A0A087XKK8_POEFO Loading...

Heat shock 70 kDa protein 13

Has peptide-independent ATPase activity.

AlphaFold DB , UniProt , Accession A0A087XKK8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 442 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	52.1	Low	65.1	Low	194 Å²	194	102 Å²	102	96%	0.956	61%	0.606	S	S	*	*				0	-37.7	0	-66	-168.9	86.4	0	0	113.8	I5	M1-I5 WeakPolarHBondContact O-CD1 3.47Å; M1-I5 WeakPolarHBondContact O-CG1 3.45Å
2	S	54.2	Low	66.6	Low	109 Å²	109	100.3 Å²	100.3	76%	0.762	59%	0.59	S	S	*	*	H	α-helix	trans	-70.5	-33.2	179	60.2	0	0	0	0	115	S6	S2-S6 PolarHBondContact O-N 3.03Å
3	G	54.4	Low	68	Low	51 Å²	51	100.9 Å²	100.9	53%	0.526	59%	0.588	S	S	.	*	H	α-helix	trans	-72	-34.2	-179.6	0	0	0	0	0	115.2	M7	G3-M7 PolarHBondContact O-N 3.49Å
4	E	52.9	Low	69.2	Low	136 Å²	136	98 Å²	98	64%	0.636	58%	0.582	S	S	*	*	H	α-helix	trans	-72.4	-38.3	178.3	-75.7	176.6	148.3	0	0	112.1	S6 M7 I8	E4-S6 VanDerWaalsContact C-N 3.3Å; E4-S6 PolarHBondContact O-N 3.43Å; E4-M7 PolarHBondContact O-N 3.42Å; E4-I8 WeakPolarHBondContact O-CG1 3.48Å; E4-I8 PolarHBondContact O-N 3.14Å; E4-I8 VanDerWaalsContact O-N 3.11Å
5	I	56	Low	70.2	Confident	118 Å²	118	99.4 Å²	99.4	61%	0.605	58%	0.584	S	S	*	*	H	α-helix	trans	-65.1	-36.8	176.6	-62.8	169.6	0	0	0	110.6	M1 G9	M1-I5 WeakPolarHBondContact O-CD1 3.47Å; M1-I5 WeakPolarHBondContact O-CG1 3.45Å; I5-G9 PolarHBondContact O-N 2.92Å
6	S	63.3	Low	71.1	Confident	77 Å²	77	102.5 Å²	102.5	54%	0.538	59%	0.589	S	S	.	*	H	α-helix	trans	-67.5	-37.2	175.9	-177	0	0	0	0	112.9	S2 E4 S10	S2-S6 PolarHBondContact O-N 3.03Å; E4-S6 VanDerWaalsContact C-N 3.3Å; E4-S6 PolarHBondContact O-N 3.43Å; S6-S10 WeakPolarHBondContact O-CB 3.45Å; S6-S10 PolarHBondContact O-N 2.93Å; S6-S10 VanDerWaalsContact O-N 3.12Å; S6-S10 PolarHBondContact O-OG 2.76Å
7	M	68.3	Low	71.8	Confident	135 Å²	135	102 Å²	102	67%	0.665	58%	0.583	S	S	*	*	H	α-helix	trans	-68.4	-43.4	176.3	-103.1	-132.9	-68.1	0	0	111.9	G3 E4 G9 S10 V11	G3-M7 PolarHBondContact O-N 3.49Å; E4-M7 PolarHBondContact O-N 3.42Å; M7-G9 VanDerWaalsContact C-N 3.34Å; M7-G9 PolarHBondContact O-N 2.93Å; M7-S10 PolarHBondContact O-N 3.18Å; M7-V11 WeakPolarHBondContact O-CG2 3.32Å; M7-V11 PolarHBondContact O-N 3.14Å
8	I	73.3	Confident	72.3	Confident	105 Å²	105	99.7 Å²	99.7	54%	0.538	58%	0.579	S	S	.	*	H	α-helix	trans	-62.7	-43.5	178.2	-65.9	165.9	0	0	0	110.4	E4 S10 V11 I12	E4-I8 WeakPolarHBondContact O-CG1 3.48Å; E4-I8 PolarHBondContact O-N 3.14Å; E4-I8 VanDerWaalsContact O-N 3.11Å; I8-S10 PolarHBondContact O-N 3.38Å; I8-V11 PolarHBondContact O-N 2.94Å; I8-I12 HydrophobicContact CG2-CD1 3.71Å; I8-I12 HydrophobicContact CG2-CG1 4.41Å; I8-I12 WeakPolarHBondContact O-CB 3.44Å; I8-I12 VanDerWaalsContact O-CG1 3.25Å; I8-I12 WeakPolarHBondContact O-CG1 3.45Å; I8-I12 PolarHBondContact O-N 3.31Å
9	G	77.4	Confident	72.5	Confident	41 Å²	41	96.6 Å²	96.6	42%	0.423	57%	0.57	S	S	.	*	H	α-helix	trans	-60.3	-42.7	175.8	0	0	0	0	0	113.3	I5 M7 I12 L13	I5-G9 PolarHBondContact O-N 2.92Å; M7-G9 VanDerWaalsContact C-N 3.34Å; M7-G9 PolarHBondContact O-N 2.93Å; G9-I12 PolarHBondContact O-N 2.87Å; G9-L13 WeakPolarHBondContact O-CB 3.45Å; G9-L13 PolarHBondContact O-N 3.38Å
10	S	80.6	Confident	72.7	Confident	72 Å²	72	99.2 Å²	99.2	50%	0.503	57%	0.571	S	S	.	*	H	α-helix	trans	-67.6	-38.3	177.9	-61	0	0	0	0	113.1	S6 M7 I8 A14	S6-S10 WeakPolarHBondContact O-CB 3.45Å; S6-S10 PolarHBondContact O-N 2.93Å; S6-S10 VanDerWaalsContact O-N 3.12Å; S6-S10 PolarHBondContact O-OG 2.76Å; M7-S10 PolarHBondContact O-N 3.18Å; I8-S10 PolarHBondContact O-N 3.38Å; S10-A14 VanDerWaalsContact O-CB 3.27Å; S10-A14 WeakPolarHBondContact O-CB 3.49Å; S10-A14 PolarHBondContact O-N 2.98Å
11	V	83.1	Confident	72.8	Confident	84 Å²	84	98 Å²	98	51%	0.509	56%	0.562	S	S	.	*	H	α-helix	trans	-67.9	-43.2	176.2	171.7	0	0	0	0	110.9	M7 I8 A14 L15	M7-V11 WeakPolarHBondContact O-CG2 3.32Å; M7-V11 PolarHBondContact O-N 3.14Å; I8-V11 PolarHBondContact O-N 2.94Å; V11-A14 PolarHBondContact O-N 3.48Å; V11-L15 HydrophobicContact CG1-CD1 4.09Å; V11-L15 WeakPolarHBondContact O-CB 3.49Å; V11-L15 WeakPolarHBondContact O-CG 3.41Å; V11-L15 PolarHBondContact O-N 2.86Å
12	I	83.9	Confident	73.7	Confident	82 Å²	82	89.7 Å²	89.7	42%	0.421	53%	0.526	S	S	.	.	H	α-helix	trans	-62	-45.9	175.8	-70.3	171.2	0	0	0	110.3	I8 G9 A14 L15 F16	I8-I12 HydrophobicContact CG2-CD1 3.71Å; I8-I12 HydrophobicContact CG2-CG1 4.41Å; I8-I12 WeakPolarHBondContact O-CB 3.44Å; I8-I12 VanDerWaalsContact O-CG1 3.25Å; I8-I12 WeakPolarHBondContact O-CG1 3.45Å; I8-I12 PolarHBondContact O-N 3.31Å; G9-I12 PolarHBondContact O-N 2.87Å; I12-A14 PolarHBondContact O-N 3.21Å; I12-L15 PolarHBondContact O-N 3.06Å; I12-F16 HydrophobicContact CG2-CD2 3.55Å; I12-F16 HydrophobicContact CG2-CE2 3.39Å; I12-F16 WeakPolarHBondContact O-CD2 3.42Å; I12-F16 PolarHBondContact O-N 3.17Å
13	L	84.3	Confident	74.3	Confident	108 Å²	108	92.6 Å²	92.6	57%	0.565	53%	0.528	S	S	*	.	H	α-helix	trans	-63	-41.7	177.4	-176	64.2	0	0	0	111.9	G9 L15 F16 L17	G9-L13 WeakPolarHBondContact O-CB 3.45Å; G9-L13 PolarHBondContact O-N 3.38Å; L13-L15 VanDerWaalsContact C-N 3.35Å; L13-F16 PolarHBondContact O-N 2.91Å; L13-L17 HydrophobicContact CD1-CD1 4.06Å; L13-L17 HydrophobicContact CG-CD1 4.24Å; L13-L17 WeakPolarHBondContact O-CB 3.28Å; L13-L17 PolarHBondContact O-N 3.24Å
14	A	85.4	Confident	74.9	Confident	60 Å²	60	95.6 Å²	95.6	50%	0.496	53%	0.528	S	S	.	.	H	α-helix	trans	-64.1	-38.3	175.9	0	0	0	0	0	112.1	S10 V11 I12 L17 A18	S10-A14 VanDerWaalsContact O-CB 3.27Å; S10-A14 WeakPolarHBondContact O-CB 3.49Å; S10-A14 PolarHBondContact O-N 2.98Å; V11-A14 PolarHBondContact O-N 3.48Å; I12-A14 PolarHBondContact O-N 3.21Å; A14-L17 PolarHBondContact O-N 3.38Å; A14-A18 WeakPolarHBondContact O-CB 3.36Å; A14-A18 PolarHBondContact O-N 2.81Å
15	L	84.3	Confident	75.8	Confident	119 Å²	119	97.5 Å²	97.5	62%	0.623	53%	0.531	S	S	*	.	H	α-helix	trans	-66.6	-40.8	173.8	-75.5	168.4	0	0	0	111.9	V11 I12 L13 A18 G19	V11-L15 HydrophobicContact CG1-CD1 4.09Å; V11-L15 WeakPolarHBondContact O-CB 3.49Å; V11-L15 WeakPolarHBondContact O-CG 3.41Å; V11-L15 PolarHBondContact O-N 2.86Å; I12-L15 PolarHBondContact O-N 3.06Å; L13-L15 VanDerWaalsContact C-N 3.35Å; L15-A18 PolarHBondContact O-N 3.34Å; L15-G19 PolarHBondContact O-N 2.8Å
16	F	83.8	Confident	76.4	Confident	149 Å²	149	97.7 Å²	97.7	65%	0.654	53%	0.533	S	S	*	.	H	α-helix	trans	-65.8	-42.6	174	-81.9	-64.4	0	0	0	112	I12 L13 G19 Y20	I12-F16 HydrophobicContact CG2-CD2 3.55Å; I12-F16 HydrophobicContact CG2-CE2 3.39Å; I12-F16 WeakPolarHBondContact O-CD2 3.42Å; I12-F16 PolarHBondContact O-N 3.17Å; L13-F16 PolarHBondContact O-N 2.91Å; F16-G19 PolarHBondContact O-N 2.85Å; F16-Y20 VanDerWaalsContact O-CB 3.24Å; F16-Y20 WeakPolarHBondContact O-CB 3.22Å; F16-Y20 PolarHBondContact O-N 3.05Å
17	L	83.2	Confident	76.6	Confident	94 Å²	94	99.2 Å²	99.2	49%	0.492	54%	0.54	S	S	.	.	H	α-helix	trans	-64.7	-43.5	175.3	-115.1	93.3	0	0	0	111.4	L13 A14 G19 Y20 L21	L13-L17 HydrophobicContact CD1-CD1 4.06Å; L13-L17 HydrophobicContact CG-CD1 4.24Å; L13-L17 WeakPolarHBondContact O-CB 3.28Å; L13-L17 PolarHBondContact O-N 3.24Å; A14-L17 PolarHBondContact O-N 3.38Å; L17-G19 VanDerWaalsContact C-N 3.32Å; L17-G19 PolarHBondContact O-N 3.36Å; L17-Y20 PolarHBondContact O-N 3.22Å; L17-L21 HydrophobicContact CD2-CD1 4.35Å; L17-L21 VanDerWaalsContact O-CB 3.25Å; L17-L21 WeakPolarHBondContact O-CB 3.25Å; L17-L21 WeakPolarHBondContact O-CG 3.41Å; L17-L21 PolarHBondContact O-N 3.28Å
18	A	80.2	Confident	76.7	Confident	61 Å²	61	96.9 Å²	96.9	50%	0.504	54%	0.535	S	S	.	.	H	α-helix	trans	-65	-37.3	176.7	0	0	0	0	0	111.6	A14 L15 G22	A14-A18 WeakPolarHBondContact O-CB 3.36Å; A14-A18 PolarHBondContact O-N 2.81Å; L15-A18 PolarHBondContact O-N 3.34Å; A18-G22 WeakPolarHBondContact O-CA 3.34Å; A18-G22 PolarHBondContact O-N 2.95Å
19	G	76.9	Confident	76.9	Confident	40 Å²	40	96.3 Å²	96.3	41%	0.412	54%	0.538	S	S	.	.	H	α-helix	trans	-66.5	-44	172.6	0	0	0	0	0	112.7	L15 F16 L17 G22 Q23	L15-G19 PolarHBondContact O-N 2.8Å; F16-G19 PolarHBondContact O-N 2.85Å; L17-G19 VanDerWaalsContact C-N 3.32Å; L17-G19 PolarHBondContact O-N 3.36Å; G19-G22 PolarHBondContact O-N 3.19Å; G19-Q23 PolarHBondContact O-N 3.06Å
20	Y	76.8	Confident	77.2	Confident	149 Å²	149	99.6 Å²	99.6	58%	0.584	54%	0.541	S	S	*	.	H	α-helix	trans	-65.7	-49.4	178.2	179.3	-95.5	0	0	0	111.8	F16 L17 G22 Q23 Q24	F16-Y20 VanDerWaalsContact O-CB 3.24Å; F16-Y20 WeakPolarHBondContact O-CB 3.22Å; F16-Y20 PolarHBondContact O-N 3.05Å; L17-Y20 PolarHBondContact O-N 3.22Å; Y20-G22 VanDerWaalsContact C-N 3.33Å; Y20-Q23 PolarHBondContact O-N 3.49Å; Y20-Q24 PolarHBondContact O-N 2.86Å
21	L	75.2	Confident	77.4	Confident	73 Å²	73	96.5 Å²	96.5	38%	0.382	52%	0.52	S	S	.	.	H	α-helix	trans	-64.9	-39.9	174.8	-67	168.6	0	0	0	110.6	L17 Q23 Q24 Y25	L17-L21 HydrophobicContact CD2-CD1 4.35Å; L17-L21 VanDerWaalsContact O-CB 3.25Å; L17-L21 WeakPolarHBondContact O-CB 3.25Å; L17-L21 WeakPolarHBondContact O-CG 3.41Å; L17-L21 PolarHBondContact O-N 3.28Å; L21-Q23 PolarHBondContact O-N 3.28Å; L21-Q24 PolarHBondContact O-N 2.84Å; L21-Q24 VanDerWaalsContact O-N 3.11Å; L21-Y25 HydrophobicContact CB-CD2 4.33Å; L21-Y25 HydrophobicContact CD2-CD2 4.38Å; L21-Y25 HydrophobicContact CD2-CE2 3.83Å; L21-Y25 WeakPolarHBondContact O-CD2 3.44Å; L21-Y25 PolarHBondContact O-N 2.78Å
22	G	70.4	Confident	77.7	Confident	21 Å²	21	100.1 Å²	100.1	22%	0.216	53%	0.528	C	S	.	.	H	α-helix	trans	-57.3	-45.7	173.6	0	0	0	0	0	112.2	A18 G19 Y20 Q24 Y25 L26	A18-G22 WeakPolarHBondContact O-CA 3.34Å; A18-G22 PolarHBondContact O-N 2.95Å; G19-G22 PolarHBondContact O-N 3.19Å; Y20-G22 VanDerWaalsContact C-N 3.33Å; G22-Q24 VanDerWaalsContact C-N 3.29Å; G22-Q24 PolarHBondContact O-N 2.74Å; G22-Y25 PolarHBondContact O-N 3.06Å; G22-L26 WeakPolarHBondContact O-CB 3.36Å; G22-L26 VanDerWaalsContact O-CG 3.3Å; G22-L26 WeakPolarHBondContact O-CG 3.48Å; G22-L26 PolarHBondContact O-N 3.21Å
23	Q	67.1	Low	78.2	Confident	169 Å²	169	96.9 Å²	96.9	79%	0.79	51%	0.512	S	S	*	.	H	α-helix	trans	-63.8	-33	174.6	-82.8	-174.9	-17.2	0	0	113.2	G19 Y20 L21	G19-Q23 PolarHBondContact O-N 3.06Å; Y20-Q23 PolarHBondContact O-N 3.49Å; L21-Q23 PolarHBondContact O-N 3.28Å
24	Q	67.6	Low	78.8	Confident	115 Å²	115	91.7 Å²	91.7	54%	0.537	49%	0.485	S	S	.	.	H	α-helix	trans	-79.6	-28.2	-177.7	-161.6	175.9	1.9	0	0	113.1	Y20 L21 G22	Y20-Q24 PolarHBondContact O-N 2.86Å; L21-Q24 PolarHBondContact O-N 2.84Å; L21-Q24 VanDerWaalsContact O-N 3.11Å; G22-Q24 VanDerWaalsContact C-N 3.29Å; G22-Q24 PolarHBondContact O-N 2.74Å
25	Y	70.4	Confident	79.4	Confident	175 Å²	175	88.9 Å²	88.9	69%	0.686	46%	0.462	S	S	*	.	H	α-helix	trans	-115.2	-14.9	-172.5	-67.2	-72.4	0	0	0	115.2	L21 G22	L21-Y25 HydrophobicContact CB-CD2 4.33Å; L21-Y25 HydrophobicContact CD2-CD2 4.38Å; L21-Y25 HydrophobicContact CD2-CE2 3.83Å; L21-Y25 WeakPolarHBondContact O-CD2 3.44Å; L21-Y25 PolarHBondContact O-N 2.78Å; G22-Y25 PolarHBondContact O-N 3.06Å
26	L	68.5	Low	80.1	Confident	123 Å²	123	83.2 Å²	83.2	64%	0.644	43%	0.432	S	S	*	.	S	Bend	trans	-83.2	139.7	172.3	-69.8	166	0	0	0	110.4	G22	G22-L26 WeakPolarHBondContact O-CB 3.36Å; G22-L26 VanDerWaalsContact O-CG 3.3Å; G22-L26 WeakPolarHBondContact O-CG 3.48Å; G22-L26 PolarHBondContact O-N 3.21Å
27	P	67.4	Low	80.7	Confident	108 Å²	108	77 Å²	77	70%	0.701	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-60.3	143.4	172.6	26.5	-33.2	0	0	0	109.7
28	P	70.8	Confident	81.2	Confident	86 Å²	86	72.8 Å²	72.8	56%	0.558	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-57.4	149	178	22.9	-32	0	0	0	110.7	K30 P50	P28-K30 PolarHBondContact O-N 2.78Å; P28-P50 VanDerWaalsContact CB-O 3.25Å; P28-P50 WeakPolarHBondContact CB-O 3.45Å
29	P	77.2	Confident	81.5	Confident	93 Å²	93	70.5 Å²	70.5	60%	0.604	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-60.3	133.2	178.8	25.7	-32.6	0	0	0	109.4	P50	P29-P50 HydrophobicContact CG-CB 3.94Å; P29-P50 HydrophobicContact CG-CG 4.28Å; P29-P50 WeakPolarHBondContact O-CD 3.36Å; P29-P50 WeakPolarHBondContact O-CG 3.17Å
30	K	84.3	Confident	81.9	Confident	110 Å²	110	70.7 Å²	70.7	48%	0.478	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-65.8	136.9	179.3	-67.5	179.1	170.7	-170.8	0	110.4	P28 K32 L163 V165	P28-K30 PolarHBondContact O-N 2.78Å; K30-K32 PolarHBondContact O-N 2.81Å; K30-L163 WeakPolarHBondContact CD-O 3.49Å; K30-L163 WeakPolarHBondContact CE-O 3.48Å; K30-L163 PolarHBondContact NZ-O 3.28Å; K30-V165 HydrophobicContact CB-CG1 4.45Å; K30-V165 HydrophobicContact CB-CG2 4.28Å; K30-V165 HydrophobicContact CD-CG1 3.54Å; K30-V165 HydrophobicContact CD-CG2 4.41Å
31	P	85.6	Confident	82.2	Confident	8 Å²	8	67.7 Å²	67.7	5%	0.052	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-54.3	134.2	173.8	-17.9	24.8	0	0	0	111	V47 F48 L49 L163	P31-V47 HydrophobicContact CB-CB 4.12Å; P31-V47 HydrophobicContact CG-CB 4.07Å; P31-V47 HydrophobicContact CG-CG2 4.25Å; P31-F48 WeakPolarHBondContact CG-O 3.33Å; P31-L49 HydrophobicContact CG-CD2 3.98Å; P31-L163 HydrophobicContact CB-CD1 4.34Å; P31-L163 HydrophobicContact CG-CD2 4.24Å
32	K	87.8	Confident	82.9	Confident	160 Å²	160	68.7 Å²	68.7	70%	0.696	36%	0.358	S	S	*	.			trans	-112.2	-8.8	175.7	-63.3	-172.5	-178.4	179.6	0	113.5	K30	K30-K32 PolarHBondContact O-N 2.81Å
33	V	95.3	Very high	84.1	Confident	13 Å²	13	67.7 Å²	67.7	8%	0.079	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	126.5	176.3	-168.5	0	0	0	0	107.2	K169 V171 L198 A415	V33-K169 WeakPolarHBondContact CA-O 3.06Å; V33-K169 HydrophobicContact CG1-CB 4.35Å; V33-K169 HydrophobicContact CG2-CB 4.1Å; V33-V171 HydrophobicContact CG1-CG2 4.39Å; V33-L198 HydrophobicContact CG1-CD1 3.76Å; V33-L198 HydrophobicContact CG2-CD1 3.87Å; V33-A415 HydrophobicContact CB-CB 4.28Å; V33-A415 HydrophobicContact CG1-CB 3.78Å
34	I	97.3	Very high	85.5	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	151.1	179.3	63.6	172	0	0	0	110.5	L36 V45 V47 A159 I167 K169 A170 V171 L195	I34-L36 HydrophobicContact CD1-CD1 4.24Å; I34-L36 HydrophobicContact CD1-CD2 3.81Å; I34-L36 HydrophobicContact CD1-CG 4.1Å; I34-L36 HydrophobicContact CG1-CD1 4.41Å; I34-L36 HydrophobicContact CG1-CD2 4.42Å; I34-L36 HydrophobicContact CG1-CG 4.21Å; I34-V45 HydrophobicContact CB-CG2 4.04Å; I34-V45 HydrophobicContact CD1-CG2 3.83Å; I34-V45 HydrophobicContact CG1-CG2 4.36Å; I34-V47 HydrophobicContact CB-CG1 4.37Å; I34-V47 HydrophobicContact CG2-CG1 3.79Å; I34-A159 HydrophobicContact CG2-CB 4.14Å; I34-I167 HydrophobicContact CB-CG2 4.43Å; I34-I167 HydrophobicContact CD1-CG2 3.8Å; I34-I167 HydrophobicContact CG1-CG2 3.85Å; I34-I167 HydrophobicContact CG2-CD1 4.13Å; I34-I167 HydrophobicContact CG2-CG1 4.17Å; I34-I167 HydrophobicContact CG2-CG2 3.74Å; I34-K169 PolarHBondContact N-O 3.36Å; I34-A170 HydrophobicContact CG1-CB 3.77Å; I34-A170 CarbonylContact O-C 3.56Å; I34-A170 WeakPolarHBondContact O-CA 3.41Å; I34-A170 WeakPolarHBondContact O-CB 3.47Å; I34-V171 PolarHBondContact O-N 3Å; I34-L195 HydrophobicContact CD1-CD2 4.34Å
35	G	98	Very high	87	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	130.1	168.9	0	0	0	0	0	110.5	V45 G46	G35-V45 WeakPolarHBondContact O-CA 3.44Å; G35-G46 PolarHBondContact N-O 3.38Å; G35-G46 PolarHBondContact O-N 2.7Å
36	L	98.2	Very high	88.2	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	123.7	-176.9	-66.3	163.7	0	0	0	110	I34 V45 L152 L155 A170 V171 I172 S173 L195	I34-L36 HydrophobicContact CD1-CD1 4.24Å; I34-L36 HydrophobicContact CD1-CD2 3.81Å; I34-L36 HydrophobicContact CD1-CG 4.1Å; I34-L36 HydrophobicContact CG1-CD1 4.41Å; I34-L36 HydrophobicContact CG1-CD2 4.42Å; I34-L36 HydrophobicContact CG1-CG 4.21Å; L36-V45 HydrophobicContact CD2-CB 4.03Å; L36-V45 HydrophobicContact CD2-CG2 3.81Å; L36-L152 HydrophobicContact CB-CD2 4.35Å; L36-L152 HydrophobicContact CD1-CD2 4.18Å; L36-L152 HydrophobicContact CD2-CD2 4.31Å; L36-L155 HydrophobicContact CD2-CB 3.95Å; L36-L155 HydrophobicContact CD2-CD1 3.82Å; L36-A170 HydrophobicContact CD1-CB 3.41Å; L36-A170 VanDerWaalsContact CD1-CB 3.41Å; L36-A170 HydrophobicContact CG-CB 4.17Å; L36-V171 PolarHBondContact N-O 3.21Å; L36-I172 HydrophobicContact CB-CB 4.35Å; L36-I172 HydrophobicContact CB-CD1 4.46Å; L36-I172 HydrophobicContact CB-CG1 4.11Å; L36-I172 WeakPolarHBondContact O-CA 3Å; L36-S173 PolarHBondContact O-N 3.43Å; L36-S173 PolarHBondContact O-OG 2.97Å; L36-L195 HydrophobicContact CD1-CD1 3.65Å
37	D	96.2	Very high	89.5	Confident	19 Å²	19	40.2 Å²	40.2	10%	0.102	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	105.6	164.5	-174.3	19.8	0	0	0	109.4	G39 C43 S44 S173 V407 V408	D37-G39 PolarHBondContact O-N 2.71Å; D37-C43 CarbonylContact O-C 3.59Å; D37-C43 WeakPolarHBondContact O-CA 3.4Å; D37-C43 WeakPolarHBondContact O-CB 3.43Å; D37-S44 PolarHBondContact N-O 2.97Å; D37-S44 PolarHBondContact O-N 3.04Å; D37-S173 WeakPolarHBondContact CA-OG 3.12Å; D37-S173 PolarHBondContact OD1-OG 3.48Å; D37-V407 HydrophobicContact CB-CG1 4.14Å; D37-V408 HydrophobicContact CB-CB 3.91Å; D37-V408 HydrophobicContact CB-CG2 4.43Å
38	L	93.6	Very high	90.7	Very high	6 Å²	6	35.3 Å²	35.3	3%	0.031	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	78.7	175.3	179.1	64.3	0	0	0	107.7	K100 L151 L152 I172 T186	L38-K100 WeakPolarHBondContact O-CD 3.39Å; L38-K100 WeakPolarHBondContact O-CE 3.45Å; L38-K100 PolarHBondContact O-NZ 2.92Å; L38-L151 HydrophobicContact CD1-CB 4.3Å; L38-L151 HydrophobicContact CD1-CD1 4.2Å; L38-L152 HydrophobicContact CB-CD2 4.25Å; L38-L152 HydrophobicContact CD1-CD2 4.17Å; L38-L152 HydrophobicContact CD1-CG 4.35Å; L38-L152 HydrophobicContact CD2-CD1 4.45Å; L38-I172 HydrophobicContact CB-CD1 4.27Å; L38-I172 HydrophobicContact CD2-CD1 4.49Å; L38-T186 HydrophobicContact CD2-CG2 4.14Å
39	G	87.3	Confident	91.5	Very high	12 Å²	12	33.3 Å²	33.3	12%	0.124	18%	0.175	C	C	.	.			trans	-78	166.3	-179.4	0	0	0	0	0	113.5	D37 F42 S69	D37-G39 PolarHBondContact O-N 2.71Å; G39-F42 CarbonylContact C-O 3.53Å; G39-F42 WeakPolarHBondContact CA-O 3.44Å; G39-F42 PolarHBondContact N-O 2.57Å; G39-F42 VanDerWaalsContact N-O 3.13Å; G39-S69 PolarHBondContact O-OG 3.03Å
40	T	85.3	Confident	91.3	Very high	44 Å²	44	29.4 Å²	29.4	27%	0.27	15%	0.15	S	C	.	.	S	Bend	trans	-69	-38.3	177.7	-56.8	0	0	0	0	111.8	S69 R101	T40-S69 WeakPolarHBondContact O-CB 3.18Å; T40-R101 HydrophobicContact CG2-CG 4Å
41	T	83.1	Confident	90.7	Very high	87 Å²	87	28.1 Å²	28.1	53%	0.534	17%	0.167	S	C	.	.	S	Bend	trans	-105.5	-41.3	-176.6	-47.6	0	0	0	0	112.7	P68 S69	T41-P68 CarbonylContact O-C 3Å; T41-P68 WeakPolarHBondContact O-CA 3.29Å; T41-S69 PolarHBondContact O-N 2.79Å; T41-S69 PolarHBondContact O-OG 3.26Å
42	F	90.8	Very high	90.3	Very high	93 Å²	93	31 Å²	31	41%	0.408	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	149.3	178.9	-72.3	-84.3	0	0	0	110	G39 I67 P68 S69	G39-F42 CarbonylContact C-O 3.53Å; G39-F42 WeakPolarHBondContact CA-O 3.44Å; G39-F42 PolarHBondContact N-O 2.57Å; G39-F42 VanDerWaalsContact N-O 3.13Å; F42-I67 CarbonylContact C-O 3.54Å; F42-I67 VanDerWaalsContact CA-O 3.25Å; F42-I67 WeakPolarHBondContact CA-O 3.45Å; F42-P68 HydrophobicContact CD1-CG 4.42Å; F42-P68 HydrophobicContact CE1-CB 4.44Å; F42-P68 HydrophobicContact CE1-CG 3.96Å; F42-S69 WeakPolarHBondContact CA-OG 3.41Å; F42-S69 PolarHBondContact N-OG 2.77Å
43	C	94.4	Very high	89.9	Confident	0 Å²	0	25 Å²	25	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	148.2	171.6	-50.4	0	0	0	0	110.1	D37 S66 I67 S69 L155	D37-C43 CarbonylContact O-C 3.59Å; D37-C43 WeakPolarHBondContact O-CA 3.4Å; D37-C43 WeakPolarHBondContact O-CB 3.43Å; C43-S66 CarbonylContact O-C 3.53Å; C43-S66 VanDerWaalsContact O-CA 3.28Å; C43-S66 WeakPolarHBondContact O-CA 3.23Å; C43-I67 HydrophobicContact CB-CG1 4.12Å; C43-I67 PolarHBondContact N-O 3.39Å; C43-I67 PolarHBondContact O-N 3.4Å; C43-S69 PolarHBondContact SG-OG 3.06Å; C43-L155 HydrophobicContact CB-CD1 3.82Å; C43-L155 HydrophobicContact CB-CD2 4.49Å; C43-L155 HydrophobicContact CB-CG 4.46Å
44	S	97.1	Very high	89.5	Confident	5 Å²	5	30.5 Å²	30.5	4%	0.035	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	157.4	178.5	-72.5	0	0	0	0	111.2	D37 K65 S66	D37-S44 PolarHBondContact N-O 2.97Å; D37-S44 PolarHBondContact O-N 3.04Å; S44-K65 PolarHBondContact OG-O 2.99Å; S44-S66 WeakPolarHBondContact OG-CA 3.49Å; S44-S66 WeakPolarHBondContact OG-CB 3.45Å
45	V	98.1	Very high	89.2	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.006	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	135.5	174.5	58	0	0	0	0	109.9	I34 G35 L36 I58 L155 A159 V408	I34-V45 HydrophobicContact CB-CG2 4.04Å; I34-V45 HydrophobicContact CD1-CG2 3.83Å; I34-V45 HydrophobicContact CG1-CG2 4.36Å; G35-V45 WeakPolarHBondContact O-CA 3.44Å; L36-V45 HydrophobicContact CD2-CB 4.03Å; L36-V45 HydrophobicContact CD2-CG2 3.81Å; V45-I58 HydrophobicContact CG1-CB 3.66Å; V45-I58 HydrophobicContact CG1-CG1 4.08Å; V45-I58 HydrophobicContact CG1-CG2 3.96Å; V45-I58 WeakPolarHBondContact O-CB 3.18Å; V45-I58 PolarHBondContact O-N 3.24Å; V45-L155 HydrophobicContact CB-CB 4.02Å; V45-L155 HydrophobicContact CB-CD1 4.37Å; V45-L155 HydrophobicContact CB-CD2 4.16Å; V45-L155 HydrophobicContact CB-CG 4.42Å; V45-L155 HydrophobicContact CG1-CB 4.02Å; V45-L155 HydrophobicContact CG1-CD2 3.86Å; V45-L155 HydrophobicContact CG1-CG 4.45Å; V45-A159 HydrophobicContact CG2-CB 4.2Å; V45-V408 VanDerWaalsContact C-CG2 3.47Å
46	G	97.1	Very high	89.1	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	156.7	179.9	0	0	0	0	0	111.2	G35 E56 V408	G35-G46 PolarHBondContact N-O 3.38Å; G35-G46 PolarHBondContact O-N 2.7Å; G46-E56 CarbonylContact C-O 3.44Å; G46-E56 VanDerWaalsContact CA-O 3.29Å; G46-E56 WeakPolarHBondContact CA-O 3.39Å; G46-V408 VanDerWaalsContact N-CG2 3.32Å
47	V	95.3	Very high	89	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	145.4	178.4	-57.7	0	0	0	0	109.4	P31 I34 L49 V55 E56 I58 L163	P31-V47 HydrophobicContact CB-CB 4.12Å; P31-V47 HydrophobicContact CG-CB 4.07Å; P31-V47 HydrophobicContact CG-CG2 4.25Å; I34-V47 HydrophobicContact CB-CG1 4.37Å; I34-V47 HydrophobicContact CG2-CG1 3.79Å; V47-L49 HydrophobicContact CG2-CD2 4.11Å; V47-V55 WeakPolarHBondContact O-CA 3.43Å; V47-E56 HydrophobicContact CG2-CB 3.98Å; V47-E56 PolarHBondContact N-O 3.16Å; V47-E56 PolarHBondContact O-N 3.1Å; V47-I58 HydrophobicContact CG1-CD1 3.99Å; V47-I58 HydrophobicContact CG1-CG1 4.11Å; V47-I58 HydrophobicContact CG2-CD1 3.89Å; V47-L163 HydrophobicContact CG1-CD1 4.17Å
48	F	92.4	Very high	89	Confident	4 Å²	4	35.7 Å²	35.7	2%	0.018	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	120.4	173.1	-178.5	-88.5	0	0	0	108.6	P31 P50 G53 V55 A412 S421 W422	P31-F48 WeakPolarHBondContact CG-O 3.33Å; F48-P50 VanDerWaalsContact O-CD 3.29Å; F48-P50 WeakPolarHBondContact O-CD 3.43Å; F48-G53 WeakPolarHBondContact CE2-O 3.43Å; F48-V55 HydrophobicContact CD2-CG2 3.96Å; F48-A412 WeakPolarHBondContact CB-O 3.37Å; F48-S421 WeakPolarHBondContact CE1-O 3.4Å; F48-W422 HydrophobicContact CD2-CE3 4.38Å; F48-W422 HydrophobicContact CD2-CZ3 4.36Å; F48-W422 AromaticContact CE1-CE3 3.76Å; F48-W422 HydrophobicContact CE1-CE3 3.76Å; F48-W422 HydrophobicContact CE1-CZ3 4.3Å; F48-W422 HydrophobicContact CE2-CD2 4.31Å; F48-W422 AromaticContact CE2-CE3 3.32Å; F48-W422 HydrophobicContact CE2-CE3 3.32Å; F48-W422 AromaticContact CE2-CH2 3.98Å; F48-W422 HydrophobicContact CE2-CH2 3.98Å; F48-W422 AromaticContact CE2-CZ3 3.13Å; F48-W422 HydrophobicContact CE2-CZ3 3.13Å; F48-W422 HydrophobicContact CZ-CD2 4.1Å; F48-W422 AromaticContact CZ-CE3 2.96Å; F48-W422 HydrophobicContact CZ-CE3 2.96Å; F48-W422 HydrophobicContact CZ-CH2 4.33Å; F48-W422 AromaticContact CZ-CZ3 3.13Å; F48-W422 HydrophobicContact CZ-CZ3 3.13Å
49	L	87.1	Confident	89.1	Confident	44 Å²	44	39.5 Å²	39.5	23%	0.23	24%	0.241	C	C	.	.			trans	-84.1	113.7	-175.8	-65.5	-179.7	0	0	0	110.6	P31 V47 G51 S52 G53 E54 E56	P31-L49 HydrophobicContact CG-CD2 3.98Å; V47-L49 HydrophobicContact CG2-CD2 4.11Å; L49-G51 PolarHBondContact O-N 3.45Å; L49-S52 WeakPolarHBondContact CB-OG 3.24Å; L49-G53 PolarHBondContact O-N 2.76Å; L49-E54 PolarHBondContact N-O 3Å; L49-E56 HydrophobicContact CD1-CB 4.09Å; L49-E56 HydrophobicContact CG-CB 4.24Å
50	P	73.4	Confident	89.4	Confident	12 Å²	12	39.6 Å²	39.6	8%	0.078	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	135.6	176.3	-18.4	33.3	0	0	0	109.9	P28 P29 F48	P28-P50 VanDerWaalsContact CB-O 3.25Å; P28-P50 WeakPolarHBondContact CB-O 3.45Å; P29-P50 HydrophobicContact CG-CB 3.94Å; P29-P50 HydrophobicContact CG-CG 4.28Å; P29-P50 WeakPolarHBondContact O-CD 3.36Å; P29-P50 WeakPolarHBondContact O-CG 3.17Å; F48-P50 VanDerWaalsContact O-CD 3.29Å; F48-P50 WeakPolarHBondContact O-CD 3.43Å
51	G	71.9	Confident	89.6	Confident	82 Å²	82	42.1 Å²	42.1	85%	0.845	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	100.1	-51.5	178.5	0	0	0	0	0	114	L49	L49-G51 PolarHBondContact O-N 3.45Å
52	S	77.7	Confident	90.1	Very high	69 Å²	69	44.6 Å²	44.6	48%	0.483	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-29.8	177.8	63.9	0	0	0	0	112.7	L49 E54	L49-S52 WeakPolarHBondContact CB-OG 3.24Å; S52-E54 VanDerWaalsContact C-N 3.29Å; S52-E54 PolarHBondContact OG-N 2.94Å
53	G	79.3	Confident	90.2	Very high	35 Å²	35	42 Å²	42	36%	0.361	25%	0.252	S	S	.	.			trans	86.7	2.8	-172.7	0	0	0	0	0	113.5	F48 L49 W422	F48-G53 WeakPolarHBondContact CE2-O 3.43Å; L49-G53 PolarHBondContact O-N 2.76Å; G53-W422 WeakPolarHBondContact O-CZ3 3.33Å
54	E	86.2	Confident	90.2	Very high	127 Å²	127	44.6 Å²	44.6	59%	0.593	26%	0.262	S	S	*	.			trans	-100.8	156.8	-168.6	-63	-178	161.4	0	0	112.5	L49 S52	L49-E54 PolarHBondContact N-O 3Å; S52-E54 VanDerWaalsContact C-N 3.29Å; S52-E54 PolarHBondContact OG-N 2.94Å
55	V	91.6	Very high	90.1	Very high	42 Å²	42	48.6 Å²	48.6	26%	0.255	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	131.5	171.8	176.4	0	0	0	0	108.8	V47 F48 T409 A412 I413	V47-V55 WeakPolarHBondContact O-CA 3.43Å; F48-V55 HydrophobicContact CD2-CG2 3.96Å; V55-T409 HydrophobicContact CB-CG2 4.13Å; V55-T409 HydrophobicContact CG1-CG2 4.03Å; V55-T409 HydrophobicContact CG2-CG2 4.16Å; V55-A412 HydrophobicContact CG1-CB 3.62Å; V55-A412 HydrophobicContact CG2-CB 4.48Å; V55-I413 HydrophobicContact CG2-CD1 4.25Å; V55-I413 HydrophobicContact CG2-CG1 3.48Å; V55-I413 VanDerWaalsContact CG2-CG1 3.48Å
56	E	94.2	Very high	89.9	Confident	70 Å²	70	50 Å²	50	33%	0.327	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	122.1	173.1	-175	178	-167.6	0	0	108.9	G46 V47 L49 Q162	G46-E56 CarbonylContact C-O 3.44Å; G46-E56 VanDerWaalsContact CA-O 3.29Å; G46-E56 WeakPolarHBondContact CA-O 3.39Å; V47-E56 HydrophobicContact CG2-CB 3.98Å; V47-E56 PolarHBondContact N-O 3.16Å; V47-E56 PolarHBondContact O-N 3.1Å; L49-E56 HydrophobicContact CD1-CB 4.09Å; L49-E56 HydrophobicContact CG-CB 4.24Å; E56-Q162 PolarHBondContact OE1-NE2 2.96Å
57	V	96.8	Very high	89.8	Confident	17 Å²	17	50.1 Å²	50.1	10%	0.103	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	125.5	169.5	-176.5	0	0	0	0	107.7	K65 L405 V408	V57-K65 HydrophobicContact CB-CD 4.47Å; V57-K65 HydrophobicContact CG1-CB 3.93Å; V57-K65 HydrophobicContact CG1-CG 4.32Å; V57-L405 HydrophobicContact CG1-CD2 4.34Å; V57-L405 HydrophobicContact CG2-CB 4.49Å; V57-L405 HydrophobicContact CG2-CD1 4.41Å; V57-V408 HydrophobicContact CG1-CG1 4.14Å; V57-V408 HydrophobicContact CG2-CG1 3.89Å
58	I	96.9	Very high	89.7	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-73.9	131.6	-174.8	-58.5	-60.5	0	0	0	109.2	V45 V47 M158 A159 Q162	V45-I58 HydrophobicContact CG1-CB 3.66Å; V45-I58 HydrophobicContact CG1-CG1 4.08Å; V45-I58 HydrophobicContact CG1-CG2 3.96Å; V45-I58 WeakPolarHBondContact O-CB 3.18Å; V45-I58 PolarHBondContact O-N 3.24Å; V47-I58 HydrophobicContact CG1-CD1 3.99Å; V47-I58 HydrophobicContact CG1-CG1 4.11Å; V47-I58 HydrophobicContact CG2-CD1 3.89Å; I58-M158 HydrophobicContact CG2-CB 3.82Å; I58-M158 HydrophobicContact CG2-CE 4.46Å; I58-A159 HydrophobicContact CG1-CB 4.32Å; I58-Q162 HydrophobicContact CD1-CB 4.38Å; I58-Q162 VanDerWaalsContact CD1-CD 3.46Å; I58-Q162 HydrophobicContact CD1-CG 4.19Å; I58-Q162 VanDerWaalsContact CG2-OE1 3.3Å
59	E	96	Very high	89.8	Confident	85 Å²	85	50.8 Å²	50.8	40%	0.397	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-95.3	152.9	178.4	-69.8	174.8	-171.9	0	0	110.8	R64 K65	E59-R64 CarbonylContact C-O 3.46Å; E59-R64 WeakPolarHBondContact CA-O 3.48Å; E59-K65 HydrophobicContact CG-CG 3.61Å; E59-K65 WeakPolarHBondContact OE1-CE 3.22Å; E59-K65 IonicContact OE1-NZ 3.8Å
60	D	92.9	Very high	90.3	Very high	14 Å²	14	48.7 Å²	48.7	8%	0.075	28%	0.284	C	S	.	.			trans	-81	-175.9	167.9	82.1	-7.9	0	0	0	112	E62 G63 R64 M158	D60-E62 PolarHBondContact O-N 3.34Å; D60-E62 VanDerWaalsContact O-N 3.11Å; D60-E62 WeakPolarHBondContact OD1-CA 3.42Å; D60-E62 PolarHBondContact OD1-N 2.93Å; D60-G63 PolarHBondContact O-N 2.79Å; D60-G63 PolarHBondContact OD1-N 3.47Å; D60-R64 PolarHBondContact N-O 3.39Å; D60-R64 WeakPolarHBondContact OD1-CB 3.44Å; D60-R64 PolarHBondContact OD1-N 3.14Å; D60-R64 IonicContact OD1-NE 3.58Å; D60-R64 PolarHBondContact OD1-NE 3.5Å; D60-R64 IonicContact OD2-CZ 2.77Å; D60-R64 IonicContact OD2-NE 3.54Å; D60-R64 PolarHBondContact OD2-NE 2.8Å; D60-R64 IonicContact OD2-NH2 3.33Å; D60-R64 PolarHBondContact OD2-NH2 2.82Å; D60-M158 HydrophobicContact CB-CE 3.78Å; D60-M158 HydrophobicContact CB-SD 4.4Å
61	E	90.4	Very high	91.5	Very high	98 Å²	98	48.1 Å²	48.1	46%	0.458	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-17.3	-177.2	-58.1	87.6	168.5	0	0	114.2	R154 R161	E61-R154 IonicContact OE1-CZ 2.74Å; E61-R154 IonicContact OE1-NH1 3.16Å; E61-R154 PolarHBondContact OE1-NH1 2.78Å; E61-R154 IonicContact OE1-NH2 3.46Å; E61-R154 PolarHBondContact OE1-NH2 2.78Å; E61-R154 IonicContact OE2-CZ 2.83Å; E61-R154 IonicContact OE2-NH1 2.81Å; E61-R154 PolarHBondContact OE2-NH1 3.46Å; E61-R154 IonicContact OE2-NH2 2.83Å; E61-R154 PolarHBondContact OE2-NH2 2.89Å; E61-R161 VanDerWaalsContact CD-NH1 3.28Å; E61-R161 IonicContact OE1-CZ 2.72Å; E61-R161 IonicContact OE1-NH1 2.67Å; E61-R161 PolarHBondContact OE1-NH1 3.33Å; E61-R161 IonicContact OE1-NH2 3.35Å; E61-R161 PolarHBondContact OE1-NH2 3.31Å
62	E	91.9	Very high	92.7	Very high	139 Å²	139	44.2 Å²	44.2	65%	0.65	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.4	8.8	178.7	-68.4	173.4	-130.1	0	0	112.2	D60 R64	D60-E62 PolarHBondContact O-N 3.34Å; D60-E62 VanDerWaalsContact O-N 3.11Å; D60-E62 WeakPolarHBondContact OD1-CA 3.42Å; D60-E62 PolarHBondContact OD1-N 2.93Å; E62-R64 HydrophobicContact CB-CG 4.33Å; E62-R64 VanDerWaalsContact CD-NH1 3.27Å; E62-R64 IonicContact OE1-CZ 3.98Å; E62-R64 IonicContact OE1-NH1 2.97Å; E62-R64 PolarHBondContact OE1-NH1 2.85Å; E62-R64 IonicContact OE1-NH2 2.99Å; E62-R64 PolarHBondContact OE1-NH2 3.07Å; E62-R64 IonicContact OE2-CZ 3.84Å; E62-R64 IonicContact OE2-NE 3.15Å; E62-R64 IonicContact OE2-NH1 3.95Å; E62-R64 PolarHBondContact OE2-NH1 2.88Å; E62-R64 IonicContact OE2-NH2 2.73Å; E62-R64 PolarHBondContact OE2-NH2 3Å
63	G	93.7	Very high	93.7	Very high	37 Å²	37	41.3 Å²	41.3	38%	0.381	22%	0.218	S	C	.	.	S	Bend	trans	80.6	14.4	-179.9	0	0	0	0	0	114.1	D60	D60-G63 PolarHBondContact O-N 2.79Å; D60-G63 PolarHBondContact OD1-N 3.47Å
