondContact OH-NZ 2.79Å; I175-K179 HydrophobicContact CG2-CD 4.48Å; I175-K179 WeakPolarHBondContact O-CG 3.32Å; I175-K179 PolarHBondContact O-N 2.87Å; R176-K179 PolarHBondContact O-N 2.83Å; T177-K179 PolarHBondContact O-N 2.93Å; K179-V283 HydrophobicContact CG-CB 4.05Å; K179-V283 HydrophobicContact CG-CG1 3.96Å
180	A	96.9	Very high	97.6	Very high	89 Å²	89	35.8 Å²	35.8	74%	0.736	19%	0.186	S	C	*	.	H	α-helix	trans	-89.3	-25.1	-173.9	0	0	0	0	0	113.8	R176 T177	R176-A180 WeakPolarHBondContact O-CB 3.38Å; R176-A180 PolarHBondContact O-N 3.36Å; R176-A180 VanDerWaalsContact O-N 3.1Å; T177-A180 PolarHBondContact O-N 3.4Å
181	Q	95.3	Very high	97.6	Very high	85 Å²	85	36.4 Å²	36.4	40%	0.397	19%	0.193	S	C	.	.	S	Bend	trans	-140	146.9	-178.9	73.5	-173.5	6	0	0	111.6	T177 M178 I185	T177-Q181 HydrophobicContact CG2-CG 4.15Å; T177-Q181 WeakPolarHBondContact O-CG 3.46Å; T177-Q181 PolarHBondContact O-N 2.91Å; M178-Q181 VanDerWaalsContact O-O 3.11Å; Q181-I185 HydrophobicContact CG-CD1 3.91Å; Q181-I185 HydrophobicContact CG-CG1 3.86Å
182	Q	94.7	Very high	97.6	Very high	117 Å²	117	41.6 Å²	41.6	55%	0.547	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-82.6	153.8	172.9	-71.6	-67.2	-48.8	0	0	111
183	P	96.9	Very high	97.6	Very high	13 Å²	13	41.5 Å²	41.5	8%	0.084	21%	0.211	C	C	.	.	S	Bend	trans	-52	148.3	171.5	-27.9	37.1	0	0	0	114.1	V214 I285 Y290	P183-V214 HydrophobicContact CB-CG1 4.22Å; P183-V214 HydrophobicContact CG-CB 4.38Å; P183-V214 HydrophobicContact CG-CG1 3.7Å; P183-I285 HydrophobicContact CG-CD1 3.88Å; P183-I285 HydrophobicContact CG-CG1 4.23Å; P183-I285 HydrophobicContact CG-CG2 4.05Å; P183-Y290 HydrophobicContact CB-CD1 3.56Å; P183-Y290 HydrophobicContact CB-CE1 3.51Å; P183-Y290 HydrophobicContact CB-CG 4.11Å; P183-Y290 HydrophobicContact CG-CD1 3.94Å; P183-Y290 HydrophobicContact CG-CD2 4.18Å; P183-Y290 HydrophobicContact CG-CE1 4.13Å; P183-Y290 HydrophobicContact CG-CE2 4.35Å; P183-Y290 HydrophobicContact CG-CG 3.96Å
184	P	96.9	Very high	97.5	Very high	87 Å²	87	42.7 Å²	42.7	57%	0.565	22%	0.215	S	C	*	.	P	Polyproline II helix	cis	-77.9	136.9	8.7	31.2	-36	0	0	0	114	V214 D215	P184-V214 CarbonylContact C-O 3.19Å; P184-V214 WeakPolarHBondContact CA-O 3.45Å; P184-D215 HydrophobicContact CB-CB 4.34Å; P184-D215 WeakPolarHBondContact CB-OD2 3.25Å
185	I	98.1	Very high	97.3	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	129.5	177.2	-61.2	175.1	0	0	0	108.4	T177 M178 Q181 I187 L212 I213 V214 I285	T177-I185 HydrophobicContact CG2-CG2 3.97Å; M178-I185 HydrophobicContact CB-CD1 4.23Å; M178-I185 HydrophobicContact CG-CD1 3.75Å; Q181-I185 HydrophobicContact CG-CD1 3.91Å; Q181-I185 HydrophobicContact CG-CG1 3.86Å; I185-I187 HydrophobicContact CG2-CG1 4.2Å; I185-I187 HydrophobicContact CG2-CG2 4.18Å; I185-L212 HydrophobicContact CG2-CD2 4.26Å; I185-I213 CarbonylContact O-C 3.56Å; I185-I213 VanDerWaalsContact O-CA 3.23Å; I185-I213 WeakPolarHBondContact O-CA 3.5Å; I185-V214 HydrophobicContact CB-CB 4.35Å; I185-V214 PolarHBondContact N-O 2.98Å; I185-V214 PolarHBondContact O-N 3.28Å; I185-I285 HydrophobicContact CD1-CD1 4.34Å
186	R	98	Very high	96.7	Very high	102 Å²	102	50.4 Å²	50.4	39%	0.385	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	98.2	173.6	-64.5	178.7	-167.6	-178.6	4.8	108.8	F125 T126 L212 I213 D215	F125-R186 WeakPolarHBondContact CA-O 3.48Å; F125-R186 HydrophobicContact CD1-CB 4.09Å; F125-R186 HydrophobicContact CD2-CB 4.46Å; F125-R186 HydrophobicContact CE1-CB 4.36Å; F125-R186 HydrophobicContact CG-CB 4.14Å; T126-R186 PolarHBondContact N-O 2.96Å; T126-R186 PolarHBondContact OG1-O 3.05Å; R186-L212 WeakPolarHBondContact CA-O 3.49Å; R186-I213 HydrophobicContact CG-CD1 3.85Å; R186-I213 HydrophobicContact CG-CG1 3.84Å; R186-D215 IonicContact NH2-OD2 3.79Å; R186-D215 PolarHBondContact NH2-OD2 3.45Å; R186-D215 VanDerWaalsContact NH2-OD2 3.15Å
187	I	98.5	Very high	96	Very high	3 Å²	3	49.4 Å²	49.4	2%	0.015	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	150.7	-177.4	61.2	161.5	0	0	0	112.2	F125 T126 A128 Q174 T177 I185 G211 L212	F125-I187 WeakPolarHBondContact CD1-O 3.37Å; T126-I187 CarbonylContact O-C 3.59Å; T126-I187 WeakPolarHBondContact O-CA 3.4Å; A128-I187 HydrophobicContact CB-CB 4.12Å; A128-I187 HydrophobicContact CB-CD1 3.92Å; A128-I187 HydrophobicContact CB-CG2 4.25Å; Q174-I187 HydrophobicContact CG-CD1 4.15Å; T177-I187 HydrophobicContact CG2-CD1 3.78Å; T177-I187 HydrophobicContact CG2-CG1 4.48Å; T177-I187 HydrophobicContact CG2-CG2 4.06Å; T177-I187 WeakPolarHBondContact OG1-CD1 3.26Å; I185-I187 HydrophobicContact CG2-CG1 4.2Å; I185-I187 HydrophobicContact CG2-CG2 4.18Å; I187-G211 CarbonylContact O-C 3.37Å; I187-G211 VanDerWaalsContact O-CA 3.32Å; I187-G211 WeakPolarHBondContact O-CA 3.39Å; I187-L212 HydrophobicContact CG1-CB 4.02Å; I187-L212 PolarHBondContact N-O 2.73Å; I187-L212 PolarHBondContact O-N 2.75Å
188	I	98.5	Very high	95.2	Very high	1 Å²	1	56 Å²	56	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	140.3	160.2	54.2	169.6	0	0	0	108.7	E117 F120 F125 T126 V127 A128 P190 M209 E210	E117-I188 HydrophobicContact CB-CD1 4.15Å; E117-I188 HydrophobicContact CG-CD1 3.82Å; F120-I188 HydrophobicContact CB-CD1 4.05Å; F120-I188 HydrophobicContact CB-CG2 3.92Å; F120-I188 HydrophobicContact CD1-CG2 4.35Å; F120-I188 HydrophobicContact CD2-CG2 4.15Å; F120-I188 HydrophobicContact CG-CG2 3.89Å; F125-I188 HydrophobicContact CB-CG2 4.39Å; F125-I188 HydrophobicContact CD1-CG2 3.97Å; F125-I188 HydrophobicContact CG-CG2 4.43Å; T126-I188 PolarHBondContact O-N 3.26Å; V127-I188 CarbonylContact C-O 3.44Å; V127-I188 WeakPolarHBondContact CA-O 3.42Å; V127-I188 HydrophobicContact CG2-CD1 3.96Å; V127-I188 HydrophobicContact CG2-CG1 4Å; A128-I188 PolarHBondContact N-O 3.03Å; I188-P190 WeakPolarHBondContact O-CD 3.24Å; I188-M209 HydrophobicContact CB-CG 4.31Å; I188-M209 HydrophobicContact CB-SD 4.23Å; I188-M209 HydrophobicContact CD1-CE 4.29Å; I188-M209 HydrophobicContact CD1-SD 4.02Å; I188-E210 CarbonylContact C-O 3.55Å; I188-E210 WeakPolarHBondContact CA-O 3.48Å
189	A	98.3	Very high	94.5	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	86	-177.6	0	0	0	0	0	109.4	A128 T170 V173 E210	A128-A189 WeakPolarHBondContact O-CA 3.5Å; T170-A189 WeakPolarHBondContact CB-O 3.25Å; T170-A189 PolarHBondContact OG1-O 2.86Å; V173-A189 HydrophobicContact CB-CB 3.94Å; V173-A189 HydrophobicContact CG1-CB 3.99Å; V173-A189 HydrophobicContact CG2-CB 4.38Å; A189-E210 PolarHBondContact N-O 2.87Å; A189-E210 PolarHBondContact O-N 3.14Å
190	P	98.2	Very high	93.4	Very high	21 Å²	21	60.5 Å²	60.5	14%	0.136	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	142.7	169.5	27.3	-26	0	0	0	110.7	I113 E117 V127 I188 Q208 M209	I113-P190 HydrophobicContact CG2-CB 4.11Å; E117-P190 VanDerWaalsContact OE1-CG 3.25Å; E117-P190 WeakPolarHBondContact OE1-CG 3.49Å; V127-P190 HydrophobicContact CG1-CG 3.87Å; I188-P190 WeakPolarHBondContact O-CD 3.24Å; P190-Q208 CarbonylContact C-O 3.57Å; P190-Q208 WeakPolarHBondContact CA-O 3.44Å; P190-M209 HydrophobicContact CB-CE 3.77Å; P190-M209 HydrophobicContact CB-CG 4.3Å; P190-M209 HydrophobicContact CG-CE 4.18Å
191	G	97.7	Very high	92.6	Very high	14 Å²	14	59.9 Å²	59.9	14%	0.144	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.7	166.2	174.7	0	0	0	0	0	114.4	H207 Q208	G191-H207 WeakPolarHBondContact O-CA 3.26Å; G191-Q208 PolarHBondContact N-O 2.69Å; G191-Q208 PolarHBondContact O-N 2.95Å
192	R	97.7	Very high	92.1	Very high	112 Å²	112	60 Å²	60	42%	0.423	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	139.1	170.1	-65.7	177.9	-175.1	162.1	0.4	110.8	E132 R167 Y194 M205 F206 H207	E132-R192 WeakPolarHBondContact OE1-CD 3.33Å; R167-R192 VanDerWaalsContact CZ-O 3.23Å; R167-R192 PolarHBondContact NE-O 3.47Å; R167-R192 PolarHBondContact NH2-O 3.43Å; R192-Y194 HydrophobicContact CB-CE2 4.26Å; R192-M205 HydrophobicContact CB-CG 4.31Å; R192-M205 HydrophobicContact CB-SD 4.28Å; R192-M205 HydrophobicContact CG-CG 4.48Å; R192-M205 HydrophobicContact CG-SD 3.87Å; R192-F206 CarbonylContact C-O 3.59Å; R192-F206 WeakPolarHBondContact CA-O 3.33Å; R192-H207 WeakPolarHBondContact CG-NE2 3.48Å
193	V	97.6	Very high	91.9	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	159.9	176.4	-65.1	0	0	0	0	108.8	R167 T170 M205 F206 Q208	R167-V193 HydrophobicContact CG-CG1 4.38Å; T170-V193 HydrophobicContact CG2-CG1 3.83Å; V193-M205 WeakPolarHBondContact O-CA 3.26Å; V193-F206 HydrophobicContact CB-CZ 4.38Å; V193-F206 HydrophobicContact CG2-CD1 4.01Å; V193-F206 HydrophobicContact CG2-CD2 3.5Å; V193-F206 VanDerWaalsContact CG2-CD2 3.5Å; V193-F206 HydrophobicContact CG2-CE1 3.71Å; V193-F206 HydrophobicContact CG2-CE2 3.17Å; V193-F206 HydrophobicContact CG2-CG 3.9Å; V193-F206 HydrophobicContact CG2-CZ 3.27Å; V193-F206 PolarHBondContact N-O 3.5Å; V193-F206 PolarHBondContact O-N 3.2Å; V193-Q208 HydrophobicContact CG1-CB 4Å; V193-Q208 HydrophobicContact CG2-CB 3.77Å
194	Y	97.2	Very high	91.7	Very high	30 Å²	30	56.3 Å²	56.3	12%	0.118	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	137.8	-168.6	-53.3	-97	0	0	0	111.5	E132 L166 R167 R192 P204 M205	E132-Y194 HydrophobicContact CB-CE2 4.12Å; E132-Y194 VanDerWaalsContact CD-OH 3.31Å; E132-Y194 HydrophobicContact CG-CE2 4.32Å; E132-Y194 PolarHBondContact OE2-OH 2.95Å; L166-Y194 HydrophobicContact CB-CD2 3.69Å; L166-Y194 HydrophobicContact CB-CE2 4.44Å; L166-Y194 HydrophobicContact CB-CG 3.82Å; L166-Y194 HydrophobicContact CD1-CD1 3.84Å; L166-Y194 HydrophobicContact CD1-CD2 4.29Å; L166-Y194 HydrophobicContact CD1-CE1 4.24Å; L166-Y194 HydrophobicContact CD1-CG 3.86Å; L166-Y194 HydrophobicContact CD2-CD2 4.29Å; L166-Y194 HydrophobicContact CD2-CE2 4.22Å; L166-Y194 HydrophobicContact CG-CD2 4.32Å; L166-Y194 HydrophobicContact CG-CG 4.33Å; R167-Y194 PolarHBondContact O-N 2.83Å; R192-Y194 HydrophobicContact CB-CE2 4.26Å; Y194-P204 WeakPolarHBondContact CA-O 3.4Å; Y194-M205 HydrophobicContact CD1-CB 3.84Å; Y194-M205 HydrophobicContact CD1-CG 3.93Å; Y194-M205 HydrophobicContact CE1-CB 3.79Å; Y194-M205 HydrophobicContact CE1-CG 3.47Å; Y194-M205 VanDerWaalsContact CE1-CG 3.47Å
195	R	93.2	Very high	91.6	Very high	96 Å²	96	54.5 Å²	54.5	36%	0.362	26%	0.257	S	S	.	.			trans	-144.6	151.6	174.5	-68.1	-177.3	-169.1	169.7	5.1	108.9	F158 D197 P204 F206	F158-R195 VanDerWaalsContact CE2-O 3.3Å; F158-R195 WeakPolarHBondContact CE2-O 3.48Å; R195-D197 PolarHBondContact O-N 2.7Å; R195-P204 PolarHBondContact N-O 2.9Å; R195-P204 VanDerWaalsContact N-O 3.1Å; R195-P204 WeakPolarHBondContact O-CA 3.38Å; R195-F206 HydrophobicContact CB-CE1 4.28Å; R195-F206 HydrophobicContact CG-CE1 3.9Å; R195-F206 HydrophobicContact CG-CZ 4.33Å
196	N	86.9	Confident	91.5	Very high	78 Å²	78	55.8 Å²	55.8	42%	0.417	26%	0.263	S	S	.	.	S	Bend	trans	-86.6	52.1	-176.8	-169.4	18.6	0	0	0	113.1	H155 D156 F158	H155-N196 VanDerWaalsContact O-CB 3.31Å; H155-N196 WeakPolarHBondContact O-CB 3.47Å; H155-N196 PolarHBondContact O-ND2 2.94Å; D156-N196 PolarHBondContact O-N 2.83Å; D156-N196 VanDerWaalsContact O-N 3.11Å; F158-N196 HydrophobicContact CE1-CB 4.05Å; F158-N196 HydrophobicContact CE2-CB 4.39Å; F158-N196 HydrophobicContact CZ-CB 3.87Å
197	D	82.5	Confident	91.5	Very high	68 Å²	68	52.6 Å²	52.6	36%	0.364	25%	0.252	S	S	.	.			trans	-125.5	138.5	-179	-61.8	-43.9	0	0	0	111	R195 H202 T203 P204	R195-D197 PolarHBondContact O-N 2.7Å; D197-H202 HydrophobicContact CB-CB 3.8Å; D197-T203 CarbonylContact O-C 3.52Å; D197-P204 WeakPolarHBondContact O-CD 3.43Å; D197-P204 WeakPolarHBondContact O-CG 3.31Å; D197-P204 VanDerWaalsContact O-N 3.08Å
198	Y	81.6	Confident	91.4	Very high	160 Å²	160	53.5 Å²	53.5	63%	0.627	26%	0.256	S	S	*	.			trans	-143.5	106	174.8	-170.2	-81	0	0	0	111.3	H202 P204	Y198-H202 WeakPolarHBondContact CA-O 3.23Å; Y198-P204 HydrophobicContact CD2-CG 3.81Å; Y198-P204 HydrophobicContact CG-CG 4.46Å
199	D	81.8	Confident	91.4	Very high	67 Å²	67	53.4 Å²	53.4	36%	0.358	26%	0.256	S	S	.	.	S	Bend	trans	-150.7	-161.2	172.4	67	39.1	0	0	0	111.8	T201 H202	D199-T201 PolarHBondContact O-N 3.17Å; D199-T201 WeakPolarHBondContact OD1-CA 3.46Å; D199-T201 PolarHBondContact OD1-N 2.72Å; D199-T201 PolarHBondContact OD1-OG1 3.02Å; D199-H202 VanDerWaalsContact CG-ND1 3.25Å; D199-H202 PolarHBondContact N-O 3.18Å; D199-H202 IonicContact OD1-CG 3.82Å; D199-H202 PolarHBondContact OD1-N 2.91Å; D199-H202 IonicContact OD1-ND1 3.11Å; D199-H202 PolarHBondContact OD1-ND1 3.21Å; D199-H202 IonicContact OD2-CE1 3.15Å; D199-H202 IonicContact OD2-CG 3.61Å; D199-H202 IonicContact OD2-ND1 3.15Å; D199-H202 PolarHBondContact OD2-ND1 2.92Å
200	Q	75.4	Confident	91.4	Very high	127 Å²	127	53.8 Å²	53.8	59%	0.593	26%	0.258	S	S	*	.	S	Bend	trans	-69.1	-21.7	179.7	-66.9	-178.1	-9.7	0	0	113.8	L312	Q200-L312 WeakPolarHBondContact O-CB 3.37Å; Q200-L312 PolarHBondContact O-N 3.08Å
201	T	79.8	Confident	91.4	Very high	76 Å²	76	52.8 Å²	52.8	47%	0.466	25%	0.251	S	S	.	.	S	Bend	trans	-118.2	-10.5	-174.2	48.7	0	0	0	0	113.5	D199	D199-T201 PolarHBondContact O-N 3.17Å; D199-T201 WeakPolarHBondContact OD1-CA 3.46Å; D199-T201 PolarHBondContact OD1-N 2.72Å; D199-T201 PolarHBondContact OD1-OG1 3.02Å
202	H	85.2	Confident	91.5	Very high	89 Å²	89	52.2 Å²	52.2	41%	0.412	25%	0.245	S	C	.	.			trans	-129.5	136.7	-179.4	-54.7	101.2	0	0	0	110.6	D197 Y198 D199	D197-H202 HydrophobicContact CB-CB 3.8Å; Y198-H202 WeakPolarHBondContact CA-O 3.23Å; D199-H202 VanDerWaalsContact CG-ND1 3.25Å; D199-H202 PolarHBondContact N-O 3.18Å; D199-H202 IonicContact OD1-CG 3.82Å; D199-H202 PolarHBondContact OD1-N 2.91Å; D199-H202 IonicContact OD1-ND1 3.11Å; D199-H202 PolarHBondContact OD1-ND1 3.21Å; D199-H202 IonicContact OD2-CE1 3.15Å; D199-H202 IonicContact OD2-CG 3.61Å; D199-H202 IonicContact OD2-ND1 3.15Å; D199-H202 PolarHBondContact OD2-ND1 2.92Å