64	R	93.3	Very high	94.5	Very high	55 Å²	55	41.6 Å²	41.6	21%	0.208	21%	0.213	C	C	.	.			trans	-87.1	130	-178.1	-55.9	175.4	-66.6	-143	-11.1	110.1	E59 D60 E62 S66 Y82	E59-R64 CarbonylContact C-O 3.46Å; E59-R64 WeakPolarHBondContact CA-O 3.48Å; D60-R64 PolarHBondContact N-O 3.39Å; D60-R64 WeakPolarHBondContact OD1-CB 3.44Å; D60-R64 PolarHBondContact OD1-N 3.14Å; D60-R64 IonicContact OD1-NE 3.58Å; D60-R64 PolarHBondContact OD1-NE 3.5Å; D60-R64 IonicContact OD2-CZ 2.77Å; D60-R64 IonicContact OD2-NE 3.54Å; D60-R64 PolarHBondContact OD2-NE 2.8Å; D60-R64 IonicContact OD2-NH2 3.33Å; D60-R64 PolarHBondContact OD2-NH2 2.82Å; E62-R64 HydrophobicContact CB-CG 4.33Å; E62-R64 VanDerWaalsContact CD-NH1 3.27Å; E62-R64 IonicContact OE1-CZ 3.98Å; E62-R64 IonicContact OE1-NH1 2.97Å; E62-R64 PolarHBondContact OE1-NH1 2.85Å; E62-R64 IonicContact OE1-NH2 2.99Å; E62-R64 PolarHBondContact OE1-NH2 3.07Å; E62-R64 IonicContact OE2-CZ 3.84Å; E62-R64 IonicContact OE2-NE 3.15Å; E62-R64 IonicContact OE2-NH1 3.95Å; E62-R64 PolarHBondContact OE2-NH1 2.88Å; E62-R64 IonicContact OE2-NH2 2.73Å; E62-R64 PolarHBondContact OE2-NH2 3Å; R64-S66 VanDerWaalsContact C-N 3.3Å; R64-S66 PolarHBondContact O-N 3.27Å; R64-Y82 HydrophobicContact CB-CE2 4.29Å; R64-Y82 HydrophobicContact CG-CE2 4.42Å; R64-Y82 VanDerWaalsContact CZ-CG 3.48Å
65	K	95.2	Very high	94.8	Very high	89 Å²	89	38.9 Å²	38.9	39%	0.387	21%	0.208	S	C	.	.	S	Bend	trans	-83.5	-2.7	-178	-68.5	-179.2	178.4	179.2	0	114.7	S44 V57 E59 L405	S44-K65 PolarHBondContact OG-O 2.99Å; V57-K65 HydrophobicContact CB-CD 4.47Å; V57-K65 HydrophobicContact CG1-CB 3.93Å; V57-K65 HydrophobicContact CG1-CG 4.32Å; E59-K65 HydrophobicContact CG-CG 3.61Å; E59-K65 WeakPolarHBondContact OE1-CE 3.22Å; E59-K65 IonicContact OE1-NZ 3.8Å; K65-L405 HydrophobicContact CB-CD2 4Å; K65-L405 HydrophobicContact CD-CD1 3.71Å
66	S	93.6	Very high	94.9	Very high	32 Å²	32	43.1 Å²	43.1	22%	0.224	23%	0.234	C	C	.	.			trans	-145.4	155.8	178	65.3	0	0	0	0	110	C43 S44 R64 Y82	C43-S66 CarbonylContact O-C 3.53Å; C43-S66 VanDerWaalsContact O-CA 3.28Å; C43-S66 WeakPolarHBondContact O-CA 3.23Å; S44-S66 WeakPolarHBondContact OG-CA 3.49Å; S44-S66 WeakPolarHBondContact OG-CB 3.45Å; R64-S66 VanDerWaalsContact C-N 3.3Å; R64-S66 PolarHBondContact O-N 3.27Å; S66-Y82 WeakPolarHBondContact O-CE2 3.21Å
67	I	95.1	Very high	95	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.01	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	144.5	173.3	64.3	174.6	0	0	0	109.4	F42 C43 R154 L155 M158	F42-I67 CarbonylContact C-O 3.54Å; F42-I67 VanDerWaalsContact CA-O 3.25Å; F42-I67 WeakPolarHBondContact CA-O 3.45Å; C43-I67 HydrophobicContact CB-CG1 4.12Å; C43-I67 PolarHBondContact N-O 3.39Å; C43-I67 PolarHBondContact O-N 3.4Å; I67-R154 HydrophobicContact CD1-CB 4.06Å; I67-R154 HydrophobicContact CD1-CG 3.71Å; I67-L155 HydrophobicContact CD1-CD2 3.77Å; I67-L155 HydrophobicContact CD1-CG 4.11Å; I67-L155 HydrophobicContact CG1-CD2 3.97Å; I67-M158 HydrophobicContact CG2-CE 4.29Å; I67-M158 HydrophobicContact CG2-SD 4Å
68	P	93.5	Very high	95	Very high	10 Å²	10	44 Å²	44	7%	0.065	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	141.5	172.5	-25.8	32.1	0	0	0	111.9	T41 F42 A70 G81 Y82 M85	T41-P68 CarbonylContact O-C 3Å; T41-P68 WeakPolarHBondContact O-CA 3.29Å; F42-P68 HydrophobicContact CD1-CG 4.42Å; F42-P68 HydrophobicContact CE1-CB 4.44Å; F42-P68 HydrophobicContact CE1-CG 3.96Å; P68-A70 PolarHBondContact O-N 3.45Å; P68-G81 WeakPolarHBondContact O-CA 3.34Å; P68-Y82 VanDerWaalsContact CD-CD2 3.4Å; P68-Y82 HydrophobicContact CG-CD1 3.8Å; P68-Y82 HydrophobicContact CG-CD2 4.21Å; P68-Y82 HydrophobicContact CG-CE1 3.74Å; P68-Y82 HydrophobicContact CG-CE2 4.14Å; P68-Y82 HydrophobicContact CG-CG 4.05Å; P68-M85 HydrophobicContact CB-CG 3.52Å; P68-M85 HydrophobicContact CB-SD 4.27Å; P68-M85 HydrophobicContact CG-CG 3.69Å
69	S	94.8	Very high	95	Very high	7 Å²	7	45.6 Å²	45.6	5%	0.049	26%	0.257	C	S	.	.	S	Bend	trans	-78.8	55.2	175.9	-56.7	0	0	0	0	111.5	G39 T40 T41 F42 C43	G39-S69 PolarHBondContact O-OG 3.03Å; T40-S69 WeakPolarHBondContact O-CB 3.18Å; T41-S69 PolarHBondContact O-N 2.79Å; T41-S69 PolarHBondContact O-OG 3.26Å; F42-S69 WeakPolarHBondContact CA-OG 3.41Å; F42-S69 PolarHBondContact N-OG 2.77Å; C43-S69 PolarHBondContact SG-OG 3.06Å
70	A	97.2	Very high	95.1	Very high	1 Å²	1	42 Å²	42	1%	0.008	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	142.4	-177.4	0	0	0	0	0	111.6	P68 A80 G81 A84 M85 V96	P68-A70 PolarHBondContact O-N 3.45Å; A70-A80 WeakPolarHBondContact O-CA 3.4Å; A70-G81 PolarHBondContact O-N 3.44Å; A70-A84 HydrophobicContact CB-CB 4.1Å; A70-A84 WeakPolarHBondContact O-CB 3.3Å; A70-M85 HydrophobicContact CB-CG 4.09Å; A70-M85 HydrophobicContact CB-SD 3.64Å; A70-V96 CarbonylContact C-O 3.53Å; A70-V96 WeakPolarHBondContact CA-O 3.31Å
71	V	98.6	Very high	95.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	125.2	176.2	178.2	0	0	0	0	109	F73 V78 L79 A80 T95 V96 I147 R150 L151	V71-F73 HydrophobicContact CG1-CD2 4.41Å; V71-F73 HydrophobicContact CG1-CE2 3.8Å; V71-F73 HydrophobicContact CG1-CZ 4.06Å; V71-V78 HydrophobicContact CG1-CG1 3.63Å; V71-L79 CarbonylContact C-O 3.52Å; V71-L79 VanDerWaalsContact CA-O 3.26Å; V71-L79 WeakPolarHBondContact CA-O 3.33Å; V71-L79 WeakPolarHBondContact CG1-O 3.36Å; V71-A80 HydrophobicContact CG2-CB 4.34Å; V71-T95 CarbonylContact O-C 3.59Å; V71-T95 WeakPolarHBondContact O-CA 3.4Å; V71-V96 PolarHBondContact N-O 3.29Å; V71-V96 PolarHBondContact O-N 2.98Å; V71-I147 HydrophobicContact CB-CD1 4.31Å; V71-I147 HydrophobicContact CB-CG2 4.09Å; V71-I147 HydrophobicContact CG1-CD1 4.34Å; V71-I147 HydrophobicContact CG2-CG2 3.76Å; V71-R150 HydrophobicContact CG1-CB 4.22Å; V71-R150 HydrophobicContact CG1-CG 4.35Å; V71-R150 HydrophobicContact CG2-CB 3.94Å; V71-L151 HydrophobicContact CG2-CD2 4.02Å; V71-L151 HydrophobicContact CG2-CG 3.96Å
72	S	98.4	Very high	95.5	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	133.9	178.7	-166.7	0	0	0	0	110.8	L79 V87 N91 N94 T95	S72-L79 PolarHBondContact N-O 3.29Å; S72-L79 PolarHBondContact O-N 2.86Å; S72-V87 WeakPolarHBondContact OG-CG2 3.37Å; S72-N91 PolarHBondContact OG-ND2 3.04Å; S72-N91 VanDerWaalsContact OG-ND2 3.14Å; S72-N94 WeakPolarHBondContact CA-O 3.26Å; S72-T95 WeakPolarHBondContact CB-OG1 3.44Å; S72-T95 PolarHBondContact OG-OG1 3.22Å
73	F	98.2	Very high	95.6	Very high	7 Å²	7	37.5 Å²	37.5	3%	0.031	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	125	176.4	-63.7	-99.9	0	0	0	109.5	V71 V78 N91 N94 I134 T136 F140 V142 F146 I147	V71-F73 HydrophobicContact CG1-CD2 4.41Å; V71-F73 HydrophobicContact CG1-CE2 3.8Å; V71-F73 HydrophobicContact CG1-CZ 4.06Å; F73-V78 HydrophobicContact CD1-CG1 4.19Å; F73-V78 HydrophobicContact CD1-CG2 3.74Å; F73-V78 HydrophobicContact CE1-CG1 3.94Å; F73-V78 HydrophobicContact CE1-CG2 3.88Å; F73-V78 HydrophobicContact CZ-CG1 4.29Å; F73-N91 PolarHBondContact O-ND2 3.27Å; F73-N94 HydrophobicContact CB-CB 4.41Å; F73-N94 PolarHBondContact N-O 2.76Å; F73-N94 WeakPolarHBondContact O-CB 3.17Å; F73-I134 HydrophobicContact CB-CG2 3.45Å; F73-I134 VanDerWaalsContact CB-CG2 3.45Å; F73-I134 HydrophobicContact CD1-CG2 4.24Å; F73-I134 HydrophobicContact CD2-CD1 3.63Å; F73-I134 HydrophobicContact CD2-CG1 3.91Å; F73-I134 HydrophobicContact CD2-CG2 4.07Å; F73-I134 HydrophobicContact CE2-CD1 3.92Å; F73-I134 HydrophobicContact CE2-CG1 4.08Å; F73-I134 HydrophobicContact CG-CD1 4.35Å; F73-I134 HydrophobicContact CG-CG1 4.27Å; F73-I134 HydrophobicContact CG-CG2 3.68Å; F73-T136 HydrophobicContact CB-CG2 3.95Å; F73-F140 HydrophobicContact CD1-CE2 4.36Å; F73-F140 AromaticContact CD1-CZ 3.96Å; F73-F140 HydrophobicContact CD1-CZ 3.96Å; F73-F140 HydrophobicContact CE1-CE2 4.31Å; F73-F140 HydrophobicContact CE1-CZ 4.35Å; F73-V142 HydrophobicContact CE1-CG1 4.28Å; F73-V142 HydrophobicContact CE2-CG2 4.24Å; F73-V142 HydrophobicContact CZ-CG1 4.05Å; F73-V142 HydrophobicContact CZ-CG2 4.13Å; F73-F146 AromaticContact CE1-CE1 3.95Å; F73-F146 HydrophobicContact CE1-CE1 3.95Å; F73-F146 HydrophobicContact CZ-CD1 4.35Å; F73-F146 AromaticContact CZ-CE1 3.9Å; F73-F146 HydrophobicContact CZ-CE1 3.9Å; F73-I147 HydrophobicContact CE2-CD1 3.66Å; F73-I147 HydrophobicContact CZ-CD1 3.86Å
74	T	95.9	Very high	95.8	Very high	41 Å²	41	35.8 Å²	35.8	25%	0.252	20%	0.2	S	C	.	.			trans	-111.5	176.3	172.3	76.5	0	0	0	0	109.8	T76 A77 L79 T136	T74-T76 PolarHBondContact O-N 3.48Å; T74-T76 PolarHBondContact OG1-N 3.18Å; T74-T76 PolarHBondContact OG1-OG1 3.32Å; T74-A77 PolarHBondContact N-O 2.8Å; T74-A77 PolarHBondContact OG1-N 2.9Å; T74-A77 PolarHBondContact OG1-O 3.11Å; T74-L79 HydrophobicContact CG2-CD1 4.1Å; T74-L79 HydrophobicContact CG2-CG 4.47Å; T74-T136 WeakPolarHBondContact O-CG2 3.33Å
75	S	93.1	Very high	95.7	Very high	71 Å²	71	37.1 Å²	37.1	50%	0.497	21%	0.21	S	C	.	.	S	Bend	trans	-64	-17.4	174.3	52.9	0	0	0	0	113.6	N137	S75-N137 WeakPolarHBondContact CB-OD1 3.5Å; S75-N137 PolarHBondContact O-ND2 2.94Å
76	T	93.6	Very high	95.6	Very high	130 Å²	130	39.1 Å²	39.1	80%	0.798	23%	0.225	S	C	*	.	S	Bend	trans	-123.9	-21.3	-172.7	56.9	0	0	0	0	114.3	T74	T74-T76 PolarHBondContact O-N 3.48Å; T74-T76 PolarHBondContact OG1-N 3.18Å; T74-T76 PolarHBondContact OG1-OG1 3.32Å
77	A	95.2	Very high	95.6	Very high	40 Å²	40	39.4 Å²	39.4	33%	0.331	23%	0.225	S	C	.	.			trans	-148.7	161.1	-170.3	0	0	0	0	0	113.3	T74 L79	T74-A77 PolarHBondContact N-O 2.8Å; T74-A77 PolarHBondContact OG1-N 2.9Å; T74-A77 PolarHBondContact OG1-O 3.11Å; A77-L79 HydrophobicContact CB-CD2 4.06Å
78	V	97.1	Very high	95.3	Very high	65 Å²	65	40 Å²	40	39%	0.394	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	109.5	166.6	-176.2	0	0	0	0	107.3	V71 F73 R150	V71-V78 HydrophobicContact CG1-CG1 3.63Å; F73-V78 HydrophobicContact CD1-CG1 4.19Å; F73-V78 HydrophobicContact CD1-CG2 3.74Å; F73-V78 HydrophobicContact CE1-CG1 3.94Å; F73-V78 HydrophobicContact CE1-CG2 3.88Å; F73-V78 HydrophobicContact CZ-CG1 4.29Å; V78-R150 HydrophobicContact CG1-CG 4.08Å
79	L	97.7	Very high	95	Very high	34 Å²	34	46.5 Å²	46.5	18%	0.178	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	145.5	-178.6	-52.7	179.6	0	0	0	109.3	V71 S72 T74 A77 E83 A84 V87	V71-L79 CarbonylContact C-O 3.52Å; V71-L79 VanDerWaalsContact CA-O 3.26Å; V71-L79 WeakPolarHBondContact CA-O 3.33Å; V71-L79 WeakPolarHBondContact CG1-O 3.36Å; S72-L79 PolarHBondContact N-O 3.29Å; S72-L79 PolarHBondContact O-N 2.86Å; T74-L79 HydrophobicContact CG2-CD1 4.1Å; T74-L79 HydrophobicContact CG2-CG 4.47Å; A77-L79 HydrophobicContact CB-CD2 4.06Å; L79-E83 HydrophobicContact CB-CB 3.97Å; L79-E83 HydrophobicContact CD2-CB 4.42Å; L79-A84 HydrophobicContact CB-CB 4.31Å; L79-V87 HydrophobicContact CD1-CG1 4.3Å; L79-V87 HydrophobicContact CD1-CG2 3.96Å
80	A	97.7	Very high	94.8	Very high	11 Å²	11	50.9 Å²	50.9	9%	0.091	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	147	179.9	0	0	0	0	0	111.3	A70 V71 L151 R154	A70-A80 WeakPolarHBondContact O-CA 3.4Å; V71-A80 HydrophobicContact CG2-CB 4.34Å; A80-L151 HydrophobicContact CB-CD2 4.43Å; A80-R154 HydrophobicContact CB-CB 4.42Å
81	G	96.4	Very high	94.7	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.1	-137.8	-178.3	0	0	0	0	0	112.3	P68 A70 E83 A84 M85	P68-G81 WeakPolarHBondContact O-CA 3.34Å; A70-G81 PolarHBondContact O-N 3.44Å; G81-E83 VanDerWaalsContact C-N 3.26Å; G81-E83 PolarHBondContact O-N 3.03Å; G81-A84 WeakPolarHBondContact O-CB 2.87Å; G81-A84 PolarHBondContact O-N 3.48Å; G81-A84 VanDerWaalsContact O-N 3.08Å; G81-M85 PolarHBondContact O-N 3.35Å; G81-M85 VanDerWaalsContact O-N 3.12Å
82	Y	94.9	Very high	94.4	Very high	61 Å²	61	54.8 Å²	54.8	24%	0.239	32%	0.319	C	S	.	.	H	α-helix	trans	-61.1	-32.7	-179.4	-75.4	-76.5	0	0	0	113.4	R64 S66 P68 A84 M85 N86	R64-Y82 HydrophobicContact CB-CE2 4.29Å; R64-Y82 HydrophobicContact CG-CE2 4.42Å; R64-Y82 VanDerWaalsContact CZ-CG 3.48Å; S66-Y82 WeakPolarHBondContact O-CE2 3.21Å; P68-Y82 VanDerWaalsContact CD-CD2 3.4Å; P68-Y82 HydrophobicContact CG-CD1 3.8Å; P68-Y82 HydrophobicContact CG-CD2 4.21Å; P68-Y82 HydrophobicContact CG-CE1 3.74Å; P68-Y82 HydrophobicContact CG-CE2 4.14Å; P68-Y82 HydrophobicContact CG-CG 4.05Å; Y82-A84 VanDerWaalsContact C-N 3.27Å; Y82-A84 PolarHBondContact O-N 3.27Å; Y82-M85 PolarHBondContact O-N 2.97Å; Y82-M85 VanDerWaalsContact O-N 3.16Å; Y82-N86 PolarHBondContact O-N 2.84Å; Y82-N86 PolarHBondContact O-ND2 2.89Å; Y82-N86 PolarHBondContact O-OD1 3.43Å
83	E	95.5	Very high	94.3	Very high	95 Å²	95	61.1 Å²	61.1	44%	0.444	35%	0.348	S	S	.	.	H	α-helix	trans	-60.5	-37.9	174.8	-65.3	178	-173.5	0	0	112.1	L79 G81	L79-E83 HydrophobicContact CB-CB 3.97Å; L79-E83 HydrophobicContact CD2-CB 4.42Å; G81-E83 VanDerWaalsContact C-N 3.26Å; G81-E83 PolarHBondContact O-N 3.03Å
84	A	96.8	Very high	94.2	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-71.2	-40.4	175	0	0	0	0	0	111.6	A70 L79 G81 Y82 N86 V87 A88	A70-A84 HydrophobicContact CB-CB 4.1Å; A70-A84 WeakPolarHBondContact O-CB 3.3Å; L79-A84 HydrophobicContact CB-CB 4.31Å; G81-A84 WeakPolarHBondContact O-CB 2.87Å; G81-A84 PolarHBondContact O-N 3.48Å; G81-A84 VanDerWaalsContact O-N 3.08Å; Y82-A84 VanDerWaalsContact C-N 3.27Å; Y82-A84 PolarHBondContact O-N 3.27Å; A84-N86 VanDerWaalsContact C-N 3.34Å; A84-N86 PolarHBondContact O-N 3.34Å; A84-V87 VanDerWaalsContact O-CG2 3.27Å; A84-V87 WeakPolarHBondContact O-CG2 2.94Å; A84-V87 PolarHBondContact O-N 3.23Å; A84-A88 PolarHBondContact O-N 3.08Å
85	M	92	Very high	94.3	Very high	84 Å²	84	59.5 Å²	59.5	41%	0.414	34%	0.339	S	S	.	.	H	α-helix	trans	-64.4	-37.2	178.4	-71.9	-57.1	-58.3	0	0	112.7	P68 A70 G81 Y82 V87 A88	P68-M85 HydrophobicContact CB-CG 3.52Å; P68-M85 HydrophobicContact CB-SD 4.27Å; P68-M85 HydrophobicContact CG-CG 3.69Å; A70-M85 HydrophobicContact CB-CG 4.09Å; A70-M85 HydrophobicContact CB-SD 3.64Å; G81-M85 PolarHBondContact O-N 3.35Å; G81-M85 VanDerWaalsContact O-N 3.12Å; Y82-M85 PolarHBondContact O-N 2.97Å; Y82-M85 VanDerWaalsContact O-N 3.16Å; M85-V87 PolarHBondContact O-N 3.49Å; M85-V87 VanDerWaalsContact O-N 3.13Å; M85-A88 WeakPolarHBondContact O-CB 3.39Å; M85-A88 PolarHBondContact O-N 2.78Å; M85-A88 VanDerWaalsContact O-N 3.09Å
86	N	91.9	Very high	94.5	Very high	130 Å²	130	56.1 Å²	56.1	70%	0.695	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-22.1	179.3	-71.2	-12.8	0	0	0	113.4	Y82 A84	Y82-N86 PolarHBondContact O-N 2.84Å; Y82-N86 PolarHBondContact O-ND2 2.89Å; Y82-N86 PolarHBondContact O-OD1 3.43Å; A84-N86 VanDerWaalsContact C-N 3.34Å; A84-N86 PolarHBondContact O-N 3.34Å
87	V	93.4	Very high	94.5	Very high	38 Å²	38	53.6 Å²	53.6	23%	0.23	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	3.3	178.3	-57.4	0	0	0	0	112.9	S72 L79 A84 M85 D89 S90 N91	S72-V87 WeakPolarHBondContact OG-CG2 3.37Å; L79-V87 HydrophobicContact CD1-CG1 4.3Å; L79-V87 HydrophobicContact CD1-CG2 3.96Å; A84-V87 VanDerWaalsContact O-CG2 3.27Å; A84-V87 WeakPolarHBondContact O-CG2 2.94Å; A84-V87 PolarHBondContact O-N 3.23Å; M85-V87 PolarHBondContact O-N 3.49Å; M85-V87 VanDerWaalsContact O-N 3.13Å; V87-D89 VanDerWaalsContact C-N 3.32Å; V87-D89 PolarHBondContact O-N 2.69Å; V87-S90 PolarHBondContact O-N 3.45Å; V87-S90 PolarHBondContact O-OG 3.06Å; V87-N91 WeakPolarHBondContact O-CB 3.49Å; V87-N91 PolarHBondContact O-N 2.89Å
88	A	89.8	Confident	94.3	Very high	14 Å²	14	52.9 Å²	52.9	12%	0.116	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-39.5	-172.3	0	0	0	0	0	112.5	A84 M85 N91 P92 T95	A84-A88 PolarHBondContact O-N 3.08Å; M85-A88 WeakPolarHBondContact O-CB 3.39Å; M85-A88 PolarHBondContact O-N 2.78Å; M85-A88 VanDerWaalsContact O-N 3.09Å; A88-N91 CarbonylContact O-C 3.46Å; A88-P92 WeakPolarHBondContact O-CA 3.11Å; A88-P92 WeakPolarHBondContact O-CB 3.46Å; A88-P92 VanDerWaalsContact O-N 3.16Å; A88-T95 HydrophobicContact CB-CG2 3.87Å
89	D	87.1	Confident	94.2	Very high	147 Å²	147	50.1 Å²	50.1	79%	0.786	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-34.8	-179.2	-69.3	-20.8	0	0	0	112.7	V87	V87-D89 VanDerWaalsContact C-N 3.32Å; V87-D89 PolarHBondContact O-N 2.69Å
90	S	90.4	Very high	93.8	Very high	100 Å²	100	49.2 Å²	49.2	70%	0.699	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-19.1	179.2	59.4	0	0	0	0	113.4	V87 P92	V87-S90 PolarHBondContact O-N 3.45Å; V87-S90 PolarHBondContact O-OG 3.06Å; S90-P92 VanDerWaalsContact C-CD 3.43Å
91	N	94.1	Very high	93.5	Very high	32 Å²	32	52 Å²	52	17%	0.171	27%	0.269	C	S	.	.	S	Bend	trans	-132.1	54.8	179.4	-169.2	28.3	0	0	0	112.5	S72 F73 V87 A88 Q93 N94 T95	S72-N91 PolarHBondContact OG-ND2 3.04Å; S72-N91 VanDerWaalsContact OG-ND2 3.14Å; F73-N91 PolarHBondContact O-ND2 3.27Å; V87-N91 WeakPolarHBondContact O-CB 3.49Å; V87-N91 PolarHBondContact O-N 2.89Å; A88-N91 CarbonylContact O-C 3.46Å; N91-Q93 PolarHBondContact O-N 3.37Å; N91-N94 PolarHBondContact O-N 2.69Å; N91-N94 WeakPolarHBondContact OD1-CB 3.38Å; N91-N94 PolarHBondContact OD1-ND2 2.88Å; N91-T95 WeakPolarHBondContact O-CB 3.36Å; N91-T95 PolarHBondContact O-N 3.28Å; N91-T95 PolarHBondContact O-OG1 3.24Å
92	P	93.3	Very high	93.3	Very high	51 Å²	51	52.1 Å²	52.1	33%	0.331	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-71.2	-30.1	-168.5	27.8	-36.1	0	0	0	113.5	A88 S90 N94 P120	A88-P92 WeakPolarHBondContact O-CA 3.11Å; A88-P92 WeakPolarHBondContact O-CB 3.46Å; A88-P92 VanDerWaalsContact O-N 3.16Å; S90-P92 VanDerWaalsContact C-CD 3.43Å; P92-N94 VanDerWaalsContact C-N 3.31Å; P92-N94 PolarHBondContact O-N 3.35Å; P92-P120 HydrophobicContact CB-CB 3.99Å; P92-P120 HydrophobicContact CB-CG 4.08Å
93	Q	95.4	Very high	93.2	Very high	132 Å²	132	49.3 Å²	49.3	62%	0.617	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-72.7	-23.5	-179.5	-67.7	-175	-18.1	0	0	113.3	N91 F121	N91-Q93 PolarHBondContact O-N 3.37Å; Q93-F121 VanDerWaalsContact O-CB 3.26Å; Q93-F121 WeakPolarHBondContact O-CB 3.23Å
94	N	97.4	Very high	93.1	Very high	14 Å²	14	45 Å²	45	8%	0.075	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-112.3	9.6	-178.6	-59.6	-52.8	0	0	0	112.9	S72 F73 N91 P92 I134 S135	S72-N94 WeakPolarHBondContact CA-O 3.26Å; F73-N94 HydrophobicContact CB-CB 4.41Å; F73-N94 PolarHBondContact N-O 2.76Å; F73-N94 WeakPolarHBondContact O-CB 3.17Å; N91-N94 PolarHBondContact O-N 2.69Å; N91-N94 WeakPolarHBondContact OD1-CB 3.38Å; N91-N94 PolarHBondContact OD1-ND2 2.88Å; P92-N94 VanDerWaalsContact C-N 3.31Å; P92-N94 PolarHBondContact O-N 3.35Å; N94-I134 HydrophobicContact CB-CG2 4.47Å; N94-S135 PolarHBondContact ND2-O 3.12Å; N94-S135 PolarHBondContact OD1-N 3.31Å; N94-S135 PolarHBondContact OD1-O 3.08Å
95	T	97.6	Very high	92.8	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	102.9	176.7	-56.8	0	0	0	0	109.4	V71 S72 A88 N91 F121	V71-T95 CarbonylContact O-C 3.59Å; V71-T95 WeakPolarHBondContact O-CA 3.4Å; S72-T95 WeakPolarHBondContact CB-OG1 3.44Å; S72-T95 PolarHBondContact OG-OG1 3.22Å; A88-T95 HydrophobicContact CB-CG2 3.87Å; N91-T95 WeakPolarHBondContact O-CB 3.36Å; N91-T95 PolarHBondContact O-N 3.28Å; N91-T95 PolarHBondContact O-OG1 3.24Å; T95-F121 WeakPolarHBondContact O-CD1 3.34Å
96	V	97.4	Very high	92.8	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	128.1	-177.2	-175.8	0	0	0	0	109.9	A70 V71 A99 F121 F132 I134 I147	A70-V96 CarbonylContact C-O 3.53Å; A70-V96 WeakPolarHBondContact CA-O 3.31Å; V71-V96 PolarHBondContact N-O 3.29Å; V71-V96 PolarHBondContact O-N 2.98Å; V96-A99 HydrophobicContact CG1-CB 4.26Å; V96-F121 HydrophobicContact CG1-CE2 4.33Å; V96-F121 HydrophobicContact CG1-CZ 4.25Å; V96-F121 HydrophobicContact CG2-CG 4.44Å; V96-F132 HydrophobicContact CG1-CD1 3.87Å; V96-F132 HydrophobicContact CG1-CD2 3.85Å; V96-F132 HydrophobicContact CG1-CE1 3.96Å; V96-F132 HydrophobicContact CG1-CE2 3.9Å; V96-F132 HydrophobicContact CG1-CG 3.83Å; V96-F132 HydrophobicContact CG1-CZ 3.97Å; V96-F132 HydrophobicContact CG2-CB 3.97Å; V96-F132 HydrophobicContact CG2-CD1 4.49Å; V96-F132 HydrophobicContact CG2-CG 4.09Å; V96-I134 HydrophobicContact CG2-CD1 3.85Å; V96-I147 HydrophobicContact CB-CD1 4.15Å; V96-I147 HydrophobicContact CB-CG1 4.5Å; V96-I147 HydrophobicContact CG1-CD1 4.35Å; V96-I147 HydrophobicContact CG1-CG1 4.16Å; V96-I147 HydrophobicContact CG1-CG2 4.45Å; V96-I147 HydrophobicContact CG2-CD1 4.33Å
97	Y	93.6	Very high	92.7	Very high	76 Å²	76	45.1 Å²	45.1	30%	0.298	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	173.2	171.1	50.4	-91.4	0	0	0	109.3	A99 Y119 P120 F121	Y97-A99 PolarHBondContact O-N 3.24Å; Y97-Y119 HydrophobicContact CD2-CD1 4.16Å; Y97-Y119 AromaticContact CD2-CE1 4Å; Y97-Y119 HydrophobicContact CD2-CE1 4Å; Y97-Y119 AromaticContact CE2-CD1 3.49Å; Y97-Y119 HydrophobicContact CE2-CD1 3.49Å; Y97-Y119 VanDerWaalsContact CE2-CD1 3.49Å; Y97-Y119 AromaticContact CE2-CE1 3.61Å; Y97-Y119 HydrophobicContact CE2-CE1 3.61Å; Y97-Y119 AromaticContact CZ-CD1 3.97Å; Y97-P120 WeakPolarHBondContact OH-CD 3.43Å; Y97-F121 AromaticContact CD1-CE1 3.87Å; Y97-F121 HydrophobicContact CD1-CE1 3.87Å; Y97-F121 HydrophobicContact CD2-CE1 4.34Å; Y97-F121 HydrophobicContact CE1-CD1 4.25Å; Y97-F121 AromaticContact CE1-CE1 3.75Å; Y97-F121 HydrophobicContact CE1-CE1 3.75Å; Y97-F121 HydrophobicContact CE2-CE1 4.23Å; Y97-F121 HydrophobicContact CG-CE1 4.17Å; Y97-F121 AromaticContact CZ-CE1 3.93Å; Y97-F121 WeakPolarHBondContact O-CZ 3.12Å
98	D	91.3	Very high	92.4	Very high	25 Å²	25	50.2 Å²	50.2	13%	0.134	26%	0.257	C	S	.	.			trans	58.3	15.6	-176.7	-78	-5.3	0	0	0	114.9	K100 R101 Y119	D98-K100 PolarHBondContact O-N 3.2Å; D98-R101 HydrophobicContact CB-CG 4.36Å; D98-R101 VanDerWaalsContact O-CB 3.3Å; D98-R101 WeakPolarHBondContact O-CB 3.36Å; D98-R101 PolarHBondContact O-N 3.35Å; D98-R101 IonicContact OD2-CZ 2.59Å; D98-R101 IonicContact OD2-NE 3.37Å; D98-R101 IonicContact OD2-NH1 3.49Å; D98-R101 PolarHBondContact OD2-NH1 2.97Å; D98-R101 VanDerWaalsContact OD2-NH1 3.1Å; D98-Y119 HydrophobicContact CB-CE1 3.89Å; D98-Y119 WeakPolarHBondContact CB-OH 3.48Å; D98-Y119 WeakPolarHBondContact OD2-CE1 3.42Å; D98-Y119 PolarHBondContact OD2-OH 3.08Å
99	A	93.8	Very high	91.6	Very high	7 Å²	7	53.8 Å²	53.8	6%	0.058	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-56.5	-29.2	-174.6	0	0	0	0	0	113.5	V96 Y97 R101 F102 I103 F132 I147	V96-A99 HydrophobicContact CG1-CB 4.26Å; Y97-A99 PolarHBondContact O-N 3.24Å; A99-R101 PolarHBondContact O-N 3.48Å; A99-R101 VanDerWaalsContact O-N 3.17Å; A99-F102 PolarHBondContact O-N 3.22Å; A99-I103 PolarHBondContact O-N 3.09Å; A99-F132 HydrophobicContact CB-CE2 3.98Å; A99-F132 HydrophobicContact CB-CZ 4.05Å; A99-I147 HydrophobicContact CB-CB 3.82Å; A99-I147 HydrophobicContact CB-CG1 4.3Å; A99-I147 HydrophobicContact CB-CG2 3.55Å
100	K	91.1	Very high	91.3	Very high	16 Å²	16	48.7 Å²	48.7	7%	0.07	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-58.7	-24.6	174.2	-167	178.5	-176.7	-174	0	113.1	L38 D98 F102 I103 F178 E203	L38-K100 WeakPolarHBondContact O-CD 3.39Å; L38-K100 WeakPolarHBondContact O-CE 3.45Å; L38-K100 PolarHBondContact O-NZ 2.92Å; D98-K100 PolarHBondContact O-N 3.2Å; K100-F102 PolarHBondContact O-N 2.78Å; K100-I103 HydrophobicContact CG-CG2 4.34Å; K100-I103 VanDerWaalsContact O-CG2 3.26Å; K100-I103 WeakPolarHBondContact O-CG2 3.33Å; K100-F178 HydrophobicContact CG-CZ 4.13Å; K100-E203 IonicContact NZ-OE1 2.71Å; K100-E203 PolarHBondContact NZ-OE1 2.89Å
101	R	89.5	Confident	91.1	Very high	68 Å²	68	47.1 Å²	47.1	26%	0.257	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-68.2	-21.6	174.9	-66.6	-172.8	169.9	169.4	1	113.4	T40 D98 A99 K105 Y119	T40-R101 HydrophobicContact CG2-CG 4Å; D98-R101 HydrophobicContact CB-CG 4.36Å; D98-R101 VanDerWaalsContact O-CB 3.3Å; D98-R101 WeakPolarHBondContact O-CB 3.36Å; D98-R101 PolarHBondContact O-N 3.35Å; D98-R101 IonicContact OD2-CZ 2.59Å; D98-R101 IonicContact OD2-NE 3.37Å; D98-R101 IonicContact OD2-NH1 3.49Å; D98-R101 PolarHBondContact OD2-NH1 2.97Å; D98-R101 VanDerWaalsContact OD2-NH1 3.1Å; A99-R101 PolarHBondContact O-N 3.48Å; A99-R101 VanDerWaalsContact O-N 3.17Å; R101-K105 WeakPolarHBondContact O-CD 3.05Å; R101-K105 WeakPolarHBondContact O-CE 3.3Å; R101-K105 PolarHBondContact O-NZ 3.09Å; R101-Y119 PolarHBondContact NH1-OH 3.19Å; R101-Y119 VanDerWaalsContact NH1-OH 3.11Å
102	F	92.9	Very high	90.8	Very high	3 Å²	3	45.9 Å²	45.9	1%	0.013	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-18.8	-177.1	-60.7	-89.8	0	0	0	112.9	A99 K100 G104 K105 F107 L112 E115 Y119 V123 A130 F132 P144	A99-F102 PolarHBondContact O-N 3.22Å; K100-F102 PolarHBondContact O-N 2.78Å; F102-G104 PolarHBondContact O-N 2.96Å; F102-K105 PolarHBondContact O-N 3.27Å; F102-F107 HydrophobicContact CB-CE2 4.34Å; F102-F107 HydrophobicContact CB-CZ 4.46Å; F102-F107 HydrophobicContact CD1-CE1 4.41Å; F102-F107 AromaticContact CD1-CE2 3.84Å; F102-F107 HydrophobicContact CD1-CE2 3.84Å; F102-F107 AromaticContact CD1-CZ 3.57Å; F102-F107 HydrophobicContact CD1-CZ 3.57Å; F102-F107 HydrophobicContact CE1-CZ 4.21Å; F102-F107 HydrophobicContact CG-CZ 4.33Å; F102-L112 HydrophobicContact CD1-CD1 4.19Å; F102-L112 HydrophobicContact CE1-CD1 4.03Å; F102-E115 HydrophobicContact CE1-CB 4.35Å; F102-Y119 HydrophobicContact CE2-CE2 4.1Å; F102-Y119 HydrophobicContact CZ-CD2 4.26Å; F102-Y119 AromaticContact CZ-CE2 3.82Å; F102-Y119 HydrophobicContact CZ-CE2 3.82Å; F102-V123 HydrophobicContact CD1-CG1 4.44Å; F102-V123 HydrophobicContact CE1-CG1 4.25Å; F102-V123 HydrophobicContact CE1-CG2 4.47Å; F102-V123 HydrophobicContact CZ-CG2 4.42Å; F102-A130 HydrophobicContact CB-CB 4.09Å; F102-A130 HydrophobicContact CD1-CB 3.71Å; F102-A130 HydrophobicContact CG-CB 4.28Å; F102-F132 HydrophobicContact CB-CZ 4.21Å; F102-F132 AromaticContact CD2-CE1 3.96Å; F102-F132 HydrophobicContact CD2-CE1 3.96Å; F102-F132 AromaticContact CD2-CZ 3.71Å; F102-F132 HydrophobicContact CD2-CZ 3.71Å; F102-F132 HydrophobicContact CE2-CE1 4.1Å; F102-F132 HydrophobicContact CE2-CZ 4.29Å; F102-F132 HydrophobicContact CG-CE1 4.33Å; F102-F132 HydrophobicContact CG-CZ 4.02Å; F102-P144 HydrophobicContact CB-CB 4.27Å; F102-P144 HydrophobicContact CB-CG 3.69Å
103	I	93.9	Very high	90.5	Very high	3 Å²	3	50.3 Å²	50.3	2%	0.015	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	125.8	-172.4	-159.3	168	0	0	0	112	A99 K100 K105 P144 E145 F178 Q182	A99-I103 PolarHBondContact O-N 3.09Å; K100-I103 HydrophobicContact CG-CG2 4.34Å; K100-I103 VanDerWaalsContact O-CG2 3.26Å; K100-I103 WeakPolarHBondContact O-CG2 3.33Å; I103-K105 PolarHBondContact O-N 3.35Å; I103-P144 HydrophobicContact CB-CB 3.98Å; I103-P144 HydrophobicContact CG1-CB 4.22Å; I103-E145 HydrophobicContact CD1-CB 4.24Å; I103-F178 HydrophobicContact CG2-CE2 3.72Å; I103-F178 HydrophobicContact CG2-CZ 3.78Å; I103-Q182 WeakPolarHBondContact O-CG 3.24Å
104	G	92.3	Very high	90	Very high	4 Å²	4	50.9 Å²	50.9	4%	0.041	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.4	2.8	178.2	0	0	0	0	0	116.3	F102 R181	F102-G104 PolarHBondContact O-N 2.96Å; G104-R181 WeakPolarHBondContact O-CD 3.33Å; G104-R181 WeakPolarHBondContact O-CG 3.35Å; G104-R181 PolarHBondContact O-NE 3.22Å
105	K	91.8	Very high	89.2	Confident	81 Å²	81	52.6 Å²	52.6	35%	0.352	27%	0.267	S	S	.	.			trans	-78.5	152	177.4	-70.9	-170.3	-175.6	166.3	0	112	R101 F102 I103 F107	R101-K105 WeakPolarHBondContact O-CD 3.05Å; R101-K105 WeakPolarHBondContact O-CE 3.3Å; R101-K105 PolarHBondContact O-NZ 3.09Å; F102-K105 PolarHBondContact O-N 3.27Å; I103-K105 PolarHBondContact O-N 3.35Å; K105-F107 HydrophobicContact CB-CD2 4.1Å; K105-F107 HydrophobicContact CB-CE2 3.51Å; K105-F107 HydrophobicContact CB-CZ 3.88Å; K105-F107 HydrophobicContact CD-CE1 4.41Å; K105-F107 HydrophobicContact CD-CE2 4.36Å; K105-F107 HydrophobicContact CD-CZ 3.84Å; K105-F107 HydrophobicContact CG-CZ 4.49Å
106	I	91.7	Very high	88.7	Confident	117 Å²	117	53.6 Å²	53.6	60%	0.6	27%	0.274	S	S	*	.			trans	-105	125.1	165.5	-53	176.1	0	0	0	107	G128	I106-G128 CarbonylContact C-O 3.59Å; I106-G128 VanDerWaalsContact CA-O 3.32Å; I106-G128 WeakPolarHBondContact CA-O 3.16Å
107	F	88.8	Confident	88.2	Confident	18 Å²	18	57.7 Å²	57.7	8%	0.079	31%	0.308	C	S	.	.			trans	-108.9	133.3	177.6	-65.6	-92.4	0	0	0	110.7	F102 K105 V111 L112 N125 G128 A130	F102-F107 HydrophobicContact CB-CE2 4.34Å; F102-F107 HydrophobicContact CB-CZ 4.46Å; F102-F107 HydrophobicContact CD1-CE1 4.41Å; F102-F107 AromaticContact CD1-CE2 3.84Å; F102-F107 HydrophobicContact CD1-CE2 3.84Å; F102-F107 AromaticContact CD1-CZ 3.57Å; F102-F107 HydrophobicContact CD1-CZ 3.57Å; F102-F107 HydrophobicContact CE1-CZ 4.21Å; F102-F107 HydrophobicContact CG-CZ 4.33Å; K105-F107 HydrophobicContact CB-CD2 4.1Å; K105-F107 HydrophobicContact CB-CE2 3.51Å; K105-F107 HydrophobicContact CB-CZ 3.88Å; K105-F107 HydrophobicContact CD-CE1 4.41Å; K105-F107 HydrophobicContact CD-CE2 4.36Å; K105-F107 HydrophobicContact CD-CZ 3.84Å; K105-F107 HydrophobicContact CG-CZ 4.49Å; F107-V111 HydrophobicContact CD1-CG1 4.3Å; F107-L112 HydrophobicContact CB-CB 3.84Å; F107-L112 HydrophobicContact CB-CD1 4.25Å; F107-L112 HydrophobicContact CB-CG 4.44Å; F107-L112 HydrophobicContact CD1-CB 4.38Å; F107-L112 HydrophobicContact CD1-CD1 3.98Å; F107-L112 HydrophobicContact CD2-CD1 3.99Å; F107-L112 HydrophobicContact CE1-CD1 4.28Å; F107-L112 HydrophobicContact CE2-CD1 4.28Å; F107-L112 HydrophobicContact CG-CB 4.24Å; F107-L112 HydrophobicContact CG-CD1 3.82Å; F107-L112 HydrophobicContact CZ-CD1 4.42Å; F107-N125 PolarHBondContact O-ND2 2.86Å; F107-G128 PolarHBondContact N-O 2.98Å; F107-A130 HydrophobicContact CD2-CB 4.06Å; F107-A130 HydrophobicContact CE2-CB 3.9Å
108	E	87.4	Confident	87.8	Confident	146 Å²	146	60.8 Å²	60.8	68%	0.682	32%	0.319	S	S	*	.			trans	-69	143.4	159.1	-62.9	-175	175.3	0	0	109	G110 V111 L112	E108-G110 VanDerWaalsContact C-N 3.34Å; E108-G110 PolarHBondContact O-N 3.02Å; E108-V111 HydrophobicContact CB-CG2 4.26Å; E108-V111 PolarHBondContact O-N 3.03Å; E108-L112 PolarHBondContact O-N 3.4Å; E108-L112 VanDerWaalsContact O-N 3.15Å
109	P	74	Confident	87.6	Confident	88 Å²	88	60.7 Å²	60.7	57%	0.571	32%	0.317	S	S	*	.	H	α-helix	trans	-50.5	-47	-173.5	-30.4	35.8	0	0	0	114.6	V111 L112 E113	P109-V111 VanDerWaalsContact C-N 3.33Å; P109-V111 PolarHBondContact O-N 3Å; P109-L112 PolarHBondContact O-N 3.41Å; P109-E113 PolarHBondContact O-N 3.35Å
110	G	80.7	Confident	87.4	Confident	40 Å²	40	63.2 Å²	63.2	41%	0.412	33%	0.333	S	S	.	.	H	α-helix	trans	-69.5	-26.1	-178.7	0	0	0	0	0	114.7	E108 Q114	E108-G110 VanDerWaalsContact C-N 3.34Å; E108-G110 PolarHBondContact O-N 3.02Å; G110-Q114 WeakPolarHBondContact O-CG 3.2Å; G110-Q114 PolarHBondContact O-N 3.2Å
111	V	85.2	Confident	87.6	Confident	68 Å²	68	62.6 Å²	62.6	41%	0.412	33%	0.33	S	S	.	.	H	α-helix	trans	-75.7	-39.4	176	179.4	0	0	0	0	110.3	F107 E108 P109 Q114 E115	F107-V111 HydrophobicContact CD1-CG1 4.3Å; E108-V111 HydrophobicContact CB-CG2 4.26Å; E108-V111 PolarHBondContact O-N 3.03Å; P109-V111 VanDerWaalsContact C-N 3.33Å; P109-V111 PolarHBondContact O-N 3Å; V111-Q114 PolarHBondContact O-N 3.09Å; V111-E115 PolarHBondContact O-N 3.21Å; V111-E115 VanDerWaalsContact O-N 3.1Å
112	L	88.1	Confident	87.9	Confident	6 Å²	6	64.8 Å²	64.8	3%	0.031	34%	0.344	C	S	.	.	H	α-helix	trans	-65.3	-39.9	178.1	-171	60.3	0	0	0	111.9	F102 F107 E108 P109 E115 S116 V123 N125 A130	F102-L112 HydrophobicContact CD1-CD1 4.19Å; F102-L112 HydrophobicContact CE1-CD1 4.03Å; F107-L112 HydrophobicContact CB-CB 3.84Å; F107-L112 HydrophobicContact CB-CD1 4.25Å; F107-L112 HydrophobicContact CB-CG 4.44Å; F107-L112 HydrophobicContact CD1-CB 4.38Å; F107-L112 HydrophobicContact CD1-CD1 3.98Å; F107-L112 HydrophobicContact CD2-CD1 3.99Å; F107-L112 HydrophobicContact CE1-CD1 4.28Å; F107-L112 HydrophobicContact CE2-CD1 4.28Å; F107-L112 HydrophobicContact CG-CB 4.24Å; F107-L112 HydrophobicContact CG-CD1 3.82Å; F107-L112 HydrophobicContact CZ-CD1 4.42Å; E108-L112 PolarHBondContact O-N 3.4Å; E108-L112 VanDerWaalsContact O-N 3.15Å; P109-L112 PolarHBondContact O-N 3.41Å; L112-E115 PolarHBondContact O-N 3.05Å; L112-S116 WeakPolarHBondContact O-CB 3.5Å; L112-S116 PolarHBondContact O-N 3.38Å; L112-V123 HydrophobicContact CD1-CG1 3.81Å; L112-V123 HydrophobicContact CD2-CG1 4.4Å; L112-V123 HydrophobicContact CG-CG1 4.32Å; L112-N125 HydrophobicContact CD2-CB 3.73Å; L112-A130 HydrophobicContact CD1-CB 3.85Å; L112-A130 HydrophobicContact CD2-CB 4.45Å
113	E	85.9	Confident	88	Confident	143 Å²	143	65.2 Å²	65.2	67%	0.668	35%	0.346	S	S	*	.	H	α-helix	trans	-61.2	-44.1	177.6	-74.7	175.1	-173.2	0	0	111.9	P109 S116 A117	P109-E113 PolarHBondContact O-N 3.35Å; E113-S116 PolarHBondContact O-N 2.87Å; E113-A117 PolarHBondContact O-N 3.32Å
114	Q	85.3	Confident	88	Confident	144 Å²	144	67.2 Å²	67.2	67%	0.673	36%	0.358	S	S	*	.	H	α-helix	trans	-62.9	-42.8	176	-70.9	177.8	9.1	0	0	112.2	G110 V111 A117	G110-Q114 WeakPolarHBondContact O-CG 3.2Å; G110-Q114 PolarHBondContact O-N 3.2Å; V111-Q114 PolarHBondContact O-N 3.09Å; Q114-A117 PolarHBondContact O-N 3.42Å
115	E	81.6	Confident	88	Confident	50 Å²	50	70.1 Å²	70.1	23%	0.234	37%	0.373	C	S	.	.	H	α-helix	trans	-66.8	-40.3	176	-75.4	-67.4	107	0	0	111.5	F102 V111 L112 A117 R118 Y119	F102-E115 HydrophobicContact CE1-CB 4.35Å; V111-E115 PolarHBondContact O-N 3.21Å; V111-E115 VanDerWaalsContact O-N 3.1Å; L112-E115 PolarHBondContact O-N 3.05Å; E115-A117 VanDerWaalsContact C-N 3.29Å; E115-A117 PolarHBondContact O-N 3.16Å; E115-R118 WeakPolarHBondContact O-CB 3.29Å; E115-R118 PolarHBondContact O-N 3.42Å; E115-R118 IonicContact OE1-CZ 2.83Å; E115-R118 IonicContact OE1-NH1 3.38Å; E115-R118 PolarHBondContact OE1-NH1 3.43Å; E115-R118 IonicContact OE2-NH1 3.99Å; E115-R118 PolarHBondContact OE2-NH1 3.43Å; E115-Y119 WeakPolarHBondContact O-CD2 3.36Å; E115-Y119 WeakPolarHBondContact O-CE2 3.39Å
116	S	86.9	Confident	88	Confident	22 Å²	22	69.5 Å²	69.5	15%	0.154	37%	0.374	C	S	.	.	H	α-helix	trans	-63.2	-33.4	178.2	-170.5	0	0	0	0	112.5	L112 E113 R118 Y119 V123	L112-S116 WeakPolarHBondContact O-CB 3.5Å; L112-S116 PolarHBondContact O-N 3.38Å; E113-S116 PolarHBondContact O-N 2.87Å; S116-R118 PolarHBondContact O-N 3.18Å; S116-R118 VanDerWaalsContact O-N 3.09Å; S116-Y119 PolarHBondContact O-N 2.79Å; S116-Y119 VanDerWaalsContact O-N 3.12Å; S116-V123 PolarHBondContact OG-N 2.97Å
117	A	87.4	Confident	87.8	Confident	86 Å²	86	71.5 Å²	71.5	71%	0.711	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-13.5	179.3	0	0	0	0	0	113.8	E113 Q114 E115 Y119	E113-A117 PolarHBondContact O-N 3.32Å; Q114-A117 PolarHBondContact O-N 3.42Å; E115-A117 VanDerWaalsContact C-N 3.29Å; E115-A117 PolarHBondContact O-N 3.16Å; A117-Y119 VanDerWaalsContact C-N 3.3Å
118	R	84.2	Confident	87.7	Confident	142 Å²	142	71.3 Å²	71.3	54%	0.536	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-10.3	178.2	-56.6	170.9	64.1	-177.1	-1.7	113	E115 S116	E115-R118 WeakPolarHBondContact O-CB 3.29Å; E115-R118 PolarHBondContact O-N 3.42Å; E115-R118 IonicContact OE1-CZ 2.83Å; E115-R118 IonicContact OE1-NH1 3.38Å; E115-R118 PolarHBondContact OE1-NH1 3.43Å; E115-R118 IonicContact OE2-NH1 3.99Å; E115-R118 PolarHBondContact OE2-NH1 3.43Å; S116-R118 PolarHBondContact O-N 3.18Å; S116-R118 VanDerWaalsContact O-N 3.09Å
119	Y	87.3	Confident	87.9	Confident	22 Å²	22	65.5 Å²	65.5	9%	0.086	36%	0.364	C	S	.	.	S	Bend	trans	-125	148.7	-170	-60.1	-76.2	0	0	0	111.4	Y97 D98 R101 F102 E115 S116 A117 F121	Y97-Y119 HydrophobicContact CD2-CD1 4.16Å; Y97-Y119 AromaticContact CD2-CE1 4Å; Y97-Y119 HydrophobicContact CD2-CE1 4Å; Y97-Y119 AromaticContact CE2-CD1 3.49Å; Y97-Y119 HydrophobicContact CE2-CD1 3.49Å; Y97-Y119 VanDerWaalsContact CE2-CD1 3.49Å; Y97-Y119 AromaticContact CE2-CE1 3.61Å; Y97-Y119 HydrophobicContact CE2-CE1 3.61Å; Y97-Y119 AromaticContact CZ-CD1 3.97Å; D98-Y119 HydrophobicContact CB-CE1 3.89Å; D98-Y119 WeakPolarHBondContact CB-OH 3.48Å; D98-Y119 WeakPolarHBondContact OD2-CE1 3.42Å; D98-Y119 PolarHBondContact OD2-OH 3.08Å; R101-Y119 PolarHBondContact NH1-OH 3.19Å; R101-Y119 VanDerWaalsContact NH1-OH 3.11Å; F102-Y119 HydrophobicContact CE2-CE2 4.1Å; F102-Y119 HydrophobicContact CZ-CD2 4.26Å; F102-Y119 AromaticContact CZ-CE2 3.82Å; F102-Y119 HydrophobicContact CZ-CE2 3.82Å; E115-Y119 WeakPolarHBondContact O-CD2 3.36Å; E115-Y119 WeakPolarHBondContact O-CE2 3.39Å; S116-Y119 PolarHBondContact O-N 2.79Å; S116-Y119 VanDerWaalsContact O-N 3.12Å; A117-Y119 VanDerWaalsContact C-N 3.3Å; Y119-F121 AromaticContact CD1-CE1 3.71Å; Y119-F121 HydrophobicContact CD1-CE1 3.71Å; Y119-F121 HydrophobicContact CD1-CE2 4.2Å; Y119-F121 AromaticContact CD1-CZ 3.37Å; Y119-F121 HydrophobicContact CD1-CZ 3.37Å; Y119-F121 HydrophobicContact CD2-CE2 4.3Å; Y119-F121 HydrophobicContact CD2-CZ 4.23Å; Y119-F121 HydrophobicContact CE1-CZ 4.1Å; Y119-F121 AromaticContact CG-CE1 4Å; Y119-F121 HydrophobicContact CG-CE1 4Å; Y119-F121 AromaticContact CG-CE2 3.8Å; Y119-F121 HydrophobicContact CG-CE2 3.8Å; Y119-F121 AromaticContact CG-CZ 3.45Å; Y119-F121 HydrophobicContact CG-CZ 3.45Å; Y119-F121 VanDerWaalsContact CG-CZ 3.45Å
120	P	90.2	Very high	88.9	Confident	61 Å²	61	61.4 Å²	61.4	40%	0.396	34%	0.338	S	S	.	.	S	Bend	trans	-77.2	-22	175.7	31	-34.5	0	0	0	113.1	P92 Y97	P92-P120 HydrophobicContact CB-CB 3.99Å; P92-P120 HydrophobicContact CB-CG 4.08Å; Y97-P120 WeakPolarHBondContact OH-CD 3.43Å
121	F	94.4	Very high	89.7	Confident	2 Å²	2	61.2 Å²	61.2	1%	0.009	33%	0.326	C	S	.	.	S	Bend	trans	-84.8	148.9	173.3	53.7	-99.9	0	0	0	110.7	Q93 T95 V96 Y97 Y119 V123 F132	Q93-F121 VanDerWaalsContact O-CB 3.26Å; Q93-F121 WeakPolarHBondContact O-CB 3.23Å; T95-F121 WeakPolarHBondContact O-CD1 3.34Å; V96-F121 HydrophobicContact CG1-CE2 4.33Å; V96-F121 HydrophobicContact CG1-CZ 4.25Å; V96-F121 HydrophobicContact CG2-CG 4.44Å; Y97-F121 AromaticContact CD1-CE1 3.87Å; Y97-F121 HydrophobicContact CD1-CE1 3.87Å; Y97-F121 HydrophobicContact CD2-CE1 4.34Å; Y97-F121 HydrophobicContact CE1-CD1 4.25Å; Y97-F121 AromaticContact CE1-CE1 3.75Å; Y97-F121 HydrophobicContact CE1-CE1 3.75Å; Y97-F121 HydrophobicContact CE2-CE1 4.23Å; Y97-F121 HydrophobicContact CG-CE1 4.17Å; Y97-F121 AromaticContact CZ-CE1 3.93Å; Y97-F121 WeakPolarHBondContact O-CZ 3.12Å; Y119-F121 AromaticContact CD1-CE1 3.71Å; Y119-F121 HydrophobicContact CD1-CE1 3.71Å; Y119-F121 HydrophobicContact CD1-CE2 4.2Å; Y119-F121 AromaticContact CD1-CZ 3.37Å; Y119-F121 HydrophobicContact CD1-CZ 3.37Å; Y119-F121 HydrophobicContact CD2-CE2 4.3Å; Y119-F121 HydrophobicContact CD2-CZ 4.23Å; Y119-F121 HydrophobicContact CE1-CZ 4.1Å; Y119-F121 AromaticContact CG-CE1 4Å; Y119-F121 HydrophobicContact CG-CE1 4Å; Y119-F121 AromaticContact CG-CE2 3.8Å; Y119-F121 HydrophobicContact CG-CE2 3.8Å; Y119-F121 AromaticContact CG-CZ 3.45Å; Y119-F121 HydrophobicContact CG-CZ 3.45Å; Y119-F121 VanDerWaalsContact CG-CZ 3.45Å; F121-V123 HydrophobicContact CD2-CG2 4.09Å; F121-V123 HydrophobicContact CE2-CG2 4.02Å; F121-F132 AromaticContact CD2-CD1 3.81Å; F121-F132 HydrophobicContact CD2-CD1 3.81Å; F121-F132 HydrophobicContact CD2-CE1 4.3Å; F121-F132 AromaticContact CE2-CD1 3.7Å; F121-F132 HydrophobicContact CE2-CD1 3.7Å; F121-F132 AromaticContact CE2-CE1 3.71Å; F121-F132 HydrophobicContact CE2-CE1 3.71Å
122	Q	95	Very high	90.3	Very high	115 Å²	115	58 Å²	58	54%	0.537	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	135	-177.7	179.8	-178.3	18.3	0	0	111.1	V124 F132 V133	Q122-V124 HydrophobicContact CG-CG1 4.28Å; Q122-F132 WeakPolarHBondContact O-CA 3.25Å; Q122-V133 HydrophobicContact CB-CB 4.1Å; Q122-V133 HydrophobicContact CB-CG2 4.27Å; Q122-V133 HydrophobicContact CG-CB 4.32Å; Q122-V133 HydrophobicContact CG-CG2 3.96Å; Q122-V133 PolarHBondContact O-N 2.99Å
123	V	95.2	Very high	90.7	Very high	12 Å²	12	58.4 Å²	58.4	7%	0.073	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	131.9	172.9	-165.2	0	0	0	0	109.3	F102 L112 S116 F121 A130 E131 F132	F102-V123 HydrophobicContact CD1-CG1 4.44Å; F102-V123 HydrophobicContact CE1-CG1 4.25Å; F102-V123 HydrophobicContact CE1-CG2 4.47Å; F102-V123 HydrophobicContact CZ-CG2 4.42Å; L112-V123 HydrophobicContact CD1-CG1 3.81Å; L112-V123 HydrophobicContact CD2-CG1 4.4Å; L112-V123 HydrophobicContact CG-CG1 4.32Å; S116-V123 PolarHBondContact OG-N 2.97Å; F121-V123 HydrophobicContact CD2-CG2 4.09Å; F121-V123 HydrophobicContact CE2-CG2 4.02Å; V123-A130 HydrophobicContact CG1-CB 3.77Å; V123-E131 CarbonylContact C-O 3.54Å; V123-E131 WeakPolarHBondContact CA-O 3.47Å; V123-E131 WeakPolarHBondContact CG1-O 3.31Å; V123-F132 HydrophobicContact CG1-CD1 4.44Å; V123-F132 HydrophobicContact CG1-CE1 4.42Å; V123-F132 HydrophobicContact CG2-CD1 3.93Å; V123-F132 HydrophobicContact CG2-CE1 4.02Å
124	V	94.2	Very high	91.3	Very high	44 Å²	44	51.6 Å²	51.6	27%	0.267	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	151.8	178.4	-66.7	0	0	0	0	111	Q122 A130 E131 V133 T141	Q122-V124 HydrophobicContact CG-CG1 4.28Å; V124-A130 WeakPolarHBondContact O-CA 3.28Å; V124-E131 HydrophobicContact CG2-CB 4.13Å; V124-E131 PolarHBondContact N-O 2.71Å; V124-E131 PolarHBondContact O-N 3.37Å; V124-V133 HydrophobicContact CB-CG2 4.3Å; V124-V133 HydrophobicContact CG1-CG2 3.52Å; V124-V133 HydrophobicContact CG2-CG2 3.83Å; V124-T141 HydrophobicContact CG2-CG2 4Å
125	N	93.5	Very high	91.8	Very high	66 Å²	66	47.2 Å²	47.2	35%	0.353	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	123.1	174.6	-166.6	-53	0	0	0	109.6	F107 L112 N127 G128 S129	F107-N125 PolarHBondContact O-ND2 2.86Å; L112-N125 HydrophobicContact CD2-CB 3.73Å; N125-N127 PolarHBondContact OD1-N 3.35Å; N125-G128 VanDerWaalsContact OD1-CA 3.26Å; N125-G128 WeakPolarHBondContact OD1-CA 3.32Å; N125-G128 PolarHBondContact OD1-N 3.26Å; N125-S129 CarbonylContact C-O 3.55Å
126	N	91.6	Very high	92.3	Very high	68 Å²	68	46.9 Å²	46.9	36%	0.364	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	99.9	168.9	-175.4	13.8	0	0	0	109.1	G128 S129 E131	N126-G128 VanDerWaalsContact C-N 3.27Å; N126-G128 PolarHBondContact O-N 3.48Å; N126-S129 PolarHBondContact N-O 3.49Å; N126-S129 PolarHBondContact O-N 2.66Å; N126-E131 HydrophobicContact CB-CG 3.94Å; N126-E131 VanDerWaalsContact ND2-CD 3.35Å; N126-E131 PolarHBondContact ND2-OE1 3.03Å
127	N	87.9	Confident	92.5	Very high	158 Å²	158	51.8 Å²	51.8	85%	0.845	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	42.3	178.8	-63.6	-31.6	0	0	0	114.1	N125 S129	N125-N127 PolarHBondContact OD1-N 3.35Å; N127-S129 VanDerWaalsContact C-N 3.32Å; N127-S129 PolarHBondContact O-N 2.91Å
128	G	86.7	Confident	92.8	Very high	14 Å²	14	53.5 Å²	53.5	14%	0.144	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.5	-15.1	-178.2	0	0	0	0	0	114.3	I106 F107 N125 N126	I106-G128 CarbonylContact C-O 3.59Å; I106-G128 VanDerWaalsContact CA-O 3.32Å; I106-G128 WeakPolarHBondContact CA-O 3.16Å; F107-G128 PolarHBondContact N-O 2.98Å; N125-G128 VanDerWaalsContact OD1-CA 3.26Å; N125-G128 WeakPolarHBondContact OD1-CA 3.32Å; N125-G128 PolarHBondContact OD1-N 3.26Å; N126-G128 VanDerWaalsContact C-N 3.27Å; N126-G128 PolarHBondContact O-N 3.48Å
129	S	91.2	Very high	93.4	Very high	24 Å²	24	51.3 Å²	51.3	17%	0.168	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	150.7	174.6	-72.5	0	0	0	0	111.5	N125 N126 N127 R181	N125-S129 CarbonylContact C-O 3.55Å; N126-S129 PolarHBondContact N-O 3.49Å; N126-S129 PolarHBondContact O-N 2.66Å; N127-S129 VanDerWaalsContact C-N 3.32Å; N127-S129 PolarHBondContact O-N 2.91Å; S129-R181 PolarHBondContact OG-NH2 3.04Å
130	A	94.6	Very high	93.8	Very high	2 Å²	2	53.1 Å²	53.1	2%	0.017	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	141	176.1	0	0	0	0	0	111.1	F102 F107 L112 V123 V124 P144	F102-A130 HydrophobicContact CB-CB 4.09Å; F102-A130 HydrophobicContact CD1-CB 3.71Å; F102-A130 HydrophobicContact CG-CB 4.28Å; F107-A130 HydrophobicContact CD2-CB 4.06Å; F107-A130 HydrophobicContact CE2-CB 3.9Å; L112-A130 HydrophobicContact CD1-CB 3.85Å; L112-A130 HydrophobicContact CD2-CB 4.45Å; V123-A130 HydrophobicContact CG1-CB 3.77Å; V124-A130 WeakPolarHBondContact O-CA 3.28Å; A130-P144 WeakPolarHBondContact O-CD 3.25Å
131	E	96.8	Very high	94.1	Very high	36 Å²	36	53.3 Å²	53.3	17%	0.168	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	148	166.9	-63.9	-170.9	169	0	0	110.7	V123 V124 N126 T141	V123-E131 CarbonylContact C-O 3.54Å; V123-E131 WeakPolarHBondContact CA-O 3.47Å; V123-E131 WeakPolarHBondContact CG1-O 3.31Å; V124-E131 HydrophobicContact CG2-CB 4.13Å; V124-E131 PolarHBondContact N-O 2.71Å; V124-E131 PolarHBondContact O-N 3.37Å; N126-E131 HydrophobicContact CB-CG 3.94Å; N126-E131 VanDerWaalsContact ND2-CD 3.35Å; N126-E131 PolarHBondContact ND2-OE1 3.03Å; E131-T141 WeakPolarHBondContact OE2-CB 3.18Å; E131-T141 PolarHBondContact OE2-OG1 3.46Å
132	F	97.6	Very high	94.3	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	128.7	178.5	-51.6	-72.8	0	0	0	109.8	V96 A99 F102 F121 Q122 V123 T141 V142 P144 I147	V96-F132 HydrophobicContact CG1-CD1 3.87Å; V96-F132 HydrophobicContact CG1-CD2 3.85Å; V96-F132 HydrophobicContact CG1-CE1 3.96Å; V96-F132 HydrophobicContact CG1-CE2 3.9Å; V96-F132 HydrophobicContact CG1-CG 3.83Å; V96-F132 HydrophobicContact CG1-CZ 3.97Å; V96-F132 HydrophobicContact CG2-CB 3.97Å; V96-F132 HydrophobicContact CG2-CD1 4.49Å; V96-F132 HydrophobicContact CG2-CG 4.09Å; A99-F132 HydrophobicContact CB-CE2 3.98Å; A99-F132 HydrophobicContact CB-CZ 4.05Å; F102-F132 HydrophobicContact CB-CZ 4.21Å; F102-F132 AromaticContact CD2-CE1 3.96Å; F102-F132 HydrophobicContact CD2-CE1 3.96Å; F102-F132 AromaticContact CD2-CZ 3.71Å; F102-F132 HydrophobicContact CD2-CZ 3.71Å; F102-F132 HydrophobicContact CE2-CE1 4.1Å; F102-F132 HydrophobicContact CE2-CZ 4.29Å; F102-F132 HydrophobicContact CG-CE1 4.33Å; F102-F132 HydrophobicContact CG-CZ 4.02Å; F121-F132 AromaticContact CD2-CD1 3.81Å; F121-F132 HydrophobicContact CD2-CD1 3.81Å; F121-F132 HydrophobicContact CD2-CE1 4.3Å; F121-F132 AromaticContact CE2-CD1 3.7Å; F121-F132 HydrophobicContact CE2-CD1 3.7Å; F121-F132 AromaticContact CE2-CE1 3.71Å; F121-F132 HydrophobicContact CE2-CE1 3.71Å; Q122-F132 WeakPolarHBondContact O-CA 3.25Å; V123-F132 HydrophobicContact CG1-CD1 4.44Å; V123-F132 HydrophobicContact CG1-CE1 4.42Å; V123-F132 HydrophobicContact CG2-CD1 3.93Å; V123-F132 HydrophobicContact CG2-CE1 4.02Å; F132-T141 CarbonylContact O-C 3.46Å; F132-T141 VanDerWaalsContact O-CA 3.25Å; F132-T141 WeakPolarHBondContact O-CA 3.35Å; F132-V142 HydrophobicContact CB-CG2 3.91Å; F132-V142 HydrophobicContact CD2-CG2 4.32Å; F132-V142 WeakPolarHBondContact CD2-O 3.44Å; F132-V142 PolarHBondContact N-O 2.92Å; F132-V142 PolarHBondContact O-N 3.13Å; F132-P144 HydrophobicContact CE2-CB 4.18Å; F132-P144 HydrophobicContact CE2-CG 3.86Å; F132-P144 HydrophobicContact CZ-CG 4.25Å; F132-I147 HydrophobicContact CD2-CG1 3.89Å; F132-I147 HydrophobicContact CE2-CG1 4.04Å
133	V	97.6	Very high	94.4	Very high	16 Å²	16	49.4 Å²	49.4	10%	0.097	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	124.2	175.6	-175.6	0	0	0	0	108.8	Q122 V124 T139 T141	Q122-V133 HydrophobicContact CB-CB 4.1Å; Q122-V133 HydrophobicContact CB-CG2 4.27Å; Q122-V133 HydrophobicContact CG-CB 4.32Å; Q122-V133 HydrophobicContact CG-CG2 3.96Å; Q122-V133 PolarHBondContact O-N 2.99Å; V124-V133 HydrophobicContact CB-CG2 4.3Å; V124-V133 HydrophobicContact CG1-CG2 3.52Å; V124-V133 HydrophobicContact CG2-CG2 3.83Å; V133-T139 HydrophobicContact CG1-CG2 3.58Å; V133-T141 HydrophobicContact CG2-CG2 4.2Å
134	I	97.7	Very high	94.5	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	127.6	178.5	-55.7	-57.6	0	0	0	108.1	F73 N94 V96 T136 T139 F140 V142	F73-I134 HydrophobicContact CB-CG2 3.45Å; F73-I134 VanDerWaalsContact CB-CG2 3.45Å; F73-I134 HydrophobicContact CD1-CG2 4.24Å; F73-I134 HydrophobicContact CD2-CD1 3.63Å; F73-I134 HydrophobicContact CD2-CG1 3.91Å; F73-I134 HydrophobicContact CD2-CG2 4.07Å; F73-I134 HydrophobicContact CE2-CD1 3.92Å; F73-I134 HydrophobicContact CE2-CG1 4.08Å; F73-I134 HydrophobicContact CG-CD1 4.35Å; F73-I134 HydrophobicContact CG-CG1 4.27Å; F73-I134 HydrophobicContact CG-CG2 3.68Å; N94-I134 HydrophobicContact CB-CG2 4.47Å; V96-I134 HydrophobicContact CG2-CD1 3.85Å; I134-T136 HydrophobicContact CG2-CG2 3.98Å; I134-T139 CarbonylContact O-C 3.47Å; I134-T139 VanDerWaalsContact O-CA 3.28Å; I134-T139 WeakPolarHBondContact O-CA 3.31Å; I134-F140 HydrophobicContact CB-CD1 4.41Å; I134-F140 HydrophobicContact CB-CD2 4.36Å; I134-F140 HydrophobicContact CB-CE1 4.02Å; I134-F140 HydrophobicContact CB-CE2 3.96Å; I134-F140 HydrophobicContact CB-CZ 3.78Å; I134-F140 HydrophobicContact CG1-CE2 4.26Å; I134-F140 HydrophobicContact CG1-CZ 4.42Å; I134-F140 HydrophobicContact CG2-CE1 3.73Å; I134-F140 HydrophobicContact CG2-CE2 4.19Å; I134-F140 HydrophobicContact CG2-CZ 3.52Å; I134-F140 PolarHBondContact N-O 2.95Å; I134-F140 PolarHBondContact O-N 2.87Å; I134-V142 HydrophobicContact CD1-CG2 4.22Å; I134-V142 HydrophobicContact CG1-CG1 4.33Å; I134-V142 HydrophobicContact CG1-CG2 3.74Å
135	S	95.4	Very high	94.7	Very high	52 Å²	52	47.6 Å²	47.6	36%	0.364	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	96.7	178.1	-65.3	0	0	0	0	110.1	N94 T139	N94-S135 PolarHBondContact ND2-O 3.12Å; N94-S135 PolarHBondContact OD1-N 3.31Å; N94-S135 PolarHBondContact OD1-O 3.08Å; S135-T139 WeakPolarHBondContact OG-CG2 3.41Å; S135-T139 PolarHBondContact OG-OG1 2.79Å
136	T	92.2	Very high	94.9	Very high	42 Å²	42	47 Å²	47	26%	0.258	26%	0.261	S	S	.	.	S	Bend	trans	-107.5	-107.7	172.9	62.5	0	0	0	0	109.7	F73 T74 I134 H138	F73-T136 HydrophobicContact CB-CG2 3.95Å; T74-T136 WeakPolarHBondContact O-CG2 3.33Å; I134-T136 HydrophobicContact CG2-CG2 3.98Å; T136-H138 PolarHBondContact N-O 3.22Å
137	N	91.9	Very high	95.2	Very high	126 Å²	126	43.7 Å²	43.7	67%	0.674	24%	0.243	S	C	*	.	S	Bend	trans	-79.7	-24.9	170.8	-62.4	-25.3	0	0	0	112	S75	S75-N137 WeakPolarHBondContact CB-OD1 3.5Å; S75-N137 PolarHBondContact O-ND2 2.94Å
138	H	93.3	Very high	95.7	Very high	121 Å²	121	36.4 Å²	36.4	56%	0.56	21%	0.206	S	C	*	.	S	Bend	trans	-138.9	157.2	173.7	54.4	-81	0	0	0	108	T136 F140	T136-H138 PolarHBondContact N-O 3.22Å; H138-F140 AromaticContact CD2-CD1 3.44Å; H138-F140 VanDerWaalsContact CD2-CD1 3.44Å; H138-F140 WeakPolarHBondContact CD2-CD1 3.18Å; H138-F140 AromaticContact NE2-CD1 3.5Å; H138-F140 WeakPolarHBondContact NE2-CD1 3.37Å; H138-F140 AromaticContact NE2-CE1 3.87Å
139	T	96.3	Very high	96.3	Very high	97 Å²	97	35.8 Å²	35.8	60%	0.595	20%	0.199	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	128.9	174.5	-58.1	0	0	0	0	109.5	V133 I134 S135	V133-T139 HydrophobicContact CG1-CG2 3.58Å; I134-T139 CarbonylContact O-C 3.47Å; I134-T139 VanDerWaalsContact O-CA 3.28Å; I134-T139 WeakPolarHBondContact O-CA 3.31Å; S135-T139 WeakPolarHBondContact OG-CG2 3.41Å; S135-T139 PolarHBondContact OG-OG1 2.79Å
140	F	96.7	Very high	96.6	Very high	59 Å²	59	37.6 Å²	37.6	26%	0.259	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	169.2	177.2	61.5	-81.8	0	0	0	109.8	F73 I134 H138 V142	F73-F140 HydrophobicContact CD1-CE2 4.36Å; F73-F140 AromaticContact CD1-CZ 3.96Å; F73-F140 HydrophobicContact CD1-CZ 3.96Å; F73-F140 HydrophobicContact CE1-CE2 4.31Å; F73-F140 HydrophobicContact CE1-CZ 4.35Å; I134-F140 HydrophobicContact CB-CD1 4.41Å; I134-F140 HydrophobicContact CB-CD2 4.36Å; I134-F140 HydrophobicContact CB-CE1 4.02Å; I134-F140 HydrophobicContact CB-CE2 3.96Å; I134-F140 HydrophobicContact CB-CZ 3.78Å; I134-F140 HydrophobicContact CG1-CE2 4.26Å; I134-F140 HydrophobicContact CG1-CZ 4.42Å; I134-F140 HydrophobicContact CG2-CE1 3.73Å; I134-F140 HydrophobicContact CG2-CE2 4.19Å; I134-F140 HydrophobicContact CG2-CZ 3.52Å; I134-F140 PolarHBondContact N-O 2.95Å; I134-F140 PolarHBondContact O-N 2.87Å; H138-F140 AromaticContact CD2-CD1 3.44Å; H138-F140 VanDerWaalsContact CD2-CD1 3.44Å; H138-F140 WeakPolarHBondContact CD2-CD1 3.18Å; H138-F140 AromaticContact NE2-CD1 3.5Å; H138-F140 WeakPolarHBondContact NE2-CD1 3.37Å; H138-F140 AromaticContact NE2-CE1 3.87Å; F140-V142 HydrophobicContact CD2-CG1 3.75Å; F140-V142 HydrophobicContact CE2-CG1 3.47Å; F140-V142 VanDerWaalsContact CE2-CG1 3.47Å
141	T	97.6	Very high	96.8	Very high	66 Å²	66	37.8 Å²	37.8	41%	0.405	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	149.4	176	58.6	0	0	0	0	111.3	V124 E131 F132 V133	V124-T141 HydrophobicContact CG2-CG2 4Å; E131-T141 WeakPolarHBondContact OE2-CB 3.18Å; E131-T141 PolarHBondContact OE2-OG1 3.46Å; F132-T141 CarbonylContact O-C 3.46Å; F132-T141 VanDerWaalsContact O-CA 3.25Å; F132-T141 WeakPolarHBondContact O-CA 3.35Å; V133-T141 HydrophobicContact CG2-CG2 4.2Å
142	V	97.7	Very high	96.9	Very high	9 Å²	9	36.1 Å²	36.1	6%	0.055	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	140.1	175.4	-64	0	0	0	0	110.7	F73 F132 I134 F140 F146 I147	F73-V142 HydrophobicContact CE1-CG1 4.28Å; F73-V142 HydrophobicContact CE2-CG2 4.24Å; F73-V142 HydrophobicContact CZ-CG1 4.05Å; F73-V142 HydrophobicContact CZ-CG2 4.13Å; F132-V142 HydrophobicContact CB-CG2 3.91Å; F132-V142 HydrophobicContact CD2-CG2 4.32Å; F132-V142 WeakPolarHBondContact CD2-O 3.44Å; F132-V142 PolarHBondContact N-O 2.92Å; F132-V142 PolarHBondContact O-N 3.13Å; I134-V142 HydrophobicContact CD1-CG2 4.22Å; I134-V142 HydrophobicContact CG1-CG1 4.33Å; I134-V142 HydrophobicContact CG1-CG2 3.74Å; F140-V142 HydrophobicContact CD2-CG1 3.75Å; F140-V142 HydrophobicContact CE2-CG1 3.47Å; F140-V142 VanDerWaalsContact CE2-CG1 3.47Å; V142-F146 HydrophobicContact CB-CD1 3.96Å; V142-F146 HydrophobicContact CG1-CD1 3.98Å; V142-F146 HydrophobicContact CG1-CE1 4.03Å; V142-I147 HydrophobicContact CG2-CD1 3.74Å; V142-I147 HydrophobicContact CG2-CG1 4.31Å
143	S	97.9	Very high	96.9	Very high	25 Å²	25	39 Å²	39	18%	0.175	21%	0.209	C	C	.	.			trans	-82.7	157.7	-179.9	65.7	0	0	0	0	112.5	E145 F146 I147	S143-E145 VanDerWaalsContact C-N 3.31Å; S143-E145 WeakPolarHBondContact CB-OE2 3.46Å; S143-E145 PolarHBondContact O-N 3.34Å; S143-E145 WeakPolarHBondContact OG-CG 3.49Å; S143-E145 PolarHBondContact OG-OE1 2.97Å; S143-E145 PolarHBondContact OG-OE2 3.34Å; S143-F146 WeakPolarHBondContact O-CB 3.34Å; S143-F146 PolarHBondContact O-N 3.3Å; S143-F146 PolarHBondContact OG-N 3.16Å; S143-I147 PolarHBondContact O-N 2.96Å; S143-I147 VanDerWaalsContact O-N 3.15Å
144	P	97.3	Very high	96.9	Very high	6 Å²	6	39.9 Å²	39.9	4%	0.039	21%	0.211	C	C	.	.	H	α-helix	trans	-55.7	-39.9	174.5	-26.8	34.8	0	0	0	114.3	F102 I103 A130 F132 F146 I147 G148	F102-P144 HydrophobicContact CB-CB 4.27Å; F102-P144 HydrophobicContact CB-CG 3.69Å; I103-P144 HydrophobicContact CB-CB 3.98Å; I103-P144 HydrophobicContact CG1-CB 4.22Å; A130-P144 WeakPolarHBondContact O-CD 3.25Å; F132-P144 HydrophobicContact CE2-CB 4.18Å; F132-P144 HydrophobicContact CE2-CG 3.86Å; F132-P144 HydrophobicContact CZ-CG 4.25Å; P144-F146 VanDerWaalsContact C-N 3.27Å; P144-F146 PolarHBondContact O-N 3.33Å; P144-I147 PolarHBondContact O-N 3Å; P144-G148 PolarHBondContact O-N 3.2Å
145	E	97.3	Very high	96.9	Very high	12 Å²	12	39.9 Å²	39.9	6%	0.056	21%	0.211	C	C	.	.	H	α-helix	trans	-67.6	-28	176.4	67.3	-90	-151.5	0	0	112.6	I103 S143 S149 Y185 R188 A189 L192	I103-E145 HydrophobicContact CD1-CB 4.24Å; S143-E145 VanDerWaalsContact C-N 3.31Å; S143-E145 WeakPolarHBondContact CB-OE2 3.46Å; S143-E145 PolarHBondContact O-N 3.34Å; S143-E145 WeakPolarHBondContact OG-CG 3.49Å; S143-E145 PolarHBondContact OG-OE1 2.97Å; S143-E145 PolarHBondContact OG-OE2 3.34Å; E145-S149 WeakPolarHBondContact O-CB 3.46Å; E145-S149 PolarHBondContact O-N 3.42Å; E145-Y185 HydrophobicContact CG-CD1 4.39Å; E145-Y185 WeakPolarHBondContact OE1-CE1 3.26Å; E145-Y185 WeakPolarHBondContact OE2-CD1 3.27Å; E145-R188 HydrophobicContact CG-CG 4.3Å; E145-R188 IonicContact OE1-CZ 3.92Å; E145-R188 IonicContact OE1-NE 2.73Å; E145-R188 IonicContact OE1-NH1 3.96Å; E145-R188 PolarHBondContact OE1-NH1 2.74Å; E145-A189 HydrophobicContact CB-CB 3.93Å; E145-A189 WeakPolarHBondContact O-CA 3.28Å; E145-A189 WeakPolarHBondContact O-CB 3.09Å; E145-L192 HydrophobicContact CG-CD1 4.12Å
146	F	98.1	Very high	97	Very high	53 Å²	53	38.9 Å²	38.9	23%	0.232	20%	0.2	C	C	.	.	H	α-helix	trans	-69.6	-43.2	173.6	-178.8	-91.1	0	0	0	110.9	F73 V142 S143 P144 G148 S149 R150	F73-F146 AromaticContact CE1-CE1 3.95Å; F73-F146 HydrophobicContact CE1-CE1 3.95Å; F73-F146 HydrophobicContact CZ-CD1 4.35Å; F73-F146 AromaticContact CZ-CE1 3.9Å; F73-F146 HydrophobicContact CZ-CE1 3.9Å; V142-F146 HydrophobicContact CB-CD1 3.96Å; V142-F146 HydrophobicContact CG1-CD1 3.98Å; V142-F146 HydrophobicContact CG1-CE1 4.03Å; S143-F146 WeakPolarHBondContact O-CB 3.34Å; S143-F146 PolarHBondContact O-N 3.3Å; S143-F146 PolarHBondContact OG-N 3.16Å; P144-F146 VanDerWaalsContact C-N 3.27Å; P144-F146 PolarHBondContact O-N 3.33Å; F146-G148 VanDerWaalsContact C-N 3.35Å; F146-S149 WeakPolarHBondContact O-CB 3.41Å; F146-S149 PolarHBondContact O-N 3.47Å; F146-S149 VanDerWaalsContact O-N 3.17Å; F146-S149 PolarHBondContact O-OG 2.57Å; F146-R150 HydrophobicContact CE1-CG 4.29Å; F146-R150 VanDerWaalsContact CE2-CZ 3.5Å; F146-R150 VanDerWaalsContact CE2-NH2 3.3Å; F146-R150 PolarHBondContact O-N 2.77Å
147	I	98.4	Very high	97.2	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-57.8	-49.6	172.4	-59.2	-59.6	0	0	0	110.1	V71 F73 V96 A99 F132 V142 S143 P144 S149 R150 L151	V71-I147 HydrophobicContact CB-CD1 4.31Å; V71-I147 HydrophobicContact CB-CG2 4.09Å; V71-I147 HydrophobicContact CG1-CD1 4.34Å; V71-I147 HydrophobicContact CG2-CG2 3.76Å; F73-I147 HydrophobicContact CE2-CD1 3.66Å; F73-I147 HydrophobicContact CZ-CD1 3.86Å; V96-I147 HydrophobicContact CB-CD1 4.15Å; V96-I147 HydrophobicContact CB-CG1 4.5Å; V96-I147 HydrophobicContact CG1-CD1 4.35Å; V96-I147 HydrophobicContact CG1-CG1 4.16Å; V96-I147 HydrophobicContact CG1-CG2 4.45Å; V96-I147 HydrophobicContact CG2-CD1 4.33Å; A99-I147 HydrophobicContact CB-CB 3.82Å; A99-I147 HydrophobicContact CB-CG1 4.3Å; A99-I147 HydrophobicContact CB-CG2 3.55Å; F132-I147 HydrophobicContact CD2-CG1 3.89Å; F132-I147 HydrophobicContact CE2-CG1 4.04Å; V142-I147 HydrophobicContact CG2-CD1 3.74Å; V142-I147 HydrophobicContact CG2-CG1 4.31Å; S143-I147 PolarHBondContact O-N 2.96Å; S143-I147 VanDerWaalsContact O-N 3.15Å; P144-I147 PolarHBondContact O-N 3Å; I147-S149 VanDerWaalsContact C-N 3.27Å; I147-S149 PolarHBondContact O-N 3.42Å; I147-R150 WeakPolarHBondContact O-CB 3.24Å; I147-R150 PolarHBondContact O-N 2.83Å; I147-L151 PolarHBondContact O-N 3.26Å
148	G	97.7	Very high	97.5	Very high	5 Å²	5	36.4 Å²	36.4	5%	0.052	18%	0.18	C	C	.	.	H	α-helix	trans	-54.2	-42.6	174.6	0	0	0	0	0	112.4	P144 F146 R150 L151 L152	P144-G148 PolarHBondContact O-N 3.2Å; F146-G148 VanDerWaalsContact C-N 3.35Å; G148-R150 VanDerWaalsContact C-N 3.28Å; G148-R150 PolarHBondContact O-N 3.43Å; G148-L151 PolarHBondContact O-N 2.93Å; G148-L152 VanDerWaalsContact O-CG 3.31Å; G148-L152 WeakPolarHBondContact O-CG 3.37Å; G148-L152 PolarHBondContact O-N 2.84Å
149	S	98.5	Very high	97.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.9	-34.4	178.5	82.2	0	0	0	0	113.5	E145 F146 I147 M153 A189 L192 A193	E145-S149 WeakPolarHBondContact O-CB 3.46Å; E145-S149 PolarHBondContact O-N 3.42Å; F146-S149 WeakPolarHBondContact O-CB 3.41Å; F146-S149 PolarHBondContact O-N 3.47Å; F146-S149 VanDerWaalsContact O-N 3.17Å; F146-S149 PolarHBondContact O-OG 2.57Å; I147-S149 VanDerWaalsContact C-N 3.27Å; I147-S149 PolarHBondContact O-N 3.42Å; S149-M153 WeakPolarHBondContact O-CB 3.33Å; S149-M153 PolarHBondContact O-N 2.9Å; S149-A189 WeakPolarHBondContact CA-O 3.2Å; S149-A189 WeakPolarHBondContact CB-O 3.26Å; S149-L192 VanDerWaalsContact CB-CB 3.48Å; S149-A193 WeakPolarHBondContact O-CB 3.06Å
150	R	98.6	Very high	97.6	Very high	63 Å²	63	28.3 Å²	28.3	24%	0.238	14%	0.135	C	C	.	.	H	α-helix	trans	-69.3	-39.8	178.5	-66.7	-65.9	179.8	-96.8	15.6	111.3	V71 V78 F146 I147 G148 R154	V71-R150 HydrophobicContact CG1-CB 4.22Å; V71-R150 HydrophobicContact CG1-CG 4.35Å; V71-R150 HydrophobicContact CG2-CB 3.94Å; V78-R150 HydrophobicContact CG1-CG 4.08Å; F146-R150 HydrophobicContact CE1-CG 4.29Å; F146-R150 VanDerWaalsContact CE2-CZ 3.5Å; F146-R150 VanDerWaalsContact CE2-NH2 3.3Å; F146-R150 PolarHBondContact O-N 2.77Å; I147-R150 WeakPolarHBondContact O-CB 3.24Å; I147-R150 PolarHBondContact O-N 2.83Å; G148-R150 VanDerWaalsContact C-N 3.28Å; G148-R150 PolarHBondContact O-N 3.43Å; R150-R154 PolarHBondContact O-N 2.83Å; R150-R154 VanDerWaalsContact O-N 3.12Å
151	L	98.3	Very high	97.6	Very high	6 Å²	6	32.8 Å²	32.8	3%	0.031	15%	0.15	C	C	.	.	H	α-helix	trans	-65.1	-49.2	173.5	-63.3	168.8	0	0	0	111.1	L38 V71 A80 I147 G148 M153 R154 L155	L38-L151 HydrophobicContact CD1-CB 4.3Å; L38-L151 HydrophobicContact CD1-CD1 4.2Å; V71-L151 HydrophobicContact CG2-CD2 4.02Å; V71-L151 HydrophobicContact CG2-CG 3.96Å; A80-L151 HydrophobicContact CB-CD2 4.43Å; I147-L151 PolarHBondContact O-N 3.26Å; G148-L151 PolarHBondContact O-N 2.93Å; L151-M153 VanDerWaalsContact C-N 3.29Å; L151-M153 PolarHBondContact O-N 2.97Å; L151-R154 WeakPolarHBondContact O-CB 3.38Å; L151-R154 PolarHBondContact O-N 2.77Å; L151-R154 VanDerWaalsContact O-N 3.08Å; L151-L155 PolarHBondContact O-N 3.12Å
152	L	98.4	Very high	97.4	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-62.6	-36.1	178.7	-65.9	178.3	0	0	0	112.3	L36 L38 G148 L155 K156 I172 A189 A190 A193 L195	L36-L152 HydrophobicContact CB-CD2 4.35Å; L36-L152 HydrophobicContact CD1-CD2 4.18Å; L36-L152 HydrophobicContact CD2-CD2 4.31Å; L38-L152 HydrophobicContact CB-CD2 4.25Å; L38-L152 HydrophobicContact CD1-CD2 4.17Å; L38-L152 HydrophobicContact CD1-CG 4.35Å; L38-L152 HydrophobicContact CD2-CD1 4.45Å; G148-L152 VanDerWaalsContact O-CG 3.31Å; G148-L152 WeakPolarHBondContact O-CG 3.37Å; G148-L152 PolarHBondContact O-N 2.84Å; L152-L155 HydrophobicContact CD2-CD1 4.36Å; L152-L155 PolarHBondContact O-N 2.87Å; L152-K156 WeakPolarHBondContact O-CB 3.29Å; L152-K156 PolarHBondContact O-N 3.41Å; L152-I172 HydrophobicContact CD1-CD1 3.98Å; L152-I172 HydrophobicContact CD2-CD1 4.07Å; L152-A189 HydrophobicContact CD1-CB 4.19Å; L152-A190 VanDerWaalsContact CD1-CA 3.48Å; L152-A190 HydrophobicContact CD1-CB 3.78Å; L152-A193 HydrophobicContact CB-CB 3.82Å; L152-L195 HydrophobicContact CB-CD1 4.48Å