203	T	89.8	Confident	91.5	Very high	9 Å²	9	47.5 Å²	47.5	6%	0.055	23%	0.228	C	C	.	.			trans	-126.9	151	170.3	47.7	0	0	0	0	110.6	D197 M205 L312 F316	D197-T203 CarbonylContact O-C 3.52Å; T203-M205 WeakPolarHBondContact CB-O 3.25Å; T203-M205 PolarHBondContact O-N 2.81Å; T203-M205 VanDerWaalsContact O-N 3.14Å; T203-M205 PolarHBondContact OG1-O 3.03Å; T203-L312 HydrophobicContact CG2-CD2 3.23Å; T203-L312 WeakPolarHBondContact OG1-CD2 2.9Å; T203-F316 HydrophobicContact CG2-CD2 3.8Å; T203-F316 HydrophobicContact CG2-CE2 3.89Å; T203-F316 WeakPolarHBondContact OG1-CE2 3.4Å
204	P	93.2	Very high	91.5	Very high	42 Å²	42	47.5 Å²	47.5	27%	0.273	23%	0.228	S	C	.	.	S	Bend	trans	-66.1	-21.7	-176.6	-25.1	32.4	0	0	0	114.2	F158 Y194 R195 D197 Y198	F158-P204 HydrophobicContact CE2-CB 4.32Å; F158-P204 HydrophobicContact CZ-CB 4.23Å; Y194-P204 WeakPolarHBondContact CA-O 3.4Å; R195-P204 PolarHBondContact N-O 2.9Å; R195-P204 VanDerWaalsContact N-O 3.1Å; R195-P204 WeakPolarHBondContact O-CA 3.38Å; D197-P204 WeakPolarHBondContact O-CD 3.43Å; D197-P204 WeakPolarHBondContact O-CG 3.31Å; D197-P204 VanDerWaalsContact O-N 3.08Å; Y198-P204 HydrophobicContact CD2-CG 3.81Å; Y198-P204 HydrophobicContact CG-CG 4.46Å
205	M	95.1	Very high	91.5	Very high	50 Å²	50	47.4 Å²	47.4	25%	0.246	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	132.2	170.1	-177.9	-85.4	-67.5	0	0	107.7	R192 V193 Y194 T203 F316	R192-M205 HydrophobicContact CB-CG 4.31Å; R192-M205 HydrophobicContact CB-SD 4.28Å; R192-M205 HydrophobicContact CG-CG 4.48Å; R192-M205 HydrophobicContact CG-SD 3.87Å; V193-M205 WeakPolarHBondContact O-CA 3.26Å; Y194-M205 HydrophobicContact CD1-CB 3.84Å; Y194-M205 HydrophobicContact CD1-CG 3.93Å; Y194-M205 HydrophobicContact CE1-CB 3.79Å; Y194-M205 HydrophobicContact CE1-CG 3.47Å; Y194-M205 VanDerWaalsContact CE1-CG 3.47Å; T203-M205 WeakPolarHBondContact CB-O 3.25Å; T203-M205 PolarHBondContact O-N 2.81Å; T203-M205 VanDerWaalsContact O-N 3.14Å; T203-M205 PolarHBondContact OG1-O 3.03Å; M205-F316 HydrophobicContact CE-CD1 3.83Å; M205-F316 HydrophobicContact CE-CE1 3.55Å; M205-F316 VanDerWaalsContact O-CE1 3.28Å; M205-F316 WeakPolarHBondContact O-CE1 3.47Å; M205-F316 WeakPolarHBondContact O-CZ 3.29Å; M205-F316 HydrophobicContact SD-CE1 3.84Å
206	F	95.8	Very high	91.7	Very high	27 Å²	27	46 Å²	46	12%	0.118	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	173.2	175.5	63.3	-82.3	0	0	0	109.2	R192 V193 R195 Q208 E300	R192-F206 CarbonylContact C-O 3.59Å; R192-F206 WeakPolarHBondContact CA-O 3.33Å; V193-F206 HydrophobicContact CB-CZ 4.38Å; V193-F206 HydrophobicContact CG2-CD1 4.01Å; V193-F206 HydrophobicContact CG2-CD2 3.5Å; V193-F206 VanDerWaalsContact CG2-CD2 3.5Å; V193-F206 HydrophobicContact CG2-CE1 3.71Å; V193-F206 HydrophobicContact CG2-CE2 3.17Å; V193-F206 HydrophobicContact CG2-CG 3.9Å; V193-F206 HydrophobicContact CG2-CZ 3.27Å; V193-F206 PolarHBondContact N-O 3.5Å; V193-F206 PolarHBondContact O-N 3.2Å; R195-F206 HydrophobicContact CB-CE1 4.28Å; R195-F206 HydrophobicContact CG-CE1 3.9Å; R195-F206 HydrophobicContact CG-CZ 4.33Å; F206-Q208 HydrophobicContact CE2-CB 4.48Å; F206-E300 WeakPolarHBondContact CB-OE2 3.15Å
207	H	97.6	Very high	92	Very high	34 Å²	34	49.2 Å²	49.2	16%	0.157	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	132	-179.9	-57.3	77	0	0	0	109.7	V109 I113 G191 R192 M299 E300	V109-H207 HydrophobicContact CG1-CB 4.16Å; I113-H207 HydrophobicContact CD1-CB 4.44Å; G191-H207 WeakPolarHBondContact O-CA 3.26Å; R192-H207 WeakPolarHBondContact CG-NE2 3.48Å; H207-M299 HydrophobicContact CB-CB 3.85Å; H207-M299 HydrophobicContact CB-CG 3.76Å; H207-M299 WeakPolarHBondContact O-CB 3.4Å; H207-M299 WeakPolarHBondContact O-CG 3.29Å; H207-M299 PolarHBondContact O-N 3.5Å; H207-E300 IonicContact CE1-OE1 3.09Å; H207-E300 IonicContact CG-OE1 3.11Å; H207-E300 VanDerWaalsContact N-CD 3.32Å; H207-E300 PolarHBondContact N-OE1 3.5Å; H207-E300 PolarHBondContact N-OE2 2.75Å; H207-E300 IonicContact ND1-OE1 2.66Å; H207-E300 PolarHBondContact ND1-OE1 2.75Å; H207-E300 VanDerWaalsContact O-OE2 3.13Å
208	Q	97	Very high	92.7	Very high	22 Å²	22	47 Å²	47	10%	0.103	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	146	174.3	-166.5	163	-49.3	0	0	108.6	P190 G191 V193 F206 E210	P190-Q208 CarbonylContact C-O 3.57Å; P190-Q208 WeakPolarHBondContact CA-O 3.44Å; G191-Q208 PolarHBondContact N-O 2.69Å; G191-Q208 PolarHBondContact O-N 2.95Å; V193-Q208 HydrophobicContact CG1-CB 4Å; V193-Q208 HydrophobicContact CG2-CB 3.77Å; F206-Q208 HydrophobicContact CE2-CB 4.48Å; Q208-E210 HydrophobicContact CG-CG 4.21Å; Q208-E210 PolarHBondContact NE2-OE1 2.87Å
209	M	97.9	Very high	93.5	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	126.3	165.4	-173.5	-177.7	-74.2	0	0	108.1	I113 I116 E117 I188 P190 M297 M299	I113-M209 HydrophobicContact CG2-CE 3.99Å; I116-M209 HydrophobicContact CB-CE 4.02Å; I116-M209 HydrophobicContact CB-SD 3.97Å; I116-M209 HydrophobicContact CG2-CE 3.99Å; I116-M209 HydrophobicContact CG2-SD 3.25Å; I116-M209 WeakPolarHBondContact CG2-SD 3.37Å; E117-M209 HydrophobicContact CG-CE 3.72Å; I188-M209 HydrophobicContact CB-CG 4.31Å; I188-M209 HydrophobicContact CB-SD 4.23Å; I188-M209 HydrophobicContact CD1-CE 4.29Å; I188-M209 HydrophobicContact CD1-SD 4.02Å; P190-M209 HydrophobicContact CB-CE 3.77Å; P190-M209 HydrophobicContact CB-CG 4.3Å; P190-M209 HydrophobicContact CG-CE 4.18Å; M209-M297 HydrophobicContact CB-CG 4.4Å; M209-M297 PolarHBondContact N-O 3Å; M209-M297 PolarHBondContact O-N 3.4Å; M209-M299 HydrophobicContact CB-CE 3.38Å; M209-M299 HydrophobicContact CB-SD 3.87Å; M209-M299 HydrophobicContact CE-SD 4.4Å
210	E	98.5	Very high	94.2	Very high	8 Å²	8	41 Å²	41	4%	0.037	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	136.7	173.4	-64.6	167	-149.1	0	0	111.4	Q169 T170 S171 Q174 I188 A189 Q208 F295	Q169-E210 VanDerWaalsContact CB-OE1 3.26Å; Q169-E210 WeakPolarHBondContact CB-OE1 3.45Å; T170-E210 PolarHBondContact N-OE1 2.83Å; T170-E210 WeakPolarHBondContact OG1-CB 3.43Å; T170-E210 VanDerWaalsContact OG1-CG 3.29Å; T170-E210 WeakPolarHBondContact OG1-CG 3.32Å; T170-E210 PolarHBondContact OG1-OE1 2.82Å; T170-E210 VanDerWaalsContact OG1-OE1 3.08Å; S171-E210 WeakPolarHBondContact CA-OE2 3.23Å; S171-E210 WeakPolarHBondContact CB-OE2 3.46Å; S171-E210 PolarHBondContact N-OE2 3.44Å; S171-E210 PolarHBondContact OG-OE1 2.9Å; S171-E210 PolarHBondContact OG-OE2 2.85Å; Q174-E210 PolarHBondContact NE2-OE2 2.91Å; I188-E210 CarbonylContact C-O 3.55Å; I188-E210 WeakPolarHBondContact CA-O 3.48Å; A189-E210 PolarHBondContact N-O 2.87Å; A189-E210 PolarHBondContact O-N 3.14Å; Q208-E210 HydrophobicContact CG-CG 4.21Å; Q208-E210 PolarHBondContact NE2-OE1 2.87Å; E210-F295 CarbonylContact C-O 3.54Å; E210-F295 WeakPolarHBondContact CA-O 3.44Å; E210-F295 WeakPolarHBondContact CB-O 3.43Å
211	G	98.2	Very high	95.3	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	148.5	172.2	0	0	0	0	0	111.9	I187 A294 F295	I187-G211 CarbonylContact O-C 3.37Å; I187-G211 VanDerWaalsContact O-CA 3.32Å; I187-G211 WeakPolarHBondContact O-CA 3.39Å; G211-A294 WeakPolarHBondContact O-CA 3.45Å; G211-F295 VanDerWaalsContact CA-CZ 3.49Å; G211-F295 PolarHBondContact N-O 3.1Å; G211-F295 PolarHBondContact O-N 3Å
212	L	98.5	Very high	96.1	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	131	173	174.4	71.5	0	0	0	109.2	Q174 M178 I185 R186 I187 V214 V275 A294	Q174-L212 HydrophobicContact CB-CD2 3.97Å; Q174-L212 HydrophobicContact CG-CB 4.03Å; Q174-L212 HydrophobicContact CG-CD2 4.28Å; M178-L212 HydrophobicContact CE-CD2 4.18Å; M178-L212 HydrophobicContact CG-CD2 3.76Å; M178-L212 HydrophobicContact SD-CD2 3.75Å; I185-L212 HydrophobicContact CG2-CD2 4.26Å; R186-L212 WeakPolarHBondContact CA-O 3.49Å; I187-L212 HydrophobicContact CG1-CB 4.02Å; I187-L212 PolarHBondContact N-O 2.73Å; I187-L212 PolarHBondContact O-N 2.75Å; L212-V214 HydrophobicContact CD1-CG2 3.76Å; L212-V214 HydrophobicContact CD2-CG2 4.12Å; L212-V214 HydrophobicContact CG-CG2 3.97Å; L212-V275 HydrophobicContact CD1-CG2 3.6Å; L212-A294 HydrophobicContact CD1-CB 4.25Å
213	I	98.2	Very high	96.7	Very high	13 Å²	13	35.7 Å²	35.7	7%	0.067	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	134	160.7	-174.2	162.9	0	0	0	109.7	F125 I185 R186 I218 G292 F293	F125-I213 HydrophobicContact CZ-CB 4.43Å; I185-I213 CarbonylContact O-C 3.56Å; I185-I213 VanDerWaalsContact O-CA 3.23Å; I185-I213 WeakPolarHBondContact O-CA 3.5Å; R186-I213 HydrophobicContact CG-CD1 3.85Å; R186-I213 HydrophobicContact CG-CG1 3.84Å; I213-I218 HydrophobicContact CD1-CD1 3.87Å; I213-I218 HydrophobicContact CG1-CD1 4.14Å; I213-I218 HydrophobicContact CG1-CG1 4.4Å; I213-I218 HydrophobicContact CG2-CG2 4.11Å; I213-G292 CarbonylContact O-C 3.54Å; I213-G292 WeakPolarHBondContact O-CA 3.46Å; I213-F293 HydrophobicContact CB-CE2 4.47Å; I213-F293 HydrophobicContact CB-CZ 4.39Å; I213-F293 HydrophobicContact CG2-CB 4.41Å; I213-F293 HydrophobicContact CG2-CD1 3.33Å; I213-F293 HydrophobicContact CG2-CD2 3.53Å; I213-F293 HydrophobicContact CG2-CE1 3.28Å; I213-F293 HydrophobicContact CG2-CE2 3.48Å; I213-F293 VanDerWaalsContact CG2-CE2 3.48Å; I213-F293 HydrophobicContact CG2-CG 3.46Å; I213-F293 VanDerWaalsContact CG2-CG 3.46Å; I213-F293 HydrophobicContact CG2-CZ 3.35Å; I213-F293 PolarHBondContact N-O 3.01Å; I213-F293 PolarHBondContact O-N 3.5Å
214	V	98.4	Very high	97.1	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	119.6	169.8	-175.6	0	0	0	0	107.6	M178 P183 P184 I185 L212 L280 I285 S291	M178-V214 HydrophobicContact SD-CG2 4.09Å; P183-V214 HydrophobicContact CB-CG1 4.22Å; P183-V214 HydrophobicContact CG-CB 4.38Å; P183-V214 HydrophobicContact CG-CG1 3.7Å; P184-V214 CarbonylContact C-O 3.19Å; P184-V214 WeakPolarHBondContact CA-O 3.45Å; I185-V214 HydrophobicContact CB-CB 4.35Å; I185-V214 PolarHBondContact N-O 2.98Å; I185-V214 PolarHBondContact O-N 3.28Å; L212-V214 HydrophobicContact CD1-CG2 3.76Å; L212-V214 HydrophobicContact CD2-CG2 4.12Å; L212-V214 HydrophobicContact CG-CG2 3.97Å; V214-L280 HydrophobicContact CG1-CD2 4.18Å; V214-L280 HydrophobicContact CG2-CD2 4.17Å; V214-I285 HydrophobicContact CG1-CD1 4.44Å; V214-I285 HydrophobicContact CG1-CG2 4.29Å; V214-S291 WeakPolarHBondContact CA-O 3.39Å
215	D	97.9	Very high	97.3	Very high	29 Å²	29	39 Å²	39	16%	0.155	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	176.9	-177.9	-153.5	-23.1	0	0	0	108.9	P184 R186 I218 S291	P184-D215 HydrophobicContact CB-CB 4.34Å; P184-D215 WeakPolarHBondContact CB-OD2 3.25Å; R186-D215 IonicContact NH2-OD2 3.79Å; R186-D215 PolarHBondContact NH2-OD2 3.45Å; R186-D215 VanDerWaalsContact NH2-OD2 3.15Å; D215-I218 HydrophobicContact CB-CD1 3.84Å; D215-I218 HydrophobicContact CB-CG1 3.67Å; D215-S291 PolarHBondContact N-O 3.46Å; D215-S291 PolarHBondContact O-N 2.89Å
216	T	97	Very high	97.4	Very high	66 Å²	66	38 Å²	38	41%	0.405	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	144	168.6	61.3	0	0	0	0	110.3	I218 Y290	T216-I218 VanDerWaalsContact C-N 3.32Å; T216-I218 PolarHBondContact O-N 2.89Å; T216-Y290 HydrophobicContact CG2-CD1 3.96Å; T216-Y290 HydrophobicContact CG2-CE1 3.83Å
217	N	93.2	Very high	97.4	Very high	146 Å²	146	36.7 Å²	36.7	78%	0.781	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.7	29.4	174.5	-53	-56.6	0	0	0	115.9
218	I	97.3	Very high	97.4	Very high	21 Å²	21	38.1 Å²	38.1	11%	0.108	21%	0.212	C	C	.	.			trans	-79	128.6	171.4	-58.3	-59.1	0	0	0	110	I213 D215 T216 M274 S291 F293	I213-I218 HydrophobicContact CD1-CD1 3.87Å; I213-I218 HydrophobicContact CG1-CD1 4.14Å; I213-I218 HydrophobicContact CG1-CG1 4.4Å; I213-I218 HydrophobicContact CG2-CG2 4.11Å; D215-I218 HydrophobicContact CB-CD1 3.84Å; D215-I218 HydrophobicContact CB-CG1 3.67Å; T216-I218 VanDerWaalsContact C-N 3.32Å; T216-I218 PolarHBondContact O-N 2.89Å; I218-M274 HydrophobicContact CG2-CE 4.24Å; I218-M274 WeakPolarHBondContact O-CE 3.13Å; I218-S291 WeakPolarHBondContact CA-OG 3.35Å; I218-S291 WeakPolarHBondContact CB-OG 3.46Å; I218-S291 PolarHBondContact N-OG 2.94Å; I218-S291 WeakPolarHBondContact O-CB 3.47Å; I218-S291 PolarHBondContact O-OG 3.44Å; I218-F293 HydrophobicContact CG2-CD1 3.49Å; I218-F293 VanDerWaalsContact CG2-CD1 3.49Å; I218-F293 HydrophobicContact CG2-CE1 4.12Å; I218-F293 HydrophobicContact CG2-CG 4.37Å
219	S	97.1	Very high	97.3	Very high	46 Å²	46	41.5 Å²	41.5	32%	0.322	23%	0.231	S	C	.	.			trans	-124.4	166.6	-178.5	72.6	0	0	0	0	112	T221 N222 L223	S219-T221 PolarHBondContact O-N 3.19Å; S219-T221 VanDerWaalsContact O-N 3.17Å; S219-T221 WeakPolarHBondContact OG-CB 3.5Å; S219-T221 PolarHBondContact OG-N 2.77Å; S219-N222 PolarHBondContact N-OD1 2.87Å; S219-N222 WeakPolarHBondContact O-CB 3.25Å; S219-N222 PolarHBondContact O-N 2.72Å; S219-N222 PolarHBondContact O-OD1 3.12Å; S219-N222 PolarHBondContact OG-OD1 3.1Å; S219-L223 PolarHBondContact O-N 3.43Å
220	F	97.6	Very high	97.3	Very high	55 Å²	55	41.6 Å²	41.6	24%	0.241	23%	0.231	C	C	.	.	H	α-helix	trans	-61.9	-22.7	174.1	-157.4	-111.2	0	0	0	112.7	L223 K224 P253 A255 M274	F220-L223 HydrophobicContact CD2-CD2 3.73Å; F220-L223 HydrophobicContact CE2-CD2 3.57Å; F220-L223 HydrophobicContact CZ-CD2 4.36Å; F220-L223 PolarHBondContact O-N 3.4Å; F220-K224 HydrophobicContact CD1-CD 4.31Å; F220-K224 HydrophobicContact CD1-CG 4.28Å; F220-K224 HydrophobicContact CE1-CD 4.35Å; F220-K224 HydrophobicContact CE1-CG 4.3Å; F220-K224 PolarHBondContact O-N 2.95Å; F220-P253 HydrophobicContact CD2-CG 4.17Å; F220-P253 HydrophobicContact CE2-CG 4.26Å; F220-A255 HydrophobicContact CZ-CB 3.91Å; F220-M274 VanDerWaalsContact CA-SD 3.59Å; F220-M274 HydrophobicContact CB-CG 4.38Å; F220-M274 HydrophobicContact CB-SD 4.01Å; F220-M274 HydrophobicContact CD2-CG 3.77Å; F220-M274 HydrophobicContact CD2-SD 3.84Å; F220-M274 HydrophobicContact CG-SD 4.44Å; F220-M274 PolarHBondContact N-SD 2.85Å; F220-M274 VanDerWaalsContact N-SD 3.43Å