153	M	98	Very high	97.1	Very high	60 Å²	60	33.5 Å²	33.5	30%	0.296	15%	0.149	S	C	.	.	H	α-helix	trans	-66	-36.5	174.1	-178	171.5	57.2	0	0	112	S149 L151 K157 A193	S149-M153 WeakPolarHBondContact O-CB 3.33Å; S149-M153 PolarHBondContact O-N 2.9Å; L151-M153 VanDerWaalsContact C-N 3.29Å; L151-M153 PolarHBondContact O-N 2.97Å; M153-K157 WeakPolarHBondContact O-CG 3.4Å; M153-K157 PolarHBondContact O-N 3.05Å; M153-A193 HydrophobicContact CB-CB 4.16Å
154	R	97.4	Very high	96.9	Very high	36 Å²	36	34.9 Å²	34.9	14%	0.136	17%	0.167	C	C	.	.	H	α-helix	trans	-64.5	-47.7	173.6	178.7	58.4	166.4	137.7	-0.8	111	E61 I67 A80 R150 L151 K156 K157 M158	E61-R154 IonicContact OE1-CZ 2.74Å; E61-R154 IonicContact OE1-NH1 3.16Å; E61-R154 PolarHBondContact OE1-NH1 2.78Å; E61-R154 IonicContact OE1-NH2 3.46Å; E61-R154 PolarHBondContact OE1-NH2 2.78Å; E61-R154 IonicContact OE2-CZ 2.83Å; E61-R154 IonicContact OE2-NH1 2.81Å; E61-R154 PolarHBondContact OE2-NH1 3.46Å; E61-R154 IonicContact OE2-NH2 2.83Å; E61-R154 PolarHBondContact OE2-NH2 2.89Å; I67-R154 HydrophobicContact CD1-CB 4.06Å; I67-R154 HydrophobicContact CD1-CG 3.71Å; A80-R154 HydrophobicContact CB-CB 4.42Å; R150-R154 PolarHBondContact O-N 2.83Å; R150-R154 VanDerWaalsContact O-N 3.12Å; L151-R154 WeakPolarHBondContact O-CB 3.38Å; L151-R154 PolarHBondContact O-N 2.77Å; L151-R154 VanDerWaalsContact O-N 3.08Å; R154-K156 PolarHBondContact O-N 3.22Å; R154-K157 PolarHBondContact O-N 3.41Å; R154-M158 HydrophobicContact CG-SD 4.23Å; R154-M158 WeakPolarHBondContact O-CG 3.43Å; R154-M158 PolarHBondContact O-N 3.07Å
155	L	98.1	Very high	96.7	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-59.3	-44.7	175.9	-69.4	-176.2	0	0	0	112.6	L36 C43 V45 I67 L151 L152 K157 M158 A159	L36-L155 HydrophobicContact CD2-CB 3.95Å; L36-L155 HydrophobicContact CD2-CD1 3.82Å; C43-L155 HydrophobicContact CB-CD1 3.82Å; C43-L155 HydrophobicContact CB-CD2 4.49Å; C43-L155 HydrophobicContact CB-CG 4.46Å; V45-L155 HydrophobicContact CB-CB 4.02Å; V45-L155 HydrophobicContact CB-CD1 4.37Å; V45-L155 HydrophobicContact CB-CD2 4.16Å; V45-L155 HydrophobicContact CB-CG 4.42Å; V45-L155 HydrophobicContact CG1-CB 4.02Å; V45-L155 HydrophobicContact CG1-CD2 3.86Å; V45-L155 HydrophobicContact CG1-CG 4.45Å; I67-L155 HydrophobicContact CD1-CD2 3.77Å; I67-L155 HydrophobicContact CD1-CG 4.11Å; I67-L155 HydrophobicContact CG1-CD2 3.97Å; L151-L155 PolarHBondContact O-N 3.12Å; L152-L155 HydrophobicContact CD2-CD1 4.36Å; L152-L155 PolarHBondContact O-N 2.87Å; L155-K157 PolarHBondContact O-N 2.85Å; L155-M158 HydrophobicContact CD2-CE 4.49Å; L155-M158 HydrophobicContact CD2-SD 4.08Å; L155-M158 WeakPolarHBondContact O-CB 3.36Å; L155-M158 PolarHBondContact O-N 2.94Å; L155-A159 PolarHBondContact O-N 3.26Å
156	K	97.8	Very high	96.5	Very high	30 Å²	30	40.4 Å²	40.4	13%	0.13	20%	0.203	C	C	.	.	H	α-helix	trans	-55.6	-49.7	173.4	173.6	-179.5	170.4	165.1	0	111.2	L152 R154 M158 A159 E160 I167 G194 L195	L152-K156 WeakPolarHBondContact O-CB 3.29Å; L152-K156 PolarHBondContact O-N 3.41Å; R154-K156 PolarHBondContact O-N 3.22Å; K156-M158 VanDerWaalsContact C-N 3.3Å; K156-M158 PolarHBondContact O-N 3.03Å; K156-A159 PolarHBondContact O-N 3.33Å; K156-E160 WeakPolarHBondContact CE-OE1 3.41Å; K156-E160 HydrophobicContact CG-CG 4.2Å; K156-E160 IonicContact NZ-OE1 2.73Å; K156-E160 WeakPolarHBondContact O-CB 3.36Å; K156-E160 WeakPolarHBondContact O-CG 3.3Å; K156-E160 PolarHBondContact O-N 3.12Å; K156-I167 WeakPolarHBondContact CE-O 3.21Å; K156-I167 PolarHBondContact NZ-O 3.29Å; K156-I167 VanDerWaalsContact NZ-O 3.12Å; K156-G194 PolarHBondContact NZ-O 3.29Å; K156-L195 HydrophobicContact CB-CD1 4.36Å; K156-L195 HydrophobicContact CD-CD2 3.91Å; K156-L195 HydrophobicContact CD-CG 4.08Å; K156-L195 HydrophobicContact CG-CD2 4.25Å
157	K	96.8	Very high	96.4	Very high	110 Å²	110	37.9 Å²	37.9	48%	0.478	19%	0.192	S	C	.	.	H	α-helix	trans	-62.2	-35.7	179.2	-76.1	176.1	178.1	-177.7	0	112.8	M153 R154 L155 R161	M153-K157 WeakPolarHBondContact O-CG 3.4Å; M153-K157 PolarHBondContact O-N 3.05Å; R154-K157 PolarHBondContact O-N 3.41Å; L155-K157 PolarHBondContact O-N 2.85Å; K157-R161 VanDerWaalsContact O-CB 3.31Å; K157-R161 WeakPolarHBondContact O-CB 3.4Å; K157-R161 PolarHBondContact O-N 2.84Å
158	M	96.8	Very high	96.3	Very high	7 Å²	7	44 Å²	44	3%	0.034	22%	0.221	C	C	.	.	H	α-helix	trans	-61.7	-51.3	173.7	-67.9	162.4	58	0	0	110.2	I58 D60 I67 R154 L155 K156 E160 R161 Q162	I58-M158 HydrophobicContact CG2-CB 3.82Å; I58-M158 HydrophobicContact CG2-CE 4.46Å; D60-M158 HydrophobicContact CB-CE 3.78Å; D60-M158 HydrophobicContact CB-SD 4.4Å; I67-M158 HydrophobicContact CG2-CE 4.29Å; I67-M158 HydrophobicContact CG2-SD 4Å; R154-M158 HydrophobicContact CG-SD 4.23Å; R154-M158 WeakPolarHBondContact O-CG 3.43Å; R154-M158 PolarHBondContact O-N 3.07Å; L155-M158 HydrophobicContact CD2-CE 4.49Å; L155-M158 HydrophobicContact CD2-SD 4.08Å; L155-M158 WeakPolarHBondContact O-CB 3.36Å; L155-M158 PolarHBondContact O-N 2.94Å; K156-M158 VanDerWaalsContact C-N 3.3Å; K156-M158 PolarHBondContact O-N 3.03Å; M158-E160 PolarHBondContact O-N 2.88Å; M158-R161 PolarHBondContact O-N 3.4Å; M158-Q162 PolarHBondContact O-N 3.44Å
159	A	96.8	Very high	96.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.5	-44.4	178.6	0	0	0	0	0	112.6	I34 V45 I58 L155 K156 R161 Q162 L163	I34-A159 HydrophobicContact CG2-CB 4.14Å; V45-A159 HydrophobicContact CG2-CB 4.2Å; I58-A159 HydrophobicContact CG1-CB 4.32Å; L155-A159 PolarHBondContact O-N 3.26Å; K156-A159 PolarHBondContact O-N 3.33Å; A159-R161 VanDerWaalsContact C-N 3.29Å; A159-R161 PolarHBondContact O-N 3.11Å; A159-Q162 PolarHBondContact O-N 2.96Å; A159-L163 VanDerWaalsContact O-CB 3.28Å; A159-L163 WeakPolarHBondContact O-CB 3.33Å; A159-L163 VanDerWaalsContact O-CG 3.28Å; A159-L163 WeakPolarHBondContact O-CG 3.43Å; A159-L163 PolarHBondContact O-N 3.48Å
160	E	96.3	Very high	96.3	Very high	48 Å²	48	47.8 Å²	47.8	22%	0.224	24%	0.236	C	C	.	.	H	α-helix	trans	-61	-37.6	177.3	-73.5	-179.6	149.1	0	0	112.2	K156 M158 G164 V165 I167	K156-E160 WeakPolarHBondContact CE-OE1 3.41Å; K156-E160 HydrophobicContact CG-CG 4.2Å; K156-E160 IonicContact NZ-OE1 2.73Å; K156-E160 WeakPolarHBondContact O-CB 3.36Å; K156-E160 WeakPolarHBondContact O-CG 3.3Å; K156-E160 PolarHBondContact O-N 3.12Å; M158-E160 PolarHBondContact O-N 2.88Å; E160-G164 VanDerWaalsContact O-CA 3.25Å; E160-G164 WeakPolarHBondContact O-CA 3.33Å; E160-G164 PolarHBondContact O-N 3.49Å; E160-V165 WeakPolarHBondContact CG-O 3.5Å; E160-I167 HydrophobicContact CG-CB 3.9Å; E160-I167 HydrophobicContact CG-CG1 3.78Å; E160-I167 PolarHBondContact OE1-N 3.29Å
161	R	95.1	Very high	96.3	Very high	152 Å²	152	44.8 Å²	44.8	57%	0.574	22%	0.224	S	C	*	.	H	α-helix	trans	-68.2	-47.8	177.4	-171.9	-174.6	-55.2	178.3	12.5	111.8	E61 K157 M158 A159	E61-R161 VanDerWaalsContact CD-NH1 3.28Å; E61-R161 IonicContact OE1-CZ 2.72Å; E61-R161 IonicContact OE1-NH1 2.67Å; E61-R161 PolarHBondContact OE1-NH1 3.33Å; E61-R161 IonicContact OE1-NH2 3.35Å; E61-R161 PolarHBondContact OE1-NH2 3.31Å; K157-R161 VanDerWaalsContact O-CB 3.31Å; K157-R161 WeakPolarHBondContact O-CB 3.4Å; K157-R161 PolarHBondContact O-N 2.84Å; M158-R161 PolarHBondContact O-N 3.4Å; A159-R161 VanDerWaalsContact C-N 3.29Å; A159-R161 PolarHBondContact O-N 3.11Å
162	Q	93.4	Very high	96.2	Very high	77 Å²	77	44.5 Å²	44.5	36%	0.36	22%	0.223	S	C	.	.	H	α-helix	trans	-66.9	-42.2	-179.4	-176.9	166.9	-23.3	0	0	111.5	E56 I58 M158 A159	E56-Q162 PolarHBondContact OE1-NE2 2.96Å; I58-Q162 HydrophobicContact CD1-CB 4.38Å; I58-Q162 VanDerWaalsContact CD1-CD 3.46Å; I58-Q162 HydrophobicContact CD1-CG 4.19Å; I58-Q162 VanDerWaalsContact CG2-OE1 3.3Å; M158-Q162 PolarHBondContact O-N 3.44Å; A159-Q162 PolarHBondContact O-N 2.96Å
163	L	91.9	Very high	96.1	Very high	14 Å²	14	44.5 Å²	44.5	7%	0.073	22%	0.223	C	C	.	.	H	α-helix	trans	-81	-23.7	-180	-62	178.7	0	0	0	112.9	K30 P31 V47 A159 V165 I167	K30-L163 WeakPolarHBondContact CD-O 3.49Å; K30-L163 WeakPolarHBondContact CE-O 3.48Å; K30-L163 PolarHBondContact NZ-O 3.28Å; P31-L163 HydrophobicContact CB-CD1 4.34Å; P31-L163 HydrophobicContact CG-CD2 4.24Å; V47-L163 HydrophobicContact CG1-CD1 4.17Å; A159-L163 VanDerWaalsContact O-CB 3.28Å; A159-L163 WeakPolarHBondContact O-CB 3.33Å; A159-L163 VanDerWaalsContact O-CG 3.28Å; A159-L163 WeakPolarHBondContact O-CG 3.43Å; A159-L163 PolarHBondContact O-N 3.48Å; L163-V165 VanDerWaalsContact C-N 3.28Å; L163-V165 HydrophobicContact CB-CG2 3.91Å; L163-V165 PolarHBondContact O-N 3.46Å; L163-I167 HydrophobicContact CD1-CD1 3.89Å; L163-I167 HydrophobicContact CD1-CG1 4.49Å
164	G	93.4	Very high	95.8	Very high	54 Å²	54	41.6 Å²	41.6	56%	0.557	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.5	29.6	-176	0	0	0	0	0	113.8	E160	E160-G164 VanDerWaalsContact O-CA 3.25Å; E160-G164 WeakPolarHBondContact O-CA 3.33Å; E160-G164 PolarHBondContact O-N 3.49Å
165	V	92.6	Very high	95.3	Very high	38 Å²	38	40.6 Å²	40.6	23%	0.23	21%	0.207	C	C	.	.	S	Bend	trans	-140.7	150.1	175.8	-65	0	0	0	0	110	K30 E160 L163 I167	K30-V165 HydrophobicContact CB-CG1 4.45Å; K30-V165 HydrophobicContact CB-CG2 4.28Å; K30-V165 HydrophobicContact CD-CG1 3.54Å; K30-V165 HydrophobicContact CD-CG2 4.41Å; E160-V165 WeakPolarHBondContact CG-O 3.5Å; L163-V165 VanDerWaalsContact C-N 3.28Å; L163-V165 HydrophobicContact CB-CG2 3.91Å; L163-V165 PolarHBondContact O-N 3.46Å; V165-I167 HydrophobicContact CG2-CD1 4.23Å
166	P	94.6	Very high	94.6	Very high	95 Å²	95	41 Å²	41	62%	0.617	21%	0.21	S	C	*	.			trans	-67.6	140.5	174.9	28.2	-34.6	0	0	0	111.3
167	I	96.3	Very high	93.9	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.219	C	C	.	.			trans	-113.8	126.8	179.2	-61.3	-61	0	0	0	109.6	I34 K156 E160 L163 V165 L195	I34-I167 HydrophobicContact CB-CG2 4.43Å; I34-I167 HydrophobicContact CD1-CG2 3.8Å; I34-I167 HydrophobicContact CG1-CG2 3.85Å; I34-I167 HydrophobicContact CG2-CD1 4.13Å; I34-I167 HydrophobicContact CG2-CG1 4.17Å; I34-I167 HydrophobicContact CG2-CG2 3.74Å; K156-I167 WeakPolarHBondContact CE-O 3.21Å; K156-I167 PolarHBondContact NZ-O 3.29Å; K156-I167 VanDerWaalsContact NZ-O 3.12Å; E160-I167 HydrophobicContact CG-CB 3.9Å; E160-I167 HydrophobicContact CG-CG1 3.78Å; E160-I167 PolarHBondContact OE1-N 3.29Å; L163-I167 HydrophobicContact CD1-CD1 3.89Å; L163-I167 HydrophobicContact CD1-CG1 4.49Å; V165-I167 HydrophobicContact CG2-CD1 4.23Å; I167-L195 HydrophobicContact CG2-CD2 4.03Å
168	Q	96.1	Very high	93.4	Very high	129 Å²	129	38.7 Å²	38.7	60%	0.603	20%	0.201	S	C	*	.			trans	-123.9	-15.2	-178.4	-64.1	179.1	26.5	0	0	113.1	L195 E196	Q168-L195 CarbonylContact O-C 3.55Å; Q168-L195 WeakPolarHBondContact O-CA 3.1Å; Q168-E196 WeakPolarHBondContact O-CB 3.42Å; Q168-E196 PolarHBondContact O-N 3.02Å
169	K	97.9	Very high	93	Very high	84 Å²	84	42.4 Å²	42.4	37%	0.365	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	142.5	-172.4	-68.4	179.7	175.4	-161	0	110.6	V33 I34 E196 L198	V33-K169 WeakPolarHBondContact CA-O 3.06Å; V33-K169 HydrophobicContact CG1-CB 4.35Å; V33-K169 HydrophobicContact CG2-CB 4.1Å; I34-K169 PolarHBondContact N-O 3.36Å; K169-E196 CarbonylContact C-O 3.51Å; K169-E196 WeakPolarHBondContact CA-O 3.35Å; K169-E196 WeakPolarHBondContact CE-OE2 3.2Å; K169-E196 HydrophobicContact CG-CB 4.35Å; K169-E196 IonicContact NZ-OE2 2.71Å; K169-L198 HydrophobicContact CB-CD1 4.06Å; K169-L198 HydrophobicContact CB-CD2 4.48Å; K169-L198 HydrophobicContact CB-CG 4.16Å; K169-L198 HydrophobicContact CD-CD1 4.2Å; K169-L198 HydrophobicContact CD-CD2 4.07Å; K169-L198 HydrophobicContact CD-CG 4.49Å; K169-L198 HydrophobicContact CG-CD2 4.26Å; K169-L198 HydrophobicContact CG-CG 4.48Å
170	A	98.1	Very high	92.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	162	177.8	0	0	0	0	0	113.5	I34 L36 L195 E196 I197 L198	I34-A170 HydrophobicContact CG1-CB 3.77Å; I34-A170 CarbonylContact O-C 3.56Å; I34-A170 WeakPolarHBondContact O-CA 3.41Å; I34-A170 WeakPolarHBondContact O-CB 3.47Å; L36-A170 HydrophobicContact CD1-CB 3.41Å; L36-A170 VanDerWaalsContact CD1-CB 3.41Å; L36-A170 HydrophobicContact CG-CB 4.17Å; A170-L195 HydrophobicContact CB-CD2 4.44Å; A170-E196 PolarHBondContact N-O 2.93Å; A170-I197 HydrophobicContact CB-CD1 3.96Å; A170-I197 CarbonylContact O-C 3.6Å; A170-I197 WeakPolarHBondContact O-CA 3.47Å; A170-L198 PolarHBondContact O-N 2.8Å
171	V	97.9	Very high	92.5	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	141	159.9	178.8	0	0	0	0	107	V33 I34 L36 R199 I201 V411 Q414 A415 M418	V33-V171 HydrophobicContact CG1-CG2 4.39Å; I34-V171 PolarHBondContact O-N 3Å; L36-V171 PolarHBondContact N-O 3.21Å; V171-R199 WeakPolarHBondContact CA-O 3.32Å; V171-R199 HydrophobicContact CG1-CB 4.01Å; V171-R199 HydrophobicContact CG1-CG 4.47Å; V171-R199 WeakPolarHBondContact CG1-O 3.38Å; V171-R199 HydrophobicContact CG2-CB 4.07Å; V171-I201 HydrophobicContact CG1-CG2 4.11Å; V171-V411 HydrophobicContact CB-CG1 3.94Å; V171-V411 HydrophobicContact CG1-CG1 3.72Å; V171-V411 VanDerWaalsContact O-CG1 3.24Å; V171-V411 WeakPolarHBondContact O-CG1 3.17Å; V171-Q414 HydrophobicContact CG1-CB 4.18Å; V171-Q414 HydrophobicContact CG1-CG 3.88Å; V171-Q414 HydrophobicContact CG2-CG 4.42Å; V171-A415 HydrophobicContact CB-CB 4.21Å; V171-A415 HydrophobicContact CG2-CB 3.97Å; V171-M418 HydrophobicContact CG2-CB 4.4Å; V171-M418 HydrophobicContact CG2-CG 3.96Å
172	I	97.4	Very high	92.5	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	139.3	-177	-167.8	161.9	0	0	0	111.6	L36 L38 L152 T186 I197 R199 V200 I201	L36-I172 HydrophobicContact CB-CB 4.35Å; L36-I172 HydrophobicContact CB-CD1 4.46Å; L36-I172 HydrophobicContact CB-CG1 4.11Å; L36-I172 WeakPolarHBondContact O-CA 3Å; L38-I172 HydrophobicContact CB-CD1 4.27Å; L38-I172 HydrophobicContact CD2-CD1 4.49Å; L152-I172 HydrophobicContact CD1-CD1 3.98Å; L152-I172 HydrophobicContact CD2-CD1 4.07Å; I172-T186 HydrophobicContact CD1-CG2 3.7Å; I172-T186 HydrophobicContact CG1-CG2 4.23Å; I172-I197 HydrophobicContact CB-CD1 4.11Å; I172-I197 HydrophobicContact CG2-CD1 3.97Å; I172-I197 HydrophobicContact CG2-CG1 4.21Å; I172-I197 HydrophobicContact CG2-CG2 3.8Å; I172-R199 PolarHBondContact N-O 3.3Å; I172-R199 VanDerWaalsContact N-O 3.07Å; I172-V200 HydrophobicContact CG2-CG2 3.98Å; I172-V200 WeakPolarHBondContact O-CA 3.39Å; I172-I201 PolarHBondContact O-N 3.22Å
173	S	95.1	Very high	92.5	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	151.9	172.5	60.5	0	0	0	0	112.6	L36 D37 I201	L36-S173 PolarHBondContact O-N 3.43Å; L36-S173 PolarHBondContact O-OG 2.97Å; D37-S173 WeakPolarHBondContact CA-OG 3.12Å; D37-S173 PolarHBondContact OD1-OG 3.48Å; S173-I201 CarbonylContact C-O 3.58Å; S173-I201 WeakPolarHBondContact CA-O 3.24Å
174	V	92.3	Very high	92.8	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	156.9	167.3	-67.2	0	0	0	0	110.4	F178 R183 T186 V200 I201 N202 E203	V174-F178 HydrophobicContact CB-CB 4.48Å; V174-F178 HydrophobicContact CB-CD2 4.05Å; V174-F178 HydrophobicContact CB-CG 4.44Å; V174-F178 HydrophobicContact CG1-CD2 4.19Å; V174-R183 HydrophobicContact CG2-CG 4.17Å; V174-T186 HydrophobicContact CG1-CG2 3.86Å; V174-V200 HydrophobicContact CB-CG1 4.23Å; V174-V200 HydrophobicContact CG1-CG1 3.74Å; V174-V200 HydrophobicContact CG2-CG1 3.45Å; V174-V200 VanDerWaalsContact CG2-CG1 3.45Å; V174-I201 PolarHBondContact N-O 3.18Å; V174-N202 CarbonylContact O-C 3.52Å; V174-N202 VanDerWaalsContact O-CA 3.26Å; V174-N202 WeakPolarHBondContact O-CA 3.43Å; V174-E203 WeakPolarHBondContact O-CG 3.32Å; V174-E203 PolarHBondContact O-N 2.85Å
175	P	87.5	Confident	93	Very high	14 Å²	14	47.4 Å²	47.4	9%	0.091	23%	0.231	C	C	.	.			trans	-59.4	143.1	171.7	-23.7	35.4	0	0	0	110.5	E177 F178 E203	P175-E177 HydrophobicContact CB-CG 4.31Å; P175-E177 VanDerWaalsContact CB-OE2 3.24Å; P175-E177 WeakPolarHBondContact CB-OE2 3.33Å; P175-E177 PolarHBondContact O-N 3.25Å; P175-F178 HydrophobicContact CB-CD1 3.79Å; P175-F178 HydrophobicContact CB-CE1 4.12Å; P175-F178 HydrophobicContact CB-CG 4.41Å; P175-F178 HydrophobicContact CG-CD1 3.72Å; P175-F178 HydrophobicContact CG-CE1 3.58Å; P175-F178 HydrophobicContact CG-CG 4.33Å; P175-F178 HydrophobicContact CG-CZ 4.09Å; P175-F178 WeakPolarHBondContact O-CB 3.4Å; P175-F178 PolarHBondContact O-N 2.67Å; P175-E203 VanDerWaalsContact CD-OE1 3.29Å; P175-E203 WeakPolarHBondContact CD-OE1 3.38Å
176	A	83.3	Confident	93.2	Very high	8 Å²	8	45.6 Å²	45.6	7%	0.066	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-25.9	-177.3	0	0	0	0	0	112.6	F178 R183 N202 P204 M248	A176-F178 VanDerWaalsContact C-N 3.3Å; A176-F178 PolarHBondContact O-N 2.88Å; A176-R183 PolarHBondContact O-NH2 2.81Å; A176-N202 HydrophobicContact CB-CB 3.97Å; A176-P204 HydrophobicContact CB-CG 3.73Å; A176-M248 HydrophobicContact CB-CE 3.56Å; A176-M248 HydrophobicContact CB-SD 3.39Å; A176-M248 WeakPolarHBondContact CB-SD 3.3Å
177	E	81.6	Confident	93.3	Very high	72 Å²	72	42.6 Å²	42.6	34%	0.336	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-8.3	175.3	69.8	-95.1	-132.6	0	0	114.7	P175 D179 M248 K438	P175-E177 HydrophobicContact CB-CG 4.31Å; P175-E177 VanDerWaalsContact CB-OE2 3.24Å; P175-E177 WeakPolarHBondContact CB-OE2 3.33Å; P175-E177 PolarHBondContact O-N 3.25Å; E177-D179 PolarHBondContact O-N 2.93Å; E177-M248 HydrophobicContact CB-CE 4.32Å; E177-M248 WeakPolarHBondContact OE2-CE 3.49Å; E177-K438 HydrophobicContact CB-CB 4.27Å; E177-K438 HydrophobicContact CB-CD 4.35Å; E177-K438 HydrophobicContact CG-CD 4.27Å; E177-K438 WeakPolarHBondContact OE1-CD 3.39Å; E177-K438 IonicContact OE1-NZ 3.47Å; E177-K438 PolarHBondContact OE1-NZ 3.37Å
178	F	86.9	Confident	93.4	Very high	20 Å²	20	48.8 Å²	48.8	9%	0.088	22%	0.224	C	C	.	.			trans	-63.1	125.7	178.7	-92.3	27.7	0	0	0	110.8	K100 I103 V174 P175 A176 Q182 R183	K100-F178 HydrophobicContact CG-CZ 4.13Å; I103-F178 HydrophobicContact CG2-CE2 3.72Å; I103-F178 HydrophobicContact CG2-CZ 3.78Å; V174-F178 HydrophobicContact CB-CB 4.48Å; V174-F178 HydrophobicContact CB-CD2 4.05Å; V174-F178 HydrophobicContact CB-CG 4.44Å; V174-F178 HydrophobicContact CG1-CD2 4.19Å; P175-F178 HydrophobicContact CB-CD1 3.79Å; P175-F178 HydrophobicContact CB-CE1 4.12Å; P175-F178 HydrophobicContact CB-CG 4.41Å; P175-F178 HydrophobicContact CG-CD1 3.72Å; P175-F178 HydrophobicContact CG-CE1 3.58Å; P175-F178 HydrophobicContact CG-CG 4.33Å; P175-F178 HydrophobicContact CG-CZ 4.09Å; P175-F178 WeakPolarHBondContact O-CB 3.4Å; P175-F178 PolarHBondContact O-N 2.67Å; A176-F178 VanDerWaalsContact C-N 3.3Å; A176-F178 PolarHBondContact O-N 2.88Å; F178-Q182 HydrophobicContact CB-CB 4Å; F178-Q182 HydrophobicContact CD1-CB 4.28Å; F178-Q182 HydrophobicContact CD2-CB 3.4Å; F178-Q182 VanDerWaalsContact CE1-NE2 3.28Å; F178-Q182 HydrophobicContact CE2-CB 3.81Å; F178-Q182 HydrophobicContact CG-CB 3.64Å; F178-Q182 HydrophobicContact CG-CG 4.5Å; F178-Q182 HydrophobicContact CZ-CB 4.41Å; F178-R183 HydrophobicContact CB-CG 4.11Å; F178-R183 PolarHBondContact O-NE 2.97Å
179	D	88.1	Confident	93.5	Very high	85 Å²	85	42.7 Å²	42.7	46%	0.455	20%	0.195	S	C	.	.			trans	-70.7	174.8	171.5	74.3	22.5	0	0	0	111.9	E177 R181 Q182 R183	E177-D179 PolarHBondContact O-N 2.93Å; D179-R181 PolarHBondContact O-N 3.46Å; D179-R181 WeakPolarHBondContact OD1-CA 3.35Å; D179-R181 VanDerWaalsContact OD1-CB 3.31Å; D179-R181 WeakPolarHBondContact OD1-CB 3.41Å; D179-R181 PolarHBondContact OD1-N 3.04Å; D179-Q182 PolarHBondContact O-N 3.19Å; D179-Q182 WeakPolarHBondContact OD1-CG 3.38Å; D179-Q182 PolarHBondContact OD1-N 3.01Å; D179-R183 VanDerWaalsContact O-CG 3.28Å; D179-R183 WeakPolarHBondContact O-CG 3.45Å; D179-R183 PolarHBondContact O-N 3.29Å
180	E	90.6	Very high	93.5	Very high	149 Å²	149	38.7 Å²	38.7	70%	0.696	18%	0.178	S	C	*	.	H	α-helix	trans	-60.4	-34.7	-179.4	-172	174.5	-176.7	0	0	112.6	N184	E180-N184 WeakPolarHBondContact O-CB 3.46Å; E180-N184 PolarHBondContact O-N 3.02Å; E180-N184 PolarHBondContact O-ND2 2.87Å; E180-N184 VanDerWaalsContact O-ND2 3.16Å
181	R	93.4	Very high	93.5	Very high	83 Å²	83	43 Å²	43	31%	0.313	20%	0.2	S	C	.	.	H	α-helix	trans	-66.8	-51.9	177.9	-174.9	177	174.8	158.5	-3.9	109.8	G104 S129 D179 R183 N184 Y185	G104-R181 WeakPolarHBondContact O-CD 3.33Å; G104-R181 WeakPolarHBondContact O-CG 3.35Å; G104-R181 PolarHBondContact O-NE 3.22Å; S129-R181 PolarHBondContact OG-NH2 3.04Å; D179-R181 PolarHBondContact O-N 3.46Å; D179-R181 WeakPolarHBondContact OD1-CA 3.35Å; D179-R181 VanDerWaalsContact OD1-CB 3.31Å; D179-R181 WeakPolarHBondContact OD1-CB 3.41Å; D179-R181 PolarHBondContact OD1-N 3.04Å; R181-R183 VanDerWaalsContact C-N 3.29Å; R181-R183 PolarHBondContact O-N 3.14Å; R181-N184 PolarHBondContact O-N 3.03Å; R181-N184 VanDerWaalsContact O-N 3.13Å; R181-Y185 HydrophobicContact CG-CD2 3.78Å; R181-Y185 HydrophobicContact CG-CE2 3.67Å; R181-Y185 VanDerWaalsContact O-CD2 3.25Å; R181-Y185 WeakPolarHBondContact O-CD2 3.47Å; R181-Y185 PolarHBondContact O-N 3.21Å
182	Q	93.5	Very high	93.6	Very high	19 Å²	19	47.2 Å²	47.2	9%	0.089	22%	0.223	C	C	.	.	H	α-helix	trans	-58.9	-41.5	179.1	-60.5	-178.5	-90	0	0	111.7	I103 F178 D179 Y185 T186	I103-Q182 WeakPolarHBondContact O-CG 3.24Å; F178-Q182 HydrophobicContact CB-CB 4Å; F178-Q182 HydrophobicContact CD1-CB 4.28Å; F178-Q182 HydrophobicContact CD2-CB 3.4Å; F178-Q182 VanDerWaalsContact CE1-NE2 3.28Å; F178-Q182 HydrophobicContact CE2-CB 3.81Å; F178-Q182 HydrophobicContact CG-CB 3.64Å; F178-Q182 HydrophobicContact CG-CG 4.5Å; F178-Q182 HydrophobicContact CZ-CB 4.41Å; D179-Q182 PolarHBondContact O-N 3.19Å; D179-Q182 WeakPolarHBondContact OD1-CG 3.38Å; D179-Q182 PolarHBondContact OD1-N 3.01Å; Q182-Y185 PolarHBondContact O-N 2.88Å; Q182-T186 PolarHBondContact O-N 2.83Å; Q182-T186 PolarHBondContact O-OG1 3.45Å
183	R	95.1	Very high	93.6	Very high	53 Å²	53	47.6 Å²	47.6	20%	0.2	23%	0.226	C	C	.	.	H	α-helix	trans	-58.4	-48.6	173.1	-70.6	175.9	-173	-102.8	-5.4	112.3	V174 A176 F178 D179 R181 Y185 T186 V187 N202 E430	V174-R183 HydrophobicContact CG2-CG 4.17Å; A176-R183 PolarHBondContact O-NH2 2.81Å; F178-R183 HydrophobicContact CB-CG 4.11Å; F178-R183 PolarHBondContact O-NE 2.97Å; D179-R183 VanDerWaalsContact O-CG 3.28Å; D179-R183 WeakPolarHBondContact O-CG 3.45Å; D179-R183 PolarHBondContact O-N 3.29Å; R181-R183 VanDerWaalsContact C-N 3.29Å; R181-R183 PolarHBondContact O-N 3.14Å; R183-Y185 VanDerWaalsContact C-N 3.33Å; R183-Y185 PolarHBondContact O-N 3.23Å; R183-T186 WeakPolarHBondContact O-CB 3.2Å; R183-T186 PolarHBondContact O-N 3.45Å; R183-V187 WeakPolarHBondContact O-CG2 3.25Å; R183-V187 PolarHBondContact O-N 3.34Å; R183-N202 PolarHBondContact NH1-OD1 3.35Å; R183-N202 PolarHBondContact NH2-OD1 3.43Å; R183-E430 IonicContact NH1-OE2 3.84Å
184	N	96.6	Very high	93.7	Very high	92 Å²	92	49.7 Å²	49.7	49%	0.492	25%	0.247	S	C	.	.	H	α-helix	trans	-63.3	-37.8	179.8	-72.5	-21.9	0	0	0	112.3	E180 R181 V187 R188	E180-N184 WeakPolarHBondContact O-CB 3.46Å; E180-N184 PolarHBondContact O-N 3.02Å; E180-N184 PolarHBondContact O-ND2 2.87Å; E180-N184 VanDerWaalsContact O-ND2 3.16Å; R181-N184 PolarHBondContact O-N 3.03Å; R181-N184 VanDerWaalsContact O-N 3.13Å; N184-V187 PolarHBondContact O-N 3.36Å; N184-R188 WeakPolarHBondContact O-CB 3.47Å; N184-R188 PolarHBondContact O-N 2.82Å
185	Y	97.4	Very high	94	Very high	54 Å²	54	49.8 Å²	49.8	21%	0.212	25%	0.248	C	C	.	.	H	α-helix	trans	-70.2	-33.9	175.5	-84.9	-101.5	0	0	0	112.5	E145 R181 Q182 R183 R188 A189	E145-Y185 HydrophobicContact CG-CD1 4.39Å; E145-Y185 WeakPolarHBondContact OE1-CE1 3.26Å; E145-Y185 WeakPolarHBondContact OE2-CD1 3.27Å; R181-Y185 HydrophobicContact CG-CD2 3.78Å; R181-Y185 HydrophobicContact CG-CE2 3.67Å; R181-Y185 VanDerWaalsContact O-CD2 3.25Å; R181-Y185 WeakPolarHBondContact O-CD2 3.47Å; R181-Y185 PolarHBondContact O-N 3.21Å; Q182-Y185 PolarHBondContact O-N 2.88Å; R183-Y185 VanDerWaalsContact C-N 3.33Å; R183-Y185 PolarHBondContact O-N 3.23Å; Y185-R188 WeakPolarHBondContact O-CB 3.47Å; Y185-R188 PolarHBondContact O-N 3.5Å; Y185-A189 PolarHBondContact O-N 3.37Å
186	T	97	Very high	94.5	Very high	1 Å²	1	54 Å²	54	1%	0.006	27%	0.266	C	S	.	.	H	α-helix	trans	-63.7	-42.6	170	-60.6	0	0	0	0	111.6	L38 I172 V174 Q182 R183 R188 A189 A190	L38-T186 HydrophobicContact CD2-CG2 4.14Å; I172-T186 HydrophobicContact CD1-CG2 3.7Å; I172-T186 HydrophobicContact CG1-CG2 4.23Å; V174-T186 HydrophobicContact CG1-CG2 3.86Å; Q182-T186 PolarHBondContact O-N 2.83Å; Q182-T186 PolarHBondContact O-OG1 3.45Å; R183-T186 WeakPolarHBondContact O-CB 3.2Å; R183-T186 PolarHBondContact O-N 3.45Å; T186-R188 VanDerWaalsContact C-N 3.31Å; T186-R188 PolarHBondContact O-N 3.31Å; T186-A189 WeakPolarHBondContact O-CB 3.32Å; T186-A189 PolarHBondContact O-N 3.49Å; T186-A190 PolarHBondContact O-N 2.91Å
187	V	98	Very high	95.2	Very high	32 Å²	32	54.9 Å²	54.9	19%	0.194	27%	0.27	C	S	.	.	H	α-helix	trans	-62.4	-40.1	172.9	173.2	0	0	0	0	111	R183 N184 A189 A190 N191 I197 V200	R183-V187 WeakPolarHBondContact O-CG2 3.25Å; R183-V187 PolarHBondContact O-N 3.34Å; N184-V187 PolarHBondContact O-N 3.36Å; V187-A189 VanDerWaalsContact C-N 3.31Å; V187-A189 PolarHBondContact O-N 3.06Å; V187-A190 WeakPolarHBondContact O-CB 3.5Å; V187-A190 PolarHBondContact O-N 2.8Å; V187-A190 VanDerWaalsContact O-N 3.15Å; V187-N191 VanDerWaalsContact O-CG 3.28Å; V187-N191 PolarHBondContact O-N 2.81Å; V187-N191 PolarHBondContact O-ND2 3.47Å; V187-I197 HydrophobicContact CG1-CB 4.21Å; V187-I197 HydrophobicContact CG1-CG1 4.25Å; V187-I197 HydrophobicContact CG2-CB 4.41Å; V187-I197 HydrophobicContact CG2-CG1 4.48Å; V187-I197 HydrophobicContact CG2-CG2 4.23Å; V187-V200 HydrophobicContact CG2-CG2 3.44Å; V187-V200 VanDerWaalsContact CG2-CG2 3.44Å
188	R	98.1	Very high	95.9	Very high	130 Å²	130	53.9 Å²	53.9	49%	0.491	27%	0.267	S	S	.	.	H	α-helix	trans	-59.8	-41.3	174.5	-171.7	179.5	-176.6	-165.3	9.6	111.8	E145 N184 Y185 T186 A190 N191 L192	E145-R188 HydrophobicContact CG-CG 4.3Å; E145-R188 IonicContact OE1-CZ 3.92Å; E145-R188 IonicContact OE1-NE 2.73Å; E145-R188 IonicContact OE1-NH1 3.96Å; E145-R188 PolarHBondContact OE1-NH1 2.74Å; N184-R188 WeakPolarHBondContact O-CB 3.47Å; N184-R188 PolarHBondContact O-N 2.82Å; Y185-R188 WeakPolarHBondContact O-CB 3.47Å; Y185-R188 PolarHBondContact O-N 3.5Å; T186-R188 VanDerWaalsContact C-N 3.31Å; T186-R188 PolarHBondContact O-N 3.31Å; R188-A190 VanDerWaalsContact C-N 3.3Å; R188-A190 PolarHBondContact O-N 2.89Å; R188-N191 PolarHBondContact O-N 3.05Å; R188-L192 WeakPolarHBondContact O-CG 3.41Å; R188-L192 PolarHBondContact O-N 2.79Å
189	A	98.3	Very high	96.2	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-58.4	-43.3	174.8	0	0	0	0	0	111.7	E145 S149 L152 Y185 T186 V187 L192 A193	E145-A189 HydrophobicContact CB-CB 3.93Å; E145-A189 WeakPolarHBondContact O-CA 3.28Å; E145-A189 WeakPolarHBondContact O-CB 3.09Å; S149-A189 WeakPolarHBondContact CA-O 3.2Å; S149-A189 WeakPolarHBondContact CB-O 3.26Å; L152-A189 HydrophobicContact CD1-CB 4.19Å; Y185-A189 PolarHBondContact O-N 3.37Å; T186-A189 WeakPolarHBondContact O-CB 3.32Å; T186-A189 PolarHBondContact O-N 3.49Å; V187-A189 VanDerWaalsContact C-N 3.31Å; V187-A189 PolarHBondContact O-N 3.06Å; A189-L192 PolarHBondContact O-N 3.04Å; A189-A193 PolarHBondContact O-N 3.22Å
190	A	98.2	Very high	96.5	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-66.7	-42.5	176.4	0	0	0	0	0	112.8	L152 T186 V187 R188 L192 A193 G194 L195 I197	L152-A190 VanDerWaalsContact CD1-CA 3.48Å; L152-A190 HydrophobicContact CD1-CB 3.78Å; T186-A190 PolarHBondContact O-N 2.91Å; V187-A190 WeakPolarHBondContact O-CB 3.5Å; V187-A190 PolarHBondContact O-N 2.8Å; V187-A190 VanDerWaalsContact O-N 3.15Å; R188-A190 VanDerWaalsContact C-N 3.3Å; R188-A190 PolarHBondContact O-N 2.89Å; A190-L192 VanDerWaalsContact C-N 3.29Å; A190-L192 PolarHBondContact O-N 3.3Å; A190-A193 CarbonylContact O-C 3.5Å; A190-A193 WeakPolarHBondContact O-CA 3.34Å; A190-A193 WeakPolarHBondContact O-CB 3.47Å; A190-A193 PolarHBondContact O-N 3.23Å; A190-G194 PolarHBondContact O-N 3.49Å; A190-L195 CarbonylContact C-O 3.58Å; A190-L195 HydrophobicContact CB-CB 4.38Å; A190-L195 PolarHBondContact O-N 3.38Å; A190-I197 HydrophobicContact CB-CD1 3.39Å; A190-I197 HydrophobicContact CB-CG1 3.44Å; A190-I197 VanDerWaalsContact CB-CG1 3.44Å
191	N	98.1	Very high	96.5	Very high	90 Å²	90	48 Å²	48	48%	0.481	23%	0.234	S	C	.	.	H	α-helix	trans	-60	-40.6	175.7	-68	-20	0	0	0	111.4	V187 R188 A193 G194 L195	V187-N191 VanDerWaalsContact O-CG 3.28Å; V187-N191 PolarHBondContact O-N 2.81Å; V187-N191 PolarHBondContact O-ND2 3.47Å; R188-N191 PolarHBondContact O-N 3.05Å; N191-A193 PolarHBondContact O-N 3.21Å; N191-G194 PolarHBondContact O-N 3.15Å; N191-L195 PolarHBondContact OD1-O 3.28Å; N191-L195 VanDerWaalsContact OD1-O 3.14Å
192	L	98.3	Very high	96.5	Very high	89 Å²	89	44.5 Å²	44.5	47%	0.466	22%	0.222	S	C	.	.	H	α-helix	trans	-63.4	-25.8	173.9	-72.8	173.1	0	0	0	113.1	E145 S149 R188 A189 A190 G194	E145-L192 HydrophobicContact CG-CD1 4.12Å; S149-L192 VanDerWaalsContact CB-CB 3.48Å; R188-L192 WeakPolarHBondContact O-CG 3.41Å; R188-L192 PolarHBondContact O-N 2.79Å; A189-L192 PolarHBondContact O-N 3.04Å; A190-L192 VanDerWaalsContact C-N 3.29Å; A190-L192 PolarHBondContact O-N 3.3Å; L192-G194 VanDerWaalsContact C-N 3.26Å
193	A	98.1	Very high	96.4	Very high	9 Å²	9	45 Å²	45	7%	0.074	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	1.5	172.6	0	0	0	0	0	113.3	S149 L152 M153 A189 A190 N191 L195	S149-A193 WeakPolarHBondContact O-CB 3.06Å; L152-A193 HydrophobicContact CB-CB 3.82Å; M153-A193 HydrophobicContact CB-CB 4.16Å; A189-A193 PolarHBondContact O-N 3.22Å; A190-A193 CarbonylContact O-C 3.5Å; A190-A193 WeakPolarHBondContact O-CA 3.34Å; A190-A193 WeakPolarHBondContact O-CB 3.47Å; A190-A193 PolarHBondContact O-N 3.23Å; N191-A193 PolarHBondContact O-N 3.21Å; A193-L195 HydrophobicContact CB-CD1 4.33Å
194	G	97.6	Very high	96.3	Very high	43 Å²	43	43 Å²	43	44%	0.443	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.5	37.9	-176.7	0	0	0	0	0	112.9	K156 A190 N191 L192	K156-G194 PolarHBondContact NZ-O 3.29Å; A190-G194 PolarHBondContact O-N 3.49Å; N191-G194 PolarHBondContact O-N 3.15Å; L192-G194 VanDerWaalsContact C-N 3.26Å
195	L	98.4	Very high	96	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.01	20%	0.195	C	C	.	.			trans	-120.3	124.1	175.2	-67.7	164.7	0	0	0	110.1	I34 L36 L152 K156 I167 Q168 A170 A190 N191 A193	I34-L195 HydrophobicContact CD1-CD2 4.34Å; L36-L195 HydrophobicContact CD1-CD1 3.65Å; L152-L195 HydrophobicContact CB-CD1 4.48Å; K156-L195 HydrophobicContact CB-CD1 4.36Å; K156-L195 HydrophobicContact CD-CD2 3.91Å; K156-L195 HydrophobicContact CD-CG 4.08Å; K156-L195 HydrophobicContact CG-CD2 4.25Å; I167-L195 HydrophobicContact CG2-CD2 4.03Å; Q168-L195 CarbonylContact O-C 3.55Å; Q168-L195 WeakPolarHBondContact O-CA 3.1Å; A170-L195 HydrophobicContact CB-CD2 4.44Å; A190-L195 CarbonylContact C-O 3.58Å; A190-L195 HydrophobicContact CB-CB 4.38Å; A190-L195 PolarHBondContact O-N 3.38Å; N191-L195 PolarHBondContact OD1-O 3.28Å; N191-L195 VanDerWaalsContact OD1-O 3.14Å; A193-L195 HydrophobicContact CB-CD1 4.33Å
196	E	98.1	Very high	95.8	Very high	102 Å²	102	36 Å²	36	48%	0.477	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	118	167.1	-177.2	-168.2	165.5	0	0	109.2	Q168 K169 A170 L198	Q168-E196 WeakPolarHBondContact O-CB 3.42Å; Q168-E196 PolarHBondContact O-N 3.02Å; K169-E196 CarbonylContact C-O 3.51Å; K169-E196 WeakPolarHBondContact CA-O 3.35Å; K169-E196 WeakPolarHBondContact CE-OE2 3.2Å; K169-E196 HydrophobicContact CG-CB 4.35Å; K169-E196 IonicContact NZ-OE2 2.71Å; A170-E196 PolarHBondContact N-O 2.93Å; E196-L198 HydrophobicContact CG-CD2 4.41Å; E196-L198 PolarHBondContact O-N 3.34Å
197	I	97.6	Very high	95.6	Very high	28 Å²	28	36 Å²	36	14%	0.144	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	111.8	176.8	-61.2	-53.1	0	0	0	110.2	A170 I172 V187 A190 R199 V200	A170-I197 HydrophobicContact CB-CD1 3.96Å; A170-I197 CarbonylContact O-C 3.6Å; A170-I197 WeakPolarHBondContact O-CA 3.47Å; I172-I197 HydrophobicContact CB-CD1 4.11Å; I172-I197 HydrophobicContact CG2-CD1 3.97Å; I172-I197 HydrophobicContact CG2-CG1 4.21Å; I172-I197 HydrophobicContact CG2-CG2 3.8Å; V187-I197 HydrophobicContact CG1-CB 4.21Å; V187-I197 HydrophobicContact CG1-CG1 4.25Å; V187-I197 HydrophobicContact CG2-CB 4.41Å; V187-I197 HydrophobicContact CG2-CG1 4.48Å; V187-I197 HydrophobicContact CG2-CG2 4.23Å; A190-I197 HydrophobicContact CB-CD1 3.39Å; A190-I197 HydrophobicContact CB-CG1 3.44Å; A190-I197 VanDerWaalsContact CB-CG1 3.44Å; I197-R199 WeakPolarHBondContact CG2-O 3.33Å; I197-V200 HydrophobicContact CG2-CG2 3.91Å
198	L	95.8	Very high	95.2	Very high	51 Å²	51	34.4 Å²	34.4	27%	0.267	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	-30.1	176	-58.6	-175.4	0	0	0	112.2	V33 K169 A170 E196 M418	V33-L198 HydrophobicContact CG1-CD1 3.76Å; V33-L198 HydrophobicContact CG2-CD1 3.87Å; K169-L198 HydrophobicContact CB-CD1 4.06Å; K169-L198 HydrophobicContact CB-CD2 4.48Å; K169-L198 HydrophobicContact CB-CG 4.16Å; K169-L198 HydrophobicContact CD-CD1 4.2Å; K169-L198 HydrophobicContact CD-CD2 4.07Å; K169-L198 HydrophobicContact CD-CG 4.49Å; K169-L198 HydrophobicContact CG-CD2 4.26Å; K169-L198 HydrophobicContact CG-CG 4.48Å; A170-L198 PolarHBondContact O-N 2.8Å; E196-L198 HydrophobicContact CG-CD2 4.41Å; E196-L198 PolarHBondContact O-N 3.34Å; L198-M418 HydrophobicContact CB-CB 4.46Å; L198-M418 HydrophobicContact CD1-CB 3.97Å
199	R	93.8	Very high	94.8	Very high	94 Å²	94	28.2 Å²	28.2	36%	0.355	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	140.1	-178.1	-172	73.2	62.1	167.8	3	110.6	V171 I172 I197 M418	V171-R199 WeakPolarHBondContact CA-O 3.32Å; V171-R199 HydrophobicContact CG1-CB 4.01Å; V171-R199 HydrophobicContact CG1-CG 4.47Å; V171-R199 WeakPolarHBondContact CG1-O 3.38Å; V171-R199 HydrophobicContact CG2-CB 4.07Å; I172-R199 PolarHBondContact N-O 3.3Å; I172-R199 VanDerWaalsContact N-O 3.07Å; I197-R199 WeakPolarHBondContact CG2-O 3.33Å; R199-M418 HydrophobicContact CB-CG 4.41Å; R199-M418 HydrophobicContact CB-SD 4.45Å
200	V	93.8	Very high	94.3	Very high	33 Å²	33	28.9 Å²	28.9	20%	0.2	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	131.2	163.1	-178.5	0	0	0	0	107.3	I172 V174 V187 I197	I172-V200 HydrophobicContact CG2-CG2 3.98Å; I172-V200 WeakPolarHBondContact O-CA 3.39Å; V174-V200 HydrophobicContact CB-CG1 4.23Å; V174-V200 HydrophobicContact CG1-CG1 3.74Å; V174-V200 HydrophobicContact CG2-CG1 3.45Å; V174-V200 VanDerWaalsContact CG2-CG1 3.45Å; V187-V200 HydrophobicContact CG2-CG2 3.44Å; V187-V200 VanDerWaalsContact CG2-CG2 3.44Å; I197-V200 HydrophobicContact CG2-CG2 3.91Å
201	I	92.5	Very high	93.6	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.01	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	147.8	179.2	-170.7	170.9	0	0	0	109.7	V171 I172 S173 V174 T205 A206 M209 V411 Q414 A428	V171-I201 HydrophobicContact CG1-CG2 4.11Å; I172-I201 PolarHBondContact O-N 3.22Å; S173-I201 CarbonylContact C-O 3.58Å; S173-I201 WeakPolarHBondContact CA-O 3.24Å; V174-I201 PolarHBondContact N-O 3.18Å; I201-T205 HydrophobicContact CD1-CG2 4Å; I201-T205 HydrophobicContact CG1-CG2 4.08Å; I201-A206 HydrophobicContact CD1-CB 4.28Å; I201-A206 HydrophobicContact CG2-CB 4.28Å; I201-M209 HydrophobicContact CD1-SD 3.57Å; I201-M209 VanDerWaalsContact CD1-SD 3.57Å; I201-V411 HydrophobicContact CG2-CG1 4.34Å; I201-V411 HydrophobicContact CG2-CG2 3.9Å; I201-Q414 HydrophobicContact CD1-CB 4.34Å; I201-Q414 HydrophobicContact CD1-CG 4.29Å; I201-A428 HydrophobicContact CD1-CB 4.02Å
202	N	91.8	Very high	92.6	Very high	10 Å²	10	26.3 Å²	26.3	5%	0.053	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	141	173.4	-59.9	-24.9	0	0	0	110.7	V174 A176 R183 P204 T205 A206 E430	V174-N202 CarbonylContact O-C 3.52Å; V174-N202 VanDerWaalsContact O-CA 3.26Å; V174-N202 WeakPolarHBondContact O-CA 3.43Å; A176-N202 HydrophobicContact CB-CB 3.97Å; R183-N202 PolarHBondContact NH1-OD1 3.35Å; R183-N202 PolarHBondContact NH2-OD1 3.43Å; N202-P204 HydrophobicContact CB-CG 4.21Å; N202-T205 WeakPolarHBondContact O-CB 3.4Å; N202-T205 PolarHBondContact O-N 3.46Å; N202-T205 VanDerWaalsContact O-N 3.08Å; N202-A206 PolarHBondContact O-N 2.99Å; N202-E430 WeakPolarHBondContact CA-OE1 3.35Å; N202-E430 WeakPolarHBondContact CB-OE1 3.17Å; N202-E430 PolarHBondContact N-OE1 3.14Å; N202-E430 PolarHBondContact N-OE2 2.93Å; N202-E430 VanDerWaalsContact ND2-CD 3.3Å; N202-E430 PolarHBondContact ND2-OE1 2.95Å; N202-E430 PolarHBondContact ND2-OE2 3.28Å; N202-E430 PolarHBondContact OD1-OE2 3.15Å; N202-E430 VanDerWaalsContact OD1-OE2 3.08Å
203	E	92.3	Very high	91.1	Very high	29 Å²	29	22.3 Å²	22.3	14%	0.136	13%	0.127	C	C	.	.	H	α-helix	trans	-50	-50.4	174.2	-72.2	162.5	-165.7	0	0	113.3	K100 V174 P175 T205 A206 A207 V407	K100-E203 IonicContact NZ-OE1 2.71Å; K100-E203 PolarHBondContact NZ-OE1 2.89Å; V174-E203 WeakPolarHBondContact O-CG 3.32Å; V174-E203 PolarHBondContact O-N 2.85Å; P175-E203 VanDerWaalsContact CD-OE1 3.29Å; P175-E203 WeakPolarHBondContact CD-OE1 3.38Å; E203-T205 VanDerWaalsContact C-N 3.31Å; E203-T205 PolarHBondContact O-N 3.5Å; E203-A206 PolarHBondContact O-N 2.91Å; E203-A207 PolarHBondContact O-N 3.42Å; E203-V407 HydrophobicContact CB-CG1 4.33Å; E203-V407 HydrophobicContact CB-CG2 4.39Å; E203-V407 HydrophobicContact CG-CG1 4Å
204	P	91.8	Very high	89.5	Confident	11 Å²	11	22.4 Å²	22.4	7%	0.071	13%	0.125	C	C	.	.	H	α-helix	trans	-64.3	-33.9	177.7	24.4	-35.9	0	0	0	113	A176 N202 A207 A208 V223 L236	A176-P204 HydrophobicContact CB-CG 3.73Å; N202-P204 HydrophobicContact CB-CG 4.21Å; P204-A207 PolarHBondContact O-N 3.42Å; P204-A208 PolarHBondContact O-N 3.15Å; P204-V223 HydrophobicContact CB-CB 4.09Å; P204-V223 HydrophobicContact CB-CG1 4.14Å; P204-V223 HydrophobicContact CB-CG2 4.11Å; P204-L236 HydrophobicContact CB-CD1 4.31Å; P204-L236 HydrophobicContact CB-CD2 4.42Å; P204-L236 WeakPolarHBondContact O-CD1 3.33Å
205	T	91.8	Very high	87.9	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-66	-45.5	174.9	-52.2	0	0	0	0	110.8	I201 N202 E203 A208 M209 F243 A428 E430	I201-T205 HydrophobicContact CD1-CG2 4Å; I201-T205 HydrophobicContact CG1-CG2 4.08Å; N202-T205 WeakPolarHBondContact O-CB 3.4Å; N202-T205 PolarHBondContact O-N 3.46Å; N202-T205 VanDerWaalsContact O-N 3.08Å; E203-T205 VanDerWaalsContact C-N 3.31Å; E203-T205 PolarHBondContact O-N 3.5Å; T205-A208 PolarHBondContact O-N 3.36Å; T205-M209 WeakPolarHBondContact O-CG 3.34Å; T205-M209 PolarHBondContact O-N 3.14Å; T205-F243 HydrophobicContact CG2-CB 3.66Å; T205-F243 HydrophobicContact CG2-CD2 3.82Å; T205-F243 HydrophobicContact CG2-CG 3.77Å; T205-A428 HydrophobicContact CG2-CB 4.02Å; T205-E430 WeakPolarHBondContact CB-OE1 3.41Å; T205-E430 HydrophobicContact CG2-CG 4.48Å; T205-E430 PolarHBondContact OG1-OE1 3.22Å
206	A	92.8	Very high	86.5	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.4	-47.4	175.8	0	0	0	0	0	110.7	I201 N202 E203 A208 M209 A210 V407 G410 V411	I201-A206 HydrophobicContact CD1-CB 4.28Å; I201-A206 HydrophobicContact CG2-CB 4.28Å; N202-A206 PolarHBondContact O-N 2.99Å; E203-A206 PolarHBondContact O-N 2.91Å; A206-A208 PolarHBondContact O-N 3.45Å; A206-M209 WeakPolarHBondContact O-CB 3.24Å; A206-M209 PolarHBondContact O-N 3Å; A206-M209 VanDerWaalsContact O-N 3.09Å; A206-A210 PolarHBondContact O-N 3.37Å; A206-V407 HydrophobicContact CB-CG1 4.32Å; A206-G410 WeakPolarHBondContact O-CA 3.39Å; A206-V411 HydrophobicContact CB-CG2 3.74Å
207	A	92.8	Very high	85.7	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-54.3	-52.2	174.2	0	0	0	0	0	111.3	E203 P204 M209 A210 Y211 V223 V374 V376 A406	E203-A207 PolarHBondContact O-N 3.42Å; P204-A207 PolarHBondContact O-N 3.42Å; A207-M209 PolarHBondContact O-N 2.59Å; A207-A210 WeakPolarHBondContact O-CB 3.36Å; A207-A210 PolarHBondContact O-N 2.64Å; A207-Y211 VanDerWaalsContact O-CD2 3.29Å; A207-Y211 WeakPolarHBondContact O-CD2 3.36Å; A207-Y211 PolarHBondContact O-N 2.83Å; A207-V223 HydrophobicContact CB-CG1 4.22Å; A207-V374 HydrophobicContact CB-CG1 4.39Å; A207-V376 HydrophobicContact CB-CG2 3.5Å; A207-A406 HydrophobicContact CB-CB 4.43Å
208	A	90.3	Very high	85.1	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-57.8	-35.2	177.7	0	0	0	0	0	113.5	P204 T205 A206 L213 V221 L236 F243	P204-A208 PolarHBondContact O-N 3.15Å; T205-A208 PolarHBondContact O-N 3.36Å; A206-A208 PolarHBondContact O-N 3.45Å; A208-L213 WeakPolarHBondContact O-CB 3.29Å; A208-V221 HydrophobicContact CB-CG1 4.2Å; A208-L236 HydrophobicContact CB-CD1 3.87Å; A208-F243 HydrophobicContact CB-CE1 3.98Å
209	M	88.4	Confident	84.8	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-65.2	-40.3	174.5	-72	-178.8	72	0	0	112.9	I201 T205 A206 A207 Y211 G212 H214 F243 I413 Q414 I417 A428	I201-M209 HydrophobicContact CD1-SD 3.57Å; I201-M209 VanDerWaalsContact CD1-SD 3.57Å; T205-M209 WeakPolarHBondContact O-CG 3.34Å; T205-M209 PolarHBondContact O-N 3.14Å; A206-M209 WeakPolarHBondContact O-CB 3.24Å; A206-M209 PolarHBondContact O-N 3Å; A206-M209 VanDerWaalsContact O-N 3.09Å; A207-M209 PolarHBondContact O-N 2.59Å; M209-Y211 VanDerWaalsContact C-N 3.26Å; M209-Y211 PolarHBondContact O-N 2.84Å; M209-G212 PolarHBondContact O-N 2.9Å; M209-H214 PolarHBondContact O-ND1 3.2Å; M209-F243 HydrophobicContact CG-CE2 4.13Å; M209-I413 HydrophobicContact CE-CB 4.35Å; M209-I413 HydrophobicContact CE-CG2 3.85Å; M209-Q414 HydrophobicContact CE-CB 4.1Å; M209-Q414 HydrophobicContact SD-CB 4.37Å; M209-I417 HydrophobicContact CE-CD1 3.85Å; M209-A428 HydrophobicContact CE-CB 4.28Å; M209-A428 HydrophobicContact CG-CB 4.43Å; M209-A428 HydrophobicContact SD-CB 3.45Å; M209-A428 WeakPolarHBondContact SD-CB 3.4Å
210	A	88.9	Confident	84.8	Confident	14 Å²	14	30.8 Å²	30.8	12%	0.116	16%	0.163	C	C	.	.	H	α-helix	trans	-60.6	-35.9	-178.7	0	0	0	0	0	112.6	A206 A207 G212 V401 A406 T409	A206-A210 PolarHBondContact O-N 3.37Å; A207-A210 WeakPolarHBondContact O-CB 3.36Å; A207-A210 PolarHBondContact O-N 2.64Å; A210-G212 PolarHBondContact O-N 2.98Å; A210-G212 VanDerWaalsContact O-N 3.16Å; A210-V401 HydrophobicContact CB-CG1 4.27Å; A210-V401 HydrophobicContact CB-CG2 4.47Å; A210-V401 WeakPolarHBondContact O-CG2 3.4Å; A210-A406 WeakPolarHBondContact CB-O 3.41Å; A210-T409 HydrophobicContact CB-CG2 3.76Å
211	Y	83.6	Confident	84.9	Confident	15 Å²	15	29.2 Å²	29.2	6%	0.059	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	7.1	176.3	-75.7	-94.4	0	0	0	113.7	A207 M209 L213 V374 L375 N398 S400 V401 A406	A207-Y211 VanDerWaalsContact O-CD2 3.29Å; A207-Y211 WeakPolarHBondContact O-CD2 3.36Å; A207-Y211 PolarHBondContact O-N 2.83Å; M209-Y211 VanDerWaalsContact C-N 3.26Å; M209-Y211 PolarHBondContact O-N 2.84Å; Y211-L213 PolarHBondContact O-N 3.45Å; Y211-V374 HydrophobicContact CD1-CG2 4.3Å; Y211-V374 HydrophobicContact CD2-CB 4.26Å; Y211-V374 HydrophobicContact CD2-CG1 3.39Å; Y211-V374 HydrophobicContact CD2-CG2 3.86Å; Y211-V374 HydrophobicContact CE2-CB 4.31Å; Y211-V374 HydrophobicContact CE2-CG1 3.18Å; Y211-V374 HydrophobicContact CE2-CG2 4.36Å; Y211-V374 HydrophobicContact CG-CG1 4.16Å; Y211-V374 HydrophobicContact CG-CG2 3.82Å; Y211-L375 PolarHBondContact OH-O 3.48Å; Y211-N398 HydrophobicContact CD1-CB 3.95Å; Y211-N398 VanDerWaalsContact CD1-CG 3.42Å; Y211-N398 VanDerWaalsContact CD1-OD1 3.28Å; Y211-N398 WeakPolarHBondContact CD1-OD1 3.4Å; Y211-N398 HydrophobicContact CE1-CB 4.14Å; Y211-N398 WeakPolarHBondContact CE1-O 3.5Å; Y211-S400 WeakPolarHBondContact CD1-OG 3.5Å; Y211-V401 HydrophobicContact CD1-CB 4.16Å; Y211-V401 HydrophobicContact CD1-CG2 3.75Å; Y211-V401 HydrophobicContact CD2-CB 4.13Å; Y211-V401 HydrophobicContact CD2-CG2 3.94Å; Y211-V401 HydrophobicContact CE1-CB 3.78Å; Y211-V401 HydrophobicContact CE1-CG2 3.91Å; Y211-V401 HydrophobicContact CE2-CB 3.71Å; Y211-V401 HydrophobicContact CE2-CG1 4.41Å; Y211-V401 HydrophobicContact CE2-CG2 4.05Å; Y211-V401 HydrophobicContact CG-CB 4.35Å; Y211-V401 HydrophobicContact CG-CG2 3.8Å; Y211-V401 PolarHBondContact OH-O 3.45Å; Y211-A406 HydrophobicContact CE2-CB 3.91Å
212	G	75.8	Confident	85.1	Confident	21 Å²	21	29.1 Å²	29.1	22%	0.216	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.6	9.2	177.3	0	0	0	0	0	114.1	M209 A210 H214 K215	M209-G212 PolarHBondContact O-N 2.9Å; A210-G212 PolarHBondContact O-N 2.98Å; A210-G212 VanDerWaalsContact O-N 3.16Å; G212-H214 PolarHBondContact O-N 2.8Å; G212-K215 WeakPolarHBondContact O-CB 3.29Å; G212-K215 PolarHBondContact O-N 2.77Å
213	L	67.6	Low	85.3	Confident	5 Å²	5	28.8 Å²	28.8	3%	0.026	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-66.7	-15.4	-174.3	-55.4	-175.3	0	0	0	113	A208 Y211 K215 V218 V221 K238 E372 V374	A208-L213 WeakPolarHBondContact O-CB 3.29Å; Y211-L213 PolarHBondContact O-N 3.45Å; L213-K215 PolarHBondContact O-N 3.45Å; L213-V218 HydrophobicContact CB-CG1 4.49Å; L213-V218 HydrophobicContact CD2-CG2 4.45Å; L213-V221 HydrophobicContact CD1-CB 4.36Å; L213-V221 HydrophobicContact CD1-CG1 3.6Å; L213-V221 HydrophobicContact CD1-CG2 3.75Å; L213-K238 WeakPolarHBondContact O-CD 3.25Å; L213-K238 PolarHBondContact O-NZ 3Å; L213-E372 HydrophobicContact CD1-CB 3.82Å; L213-E372 HydrophobicContact CD1-CG 4.28Å; L213-E372 HydrophobicContact CD2-CB 4.26Å; L213-E372 HydrophobicContact CD2-CG 3.79Å; L213-V374 HydrophobicContact CD1-CG2 3.67Å
214	H	64.2	Low	85.5	Confident	10 Å²	10	27.4 Å²	27.4	5%	0.046	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-65	-20.9	169.9	67.6	-82.8	0	0	0	113.2	M209 G212 K238 F243 W422 V426	M209-H214 PolarHBondContact O-ND1 3.2Å; G212-H214 PolarHBondContact O-N 2.8Å; H214-K238 VanDerWaalsContact C-NZ 3.27Å; H214-K238 WeakPolarHBondContact O-CE 3.32Å; H214-K238 PolarHBondContact O-NZ 3.26Å; H214-F243 HydrophobicContact CB-CE2 4.34Å; H214-F243 HydrophobicContact CB-CZ 4.25Å; H214-W422 AromaticContact NE2-CZ2 3.77Å; H214-V426 HydrophobicContact CB-CG1 4.08Å
215	K	64.1	Low	85.6	Confident	122 Å²	122	28.6 Å²	28.6	53%	0.53	15%	0.151	S	C	.	.	G	3₁₀ helix	trans	-99.1	-12.3	-177	-57.3	-176.3	179.7	177.3	0	115.1	G212 L213 W422 L424	G212-K215 WeakPolarHBondContact O-CB 3.29Å; G212-K215 PolarHBondContact O-N 2.77Å; L213-K215 PolarHBondContact O-N 3.45Å; K215-W422 VanDerWaalsContact NZ-CH2 3.31Å; K215-L424 HydrophobicContact CD-CD1 4.25Å; K215-L424 HydrophobicContact CG-CD1 4.12Å
216	V	68.5	Low	85.6	Confident	81 Å²	81	28.6 Å²	28.6	49%	0.491	15%	0.151	S	C	.	.	S	Bend	trans	-105.9	153.8	-175.5	-166.6	0	0	0	0	109.5	V218 K238	V216-V218 HydrophobicContact CB-CG2 3.81Å; V216-V218 HydrophobicContact CG1-CG2 3.85Å; V216-V218 PolarHBondContact O-N 3.09Å; V216-K238 PolarHBondContact O-NZ 3.11Å
217	D	80.8	Confident	85.4	Confident	149 Å²	149	29.4 Å²	29.4	80%	0.797	16%	0.159	S	C	*	.	S	Bend	trans	-71	69.5	170.8	-80.8	-22.6	0	0	0	110.7
218	V	85.3	Confident	84.8	Confident	7 Å²	7	31 Å²	31	4%	0.042	18%	0.176	C	C	.	.			trans	-115.2	126.7	178.3	170.9	0	0	0	0	106.7	L213 V216 V221 K238 D371 E372	L213-V218 HydrophobicContact CB-CG1 4.49Å; L213-V218 HydrophobicContact CD2-CG2 4.45Å; V216-V218 HydrophobicContact CB-CG2 3.81Å; V216-V218 HydrophobicContact CG1-CG2 3.85Å; V216-V218 PolarHBondContact O-N 3.09Å; V218-V221 HydrophobicContact CG1-CG2 3.44Å; V218-V221 VanDerWaalsContact CG1-CG2 3.44Å; V218-K238 WeakPolarHBondContact O-CD 3.3Å; V218-D371 HydrophobicContact CG1-CB 3.92Å; V218-E372 HydrophobicContact CG1-CB 4Å; V218-E372 HydrophobicContact CG1-CG 3.83Å; V218-E372 HydrophobicContact CG2-CG 3.78Å
219	F	90.7	Very high	84.2	Confident	112 Å²	112	32.1 Å²	32.1	49%	0.491	19%	0.187	S	C	.	.			trans	-109.5	-41.2	-176.6	-64.5	-84.9	0	0	0	111.9	N237 K238 D371	F219-N237 CarbonylContact O-C 3.51Å; F219-N237 VanDerWaalsContact O-CA 3.22Å; F219-N237 WeakPolarHBondContact O-CA 3.49Å; F219-N237 PolarHBondContact O-ND2 3.33Å; F219-K238 PolarHBondContact O-N 3.15Å; F219-D371 WeakPolarHBondContact CA-OD2 3.14Å; F219-D371 WeakPolarHBondContact CB-OD2 3.41Å; F219-D371 PolarHBondContact N-OD2 2.81Å
220	N	94	Very high	84.1	Confident	25 Å²	25	34 Å²	34	13%	0.134	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	112.4	-177	-61.7	-43.1	0	0	0	110.1	L236 N237 L365 D369 D371 E372	N220-L236 WeakPolarHBondContact CA-O 3.46Å; N220-N237 PolarHBondContact OD1-ND2 3.06Å; N220-L365 HydrophobicContact CB-CD1 4.03Å; N220-D369 VanDerWaalsContact CB-O 3.32Å; N220-D369 WeakPolarHBondContact CB-O 3.25Å; N220-D369 PolarHBondContact ND2-O 2.94Å; N220-D371 PolarHBondContact N-OD2 3.41Å; N220-D371 WeakPolarHBondContact O-CB 3.29Å; N220-D371 PolarHBondContact O-N 3.25Å; N220-E372 PolarHBondContact O-N 3.04Å
221	V	94.8	Very high	84.3	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	125.1	179.6	-175.9	0	0	0	0	108.9	A208 L213 V218 V223 L236 E372 V374	A208-V221 HydrophobicContact CB-CG1 4.2Å; L213-V221 HydrophobicContact CD1-CB 4.36Å; L213-V221 HydrophobicContact CD1-CG1 3.6Å; L213-V221 HydrophobicContact CD1-CG2 3.75Å; V218-V221 HydrophobicContact CG1-CG2 3.44Å; V218-V221 VanDerWaalsContact CG1-CG2 3.44Å; V221-V223 HydrophobicContact CG1-CG2 4.22Å; V221-L236 HydrophobicContact CB-CB 4.34Å; V221-L236 PolarHBondContact N-O 3.4Å; V221-L236 PolarHBondContact O-N 2.84Å; V221-E372 WeakPolarHBondContact CA-O 3.35Å; V221-E372 HydrophobicContact CG2-CB 4.47Å; V221-V374 HydrophobicContact CG1-CG2 4.09Å
222	L	96.4	Very high	84.7	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	121.2	169.1	-171.3	77.5	0	0	0	109.1	V224 V233 L235 V356 V359 V370 E372 I373 V374 F393	L222-V224 HydrophobicContact CD2-CG2 3.95Å; L222-V224 HydrophobicContact CG-CG2 4.18Å; L222-V233 HydrophobicContact CD1-CG1 3.67Å; L222-V233 HydrophobicContact CG-CG1 4.19Å; L222-L235 HydrophobicContact CD1-CB 4.46Å; L222-L235 HydrophobicContact CD1-CD1 4.37Å; L222-V356 HydrophobicContact CD2-CG1 4.05Å; L222-V359 HydrophobicContact CD1-CG2 3.66Å; L222-V370 HydrophobicContact CB-CG1 3.88Å; L222-E372 PolarHBondContact N-O 3.02Å; L222-I373 HydrophobicContact CB-CG1 4.45Å; L222-I373 HydrophobicContact CD2-CG2 4.36Å; L222-I373 CarbonylContact O-C 3.58Å; L222-I373 WeakPolarHBondContact O-CA 3.11Å; L222-V374 PolarHBondContact O-N 3.15Å; L222-F393 HydrophobicContact CD2-CE1 4.34Å; L222-F393 HydrophobicContact CD2-CE2 3.65Å; L222-F393 HydrophobicContact CD2-CZ 3.38Å
223	V	96.3	Very high	85.7	Confident	3 Å²	3	33 Å²	33	2%	0.018	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	122.5	172.2	-174.8	0	0	0	0	108.3	P204 A207 V221 V233 S234 L236 V374 V376	P204-V223 HydrophobicContact CB-CB 4.09Å; P204-V223 HydrophobicContact CB-CG1 4.14Å; P204-V223 HydrophobicContact CB-CG2 4.11Å; A207-V223 HydrophobicContact CB-CG1 4.22Å; V221-V223 HydrophobicContact CG1-CG2 4.22Å; V223-V233 WeakPolarHBondContact O-CA 3.29Å; V223-S234 PolarHBondContact N-O 3.4Å; V223-S234 PolarHBondContact O-N 2.91Å; V223-L236 HydrophobicContact CG2-CD1 3.85Å; V223-L236 HydrophobicContact CG2-CG 4.34Å; V223-V374 WeakPolarHBondContact CA-O 3.47Å; V223-V374 HydrophobicContact CG1-CG1 4.5Å; V223-V374 HydrophobicContact CG2-CB 4.47Å; V223-V376 HydrophobicContact CG1-CG2 3.81Å
224	V	96.4	Very high	87.1	Confident	1 Å²	1	33 Å²	33	1%	0.006	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	103.2	175	-177.2	0	0	0	0	108	L222 L231 V233 V356 I373 V374 L375 V376 I389	L222-V224 HydrophobicContact CD2-CG2 3.95Å; L222-V224 HydrophobicContact CG-CG2 4.18Å; V224-L231 HydrophobicContact CG1-CD1 3.94Å; V224-V233 HydrophobicContact CG1-CG2 4.46Å; V224-V233 HydrophobicContact CG2-CG1 4.36Å; V224-V356 HydrophobicContact CG2-CG2 4.4Å; V224-I373 HydrophobicContact CG2-CG2 4.5Å; V224-V374 PolarHBondContact N-O 3.2Å; V224-L375 HydrophobicContact CB-CD2 3.93Å; V224-L375 HydrophobicContact CG2-CD2 4.47Å; V224-L375 WeakPolarHBondContact O-CA 3.27Å; V224-V376 PolarHBondContact O-N 3.09Å; V224-I389 HydrophobicContact CG1-CD1 4.24Å
225	D	93.4	Very high	88.5	Confident	36 Å²	36	32.5 Å²	32.5	19%	0.193	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	109.2	176.3	-172.4	-9.6	0	0	0	109.9	L231 D232 V376	D225-L231 CarbonylContact O-C 3.53Å; D225-L231 WeakPolarHBondContact O-CA 3.43Å; D225-D232 HydrophobicContact CB-CB 4.31Å; D225-D232 PolarHBondContact N-O 2.79Å; D225-D232 PolarHBondContact O-N 2.89Å; D225-V376 CarbonylContact C-O 3.57Å; D225-V376 WeakPolarHBondContact CA-O 3.24Å; D225-V376 HydrophobicContact CB-CB 3.92Å; D225-V376 HydrophobicContact CB-CG1 4.28Å
226	L	92.8	Very high	89.9	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	98.3	175.4	-174.8	70.7	0	0	0	109.6	L231 F259 I352 V376 G377 S379 T380 I385	L226-L231 HydrophobicContact CB-CD1 4.16Å; L226-L231 HydrophobicContact CD1-CB 3.65Å; L226-L231 HydrophobicContact CD1-CD1 3.95Å; L226-L231 HydrophobicContact CD1-CG 4.26Å; L226-F259 HydrophobicContact CD2-CE2 4.03Å; L226-F259 HydrophobicContact CD2-CZ 4.14Å; L226-I352 HydrophobicContact CD2-CD1 3.99Å; L226-V376 PolarHBondContact N-O 3.03Å; L226-G377 CarbonylContact O-C 3.33Å; L226-S379 VanDerWaalsContact O-CB 3.29Å; L226-S379 WeakPolarHBondContact O-CB 3.26Å; L226-S379 PolarHBondContact O-N 2.72Å; L226-T380 HydrophobicContact CB-CG2 3.75Å; L226-I385 HydrophobicContact CD2-CD1 3.39Å
227	G	87.9	Confident	91	Very high	16 Å²	16	23.5 Å²	23.5	17%	0.165	14%	0.14	C	C	.	.			trans	-86.8	-156.4	179.1	0	0	0	0	0	113.6	T230 G256 S379	G227-T230 PolarHBondContact N-O 2.9Å; G227-G256 PolarHBondContact O-N 3.11Å; G227-S379 PolarHBondContact O-OG 2.77Å
228	G	81.6	Confident	91.3	Very high	35 Å²	35	17.1 Å²	17.1	36%	0.361	11%	0.105	S	C	.	.	S	Bend	trans	-73.8	-22.7	178.5	0	0	0	0	0	114.4	G255 G256 Q257	G228-G255 CarbonylContact O-C 3.5Å; G228-G256 PolarHBondContact O-N 3.12Å; G228-G256 VanDerWaalsContact O-N 3.09Å; G228-Q257 VanDerWaalsContact O-CB 3.31Å; G228-Q257 WeakPolarHBondContact O-CB 3.42Å; G228-Q257 WeakPolarHBondContact O-CG 3.33Å; G228-Q257 PolarHBondContact O-N 2.89Å
229	G	77.8	Confident	91.1	Very high	22 Å²	22	21.9 Å²	21.9	23%	0.227	13%	0.127	C	C	.	.	S	Bend	trans	-150	-0.1	-176.5	0	0	0	0	0	115.8	N252	G229-N252 CarbonylContact O-C 3.54Å
230	T	85.6	Confident	90.4	Very high	40 Å²	40	19.6 Å²	19.6	25%	0.245	14%	0.135	C	C	.	.			trans	-137.1	150.5	178.1	60.8	0	0	0	0	110.3	G227 N251 L254	G227-T230 PolarHBondContact N-O 2.9Å; T230-N251 WeakPolarHBondContact CA-O 3.16Å; T230-L254 CarbonylContact C-O 3.44Å; T230-L254 VanDerWaalsContact CA-O 3.32Å; T230-L254 WeakPolarHBondContact CA-O 3.31Å; T230-L254 PolarHBondContact N-O 3.38Å
231	L	92.8	Very high	89.3	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	123.2	169.3	169.3	60.4	0	0	0	108.2	V224 D225 L226 V233 G250 N251 L254 I352 P355	V224-L231 HydrophobicContact CG1-CD1 3.94Å; D225-L231 CarbonylContact O-C 3.53Å; D225-L231 WeakPolarHBondContact O-CA 3.43Å; L226-L231 HydrophobicContact CB-CD1 4.16Å; L226-L231 HydrophobicContact CD1-CB 3.65Å; L226-L231 HydrophobicContact CD1-CD1 3.95Å; L226-L231 HydrophobicContact CD1-CG 4.26Å; L231-V233 HydrophobicContact CD1-CG2 4.06Å; L231-V233 HydrophobicContact CG-CG2 4.34Å; L231-G250 CarbonylContact O-C 3.54Å; L231-G250 WeakPolarHBondContact O-CA 3.3Å; L231-N251 HydrophobicContact CB-CB 4.43Å; L231-N251 PolarHBondContact N-O 3.28Å; L231-N251 PolarHBondContact O-N 2.96Å; L231-L254 HydrophobicContact CB-CD2 4.48Å; L231-L254 HydrophobicContact CD2-CD2 3.83Å; L231-L254 PolarHBondContact N-O 3.29Å; L231-L254 VanDerWaalsContact N-O 3.12Å; L231-I352 HydrophobicContact CD1-CG2 4.31Å; L231-I352 HydrophobicContact CD2-CB 4.13Å; L231-I352 HydrophobicContact CD2-CG1 4.19Å; L231-I352 HydrophobicContact CD2-CG2 3.99Å; L231-P355 HydrophobicContact CD2-CG 3.52Å; L231-P355 HydrophobicContact CG-CG 4.1Å
232	D	93	Very high	88.5	Confident	27 Å²	27	22.8 Å²	22.8	14%	0.144	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	129.9	176.8	-64.5	-39.1	0	0	0	110.3	D225 K438	D225-D232 HydrophobicContact CB-CB 4.31Å; D225-D232 PolarHBondContact N-O 2.79Å; D225-D232 PolarHBondContact O-N 2.89Å; D232-K438 VanDerWaalsContact CG-NZ 3.25Å; D232-K438 WeakPolarHBondContact OD1-CE 3.47Å; D232-K438 IonicContact OD1-NZ 3.08Å; D232-K438 PolarHBondContact OD1-NZ 2.81Å; D232-K438 IonicContact OD2-NZ 3.43Å; D232-K438 PolarHBondContact OD2-NZ 3.24Å
233	V	96.3	Very high	87.9	Confident	1 Å²	1	22.9 Å²	22.9	1%	0.006	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	126.1	179.4	-171.9	0	0	0	0	108.6	L222 V223 V224 L231 M248 A249 P355 V356 V359	L222-V233 HydrophobicContact CD1-CG1 3.67Å; L222-V233 HydrophobicContact CG-CG1 4.19Å; V223-V233 WeakPolarHBondContact O-CA 3.29Å; V224-V233 HydrophobicContact CG1-CG2 4.46Å; V224-V233 HydrophobicContact CG2-CG1 4.36Å; L231-V233 HydrophobicContact CD1-CG2 4.06Å; L231-V233 HydrophobicContact CG-CG2 4.34Å; V233-M248 WeakPolarHBondContact O-CA 3.31Å; V233-A249 PolarHBondContact N-O 2.88Å; V233-A249 PolarHBondContact O-N 2.8Å; V233-P355 HydrophobicContact CB-CB 4.25Å; V233-P355 HydrophobicContact CG2-CB 3.84Å; V233-P355 HydrophobicContact CG2-CG 3.86Å; V233-V356 HydrophobicContact CG1-CG2 4.15Å; V233-V356 HydrophobicContact CG2-CG2 4.06Å; V233-V359 HydrophobicContact CB-CG1 4.41Å; V233-V359 HydrophobicContact CG1-CG1 4.34Å; V233-V359 HydrophobicContact CG1-CG2 3.68Å
234	S	95.6	Very high	87.4	Confident	5 Å²	5	24.5 Å²	24.5	4%	0.035	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	127.9	177.6	-63.4	0	0	0	0	110.3	V223	V223-S234 PolarHBondContact N-O 3.4Å; V223-S234 PolarHBondContact O-N 2.91Å
235	L	95.4	Very high	87.1	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	115.6	169	179.1	65.4	0	0	0	108.8	L222 R246 A247 V359 L365	L222-L235 HydrophobicContact CD1-CB 4.46Å; L222-L235 HydrophobicContact CD1-CD1 4.37Å; L235-R246 HydrophobicContact CD2-CB 4.19Å; L235-R246 HydrophobicContact CG-CB 4.24Å; L235-R246 PolarHBondContact O-N 2.92Å; L235-A247 HydrophobicContact CB-CB 4.49Å; L235-A247 PolarHBondContact N-O 2.89Å; L235-V359 HydrophobicContact CB-CB 4.16Å; L235-V359 HydrophobicContact CB-CG2 4.26Å; L235-V359 WeakPolarHBondContact CD2-O 3.28Å; L235-L365 HydrophobicContact CD1-CD1 4.03Å; L235-L365 HydrophobicContact CD2-CD1 3.75Å; L235-L365 HydrophobicContact CD2-CG 4.25Å; L235-L365 HydrophobicContact CG-CD1 4.35Å
236	L	93.7	Very high	86.9	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	138.1	178.9	-52.3	-179.2	0	0	0	109.9	P204 A208 N220 V221 V223 F243 L244 T245	P204-L236 HydrophobicContact CB-CD1 4.31Å; P204-L236 HydrophobicContact CB-CD2 4.42Å; P204-L236 WeakPolarHBondContact O-CD1 3.33Å; A208-L236 HydrophobicContact CB-CD1 3.87Å; N220-L236 WeakPolarHBondContact CA-O 3.46Å; V221-L236 HydrophobicContact CB-CB 4.34Å; V221-L236 PolarHBondContact N-O 3.4Å; V221-L236 PolarHBondContact O-N 2.84Å; V223-L236 HydrophobicContact CG2-CD1 3.85Å; V223-L236 HydrophobicContact CG2-CG 4.34Å; L236-F243 HydrophobicContact CD1-CD1 4.42Å; L236-L244 CarbonylContact C-O 3.54Å; L236-L244 WeakPolarHBondContact CA-O 3.35Å; L236-T245 HydrophobicContact CD2-CG2 4.06Å; L236-T245 WeakPolarHBondContact CD2-OG1 3.36Å
237	N	90.7	Very high	86.9	Confident	15 Å²	15	28.5 Å²	28.5	8%	0.08	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	122.9	167.5	-177.5	-122.1	0	0	0	109.1	F219 N220 Q239 L244 R246	F219-N237 CarbonylContact O-C 3.51Å; F219-N237 VanDerWaalsContact O-CA 3.22Å; F219-N237 WeakPolarHBondContact O-CA 3.49Å; F219-N237 PolarHBondContact O-ND2 3.33Å; N220-N237 PolarHBondContact OD1-ND2 3.06Å; N237-Q239 PolarHBondContact OD1-NE2 3.16Å; N237-L244 PolarHBondContact N-O 2.94Å; N237-L244 PolarHBondContact O-N 3.21Å; N237-R246 HydrophobicContact CB-CG 3.68Å; N237-R246 PolarHBondContact OD1-NH2 2.98Å
238	K	86.9	Confident	87.2	Confident	15 Å²	15	28 Å²	28	7%	0.065	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	130.5	175.4	179	-176.7	160.1	-149.3	0	109.5	L213 H214 V216 V218 F219 G240 M242 F243	L213-K238 WeakPolarHBondContact O-CD 3.25Å; L213-K238 PolarHBondContact O-NZ 3Å; H214-K238 VanDerWaalsContact C-NZ 3.27Å; H214-K238 WeakPolarHBondContact O-CE 3.32Å; H214-K238 PolarHBondContact O-NZ 3.26Å; V216-K238 PolarHBondContact O-NZ 3.11Å; V218-K238 WeakPolarHBondContact O-CD 3.3Å; F219-K238 PolarHBondContact O-N 3.15Å; K238-G240 WeakPolarHBondContact CE-O 3.48Å; K238-M242 WeakPolarHBondContact CA-O 3.25Å; K238-F243 HydrophobicContact CB-CD1 4.17Å; K238-F243 HydrophobicContact CB-CE1 4.02Å; K238-F243 HydrophobicContact CD-CE1 4.16Å; K238-F243 HydrophobicContact CD-CZ 4.03Å; K238-F243 HydrophobicContact CG-CE1 4.17Å; K238-F243 HydrophobicContact CG-CZ 4.28Å
239	Q	82.1	Confident	87.8	Confident	107 Å²	107	26.3 Å²	26.3	50%	0.5	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	104.3	173.5	-64.5	-173.4	2.7	0	0	109.2	N237 G241 M242	N237-Q239 PolarHBondContact OD1-NE2 3.16Å; Q239-G241 PolarHBondContact O-N 3.29Å; Q239-M242 PolarHBondContact N-O 2.87Å; Q239-M242 PolarHBondContact O-N 2.82Å
240	G	76	Confident	88.5	Confident	63 Å²	63	25.2 Å²	25.2	65%	0.649	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.2	-118.9	-170.2	0	0	0	0	0	110.8	K238	K238-G240 WeakPolarHBondContact CE-O 3.48Å
241	G	69.9	Low	88.6	Confident	21 Å²	21	23.7 Å²	23.7	22%	0.216	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-2.9	176.3	0	0	0	0	0	115.6	Q239	Q239-G241 PolarHBondContact O-N 3.29Å
242	M	77.7	Confident	88.3	Confident	72 Å²	72	27.4 Å²	27.4	36%	0.355	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	143.5	-173.3	-54.6	-171.5	-65.1	0	0	111.4	K238 Q239 I429	K238-M242 WeakPolarHBondContact CA-O 3.25Å; Q239-M242 PolarHBondContact N-O 2.87Å; Q239-M242 PolarHBondContact O-N 2.82Å; M242-I429 HydrophobicContact CG-CB 4.18Å
243	F	84.5	Confident	87.9	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.009	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	128.8	172.7	-71.6	-92.3	0	0	0	109.5	T205 A208 M209 H214 L236 K238 A428 I429	T205-F243 HydrophobicContact CG2-CB 3.66Å; T205-F243 HydrophobicContact CG2-CD2 3.82Å; T205-F243 HydrophobicContact CG2-CG 3.77Å; A208-F243 HydrophobicContact CB-CE1 3.98Å; M209-F243 HydrophobicContact CG-CE2 4.13Å; H214-F243 HydrophobicContact CB-CE2 4.34Å; H214-F243 HydrophobicContact CB-CZ 4.25Å; L236-F243 HydrophobicContact CD1-CD1 4.42Å; K238-F243 HydrophobicContact CB-CD1 4.17Å; K238-F243 HydrophobicContact CB-CE1 4.02Å; K238-F243 HydrophobicContact CD-CE1 4.16Å; K238-F243 HydrophobicContact CD-CZ 4.03Å; K238-F243 HydrophobicContact CG-CE1 4.17Å; K238-F243 HydrophobicContact CG-CZ 4.28Å; F243-A428 HydrophobicContact CD2-CB 4.11Å; F243-I429 PolarHBondContact N-O 2.93Å