221	T	97.6	Very high	97.2	Very high	111 Å²	111	41.2 Å²	41.2	68%	0.681	23%	0.229	S	C	*	.	H	α-helix	trans	-65.9	-40.7	172.7	-55.5	0	0	0	0	111.3	S219 L223 K224 G225	S219-T221 PolarHBondContact O-N 3.19Å; S219-T221 VanDerWaalsContact O-N 3.17Å; S219-T221 WeakPolarHBondContact OG-CB 3.5Å; S219-T221 PolarHBondContact OG-N 2.77Å; T221-L223 VanDerWaalsContact C-N 3.33Å; T221-L223 PolarHBondContact O-N 2.91Å; T221-K224 PolarHBondContact O-N 2.94Å; T221-G225 PolarHBondContact O-N 2.94Å
222	N	97.5	Very high	97	Very high	69 Å²	69	45.9 Å²	45.9	37%	0.369	25%	0.247	S	C	.	.	H	α-helix	trans	-63.3	-41.9	176.1	-55.9	102.6	0	0	0	110.9	S219 G225 T226 F293	S219-N222 PolarHBondContact N-OD1 2.87Å; S219-N222 WeakPolarHBondContact O-CB 3.25Å; S219-N222 PolarHBondContact O-N 2.72Å; S219-N222 PolarHBondContact O-OD1 3.12Å; S219-N222 PolarHBondContact OG-OD1 3.1Å; N222-G225 PolarHBondContact O-N 2.86Å; N222-T226 WeakPolarHBondContact O-CB 3.48Å; N222-T226 PolarHBondContact O-N 3.49Å; N222-T226 PolarHBondContact O-OG1 2.92Å; N222-F293 HydrophobicContact CB-CD1 4.32Å; N222-F293 HydrophobicContact CB-CE1 3.82Å
223	L	97.8	Very high	96.9	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-59.5	-51.6	175.5	174.1	62.5	0	0	0	111.4	S219 F220 T221 G225 T226 L227 C272 F293 F295	S219-L223 PolarHBondContact O-N 3.43Å; F220-L223 HydrophobicContact CD2-CD2 3.73Å; F220-L223 HydrophobicContact CE2-CD2 3.57Å; F220-L223 HydrophobicContact CZ-CD2 4.36Å; F220-L223 PolarHBondContact O-N 3.4Å; T221-L223 VanDerWaalsContact C-N 3.33Å; T221-L223 PolarHBondContact O-N 2.91Å; L223-G225 PolarHBondContact O-N 3.29Å; L223-T226 PolarHBondContact O-N 2.71Å; L223-L227 HydrophobicContact CD1-CD1 3.51Å; L223-L227 HydrophobicContact CD1-CG 3.97Å; L223-L227 HydrophobicContact CG-CD1 4.03Å; L223-L227 WeakPolarHBondContact O-CG 3.33Å; L223-L227 PolarHBondContact O-N 3Å; L223-C272 HydrophobicContact CD1-CB 3.98Å; L223-C272 HydrophobicContact CD2-CB 4Å; L223-C272 HydrophobicContact CG-CB 4.42Å; L223-F293 HydrophobicContact CB-CB 3.9Å; L223-F293 HydrophobicContact CB-CD1 3.65Å; L223-F293 HydrophobicContact CB-CD2 4.18Å; L223-F293 HydrophobicContact CB-CE1 4.15Å; L223-F293 HydrophobicContact CB-CG 3.67Å; L223-F293 HydrophobicContact CD1-CB 3.99Å; L223-F293 HydrophobicContact CD1-CD1 4.42Å; L223-F293 HydrophobicContact CD1-CD2 3.36Å; L223-F293 HydrophobicContact CD1-CE2 3.86Å; L223-F293 HydrophobicContact CD1-CG 3.7Å; L223-F293 HydrophobicContact CD2-CB 4.13Å; L223-F293 HydrophobicContact CG-CB 4.22Å; L223-F293 HydrophobicContact CG-CD2 4.31Å; L223-F293 HydrophobicContact CG-CG 4.17Å; L223-F295 HydrophobicContact CD1-CD1 4.39Å
224	K	97.2	Very high	96.8	Very high	90 Å²	90	48.9 Å²	48.9	39%	0.391	26%	0.263	S	S	.	.	H	α-helix	trans	-59.1	-46.4	179.4	-79.7	-169	168.7	-179.6	0	112.4	F220 T221 H228 F243	F220-K224 HydrophobicContact CD1-CD 4.31Å; F220-K224 HydrophobicContact CD1-CG 4.28Å; F220-K224 HydrophobicContact CE1-CD 4.35Å; F220-K224 HydrophobicContact CE1-CG 4.3Å; F220-K224 PolarHBondContact O-N 2.95Å; T221-K224 PolarHBondContact O-N 2.94Å; K224-H228 WeakPolarHBondContact O-CB 3.41Å; K224-H228 PolarHBondContact O-N 2.84Å; K224-F243 HydrophobicContact CB-CZ 4.2Å; K224-F243 HydrophobicContact CD-CD2 4.41Å; K224-F243 HydrophobicContact CG-CD1 4.1Å; K224-F243 HydrophobicContact CG-CD2 4.37Å; K224-F243 HydrophobicContact CG-CE1 3.82Å; K224-F243 HydrophobicContact CG-CE2 4.11Å; K224-F243 HydrophobicContact CG-CG 4.38Å; K224-F243 HydrophobicContact CG-CZ 3.84Å
225	G	96.9	Very high	96.5	Very high	30 Å²	30	50.4 Å²	50.4	31%	0.309	27%	0.27	S	S	.	.	H	α-helix	trans	-61	-48.9	178.7	0	0	0	0	0	111.9	T221 N222 L223 L227 H228 D229	T221-G225 PolarHBondContact O-N 2.94Å; N222-G225 PolarHBondContact O-N 2.86Å; L223-G225 PolarHBondContact O-N 3.29Å; G225-L227 PolarHBondContact O-N 3.34Å; G225-H228 PolarHBondContact O-N 3.34Å; G225-D229 PolarHBondContact O-N 3.4Å
226	T	97.2	Very high	96.4	Very high	29 Å²	29	55 Å²	55	18%	0.178	29%	0.29	C	S	.	.	H	α-helix	trans	-58.6	-47.9	-179.9	-54.8	0	0	0	0	111.7	F120 L123 N222 L223 F230 F293	F120-T226 HydrophobicContact CE1-CG2 3.84Å; L123-T226 HydrophobicContact CD1-CG2 4.18Å; N222-T226 WeakPolarHBondContact O-CB 3.48Å; N222-T226 PolarHBondContact O-N 3.49Å; N222-T226 PolarHBondContact O-OG1 2.92Å; L223-T226 PolarHBondContact O-N 2.71Å; T226-F230 VanDerWaalsContact O-CB 3.25Å; T226-F230 WeakPolarHBondContact O-CB 3.47Å; T226-F230 PolarHBondContact O-N 3.02Å; T226-F293 HydrophobicContact CG2-CZ 4.37Å
227	L	97.5	Very high	96.1	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-71.5	-34.5	-179.4	-68.4	177.6	0	0	0	113	L223 G225 L231 F243 V257 L270 C272 F295	L223-L227 HydrophobicContact CD1-CD1 3.51Å; L223-L227 HydrophobicContact CD1-CG 3.97Å; L223-L227 HydrophobicContact CG-CD1 4.03Å; L223-L227 WeakPolarHBondContact O-CG 3.33Å; L223-L227 PolarHBondContact O-N 3Å; G225-L227 PolarHBondContact O-N 3.34Å; L227-L231 WeakPolarHBondContact O-CB 3.42Å; L227-L231 VanDerWaalsContact O-CG 3.27Å; L227-L231 WeakPolarHBondContact O-CG 3.27Å; L227-L231 PolarHBondContact O-N 2.98Å; L227-F243 HydrophobicContact CB-CZ 4.31Å; L227-F243 HydrophobicContact CD1-CE1 4.12Å; L227-V257 HydrophobicContact CD1-CG2 4.3Å; L227-L270 HydrophobicContact CD1-CD1 3.73Å; L227-L270 HydrophobicContact CD2-CD1 4.18Å; L227-L270 HydrophobicContact CD2-CD2 4.02Å; L227-C272 HydrophobicContact CD1-CB 3.74Å; L227-F295 HydrophobicContact CD1-CB 4.36Å; L227-F295 HydrophobicContact CD2-CB 4.04Å; L227-F295 HydrophobicContact CD2-CD1 4.01Å; L227-F295 HydrophobicContact CD2-CD2 4.12Å; L227-F295 HydrophobicContact CD2-CG 3.79Å
228	H	96.1	Very high	96.1	Very high	65 Å²	65	55 Å²	55	30%	0.301	29%	0.285	S	S	.	.	H	α-helix	trans	-62.8	-48.6	175.1	176.9	-85.7	0	0	0	111.2	K224 G225 L231 R232 I241	K224-H228 WeakPolarHBondContact O-CB 3.41Å; K224-H228 PolarHBondContact O-N 2.84Å; G225-H228 PolarHBondContact O-N 3.34Å; H228-L231 PolarHBondContact O-N 3.05Å; H228-R232 WeakPolarHBondContact CE1-CD 3.43Å; H228-R232 WeakPolarHBondContact O-CG 3.45Å; H228-R232 PolarHBondContact O-N 2.56Å; H228-R232 VanDerWaalsContact O-N 3.12Å; H228-I241 HydrophobicContact CB-CD1 4.45Å
229	D	96.1	Very high	95.8	Very high	93 Å²	93	55 Å²	55	50%	0.497	29%	0.285	S	S	.	.	H	α-helix	trans	-68.3	-38.5	179.7	-66	-13.8	0	0	0	111.3	F119 G225 N233	F119-D229 HydrophobicContact CZ-CB 4.4Å; G225-D229 PolarHBondContact O-N 3.4Å; D229-N233 VanDerWaalsContact O-CB 3.23Å; D229-N233 WeakPolarHBondContact O-CB 3.47Å; D229-N233 PolarHBondContact O-N 2.92Å
230	F	97.3	Very high	95.6	Very high	1 Å²	1	58.9 Å²	58.9	0%	0.004	30%	0.298	C	S	.	.	H	α-helix	trans	-56.6	-53.3	171.9	167.6	-114.1	0	0	0	112	I116 F119 F120 T226 R232 N233 F234 L270 M297 L302	I116-F230 HydrophobicContact CB-CE2 4.27Å; I116-F230 HydrophobicContact CD1-CZ 4.14Å; I116-F230 HydrophobicContact CG1-CE2 3.85Å; I116-F230 HydrophobicContact CG1-CZ 3.92Å; I116-F230 HydrophobicContact CG2-CE2 3.75Å; I116-F230 HydrophobicContact CG2-CZ 4.04Å; F119-F230 HydrophobicContact CD1-CB 4.17Å; F119-F230 AromaticContact CD1-CD2 3.66Å; F119-F230 HydrophobicContact CD1-CD2 3.66Å; F119-F230 HydrophobicContact CD1-CG 4.37Å; F119-F230 HydrophobicContact CE1-CB 3.54Å; F119-F230 AromaticContact CE1-CD2 3.96Å; F119-F230 HydrophobicContact CE1-CD2 3.96Å; F119-F230 HydrophobicContact CE1-CG 4.23Å; F119-F230 HydrophobicContact CG-CD2 4.18Å; F119-F230 VanDerWaalsContact CZ-CA 3.4Å; F119-F230 HydrophobicContact CZ-CB 3.95Å; F120-F230 AromaticContact CE2-CD2 3.78Å; F120-F230 HydrophobicContact CE2-CD2 3.78Å; F120-F230 HydrophobicContact CE2-CE2 4.05Å; F120-F230 HydrophobicContact CE2-CG 4.11Å; F120-F230 HydrophobicContact CZ-CB 4.27Å; F120-F230 HydrophobicContact CZ-CD2 4.16Å; F120-F230 HydrophobicContact CZ-CG 4.06Å; T226-F230 VanDerWaalsContact O-CB 3.25Å; T226-F230 WeakPolarHBondContact O-CB 3.47Å; T226-F230 PolarHBondContact O-N 3.02Å; F230-R232 PolarHBondContact O-N 3.5Å; F230-N233 PolarHBondContact O-N 2.99Å; F230-F234 HydrophobicContact CD2-CB 4.39Å; F230-F234 HydrophobicContact CE2-CB 3.93Å; F230-F234 HydrophobicContact CE2-CD2 4.21Å; F230-F234 HydrophobicContact CE2-CG 4.3Å; F230-F234 HydrophobicContact CZ-CB 4.12Å; F230-F234 HydrophobicContact CZ-CD2 4.28Å; F230-F234 HydrophobicContact CZ-CG 4.21Å; F230-F234 VanDerWaalsContact O-CB 3.23Å; F230-F234 WeakPolarHBondContact O-CB 3.4Å; F230-F234 PolarHBondContact O-N 2.74Å; F230-L270 HydrophobicContact CE1-CD2 4.47Å; F230-M297 HydrophobicContact CD1-CE 4.05Å; F230-M297 HydrophobicContact CE1-CE 3.51Å; F230-M297 HydrophobicContact CE1-SD 3.49Å; F230-M297 WeakPolarHBondContact CE1-SD 3.36Å; F230-M297 HydrophobicContact CZ-CE 3.98Å; F230-M297 HydrophobicContact CZ-SD 3.52Å; F230-M297 VanDerWaalsContact CZ-SD 3.52Å; F230-L302 HydrophobicContact CE1-CD1 4.45Å; F230-L302 HydrophobicContact CZ-CD1 4.2Å
231	L	96.4	Very high	95.6	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-65.2	-39.3	-175.5	-72.4	170.3	0	0	0	111.7	L227 H228 F235 I241 V257 V259 V269 L270	L227-L231 WeakPolarHBondContact O-CB 3.42Å; L227-L231 VanDerWaalsContact O-CG 3.27Å; L227-L231 WeakPolarHBondContact O-CG 3.27Å; L227-L231 PolarHBondContact O-N 2.98Å; H228-L231 PolarHBondContact O-N 3.05Å; L231-F235 HydrophobicContact CD2-CD2 4.34Å; L231-F235 HydrophobicContact CD2-CE2 3.92Å; L231-F235 WeakPolarHBondContact O-CB 3.49Å; L231-F235 WeakPolarHBondContact O-CD2 3.25Å; L231-F235 PolarHBondContact O-N 2.99Å; L231-I241 HydrophobicContact CB-CD1 3.75Å; L231-I241 HydrophobicContact CD1-CD1 3.93Å; L231-I241 HydrophobicContact CD1-CG1 4.21Å; L231-I241 HydrophobicContact CD1-CG2 4.01Å; L231-I241 HydrophobicContact CG-CD1 4.5Å; L231-V257 HydrophobicContact CD1-CG1 3.75Å; L231-V259 HydrophobicContact CD1-CG1 4Å; L231-V259 HydrophobicContact CD2-CG1 4.32Å; L231-V269 HydrophobicContact CD1-CG2 4.31Å; L231-V269 HydrophobicContact CD2-CG2 4.05Å; L231-L270 HydrophobicContact CD1-CD2 4.46Å; L231-L270 HydrophobicContact CD2-CD2 4.24Å
232	R	94.7	Very high	95.5	Very high	99 Å²	99	57 Å²	57	37%	0.374	28%	0.279	S	S	.	.	H	α-helix	trans	-66.7	-41.9	175.2	-69.7	-176.7	69.8	177.8	10.9	112.3	H228 F230 E236 D238 I241	H228-R232 WeakPolarHBondContact CE1-CD 3.43Å; H228-R232 WeakPolarHBondContact O-CG 3.45Å; H228-R232 PolarHBondContact O-N 2.56Å; H228-R232 VanDerWaalsContact O-N 3.12Å; F230-R232 PolarHBondContact O-N 3.5Å; R232-E236 VanDerWaalsContact O-CA 3.31Å; R232-E236 WeakPolarHBondContact O-CA 3.23Å; R232-E236 PolarHBondContact O-N 2.97Å; R232-D238 IonicContact CZ-OD1 2.72Å; R232-D238 IonicContact NE-OD1 3.16Å; R232-D238 PolarHBondContact NE-OD1 2.99Å; R232-D238 IonicContact NH1-OD1 3.26Å; R232-D238 VanDerWaalsContact NH2-CG 3.31Å; R232-D238 IonicContact NH2-OD1 2.94Å; R232-D238 PolarHBondContact NH2-OD1 3.49Å; R232-D238 IonicContact NH2-OD2 3.54Å; R232-I241 HydrophobicContact CG-CD1 4.47Å
233	N	95.5	Very high	95.5	Very high	75 Å²	75	55.8 Å²	55.8	40%	0.401	27%	0.271	S	S	.	.	H	α-helix	trans	-67	-43.1	176	-178.9	-77.5	0	0	0	111.6	R115 F119 D229 F230 E236	R115-N233 PolarHBondContact NH2-O 2.82Å; F119-N233 HydrophobicContact CD2-CB 3.76Å; F119-N233 VanDerWaalsContact CD2-CG 3.43Å; F119-N233 WeakPolarHBondContact CD2-OD1 3.28Å; F119-N233 HydrophobicContact CE2-CB 3.56Å; D229-N233 VanDerWaalsContact O-CB 3.23Å; D229-N233 WeakPolarHBondContact O-CB 3.47Å; D229-N233 PolarHBondContact O-N 2.92Å; F230-N233 PolarHBondContact O-N 2.99Å; N233-E236 WeakPolarHBondContact O-CG 3.41Å
234	F	95.7	Very high	95.5	Very high	2 Å²	2	59.3 Å²	59.3	1%	0.009	28%	0.284	C	S	.	.	H	α-helix	trans	-63.8	-54.7	179.9	-176.4	-97	0	0	0	110	T112 R115 I116 F230 E236 L302 R306	T112-F234 HydrophobicContact CG2-CE2 3.91Å; T112-F234 HydrophobicContact CG2-CZ 3.79Å; R115-F234 HydrophobicContact CG-CD2 4.41Å; I116-F234 HydrophobicContact CD1-CD2 4.45Å; I116-F234 HydrophobicContact CD1-CE2 4.06Å; I116-F234 HydrophobicContact CG1-CD2 3.86Å; I116-F234 HydrophobicContact CG1-CE2 3.79Å; F230-F234 HydrophobicContact CD2-CB 4.39Å; F230-F234 HydrophobicContact CE2-CB 3.93Å; F230-F234 HydrophobicContact CE2-CD2 4.21Å; F230-F234 HydrophobicContact CE2-CG 4.3Å; F230-F234 HydrophobicContact CZ-CB 4.12Å; F230-F234 HydrophobicContact CZ-CD2 4.28Å; F230-F234 HydrophobicContact CZ-CG 4.21Å; F230-F234 VanDerWaalsContact O-CB 3.23Å; F230-F234 WeakPolarHBondContact O-CB 3.4Å; F230-F234 PolarHBondContact O-N 2.74Å; F234-E236 VanDerWaalsContact C-N 3.29Å; F234-E236 PolarHBondContact O-N 3.24Å; F234-L302 HydrophobicContact CE1-CB 3.93Å; F234-L302 HydrophobicContact CE1-CD2 4.34Å; F234-L302 HydrophobicContact CZ-CB 3.9Å; F234-R306 HydrophobicContact CE1-CB 4.07Å; F234-R306 HydrophobicContact CZ-CB 4.2Å; F234-R306 PolarHBondContact O-NH1 3.49Å