244	L	85.4	Confident	87.6	Confident	36 Å²	36	33.2 Å²	33.2	19%	0.188	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	122.9	176	172.9	67.7	0	0	0	109.4	L236 N237 R246 I431	L236-L244 CarbonylContact C-O 3.54Å; L236-L244 WeakPolarHBondContact CA-O 3.35Å; N237-L244 PolarHBondContact N-O 2.94Å; N237-L244 PolarHBondContact O-N 3.21Å; L244-R246 PolarHBondContact O-N 3.01Å; L244-I431 HydrophobicContact CD1-CB 3.98Å; L244-I431 HydrophobicContact CD1-CG2 4.41Å
245	T	89.4	Confident	87.3	Confident	10 Å²	10	33 Å²	33	6%	0.061	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	112.8	169.9	-48.8	0	0	0	0	109.7	L236 M248 L436	L236-T245 HydrophobicContact CD2-CG2 4.06Å; L236-T245 WeakPolarHBondContact CD2-OG1 3.36Å; T245-M248 HydrophobicContact CG2-CG 3.51Å; T245-M248 HydrophobicContact CG2-SD 3.89Å; T245-L436 HydrophobicContact CG2-CD1 4.28Å; T245-L436 HydrophobicContact CG2-CD2 3.71Å
246	R	90.6	Very high	87	Confident	110 Å²	110	33 Å²	33	42%	0.415	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	-46.9	-178.9	-69	-67.9	-171.4	167.9	-0.1	111.8	L235 N237 L244	L235-R246 HydrophobicContact CD2-CB 4.19Å; L235-R246 HydrophobicContact CG-CB 4.24Å; L235-R246 PolarHBondContact O-N 2.92Å; N237-R246 HydrophobicContact CB-CG 3.68Å; N237-R246 PolarHBondContact OD1-NH2 2.98Å; L244-R246 PolarHBondContact O-N 3.01Å
247	A	92.7	Very high	86.7	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.008	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	154.1	-177.1	0	0	0	0	0	110.3	L235 V359 E362	L235-A247 HydrophobicContact CB-CB 4.49Å; L235-A247 PolarHBondContact N-O 2.89Å; A247-V359 HydrophobicContact CB-CB 3.9Å; A247-V359 HydrophobicContact CB-CG1 4.24Å; A247-V359 WeakPolarHBondContact CB-O 3.22Å; A247-E362 HydrophobicContact CB-CB 3.72Å
248	M	93.1	Very high	86.8	Confident	5 Å²	5	41.3 Å²	41.3	3%	0.025	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	135.5	177.4	-69	-178.3	68.4	0	0	110.9	A176 E177 V233 T245 L436 K438 T439	A176-M248 HydrophobicContact CB-CE 3.56Å; A176-M248 HydrophobicContact CB-SD 3.39Å; A176-M248 WeakPolarHBondContact CB-SD 3.3Å; E177-M248 HydrophobicContact CB-CE 4.32Å; E177-M248 WeakPolarHBondContact OE2-CE 3.49Å; V233-M248 WeakPolarHBondContact O-CA 3.31Å; T245-M248 HydrophobicContact CG2-CG 3.51Å; T245-M248 HydrophobicContact CG2-SD 3.89Å; M248-L436 HydrophobicContact CG-CD1 4.33Å; M248-L436 HydrophobicContact CG-CD2 4.17Å; M248-L436 HydrophobicContact CG-CG 4.45Å; M248-L436 HydrophobicContact SD-CD2 3.63Å; M248-L436 HydrophobicContact SD-CG 4.26Å; M248-K438 HydrophobicContact CB-CB 4.44Å; M248-K438 HydrophobicContact CB-CG 4.47Å; M248-K438 WeakPolarHBondContact O-CA 3.4Å; M248-T439 PolarHBondContact O-N 2.81Å; M248-T439 VanDerWaalsContact O-N 3.16Å
249	A	94.3	Very high	87.3	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	158.5	172.2	0	0	0	0	0	109.8	V233 P355 T358 V359 T439 F441	V233-A249 PolarHBondContact N-O 2.88Å; V233-A249 PolarHBondContact O-N 2.8Å; A249-P355 HydrophobicContact CB-CB 3.66Å; A249-T358 HydrophobicContact CB-CG2 4.05Å; A249-V359 HydrophobicContact CB-CG1 3.68Å; A249-V359 VanDerWaalsContact N-CG1 3.28Å; A249-T439 CarbonylContact C-O 3.44Å; A249-T439 WeakPolarHBondContact CA-O 3.49Å; A249-F441 HydrophobicContact CB-CE2 4.16Å
250	G	92.6	Very high	87.9	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.7	179.3	-179.6	0	0	0	0	0	113.9	L231 T439 N440 F441	L231-G250 CarbonylContact O-C 3.54Å; L231-G250 WeakPolarHBondContact O-CA 3.3Å; G250-T439 PolarHBondContact N-O 3.23Å; G250-N440 CarbonylContact O-C 3.36Å; G250-N440 WeakPolarHBondContact O-CA 3.47Å; G250-F441 WeakPolarHBondContact O-CD2 3.42Å; G250-F441 PolarHBondContact O-N 3.38Å
251	N	89	Confident	88.8	Confident	7 Å²	7	36.2 Å²	36.2	4%	0.037	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	114.3	171.2	-175.7	-28.5	0	0	0	108.7	T230 L231 K253 L254 F441	T230-N251 WeakPolarHBondContact CA-O 3.16Å; L231-N251 HydrophobicContact CB-CB 4.43Å; L231-N251 PolarHBondContact N-O 3.28Å; L231-N251 PolarHBondContact O-N 2.96Å; N251-K253 PolarHBondContact O-N 2.88Å; N251-K253 WeakPolarHBondContact OD1-CA 3.35Å; N251-K253 PolarHBondContact OD1-N 3.38Å; N251-L254 HydrophobicContact CB-CB 3.88Å; N251-L254 HydrophobicContact CB-CD2 4.44Å; N251-L254 PolarHBondContact OD1-N 3.2Å; N251-F441 HydrophobicContact CB-CB 4.4Å; N251-F441 PolarHBondContact OD1-O 3.33Å
252	N	85	Confident	90.1	Very high	79 Å²	79	38.8 Å²	38.8	42%	0.422	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	2.9	-176.6	-64.3	-34.6	0	0	0	113.6	G229 N440	G229-N252 CarbonylContact O-C 3.54Å; N252-N440 PolarHBondContact ND2-ND2 2.82Å
253	K	84.2	Confident	91.1	Very high	148 Å²	148	35.4 Å²	35.4	64%	0.643	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-133.2	33.3	-178.3	-58.7	-175.4	-174.4	-178.6	0	111	N251	N251-K253 PolarHBondContact O-N 2.88Å; N251-K253 WeakPolarHBondContact OD1-CA 3.35Å; N251-K253 PolarHBondContact OD1-N 3.38Å
254	L	89.9	Confident	91.7	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	17%	0.167	C	C	.	.			trans	-141.3	109.8	177.4	-180	61.1	0	0	0	109.3	T230 L231 N251 D258 F259 L348 K351 I352	T230-L254 CarbonylContact C-O 3.44Å; T230-L254 VanDerWaalsContact CA-O 3.32Å; T230-L254 WeakPolarHBondContact CA-O 3.31Å; T230-L254 PolarHBondContact N-O 3.38Å; L231-L254 HydrophobicContact CB-CD2 4.48Å; L231-L254 HydrophobicContact CD2-CD2 3.83Å; L231-L254 PolarHBondContact N-O 3.29Å; L231-L254 VanDerWaalsContact N-O 3.12Å; N251-L254 HydrophobicContact CB-CB 3.88Å; N251-L254 HydrophobicContact CB-CD2 4.44Å; N251-L254 PolarHBondContact OD1-N 3.2Å; L254-D258 WeakPolarHBondContact CA-OD2 3.17Å; L254-F259 HydrophobicContact CD1-CE1 4.08Å; L254-F259 HydrophobicContact CD1-CZ 4.39Å; L254-L348 HydrophobicContact CD1-CB 3.98Å; L254-L348 HydrophobicContact CD1-CD2 4.33Å; L254-K351 HydrophobicContact CD2-CB 3.96Å; L254-I352 HydrophobicContact CD2-CG1 4.19Å
255	G	90.4	Very high	92.3	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	18%	0.181	C	C	.	.	S	Bend	trans	-166.1	-166.8	174.4	0	0	0	0	0	113.2	G228 Q257 D258 F259	G228-G255 CarbonylContact O-C 3.5Å; G255-Q257 PolarHBondContact O-N 2.84Å; G255-Q257 VanDerWaalsContact O-N 3.15Å; G255-D258 PolarHBondContact N-OD2 3.43Å; G255-D258 PolarHBondContact O-N 3.14Å; G255-D258 VanDerWaalsContact O-N 3.09Å; G255-F259 PolarHBondContact O-N 3.39Å
256	G	90.1	Very high	92.7	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-55.1	-31.9	-178	0	0	0	0	0	115.1	G227 G228 F259 S260 K296 S379	G227-G256 PolarHBondContact O-N 3.11Å; G228-G256 PolarHBondContact O-N 3.12Å; G228-G256 VanDerWaalsContact O-N 3.09Å; G256-F259 PolarHBondContact O-N 3.4Å; G256-S260 PolarHBondContact O-N 3.41Å; G256-S260 VanDerWaalsContact O-N 3.08Å; G256-S260 PolarHBondContact O-OG 3.5Å; G256-S260 VanDerWaalsContact O-OG 3.06Å; G256-K296 PolarHBondContact O-NZ 2.71Å; G256-S379 VanDerWaalsContact CA-OG 3.25Å; G256-S379 WeakPolarHBondContact CA-OG 3.19Å; G256-S379 PolarHBondContact N-OG 2.73Å
257	Q	87.1	Confident	93	Very high	136 Å²	136	35.9 Å²	35.9	64%	0.636	17%	0.167	S	C	*	.	H	α-helix	trans	-69.1	-36.3	178.7	-72.1	172.1	23.2	0	0	112.1	G228 G255 F259 S260 Q261	G228-Q257 VanDerWaalsContact O-CB 3.31Å; G228-Q257 WeakPolarHBondContact O-CB 3.42Å; G228-Q257 WeakPolarHBondContact O-CG 3.33Å; G228-Q257 PolarHBondContact O-N 2.89Å; G255-Q257 PolarHBondContact O-N 2.84Å; G255-Q257 VanDerWaalsContact O-N 3.15Å; Q257-F259 VanDerWaalsContact C-N 3.31Å; Q257-S260 PolarHBondContact O-N 3.46Å; Q257-Q261 VanDerWaalsContact O-CB 3.3Å; Q257-Q261 WeakPolarHBondContact O-CB 3.34Å; Q257-Q261 PolarHBondContact O-N 3.44Å
258	D	92.4	Very high	93.1	Very high	53 Å²	53	36.7 Å²	36.7	28%	0.283	17%	0.172	S	C	.	.	H	α-helix	trans	-66.5	-38.3	177.1	-56.6	-73.8	0	0	0	110.6	L254 G255 Q261 R262 L348	L254-D258 WeakPolarHBondContact CA-OD2 3.17Å; G255-D258 PolarHBondContact N-OD2 3.43Å; G255-D258 PolarHBondContact O-N 3.14Å; G255-D258 VanDerWaalsContact O-N 3.09Å; D258-Q261 WeakPolarHBondContact O-CB 3.43Å; D258-Q261 PolarHBondContact O-N 3.3Å; D258-R262 PolarHBondContact O-N 2.79Å; D258-R262 VanDerWaalsContact O-N 3.12Å; D258-L348 HydrophobicContact CB-CD1 4.01Å
259	F	96.8	Very high	93.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65.3	-44.2	174.7	-47.8	-39.4	0	0	0	112.1	L226 L254 G255 G256 Q257 Q261 R262 L263 K296 F341 N345 L348 F349 I382 I385	L226-F259 HydrophobicContact CD2-CE2 4.03Å; L226-F259 HydrophobicContact CD2-CZ 4.14Å; L254-F259 HydrophobicContact CD1-CE1 4.08Å; L254-F259 HydrophobicContact CD1-CZ 4.39Å; G255-F259 PolarHBondContact O-N 3.39Å; G256-F259 PolarHBondContact O-N 3.4Å; Q257-F259 VanDerWaalsContact C-N 3.31Å; F259-Q261 VanDerWaalsContact C-N 3.28Å; F259-Q261 PolarHBondContact O-N 2.9Å; F259-R262 PolarHBondContact O-N 2.98Å; F259-L263 PolarHBondContact O-N 3.19Å; F259-K296 HydrophobicContact CB-CD 4.39Å; F259-F341 HydrophobicContact CB-CE2 3.98Å; F259-F341 HydrophobicContact CB-CZ 3.85Å; F259-N345 VanDerWaalsContact CA-OD1 3.29Å; F259-N345 WeakPolarHBondContact CA-OD1 3.01Å; F259-N345 HydrophobicContact CD1-CB 4.31Å; F259-L348 HydrophobicContact CD1-CB 4.18Å; F259-L348 HydrophobicContact CD1-CD1 4.01Å; F259-L348 HydrophobicContact CE1-CB 3.8Å; F259-L348 HydrophobicContact CE1-CD1 4.33Å; F259-F349 HydrophobicContact CD1-CD1 4.36Å; F259-F349 AromaticContact CD1-CE1 3.86Å; F259-F349 HydrophobicContact CD1-CE1 3.86Å; F259-F349 HydrophobicContact CD2-CE1 4.31Å; F259-F349 AromaticContact CE1-CD1 3.77Å; F259-F349 HydrophobicContact CE1-CD1 3.77Å; F259-F349 AromaticContact CE1-CE1 3.67Å; F259-F349 HydrophobicContact CE1-CE1 3.67Å; F259-F349 HydrophobicContact CE2-CE1 4.15Å; F259-F349 HydrophobicContact CG-CE1 4.2Å; F259-F349 AromaticContact CZ-CD1 3.96Å; F259-F349 HydrophobicContact CZ-CD1 3.96Å; F259-F349 AromaticContact CZ-CE1 3.84Å; F259-F349 HydrophobicContact CZ-CE1 3.84Å; F259-I382 HydrophobicContact CD2-CD1 3.66Å; F259-I382 HydrophobicContact CE2-CD1 3.95Å; F259-I385 HydrophobicContact CE2-CD1 3.98Å; F259-I385 HydrophobicContact CZ-CD1 4.17Å
260	S	95.5	Very high	93.4	Very high	13 Å²	13	44.2 Å²	44.2	9%	0.091	20%	0.203	C	C	.	.	H	α-helix	trans	-63.3	-35.4	174.4	-58.8	0	0	0	0	111.5	G256 Q257 L263 F264 V292 E293 K296	G256-S260 PolarHBondContact O-N 3.41Å; G256-S260 VanDerWaalsContact O-N 3.08Å; G256-S260 PolarHBondContact O-OG 3.5Å; G256-S260 VanDerWaalsContact O-OG 3.06Å; Q257-S260 PolarHBondContact O-N 3.46Å; S260-L263 PolarHBondContact O-N 3.44Å; S260-F264 VanDerWaalsContact O-CB 3.27Å; S260-F264 WeakPolarHBondContact O-CB 3.3Å; S260-F264 PolarHBondContact O-N 3.32Å; S260-V292 WeakPolarHBondContact O-CG1 3.35Å; S260-E293 WeakPolarHBondContact CB-OE2 3.17Å; S260-E293 PolarHBondContact OG-OE2 2.81Å; S260-K296 WeakPolarHBondContact OG-CD 3.32Å; S260-K296 WeakPolarHBondContact OG-CE 3.48Å; S260-K296 PolarHBondContact OG-NZ 3.5Å
261	Q	94.6	Very high	93.6	Very high	66 Å²	66	44.2 Å²	44.2	31%	0.308	20%	0.203	S	C	.	.	H	α-helix	trans	-66.2	-39.4	178.7	-178.9	58.5	37.1	0	0	112.1	Q257 D258 F259 F264 Q265	Q257-Q261 VanDerWaalsContact O-CB 3.3Å; Q257-Q261 WeakPolarHBondContact O-CB 3.34Å; Q257-Q261 PolarHBondContact O-N 3.44Å; D258-Q261 WeakPolarHBondContact O-CB 3.43Å; D258-Q261 PolarHBondContact O-N 3.3Å; F259-Q261 VanDerWaalsContact C-N 3.28Å; F259-Q261 PolarHBondContact O-N 2.9Å; Q261-F264 PolarHBondContact O-N 3.49Å; Q261-Q265 WeakPolarHBondContact O-CG 3.45Å; Q261-Q265 PolarHBondContact O-N 3.42Å
262	R	97.3	Very high	93.9	Very high	75 Å²	75	49.8 Å²	49.8	28%	0.283	22%	0.223	S	C	.	.	H	α-helix	trans	-62.6	-45.1	173.3	-68.5	-65.1	-173.1	90.2	2.5	111.6	D258 F259 Q265 Y266 L344 N345 D347 L348	D258-R262 PolarHBondContact O-N 2.79Å; D258-R262 VanDerWaalsContact O-N 3.12Å; F259-R262 PolarHBondContact O-N 2.98Å; R262-Q265 PolarHBondContact O-N 3.31Å; R262-Y266 PolarHBondContact O-N 2.95Å; R262-Y266 VanDerWaalsContact O-N 3.14Å; R262-L344 HydrophobicContact CB-CB 4.49Å; R262-L344 PolarHBondContact NH1-O 3.11Å; R262-N345 WeakPolarHBondContact CB-OD1 3Å; R262-N345 WeakPolarHBondContact CG-OD1 3.21Å; R262-D347 IonicContact CZ-OD1 2.57Å; R262-D347 IonicContact CZ-OD2 3.13Å; R262-D347 IonicContact NH1-OD1 3.67Å; R262-D347 PolarHBondContact NH1-OD1 3.47Å; R262-D347 IonicContact NH1-OD2 3.12Å; R262-D347 IonicContact NH2-OD1 2.77Å; R262-D347 PolarHBondContact NH2-OD1 2.94Å; R262-D347 IonicContact NH2-OD2 3.43Å; R262-D347 PolarHBondContact NH2-OD2 3.04Å; R262-L348 HydrophobicContact CG-CD1 4.04Å
263	L	97.9	Very high	94.3	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-65.5	-39.2	176.3	-177	55.9	0	0	0	111.8	F259 S260 Q265 Y266 T267 V292 V336 F341 L344	F259-L263 PolarHBondContact O-N 3.19Å; S260-L263 PolarHBondContact O-N 3.44Å; L263-Q265 PolarHBondContact O-N 2.8Å; L263-Y266 HydrophobicContact CD1-CD1 4.18Å; L263-Y266 PolarHBondContact O-N 3.32Å; L263-T267 HydrophobicContact CD1-CG2 4.44Å; L263-T267 PolarHBondContact O-N 2.74Å; L263-T267 PolarHBondContact O-OG1 3.35Å; L263-T267 VanDerWaalsContact O-OG1 3.05Å; L263-V292 HydrophobicContact CB-CG1 3.9Å; L263-V292 HydrophobicContact CD2-CG1 3.98Å; L263-V292 HydrophobicContact CG-CG1 3.85Å; L263-V336 HydrophobicContact CD1-CG1 3.82Å; L263-V336 HydrophobicContact CD1-CG2 4.3Å; L263-F341 HydrophobicContact CB-CD2 4.45Å; L263-F341 HydrophobicContact CD2-CD2 4.2Å; L263-L344 HydrophobicContact CD1-CD1 4.26Å
264	F	97.3	Very high	94.8	Very high	22 Å²	22	50 Å²	50	10%	0.096	22%	0.224	C	C	.	.	H	α-helix	trans	-60.9	-44.6	175.6	174.3	-95.4	0	0	0	111.9	S260 Q261 T267 S268 I285 L288 R289 V292	S260-F264 VanDerWaalsContact O-CB 3.27Å; S260-F264 WeakPolarHBondContact O-CB 3.3Å; S260-F264 PolarHBondContact O-N 3.32Å; Q261-F264 PolarHBondContact O-N 3.49Å; F264-T267 WeakPolarHBondContact CA-OG1 3.33Å; F264-T267 PolarHBondContact O-N 3.27Å; F264-T267 PolarHBondContact O-OG1 3.19Å; F264-S268 WeakPolarHBondContact CE1-OG 3.2Å; F264-S268 VanDerWaalsContact CZ-OG 3.3Å; F264-S268 WeakPolarHBondContact CZ-OG 3.44Å; F264-S268 WeakPolarHBondContact O-CB 3.43Å; F264-S268 PolarHBondContact O-N 2.76Å; F264-S268 PolarHBondContact O-OG 3.22Å; F264-I285 HydrophobicContact CE2-CG2 4.31Å; F264-I285 HydrophobicContact CZ-CG2 3.88Å; F264-L288 HydrophobicContact CD2-CD2 4.18Å; F264-L288 HydrophobicContact CD2-CG 4.04Å; F264-L288 HydrophobicContact CE2-CB 4.06Å; F264-L288 HydrophobicContact CE2-CD2 3.73Å; F264-L288 HydrophobicContact CE2-CG 3.85Å; F264-L288 HydrophobicContact CZ-CD2 4.47Å; F264-R289 HydrophobicContact CD2-CG 3.62Å; F264-R289 HydrophobicContact CE2-CG 3.66Å; F264-R289 HydrophobicContact CG-CG 4.29Å; F264-R289 HydrophobicContact CZ-CG 4.38Å; F264-V292 HydrophobicContact CB-CG1 4.21Å; F264-V292 HydrophobicContact CB-CG2 4.4Å; F264-V292 HydrophobicContact CD2-CG2 4.45Å
265	Q	97.2	Very high	94.9	Very high	103 Å²	103	52.9 Å²	52.9	48%	0.481	24%	0.237	S	C	.	.	H	α-helix	trans	-60	-46.9	176.1	-75.5	170.4	-13.1	0	0	111.4	Q261 R262 L263 S268 E269	Q261-Q265 WeakPolarHBondContact O-CG 3.45Å; Q261-Q265 PolarHBondContact O-N 3.42Å; R262-Q265 PolarHBondContact O-N 3.31Å; L263-Q265 PolarHBondContact O-N 2.8Å; Q265-S268 PolarHBondContact O-N 3.1Å; Q265-E269 PolarHBondContact O-N 2.99Å
266	Y	97.9	Very high	95	Very high	43 Å²	43	55.8 Å²	55.8	17%	0.169	27%	0.267	C	S	.	.	H	α-helix	trans	-58	-49.5	174.8	168.7	-94.4	0	0	0	112.1	R262 L263 S268 E269 R270 V336 L340 L344	R262-Y266 PolarHBondContact O-N 2.95Å; R262-Y266 VanDerWaalsContact O-N 3.14Å; L263-Y266 HydrophobicContact CD1-CD1 4.18Å; L263-Y266 PolarHBondContact O-N 3.32Å; Y266-S268 PolarHBondContact O-N 3.47Å; Y266-E269 WeakPolarHBondContact O-CB 3.31Å; Y266-E269 PolarHBondContact O-N 3.17Å; Y266-R270 HydrophobicContact CD1-CG 4.46Å; Y266-R270 HydrophobicContact CE1-CG 4Å; Y266-R270 HydrophobicContact CE2-CG 4.37Å; Y266-R270 WeakPolarHBondContact O-CG 3.4Å; Y266-R270 PolarHBondContact O-N 3.43Å; Y266-R270 PolarHBondContact OH-NE 2.87Å; Y266-R270 VanDerWaalsContact OH-NE 3.11Å; Y266-R270 PolarHBondContact OH-NH2 3.04Å; Y266-V336 HydrophobicContact CE1-CG2 4.37Å; Y266-L340 HydrophobicContact CD1-CD2 4.5Å; Y266-L340 HydrophobicContact CE1-CD2 3.76Å; Y266-L340 HydrophobicContact CE2-CD1 4.43Å; Y266-L340 HydrophobicContact CE2-CD2 4.03Å; Y266-L340 VanDerWaalsContact CZ-CD2 3.46Å; Y266-L340 WeakPolarHBondContact OH-CD2 3.21Å; Y266-L344 HydrophobicContact CD1-CD1 4.42Å; Y266-L344 HydrophobicContact CD2-CD1 4.39Å; Y266-L344 HydrophobicContact CD2-CD2 4.48Å; Y266-L344 HydrophobicContact CG-CD1 3.96Å
267	T	97.2	Very high	94.9	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-66	-37.4	179.1	48.7	0	0	0	0	113.4	L263 F264 E269 R270 V271 V292 I307 V334	L263-T267 HydrophobicContact CD1-CG2 4.44Å; L263-T267 PolarHBondContact O-N 2.74Å; L263-T267 PolarHBondContact O-OG1 3.35Å; L263-T267 VanDerWaalsContact O-OG1 3.05Å; F264-T267 WeakPolarHBondContact CA-OG1 3.33Å; F264-T267 PolarHBondContact O-N 3.27Å; F264-T267 PolarHBondContact O-OG1 3.19Å; T267-E269 VanDerWaalsContact C-N 3.26Å; T267-E269 PolarHBondContact O-N 2.84Å; T267-R270 WeakPolarHBondContact O-CB 3.14Å; T267-R270 PolarHBondContact O-N 3.4Å; T267-R270 VanDerWaalsContact O-N 3.12Å; T267-V271 WeakPolarHBondContact O-CG2 3.17Å; T267-V271 PolarHBondContact O-N 3.42Å; T267-V292 HydrophobicContact CG2-CG2 4.19Å; T267-V292 WeakPolarHBondContact OG1-CG2 3.34Å; T267-I307 HydrophobicContact CG2-CD1 3.49Å; T267-I307 VanDerWaalsContact CG2-CD1 3.49Å; T267-V334 HydrophobicContact CG2-CG1 4.21Å
268	S	96.1	Very high	95	Very high	18 Å²	18	52.9 Å²	52.9	13%	0.126	26%	0.262	C	S	.	.	H	α-helix	trans	-62.1	-37.7	175.6	-61	0	0	0	0	111.3	F264 Q265 Y266 V271 R272	F264-S268 WeakPolarHBondContact CE1-OG 3.2Å; F264-S268 VanDerWaalsContact CZ-OG 3.3Å; F264-S268 WeakPolarHBondContact CZ-OG 3.44Å; F264-S268 WeakPolarHBondContact O-CB 3.43Å; F264-S268 PolarHBondContact O-N 2.76Å; F264-S268 PolarHBondContact O-OG 3.22Å; Q265-S268 PolarHBondContact O-N 3.1Å; Y266-S268 PolarHBondContact O-N 3.47Å; S268-V271 PolarHBondContact O-N 2.95Å; S268-R272 PolarHBondContact O-N 3.23Å; S268-R272 VanDerWaalsContact O-N 3.09Å
269	E	96.5	Very high	94.8	Very high	61 Å²	61	50.9 Å²	50.9	29%	0.285	25%	0.252	S	S	.	.	H	α-helix	trans	-66.1	-40	173.4	-177.5	55.2	-149.6	0	0	111.9	Q265 Y266 T267 V271 R272 Q273	Q265-E269 PolarHBondContact O-N 2.99Å; Y266-E269 WeakPolarHBondContact O-CB 3.31Å; Y266-E269 PolarHBondContact O-N 3.17Å; T267-E269 VanDerWaalsContact C-N 3.26Å; T267-E269 PolarHBondContact O-N 2.84Å; E269-V271 PolarHBondContact O-N 2.95Å; E269-R272 WeakPolarHBondContact O-CB 3.34Å; E269-R272 PolarHBondContact O-N 3.43Å; E269-R272 IonicContact OE1-CZ 3.19Å; E269-R272 IonicContact OE1-NE 3.81Å; E269-R272 PolarHBondContact OE1-NE 3.11Å; E269-R272 VanDerWaalsContact OE1-NE 3.15Å; E269-R272 IonicContact OE1-NH2 3.52Å; E269-R272 PolarHBondContact OE1-NH2 3.1Å; E269-R272 IonicContact OE2-CZ 3.91Å; E269-R272 IonicContact OE2-NE 3.1Å; E269-R272 PolarHBondContact OE2-NE 2.71Å; E269-R272 IonicContact OE2-NH1 3.44Å; E269-R272 IonicContact OE2-NH2 2.74Å; E269-R272 PolarHBondContact OE2-NH2 3.01Å; E269-Q273 WeakPolarHBondContact O-CG 3.37Å; E269-Q273 PolarHBondContact O-N 3.03Å; E269-Q273 PolarHBondContact OE1-NE2 3.28Å
270	R	97.1	Very high	94.3	Very high	103 Å²	103	54.8 Å²	54.8	39%	0.389	28%	0.276	S	S	.	.	H	α-helix	trans	-62.6	-40.1	174.3	-68.2	-60.9	-167.7	127.8	-4.2	112.5	Y266 T267 R272 Q273 Q274 F332	Y266-R270 HydrophobicContact CD1-CG 4.46Å; Y266-R270 HydrophobicContact CE1-CG 4Å; Y266-R270 HydrophobicContact CE2-CG 4.37Å; Y266-R270 WeakPolarHBondContact O-CG 3.4Å; Y266-R270 PolarHBondContact O-N 3.43Å; Y266-R270 PolarHBondContact OH-NE 2.87Å; Y266-R270 VanDerWaalsContact OH-NE 3.11Å; Y266-R270 PolarHBondContact OH-NH2 3.04Å; T267-R270 WeakPolarHBondContact O-CB 3.14Å; T267-R270 PolarHBondContact O-N 3.4Å; T267-R270 VanDerWaalsContact O-N 3.12Å; R270-R272 VanDerWaalsContact C-N 3.33Å; R270-R272 PolarHBondContact O-N 2.96Å; R270-Q273 PolarHBondContact O-N 3.31Å; R270-Q274 WeakPolarHBondContact O-CB 3.4Å; R270-Q274 PolarHBondContact O-N 2.75Å; R270-F332 HydrophobicContact CB-CE2 4.15Å; R270-F332 HydrophobicContact CB-CZ 3.9Å
271	V	96.1	Very high	94	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-58.1	-48	172.2	174.6	0	0	0	0	110	T267 S268 E269 Q273 Q274 F275 L288 L311 L313 F332	T267-V271 WeakPolarHBondContact O-CG2 3.17Å; T267-V271 PolarHBondContact O-N 3.42Å; S268-V271 PolarHBondContact O-N 2.95Å; E269-V271 PolarHBondContact O-N 2.95Å; V271-Q273 PolarHBondContact O-N 3.07Å; V271-Q274 PolarHBondContact O-N 3.37Å; V271-F275 HydrophobicContact CG1-CD2 3.96Å; V271-F275 WeakPolarHBondContact O-CD2 3.47Å; V271-F275 PolarHBondContact O-N 3.29Å; V271-L288 HydrophobicContact CG2-CD2 4.38Å; V271-L311 HydrophobicContact CG1-CD1 3.86Å; V271-L311 HydrophobicContact CG2-CD1 3.85Å; V271-L313 HydrophobicContact CG1-CD1 3.92Å; V271-L313 HydrophobicContact CG1-CD2 3.87Å; V271-F332 HydrophobicContact CG2-CB 4.49Å; V271-F332 HydrophobicContact CG2-CD1 3.69Å; V271-F332 HydrophobicContact CG2-CD2 3.76Å; V271-F332 HydrophobicContact CG2-CE1 3.68Å; V271-F332 HydrophobicContact CG2-CE2 3.75Å; V271-F332 HydrophobicContact CG2-CG 3.71Å; V271-F332 HydrophobicContact CG2-CZ 3.7Å
272	R	94.6	Very high	93.5	Very high	123 Å²	123	61.6 Å²	61.6	46%	0.464	31%	0.305	S	S	.	.	H	α-helix	trans	-59.8	-43.1	177	-174.1	177.9	73	163.5	4.4	112.7	S268 E269 R270 Q274 G276 V277 A278	S268-R272 PolarHBondContact O-N 3.23Å; S268-R272 VanDerWaalsContact O-N 3.09Å; E269-R272 WeakPolarHBondContact O-CB 3.34Å; E269-R272 PolarHBondContact O-N 3.43Å; E269-R272 IonicContact OE1-CZ 3.19Å; E269-R272 IonicContact OE1-NE 3.81Å; E269-R272 PolarHBondContact OE1-NE 3.11Å; E269-R272 VanDerWaalsContact OE1-NE 3.15Å; E269-R272 IonicContact OE1-NH2 3.52Å; E269-R272 PolarHBondContact OE1-NH2 3.1Å; E269-R272 IonicContact OE2-CZ 3.91Å; E269-R272 IonicContact OE2-NE 3.1Å; E269-R272 PolarHBondContact OE2-NE 2.71Å; E269-R272 IonicContact OE2-NH1 3.44Å; E269-R272 IonicContact OE2-NH2 2.74Å; E269-R272 PolarHBondContact OE2-NH2 3.01Å; R270-R272 VanDerWaalsContact C-N 3.33Å; R270-R272 PolarHBondContact O-N 2.96Å; R272-Q274 VanDerWaalsContact C-N 3.35Å; R272-G276 CarbonylContact O-C 3.59Å; R272-G276 WeakPolarHBondContact O-CA 3.04Å; R272-G276 PolarHBondContact O-N 3.32Å; R272-V277 WeakPolarHBondContact CA-O 3.48Å; R272-A278 HydrophobicContact CB-CB 4.3Å
273	Q	95.1	Very high	92.9	Very high	123 Å²	123	63.5 Å²	63.5	58%	0.575	32%	0.317	S	S	*	.	H	α-helix	trans	-65.2	-37.9	178.1	-72.2	172	3.1	0	0	112.4	E269 R270 V271	E269-Q273 WeakPolarHBondContact O-CG 3.37Å; E269-Q273 PolarHBondContact O-N 3.03Å; E269-Q273 PolarHBondContact OE1-NE2 3.28Å; R270-Q273 PolarHBondContact O-N 3.31Å; V271-Q273 PolarHBondContact O-N 3.07Å
274	Q	94.5	Very high	92.6	Very high	108 Å²	108	63.6 Å²	63.6	51%	0.505	32%	0.317	S	S	.	.	H	α-helix	trans	-79.6	-36.9	-177	-175.1	171.9	-7.8	0	0	113.2	R270 V271 R272	R270-Q274 WeakPolarHBondContact O-CB 3.4Å; R270-Q274 PolarHBondContact O-N 2.75Å; V271-Q274 PolarHBondContact O-N 3.37Å; R272-Q274 VanDerWaalsContact C-N 3.35Å
275	F	92.1	Very high	92.3	Very high	62 Å²	62	64.6 Å²	64.6	27%	0.272	32%	0.323	S	S	.	.	H	α-helix	trans	-117.8	2.2	-171.8	-56.2	-69.7	0	0	0	114.2	V271 V277 L313 V330 F332	V271-F275 HydrophobicContact CG1-CD2 3.96Å; V271-F275 WeakPolarHBondContact O-CD2 3.47Å; V271-F275 PolarHBondContact O-N 3.29Å; F275-V277 PolarHBondContact O-N 2.99Å; F275-L313 HydrophobicContact CB-CD1 3.34Å; F275-L313 HydrophobicContact CD1-CD1 4.37Å; F275-L313 HydrophobicContact CD2-CD1 3.48Å; F275-L313 VanDerWaalsContact CD2-CD1 3.48Å; F275-L313 HydrophobicContact CE2-CD1 4.32Å; F275-L313 HydrophobicContact CG-CD1 3.49Å; F275-L313 VanDerWaalsContact CG-CD1 3.49Å; F275-V330 HydrophobicContact CD1-CB 4.34Å; F275-V330 HydrophobicContact CD1-CG1 4.44Å; F275-V330 HydrophobicContact CD1-CG2 4.21Å; F275-V330 HydrophobicContact CD2-CG2 4.37Å; F275-V330 HydrophobicContact CE1-CB 3.92Å; F275-V330 HydrophobicContact CE1-CG1 4.37Å; F275-V330 HydrophobicContact CE1-CG2 4.02Å; F275-V330 HydrophobicContact CE2-CG2 4.17Å; F275-V330 HydrophobicContact CG-CG2 4.37Å; F275-V330 HydrophobicContact CZ-CB 4.18Å; F275-V330 HydrophobicContact CZ-CG2 4Å; F275-F332 HydrophobicContact CE2-CB 3.93Å; F275-F332 AromaticContact CE2-CD2 3.77Å; F275-F332 HydrophobicContact CE2-CD2 3.77Å; F275-F332 HydrophobicContact CE2-CG 4.28Å; F275-F332 HydrophobicContact CZ-CB 4.43Å
276	G	91.1	Very high	91.7	Very high	61 Å²	61	63.9 Å²	63.9	63%	0.629	32%	0.32	S	S	*	.	S	Bend	trans	78.4	-11.9	-179.8	0	0	0	0	0	115	R272	R272-G276 CarbonylContact O-C 3.59Å; R272-G276 WeakPolarHBondContact O-CA 3.04Å; R272-G276 PolarHBondContact O-N 3.32Å
277	V	89.4	Confident	91.4	Very high	38 Å²	38	66.3 Å²	66.3	23%	0.23	33%	0.329	C	S	.	.	S	Bend	trans	-135.4	143.7	-177.4	-61.4	0	0	0	0	111.6	R272 F275 L313 A315	R272-V277 WeakPolarHBondContact CA-O 3.48Å; F275-V277 PolarHBondContact O-N 2.99Å; V277-L313 HydrophobicContact CG2-CB 3.79Å; V277-L313 HydrophobicContact CG2-CD1 4.12Å; V277-L313 HydrophobicContact CG2-CG 4.39Å; V277-A315 HydrophobicContact CG1-CB 4.12Å
278	A	88.8	Confident	91.3	Very high	39 Å²	39	66.3 Å²	66.3	32%	0.322	33%	0.329	S	S	.	.			trans	-79.6	155.6	174.2	0	0	0	0	0	110.8	R272 V280	R272-A278 HydrophobicContact CB-CB 4.3Å; A278-V280 PolarHBondContact O-N 3.21Å; A278-V280 VanDerWaalsContact O-N 3.12Å
279	P	87.5	Confident	91.1	Very high	11 Å²	11	71.5 Å²	71.5	7%	0.071	35%	0.346	C	S	.	.			trans	-67.7	112.4	172.7	28.2	-31.7	0	0	0	109.4	D284 I285 L288 L313	P279-D284 HydrophobicContact CB-CB 4.26Å; P279-I285 HydrophobicContact CB-CG1 4.32Å; P279-I285 WeakPolarHBondContact O-CD1 3.28Å; P279-I285 WeakPolarHBondContact O-CG1 3.15Å; P279-L288 HydrophobicContact CG-CD2 3.87Å; P279-L313 HydrophobicContact CB-CD2 4.36Å
280	V	87.6	Confident	90.8	Very high	82 Å²	82	74 Å²	74	50%	0.497	36%	0.357	S	S	.	.			trans	-108	-23.1	178.9	-65.8	0	0	0	0	113	A278	A278-V280 PolarHBondContact O-N 3.21Å; A278-V280 VanDerWaalsContact O-N 3.12Å
281	L	87.8	Confident	90.8	Very high	49 Å²	49	70 Å²	70	26%	0.257	35%	0.346	S	S	.	.	S	Bend	trans	-66.8	138.1	175.4	-72.7	-174.5	0	0	0	110.7	E283 D284 I285 H312 H314	L281-E283 VanDerWaalsContact C-N 3.28Å; L281-E283 PolarHBondContact O-N 3.08Å; L281-D284 HydrophobicContact CB-CB 4.05Å; L281-D284 PolarHBondContact O-N 2.75Å; L281-I285 WeakPolarHBondContact O-CB 3.35Å; L281-I285 VanDerWaalsContact O-CG1 3.28Å; L281-I285 WeakPolarHBondContact O-CG1 3.5Å; L281-I285 PolarHBondContact O-N 3.39Å; L281-H312 HydrophobicContact CD1-CB 3.87Å; L281-H312 WeakPolarHBondContact CD1-O 3.36Å; L281-H314 VanDerWaalsContact CD1-CD2 3.49Å; L281-H314 WeakPolarHBondContact CD1-CD2 3.3Å
282	K	84.4	Confident	90.9	Very high	172 Å²	172	70 Å²	70	75%	0.748	35%	0.346	S	S	*	.	H	α-helix	trans	-60.7	-40.8	-179.8	-69.4	-176.2	179.9	179	0	111.4	H286	K282-H286 WeakPolarHBondContact O-CB 3.2Å; K282-H286 PolarHBondContact O-N 3.13Å
283	E	85.4	Confident	90.9	Very high	116 Å²	116	67.4 Å²	67.4	54%	0.542	34%	0.339	S	S	.	.	H	α-helix	trans	-65	-42.5	179.4	-64.9	73.1	-160.2	0	0	111.7	L281 H286 R287	L281-E283 VanDerWaalsContact C-N 3.28Å; L281-E283 PolarHBondContact O-N 3.08Å; E283-H286 PolarHBondContact O-N 2.81Å; E283-R287 WeakPolarHBondContact O-CG 3.31Å; E283-R287 PolarHBondContact O-N 2.81Å
284	D	91.1	Very high	90.9	Very high	1 Å²	1	63.7 Å²	63.7	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-68.9	-43.2	177.9	-79.1	-8	0	0	0	111.9	P279 L281 H286 R287 L288 L311 H312	P279-D284 HydrophobicContact CB-CB 4.26Å; L281-D284 HydrophobicContact CB-CB 4.05Å; L281-D284 PolarHBondContact O-N 2.75Å; D284-H286 VanDerWaalsContact C-N 3.27Å; D284-H286 PolarHBondContact O-N 3.41Å; D284-R287 PolarHBondContact O-N 2.96Å; D284-R287 IonicContact OD1-NH1 3.91Å; D284-L288 WeakPolarHBondContact O-CB 3.25Å; D284-L288 PolarHBondContact O-N 3.39Å; D284-L311 HydrophobicContact CB-CD2 3.89Å; D284-L311 WeakPolarHBondContact OD1-CA 3.2Å; D284-H312 PolarHBondContact OD1-N 3.12Å; D284-H312 IonicContact OD1-ND1 3.61Å; D284-H312 WeakPolarHBondContact OD2-CA 3.46Å; D284-H312 PolarHBondContact OD2-N 2.96Å; D284-H312 VanDerWaalsContact OD2-O 3.14Å
285	I	90.9	Very high	91	Very high	43 Å²	43	58.6 Å²	58.6	22%	0.221	31%	0.306	C	S	.	.	H	α-helix	trans	-58.1	-43.9	173.4	-70.5	167.1	0	0	0	109.8	F264 P279 L281 L288 R289	F264-I285 HydrophobicContact CE2-CG2 4.31Å; F264-I285 HydrophobicContact CZ-CG2 3.88Å; P279-I285 HydrophobicContact CB-CG1 4.32Å; P279-I285 WeakPolarHBondContact O-CD1 3.28Å; P279-I285 WeakPolarHBondContact O-CG1 3.15Å; L281-I285 WeakPolarHBondContact O-CB 3.35Å; L281-I285 VanDerWaalsContact O-CG1 3.28Å; L281-I285 WeakPolarHBondContact O-CG1 3.5Å; L281-I285 PolarHBondContact O-N 3.39Å; I285-L288 PolarHBondContact O-N 3.38Å; I285-R289 WeakPolarHBondContact O-CB 3.25Å; I285-R289 VanDerWaalsContact O-CG 3.28Å; I285-R289 WeakPolarHBondContact O-CG 3.38Å; I285-R289 PolarHBondContact O-N 3.27Å
286	H	85.5	Confident	91.3	Very high	88 Å²	88	56.2 Å²	56.2	41%	0.407	30%	0.295	S	S	.	.	H	α-helix	trans	-62.9	-49.7	178.6	-178.5	84.6	0	0	0	112	K282 E283 D284 L288 R289 Q290	K282-H286 WeakPolarHBondContact O-CB 3.2Å; K282-H286 PolarHBondContact O-N 3.13Å; E283-H286 PolarHBondContact O-N 2.81Å; D284-H286 VanDerWaalsContact C-N 3.27Å; D284-H286 PolarHBondContact O-N 3.41Å; H286-L288 VanDerWaalsContact C-N 3.33Å; H286-L288 PolarHBondContact O-N 3.44Å; H286-R289 WeakPolarHBondContact O-CB 3.42Å; H286-R289 PolarHBondContact O-N 3.34Å; H286-Q290 VanDerWaalsContact NE2-CD 3.3Å; H286-Q290 PolarHBondContact NE2-NE2 2.53Å; H286-Q290 VanDerWaalsContact NE2-NE2 3.11Å; H286-Q290 PolarHBondContact O-N 2.81Å
287	R	91.2	Very high	91.5	Very high	94 Å²	94	58 Å²	58	36%	0.355	29%	0.29	S	S	.	.	H	α-helix	trans	-58.6	-44.6	176.8	-73.7	176.1	-175.8	155.1	4.6	112	E283 D284 R289 Q290 A291 H312	E283-R287 WeakPolarHBondContact O-CG 3.31Å; E283-R287 PolarHBondContact O-N 2.81Å; D284-R287 PolarHBondContact O-N 2.96Å; D284-R287 IonicContact OD1-NH1 3.91Å; R287-R289 PolarHBondContact O-N 2.8Å; R287-Q290 PolarHBondContact O-N 3.34Å; R287-A291 PolarHBondContact O-N 2.96Å; R287-H312 PolarHBondContact NH1-CE1 2.87Å; R287-H312 PolarHBondContact NH1-ND1 3.34Å
288	L	95.3	Very high	91.8	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64	-40.7	178.4	-176.8	61.6	0	0	0	111.3	F264 V271 P279 D284 I285 H286 Q290 A291 V292 I307 V309 F332	F264-L288 HydrophobicContact CD2-CD2 4.18Å; F264-L288 HydrophobicContact CD2-CG 4.04Å; F264-L288 HydrophobicContact CE2-CB 4.06Å; F264-L288 HydrophobicContact CE2-CD2 3.73Å; F264-L288 HydrophobicContact CE2-CG 3.85Å; F264-L288 HydrophobicContact CZ-CD2 4.47Å; V271-L288 HydrophobicContact CG2-CD2 4.38Å; P279-L288 HydrophobicContact CG-CD2 3.87Å; D284-L288 WeakPolarHBondContact O-CB 3.25Å; D284-L288 PolarHBondContact O-N 3.39Å; I285-L288 PolarHBondContact O-N 3.38Å; H286-L288 VanDerWaalsContact C-N 3.33Å; H286-L288 PolarHBondContact O-N 3.44Å; L288-Q290 PolarHBondContact O-N 3.23Å; L288-A291 PolarHBondContact O-N 3.06Å; L288-V292 HydrophobicContact CD1-CG2 4.42Å; L288-V292 HydrophobicContact CG-CG2 4.47Å; L288-V292 WeakPolarHBondContact O-CB 3.49Å; L288-V292 VanDerWaalsContact O-CG2 3.23Å; L288-V292 WeakPolarHBondContact O-CG2 3.15Å; L288-V292 PolarHBondContact O-N 3.08Å; L288-I307 HydrophobicContact CD1-CG2 4.16Å; L288-V309 HydrophobicContact CD1-CG2 4.03Å; L288-F332 HydrophobicContact CD1-CD1 4.29Å; L288-F332 HydrophobicContact CD1-CE1 4.25Å