235	F	93.8	Very high	95.5	Very high	32 Å²	32	61 Å²	61	14%	0.14	30%	0.304	C	S	.	.	H	α-helix	trans	-79.3	-9.4	-178	-70.9	-72.5	0	0	0	114.6	L231 E237 L239 L302 L305	L231-F235 HydrophobicContact CD2-CD2 4.34Å; L231-F235 HydrophobicContact CD2-CE2 3.92Å; L231-F235 WeakPolarHBondContact O-CB 3.49Å; L231-F235 WeakPolarHBondContact O-CD2 3.25Å; L231-F235 PolarHBondContact O-N 2.99Å; F235-E237 PolarHBondContact O-N 3.12Å; F235-L239 HydrophobicContact CB-CD1 3.58Å; F235-L239 HydrophobicContact CB-CG 4.27Å; F235-L239 HydrophobicContact CD2-CD1 3.34Å; F235-L239 HydrophobicContact CE2-CD1 4.24Å; F235-L239 HydrophobicContact CG-CD1 3.67Å; F235-L302 HydrophobicContact CE2-CD2 4.23Å; F235-L302 HydrophobicContact CZ-CD2 3.93Å; F235-L305 HydrophobicContact CE1-CB 3.68Å; F235-L305 HydrophobicContact CZ-CB 3.95Å; F235-L305 HydrophobicContact CZ-CD1 4.14Å
236	E	94.3	Very high	95.5	Very high	126 Å²	126	61.5 Å²	61.5	59%	0.589	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	27.8	-179.2	-57.7	172.4	-153.3	0	0	112.8	R115 R232 N233 F234 R306	R115-E236 IonicContact CZ-OE1 2.69Å; R115-E236 IonicContact NH1-OE1 3.72Å; R115-E236 PolarHBondContact NH1-OE1 2.94Å; R115-E236 VanDerWaalsContact NH1-OE1 3.09Å; R115-E236 VanDerWaalsContact NH2-CG 3.32Å; R115-E236 IonicContact NH2-OE1 2.75Å; R115-E236 PolarHBondContact NH2-OE1 3.14Å; R232-E236 VanDerWaalsContact O-CA 3.31Å; R232-E236 WeakPolarHBondContact O-CA 3.23Å; R232-E236 PolarHBondContact O-N 2.97Å; N233-E236 WeakPolarHBondContact O-CG 3.41Å; F234-E236 VanDerWaalsContact C-N 3.29Å; F234-E236 PolarHBondContact O-N 3.24Å; E236-R306 IonicContact OE1-CZ 3.79Å; E236-R306 IonicContact OE1-NH1 3.61Å; E236-R306 IonicContact OE1-NH2 3.94Å; E236-R306 PolarHBondContact OE1-NH2 2.88Å
237	E	92.2	Very high	95.4	Very high	86 Å²	86	67.5 Å²	67.5	40%	0.402	32%	0.323	S	S	.	.	S	Bend	trans	-135.7	153.8	-175.8	-70.8	-177.9	-168.3	0	0	110.3	F235 L239 K262	F235-E237 PolarHBondContact O-N 3.12Å; E237-L239 HydrophobicContact CB-CD2 4.02Å; E237-L239 HydrophobicContact CB-CG 4.3Å; E237-L239 PolarHBondContact O-N 3.06Å; E237-L239 VanDerWaalsContact O-N 3.1Å; E237-K262 VanDerWaalsContact OE1-CE 3.28Å; E237-K262 WeakPolarHBondContact OE1-CE 3.43Å; E237-K262 IonicContact OE1-NZ 3.07Å; E237-K262 PolarHBondContact OE1-NZ 3.11Å; E237-K262 WeakPolarHBondContact OE2-CE 3.36Å; E237-K262 IonicContact OE2-NZ 3.36Å
238	D	91.6	Very high	95.3	Very high	126 Å²	126	69.8 Å²	69.8	67%	0.674	33%	0.334	S	S	*	.			trans	-79.7	88.2	170.1	-166.4	23.1	0	0	0	110	R232	R232-D238 IonicContact CZ-OD1 2.72Å; R232-D238 IonicContact NE-OD1 3.16Å; R232-D238 PolarHBondContact NE-OD1 2.99Å; R232-D238 IonicContact NH1-OD1 3.26Å; R232-D238 VanDerWaalsContact NH2-CG 3.31Å; R232-D238 IonicContact NH2-OD1 2.94Å; R232-D238 PolarHBondContact NH2-OD1 3.49Å; R232-D238 IonicContact NH2-OD2 3.54Å
239	L	90.7	Very high	95.3	Very high	21 Å²	21	67.2 Å²	67.2	11%	0.11	32%	0.322	C	S	.	.			trans	-84.9	141.7	-173.8	-65.1	179.9	0	0	0	112.7	F235 E237 I241 V259	F235-L239 HydrophobicContact CB-CD1 3.58Å; F235-L239 HydrophobicContact CB-CG 4.27Å; F235-L239 HydrophobicContact CD2-CD1 3.34Å; F235-L239 HydrophobicContact CE2-CD1 4.24Å; F235-L239 HydrophobicContact CG-CD1 3.67Å; E237-L239 HydrophobicContact CB-CD2 4.02Å; E237-L239 HydrophobicContact CB-CG 4.3Å; E237-L239 PolarHBondContact O-N 3.06Å; E237-L239 VanDerWaalsContact O-N 3.1Å; L239-I241 HydrophobicContact CB-CG1 4.11Å; L239-I241 PolarHBondContact O-N 3.26Å; L239-V259 HydrophobicContact CD1-CB 4.41Å; L239-V259 HydrophobicContact CD1-CG1 4.13Å
240	Q	94.7	Very high	95.4	Very high	127 Å²	127	65.1 Å²	65.1	59%	0.593	31%	0.309	S	S	*	.			trans	-76.6	120.3	160.6	-62.8	-176.3	17.3	0	0	108.9	M260 W266	Q240-M260 HydrophobicContact CB-CB 3.88Å; Q240-M260 PolarHBondContact O-N 3.28Å; Q240-W266 HydrophobicContact CB-CH2 3.95Å; Q240-W266 HydrophobicContact CB-CZ3 4.46Å; Q240-W266 WeakPolarHBondContact O-CZ3 3.25Å
241	I	96.2	Very high	95.4	Very high	33 Å²	33	65.3 Å²	65.3	17%	0.169	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	133.3	-177.3	-59	167.8	0	0	0	108.6	H228 L231 R232 L239 F243 V257 D258 V259	H228-I241 HydrophobicContact CB-CD1 4.45Å; L231-I241 HydrophobicContact CB-CD1 3.75Å; L231-I241 HydrophobicContact CD1-CD1 3.93Å; L231-I241 HydrophobicContact CD1-CG1 4.21Å; L231-I241 HydrophobicContact CD1-CG2 4.01Å; L231-I241 HydrophobicContact CG-CD1 4.5Å; R232-I241 HydrophobicContact CG-CD1 4.47Å; L239-I241 HydrophobicContact CB-CG1 4.11Å; L239-I241 PolarHBondContact O-N 3.26Å; I241-F243 HydrophobicContact CG2-CD2 4.37Å; I241-F243 HydrophobicContact CG2-CE2 3.8Å; I241-F243 HydrophobicContact CG2-CZ 4.45Å; I241-V257 HydrophobicContact CG2-CG1 3.61Å; I241-D258 WeakPolarHBondContact CA-O 3.46Å; I241-V259 HydrophobicContact CG1-CG1 4.36Å
242	R	96	Very high	95.5	Very high	93 Å²	93	70.7 Å²	70.7	35%	0.351	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	138.3	176.9	-178.3	179.9	67.3	-177	-1.3	110.4	R244 V257 D258 W266	R242-R244 HydrophobicContact CG-CG 4.37Å; R242-V257 WeakPolarHBondContact O-CA 3.34Å; R242-D258 IonicContact CZ-OD2 3.19Å; R242-D258 PolarHBondContact N-O 2.71Å; R242-D258 IonicContact NE-OD2 3.71Å; R242-D258 PolarHBondContact NE-OD2 2.87Å; R242-D258 IonicContact NH2-OD2 3Å; R242-D258 PolarHBondContact NH2-OD2 2.83Å; R242-D258 PolarHBondContact O-N 2.85Å; R242-W266 HydrophobicContact CB-CE3 4.16Å; R242-W266 HydrophobicContact CB-CH2 3.79Å; R242-W266 HydrophobicContact CB-CZ2 4.34Å; R242-W266 HydrophobicContact CB-CZ3 3.68Å
243	F	97.4	Very high	95.6	Very high	44 Å²	44	69.2 Å²	69.2	19%	0.193	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	122.6	171.4	-67.7	-105.1	0	0	0	108.7	K224 L227 I241 E256 V257	K224-F243 HydrophobicContact CB-CZ 4.2Å; K224-F243 HydrophobicContact CD-CD2 4.41Å; K224-F243 HydrophobicContact CG-CD1 4.1Å; K224-F243 HydrophobicContact CG-CD2 4.37Å; K224-F243 HydrophobicContact CG-CE1 3.82Å; K224-F243 HydrophobicContact CG-CE2 4.11Å; K224-F243 HydrophobicContact CG-CG 4.38Å; K224-F243 HydrophobicContact CG-CZ 3.84Å; L227-F243 HydrophobicContact CB-CZ 4.31Å; L227-F243 HydrophobicContact CD1-CE1 4.12Å; I241-F243 HydrophobicContact CG2-CD2 4.37Å; I241-F243 HydrophobicContact CG2-CE2 3.8Å; I241-F243 HydrophobicContact CG2-CZ 4.45Å; F243-E256 CarbonylContact C-O 3.52Å; F243-E256 WeakPolarHBondContact CA-O 3.32Å; F243-V257 HydrophobicContact CD1-CG2 3.51Å; F243-V257 HydrophobicContact CE1-CG2 3.38Å; F243-V257 HydrophobicContact CG-CG2 4.25Å; F243-V257 HydrophobicContact CZ-CG1 4.38Å; F243-V257 HydrophobicContact CZ-CG2 4.04Å
244	R	97.4	Very high	95.7	Very high	74 Å²	74	66 Å²	66	28%	0.279	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	132.8	174.6	-68.4	-173.1	-69.4	99.5	3.1	109.4	R242 S246 A255 E256 D258	R242-R244 HydrophobicContact CG-CG 4.37Å; R244-S246 PolarHBondContact O-N 2.96Å; R244-A255 CarbonylContact O-C 3.48Å; R244-A255 WeakPolarHBondContact O-CA 3.12Å; R244-A255 WeakPolarHBondContact O-CB 3.28Å; R244-E256 IonicContact CZ-OE2 3.51Å; R244-E256 PolarHBondContact N-O 3.02Å; R244-E256 IonicContact NH1-OE2 3.72Å; R244-E256 PolarHBondContact NH1-OE2 2.89Å; R244-E256 IonicContact NH2-OE2 3.35Å; R244-E256 PolarHBondContact NH2-OE2 3.4Å; R244-E256 PolarHBondContact O-N 2.83Å; R244-D258 WeakPolarHBondContact CD-OD2 3.4Å; R244-D258 IonicContact CZ-OD1 2.94Å; R244-D258 IonicContact CZ-OD2 2.77Å; R244-D258 IonicContact NE-OD1 2.66Å; R244-D258 IonicContact NE-OD2 2.85Å; R244-D258 PolarHBondContact NE-OD2 3.39Å; R244-D258 IonicContact NH2-OD1 3.41Å; R244-D258 PolarHBondContact NH2-OD1 3.3Å; R244-D258 IonicContact NH2-OD2 3.68Å
245	P	97.7	Very high	95.9	Very high	124 Å²	124	66.1 Å²	66.1	81%	0.805	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-54	135.8	169.3	-23.7	34.1	0	0	0	110.7
246	S	96.3	Very high	96.1	Very high	42 Å²	42	66 Å²	66	29%	0.294	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	-166.2	174.7	-166.8	0	0	0	0	108.7	R244 S254 E256	R244-S246 PolarHBondContact O-N 2.96Å; S246-S254 PolarHBondContact N-O 3.04Å; S246-S254 VanDerWaalsContact N-O 3.11Å; S246-S254 WeakPolarHBondContact O-CB 3.42Å; S246-E256 WeakPolarHBondContact CB-OE1 3.48Å; S246-E256 PolarHBondContact OG-OE1 3.01Å
247	Y	96.1	Very high	96.2	Very high	155 Å²	155	60 Å²	60	61%	0.608	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.4	124.3	178.4	172.2	-97.6	0	0	0	110.6	P249	Y247-P249 HydrophobicContact CE1-CG 3.96Å
248	F	95.8	Very high	96.4	Very high	48 Å²	48	56.2 Å²	56.2	21%	0.211	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	133	166	-52	-75.8	0	0	0	108.8	F250 T251 S254 E256	F248-F250 HydrophobicContact CB-CD2 4.11Å; F248-F250 HydrophobicContact CB-CE1 4.34Å; F248-F250 HydrophobicContact CB-CE2 3.7Å; F248-F250 HydrophobicContact CB-CZ 3.83Å; F248-F250 HydrophobicContact CD1-CZ 4.27Å; F248-F250 HydrophobicContact CG-CE2 4.2Å; F248-F250 HydrophobicContact CG-CZ 4.29Å; F248-F250 PolarHBondContact O-N 2.77Å; F248-T251 WeakPolarHBondContact CB-OG1 3.46Å; F248-T251 PolarHBondContact O-N 3.33Å; F248-S254 PolarHBondContact N-OG 3.37Å; F248-E256 HydrophobicContact CZ-CG 4.15Å
249	P	96.3	Very high	96.6	Very high	10 Å²	10	50.5 Å²	50.5	7%	0.065	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-24.9	-175.6	-26.9	35	0	0	0	115.1	N144 I145 Y247	N144-P249 WeakPolarHBondContact CB-O 3.18Å; N144-P249 PolarHBondContact ND2-O 3.29Å; I145-P249 HydrophobicContact CG1-CB 3.81Å; I145-P249 HydrophobicContact CG1-CG 4.04Å; Y247-P249 HydrophobicContact CE1-CG 3.96Å
250	F	97.1	Very high	96.7	Very high	50 Å²	50	51.8 Å²	51.8	22%	0.219	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-1.8	-179	39.3	-93.9	0	0	0	114.3	L143 I145 F248 H276 V279	L143-F250 HydrophobicContact CB-CB 4.11Å; L143-F250 HydrophobicContact CB-CD1 4.18Å; L143-F250 HydrophobicContact CD2-CB 4.15Å; L143-F250 WeakPolarHBondContact O-CA 3.48Å; L143-F250 WeakPolarHBondContact O-CB 3.13Å; I145-F250 HydrophobicContact CD1-CD1 4.12Å; I145-F250 HydrophobicContact CD1-CE1 4.23Å; I145-F250 HydrophobicContact CG1-CD1 4.34Å; F248-F250 HydrophobicContact CB-CD2 4.11Å; F248-F250 HydrophobicContact CB-CE1 4.34Å; F248-F250 HydrophobicContact CB-CE2 3.7Å; F248-F250 HydrophobicContact CB-CZ 3.83Å; F248-F250 HydrophobicContact CD1-CZ 4.27Å; F248-F250 HydrophobicContact CG-CE2 4.2Å; F248-F250 HydrophobicContact CG-CZ 4.29Å; F248-F250 PolarHBondContact O-N 2.77Å; F250-H276 WeakPolarHBondContact O-CB 3.22Å; F250-H276 PolarHBondContact O-N 2.68Å; F250-V279 HydrophobicContact CB-CG2 4.01Å
251	T	98	Very high	96.4	Very high	5 Å²	5	46.4 Å²	46.4	3%	0.031	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	143.3	176.9	49.3	0	0	0	0	113.8	F248 S254 M274	F248-T251 WeakPolarHBondContact CB-OG1 3.46Å; F248-T251 PolarHBondContact O-N 3.33Å; T251-S254 WeakPolarHBondContact CB-OG 3.32Å; T251-S254 PolarHBondContact O-OG 2.91Å; T251-S254 PolarHBondContact OG1-OG 3.35Å; T251-M274 CarbonylContact C-O 3.51Å; T251-M274 WeakPolarHBondContact CA-O 3.41Å; T251-M274 WeakPolarHBondContact CB-O 3.4Å; T251-M274 WeakPolarHBondContact CG2-O 3.37Å
252	E	97.8	Very high	95.9	Very high	112 Å²	112	53.6 Å²	53.6	52%	0.523	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	116.3	171.8	-174.5	67.2	-179.7	0	0	111	M274	E252-M274 PolarHBondContact N-O 3.05Å
253	P	97.8	Very high	95.5	Very high	69 Å²	69	54.3 Å²	54.3	45%	0.448	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	cis	-71	151.7	-2.2	30.4	-36.9	0	0	0	113	F220 G273 M274	F220-P253 HydrophobicContact CD2-CG 4.17Å; F220-P253 HydrophobicContact CE2-CG 4.26Å; P253-G273 WeakPolarHBondContact O-CA 3.22Å; P253-M274 HydrophobicContact CG-CG 4.21Å; P253-M274 PolarHBondContact O-N 2.83Å
254	S	98.2	Very high	95.2	Very high	7 Å²	7	54.7 Å²	54.7	5%	0.049	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	146.2	177.7	-72.4	0	0	0	0	112	S246 F248 T251	S246-S254 PolarHBondContact N-O 3.04Å; S246-S254 VanDerWaalsContact N-O 3.11Å; S246-S254 WeakPolarHBondContact O-CB 3.42Å; F248-S254 PolarHBondContact N-OG 3.37Å; T251-S254 WeakPolarHBondContact CB-OG 3.32Å; T251-S254 PolarHBondContact O-OG 2.91Å; T251-S254 PolarHBondContact OG1-OG 3.35Å
255	A	98.1	Very high	95	Very high	4 Å²	4	58 Å²	58	3%	0.033	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	146.4	175.6	0	0	0	0	0	113.6	F220 R244 C272	F220-A255 HydrophobicContact CZ-CB 3.91Å; R244-A255 CarbonylContact O-C 3.48Å; R244-A255 WeakPolarHBondContact O-CA 3.12Å; R244-A255 WeakPolarHBondContact O-CB 3.28Å; A255-C272 PolarHBondContact N-O 3.04Å; A255-C272 PolarHBondContact O-N 2.86Å; A255-C272 PolarHBondContact O-SG 3.28Å
256	E	97.9	Very high	94.9	Very high	31 Å²	31	56.1 Å²	56.1	15%	0.145	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	147.5	164.1	-78.2	161.9	-159	0	0	110	F243 R244 S246 F248	F243-E256 CarbonylContact C-O 3.52Å; F243-E256 WeakPolarHBondContact CA-O 3.32Å; R244-E256 IonicContact CZ-OE2 3.51Å; R244-E256 PolarHBondContact N-O 3.02Å; R244-E256 IonicContact NH1-OE2 3.72Å; R244-E256 PolarHBondContact NH1-OE2 2.89Å; R244-E256 IonicContact NH2-OE2 3.35Å; R244-E256 PolarHBondContact NH2-OE2 3.4Å; R244-E256 PolarHBondContact O-N 2.83Å; S246-E256 WeakPolarHBondContact CB-OE1 3.48Å; S246-E256 PolarHBondContact OG-OE1 3.01Å; F248-E256 HydrophobicContact CZ-CG 4.15Å
257	V	97.5	Very high	94.7	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	124.1	179.3	-176	0	0	0	0	109.9	L227 L231 I241 R242 F243 V269 L270	L227-V257 HydrophobicContact CD1-CG2 4.3Å; L231-V257 HydrophobicContact CD1-CG1 3.75Å; I241-V257 HydrophobicContact CG2-CG1 3.61Å; R242-V257 WeakPolarHBondContact O-CA 3.34Å; F243-V257 HydrophobicContact CD1-CG2 3.51Å; F243-V257 HydrophobicContact CE1-CG2 3.38Å; F243-V257 HydrophobicContact CG-CG2 4.25Å; F243-V257 HydrophobicContact CZ-CG1 4.38Å; F243-V257 HydrophobicContact CZ-CG2 4.04Å; V257-V269 HydrophobicContact CG1-CG2 4.36Å; V257-V269 VanDerWaalsContact O-CG2 3.25Å; V257-V269 WeakPolarHBondContact O-CG2 3.35Å; V257-V269 PolarHBondContact O-N 3.4Å; V257-L270 HydrophobicContact CB-CD1 3.63Å; V257-L270 HydrophobicContact CB-CG 3.87Å; V257-L270 HydrophobicContact CG1-CD1 4.47Å; V257-L270 HydrophobicContact CG1-CG 4.49Å; V257-L270 HydrophobicContact CG2-CD1 3.45Å; V257-L270 VanDerWaalsContact CG2-CD1 3.45Å; V257-L270 HydrophobicContact CG2-CG 4.26Å; V257-L270 PolarHBondContact N-O 3.43Å