289	R	92.2	Very high	92.3	Very high	128 Å²	128	58 Å²	58	48%	0.483	28%	0.284	S	S	.	.	H	α-helix	trans	-60	-44	174.1	-77.1	176.3	-180	-136.3	-0.7	112.5	F264 I285 H286 R287 V292 E293	F264-R289 HydrophobicContact CD2-CG 3.62Å; F264-R289 HydrophobicContact CE2-CG 3.66Å; F264-R289 HydrophobicContact CG-CG 4.29Å; F264-R289 HydrophobicContact CZ-CG 4.38Å; I285-R289 WeakPolarHBondContact O-CB 3.25Å; I285-R289 VanDerWaalsContact O-CG 3.28Å; I285-R289 WeakPolarHBondContact O-CG 3.38Å; I285-R289 PolarHBondContact O-N 3.27Å; H286-R289 WeakPolarHBondContact O-CB 3.42Å; H286-R289 PolarHBondContact O-N 3.34Å; R287-R289 PolarHBondContact O-N 2.8Å; R289-V292 PolarHBondContact O-N 3.06Å; R289-E293 PolarHBondContact O-N 2.74Å
290	Q	90.2	Very high	92.6	Very high	114 Å²	114	58.8 Å²	58.8	53%	0.533	29%	0.288	S	S	.	.	H	α-helix	trans	-61.6	-44.4	177.1	-71.1	178.4	-42.3	0	0	111.6	H286 R287 L288 E293 A294	H286-Q290 VanDerWaalsContact NE2-CD 3.3Å; H286-Q290 PolarHBondContact NE2-NE2 2.53Å; H286-Q290 VanDerWaalsContact NE2-NE2 3.11Å; H286-Q290 PolarHBondContact O-N 2.81Å; R287-Q290 PolarHBondContact O-N 3.34Å; L288-Q290 PolarHBondContact O-N 3.23Å; Q290-E293 PolarHBondContact O-N 2.83Å; Q290-A294 PolarHBondContact O-N 3.14Å
291	A	96.6	Very high	92.9	Very high	18 Å²	18	61.1 Å²	61.1	15%	0.149	30%	0.297	C	S	.	.	H	α-helix	trans	-67.5	-35.3	178.1	0	0	0	0	0	112.9	R287 L288 A294 A295 I307 V309	R287-A291 PolarHBondContact O-N 2.96Å; L288-A291 PolarHBondContact O-N 3.06Å; A291-A294 PolarHBondContact O-N 3.16Å; A291-A295 WeakPolarHBondContact O-CB 3.44Å; A291-A295 PolarHBondContact O-N 3.19Å; A291-I307 HydrophobicContact CB-CG2 3.99Å; A291-V309 HydrophobicContact CB-CG1 3.33Å
292	V	97.6	Very high	93.4	Very high	1 Å²	1	63.7 Å²	63.7	1%	0.006	31%	0.307	C	S	.	.	H	α-helix	trans	-64.1	-44.3	173.3	163.7	0	0	0	0	111.5	S260 L263 F264 T267 L288 R289 A295 K296 I307	S260-V292 WeakPolarHBondContact O-CG1 3.35Å; L263-V292 HydrophobicContact CB-CG1 3.9Å; L263-V292 HydrophobicContact CD2-CG1 3.98Å; L263-V292 HydrophobicContact CG-CG1 3.85Å; F264-V292 HydrophobicContact CB-CG1 4.21Å; F264-V292 HydrophobicContact CB-CG2 4.4Å; F264-V292 HydrophobicContact CD2-CG2 4.45Å; T267-V292 HydrophobicContact CG2-CG2 4.19Å; T267-V292 WeakPolarHBondContact OG1-CG2 3.34Å; L288-V292 HydrophobicContact CD1-CG2 4.42Å; L288-V292 HydrophobicContact CG-CG2 4.47Å; L288-V292 WeakPolarHBondContact O-CB 3.49Å; L288-V292 VanDerWaalsContact O-CG2 3.23Å; L288-V292 WeakPolarHBondContact O-CG2 3.15Å; L288-V292 PolarHBondContact O-N 3.08Å; R289-V292 PolarHBondContact O-N 3.06Å; V292-A295 PolarHBondContact O-N 2.83Å; V292-K296 PolarHBondContact O-N 3.4Å; V292-I307 HydrophobicContact CG2-CD1 4.13Å
293	E	94.4	Very high	94	Very high	67 Å²	67	59.3 Å²	59.3	31%	0.313	30%	0.297	S	S	.	.	H	α-helix	trans	-62	-46.2	176	-176.5	61.8	-160.7	0	0	111.1	S260 R289 Q290 A295 K296 L297	S260-E293 WeakPolarHBondContact CB-OE2 3.17Å; S260-E293 PolarHBondContact OG-OE2 2.81Å; R289-E293 PolarHBondContact O-N 2.74Å; Q290-E293 PolarHBondContact O-N 2.83Å; E293-A295 VanDerWaalsContact C-N 3.31Å; E293-A295 PolarHBondContact O-N 3.46Å; E293-K296 PolarHBondContact O-N 3.27Å; E293-K296 WeakPolarHBondContact OE1-CE 3.32Å; E293-K296 IonicContact OE1-NZ 3.74Å; E293-K296 PolarHBondContact OE1-NZ 2.76Å; E293-K296 WeakPolarHBondContact OE2-CE 3.45Å; E293-K296 IonicContact OE2-NZ 2.77Å; E293-K296 PolarHBondContact OE2-NZ 2.96Å; E293-L297 HydrophobicContact CG-CD1 4.42Å; E293-L297 WeakPolarHBondContact O-CG 2.93Å; E293-L297 PolarHBondContact O-N 3.17Å
294	A	95	Very high	94.6	Very high	46 Å²	46	56 Å²	56	38%	0.38	29%	0.286	S	S	.	.	H	α-helix	trans	-59.2	-41.6	175.8	0	0	0	0	0	112	Q290 A291 L297 N298	Q290-A294 PolarHBondContact O-N 3.14Å; A291-A294 PolarHBondContact O-N 3.16Å; A294-L297 PolarHBondContact O-N 3.16Å; A294-N298 PolarHBondContact O-N 2.88Å; A294-N298 PolarHBondContact O-ND2 3.31Å
295	A	97.9	Very high	94.9	Very high	1 Å²	1	56.2 Å²	56.2	1%	0.008	29%	0.289	C	S	.	.	H	α-helix	trans	-64	-44	175.6	0	0	0	0	0	112.2	A291 V292 E293 L297 N298 L299 A305 I307	A291-A295 WeakPolarHBondContact O-CB 3.44Å; A291-A295 PolarHBondContact O-N 3.19Å; V292-A295 PolarHBondContact O-N 2.83Å; E293-A295 VanDerWaalsContact C-N 3.31Å; E293-A295 PolarHBondContact O-N 3.46Å; A295-L297 VanDerWaalsContact C-N 3.32Å; A295-L297 PolarHBondContact O-N 3Å; A295-N298 PolarHBondContact O-N 3.37Å; A295-L299 WeakPolarHBondContact O-CB 3.29Å; A295-L299 VanDerWaalsContact O-CG 3.24Å; A295-L299 WeakPolarHBondContact O-CG 3.47Å; A295-L299 PolarHBondContact O-N 3Å; A295-A305 HydrophobicContact CB-CB 4.02Å; A295-I307 HydrophobicContact CB-CD1 3.75Å; A295-I307 HydrophobicContact CB-CG1 3.43Å; A295-I307 VanDerWaalsContact CB-CG1 3.43Å
296	K	97.3	Very high	95.3	Very high	11 Å²	11	59 Å²	59	5%	0.048	30%	0.303	C	S	.	.	H	α-helix	trans	-57.3	-44.9	174.5	-179	-166.5	68.1	-173.6	0	111.8	G256 F259 S260 V292 E293 L299 T300 F341	G256-K296 PolarHBondContact O-NZ 2.71Å; F259-K296 HydrophobicContact CB-CD 4.39Å; S260-K296 WeakPolarHBondContact OG-CD 3.32Å; S260-K296 WeakPolarHBondContact OG-CE 3.48Å; S260-K296 PolarHBondContact OG-NZ 3.5Å; V292-K296 PolarHBondContact O-N 3.4Å; E293-K296 PolarHBondContact O-N 3.27Å; E293-K296 WeakPolarHBondContact OE1-CE 3.32Å; E293-K296 IonicContact OE1-NZ 3.74Å; E293-K296 PolarHBondContact OE1-NZ 2.76Å; E293-K296 WeakPolarHBondContact OE2-CE 3.45Å; E293-K296 IonicContact OE2-NZ 2.77Å; E293-K296 PolarHBondContact OE2-NZ 2.96Å; K296-L299 PolarHBondContact O-N 3.33Å; K296-T300 PolarHBondContact O-N 2.81Å; K296-T300 PolarHBondContact O-OG1 2.62Å; K296-F341 HydrophobicContact CD-CE2 4.33Å; K296-F341 HydrophobicContact CD-CZ 4.19Å; K296-F341 HydrophobicContact CG-CE2 3.9Å; K296-F341 HydrophobicContact CG-CZ 3.79Å
297	L	95	Very high	95.8	Very high	99 Å²	99	54.9 Å²	54.9	52%	0.518	28%	0.284	S	S	.	.	H	α-helix	trans	-61.8	-44.5	176.6	-66.4	172.1	0	0	0	110.9	E293 A294 A295 L299 T300	E293-L297 HydrophobicContact CG-CD1 4.42Å; E293-L297 WeakPolarHBondContact O-CG 2.93Å; E293-L297 PolarHBondContact O-N 3.17Å; A294-L297 PolarHBondContact O-N 3.16Å; A295-L297 VanDerWaalsContact C-N 3.32Å; A295-L297 PolarHBondContact O-N 3Å; L297-L299 PolarHBondContact O-N 2.8Å; L297-T300 WeakPolarHBondContact O-CB 3.43Å; L297-T300 PolarHBondContact O-N 2.75Å; L297-T300 VanDerWaalsContact O-N 3.16Å; L297-T300 PolarHBondContact O-OG1 3.36Å
298	N	96.9	Very high	96.1	Very high	75 Å²	75	52.7 Å²	52.7	40%	0.401	28%	0.283	S	S	.	.	H	α-helix	trans	-63	-39.9	175.9	-74.2	-25.2	0	0	0	112.7	A294 A295 T300 L301 H302 A305	A294-N298 PolarHBondContact O-N 2.88Å; A294-N298 PolarHBondContact O-ND2 3.31Å; A295-N298 PolarHBondContact O-N 3.37Å; N298-T300 PolarHBondContact O-N 2.88Å; N298-L301 PolarHBondContact O-N 3.12Å; N298-H302 PolarHBondContact O-N 3.46Å; N298-A305 HydrophobicContact CB-CB 3.84Å
299	L	98	Very high	96.1	Very high	3 Å²	3	53 Å²	53	2%	0.016	29%	0.285	C	S	.	.	H	α-helix	trans	-63.4	-19.7	177.1	-72.4	175.6	0	0	0	113.2	A295 K296 L297 L301 H302 A305 V336 R338 F341	A295-L299 WeakPolarHBondContact O-CB 3.29Å; A295-L299 VanDerWaalsContact O-CG 3.24Å; A295-L299 WeakPolarHBondContact O-CG 3.47Å; A295-L299 PolarHBondContact O-N 3Å; K296-L299 PolarHBondContact O-N 3.33Å; L297-L299 PolarHBondContact O-N 2.8Å; L299-L301 VanDerWaalsContact C-N 3.28Å; L299-H302 CarbonylContact C-O 3.57Å; L299-H302 WeakPolarHBondContact CA-O 3.33Å; L299-A305 HydrophobicContact CD2-CB 3.99Å; L299-A305 HydrophobicContact CG-CB 3.94Å; L299-V336 HydrophobicContact CD1-CG1 4.11Å; L299-R338 HydrophobicContact CD2-CB 4.24Å; L299-R338 VanDerWaalsContact O-CZ 3.31Å; L299-R338 PolarHBondContact O-NE 3.2Å; L299-R338 PolarHBondContact O-NH2 3.47Å; L299-F341 HydrophobicContact CD1-CB 3.73Å; L299-F341 HydrophobicContact CD1-CG 4.11Å
300	T	94.5	Very high	96.2	Very high	27 Å²	27	49.7 Å²	49.7	17%	0.166	28%	0.28	C	S	.	.	H	α-helix	trans	-67.5	-31.8	172.4	-57.9	0	0	0	0	111.5	K296 L297 N298 R338 R381	K296-T300 PolarHBondContact O-N 2.81Å; K296-T300 PolarHBondContact O-OG1 2.62Å; L297-T300 WeakPolarHBondContact O-CB 3.43Å; L297-T300 PolarHBondContact O-N 2.75Å; L297-T300 VanDerWaalsContact O-N 3.16Å; L297-T300 PolarHBondContact O-OG1 3.36Å; N298-T300 PolarHBondContact O-N 2.88Å; T300-R338 PolarHBondContact O-NH2 2.82Å; T300-R381 HydrophobicContact CG2-CB 3.65Å; T300-R381 VanDerWaalsContact CG2-O 3.3Å; T300-R381 WeakPolarHBondContact CG2-O 3.28Å
301	L	94.4	Very high	96.2	Very high	131 Å²	131	44.3 Å²	44.3	69%	0.686	26%	0.255	S	S	*	.	H	α-helix	trans	-101.7	-35	-177.7	-59.2	177.5	0	0	0	112.5	N298 L299	N298-L301 PolarHBondContact O-N 3.12Å; L299-L301 VanDerWaalsContact C-N 3.28Å
302	H	97.2	Very high	95.9	Very high	102 Å²	102	46.1 Å²	46.1	47%	0.472	26%	0.26	S	S	.	.	S	Bend	trans	-119.2	153.5	-171.7	-56.4	-60.4	0	0	0	111.7	N298 L299 S304 R338	N298-H302 PolarHBondContact O-N 3.46Å; L299-H302 CarbonylContact C-O 3.57Å; L299-H302 WeakPolarHBondContact CA-O 3.33Å; H302-S304 VanDerWaalsContact C-N 3.28Å; H302-S304 PolarHBondContact O-N 3.09Å; H302-R338 VanDerWaalsContact C-NH2 3.27Å; H302-R338 PolarHBondContact O-NE 3.03Å; H302-R338 PolarHBondContact O-NH2 3.45Å
303	P	97.5	Very high	95.1	Very high	81 Å²	81	47.2 Å²	47.2	53%	0.526	27%	0.266	S	S	.	.	S	Bend	trans	-73.1	-18	177.8	29.7	-35.3	0	0	0	113.3	S337 R338	P303-S337 CarbonylContact O-C 3.58Å; P303-S337 WeakPolarHBondContact O-CA 3.36Å; P303-R338 PolarHBondContact O-N 3.08Å
304	S	97.9	Very high	94.1	Very high	45 Å²	45	47.7 Å²	47.7	32%	0.315	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	161.2	174.1	71.2	0	0	0	0	112.1	H302 E335 V336	H302-S304 VanDerWaalsContact C-N 3.28Å; H302-S304 PolarHBondContact O-N 3.09Å; S304-E335 VanDerWaalsContact CB-OE1 3.25Å; S304-E335 WeakPolarHBondContact CB-OE1 3.49Å; S304-E335 PolarHBondContact OG-OE1 2.8Å; S304-V336 CarbonylContact C-O 3.57Å; S304-V336 VanDerWaalsContact CA-O 3.26Å; S304-V336 WeakPolarHBondContact CA-O 3.5Å
305	A	98.3	Very high	92.3	Very high	7 Å²	7	47.8 Å²	47.8	6%	0.058	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	142.9	176	0	0	0	0	0	110.9	A295 N298 L299 V336	A295-A305 HydrophobicContact CB-CB 4.02Å; N298-A305 HydrophobicContact CB-CB 3.84Å; L299-A305 HydrophobicContact CD2-CB 3.99Å; L299-A305 HydrophobicContact CG-CB 3.94Å; A305-V336 PolarHBondContact N-O 3.01Å; A305-V336 PolarHBondContact O-N 2.86Å
306	L	97.7	Very high	89.9	Confident	101 Å²	101	56.4 Å²	56.4	53%	0.529	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	126.3	175	-177.5	68.4	0	0	0	110.4	Q333	L306-Q333 HydrophobicContact CD1-CB 4.47Å
307	I	97.9	Very high	87.4	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.005	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	118.1	167.8	-64.9	173.3	0	0	0	107.1	T267 L288 A291 V292 A295 F332 Q333 V334 V336	T267-I307 HydrophobicContact CG2-CD1 3.49Å; T267-I307 VanDerWaalsContact CG2-CD1 3.49Å; L288-I307 HydrophobicContact CD1-CG2 4.16Å; A291-I307 HydrophobicContact CB-CG2 3.99Å; V292-I307 HydrophobicContact CG2-CD1 4.13Å; A295-I307 HydrophobicContact CB-CD1 3.75Å; A295-I307 HydrophobicContact CB-CG1 3.43Å; A295-I307 VanDerWaalsContact CB-CG1 3.43Å; I307-F332 HydrophobicContact CG2-CE1 4.31Å; I307-Q333 CarbonylContact O-C 3.6Å; I307-Q333 VanDerWaalsContact O-CA 3.28Å; I307-Q333 WeakPolarHBondContact O-CA 3.39Å; I307-V334 HydrophobicContact CB-CG1 3.93Å; I307-V334 HydrophobicContact CG2-CG1 4.44Å; I307-V334 PolarHBondContact N-O 3.12Å; I307-V334 PolarHBondContact O-N 3.35Å; I307-V336 HydrophobicContact CD1-CG2 3.86Å
308	S	96	Very high	85	Confident	48 Å²	48	60.5 Å²	60.5	34%	0.336	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	114.3	-175	-179.1	0	0	0	0	110.4	H331 F332 Q333	S308-H331 PolarHBondContact OG-CE1 3.27Å; S308-H331 VanDerWaalsContact OG-CE1 3.25Å; S308-H331 PolarHBondContact OG-NE2 2.86Å; S308-F332 WeakPolarHBondContact CA-O 3.48Å; S308-Q333 PolarHBondContact OG-NE2 3.07Å
309	V	95.3	Very high	82.5	Confident	8 Å²	8	60.6 Å²	60.6	5%	0.048	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	140.2	-176.1	-70.1	0	0	0	0	112.7	L288 A291 L311 F332	L288-V309 HydrophobicContact CD1-CG2 4.03Å; A291-V309 HydrophobicContact CB-CG1 3.33Å; V309-L311 HydrophobicContact CB-CD2 4.39Å; V309-L311 HydrophobicContact CG2-CD1 4.3Å; V309-L311 HydrophobicContact CG2-CD2 3.81Å; V309-L311 HydrophobicContact CG2-CG 3.99Å; V309-F332 HydrophobicContact CG2-CB 4.26Å; V309-F332 HydrophobicContact CG2-CD1 4.08Å; V309-F332 PolarHBondContact N-O 3.29Å; V309-F332 PolarHBondContact O-N 3.12Å
310	P	93.8	Very high	80.1	Confident	58 Å²	58	64.4 Å²	64.4	38%	0.377	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	128.3	165.5	31.7	-31.7	0	0	0	110.8	P329 V330	P310-P329 HydrophobicContact CB-CB 4.3Å; P310-V330 CarbonylContact C-O 3.58Å; P310-V330 WeakPolarHBondContact CA-O 3.12Å
311	L	92.1	Very high	77.8	Confident	0 Å²	0	68 Å²	68	0%	0	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	135.9	-178.5	-57.6	177.6	0	0	0	111	V271 D284 V309 L313 P329 V330 F332	V271-L311 HydrophobicContact CG1-CD1 3.86Å; V271-L311 HydrophobicContact CG2-CD1 3.85Å; D284-L311 HydrophobicContact CB-CD2 3.89Å; D284-L311 WeakPolarHBondContact OD1-CA 3.2Å; V309-L311 HydrophobicContact CB-CD2 4.39Å; V309-L311 HydrophobicContact CG2-CD1 4.3Å; V309-L311 HydrophobicContact CG2-CD2 3.81Å; V309-L311 HydrophobicContact CG2-CG 3.99Å; L311-L313 HydrophobicContact CB-CD2 3.9Å; L311-L313 HydrophobicContact CB-CG 3.97Å; L311-L313 HydrophobicContact CD1-CD2 4.12Å; L311-L313 PolarHBondContact O-N 3.43Å; L311-P329 CarbonylContact O-C 3.51Å; L311-P329 VanDerWaalsContact O-CA 3.24Å; L311-P329 WeakPolarHBondContact O-CA 3.18Å; L311-V330 HydrophobicContact CB-CG2 4.17Å; L311-V330 PolarHBondContact N-O 3.15Å; L311-V330 WeakPolarHBondContact O-CG2 3.35Å; L311-V330 PolarHBondContact O-N 3.04Å; L311-F332 HydrophobicContact CD1-CB 3.77Å; L311-F332 HydrophobicContact CD1-CG 4.35Å; L311-F332 HydrophobicContact CG-CB 4.35Å
312	H	88.5	Confident	75.5	Confident	56 Å²	56	67.7 Å²	67.7	26%	0.259	43%	0.433	S	S	.	.			trans	-97.1	67.8	174.2	-57.5	72.7	0	0	0	108.3	L281 D284 R287 H314	L281-H312 HydrophobicContact CD1-CB 3.87Å; L281-H312 WeakPolarHBondContact CD1-O 3.36Å; D284-H312 PolarHBondContact OD1-N 3.12Å; D284-H312 IonicContact OD1-ND1 3.61Å; D284-H312 WeakPolarHBondContact OD2-CA 3.46Å; D284-H312 PolarHBondContact OD2-N 2.96Å; D284-H312 VanDerWaalsContact OD2-O 3.14Å; R287-H312 PolarHBondContact NH1-CE1 2.87Å; R287-H312 PolarHBondContact NH1-ND1 3.34Å; H312-H314 PolarHBondContact O-N 3.21Å; H312-H314 VanDerWaalsContact O-N 3.09Å
313	L	81.8	Confident	73.3	Confident	24 Å²	24	72.6 Å²	72.6	13%	0.126	46%	0.456	C	S	.	.			trans	-65.1	112.6	-178.3	-60	-177.4	0	0	0	110.2	V271 F275 V277 P279 L311 V330	V271-L313 HydrophobicContact CG1-CD1 3.92Å; V271-L313 HydrophobicContact CG1-CD2 3.87Å; F275-L313 HydrophobicContact CB-CD1 3.34Å; F275-L313 HydrophobicContact CD1-CD1 4.37Å; F275-L313 HydrophobicContact CD2-CD1 3.48Å; F275-L313 VanDerWaalsContact CD2-CD1 3.48Å; F275-L313 HydrophobicContact CE2-CD1 4.32Å; F275-L313 HydrophobicContact CG-CD1 3.49Å; F275-L313 VanDerWaalsContact CG-CD1 3.49Å; V277-L313 HydrophobicContact CG2-CB 3.79Å; V277-L313 HydrophobicContact CG2-CD1 4.12Å; V277-L313 HydrophobicContact CG2-CG 4.39Å; P279-L313 HydrophobicContact CB-CD2 4.36Å; L311-L313 HydrophobicContact CB-CD2 3.9Å; L311-L313 HydrophobicContact CB-CG 3.97Å; L311-L313 HydrophobicContact CD1-CD2 4.12Å; L311-L313 PolarHBondContact O-N 3.43Å; L313-V330 HydrophobicContact CB-CG2 4.45Å; L313-V330 HydrophobicContact CD1-CG2 3.54Å; L313-V330 HydrophobicContact CG-CG2 3.73Å
314	H	73.4	Confident	71.2	Confident	77 Å²	77	72.2 Å²	72.2	36%	0.356	47%	0.466	S	S	.	.			trans	-95.5	124.7	168.7	-66	-61.1	0	0	0	109.7	L281 H312	L281-H314 VanDerWaalsContact CD1-CD2 3.49Å; L281-H314 WeakPolarHBondContact CD1-CD2 3.3Å; H312-H314 PolarHBondContact O-N 3.21Å; H312-H314 VanDerWaalsContact O-N 3.09Å
315	A	56.3	Low	69.1	Low	49 Å²	49	76.6 Å²	76.6	41%	0.405	49%	0.491	S	S	.	.			trans	-73.6	133.4	166.7	0	0	0	0	0	108.5	V277 D317	V277-A315 HydrophobicContact CG1-CB 4.12Å; A315-D317 VanDerWaalsContact C-OD1 3.28Å; A315-D317 WeakPolarHBondContact CB-OD1 3.49Å; A315-D317 PolarHBondContact O-N 2.62Å
316	H	48.6	Very low	67.3	Low	181 Å²	181	79.6 Å²	79.6	84%	0.838	52%	0.516	S	S	*	.			trans	-76	63.5	177.2	-119.9	-59.6	0	0	0	108.6	G318	H316-G318 PolarHBondContact O-N 3.17Å
317	D	44.7	Very low	65.9	Low	103 Å²	103	78.3 Å²	78.3	55%	0.551	51%	0.514	S	S	*	.			trans	-88.9	109.9	-178	-51.1	-2.3	0	0	0	105.7	A315 S319	A315-D317 VanDerWaalsContact C-OD1 3.28Å; A315-D317 WeakPolarHBondContact CB-OD1 3.49Å; A315-D317 PolarHBondContact O-N 2.62Å; D317-S319 PolarHBondContact O-N 2.96Å
318	G	44.4	Very low	65	Low	93 Å²	93	83.5 Å²	83.5	96%	0.959	55%	0.548	S	S	*	.	S	Bend	trans	-61.5	13.5	170.1	0	0	0	0	0	114.5	H316	H316-G318 PolarHBondContact O-N 3.17Å
319	S	44.1	Very low	64.4	Low	77 Å²	77	84.4 Å²	84.4	54%	0.538	55%	0.552	S	S	.	*	S	Bend	trans	-104.1	101	170.5	54.5	0	0	0	0	108.9	D317 S321	D317-S319 PolarHBondContact O-N 2.96Å; S319-S321 PolarHBondContact O-N 2.92Å
320	G	48.1	Very low	64.2	Low	84 Å²	84	86.4 Å²	86.4	87%	0.866	56%	0.564	S	S	*	*			trans	-47.5	107.8	172.3	0	0	0	0	0	110.9
321	S	46.2	Very low	64.2	Low	101 Å²	101	88.4 Å²	88.4	71%	0.706	57%	0.569	S	S	*	*			trans	-79.1	139.1	161.7	-62.8	0	0	0	0	107.4	S319	S319-S321 PolarHBondContact O-N 2.92Å
322	P	46.9	Very low	64.4	Low	126 Å²	126	88.5 Å²	88.5	82%	0.818	57%	0.569	S	S	*	*			trans	-61.9	146	-172.8	-5.2	16.3	0	0	0	110.9	G324	P322-G324 PolarHBondContact O-N 3.21Å
323	E	50.6	Low	64.8	Low	205 Å²	205	90.7 Å²	90.7	96%	0.958	58%	0.58	S	S	*	*	S	Bend	trans	-43.7	126	170.6	-66.9	174.4	150.2	0	0	111.3
324	G	53.1	Low	65.5	Low	72 Å²	72	90.5 Å²	90.5	74%	0.742	58%	0.579	S	S	*	*	S	Bend	trans	163.6	-40.5	161	0	0	0	0	0	118.2	P322	P322-G324 PolarHBondContact O-N 3.21Å
325	T	53.8	Low	66.7	Low	137 Å²	137	93 Å²	93	84%	0.84	59%	0.591	S	S	*	*			trans	-150.1	110.9	-174.9	28.2	0	0	0	0	111.3
326	A	60.8	Low	68.7	Low	71 Å²	71	90.7 Å²	90.7	59%	0.587	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-57.1	138.3	166.2	0	0	0	0	0	109.1
327	P	67.9	Low	71.1	Confident	73 Å²	73	84 Å²	84	47%	0.474	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-55.8	145.9	174.4	22.1	-31.1	0	0	0	110
328	P	78	Confident	73.6	Confident	110 Å²	110	81.7 Å²	81.7	71%	0.714	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-59.5	146	179	26.1	-34	0	0	0	110	V330	P328-V330 PolarHBondContact O-N 3.33Å
329	P	84.6	Confident	76.2	Confident	67 Å²	67	83 Å²	83	44%	0.435	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-57.9	136.3	179.2	21	-30.6	0	0	0	110.8	P310 L311	P310-P329 HydrophobicContact CB-CB 4.3Å; L311-P329 CarbonylContact O-C 3.51Å; L311-P329 VanDerWaalsContact O-CA 3.24Å; L311-P329 WeakPolarHBondContact O-CA 3.18Å
330	V	90.3	Very high	78.8	Confident	50 Å²	50	80.9 Å²	80.9	30%	0.303	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	149.4	168.5	-60.3	0	0	0	0	109.4	F275 P310 L311 L313 P328	F275-V330 HydrophobicContact CD1-CB 4.34Å; F275-V330 HydrophobicContact CD1-CG1 4.44Å; F275-V330 HydrophobicContact CD1-CG2 4.21Å; F275-V330 HydrophobicContact CD2-CG2 4.37Å; F275-V330 HydrophobicContact CE1-CB 3.92Å; F275-V330 HydrophobicContact CE1-CG1 4.37Å; F275-V330 HydrophobicContact CE1-CG2 4.02Å; F275-V330 HydrophobicContact CE2-CG2 4.17Å; F275-V330 HydrophobicContact CG-CG2 4.37Å; F275-V330 HydrophobicContact CZ-CB 4.18Å; F275-V330 HydrophobicContact CZ-CG2 4Å; P310-V330 CarbonylContact C-O 3.58Å; P310-V330 WeakPolarHBondContact CA-O 3.12Å; L311-V330 HydrophobicContact CB-CG2 4.17Å; L311-V330 PolarHBondContact N-O 3.15Å; L311-V330 WeakPolarHBondContact O-CG2 3.35Å; L311-V330 PolarHBondContact O-N 3.04Å; L313-V330 HydrophobicContact CB-CG2 4.45Å; L313-V330 HydrophobicContact CD1-CG2 3.54Å; L313-V330 HydrophobicContact CG-CG2 3.73Å; P328-V330 PolarHBondContact O-N 3.33Å
331	H	93.7	Very high	81.2	Confident	101 Å²	101	77.1 Å²	77.1	47%	0.468	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	110.7	176.7	-161.6	56	0	0	0	109.7	S308 Q333	S308-H331 PolarHBondContact OG-CE1 3.27Å; S308-H331 VanDerWaalsContact OG-CE1 3.25Å; S308-H331 PolarHBondContact OG-NE2 2.86Å; H331-Q333 PolarHBondContact CD2-NE2 3.29Å; H331-Q333 PolarHBondContact NE2-NE2 2.87Å
332	F	96.4	Very high	83.7	Confident	1 Å²	1	74.5 Å²	74.5	0%	0.004	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	130.3	175.3	175.9	-115.7	0	0	0	109.9	R270 V271 F275 L288 I307 S308 V309 L311 V334	R270-F332 HydrophobicContact CB-CE2 4.15Å; R270-F332 HydrophobicContact CB-CZ 3.9Å; V271-F332 HydrophobicContact CG2-CB 4.49Å; V271-F332 HydrophobicContact CG2-CD1 3.69Å; V271-F332 HydrophobicContact CG2-CD2 3.76Å; V271-F332 HydrophobicContact CG2-CE1 3.68Å; V271-F332 HydrophobicContact CG2-CE2 3.75Å; V271-F332 HydrophobicContact CG2-CG 3.71Å; V271-F332 HydrophobicContact CG2-CZ 3.7Å; F275-F332 HydrophobicContact CE2-CB 3.93Å; F275-F332 AromaticContact CE2-CD2 3.77Å; F275-F332 HydrophobicContact CE2-CD2 3.77Å; F275-F332 HydrophobicContact CE2-CG 4.28Å; F275-F332 HydrophobicContact CZ-CB 4.43Å; L288-F332 HydrophobicContact CD1-CD1 4.29Å; L288-F332 HydrophobicContact CD1-CE1 4.25Å; I307-F332 HydrophobicContact CG2-CE1 4.31Å; S308-F332 WeakPolarHBondContact CA-O 3.48Å; V309-F332 HydrophobicContact CG2-CB 4.26Å; V309-F332 HydrophobicContact CG2-CD1 4.08Å; V309-F332 PolarHBondContact N-O 3.29Å; V309-F332 PolarHBondContact O-N 3.12Å; L311-F332 HydrophobicContact CD1-CB 3.77Å; L311-F332 HydrophobicContact CD1-CG 4.35Å; L311-F332 HydrophobicContact CG-CB 4.35Å; F332-V334 HydrophobicContact CE1-CB 4.27Å; F332-V334 HydrophobicContact CE1-CG1 3.55Å; F332-V334 HydrophobicContact CE2-CB 4.25Å; F332-V334 HydrophobicContact CE2-CG1 4.36Å; F332-V334 HydrophobicContact CZ-CB 3.74Å; F332-V334 HydrophobicContact CZ-CG1 3.4Å
333	Q	97.2	Very high	86.1	Confident	103 Å²	103	75 Å²	75	48%	0.481	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	129.3	174.8	-69.3	-170.2	-10.1	0	0	110.2	L306 I307 S308 H331	L306-Q333 HydrophobicContact CD1-CB 4.47Å; I307-Q333 CarbonylContact O-C 3.6Å; I307-Q333 VanDerWaalsContact O-CA 3.28Å; I307-Q333 WeakPolarHBondContact O-CA 3.39Å; S308-Q333 PolarHBondContact OG-NE2 3.07Å; H331-Q333 PolarHBondContact CD2-NE2 3.29Å; H331-Q333 PolarHBondContact NE2-NE2 2.87Å
334	V	97.6	Very high	88.4	Confident	19 Å²	19	67.3 Å²	67.3	12%	0.115	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	133	173.3	66.7	0	0	0	0	110.3	T267 I307 F332 V336	T267-V334 HydrophobicContact CG2-CG1 4.21Å; I307-V334 HydrophobicContact CB-CG1 3.93Å; I307-V334 HydrophobicContact CG2-CG1 4.44Å; I307-V334 PolarHBondContact N-O 3.12Å; I307-V334 PolarHBondContact O-N 3.35Å; F332-V334 HydrophobicContact CE1-CB 4.27Å; F332-V334 HydrophobicContact CE1-CG1 3.55Å; F332-V334 HydrophobicContact CE2-CB 4.25Å; F332-V334 HydrophobicContact CE2-CG1 4.36Å; F332-V334 HydrophobicContact CZ-CB 3.74Å; F332-V334 HydrophobicContact CZ-CG1 3.4Å; V334-V336 HydrophobicContact CG1-CG2 4.38Å
335	E	97.9	Very high	90.5	Very high	130 Å²	130	63.9 Å²	63.9	61%	0.607	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	135.1	169.1	-171.8	174.1	-167.3	0	0	109.7	S304	S304-E335 VanDerWaalsContact CB-OE1 3.25Å; S304-E335 WeakPolarHBondContact CB-OE1 3.49Å; S304-E335 PolarHBondContact OG-OE1 2.8Å
336	V	98.2	Very high	92.6	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	132.2	177.7	-178.7	0	0	0	0	108.2	L263 Y266 L299 S304 A305 I307 V334 L340	L263-V336 HydrophobicContact CD1-CG1 3.82Å; L263-V336 HydrophobicContact CD1-CG2 4.3Å; Y266-V336 HydrophobicContact CE1-CG2 4.37Å; L299-V336 HydrophobicContact CD1-CG1 4.11Å; S304-V336 CarbonylContact C-O 3.57Å; S304-V336 VanDerWaalsContact CA-O 3.26Å; S304-V336 WeakPolarHBondContact CA-O 3.5Å; A305-V336 PolarHBondContact N-O 3.01Å; A305-V336 PolarHBondContact O-N 2.86Å; I307-V336 HydrophobicContact CD1-CG2 3.86Å; V334-V336 HydrophobicContact CG1-CG2 4.38Å; V336-L340 HydrophobicContact CG1-CD2 4.12Å
337	S	98.5	Very high	94.4	Very high	42 Å²	42	62.6 Å²	62.6	29%	0.294	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	155.9	174.3	59.6	0	0	0	0	111.9	P303 E339 L340 F341	P303-S337 CarbonylContact O-C 3.58Å; P303-S337 WeakPolarHBondContact O-CA 3.36Å; S337-E339 VanDerWaalsContact C-N 3.29Å; S337-E339 WeakPolarHBondContact CB-OE2 3.44Å; S337-E339 PolarHBondContact O-N 3.48Å; S337-L340 PolarHBondContact O-N 2.86Å; S337-L340 WeakPolarHBondContact OG-CB 3.49Å; S337-L340 PolarHBondContact OG-N 3.41Å; S337-F341 PolarHBondContact O-N 2.89Å; S337-F341 VanDerWaalsContact O-N 3.14Å
338	R	98.4	Very high	95.7	Very high	53 Å²	53	59.9 Å²	59.9	20%	0.2	31%	0.306	C	S	.	.	H	α-helix	trans	-60.4	-40.9	174.8	-179.3	-175.2	-64.5	167.2	-0	111	L299 T300 H302 P303 L340 F341 E342	L299-R338 HydrophobicContact CD2-CB 4.24Å; L299-R338 VanDerWaalsContact O-CZ 3.31Å; L299-R338 PolarHBondContact O-NE 3.2Å; L299-R338 PolarHBondContact O-NH2 3.47Å; T300-R338 PolarHBondContact O-NH2 2.82Å; H302-R338 VanDerWaalsContact C-NH2 3.27Å; H302-R338 PolarHBondContact O-NE 3.03Å; H302-R338 PolarHBondContact O-NH2 3.45Å; P303-R338 PolarHBondContact O-N 3.08Å; R338-L340 PolarHBondContact O-N 2.98Å; R338-F341 WeakPolarHBondContact O-CB 3.46Å; R338-F341 PolarHBondContact O-N 2.77Å; R338-F341 VanDerWaalsContact O-N 3.11Å; R338-E342 WeakPolarHBondContact CD-OE1 3.41Å; R338-E342 HydrophobicContact CG-CG 4.24Å; R338-E342 VanDerWaalsContact CG-OE1 3.31Å; R338-E342 WeakPolarHBondContact CG-OE1 3.32Å; R338-E342 WeakPolarHBondContact O-CG 3.42Å; R338-E342 PolarHBondContact O-N 2.73Å
339	E	98.3	Very high	96.7	Very high	120 Å²	120	54.8 Å²	54.8	56%	0.561	27%	0.273	S	S	*	.	H	α-helix	trans	-58.8	-47.9	-179	-64.6	71.6	-157.8	0	0	111	S337 E342 E343	S337-E339 VanDerWaalsContact C-N 3.29Å; S337-E339 WeakPolarHBondContact CB-OE2 3.44Å; S337-E339 PolarHBondContact O-N 3.48Å; E339-E342 PolarHBondContact O-N 3.5Å; E339-E343 PolarHBondContact O-N 3.02Å
340	L	98.4	Very high	97.3	Very high	33 Å²	33	55.9 Å²	55.9	17%	0.173	28%	0.275	C	S	.	.	H	α-helix	trans	-59.8	-45	173.2	174.5	64.2	0	0	0	112.3	Y266 V336 S337 R338 E342 E343 L344	Y266-L340 HydrophobicContact CD1-CD2 4.5Å; Y266-L340 HydrophobicContact CE1-CD2 3.76Å; Y266-L340 HydrophobicContact CE2-CD1 4.43Å; Y266-L340 HydrophobicContact CE2-CD2 4.03Å; Y266-L340 VanDerWaalsContact CZ-CD2 3.46Å; Y266-L340 WeakPolarHBondContact OH-CD2 3.21Å; V336-L340 HydrophobicContact CG1-CD2 4.12Å; S337-L340 PolarHBondContact O-N 2.86Å; S337-L340 WeakPolarHBondContact OG-CB 3.49Å; S337-L340 PolarHBondContact OG-N 3.41Å; R338-L340 PolarHBondContact O-N 2.98Å; L340-E342 PolarHBondContact O-N 3.39Å; L340-E343 PolarHBondContact O-N 3.21Å; L340-L344 HydrophobicContact CD1-CD1 4.27Å; L340-L344 HydrophobicContact CD1-CG 4.12Å; L340-L344 HydrophobicContact CG-CD1 4.15Å; L340-L344 HydrophobicContact CG-CG 4.44Å; L340-L344 VanDerWaalsContact O-CG 3.25Å; L340-L344 WeakPolarHBondContact O-CG 3.48Å; L340-L344 PolarHBondContact O-N 3.23Å
341	F	98.6	Very high	97.6	Very high	5 Å²	5	57.7 Å²	57.7	2%	0.022	28%	0.278	C	S	.	.	H	α-helix	trans	-59.9	-39.4	176.3	168.2	-101.1	0	0	0	111.5	F259 L263 K296 L299 S337 R338 N345 F349 I382	F259-F341 HydrophobicContact CB-CE2 3.98Å; F259-F341 HydrophobicContact CB-CZ 3.85Å; L263-F341 HydrophobicContact CB-CD2 4.45Å; L263-F341 HydrophobicContact CD2-CD2 4.2Å; K296-F341 HydrophobicContact CD-CE2 4.33Å; K296-F341 HydrophobicContact CD-CZ 4.19Å; K296-F341 HydrophobicContact CG-CE2 3.9Å; K296-F341 HydrophobicContact CG-CZ 3.79Å; L299-F341 HydrophobicContact CD1-CB 3.73Å; L299-F341 HydrophobicContact CD1-CG 4.11Å; S337-F341 PolarHBondContact O-N 2.89Å; S337-F341 VanDerWaalsContact O-N 3.14Å; R338-F341 WeakPolarHBondContact O-CB 3.46Å; R338-F341 PolarHBondContact O-N 2.77Å; R338-F341 VanDerWaalsContact O-N 3.11Å; F341-N345 WeakPolarHBondContact CD2-ND2 3.33Å; F341-N345 WeakPolarHBondContact CE2-ND2 3.35Å; F341-N345 PolarHBondContact O-N 2.83Å; F341-N345 PolarHBondContact O-ND2 3.38Å; F341-F349 AromaticContact CE1-CZ 3.94Å; F341-F349 HydrophobicContact CE1-CZ 3.94Å; F341-F349 HydrophobicContact CZ-CZ 4.34Å; F341-I382 HydrophobicContact CE1-CD1 4.37Å; F341-I382 HydrophobicContact CE1-CG2 4.15Å; F341-I382 HydrophobicContact CZ-CD1 4.27Å
342	E	98.3	Very high	97.7	Very high	46 Å²	46	52.9 Å²	52.9	22%	0.215	26%	0.256	C	S	.	.	H	α-helix	trans	-68.7	-39.2	177.5	-69	179	-172.1	0	0	112.4	R338 E339 L340 N345 Q346 F349 R384	R338-E342 WeakPolarHBondContact CD-OE1 3.41Å; R338-E342 HydrophobicContact CG-CG 4.24Å; R338-E342 VanDerWaalsContact CG-OE1 3.31Å; R338-E342 WeakPolarHBondContact CG-OE1 3.32Å; R338-E342 WeakPolarHBondContact O-CG 3.42Å; R338-E342 PolarHBondContact O-N 2.73Å; E339-E342 PolarHBondContact O-N 3.5Å; L340-E342 PolarHBondContact O-N 3.39Å; E342-N345 CarbonylContact O-C 3.53Å; E342-N345 PolarHBondContact O-N 3.49Å; E342-Q346 WeakPolarHBondContact O-CA 3.38Å; E342-Q346 PolarHBondContact O-N 3.27Å; E342-F349 HydrophobicContact CB-CE2 4.26Å; E342-F349 HydrophobicContact CG-CE2 4.22Å; E342-R384 HydrophobicContact CG-CB 3.82Å; E342-R384 HydrophobicContact CG-CG 4.18Å
343	E	98.3	Very high	97.8	Very high	136 Å²	136	53.6 Å²	53.6	64%	0.636	26%	0.26	S	S	*	.	H	α-helix	trans	-61.2	-49	174.3	-174.5	-175.8	170.9	0	0	111.6	E339 L340 N345 Q346	E339-E343 PolarHBondContact O-N 3.02Å; L340-E343 PolarHBondContact O-N 3.21Å; E343-N345 PolarHBondContact O-N 3.38Å; E343-Q346 PolarHBondContact O-N 3.04Å
344	L	98.3	Very high	97.8	Very high	45 Å²	45	51.6 Å²	51.6	24%	0.236	26%	0.255	C	S	.	.	H	α-helix	trans	-59.3	-23.3	179.7	-70.9	173.6	0	0	0	113.6	R262 L263 Y266 L340	R262-L344 HydrophobicContact CB-CB 4.49Å; R262-L344 PolarHBondContact NH1-O 3.11Å; L263-L344 HydrophobicContact CD1-CD1 4.26Å; Y266-L344 HydrophobicContact CD1-CD1 4.42Å; Y266-L344 HydrophobicContact CD2-CD1 4.39Å; Y266-L344 HydrophobicContact CD2-CD2 4.48Å; Y266-L344 HydrophobicContact CG-CD1 3.96Å; L340-L344 HydrophobicContact CD1-CD1 4.27Å; L340-L344 HydrophobicContact CD1-CG 4.12Å; L340-L344 HydrophobicContact CG-CD1 4.15Å; L340-L344 HydrophobicContact CG-CG 4.44Å; L340-L344 VanDerWaalsContact O-CG 3.25Å; L340-L344 WeakPolarHBondContact O-CG 3.48Å; L340-L344 PolarHBondContact O-N 3.23Å
345	N	98.3	Very high	97.8	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.3	6.8	-173.9	-69.5	-67.1	0	0	0	113.8	F259 R262 F341 E342 E343 D347 L348 F349	F259-N345 VanDerWaalsContact CA-OD1 3.29Å; F259-N345 WeakPolarHBondContact CA-OD1 3.01Å; F259-N345 HydrophobicContact CD1-CB 4.31Å; R262-N345 WeakPolarHBondContact CB-OD1 3Å; R262-N345 WeakPolarHBondContact CG-OD1 3.21Å; F341-N345 WeakPolarHBondContact CD2-ND2 3.33Å; F341-N345 WeakPolarHBondContact CE2-ND2 3.35Å; F341-N345 PolarHBondContact O-N 2.83Å; F341-N345 PolarHBondContact O-ND2 3.38Å; E342-N345 CarbonylContact O-C 3.53Å; E342-N345 PolarHBondContact O-N 3.49Å; E343-N345 PolarHBondContact O-N 3.38Å; N345-D347 VanDerWaalsContact C-N 3.27Å; N345-D347 PolarHBondContact O-N 3.33Å; N345-L348 PolarHBondContact O-N 3.48Å; N345-F349 HydrophobicContact CB-CD1 4.44Å; N345-F349 HydrophobicContact CB-CD2 4.25Å; N345-F349 HydrophobicContact CB-CE1 3.95Å; N345-F349 HydrophobicContact CB-CE2 3.79Å; N345-F349 HydrophobicContact CB-CZ 3.6Å; N345-F349 WeakPolarHBondContact O-CG 3.35Å; N345-F349 PolarHBondContact O-N 3.41Å