258	D	96.3	Very high	94.6	Very high	5 Å²	5	53.5 Å²	53.5	3%	0.027	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	146.1	175.9	-46.3	-40.1	0	0	0	110.5	I241 R242 R244 W266 L267 E268	I241-D258 WeakPolarHBondContact CA-O 3.46Å; R242-D258 IonicContact CZ-OD2 3.19Å; R242-D258 PolarHBondContact N-O 2.71Å; R242-D258 IonicContact NE-OD2 3.71Å; R242-D258 PolarHBondContact NE-OD2 2.87Å; R242-D258 IonicContact NH2-OD2 3Å; R242-D258 PolarHBondContact NH2-OD2 2.83Å; R242-D258 PolarHBondContact O-N 2.85Å; R244-D258 WeakPolarHBondContact CD-OD2 3.4Å; R244-D258 IonicContact CZ-OD1 2.94Å; R244-D258 IonicContact CZ-OD2 2.77Å; R244-D258 IonicContact NE-OD1 2.66Å; R244-D258 IonicContact NE-OD2 2.85Å; R244-D258 PolarHBondContact NE-OD2 3.39Å; R244-D258 IonicContact NH2-OD1 3.41Å; R244-D258 PolarHBondContact NH2-OD1 3.3Å; R244-D258 IonicContact NH2-OD2 3.68Å; D258-W266 HydrophobicContact CB-CB 4.21Å; D258-W266 HydrophobicContact CB-CD2 4.44Å; D258-W266 HydrophobicContact CB-CE3 3.75Å; D258-L267 CarbonylContact C-O 3.55Å; D258-L267 VanDerWaalsContact CA-O 3.24Å; D258-L267 WeakPolarHBondContact CA-O 3.3Å; D258-E268 WeakPolarHBondContact OD1-CA 3.48Å
259	V	94.7	Very high	94.6	Very high	7 Å²	7	51.5 Å²	51.5	4%	0.042	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	145.3	168.2	-61.7	0	0	0	0	110.4	L231 L239 I241 G261 L267 V269	L231-V259 HydrophobicContact CD1-CG1 4Å; L231-V259 HydrophobicContact CD2-CG1 4.32Å; L239-V259 HydrophobicContact CD1-CB 4.41Å; L239-V259 HydrophobicContact CD1-CG1 4.13Å; I241-V259 HydrophobicContact CG1-CG1 4.36Å; V259-G261 PolarHBondContact O-N 2.97Å; V259-L267 HydrophobicContact CG2-CB 4.42Å; V259-L267 PolarHBondContact N-O 2.91Å; V259-L267 PolarHBondContact O-N 3.38Å; V259-V269 HydrophobicContact CG1-CG1 4.31Å; V259-V269 HydrophobicContact CG1-CG2 3.87Å; V259-V269 HydrophobicContact CG2-CG1 3.57Å
260	M	93.9	Very high	94.6	Very high	48 Å²	48	51.2 Å²	51.2	24%	0.236	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	117.1	173	-174.1	67.8	78.7	0	0	110.1	Q240 G264 W266	Q240-M260 HydrophobicContact CB-CB 3.88Å; Q240-M260 PolarHBondContact O-N 3.28Å; M260-G264 VanDerWaalsContact SD-O 3.39Å; M260-W266 HydrophobicContact CB-CE3 4.31Å; M260-W266 HydrophobicContact CB-CH2 4.33Å; M260-W266 HydrophobicContact CB-CZ3 4.11Å; M260-W266 HydrophobicContact CE-CD2 4.05Å; M260-W266 HydrophobicContact CE-CH2 4.14Å; M260-W266 HydrophobicContact CE-CZ2 3.45Å; M260-W266 VanDerWaalsContact CE-CZ2 3.45Å; M260-W266 HydrophobicContact SD-CD2 4.38Å
261	G	88.7	Confident	94.6	Very high	14 Å²	14	49.6 Å²	49.6	14%	0.144	26%	0.26	C	S	.	.			trans	-73	160.8	172.9	0	0	0	0	0	112.5	V259 N263 G264 K265	V259-G261 PolarHBondContact O-N 2.97Å; G261-N263 PolarHBondContact O-N 2.79Å; G261-G264 PolarHBondContact O-N 3.46Å; G261-K265 PolarHBondContact N-O 3.02Å
262	K	85	Confident	94.6	Very high	183 Å²	183	49.5 Å²	49.5	80%	0.796	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-18.2	178.5	-64	-177.4	178.6	179.5	0	114	E237 G264	E237-K262 VanDerWaalsContact OE1-CE 3.28Å; E237-K262 WeakPolarHBondContact OE1-CE 3.43Å; E237-K262 IonicContact OE1-NZ 3.07Å; E237-K262 PolarHBondContact OE1-NZ 3.11Å; E237-K262 WeakPolarHBondContact OE2-CE 3.36Å; E237-K262 IonicContact OE2-NZ 3.36Å; K262-G264 VanDerWaalsContact C-N 3.3Å
263	N	87.7	Confident	94.6	Very high	108 Å²	108	44.2 Å²	44.2	58%	0.578	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.1	5.3	174.4	63.9	-1.6	0	0	0	113.8	G261 K265	G261-N263 PolarHBondContact O-N 2.79Å; N263-K265 VanDerWaalsContact C-N 3.3Å; N263-K265 PolarHBondContact O-N 3.43Å; N263-K265 WeakPolarHBondContact OD1-CB 3.46Å; N263-K265 PolarHBondContact OD1-N 2.81Å
264	G	91.5	Very high	94.7	Very high	53 Å²	53	42 Å²	42	55%	0.546	22%	0.218	S	C	.	.	S	Bend	trans	74.7	14.1	-177.9	0	0	0	0	0	114.6	M260 G261 K262	M260-G264 VanDerWaalsContact SD-O 3.39Å; G261-G264 PolarHBondContact O-N 3.46Å; K262-G264 VanDerWaalsContact C-N 3.3Å
265	K	93.3	Very high	94.7	Very high	142 Å²	142	42.3 Å²	42.3	62%	0.617	22%	0.22	S	C	*	.			trans	-104.8	140.7	175.5	-62.2	-175.9	178	-178.1	0	110.7	G261 N263	G261-K265 PolarHBondContact N-O 3.02Å; N263-K265 VanDerWaalsContact C-N 3.3Å; N263-K265 PolarHBondContact O-N 3.43Å; N263-K265 WeakPolarHBondContact OD1-CB 3.46Å; N263-K265 PolarHBondContact OD1-N 2.81Å
266	W	94.6	Very high	94.7	Very high	85 Å²	85	44.1 Å²	44.1	32%	0.322	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	136.6	171.3	-68.8	101.6	0	0	0	110.7	Q240 R242 D258 M260	Q240-W266 HydrophobicContact CB-CH2 3.95Å; Q240-W266 HydrophobicContact CB-CZ3 4.46Å; Q240-W266 WeakPolarHBondContact O-CZ3 3.25Å; R242-W266 HydrophobicContact CB-CE3 4.16Å; R242-W266 HydrophobicContact CB-CH2 3.79Å; R242-W266 HydrophobicContact CB-CZ2 4.34Å; R242-W266 HydrophobicContact CB-CZ3 3.68Å; D258-W266 HydrophobicContact CB-CB 4.21Å; D258-W266 HydrophobicContact CB-CD2 4.44Å; D258-W266 HydrophobicContact CB-CE3 3.75Å; M260-W266 HydrophobicContact CB-CE3 4.31Å; M260-W266 HydrophobicContact CB-CH2 4.33Å; M260-W266 HydrophobicContact CB-CZ3 4.11Å; M260-W266 HydrophobicContact CE-CD2 4.05Å; M260-W266 HydrophobicContact CE-CH2 4.14Å; M260-W266 HydrophobicContact CE-CZ2 3.45Å; M260-W266 VanDerWaalsContact CE-CZ2 3.45Å; M260-W266 HydrophobicContact SD-CD2 4.38Å
267	L	92.6	Very high	94.7	Very high	44 Å²	44	44.9 Å²	44.9	23%	0.23	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	120	178.2	-63	171.1	0	0	0	108.6	D258 V259 L305	D258-L267 CarbonylContact C-O 3.55Å; D258-L267 VanDerWaalsContact CA-O 3.24Å; D258-L267 WeakPolarHBondContact CA-O 3.3Å; V259-L267 HydrophobicContact CG2-CB 4.42Å; V259-L267 PolarHBondContact N-O 2.91Å; V259-L267 PolarHBondContact O-N 3.38Å; L267-L305 HydrophobicContact CD1-CD2 3.75Å
268	E	94	Very high	94.7	Very high	98 Å²	98	47.5 Å²	47.5	46%	0.458	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	134.2	170.7	-170.4	-171.1	145.4	0	0	109.8	D258 R301	D258-E268 WeakPolarHBondContact OD1-CA 3.48Å; E268-R301 PolarHBondContact O-NE 2.87Å
269	V	94.8	Very high	94.8	Very high	7 Å²	7	47.4 Å²	47.4	4%	0.042	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	-29.6	-178.1	-72.1	0	0	0	0	114	L231 V257 V259 L302 L305	L231-V269 HydrophobicContact CD1-CG2 4.31Å; L231-V269 HydrophobicContact CD2-CG2 4.05Å; V257-V269 HydrophobicContact CG1-CG2 4.36Å; V257-V269 VanDerWaalsContact O-CG2 3.25Å; V257-V269 WeakPolarHBondContact O-CG2 3.35Å; V257-V269 PolarHBondContact O-N 3.4Å; V259-V269 HydrophobicContact CG1-CG1 4.31Å; V259-V269 HydrophobicContact CG1-CG2 3.87Å; V259-V269 HydrophobicContact CG2-CG1 3.57Å; V269-L302 HydrophobicContact CB-CD2 4.23Å; V269-L302 HydrophobicContact CG1-CD2 4.37Å; V269-L305 HydrophobicContact CG1-CD1 3.55Å
270	L	96.5	Very high	95	Very high	4 Å²	4	47.2 Å²	47.2	2%	0.021	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	157.4	-179.3	62.6	88.3	0	0	0	112.2	L227 F230 L231 V257 C272 G296 M297	L227-L270 HydrophobicContact CD1-CD1 3.73Å; L227-L270 HydrophobicContact CD2-CD1 4.18Å; L227-L270 HydrophobicContact CD2-CD2 4.02Å; F230-L270 HydrophobicContact CE1-CD2 4.47Å; L231-L270 HydrophobicContact CD1-CD2 4.46Å; L231-L270 HydrophobicContact CD2-CD2 4.24Å; V257-L270 HydrophobicContact CB-CD1 3.63Å; V257-L270 HydrophobicContact CB-CG 3.87Å; V257-L270 HydrophobicContact CG1-CD1 4.47Å; V257-L270 HydrophobicContact CG1-CG 4.49Å; V257-L270 HydrophobicContact CG2-CD1 3.45Å; V257-L270 VanDerWaalsContact CG2-CD1 3.45Å; V257-L270 HydrophobicContact CG2-CG 4.26Å; V257-L270 PolarHBondContact N-O 3.43Å; L270-C272 HydrophobicContact CD1-CB 4.2Å; L270-G296 WeakPolarHBondContact CA-O 3.41Å; L270-G296 VanDerWaalsContact CB-O 3.28Å; L270-G296 WeakPolarHBondContact CB-O 3.21Å; L270-M297 HydrophobicContact CB-CB 3.67Å; L270-M297 HydrophobicContact CD2-CE 4.13Å
271	G	97.6	Very high	95.2	Very high	16 Å²	16	51 Å²	51	17%	0.165	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	149.1	168.4	0	0	0	0	0	111	F295 G296	G271-F295 CarbonylContact O-C 3.58Å; G271-F295 VanDerWaalsContact O-CA 3.28Å; G271-F295 WeakPolarHBondContact O-CA 3.45Å; G271-G296 PolarHBondContact N-O 3Å; G271-G296 PolarHBondContact O-N 3.04Å
272	C	98.4	Very high	95.5	Very high	3 Å²	3	53.5 Å²	53.5	2%	0.02	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	169.1	180	68.7	0	0	0	0	113	L223 L227 A255 L270 A294 F295	L223-C272 HydrophobicContact CD1-CB 3.98Å; L223-C272 HydrophobicContact CD2-CB 4Å; L223-C272 HydrophobicContact CG-CB 4.42Å; L227-C272 HydrophobicContact CD1-CB 3.74Å; A255-C272 PolarHBondContact N-O 3.04Å; A255-C272 PolarHBondContact O-N 2.86Å; A255-C272 PolarHBondContact O-SG 3.28Å; L270-C272 HydrophobicContact CD1-CB 4.2Å; C272-A294 CarbonylContact C-O 3.53Å; C272-A294 VanDerWaalsContact CA-O 3.29Å; C272-A294 WeakPolarHBondContact CA-O 3.47Å; C272-A294 WeakPolarHBondContact CB-O 3.27Å; C272-F295 HydrophobicContact CB-CB 3.75Å
273	G	98.3	Very high	96.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.6	176.4	171.6	0	0	0	0	0	113.3	P253 F293 A294	P253-G273 WeakPolarHBondContact O-CA 3.22Å; G273-F293 VanDerWaalsContact O-CA 3.3Å; G273-F293 WeakPolarHBondContact O-CA 3.33Å; G273-F293 WeakPolarHBondContact O-CB 3.48Å; G273-A294 PolarHBondContact N-O 3.28Å; G273-A294 PolarHBondContact O-N 3.03Å
274	M	98.6	Very high	96.6	Very high	23 Å²	23	43 Å²	43	11%	0.113	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	133.4	168.6	-58.1	-55.1	-67.6	0	0	109	I218 F220 T251 E252 P253 H276 G292 F293	I218-M274 HydrophobicContact CG2-CE 4.24Å; I218-M274 WeakPolarHBondContact O-CE 3.13Å; F220-M274 VanDerWaalsContact CA-SD 3.59Å; F220-M274 HydrophobicContact CB-CG 4.38Å; F220-M274 HydrophobicContact CB-SD 4.01Å; F220-M274 HydrophobicContact CD2-CG 3.77Å; F220-M274 HydrophobicContact CD2-SD 3.84Å; F220-M274 HydrophobicContact CG-SD 4.44Å; F220-M274 PolarHBondContact N-SD 2.85Å; F220-M274 VanDerWaalsContact N-SD 3.43Å; T251-M274 CarbonylContact C-O 3.51Å; T251-M274 WeakPolarHBondContact CA-O 3.41Å; T251-M274 WeakPolarHBondContact CB-O 3.4Å; T251-M274 WeakPolarHBondContact CG2-O 3.37Å; E252-M274 PolarHBondContact N-O 3.05Å; P253-M274 HydrophobicContact CG-CG 4.21Å; P253-M274 PolarHBondContact O-N 2.83Å; M274-H276 PolarHBondContact O-N 3.19Å; M274-G292 CarbonylContact C-O 3.42Å; M274-G292 WeakPolarHBondContact CA-O 3.48Å; M274-G292 WeakPolarHBondContact CE-O 3.12Å; M274-F293 HydrophobicContact SD-CB 3.98Å
275	V	98.3	Very high	96.8	Very high	13 Å²	13	40.5 Å²	40.5	8%	0.079	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	127.3	-179.4	179.9	0	0	0	0	109.5	L212 V279 L280 G292 A294	L212-V275 HydrophobicContact CD1-CG2 3.6Å; V275-V279 HydrophobicContact CG1-CB 3.94Å; V275-V279 HydrophobicContact CG1-CG1 4.02Å; V275-L280 HydrophobicContact CG1-CD2 3.84Å; V275-L280 HydrophobicContact CG1-CG 3.95Å; V275-G292 PolarHBondContact N-O 3.31Å; V275-A294 HydrophobicContact CG2-CB 4.1Å
276	H	98.3	Very high	97	Very high	42 Å²	42	37.7 Å²	37.7	19%	0.194	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-64	136.1	-177	-172.8	-75.3	0	0	0	110.4	F250 M274 N278 V279 L280	F250-H276 WeakPolarHBondContact O-CB 3.22Å; F250-H276 PolarHBondContact O-N 2.68Å; M274-H276 PolarHBondContact O-N 3.19Å; H276-N278 PolarHBondContact CE1-ND2 3.1Å; H276-N278 WeakPolarHBondContact ND1-CB 3.43Å; H276-N278 PolarHBondContact ND1-N 3.36Å; H276-N278 VanDerWaalsContact ND1-N 3.11Å; H276-N278 PolarHBondContact O-N 3.03Å; H276-N278 VanDerWaalsContact O-N 3.08Å; H276-V279 HydrophobicContact CB-CG2 4.2Å; H276-V279 WeakPolarHBondContact O-CB 3.48Å; H276-V279 PolarHBondContact O-N 2.95Å; H276-L280 PolarHBondContact O-N 2.93Å
277	P	98	Very high	97.2	Very high	47 Å²	47	34.9 Å²	34.9	31%	0.305	19%	0.194	S	C	.	.	H	α-helix	trans	-52.6	-36.3	-177.2	-31.3	36.6	0	0	0	114.8	V279 L280 R281 P287	P277-V279 VanDerWaalsContact C-N 3.31Å; P277-V279 PolarHBondContact O-N 3.14Å; P277-L280 PolarHBondContact O-N 2.62Å; P277-R281 WeakPolarHBondContact O-CG 3.38Å; P277-R281 PolarHBondContact O-N 3.01Å; P277-P287 HydrophobicContact CB-CB 3.84Å; P277-P287 HydrophobicContact CB-CG 4.07Å
278	N	98	Very high	97.4	Very high	55 Å²	55	40.4 Å²	40.4	29%	0.294	22%	0.219	S	C	.	.	H	α-helix	trans	-61.2	-36.1	175.1	-68.5	-9.1	0	0	0	113.4	N144 H276 L280 R281 N282	N144-N278 HydrophobicContact CB-CB 4.37Å; N144-N278 WeakPolarHBondContact OD1-CB 3.34Å; N144-N278 PolarHBondContact OD1-ND2 3.08Å; H276-N278 PolarHBondContact CE1-ND2 3.1Å; H276-N278 WeakPolarHBondContact ND1-CB 3.43Å; H276-N278 PolarHBondContact ND1-N 3.36Å; H276-N278 VanDerWaalsContact ND1-N 3.11Å; H276-N278 PolarHBondContact O-N 3.03Å; H276-N278 VanDerWaalsContact O-N 3.08Å; N278-L280 VanDerWaalsContact C-N 3.33Å; N278-R281 PolarHBondContact O-N 3.47Å; N278-R281 PolarHBondContact OD1-NH1 2.88Å; N278-N282 WeakPolarHBondContact O-CB 3.39Å; N278-N282 PolarHBondContact O-N 3.13Å; N278-N282 PolarHBondContact O-ND2 3.18Å; N278-N282 PolarHBondContact O-OD1 2.96Å
279	V	98.1	Very high	97.5	Very high	4 Å²	4	39.5 Å²	39.5	2%	0.024	22%	0.22	C	C	.	.	H	α-helix	trans	-64.5	-42.5	177.8	178.5	0	0	0	0	110	L143 N144 I175 M178 F250 V275 H276 P277 N282 V283	L143-V279 HydrophobicContact CD2-CG1 4.43Å; N144-V279 HydrophobicContact CB-CG2 3.98Å; I175-V279 HydrophobicContact CD1-CG1 3.88Å; M178-V279 HydrophobicContact CE-CG1 4.11Å; F250-V279 HydrophobicContact CB-CG2 4.01Å; V275-V279 HydrophobicContact CG1-CB 3.94Å; V275-V279 HydrophobicContact CG1-CG1 4.02Å; H276-V279 HydrophobicContact CB-CG2 4.2Å; H276-V279 WeakPolarHBondContact O-CB 3.48Å; H276-V279 PolarHBondContact O-N 2.95Å; P277-V279 VanDerWaalsContact C-N 3.31Å; P277-V279 PolarHBondContact O-N 3.14Å; V279-N282 PolarHBondContact O-N 2.63Å; V279-V283 WeakPolarHBondContact O-CG2 3.47Å
280	L	98.2	Very high	97.7	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.016	23%	0.229	C	C	.	.	H	α-helix	trans	-63.1	-45.5	174.5	-62	180	0	0	0	111.6	M178 V214 V275 H276 P277 N278 N282 V283 G284 I285 P287	M178-L280 HydrophobicContact SD-CD2 4.08Å; V214-L280 HydrophobicContact CG1-CD2 4.18Å; V214-L280 HydrophobicContact CG2-CD2 4.17Å; V275-L280 HydrophobicContact CG1-CD2 3.84Å; V275-L280 HydrophobicContact CG1-CG 3.95Å; H276-L280 PolarHBondContact O-N 2.93Å; P277-L280 PolarHBondContact O-N 2.62Å; N278-L280 VanDerWaalsContact C-N 3.33Å; L280-N282 VanDerWaalsContact C-N 3.33Å; L280-N282 PolarHBondContact O-N 3.47Å; L280-V283 WeakPolarHBondContact O-CG2 3.29Å; L280-V283 PolarHBondContact O-N 3.05Å; L280-G284 PolarHBondContact O-N 3.17Å; L280-I285 CarbonylContact C-O 3.57Å; L280-I285 HydrophobicContact CB-CB 4.15Å; L280-I285 HydrophobicContact CB-CG2 4.28Å; L280-I285 HydrophobicContact CD2-CB 4.42Å; L280-I285 HydrophobicContact CD2-CG2 4.21Å; L280-I285 PolarHBondContact O-N 3.19Å; L280-I285 VanDerWaalsContact O-O 3.13Å; L280-P287 HydrophobicContact CB-CB 4.48Å; L280-P287 HydrophobicContact CD1-CB 4.1Å
281	R	97.8	Very high	97.7	Very high	126 Å²	126	43.4 Å²	43.4	48%	0.475	24%	0.24	S	C	.	.	H	α-helix	trans	-60.5	-40.4	176.5	-68.9	179.1	-166.7	116	4	112.5	P277 N278 V283 G284 P287	P277-R281 WeakPolarHBondContact O-CG 3.38Å; P277-R281 PolarHBondContact O-N 3.01Å; N278-R281 PolarHBondContact O-N 3.47Å; N278-R281 PolarHBondContact OD1-NH1 2.88Å; R281-V283 PolarHBondContact O-N 3.22Å; R281-V283 VanDerWaalsContact O-N 3.13Å; R281-G284 PolarHBondContact O-N 3.38Å; R281-G284 VanDerWaalsContact O-N 3.09Å; R281-P287 HydrophobicContact CG-CG 3.98Å
282	N	97	Very high	97.8	Very high	67 Å²	67	42.8 Å²	42.8	36%	0.358	23%	0.233	S	C	.	.	H	α-helix	trans	-61.6	-20.7	-179.7	-72.6	-15.1	0	0	0	113.5	Y137 A142 N278 V279 L280	Y137-N282 PolarHBondContact OH-O 2.71Å; A142-N282 PolarHBondContact O-ND2 3.45Å; N278-N282 WeakPolarHBondContact O-CB 3.39Å; N278-N282 PolarHBondContact O-N 3.13Å; N278-N282 PolarHBondContact O-ND2 3.18Å; N278-N282 PolarHBondContact O-OD1 2.96Å; V279-N282 PolarHBondContact O-N 2.63Å; L280-N282 VanDerWaalsContact C-N 3.33Å; L280-N282 PolarHBondContact O-N 3.47Å
283	V	97.3	Very high	97.8	Very high	14 Å²	14	42.7 Å²	42.7	9%	0.085	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.3	8.6	178.8	-59.9	0	0	0	0	113.2	I175 M178 K179 V279 L280 R281 I285	I175-V283 HydrophobicContact CD1-CG1 4.12Å; I175-V283 HydrophobicContact CG2-CG1 3.91Å; M178-V283 HydrophobicContact CB-CB 3.95Å; M178-V283 HydrophobicContact CB-CG1 4.27Å; M178-V283 HydrophobicContact CB-CG2 3.6Å; M178-V283 HydrophobicContact CE-CG1 4.4Å; M178-V283 HydrophobicContact CE-CG2 4.13Å; M178-V283 HydrophobicContact CG-CG2 4.38Å; M178-V283 HydrophobicContact SD-CG2 3.99Å; K179-V283 HydrophobicContact CG-CB 4.05Å; K179-V283 HydrophobicContact CG-CG1 3.96Å; V279-V283 WeakPolarHBondContact O-CG2 3.47Å; L280-V283 WeakPolarHBondContact O-CG2 3.29Å; L280-V283 PolarHBondContact O-N 3.05Å; R281-V283 PolarHBondContact O-N 3.22Å; R281-V283 VanDerWaalsContact O-N 3.13Å; V283-I285 HydrophobicContact CG2-CB 4.46Å; V283-I285 HydrophobicContact CG2-CD1 3.99Å; V283-I285 HydrophobicContact CG2-CG1 4.13Å
284	G	96.7	Very high	97.8	Very high	56 Å²	56	43.2 Å²	43.2	58%	0.577	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.3	22.9	176.2	0	0	0	0	0	115	L280 R281	L280-G284 PolarHBondContact O-N 3.17Å; R281-G284 PolarHBondContact O-N 3.38Å; R281-G284 VanDerWaalsContact O-N 3.09Å
285	I	97.5	Very high	97.8	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.01	23%	0.232	C	C	.	.			trans	-101.7	127.7	173.5	-63.6	172.5	0	0	0	108.7	M178 P183 I185 V214 L280 V283 P287 Y290	M178-I285 HydrophobicContact CB-CD1 3.91Å; M178-I285 HydrophobicContact CG-CD1 4Å; M178-I285 HydrophobicContact SD-CD1 4.06Å; P183-I285 HydrophobicContact CG-CD1 3.88Å; P183-I285 HydrophobicContact CG-CG1 4.23Å; P183-I285 HydrophobicContact CG-CG2 4.05Å; I185-I285 HydrophobicContact CD1-CD1 4.34Å; V214-I285 HydrophobicContact CG1-CD1 4.44Å; V214-I285 HydrophobicContact CG1-CG2 4.29Å; L280-I285 CarbonylContact C-O 3.57Å; L280-I285 HydrophobicContact CB-CB 4.15Å; L280-I285 HydrophobicContact CB-CG2 4.28Å; L280-I285 HydrophobicContact CD2-CB 4.42Å; L280-I285 HydrophobicContact CD2-CG2 4.21Å; L280-I285 PolarHBondContact O-N 3.19Å; L280-I285 VanDerWaalsContact O-O 3.13Å; V283-I285 HydrophobicContact CG2-CB 4.46Å; V283-I285 HydrophobicContact CG2-CD1 3.99Å; V283-I285 HydrophobicContact CG2-CG1 4.13Å; I285-P287 VanDerWaalsContact O-CD 3.28Å; I285-P287 WeakPolarHBondContact O-CD 3.19Å; I285-Y290 HydrophobicContact CG2-CD2 3.8Å; I285-Y290 HydrophobicContact CG2-CG 4.08Å
286	D	97.6	Very high	97.8	Very high	82 Å²	82	42.6 Å²	42.6	44%	0.439	24%	0.237	S	C	.	.			trans	-77	112.6	-179.8	-173.1	-5.5	0	0	0	111.4	E288 V289 Y290	D286-E288 PolarHBondContact O-N 3.45Å; D286-E288 WeakPolarHBondContact OD1-CB 3.48Å; D286-E288 PolarHBondContact OD1-N 2.97Å; D286-V289 HydrophobicContact CB-CB 4.42Å; D286-V289 HydrophobicContact CB-CG2 4.27Å; D286-V289 PolarHBondContact O-N 2.86Å; D286-V289 VanDerWaalsContact O-N 3.13Å; D286-Y290 PolarHBondContact O-N 3.35Å
287	P	97.5	Very high	97.7	Very high	27 Å²	27	40.8 Å²	40.8	18%	0.175	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-10.6	-179.7	31.4	-37	0	0	0	114	P277 L280 R281 I285 V289 Y290	P277-P287 HydrophobicContact CB-CB 3.84Å; P277-P287 HydrophobicContact CB-CG 4.07Å; L280-P287 HydrophobicContact CB-CB 4.48Å; L280-P287 HydrophobicContact CD1-CB 4.1Å; R281-P287 HydrophobicContact CG-CG 3.98Å; I285-P287 VanDerWaalsContact O-CD 3.28Å; I285-P287 WeakPolarHBondContact O-CD 3.19Å; P287-V289 VanDerWaalsContact C-N 3.33Å; P287-Y290 CarbonylContact C-O 3.59Å; P287-Y290 WeakPolarHBondContact CA-O 3.48Å
288	E	96.6	Very high	97.6	Very high	160 Å²	160	39.5 Å²	39.5	75%	0.748	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-20.6	172.5	-58.9	-60.3	137.8	0	0	111.9	D286	D286-E288 PolarHBondContact O-N 3.45Å; D286-E288 WeakPolarHBondContact OD1-CB 3.48Å; D286-E288 PolarHBondContact OD1-N 2.97Å
289	V	97.4	Very high	97.5	Very high	78 Å²	78	36.9 Å²	36.9	47%	0.473	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-43	178.8	-179.6	0	0	0	0	111.3	D286 P287	D286-V289 HydrophobicContact CB-CB 4.42Å; D286-V289 HydrophobicContact CB-CG2 4.27Å; D286-V289 PolarHBondContact O-N 2.86Å; D286-V289 VanDerWaalsContact O-N 3.13Å; P287-V289 VanDerWaalsContact C-N 3.33Å
290	Y	98.1	Very high	97.3	Very high	58 Å²	58	36.8 Å²	36.8	23%	0.227	21%	0.209	C	C	.	.			trans	-114.3	142.5	-174.3	-61.7	-74.9	0	0	0	111.5	P183 T216 I285 D286 P287	P183-Y290 HydrophobicContact CB-CD1 3.56Å; P183-Y290 HydrophobicContact CB-CE1 3.51Å; P183-Y290 HydrophobicContact CB-CG 4.11Å; P183-Y290 HydrophobicContact CG-CD1 3.94Å; P183-Y290 HydrophobicContact CG-CD2 4.18Å; P183-Y290 HydrophobicContact CG-CE1 4.13Å; P183-Y290 HydrophobicContact CG-CE2 4.35Å; P183-Y290 HydrophobicContact CG-CG 3.96Å; T216-Y290 HydrophobicContact CG2-CD1 3.96Å; T216-Y290 HydrophobicContact CG2-CE1 3.83Å; I285-Y290 HydrophobicContact CG2-CD2 3.8Å; I285-Y290 HydrophobicContact CG2-CG 4.08Å; D286-Y290 PolarHBondContact O-N 3.35Å; P287-Y290 CarbonylContact C-O 3.59Å; P287-Y290 WeakPolarHBondContact CA-O 3.48Å
291	S	97.7	Very high	97	Very high	36 Å²	36	41 Å²	41	25%	0.252	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	165.4	168.7	59.8	0	0	0	0	109.6	V214 D215 I218	V214-S291 WeakPolarHBondContact CA-O 3.39Å; D215-S291 PolarHBondContact N-O 3.46Å; D215-S291 PolarHBondContact O-N 2.89Å; I218-S291 WeakPolarHBondContact CA-OG 3.35Å; I218-S291 WeakPolarHBondContact CB-OG 3.46Å; I218-S291 PolarHBondContact N-OG 2.94Å; I218-S291 WeakPolarHBondContact O-CB 3.47Å; I218-S291 PolarHBondContact O-OG 3.44Å
292	G	98	Very high	96.9	Very high	2 Å²	2	35 Å²	35	2%	0.021	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	160.1	-178.8	0	0	0	0	0	112.4	I213 M274 V275	I213-G292 CarbonylContact O-C 3.54Å; I213-G292 WeakPolarHBondContact O-CA 3.46Å; M274-G292 CarbonylContact C-O 3.42Å; M274-G292 WeakPolarHBondContact CA-O 3.48Å; M274-G292 WeakPolarHBondContact CE-O 3.12Å; V275-G292 PolarHBondContact N-O 3.31Å
293	F	98.5	Very high	96.8	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.009	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	152.9	167.3	68.3	-114.9	0	0	0	110.2	I213 I218 N222 L223 T226 G273 M274 F295	I213-F293 HydrophobicContact CB-CE2 4.47Å; I213-F293 HydrophobicContact CB-CZ 4.39Å; I213-F293 HydrophobicContact CG2-CB 4.41Å; I213-F293 HydrophobicContact CG2-CD1 3.33Å; I213-F293 HydrophobicContact CG2-CD2 3.53Å; I213-F293 HydrophobicContact CG2-CE1 3.28Å; I213-F293 HydrophobicContact CG2-CE2 3.48Å; I213-F293 VanDerWaalsContact CG2-CE2 3.48Å; I213-F293 HydrophobicContact CG2-CG 3.46Å; I213-F293 VanDerWaalsContact CG2-CG 3.46Å; I213-F293 HydrophobicContact CG2-CZ 3.35Å; I213-F293 PolarHBondContact N-O 3.01Å; I213-F293 PolarHBondContact O-N 3.5Å; I218-F293 HydrophobicContact CG2-CD1 3.49Å; I218-F293 VanDerWaalsContact CG2-CD1 3.49Å; I218-F293 HydrophobicContact CG2-CE1 4.12Å; I218-F293 HydrophobicContact CG2-CG 4.37Å; N222-F293 HydrophobicContact CB-CD1 4.32Å; N222-F293 HydrophobicContact CB-CE1 3.82Å; L223-F293 HydrophobicContact CB-CB 3.9Å; L223-F293 HydrophobicContact CB-CD1 3.65Å; L223-F293 HydrophobicContact CB-CD2 4.18Å; L223-F293 HydrophobicContact CB-CE1 4.15Å; L223-F293 HydrophobicContact CB-CG 3.67Å; L223-F293 HydrophobicContact CD1-CB 3.99Å; L223-F293 HydrophobicContact CD1-CD1 4.42Å; L223-F293 HydrophobicContact CD1-CD2 3.36Å; L223-F293 HydrophobicContact CD1-CE2 3.86Å; L223-F293 HydrophobicContact CD1-CG 3.7Å; L223-F293 HydrophobicContact CD2-CB 4.13Å; L223-F293 HydrophobicContact CG-CB 4.22Å; L223-F293 HydrophobicContact CG-CD2 4.31Å; L223-F293 HydrophobicContact CG-CG 4.17Å; T226-F293 HydrophobicContact CG2-CZ 4.37Å; G273-F293 VanDerWaalsContact O-CA 3.3Å; G273-F293 WeakPolarHBondContact O-CA 3.33Å; G273-F293 WeakPolarHBondContact O-CB 3.48Å; M274-F293 HydrophobicContact SD-CB 3.98Å; F293-F295 HydrophobicContact CD2-CD1 4.13Å; F293-F295 AromaticContact CE2-CD1 3.93Å; F293-F295 HydrophobicContact CE2-CD1 3.93Å; F293-F295 AromaticContact CE2-CE1 3.95Å; F293-F295 HydrophobicContact CE2-CE1 3.95Å
294	A	98.5	Very high	96.6	Very high	11 Å²	11	31.9 Å²	31.9	9%	0.091	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	155	172.2	0	0	0	0	0	110.3	G211 L212 C272 G273 V275	G211-A294 WeakPolarHBondContact O-CA 3.45Å; L212-A294 HydrophobicContact CD1-CB 4.25Å; C272-A294 CarbonylContact C-O 3.53Å; C272-A294 VanDerWaalsContact CA-O 3.29Å; C272-A294 WeakPolarHBondContact CA-O 3.47Å; C272-A294 WeakPolarHBondContact CB-O 3.27Å; G273-A294 PolarHBondContact N-O 3.28Å; G273-A294 PolarHBondContact O-N 3.03Å; V275-A294 HydrophobicContact CG2-CB 4.1Å
295	F	98.5	Very high	96.4	Very high	5 Å²	5	31.6 Å²	31.6	2%	0.022	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	152.9	173.4	58.7	-96	0	0	0	109.9	F120 E210 G211 L223 L227 G271 C272 F293 M297	F120-F295 HydrophobicContact CD1-CZ 4.1Å; F120-F295 AromaticContact CE1-CE1 3.92Å; F120-F295 HydrophobicContact CE1-CE1 3.92Å; F120-F295 HydrophobicContact CE1-CE2 4.18Å; F120-F295 AromaticContact CE1-CZ 3.31Å; F120-F295 HydrophobicContact CE1-CZ 3.31Å; F120-F295 HydrophobicContact CE2-CE2 4.01Å; F120-F295 AromaticContact CE2-CZ 3.93Å; F120-F295 HydrophobicContact CE2-CZ 3.93Å; F120-F295 HydrophobicContact CZ-CE1 4.09Å; F120-F295 AromaticContact CZ-CE2 3.61Å; F120-F295 HydrophobicContact CZ-CE2 3.61Å; F120-F295 AromaticContact CZ-CZ 3.22Å; F120-F295 HydrophobicContact CZ-CZ 3.22Å; E210-F295 CarbonylContact C-O 3.54Å; E210-F295 WeakPolarHBondContact CA-O 3.44Å; E210-F295 WeakPolarHBondContact CB-O 3.43Å; G211-F295 VanDerWaalsContact CA-CZ 3.49Å; G211-F295 PolarHBondContact N-O 3.1Å; G211-F295 PolarHBondContact O-N 3Å; L223-F295 HydrophobicContact CD1-CD1 4.39Å; L227-F295 HydrophobicContact CD1-CB 4.36Å; L227-F295 HydrophobicContact CD2-CB 4.04Å; L227-F295 HydrophobicContact CD2-CD1 4.01Å; L227-F295 HydrophobicContact CD2-CD2 4.12Å; L227-F295 HydrophobicContact CD2-CG 3.79Å; G271-F295 CarbonylContact O-C 3.58Å; G271-F295 VanDerWaalsContact O-CA 3.28Å; G271-F295 WeakPolarHBondContact O-CA 3.45Å; C272-F295 HydrophobicContact CB-CB 3.75Å; F293-F295 HydrophobicContact CD2-CD1 4.13Å; F293-F295 AromaticContact CE2-CD1 3.93Å; F293-F295 HydrophobicContact CE2-CD1 3.93Å; F293-F295 AromaticContact CE2-CE1 3.95Å; F293-F295 HydrophobicContact CE2-CE1 3.95Å; F295-M297 HydrophobicContact CD2-CE 3.49Å; F295-M297 VanDerWaalsContact CD2-CE 3.49Å; F295-M297 HydrophobicContact CE2-CE 3.52Å
296	G	97.8	Very high	96.1	Very high	18 Å²	18	34.7 Å²	34.7	19%	0.186	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	133.5	178.8	0	0	0	0	0	110.7	L270 G271	L270-G296 WeakPolarHBondContact CA-O 3.41Å; L270-G296 VanDerWaalsContact CB-O 3.28Å; L270-G296 WeakPolarHBondContact CB-O 3.21Å; G271-G296 PolarHBondContact N-O 3Å; G271-G296 PolarHBondContact O-N 3.04Å
297	M	96.6	Very high	95.9	Very high	3 Å²	3	34.3 Å²	34.3	2%	0.015	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	138.5	-178.3	64.1	-174.4	79.3	0	0	110.7	I116 F120 M209 F230 L270 F295 M299 L302	I116-M297 HydrophobicContact CD1-SD 4.14Å; I116-M297 HydrophobicContact CG2-SD 4.4Å; F120-M297 HydrophobicContact CE2-CE 4.42Å; M209-M297 HydrophobicContact CB-CG 4.4Å; M209-M297 PolarHBondContact N-O 3Å; M209-M297 PolarHBondContact O-N 3.4Å; F230-M297 HydrophobicContact CD1-CE 4.05Å; F230-M297 HydrophobicContact CE1-CE 3.51Å; F230-M297 HydrophobicContact CE1-SD 3.49Å; F230-M297 WeakPolarHBondContact CE1-SD 3.36Å; F230-M297 HydrophobicContact CZ-CE 3.98Å; F230-M297 HydrophobicContact CZ-SD 3.52Å; F230-M297 VanDerWaalsContact CZ-SD 3.52Å; L270-M297 HydrophobicContact CB-CB 3.67Å; L270-M297 HydrophobicContact CD2-CE 4.13Å; F295-M297 HydrophobicContact CD2-CE 3.49Å; F295-M297 VanDerWaalsContact CD2-CE 3.49Å; F295-M297 HydrophobicContact CE2-CE 3.52Å; M297-M299 HydrophobicContact CB-CE 4.48Å; M297-M299 HydrophobicContact CG-CE 3.45Å; M297-M299 VanDerWaalsContact CG-CE 3.45Å; M297-M299 WeakPolarHBondContact O-CE 3.47Å; M297-M299 HydrophobicContact SD-CE 4.09Å; M297-L302 HydrophobicContact CB-CD1 4.17Å; M297-L302 HydrophobicContact CG-CD1 3.96Å; M297-L302 HydrophobicContact SD-CD1 3.43Å; M297-L302 WeakPolarHBondContact SD-CD1 3.46Å
298	G	95.6	Very high	95.6	Very high	20 Å²	20	35.9 Å²	35.9	21%	0.206	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	126.4	174.3	0	0	0	0	0	110.7	R301 L302	G298-R301 PolarHBondContact O-N 2.79Å; G298-L302 PolarHBondContact O-N 3.49Å
299	M	96.7	Very high	95.4	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-67.1	-45.1	-178.6	-60.7	-65.3	91.6	0	0	110.9	V109 I113 I116 H207 M209 M297 R301 L302 T303	V109-M299 HydrophobicContact CG1-CB 3.97Å; I113-M299 HydrophobicContact CD1-CG 4.28Å; I113-M299 HydrophobicContact CG1-CB 4.46Å; I113-M299 HydrophobicContact CG1-CG 3.78Å; I113-M299 HydrophobicContact CG1-SD 3.64Å; I116-M299 HydrophobicContact CD1-CE 3.69Å; I116-M299 HydrophobicContact CD1-SD 3.76Å; H207-M299 HydrophobicContact CB-CB 3.85Å; H207-M299 HydrophobicContact CB-CG 3.76Å; H207-M299 WeakPolarHBondContact O-CB 3.4Å; H207-M299 WeakPolarHBondContact O-CG 3.29Å; H207-M299 PolarHBondContact O-N 3.5Å; M209-M299 HydrophobicContact CB-CE 3.38Å; M209-M299 HydrophobicContact CB-SD 3.87Å; M209-M299 HydrophobicContact CE-SD 4.4Å; M297-M299 HydrophobicContact CB-CE 4.48Å; M297-M299 HydrophobicContact CG-CE 3.45Å; M297-M299 VanDerWaalsContact CG-CE 3.45Å; M297-M299 WeakPolarHBondContact O-CE 3.47Å; M297-M299 HydrophobicContact SD-CE 4.09Å; M299-R301 VanDerWaalsContact C-N 3.27Å; M299-R301 PolarHBondContact O-N 3.28Å; M299-L302 HydrophobicContact CE-CD1 4.32Å; M299-L302 PolarHBondContact O-N 2.87Å; M299-L302 VanDerWaalsContact O-N 3.14Å; M299-T303 WeakPolarHBondContact O-CB 3.24Å; M299-T303 PolarHBondContact O-N 3.08Å; M299-T303 PolarHBondContact O-OG1 3.02Å
300	E	94.7	Very high	95	Very high	3 Å²	3	31.8 Å²	31.8	1%	0.014	18%	0.182	C	C	.	.	H	α-helix	trans	-57.4	-43	179.3	-72.5	71.2	-162.7	0	0	111.1	V109 F206 H207 L302 T303 M304 L312 F315 F316	V109-E300 HydrophobicContact CG2-CG 4.37Å; F206-E300 WeakPolarHBondContact CB-OE2 3.15Å; H207-E300 IonicContact CE1-OE1 3.09Å; H207-E300 IonicContact CG-OE1 3.11Å; H207-E300 VanDerWaalsContact N-CD 3.32Å; H207-E300 PolarHBondContact N-OE1 3.5Å; H207-E300 PolarHBondContact N-OE2 2.75Å; H207-E300 IonicContact ND1-OE1 2.66Å; H207-E300 PolarHBondContact ND1-OE1 2.75Å; H207-E300 VanDerWaalsContact O-OE2 3.13Å; E300-L302 PolarHBondContact O-N 3.43Å; E300-T303 PolarHBondContact O-N 3.36Å; E300-M304 WeakPolarHBondContact O-CB 3.21Å; E300-M304 WeakPolarHBondContact O-CG 3.14Å; E300-M304 PolarHBondContact O-N 2.97Å; E300-L312 HydrophobicContact CB-CD1 3.51Å; E300-L312 HydrophobicContact CB-CG 3.95Å; E300-L312 HydrophobicContact CG-CD1 4.12Å; E300-L312 HydrophobicContact CG-CG 4.16Å; E300-F315 HydrophobicContact CB-CD2 4.3Å; E300-F315 HydrophobicContact CB-CE2 4.38Å; E300-F315 HydrophobicContact CG-CD2 4.04Å; E300-F316 HydrophobicContact CG-CE2 4.05Å; E300-F316 HydrophobicContact CG-CZ 4.06Å
301	R	92.2	Very high	94.7	Very high	90 Å²	90	30.8 Å²	30.8	34%	0.34	18%	0.18	S	C	.	.	H	α-helix	trans	-60.4	-47	177.7	-179	59.1	167.9	-172.3	-5.2	111.6	E268 G298 M299 M304 L305	E268-R301 PolarHBondContact O-NE 2.87Å; G298-R301 PolarHBondContact O-N 2.79Å; M299-R301 VanDerWaalsContact C-N 3.27Å; M299-R301 PolarHBondContact O-N 3.28Å; R301-M304 PolarHBondContact O-N 2.83Å; R301-L305 HydrophobicContact CG-CD1 4.38Å; R301-L305 VanDerWaalsContact O-CG 3.32Å; R301-L305 WeakPolarHBondContact O-CG 3.03Å; R301-L305 PolarHBondContact O-N 2.97Å; R301-L305 VanDerWaalsContact O-N 3.08Å
302	L	94.8	Very high	94.4	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-67.3	-39	177.7	-69.5	-178	0	0	0	112.2	T112 I116 F230 F234 F235 V269 M297 G298 M299 E300 L305 R306	T112-L302 HydrophobicContact CG2-CB 4.24Å; I116-L302 HydrophobicContact CD1-CD1 3.79Å; F230-L302 HydrophobicContact CE1-CD1 4.45Å; F230-L302 HydrophobicContact CZ-CD1 4.2Å; F234-L302 HydrophobicContact CE1-CB 3.93Å; F234-L302 HydrophobicContact CE1-CD2 4.34Å; F234-L302 HydrophobicContact CZ-CB 3.9Å; F235-L302 HydrophobicContact CE2-CD2 4.23Å; F235-L302 HydrophobicContact CZ-CD2 3.93Å; V269-L302 HydrophobicContact CB-CD2 4.23Å; V269-L302 HydrophobicContact CG1-CD2 4.37Å; M297-L302 HydrophobicContact CB-CD1 4.17Å; M297-L302 HydrophobicContact CG-CD1 3.96Å; M297-L302 HydrophobicContact SD-CD1 3.43Å; M297-L302 WeakPolarHBondContact SD-CD1 3.46Å; G298-L302 PolarHBondContact O-N 3.49Å; M299-L302 HydrophobicContact CE-CD1 4.32Å; M299-L302 PolarHBondContact O-N 2.87Å; M299-L302 VanDerWaalsContact O-N 3.14Å; E300-L302 PolarHBondContact O-N 3.43Å; L302-L305 PolarHBondContact O-N 2.91Å; L302-R306 WeakPolarHBondContact O-CB 3.47Å; L302-R306 PolarHBondContact O-N 3.15Å
303	T	95.4	Very high	94	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-60.6	-45.2	174.1	-57.3	0	0	0	0	111.1	P108 V109 T112 M299 E300 R306 Y307 F315	P108-T303 HydrophobicContact CB-CG2 3.82Å; V109-T303 HydrophobicContact CG2-CG2 4.39Å; T112-T303 VanDerWaalsContact CB-OG1 3.25Å; T112-T303 WeakPolarHBondContact CB-OG1 3.49Å; T112-T303 WeakPolarHBondContact CG2-OG1 3.37Å; T112-T303 PolarHBondContact OG1-OG1 2.88Å; M299-T303 WeakPolarHBondContact O-CB 3.24Å; M299-T303 PolarHBondContact O-N 3.08Å; M299-T303 PolarHBondContact O-OG1 3.02Å; E300-T303 PolarHBondContact O-N 3.36Å; T303-R306 PolarHBondContact O-N 3.3Å; T303-Y307 HydrophobicContact CG2-CD2 3.62Å; T303-Y307 HydrophobicContact CG2-CE2 3.91Å; T303-Y307 VanDerWaalsContact O-CD2 3.31Å; T303-Y307 WeakPolarHBondContact O-CD2 3.45Å; T303-Y307 PolarHBondContact O-N 3.04Å; T303-F315 HydrophobicContact CG2-CD1 4.5Å; T303-F315 HydrophobicContact CG2-CE1 3.53Å; T303-F315 HydrophobicContact CG2-CE2 4.29Å; T303-F315 HydrophobicContact CG2-CZ 3.42Å; T303-F315 VanDerWaalsContact CG2-CZ 3.42Å
304	M	92.8	Very high	93.7	Very high	16 Å²	16	33.8 Å²	33.8	8%	0.079	19%	0.19	C	C	.	.	H	α-helix	trans	-58.8	-48.9	176	-73	174.6	80.5	0	0	111.6	E300 R301 G308 V309 T310 L312 F315	E300-M304 WeakPolarHBondContact O-CB 3.21Å; E300-M304 WeakPolarHBondContact O-CG 3.14Å; E300-M304 PolarHBondContact O-N 2.97Å; R301-M304 PolarHBondContact O-N 2.83Å; M304-G308 CarbonylContact O-C 3.6Å; M304-G308 VanDerWaalsContact O-CA 3.29Å; M304-G308 WeakPolarHBondContact O-CA 3.5Å; M304-G308 PolarHBondContact O-N 3.29Å; M304-V309 WeakPolarHBondContact CB-O 3.3Å; M304-V309 VanDerWaalsContact CE-O 3.26Å; M304-V309 WeakPolarHBondContact CE-O 3.43Å; M304-V309 HydrophobicContact CG-CB 4.29Å; M304-V309 WeakPolarHBondContact CG-O 3.37Å; M304-V309 PolarHBondContact O-N 3.32Å; M304-V309 VanDerWaalsContact O-N 3.08Å; M304-T310 WeakPolarHBondContact CE-O 3.49Å; M304-L312 HydrophobicContact CE-CB 4.34Å; M304-L312 HydrophobicContact SD-CB 3.79Å; M304-L312 HydrophobicContact SD-CD1 4.09Å; M304-L312 HydrophobicContact SD-CG 4.29Å; M304-F315 HydrophobicContact CG-CE2 3.66Å; M304-F315 HydrophobicContact CG-CZ 4.07Å
305	L	91.8	Very high	93.5	Very high	50 Å²	50	33.5 Å²	33.5	26%	0.262	19%	0.187	S	C	.	.	H	α-helix	trans	-66.4	-39.5	-178.6	-67	173.7	0	0	0	112.1	F235 L267 V269 R301 L302	F235-L305 HydrophobicContact CE1-CB 3.68Å; F235-L305 HydrophobicContact CZ-CB 3.95Å; F235-L305 HydrophobicContact CZ-CD1 4.14Å; L267-L305 HydrophobicContact CD1-CD2 3.75Å; V269-L305 HydrophobicContact CG1-CD1 3.55Å; R301-L305 HydrophobicContact CG-CD1 4.38Å; R301-L305 VanDerWaalsContact O-CG 3.32Å; R301-L305 WeakPolarHBondContact O-CG 3.03Å; R301-L305 PolarHBondContact O-N 2.97Å; R301-L305 VanDerWaalsContact O-N 3.08Å; L302-L305 PolarHBondContact O-N 2.91Å
306	R	92.3	Very high	93.2	Very high	68 Å²	68	36 Å²	36	26%	0.257	20%	0.198	S	C	.	.	H	α-helix	trans	-66.5	-44.5	179	-174.9	-178.6	-177.3	83.1	9.6	112.1	R115 F234 E236 L302 T303	R115-R306 VanDerWaalsContact NE-NH1 3.16Å; F234-R306 HydrophobicContact CE1-CB 4.07Å; F234-R306 HydrophobicContact CZ-CB 4.2Å; F234-R306 PolarHBondContact O-NH1 3.49Å; E236-R306 IonicContact OE1-CZ 3.79Å; E236-R306 IonicContact OE1-NH1 3.61Å; E236-R306 IonicContact OE1-NH2 3.94Å; E236-R306 PolarHBondContact OE1-NH2 2.88Å; L302-R306 WeakPolarHBondContact O-CB 3.47Å; L302-R306 PolarHBondContact O-N 3.15Å; T303-R306 PolarHBondContact O-N 3.3Å
307	Y	93.2	Very high	93	Very high	74 Å²	74	41.3 Å²	41.3	29%	0.29	22%	0.218	S	C	.	.	H	α-helix	trans	-101.4	-0.8	-172.2	-62.8	-60.4	0	0	0	114.5	P108 T303 V309 F326	P108-Y307 HydrophobicContact CB-CD2 4.25Å; P108-Y307 HydrophobicContact CB-CE2 4.08Å; T303-Y307 HydrophobicContact CG2-CD2 3.62Å; T303-Y307 HydrophobicContact CG2-CE2 3.91Å; T303-Y307 VanDerWaalsContact O-CD2 3.31Å; T303-Y307 WeakPolarHBondContact O-CD2 3.45Å; T303-Y307 PolarHBondContact O-N 3.04Å; Y307-V309 VanDerWaalsContact C-N 3.33Å; Y307-V309 PolarHBondContact O-N 2.88Å; Y307-F326 HydrophobicContact CD1-CD1 4.08Å; Y307-F326 HydrophobicContact CD1-CE1 4.01Å; Y307-F326 HydrophobicContact CD2-CD1 4.24Å; Y307-F326 AromaticContact CD2-CE1 3.97Å; Y307-F326 HydrophobicContact CD2-CE1 3.97Å; Y307-F326 HydrophobicContact CE1-CD1 4.31Å; Y307-F326 HydrophobicContact CE2-CD1 4.48Å; Y307-F326 HydrophobicContact CG-CD1 4.05Å; Y307-F326 AromaticContact CG-CE1 3.63Å; Y307-F326 HydrophobicContact CG-CE1 3.63Å
308	G	90.4	Very high	92.9	Very high	60 Å²	60	45.5 Å²	45.5	62%	0.619	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.6	28.5	-178.1	0	0	0	0	0	114	M304	M304-G308 CarbonylContact O-C 3.6Å; M304-G308 VanDerWaalsContact O-CA 3.29Å; M304-G308 WeakPolarHBondContact O-CA 3.5Å; M304-G308 PolarHBondContact O-N 3.29Å
309	V	92.2	Very high	92.9	Very high	20 Å²	20	46.8 Å²	46.8	12%	0.121	24%	0.243	C	C	.	.			trans	-79.6	127.2	176.6	-179.1	0	0	0	0	109.2	M304 Y307 D311 F315 F322 F326	M304-V309 WeakPolarHBondContact CB-O 3.3Å; M304-V309 VanDerWaalsContact CE-O 3.26Å; M304-V309 WeakPolarHBondContact CE-O 3.43Å; M304-V309 HydrophobicContact CG-CB 4.29Å; M304-V309 WeakPolarHBondContact CG-O 3.37Å; M304-V309 PolarHBondContact O-N 3.32Å; M304-V309 VanDerWaalsContact O-N 3.08Å; Y307-V309 VanDerWaalsContact C-N 3.33Å; Y307-V309 PolarHBondContact O-N 2.88Å; V309-D311 WeakPolarHBondContact CG1-O 3.39Å; V309-F315 HydrophobicContact CB-CZ 4.03Å; V309-F315 HydrophobicContact CG1-CE1 4.49Å; V309-F315 HydrophobicContact CG1-CE2 4.45Å; V309-F315 HydrophobicContact CG1-CZ 4.01Å; V309-F315 HydrophobicContact CG2-CE1 4.31Å; V309-F315 HydrophobicContact CG2-CZ 4.11Å; V309-F322 HydrophobicContact CG1-CE2 4.12Å; V309-F322 HydrophobicContact CG1-CZ 4.27Å; V309-F322 HydrophobicContact CG2-CE2 3.97Å; V309-F322 HydrophobicContact CG2-CZ 4.16Å; V309-F326 HydrophobicContact CG2-CZ 4.01Å
310	T	89.3	Confident	92.7	Very high	132 Å²	132	52.7 Å²	52.7	81%	0.81	27%	0.273	S	S	*	.			trans	-93.7	-22.7	-174.9	51.4	0	0	0	0	114.1	M304	M304-T310 WeakPolarHBondContact CE-O 3.49Å
311	D	90.7	Very high	92.7	Very high	36 Å²	36	61.4 Å²	61.4	19%	0.193	31%	0.306	C	S	.	.			trans	-123.1	113.4	-177.5	-169.3	-20.4	0	0	0	110.5	V309 R313 S314	V309-D311 WeakPolarHBondContact CG1-O 3.39Å; D311-R313 PolarHBondContact O-N 3.28Å; D311-R313 WeakPolarHBondContact OD1-CB 3.42Å; D311-R313 WeakPolarHBondContact OD1-CG 3.23Å; D311-R313 IonicContact OD1-CZ 3.54Å; D311-R313 PolarHBondContact OD1-N 3.02Å; D311-R313 IonicContact OD1-NE 2.66Å; D311-R313 PolarHBondContact OD1-NE 2.85Å; D311-R313 IonicContact OD1-NH2 2.81Å; D311-R313 IonicContact OD2-CZ 3.81Å; D311-R313 IonicContact OD2-NE 3.31Å; D311-R313 PolarHBondContact OD2-NE 2.97Å; D311-R313 IonicContact OD2-NH2 3.34Å; D311-R313 PolarHBondContact OD2-NH2 3.37Å; D311-S314 WeakPolarHBondContact O-CB 3.37Å; D311-S314 PolarHBondContact O-N 3.13Å; D311-S314 PolarHBondContact O-OG 3.41Å
312	L	91.8	Very high	92.9	Very high	12 Å²	12	58.4 Å²	58.4	6%	0.063	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-29.8	-176.5	-176.5	148	0	0	0	112.1	Q200 T203 E300 M304 S314 F315 F316	Q200-L312 WeakPolarHBondContact O-CB 3.37Å; Q200-L312 PolarHBondContact O-N 3.08Å; T203-L312 HydrophobicContact CG2-CD2 3.23Å; T203-L312 WeakPolarHBondContact OG1-CD2 2.9Å; E300-L312 HydrophobicContact CB-CD1 3.51Å; E300-L312 HydrophobicContact CB-CG 3.95Å; E300-L312 HydrophobicContact CG-CD1 4.12Å; E300-L312 HydrophobicContact CG-CG 4.16Å; M304-L312 HydrophobicContact CE-CB 4.34Å; M304-L312 HydrophobicContact SD-CB 3.79Å; M304-L312 HydrophobicContact SD-CD1 4.09Å; M304-L312 HydrophobicContact SD-CG 4.29Å; L312-S314 PolarHBondContact O-N 3.21Å; L312-S314 VanDerWaalsContact O-N 3.16Å; L312-F315 HydrophobicContact CG-CD2 4.36Å; L312-F315 WeakPolarHBondContact O-CB 3.48Å; L312-F315 VanDerWaalsContact O-CD2 3.24Å; L312-F315 WeakPolarHBondContact O-CD2 3.37Å; L312-F315 PolarHBondContact O-N 3.01Å; L312-F315 VanDerWaalsContact O-N 3.16Å; L312-F316 HydrophobicContact CD2-CD2 4.13Å; L312-F316 HydrophobicContact CD2-CE2 3.59Å; L312-F316 HydrophobicContact CG-CE2 4.44Å
313	R	90.5	Very high	92.9	Very high	66 Å²	66	60.2 Å²	60.2	25%	0.249	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-25.9	-178	-61	171.7	-65.7	171.2	4	112.5	D311 F315 F316 E317	D311-R313 PolarHBondContact O-N 3.28Å; D311-R313 WeakPolarHBondContact OD1-CB 3.42Å; D311-R313 WeakPolarHBondContact OD1-CG 3.23Å; D311-R313 IonicContact OD1-CZ 3.54Å; D311-R313 PolarHBondContact OD1-N 3.02Å; D311-R313 IonicContact OD1-NE 2.66Å; D311-R313 PolarHBondContact OD1-NE 2.85Å; D311-R313 IonicContact OD1-NH2 2.81Å; D311-R313 IonicContact OD2-CZ 3.81Å; D311-R313 IonicContact OD2-NE 3.31Å; D311-R313 PolarHBondContact OD2-NE 2.97Å; D311-R313 IonicContact OD2-NH2 3.34Å; D311-R313 PolarHBondContact OD2-NH2 3.37Å; R313-F315 PolarHBondContact O-N 3.38Å; R313-F315 VanDerWaalsContact O-N 3.1Å; R313-F316 PolarHBondContact O-N 3.42Å; R313-E317 PolarHBondContact O-N 3.17Å
314	S	92.3	Very high	92.8	Very high	26 Å²	26	64.9 Å²	64.9	18%	0.182	33%	0.326	C	S	.	.	H	α-helix	trans	-55.6	-29.5	177.3	-48.9	0	0	0	0	112.9	D311 L312 F316 F322	D311-S314 WeakPolarHBondContact O-CB 3.37Å; D311-S314 PolarHBondContact O-N 3.13Å; D311-S314 PolarHBondContact O-OG 3.41Å; L312-S314 PolarHBondContact O-N 3.21Å; L312-S314 VanDerWaalsContact O-N 3.16Å; S314-F316 VanDerWaalsContact C-N 3.33Å; S314-F322 WeakPolarHBondContact O-CD1 3.39Å; S314-F322 WeakPolarHBondContact O-CE1 3.28Å
315	F	93.9	Very high	92.9	Very high	4 Å²	4	71 Å²	71	2%	0.018	35%	0.354	C	S	.	.	H	α-helix	trans	-70.5	-25.8	175.5	-62.5	-49.8	0	0	0	113.5	H107 P108 V109 E300 T303 M304 V309 L312 R313 F322	H107-F315 AromaticContact CE1-CD1 3.96Å; H107-F315 PolarHBondContact NE2-O 3.35Å; P108-F315 HydrophobicContact CB-CE1 4.17Å; P108-F315 HydrophobicContact CG-CD1 3.71Å; P108-F315 HydrophobicContact CG-CE1 3.68Å; V109-F315 HydrophobicContact CG2-CB 4.37Å; V109-F315 HydrophobicContact CG2-CD1 4.14Å; V109-F315 HydrophobicContact CG2-CD2 4.41Å; V109-F315 HydrophobicContact CG2-CG 4.06Å; E300-F315 HydrophobicContact CB-CD2 4.3Å; E300-F315 HydrophobicContact CB-CE2 4.38Å; E300-F315 HydrophobicContact CG-CD2 4.04Å; T303-F315 HydrophobicContact CG2-CD1 4.5Å; T303-F315 HydrophobicContact CG2-CE1 3.53Å; T303-F315 HydrophobicContact CG2-CE2 4.29Å; T303-F315 HydrophobicContact CG2-CZ 3.42Å; T303-F315 VanDerWaalsContact CG2-CZ 3.42Å; M304-F315 HydrophobicContact CG-CE2 3.66Å; M304-F315 HydrophobicContact CG-CZ 4.07Å; V309-F315 HydrophobicContact CB-CZ 4.03Å; V309-F315 HydrophobicContact CG1-CE1 4.49Å; V309-F315 HydrophobicContact CG1-CE2 4.45Å; V309-F315 HydrophobicContact CG1-CZ 4.01Å; V309-F315 HydrophobicContact CG2-CE1 4.31Å; V309-F315 HydrophobicContact CG2-CZ 4.11Å; L312-F315 HydrophobicContact CG-CD2 4.36Å; L312-F315 WeakPolarHBondContact O-CB 3.48Å; L312-F315 VanDerWaalsContact O-CD2 3.24Å; L312-F315 WeakPolarHBondContact O-CD2 3.37Å; L312-F315 PolarHBondContact O-N 3.01Å; L312-F315 VanDerWaalsContact O-N 3.16Å; R313-F315 PolarHBondContact O-N 3.38Å; R313-F315 VanDerWaalsContact O-N 3.1Å; F315-F322 AromaticContact CD1-CE1 3.68Å; F315-F322 HydrophobicContact CD1-CE1 3.68Å; F315-F322 AromaticContact CD1-CZ 3.64Å; F315-F322 HydrophobicContact CD1-CZ 3.64Å; F315-F322 HydrophobicContact CE1-CE1 4.07Å; F315-F322 AromaticContact CE1-CZ 3.56Å; F315-F322 HydrophobicContact CE1-CZ 3.56Å
316	F	92.9	Very high	92.9	Very high	58 Å²	58	69.6 Å²	69.6	25%	0.254	35%	0.346	S	S	.	.	H	α-helix	trans	-103.3	-24.8	-174.7	-60.4	-85	0	0	0	112.7	T203 M205 E300 L312 R313 S314 N318	T203-F316 HydrophobicContact CG2-CD2 3.8Å; T203-F316 HydrophobicContact CG2-CE2 3.89Å; T203-F316 WeakPolarHBondContact OG1-CE2 3.4Å; M205-F316 HydrophobicContact CE-CD1 3.83Å; M205-F316 HydrophobicContact CE-CE1 3.55Å; M205-F316 VanDerWaalsContact O-CE1 3.28Å; M205-F316 WeakPolarHBondContact O-CE1 3.47Å; M205-F316 WeakPolarHBondContact O-CZ 3.29Å; M205-F316 HydrophobicContact SD-CE1 3.84Å; E300-F316 HydrophobicContact CG-CE2 4.05Å; E300-F316 HydrophobicContact CG-CZ 4.06Å; L312-F316 HydrophobicContact CD2-CD2 4.13Å; L312-F316 HydrophobicContact CD2-CE2 3.59Å; L312-F316 HydrophobicContact CG-CE2 4.44Å; R313-F316 PolarHBondContact O-N 3.42Å; S314-F316 VanDerWaalsContact C-N 3.33Å; F316-N318 PolarHBondContact O-N 3.43Å; F316-N318 PolarHBondContact O-ND2 2.75Å
317	E	92.9	Very high	92.6	Very high	130 Å²	130	72.4 Å²	72.4	61%	0.607	36%	0.36	S	S	*	.	H	α-helix	trans	-64.3	-24.1	171.8	-71	178.8	175.6	0	0	112.6	R313 D319	R313-E317 PolarHBondContact O-N 3.17Å; E317-D319 PolarHBondContact O-N 3.47Å
318	N	93.9	Very high	92.6	Very high	91 Å²	91	72.4 Å²	72.4	49%	0.487	36%	0.363	S	S	.	.			trans	55.1	35.8	179.7	-69.6	-79.4	0	0	0	113.4	F316 L320 L323	F316-N318 PolarHBondContact O-N 3.43Å; F316-N318 PolarHBondContact O-ND2 2.75Å; N318-L320 PolarHBondContact O-N 3Å; N318-L323 HydrophobicContact CB-CD1 4.3Å
319	D	95.4	Very high	92.7	Very high	47 Å²	47	73 Å²	73	25%	0.251	35%	0.35	S	S	.	.			trans	-62.4	120.9	176.3	-171.8	-37.6	0	0	0	110.3	E317 R321 F322 L323	E317-D319 PolarHBondContact O-N 3.47Å; D319-R321 PolarHBondContact O-N 3.44Å; D319-R321 VanDerWaalsContact O-N 3.13Å; D319-R321 VanDerWaalsContact OD1-CB 3.23Å; D319-R321 WeakPolarHBondContact OD1-CB 3.43Å; D319-R321 WeakPolarHBondContact OD1-CG 3.45Å; D319-R321 PolarHBondContact OD1-N 2.67Å; D319-R321 IonicContact OD1-NE 2.73Å; D319-R321 PolarHBondContact OD1-NE 3Å; D319-R321 VanDerWaalsContact OD1-NE 3.11Å; D319-R321 IonicContact OD2-CZ 3.91Å; D319-R321 VanDerWaalsContact OD2-CZ 3.31Å; D319-R321 IonicContact OD2-NE 2.76Å; D319-R321 PolarHBondContact OD2-NE 3.05Å; D319-R321 VanDerWaalsContact OD2-NE 3.15Å; D319-R321 IonicContact OD2-NH2 3.61Å; D319-R321 PolarHBondContact OD2-NH2 2.91Å; D319-F322 HydrophobicContact CB-CB 4.14Å; D319-F322 WeakPolarHBondContact O-CA 3.46Å; D319-F322 WeakPolarHBondContact O-CB 3.4Å; D319-F322 PolarHBondContact O-N 2.98Å; D319-L323 WeakPolarHBondContact O-CG 3.21Å; D319-L323 PolarHBondContact O-N 2.85Å
320	L	94.2	Very high	92.7	Very high	124 Å²	124	75.9 Å²	75.9	65%	0.649	36%	0.363	S	S	*	.	H	α-helix	trans	-57.1	-30.8	-179.4	-66.3	178.2	0	0	0	113	N318 K324	N318-L320 PolarHBondContact O-N 3Å; L320-K324 VanDerWaalsContact O-CB 3.24Å; L320-K324 WeakPolarHBondContact O-CB 3.47Å; L320-K324 WeakPolarHBondContact O-CG 3.35Å; L320-K324 PolarHBondContact O-N 3.3Å
321	R	94.1	Very high	92.9	Very high	186 Å²	186	72.6 Å²	72.6	70%	0.702	34%	0.336	S	S	*	.	H	α-helix	trans	-70.8	-33.9	177.4	-58.7	171.2	-68.4	179.7	0.2	111.7	D319 Q325	D319-R321 PolarHBondContact O-N 3.44Å; D319-R321 VanDerWaalsContact O-N 3.13Å; D319-R321 VanDerWaalsContact OD1-CB 3.23Å; D319-R321 WeakPolarHBondContact OD1-CB 3.43Å; D319-R321 WeakPolarHBondContact OD1-CG 3.45Å; D319-R321 PolarHBondContact OD1-N 2.67Å; D319-R321 IonicContact OD1-NE 2.73Å; D319-R321 PolarHBondContact OD1-NE 3Å; D319-R321 VanDerWaalsContact OD1-NE 3.11Å; D319-R321 IonicContact OD2-CZ 3.91Å; D319-R321 VanDerWaalsContact OD2-CZ 3.31Å; D319-R321 IonicContact OD2-NE 2.76Å; D319-R321 PolarHBondContact OD2-NE 3.05Å; D319-R321 VanDerWaalsContact OD2-NE 3.15Å; D319-R321 IonicContact OD2-NH2 3.61Å; D319-R321 PolarHBondContact OD2-NH2 2.91Å; R321-Q325 WeakPolarHBondContact O-CG 3.4Å; R321-Q325 PolarHBondContact O-NE2 3.11Å; R321-Q325 VanDerWaalsContact O-NE2 3.13Å
322	F	95.5	Very high	93.1	Very high	26 Å²	26	74.9 Å²	74.9	11%	0.114	35%	0.345	C	S	.	.	H	α-helix	trans	-72.1	-52.7	173.1	171.3	-105.7	0	0	0	110.2	P108 V309 S314 F315 D319 K324 Q325 F326	P108-F322 HydrophobicContact CG-CE1 4.16Å; P108-F322 HydrophobicContact CG-CZ 4.42Å; V309-F322 HydrophobicContact CG1-CE2 4.12Å; V309-F322 HydrophobicContact CG1-CZ 4.27Å; V309-F322 HydrophobicContact CG2-CE2 3.97Å; V309-F322 HydrophobicContact CG2-CZ 4.16Å; S314-F322 WeakPolarHBondContact O-CD1 3.39Å; S314-F322 WeakPolarHBondContact O-CE1 3.28Å; F315-F322 AromaticContact CD1-CE1 3.68Å; F315-F322 HydrophobicContact CD1-CE1 3.68Å; F315-F322 AromaticContact CD1-CZ 3.64Å; F315-F322 HydrophobicContact CD1-CZ 3.64Å; F315-F322 HydrophobicContact CE1-CE1 4.07Å; F315-F322 AromaticContact CE1-CZ 3.56Å; F315-F322 HydrophobicContact CE1-CZ 3.56Å; D319-F322 HydrophobicContact CB-CB 4.14Å; D319-F322 WeakPolarHBondContact O-CA 3.46Å; D319-F322 WeakPolarHBondContact O-CB 3.4Å; D319-F322 PolarHBondContact O-N 2.98Å; F322-K324 VanDerWaalsContact C-N 3.29Å; F322-K324 PolarHBondContact O-N 3.09Å; F322-Q325 WeakPolarHBondContact O-CB 3.38Å; F322-Q325 PolarHBondContact O-N 2.92Å; F322-F326 HydrophobicContact CD1-CE2 4.17Å; F322-F326 AromaticContact CD2-CE2 3.91Å; F322-F326 HydrophobicContact CD2-CE2 3.91Å; F322-F326 HydrophobicContact CD2-CZ 4.4Å; F322-F326 AromaticContact CE1-CE2 3.81Å; F322-F326 HydrophobicContact CE1-CE2 3.81Å; F322-F326 AromaticContact CE2-CE2 3.53Å; F322-F326 HydrophobicContact CE2-CE2 3.53Å; F322-F326 AromaticContact CE2-CZ 3.7Å; F322-F326 HydrophobicContact CE2-CZ 3.7Å; F322-F326 HydrophobicContact CG-CE2 4.22Å; F322-F326 AromaticContact CZ-CE2 3.48Å; F322-F326 HydrophobicContact CZ-CE2 3.48Å; F322-F326 VanDerWaalsContact CZ-CE2 3.48Å; F322-F326 AromaticContact CZ-CZ 3.77Å; F322-F326 HydrophobicContact CZ-CZ 3.77Å; F322-F326 WeakPolarHBondContact O-CD2 3.45Å; F322-F326 WeakPolarHBondContact O-CE2 3.48Å
323	L	95.5	Very high	93.2	Very high	39 Å²	39	79.1 Å²	79.1	20%	0.204	36%	0.364	C	S	.	.	H	α-helix	trans	-61.1	-35.3	-177.6	-62.5	179.9	0	0	0	113.1	H107 N318 D319 Q325 F326	H107-L323 WeakPolarHBondContact CD2-CD2 3.33Å; N318-L323 HydrophobicContact CB-CD1 4.3Å; D319-L323 WeakPolarHBondContact O-CG 3.21Å; D319-L323 PolarHBondContact O-N 2.85Å; L323-Q325 PolarHBondContact O-N 2.94Å; L323-Q325 VanDerWaalsContact O-N 3.16Å; L323-F326 PolarHBondContact O-N 3.13Å
324	K	93.5	Very high	93.3	Very high	98 Å²	98	80.1 Å²	80.1	43%	0.426	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-61.9	-19	176.8	-81.3	-179.5	-177.4	-153.3	0	113.8	E102 L320 F322 F326 K327	E102-K324 IonicContact OE1-NZ 3.91Å; E102-K324 IonicContact OE2-NZ 3.82Å; E102-K324 PolarHBondContact OE2-NZ 3.39Å; E102-K324 VanDerWaalsContact OE2-NZ 3.07Å; L320-K324 VanDerWaalsContact O-CB 3.24Å; L320-K324 WeakPolarHBondContact O-CB 3.47Å; L320-K324 WeakPolarHBondContact O-CG 3.35Å; L320-K324 PolarHBondContact O-N 3.3Å; F322-K324 VanDerWaalsContact C-N 3.29Å; F322-K324 PolarHBondContact O-N 3.09Å; K324-F326 PolarHBondContact O-N 3.24Å; K324-K327 HydrophobicContact CG-CD 4.28Å
325	Q	94	Very high	93.4	Very high	145 Å²	145	84.2 Å²	84.2	68%	0.678	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-74	-15.9	178.2	-63.1	173.8	50.6	0	0	113.1	R321 F322 L323	R321-Q325 WeakPolarHBondContact O-CG 3.4Å; R321-Q325 PolarHBondContact O-NE2 3.11Å; R321-Q325 VanDerWaalsContact O-NE2 3.13Å; F322-Q325 WeakPolarHBondContact O-CB 3.38Å; F322-Q325 PolarHBondContact O-N 2.92Å; L323-Q325 PolarHBondContact O-N 2.94Å; L323-Q325 VanDerWaalsContact O-N 3.16Å
326	F	93.3	Very high	93.4	Very high	19 Å²	19	90.9 Å²	90.9	8%	0.083	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-109.5	18.3	-177.5	-51.5	-80	0	0	0	113.2	P108 R111 Y307 V309 F322 L323 K324	P108-F326 HydrophobicContact CB-CB 4.38Å; P108-F326 HydrophobicContact CB-CD1 3.89Å; P108-F326 HydrophobicContact CB-CD2 4.01Å; P108-F326 HydrophobicContact CB-CE1 4.15Å; P108-F326 HydrophobicContact CB-CE2 4.26Å; P108-F326 HydrophobicContact CB-CG 3.82Å; P108-F326 HydrophobicContact CB-CZ 4.32Å; P108-F326 HydrophobicContact CG-CD2 3.82Å; P108-F326 HydrophobicContact CG-CE2 3.95Å; P108-F326 HydrophobicContact CG-CG 4.15Å; P108-F326 HydrophobicContact CG-CZ 4.38Å; R111-F326 PolarHBondContact NH1-O 2.97Å; Y307-F326 HydrophobicContact CD1-CD1 4.08Å; Y307-F326 HydrophobicContact CD1-CE1 4.01Å; Y307-F326 HydrophobicContact CD2-CD1 4.24Å; Y307-F326 AromaticContact CD2-CE1 3.97Å; Y307-F326 HydrophobicContact CD2-CE1 3.97Å; Y307-F326 HydrophobicContact CE1-CD1 4.31Å; Y307-F326 HydrophobicContact CE2-CD1 4.48Å; Y307-F326 HydrophobicContact CG-CD1 4.05Å; Y307-F326 AromaticContact CG-CE1 3.63Å; Y307-F326 HydrophobicContact CG-CE1 3.63Å; V309-F326 HydrophobicContact CG2-CZ 4.01Å; F322-F326 HydrophobicContact CD1-CE2 4.17Å; F322-F326 AromaticContact CD2-CE2 3.91Å; F322-F326 HydrophobicContact CD2-CE2 3.91Å; F322-F326 HydrophobicContact CD2-CZ 4.4Å; F322-F326 AromaticContact CE1-CE2 3.81Å; F322-F326 HydrophobicContact CE1-CE2 3.81Å; F322-F326 AromaticContact CE2-CE2 3.53Å; F322-F326 HydrophobicContact CE2-CE2 3.53Å; F322-F326 AromaticContact CE2-CZ 3.7Å; F322-F326 HydrophobicContact CE2-CZ 3.7Å; F322-F326 HydrophobicContact CG-CE2 4.22Å; F322-F326 AromaticContact CZ-CE2 3.48Å; F322-F326 HydrophobicContact CZ-CE2 3.48Å; F322-F326 VanDerWaalsContact CZ-CE2 3.48Å; F322-F326 AromaticContact CZ-CZ 3.77Å; F322-F326 HydrophobicContact CZ-CZ 3.77Å; F322-F326 WeakPolarHBondContact O-CD2 3.45Å; F322-F326 WeakPolarHBondContact O-CE2 3.48Å; L323-F326 PolarHBondContact O-N 3.13Å; K324-F326 PolarHBondContact O-N 3.24Å
327	K	85.6	Confident	93.4	Very high	128 Å²	128	93.9 Å²	93.9	56%	0.557	43%	0.433	S	S	*	.			trans	-70.4	0	176.9	-74.5	-174.9	171.7	-167.2	0	112.4	E102 N103 K324	E102-K327 IonicContact OE2-NZ 3.17Å; N103-K327 WeakPolarHBondContact O-CE 3.43Å; N103-K327 PolarHBondContact O-NZ 3.26Å; K324-K327 HydrophobicContact CG-CD 4.28Å

Retrieved 327 of 327 residues in 307.4 ms (Link to these results)

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