346	Q	97.8	Very high	97.7	Very high	116 Å²	116	44.6 Å²	44.6	54%	0.542	22%	0.221	S	C	.	.	H	α-helix	trans	-55.6	-43	-172.5	-173.8	179.8	13.6	0	0	112.2	E342 E343 F349 L350	E342-Q346 WeakPolarHBondContact O-CA 3.38Å; E342-Q346 PolarHBondContact O-N 3.27Å; E343-Q346 PolarHBondContact O-N 3.04Å; Q346-F349 PolarHBondContact O-N 3.4Å; Q346-L350 WeakPolarHBondContact O-CG 3.33Å; Q346-L350 PolarHBondContact O-N 3.32Å; Q346-L350 VanDerWaalsContact O-N 3.09Å
347	D	97.1	Very high	97.7	Very high	65 Å²	65	49.7 Å²	49.7	35%	0.348	24%	0.243	S	C	.	.	H	α-helix	trans	-64.4	-40.1	178.1	67.5	-60.4	0	0	0	112.3	R262 N345 L350 K351	R262-D347 IonicContact CZ-OD1 2.57Å; R262-D347 IonicContact CZ-OD2 3.13Å; R262-D347 IonicContact NH1-OD1 3.67Å; R262-D347 PolarHBondContact NH1-OD1 3.47Å; R262-D347 IonicContact NH1-OD2 3.12Å; R262-D347 IonicContact NH2-OD1 2.77Å; R262-D347 PolarHBondContact NH2-OD1 2.94Å; R262-D347 IonicContact NH2-OD2 3.43Å; R262-D347 PolarHBondContact NH2-OD2 3.04Å; N345-D347 VanDerWaalsContact C-N 3.27Å; N345-D347 PolarHBondContact O-N 3.33Å; D347-L350 PolarHBondContact O-N 2.88Å; D347-K351 WeakPolarHBondContact O-CG 3.44Å; D347-K351 PolarHBondContact O-N 3.39Å
348	L	96.9	Very high	97.7	Very high	15 Å²	15	49 Å²	49	8%	0.079	24%	0.237	C	C	.	.	H	α-helix	trans	-70	-37.8	178.7	-60.5	-176.1	0	0	0	111.8	L254 D258 F259 R262 N345 K351	L254-L348 HydrophobicContact CD1-CB 3.98Å; L254-L348 HydrophobicContact CD1-CD2 4.33Å; D258-L348 HydrophobicContact CB-CD1 4.01Å; F259-L348 HydrophobicContact CD1-CB 4.18Å; F259-L348 HydrophobicContact CD1-CD1 4.01Å; F259-L348 HydrophobicContact CE1-CB 3.8Å; F259-L348 HydrophobicContact CE1-CD1 4.33Å; R262-L348 HydrophobicContact CG-CD1 4.04Å; N345-L348 PolarHBondContact O-N 3.48Å; L348-K351 HydrophobicContact CD2-CD 4.29Å; L348-K351 WeakPolarHBondContact O-CB 3.5Å; L348-K351 PolarHBondContact O-N 2.92Å
349	F	97.6	Very high	97.6	Very high	4 Å²	4	46.5 Å²	46.5	2%	0.018	23%	0.228	C	C	.	.	H	α-helix	trans	-63.2	-44.9	174.2	-62.5	-28.9	0	0	0	111.5	F259 F341 E342 N345 Q346 K351 I352 I382 R384 I385 L388	F259-F349 HydrophobicContact CD1-CD1 4.36Å; F259-F349 AromaticContact CD1-CE1 3.86Å; F259-F349 HydrophobicContact CD1-CE1 3.86Å; F259-F349 HydrophobicContact CD2-CE1 4.31Å; F259-F349 AromaticContact CE1-CD1 3.77Å; F259-F349 HydrophobicContact CE1-CD1 3.77Å; F259-F349 AromaticContact CE1-CE1 3.67Å; F259-F349 HydrophobicContact CE1-CE1 3.67Å; F259-F349 HydrophobicContact CE2-CE1 4.15Å; F259-F349 HydrophobicContact CG-CE1 4.2Å; F259-F349 AromaticContact CZ-CD1 3.96Å; F259-F349 HydrophobicContact CZ-CD1 3.96Å; F259-F349 AromaticContact CZ-CE1 3.84Å; F259-F349 HydrophobicContact CZ-CE1 3.84Å; F341-F349 AromaticContact CE1-CZ 3.94Å; F341-F349 HydrophobicContact CE1-CZ 3.94Å; F341-F349 HydrophobicContact CZ-CZ 4.34Å; E342-F349 HydrophobicContact CB-CE2 4.26Å; E342-F349 HydrophobicContact CG-CE2 4.22Å; N345-F349 HydrophobicContact CB-CD1 4.44Å; N345-F349 HydrophobicContact CB-CD2 4.25Å; N345-F349 HydrophobicContact CB-CE1 3.95Å; N345-F349 HydrophobicContact CB-CE2 3.79Å; N345-F349 HydrophobicContact CB-CZ 3.6Å; N345-F349 WeakPolarHBondContact O-CG 3.35Å; N345-F349 PolarHBondContact O-N 3.41Å; Q346-F349 PolarHBondContact O-N 3.4Å; F349-K351 PolarHBondContact O-N 3.05Å; F349-I352 HydrophobicContact CD1-CD1 4.38Å; F349-I352 WeakPolarHBondContact O-CB 3.27Å; F349-I352 VanDerWaalsContact O-CG1 3.3Å; F349-I352 WeakPolarHBondContact O-CG1 3.44Å; F349-I352 PolarHBondContact O-N 2.82Å; F349-I382 HydrophobicContact CZ-CG2 4.16Å; F349-R384 HydrophobicContact CD2-CB 4.2Å; F349-R384 HydrophobicContact CD2-CG 3.57Å; F349-R384 HydrophobicContact CE2-CB 3.95Å; F349-R384 HydrophobicContact CE2-CG 3.78Å; F349-R384 HydrophobicContact CG-CG 4.42Å; F349-I385 HydrophobicContact CD1-CD1 4.19Å; F349-I385 HydrophobicContact CD1-CG1 3.96Å; F349-I385 HydrophobicContact CE1-CD1 4.11Å; F349-I385 HydrophobicContact CE1-CG1 4.08Å; F349-L388 HydrophobicContact CB-CD2 4.25Å; F349-L388 WeakPolarHBondContact O-CD2 3.14Å
350	L	96.9	Very high	97.5	Very high	90 Å²	90	41.1 Å²	41.1	47%	0.471	20%	0.203	S	C	.	.	H	α-helix	trans	-61.5	-31.1	177.7	-69.8	175.1	0	0	0	112.8	Q346 D347 I352 L353 L388	Q346-L350 WeakPolarHBondContact O-CG 3.33Å; Q346-L350 PolarHBondContact O-N 3.32Å; Q346-L350 VanDerWaalsContact O-N 3.09Å; D347-L350 PolarHBondContact O-N 2.88Å; L350-I352 PolarHBondContact O-N 2.78Å; L350-L353 PolarHBondContact O-N 2.97Å; L350-L388 HydrophobicContact CD2-CD1 4.04Å
351	K	96.8	Very high	97.4	Very high	87 Å²	87	42.8 Å²	42.8	38%	0.378	22%	0.221	S	C	.	.	H	α-helix	trans	-63	-21.3	174.5	-73	176.8	-175.2	-175.5	0	113.3	L254 D347 L348 F349 L353 V354 P355	L254-K351 HydrophobicContact CD2-CB 3.96Å; D347-K351 WeakPolarHBondContact O-CG 3.44Å; D347-K351 PolarHBondContact O-N 3.39Å; L348-K351 HydrophobicContact CD2-CD 4.29Å; L348-K351 WeakPolarHBondContact O-CB 3.5Å; L348-K351 PolarHBondContact O-N 2.92Å; F349-K351 PolarHBondContact O-N 3.05Å; K351-L353 PolarHBondContact O-N 3.36Å; K351-V354 WeakPolarHBondContact O-CB 3.48Å; K351-V354 PolarHBondContact O-N 3.46Å; K351-V354 VanDerWaalsContact O-N 3.14Å; K351-P355 WeakPolarHBondContact O-CD 3.47Å
352	I	97.1	Very high	97.2	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-33.4	176.3	-60.4	170.1	0	0	0	111.2	L226 L231 L254 F349 L350 V354 P355 I385	L226-I352 HydrophobicContact CD2-CD1 3.99Å; L231-I352 HydrophobicContact CD1-CG2 4.31Å; L231-I352 HydrophobicContact CD2-CB 4.13Å; L231-I352 HydrophobicContact CD2-CG1 4.19Å; L231-I352 HydrophobicContact CD2-CG2 3.99Å; L254-I352 HydrophobicContact CD2-CG1 4.19Å; F349-I352 HydrophobicContact CD1-CD1 4.38Å; F349-I352 WeakPolarHBondContact O-CB 3.27Å; F349-I352 VanDerWaalsContact O-CG1 3.3Å; F349-I352 WeakPolarHBondContact O-CG1 3.44Å; F349-I352 PolarHBondContact O-N 2.82Å; L350-I352 PolarHBondContact O-N 2.78Å; I352-V354 VanDerWaalsContact C-N 3.26Å; I352-V354 PolarHBondContact O-N 2.88Å; I352-P355 VanDerWaalsContact O-CD 3.31Å; I352-P355 WeakPolarHBondContact O-CD 3.42Å; I352-P355 WeakPolarHBondContact O-CG 3.34Å; I352-I385 HydrophobicContact CD1-CB 4.49Å; I352-I385 HydrophobicContact CD1-CD1 3.8Å; I352-I385 HydrophobicContact CD1-CG1 3.88Å; I352-I385 HydrophobicContact CD1-CG2 3.98Å
353	L	97.8	Very high	97	Very high	17 Å²	17	44.9 Å²	44.9	9%	0.089	24%	0.235	C	C	.	.	H	α-helix	trans	-74.2	-14	-179.2	-64.1	-178.5	0	0	0	113.8	L350 K351 V356 K357 L388 Y392	L350-L353 PolarHBondContact O-N 2.97Å; K351-L353 PolarHBondContact O-N 3.36Å; L353-V356 PolarHBondContact O-N 2.88Å; L353-K357 WeakPolarHBondContact O-CB 3.35Å; L353-K357 VanDerWaalsContact O-CG 3.28Å; L353-K357 WeakPolarHBondContact O-CG 3.41Å; L353-K357 PolarHBondContact O-N 3.05Å; L353-L388 HydrophobicContact CD1-CD1 3.88Å; L353-L388 HydrophobicContact CD1-CG 4.18Å; L353-L388 HydrophobicContact CD2-CG 4.34Å; L353-L388 HydrophobicContact CG-CD1 4.39Å; L353-L388 HydrophobicContact CG-CD2 4.18Å; L353-L388 HydrophobicContact CG-CG 4.19Å; L353-Y392 HydrophobicContact CD1-CD2 4.01Å; L353-Y392 HydrophobicContact CD1-CG 4.25Å; L353-Y392 HydrophobicContact CD2-CD1 4.13Å; L353-Y392 HydrophobicContact CD2-CD2 4.29Å; L353-Y392 HydrophobicContact CD2-CG 3.81Å
354	V	97.2	Very high	96.8	Very high	60 Å²	60	46.4 Å²	46.4	36%	0.364	24%	0.242	S	C	.	.	H	α-helix	trans	-64.5	-56.5	-179.6	177.3	0	0	0	0	111.5	K351 I352 V356 K357 T358 F441	K351-V354 WeakPolarHBondContact O-CB 3.48Å; K351-V354 PolarHBondContact O-N 3.46Å; K351-V354 VanDerWaalsContact O-N 3.14Å; I352-V354 VanDerWaalsContact C-N 3.26Å; I352-V354 PolarHBondContact O-N 2.88Å; V354-V356 VanDerWaalsContact C-N 3.29Å; V354-V356 PolarHBondContact O-N 3.37Å; V354-K357 PolarHBondContact O-N 2.71Å; V354-T358 PolarHBondContact O-N 2.77Å; V354-T358 PolarHBondContact O-OG1 3.3Å; V354-F441 HydrophobicContact CG1-CD1 3.8Å; V354-F441 HydrophobicContact CG1-CD2 4.02Å; V354-F441 HydrophobicContact CG1-CE1 3.72Å; V354-F441 HydrophobicContact CG1-CE2 3.95Å; V354-F441 HydrophobicContact CG1-CG 3.96Å; V354-F441 HydrophobicContact CG1-CZ 3.82Å
355	P	96.7	Very high	96.7	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.006	24%	0.238	C	C	.	.	H	α-helix	trans	-63.9	-33.6	175.3	24	-33.6	0	0	0	112.5	L231 V233 A249 K351 I352 T358 V359 F441	L231-P355 HydrophobicContact CD2-CG 3.52Å; L231-P355 HydrophobicContact CG-CG 4.1Å; V233-P355 HydrophobicContact CB-CB 4.25Å; V233-P355 HydrophobicContact CG2-CB 3.84Å; V233-P355 HydrophobicContact CG2-CG 3.86Å; A249-P355 HydrophobicContact CB-CB 3.66Å; K351-P355 WeakPolarHBondContact O-CD 3.47Å; I352-P355 VanDerWaalsContact O-CD 3.31Å; I352-P355 WeakPolarHBondContact O-CD 3.42Å; I352-P355 WeakPolarHBondContact O-CG 3.34Å; P355-T358 WeakPolarHBondContact O-CB 3.28Å; P355-T358 PolarHBondContact O-N 2.94Å; P355-V359 PolarHBondContact O-N 3.39Å; P355-F441 HydrophobicContact CB-CD2 4.32Å; P355-F441 HydrophobicContact CB-CE2 4.27Å
356	V	97.6	Very high	96.7	Very high	1 Å²	1	52 Å²	52	1%	0.006	27%	0.267	C	S	.	.	H	α-helix	trans	-57.9	-51	174.3	173.5	0	0	0	0	111.7	L222 V224 V233 L353 V354 T358 V359 L360 Y392 F393	L222-V356 HydrophobicContact CD2-CG1 4.05Å; V224-V356 HydrophobicContact CG2-CG2 4.4Å; V233-V356 HydrophobicContact CG1-CG2 4.15Å; V233-V356 HydrophobicContact CG2-CG2 4.06Å; L353-V356 PolarHBondContact O-N 2.88Å; V354-V356 VanDerWaalsContact C-N 3.29Å; V354-V356 PolarHBondContact O-N 3.37Å; V356-T358 VanDerWaalsContact C-N 3.25Å; V356-T358 PolarHBondContact O-N 3.22Å; V356-V359 VanDerWaalsContact O-CG2 3.24Å; V356-V359 WeakPolarHBondContact O-CG2 3.23Å; V356-V359 PolarHBondContact O-N 2.91Å; V356-L360 HydrophobicContact CG1-CD1 4.33Å; V356-L360 WeakPolarHBondContact O-CG 3.21Å; V356-L360 PolarHBondContact O-N 3.38Å; V356-Y392 HydrophobicContact CG1-CD1 4.27Å; V356-Y392 HydrophobicContact CG1-CE1 3.89Å; V356-F393 HydrophobicContact CG1-CE2 3.72Å; V356-F393 HydrophobicContact CG1-CZ 3.54Å
357	K	97.7	Very high	96.6	Very high	107 Å²	107	49.8 Å²	49.8	47%	0.465	26%	0.256	S	S	.	.	H	α-helix	trans	-61.3	-37.2	176.7	-75.5	169.1	-179.3	-177.4	0	112.1	L353 V354 A361 Y392	L353-K357 WeakPolarHBondContact O-CB 3.35Å; L353-K357 VanDerWaalsContact O-CG 3.28Å; L353-K357 WeakPolarHBondContact O-CG 3.41Å; L353-K357 PolarHBondContact O-N 3.05Å; V354-K357 PolarHBondContact O-N 2.71Å; K357-A361 WeakPolarHBondContact O-CB 3.24Å; K357-A361 PolarHBondContact O-N 3.11Å; K357-Y392 HydrophobicContact CD-CE2 4.48Å; K357-Y392 HydrophobicContact CG-CE2 4.24Å; K357-Y392 VanDerWaalsContact CG-OH 3.25Å; K357-Y392 WeakPolarHBondContact CG-OH 3.34Å
358	T	97.2	Very high	96.6	Very high	28 Å²	28	52.8 Å²	52.8	17%	0.172	27%	0.268	C	S	.	.	H	α-helix	trans	-64.7	-49.2	-179.6	-54	0	0	0	0	111.2	A249 V354 P355 V356 L360 A361 E362 T439 F441	A249-T358 HydrophobicContact CB-CG2 4.05Å; V354-T358 PolarHBondContact O-N 2.77Å; V354-T358 PolarHBondContact O-OG1 3.3Å; P355-T358 WeakPolarHBondContact O-CB 3.28Å; P355-T358 PolarHBondContact O-N 2.94Å; V356-T358 VanDerWaalsContact C-N 3.25Å; V356-T358 PolarHBondContact O-N 3.22Å; T358-L360 VanDerWaalsContact C-N 3.31Å; T358-L360 PolarHBondContact O-N 3.18Å; T358-A361 PolarHBondContact O-N 2.83Å; T358-E362 HydrophobicContact CG2-CG 4.45Å; T358-E362 WeakPolarHBondContact O-CB 3.46Å; T358-E362 WeakPolarHBondContact O-CG 3.39Å; T358-E362 PolarHBondContact O-N 3.48Å; T358-T439 HydrophobicContact CG2-CG2 4.22Å; T358-F441 HydrophobicContact CG2-CE2 4.26Å; T358-F441 HydrophobicContact CG2-CZ 4Å; T358-F441 WeakPolarHBondContact OG1-CZ 3.18Å
359	V	96.6	Very high	96.5	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-67.3	-31.3	-179.9	-60.8	0	0	0	0	113	L222 V233 L235 A247 A249 P355 V356 G363	L222-V359 HydrophobicContact CD1-CG2 3.66Å; V233-V359 HydrophobicContact CB-CG1 4.41Å; V233-V359 HydrophobicContact CG1-CG1 4.34Å; V233-V359 HydrophobicContact CG1-CG2 3.68Å; L235-V359 HydrophobicContact CB-CB 4.16Å; L235-V359 HydrophobicContact CB-CG2 4.26Å; L235-V359 WeakPolarHBondContact CD2-O 3.28Å; A247-V359 HydrophobicContact CB-CB 3.9Å; A247-V359 HydrophobicContact CB-CG1 4.24Å; A247-V359 WeakPolarHBondContact CB-O 3.22Å; A249-V359 HydrophobicContact CB-CG1 3.68Å; A249-V359 VanDerWaalsContact N-CG1 3.28Å; P355-V359 PolarHBondContact O-N 3.39Å; V356-V359 VanDerWaalsContact O-CG2 3.24Å; V356-V359 WeakPolarHBondContact O-CG2 3.23Å; V356-V359 PolarHBondContact O-N 2.91Å; V359-G363 WeakPolarHBondContact O-CA 3.38Å; V359-G363 PolarHBondContact O-N 2.89Å
360	L	97.2	Very high	96.5	Very high	7 Å²	7	55.3 Å²	55.3	4%	0.037	28%	0.282	C	S	.	.	H	α-helix	trans	-66.3	-46.2	173.6	-69.7	175.4	0	0	0	110.9	V356 T358 G363 H364 L365 K367 V370 Y392 F393	V356-L360 HydrophobicContact CG1-CD1 4.33Å; V356-L360 WeakPolarHBondContact O-CG 3.21Å; V356-L360 PolarHBondContact O-N 3.38Å; T358-L360 VanDerWaalsContact C-N 3.31Å; T358-L360 PolarHBondContact O-N 3.18Å; L360-G363 CarbonylContact O-C 3.52Å; L360-G363 PolarHBondContact O-N 2.75Å; L360-H364 PolarHBondContact O-N 2.91Å; L360-L365 CarbonylContact C-O 3.54Å; L360-L365 HydrophobicContact CD2-CB 4.29Å; L360-L365 PolarHBondContact O-N 2.91Å; L360-K367 HydrophobicContact CD1-CB 4.29Å; L360-V370 HydrophobicContact CD2-CG2 3.52Å; L360-Y392 HydrophobicContact CD1-CE1 4.12Å; L360-F393 HydrophobicContact CD1-CE1 4.07Å; L360-F393 HydrophobicContact CD1-CZ 4.11Å
361	A	96.3	Very high	96.3	Very high	68 Å²	68	53.8 Å²	53.8	56%	0.562	27%	0.274	S	S	*	.	H	α-helix	trans	-63.1	-47.6	178	0	0	0	0	0	112.3	K357 T358 G363 H364	K357-A361 WeakPolarHBondContact O-CB 3.24Å; K357-A361 PolarHBondContact O-N 3.11Å; T358-A361 PolarHBondContact O-N 2.83Å; A361-G363 VanDerWaalsContact C-N 3.31Å; A361-G363 PolarHBondContact O-N 2.94Å; A361-H364 PolarHBondContact O-N 2.9Å; A361-H364 VanDerWaalsContact O-N 3.14Å; A361-H364 PolarHBondContact O-ND1 2.8Å
362	E	94.5	Very high	96.2	Very high	81 Å²	81	52.3 Å²	52.3	38%	0.379	27%	0.268	S	S	.	.	H	α-helix	trans	-65.8	-34	176.5	-71.9	-180	-175.5	0	0	112.3	A247 T358 H364 T439	A247-E362 HydrophobicContact CB-CB 3.72Å; T358-E362 HydrophobicContact CG2-CG 4.45Å; T358-E362 WeakPolarHBondContact O-CB 3.46Å; T358-E362 WeakPolarHBondContact O-CG 3.39Å; T358-E362 PolarHBondContact O-N 3.48Å; E362-H364 PolarHBondContact O-N 2.87Å; E362-T439 PolarHBondContact OE1-OG1 2.87Å
363	G	93.2	Very high	96.2	Very high	14 Å²	14	52.4 Å²	52.4	14%	0.144	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-5.5	174.2	0	0	0	0	0	114.4	V359 L360 A361 L365	V359-G363 WeakPolarHBondContact O-CA 3.38Å; V359-G363 PolarHBondContact O-N 2.89Å; L360-G363 CarbonylContact O-C 3.52Å; L360-G363 PolarHBondContact O-N 2.75Å; A361-G363 VanDerWaalsContact C-N 3.31Å; A361-G363 PolarHBondContact O-N 2.94Å; G363-L365 PolarHBondContact O-N 2.83Å
364	H	95.1	Very high	96	Very high	169 Å²	169	51.6 Å²	51.6	78%	0.782	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	38.1	-173.2	-55	-55.6	0	0	0	113.7	L360 A361 E362	L360-H364 PolarHBondContact O-N 2.91Å; A361-H364 PolarHBondContact O-N 2.9Å; A361-H364 VanDerWaalsContact O-N 3.14Å; A361-H364 PolarHBondContact O-ND1 2.8Å; E362-H364 PolarHBondContact O-N 2.87Å
365	L	96.2	Very high	95.9	Very high	31 Å²	31	48.8 Å²	48.8	16%	0.162	25%	0.248	C	C	.	.			trans	-116.2	147.8	178.1	-64.5	-171.8	0	0	0	111	N220 L235 L360 G363 D369	N220-L365 HydrophobicContact CB-CD1 4.03Å; L235-L365 HydrophobicContact CD1-CD1 4.03Å; L235-L365 HydrophobicContact CD2-CD1 3.75Å; L235-L365 HydrophobicContact CD2-CG 4.25Å; L235-L365 HydrophobicContact CG-CD1 4.35Å; L360-L365 CarbonylContact C-O 3.54Å; L360-L365 HydrophobicContact CD2-CB 4.29Å; L360-L365 PolarHBondContact O-N 2.91Å; G363-L365 PolarHBondContact O-N 2.83Å; L365-D369 HydrophobicContact CB-CB 4.13Å; L365-D369 HydrophobicContact CD1-CB 4.48Å; L365-D369 HydrophobicContact CD2-CB 3.98Å; L365-D369 HydrophobicContact CG-CB 4.42Å
366	Q	96.6	Very high	95.7	Very high	130 Å²	130	49 Å²	49	61%	0.607	25%	0.249	S	C	*	.			trans	-86.3	167.6	162.7	-57.9	-55.7	-49.6	0	0	110.1	E368 D369	Q366-E368 WeakPolarHBondContact CB-OE2 3.26Å; Q366-E368 PolarHBondContact O-N 3.08Å; Q366-D369 WeakPolarHBondContact CB-OD2 3.17Å; Q366-D369 PolarHBondContact N-OD2 2.97Å; Q366-D369 WeakPolarHBondContact O-CB 3.25Å; Q366-D369 PolarHBondContact O-N 3.3Å; Q366-D369 VanDerWaalsContact O-N 3.14Å
367	K	96.3	Very high	95.4	Very high	71 Å²	71	49.4 Å²	49.4	31%	0.309	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-65	-29.1	-179.5	62.9	173.9	-172.7	171.8	0	112.2	L360 D369 V370 Y392 F393	L360-K367 HydrophobicContact CD1-CB 4.29Å; K367-D369 VanDerWaalsContact C-N 3.27Å; K367-D369 PolarHBondContact O-N 3.12Å; K367-V370 PolarHBondContact O-N 3.15Å; K367-Y392 HydrophobicContact CB-CE1 4.33Å; K367-Y392 WeakPolarHBondContact CD-O 3.28Å; K367-Y392 PolarHBondContact NZ-O 2.93Å; K367-F393 HydrophobicContact CB-CD1 3.78Å; K367-F393 HydrophobicContact CB-CE1 3.85Å
368	E	96.4	Very high	95	Very high	128 Å²	128	45.5 Å²	45.5	60%	0.598	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-70.7	-22.6	177	-63.4	73.7	-160	0	0	112.6	Q366 V370	Q366-E368 WeakPolarHBondContact CB-OE2 3.26Å; Q366-E368 PolarHBondContact O-N 3.08Å; E368-V370 VanDerWaalsContact C-N 3.33Å
369	D	96.1	Very high	94.8	Very high	71 Å²	71	44.7 Å²	44.7	38%	0.38	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-81.9	-12.9	-179.7	-58.9	-45.7	0	0	0	113	N220 L365 Q366 K367	N220-D369 VanDerWaalsContact CB-O 3.32Å; N220-D369 WeakPolarHBondContact CB-O 3.25Å; N220-D369 PolarHBondContact ND2-O 2.94Å; L365-D369 HydrophobicContact CB-CB 4.13Å; L365-D369 HydrophobicContact CD1-CB 4.48Å; L365-D369 HydrophobicContact CD2-CB 3.98Å; L365-D369 HydrophobicContact CG-CB 4.42Å; Q366-D369 WeakPolarHBondContact CB-OD2 3.17Å; Q366-D369 PolarHBondContact N-OD2 2.97Å; Q366-D369 WeakPolarHBondContact O-CB 3.25Å; Q366-D369 PolarHBondContact O-N 3.3Å; Q366-D369 VanDerWaalsContact O-N 3.14Å; K367-D369 VanDerWaalsContact C-N 3.27Å; K367-D369 PolarHBondContact O-N 3.12Å
370	V	96.3	Very high	94.7	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.006	24%	0.239	C	C	.	.			trans	-72.3	132.7	171.4	178.1	0	0	0	0	107	L222 L360 K367 E368 E372 I373 F393 K395	L222-V370 HydrophobicContact CB-CG1 3.88Å; L360-V370 HydrophobicContact CD2-CG2 3.52Å; K367-V370 PolarHBondContact O-N 3.15Å; E368-V370 VanDerWaalsContact C-N 3.33Å; V370-E372 WeakPolarHBondContact CG1-O 3.26Å; V370-I373 HydrophobicContact CG1-CG1 3.97Å; V370-F393 HydrophobicContact CB-CE1 4.23Å; V370-F393 HydrophobicContact CG2-CE1 3.88Å; V370-K395 PolarHBondContact O-NZ 2.95Å
371	D	94.1	Very high	94.6	Very high	58 Å²	58	48.4 Å²	48.4	31%	0.31	25%	0.253	S	S	.	.			trans	-92.1	-44.1	178.3	-63.1	-53.6	0	0	0	111	V218 F219 N220 K395	V218-D371 HydrophobicContact CG1-CB 3.92Å; F219-D371 WeakPolarHBondContact CA-OD2 3.14Å; F219-D371 WeakPolarHBondContact CB-OD2 3.41Å; F219-D371 PolarHBondContact N-OD2 2.81Å; N220-D371 PolarHBondContact N-OD2 3.41Å; N220-D371 WeakPolarHBondContact O-CB 3.29Å; N220-D371 PolarHBondContact O-N 3.25Å; D371-K395 PolarHBondContact O-NZ 2.87Å
372	E	94.7	Very high	94.7	Very high	55 Å²	55	45.5 Å²	45.5	26%	0.257	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	143.6	-174.8	-77.1	-70.1	161	0	0	111.5	L213 V218 N220 V221 L222 V370	L213-E372 HydrophobicContact CD1-CB 3.82Å; L213-E372 HydrophobicContact CD1-CG 4.28Å; L213-E372 HydrophobicContact CD2-CB 4.26Å; L213-E372 HydrophobicContact CD2-CG 3.79Å; V218-E372 HydrophobicContact CG1-CB 4Å; V218-E372 HydrophobicContact CG1-CG 3.83Å; V218-E372 HydrophobicContact CG2-CG 3.78Å; N220-E372 PolarHBondContact O-N 3.04Å; V221-E372 WeakPolarHBondContact CA-O 3.35Å; V221-E372 HydrophobicContact CG2-CB 4.47Å; L222-E372 PolarHBondContact N-O 3.02Å; V370-E372 WeakPolarHBondContact CG1-O 3.26Å
373	I	96	Very high	94.7	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.01	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	118.1	177.9	-55.3	157.1	0	0	0	107.7	L222 V224 V370 L375 I389 F393 K395 P397 N398	L222-I373 HydrophobicContact CB-CG1 4.45Å; L222-I373 HydrophobicContact CD2-CG2 4.36Å; L222-I373 CarbonylContact O-C 3.58Å; L222-I373 WeakPolarHBondContact O-CA 3.11Å; V224-I373 HydrophobicContact CG2-CG2 4.5Å; V370-I373 HydrophobicContact CG1-CG1 3.97Å; I373-L375 HydrophobicContact CG2-CD2 4.33Å; I373-I389 HydrophobicContact CD1-CG2 4.27Å; I373-I389 HydrophobicContact CG2-CG2 3.88Å; I373-F393 HydrophobicContact CD1-CB 3.61Å; I373-F393 HydrophobicContact CD1-CD1 3.95Å; I373-F393 HydrophobicContact CD1-CD2 3.43Å; I373-F393 VanDerWaalsContact CD1-CD2 3.43Å; I373-F393 HydrophobicContact CD1-CE2 4.08Å; I373-F393 HydrophobicContact CD1-CG 3.38Å; I373-F393 HydrophobicContact CG1-CD2 4.36Å; I373-F393 HydrophobicContact CG1-CG 4.42Å; I373-K395 HydrophobicContact CD1-CG 4.21Å; I373-P397 HydrophobicContact CB-CB 4.15Å; I373-P397 HydrophobicContact CG2-CB 3.99Å; I373-N398 PolarHBondContact O-N 2.97Å
374	V	94.9	Very high	94.9	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	131.1	-177.9	167.2	0	0	0	0	109.3	A207 Y211 L213 V221 L222 V223 V224 V376	A207-V374 HydrophobicContact CB-CG1 4.39Å; Y211-V374 HydrophobicContact CD1-CG2 4.3Å; Y211-V374 HydrophobicContact CD2-CB 4.26Å; Y211-V374 HydrophobicContact CD2-CG1 3.39Å; Y211-V374 HydrophobicContact CD2-CG2 3.86Å; Y211-V374 HydrophobicContact CE2-CB 4.31Å; Y211-V374 HydrophobicContact CE2-CG1 3.18Å; Y211-V374 HydrophobicContact CE2-CG2 4.36Å; Y211-V374 HydrophobicContact CG-CG1 4.16Å; Y211-V374 HydrophobicContact CG-CG2 3.82Å; L213-V374 HydrophobicContact CD1-CG2 3.67Å; V221-V374 HydrophobicContact CG1-CG2 4.09Å; L222-V374 PolarHBondContact O-N 3.15Å; V223-V374 WeakPolarHBondContact CA-O 3.47Å; V223-V374 HydrophobicContact CG1-CG1 4.5Å; V223-V374 HydrophobicContact CG2-CB 4.47Å; V224-V374 PolarHBondContact N-O 3.2Å; V374-V376 HydrophobicContact CG1-CG2 4.05Å
375	L	94.8	Very high	95	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	128.3	178	-57.4	-175.1	0	0	0	110.7	Y211 V224 I373 T380 R386 I389 P397 T399	Y211-L375 PolarHBondContact OH-O 3.48Å; V224-L375 HydrophobicContact CB-CD2 3.93Å; V224-L375 HydrophobicContact CG2-CD2 4.47Å; V224-L375 WeakPolarHBondContact O-CA 3.27Å; I373-L375 HydrophobicContact CG2-CD2 4.33Å; L375-T380 HydrophobicContact CB-CG2 4.02Å; L375-R386 HydrophobicContact CD1-CG 3.85Å; L375-I389 HydrophobicContact CD2-CD1 3.55Å; L375-P397 HydrophobicContact CD1-CB 3.82Å; L375-P397 HydrophobicContact CD1-CG 3.72Å; L375-P397 HydrophobicContact CD2-CB 4.11Å; L375-P397 HydrophobicContact CG-CB 3.79Å; L375-P397 HydrophobicContact CG-CG 4.28Å; L375-T399 HydrophobicContact CD1-CG2 4.35Å
376	V	92.9	Very high	95	Very high	6 Å²	6	39.4 Å²	39.4	4%	0.036	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	148.7	179.6	-176.8	0	0	0	0	109	A207 V223 V224 D225 L226 V374 T380 A406 V407	A207-V376 HydrophobicContact CB-CG2 3.5Å; V223-V376 HydrophobicContact CG1-CG2 3.81Å; V224-V376 PolarHBondContact O-N 3.09Å; D225-V376 CarbonylContact C-O 3.57Å; D225-V376 WeakPolarHBondContact CA-O 3.24Å; D225-V376 HydrophobicContact CB-CB 3.92Å; D225-V376 HydrophobicContact CB-CG1 4.28Å; L226-V376 PolarHBondContact N-O 3.03Å; V374-V376 HydrophobicContact CG1-CG2 4.05Å; V376-T380 WeakPolarHBondContact O-CG2 3.3Å; V376-A406 HydrophobicContact CG2-CB 4.3Å; V376-V407 HydrophobicContact CG1-CG2 3.99Å
377	G	89.5	Confident	95.1	Very high	9 Å²	9	36.2 Å²	36.2	9%	0.093	18%	0.182	C	C	.	.	S	Bend	trans	84.3	138.9	178.6	0	0	0	0	0	113.9	L226 S379 T380 P403	L226-G377 CarbonylContact O-C 3.33Å; G377-S379 VanDerWaalsContact C-N 3.26Å; G377-S379 PolarHBondContact O-N 3.35Å; G377-S379 VanDerWaalsContact O-N 3.11Å; G377-T380 WeakPolarHBondContact O-CB 3.44Å; G377-T380 PolarHBondContact O-N 3.04Å; G377-T380 PolarHBondContact O-OG1 2.8Å; G377-P403 PolarHBondContact N-O 3.03Å
378	G	89.3	Confident	95.1	Very high	25 Å²	25	33.2 Å²	33.2	26%	0.258	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-59.1	-26.5	-169.4	0	0	0	0	0	116	T380 R381 D404	G378-T380 PolarHBondContact O-N 3.38Å; G378-R381 VanDerWaalsContact O-CB 3.32Å; G378-R381 WeakPolarHBondContact O-CB 3.33Å; G378-R381 VanDerWaalsContact O-CG 3.3Å; G378-R381 WeakPolarHBondContact O-CG 3.47Å; G378-R381 PolarHBondContact O-N 2.87Å; G378-R381 VanDerWaalsContact O-N 3.12Å; G378-D404 WeakPolarHBondContact CA-OD1 3.46Å; G378-D404 PolarHBondContact N-OD1 2.94Å
379	S	93.3	Very high	95.2	Very high	12 Å²	12	27.1 Å²	27.1	8%	0.084	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-67.2	-22	177.4	-58.2	0	0	0	0	112.1	L226 G227 G256 G377 R381 I382	L226-S379 VanDerWaalsContact O-CB 3.29Å; L226-S379 WeakPolarHBondContact O-CB 3.26Å; L226-S379 PolarHBondContact O-N 2.72Å; G227-S379 PolarHBondContact O-OG 2.77Å; G256-S379 VanDerWaalsContact CA-OG 3.25Å; G256-S379 WeakPolarHBondContact CA-OG 3.19Å; G256-S379 PolarHBondContact N-OG 2.73Å; G377-S379 VanDerWaalsContact C-N 3.26Å; G377-S379 PolarHBondContact O-N 3.35Å; G377-S379 VanDerWaalsContact O-N 3.11Å; S379-R381 PolarHBondContact O-N 2.85Å; S379-R381 VanDerWaalsContact O-N 3.15Å; S379-I382 WeakPolarHBondContact O-CB 3.5Å; S379-I382 WeakPolarHBondContact O-CD1 3.45Å; S379-I382 VanDerWaalsContact O-CG1 3.29Å; S379-I382 WeakPolarHBondContact O-CG1 3.43Å; S379-I382 PolarHBondContact O-N 3.48Å; S379-I382 VanDerWaalsContact O-N 3.16Å
380	T	95.7	Very high	95.3	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-68.2	-7.8	174.1	66.1	0	0	0	0	114.1	L226 L375 V376 G377 G378 I382 R386	L226-T380 HydrophobicContact CB-CG2 3.75Å; L375-T380 HydrophobicContact CB-CG2 4.02Å; V376-T380 WeakPolarHBondContact O-CG2 3.3Å; G377-T380 WeakPolarHBondContact O-CB 3.44Å; G377-T380 PolarHBondContact O-N 3.04Å; G377-T380 PolarHBondContact O-OG1 2.8Å; G378-T380 PolarHBondContact O-N 3.38Å; T380-I382 VanDerWaalsContact C-N 3.26Å; T380-R386 WeakPolarHBondContact O-CG 3.31Å; T380-R386 PolarHBondContact O-NE 3.27Å
381	R	95.1	Very high	95.3	Very high	85 Å²	85	30 Å²	30	32%	0.321	15%	0.154	S	C	.	.	G	3₁₀ helix	trans	-70.8	-23.4	171.9	-61.7	176.7	-175.4	-94.9	8.7	112.2	T300 G378 S379 P383 D402 P403 D404	T300-R381 HydrophobicContact CG2-CB 3.65Å; T300-R381 VanDerWaalsContact CG2-O 3.3Å; T300-R381 WeakPolarHBondContact CG2-O 3.28Å; G378-R381 VanDerWaalsContact O-CB 3.32Å; G378-R381 WeakPolarHBondContact O-CB 3.33Å; G378-R381 VanDerWaalsContact O-CG 3.3Å; G378-R381 WeakPolarHBondContact O-CG 3.47Å; G378-R381 PolarHBondContact O-N 2.87Å; G378-R381 VanDerWaalsContact O-N 3.12Å; S379-R381 PolarHBondContact O-N 2.85Å; S379-R381 VanDerWaalsContact O-N 3.15Å; R381-P383 WeakPolarHBondContact O-CD 3.46Å; R381-D402 IonicContact CZ-OD1 3.67Å; R381-D402 IonicContact CZ-OD2 2.78Å; R381-D402 IonicContact NH1-OD2 2.93Å; R381-D402 IonicContact NH2-OD1 3.38Å; R381-D402 PolarHBondContact NH2-OD1 3.24Å; R381-D402 IonicContact NH2-OD2 3.78Å; R381-D402 PolarHBondContact NH2-OD2 3.43Å; R381-P403 HydrophobicContact CG-CG 3.91Å; R381-D404 IonicContact CZ-OD2 3.1Å; R381-D404 IonicContact NE-OD2 2.86Å; R381-D404 PolarHBondContact NE-OD2 2.94Å; R381-D404 VanDerWaalsContact NE-OD2 3.16Å; R381-D404 IonicContact NH2-OD2 3.48Å; R381-D404 PolarHBondContact NH2-OD2 2.91Å
382	I	96.8	Very high	95.5	Very high	6 Å²	6	29.6 Å²	29.6	3%	0.031	15%	0.148	C	C	.	.	S	Bend	trans	-56.5	120.3	179.7	-64.9	169.4	0	0	0	109.2	F259 F341 F349 S379 T380 R384 I385 R386	F259-I382 HydrophobicContact CD2-CD1 3.66Å; F259-I382 HydrophobicContact CE2-CD1 3.95Å; F341-I382 HydrophobicContact CE1-CD1 4.37Å; F341-I382 HydrophobicContact CE1-CG2 4.15Å; F341-I382 HydrophobicContact CZ-CD1 4.27Å; F349-I382 HydrophobicContact CZ-CG2 4.16Å; S379-I382 WeakPolarHBondContact O-CB 3.5Å; S379-I382 WeakPolarHBondContact O-CD1 3.45Å; S379-I382 VanDerWaalsContact O-CG1 3.29Å; S379-I382 WeakPolarHBondContact O-CG1 3.43Å; S379-I382 PolarHBondContact O-N 3.48Å; S379-I382 VanDerWaalsContact O-N 3.16Å; T380-I382 VanDerWaalsContact C-N 3.26Å; I382-R384 VanDerWaalsContact C-N 3.3Å; I382-R384 HydrophobicContact CG2-CB 4.38Å; I382-R384 PolarHBondContact O-N 3.3Å; I382-I385 HydrophobicContact CB-CD1 3.95Å; I382-I385 HydrophobicContact CB-CG1 4.04Å; I382-I385 HydrophobicContact CD1-CD1 4.02Å; I382-I385 HydrophobicContact CG2-CD1 4.35Å; I382-I385 HydrophobicContact CG2-CG1 4.08Å; I382-I385 WeakPolarHBondContact O-CB 3.43Å; I382-I385 PolarHBondContact O-N 3.19Å; I382-R386 PolarHBondContact O-N 3.09Å
383	P	96.3	Very high	95.7	Very high	35 Å²	35	27.6 Å²	27.6	23%	0.227	14%	0.139	C	C	.	.	H	α-helix	trans	-54.8	-42.8	-174.1	-30.2	36.6	0	0	0	113.5	R381 I385 R386 T387	R381-P383 WeakPolarHBondContact O-CD 3.46Å; P383-I385 PolarHBondContact O-N 3.5Å; P383-R386 PolarHBondContact O-N 3.49Å; P383-R386 VanDerWaalsContact O-N 3.14Å; P383-T387 PolarHBondContact O-N 2.94Å; P383-T387 PolarHBondContact O-OG1 3.12Å
384	R	97.3	Very high	95.7	Very high	61 Å²	61	30.9 Å²	30.9	23%	0.23	17%	0.173	C	C	.	.	H	α-helix	trans	-58.6	-33.7	179.2	-172.4	58.8	-166.7	141.8	8.5	113.8	E342 F349 I382 L388 E391	E342-R384 HydrophobicContact CG-CB 3.82Å; E342-R384 HydrophobicContact CG-CG 4.18Å; F349-R384 HydrophobicContact CD2-CB 4.2Å; F349-R384 HydrophobicContact CD2-CG 3.57Å; F349-R384 HydrophobicContact CE2-CB 3.95Å; F349-R384 HydrophobicContact CE2-CG 3.78Å; F349-R384 HydrophobicContact CG-CG 4.42Å; I382-R384 VanDerWaalsContact C-N 3.3Å; I382-R384 HydrophobicContact CG2-CB 4.38Å; I382-R384 PolarHBondContact O-N 3.3Å; R384-L388 VanDerWaalsContact O-CB 3.23Å; R384-L388 WeakPolarHBondContact O-CB 3.25Å; R384-L388 PolarHBondContact O-N 3.35Å; R384-E391 IonicContact CZ-OE2 3.89Å; R384-E391 IonicContact NH1-OE1 3.48Å; R384-E391 PolarHBondContact NH1-OE1 2.71Å; R384-E391 VanDerWaalsContact NH1-OE1 3.08Å; R384-E391 IonicContact NH1-OE2 2.85Å; R384-E391 PolarHBondContact NH1-OE2 2.71Å; R384-E391 IonicContact NH2-OE2 3.42Å; R384-E391 PolarHBondContact NH2-OE2 2.83Å
385	I	97.2	Very high	95.7	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-69.7	-43.5	179.5	-62.2	-176.5	0	0	0	110.2	L226 F259 F349 I352 I382 P383 L388 I389	L226-I385 HydrophobicContact CD2-CD1 3.39Å; F259-I385 HydrophobicContact CE2-CD1 3.98Å; F259-I385 HydrophobicContact CZ-CD1 4.17Å; F349-I385 HydrophobicContact CD1-CD1 4.19Å; F349-I385 HydrophobicContact CD1-CG1 3.96Å; F349-I385 HydrophobicContact CE1-CD1 4.11Å; F349-I385 HydrophobicContact CE1-CG1 4.08Å; I352-I385 HydrophobicContact CD1-CB 4.49Å; I352-I385 HydrophobicContact CD1-CD1 3.8Å; I352-I385 HydrophobicContact CD1-CG1 3.88Å; I352-I385 HydrophobicContact CD1-CG2 3.98Å; I382-I385 HydrophobicContact CB-CD1 3.95Å; I382-I385 HydrophobicContact CB-CG1 4.04Å; I382-I385 HydrophobicContact CD1-CD1 4.02Å; I382-I385 HydrophobicContact CG2-CD1 4.35Å; I382-I385 HydrophobicContact CG2-CG1 4.08Å; I382-I385 WeakPolarHBondContact O-CB 3.43Å; I382-I385 PolarHBondContact O-N 3.19Å; P383-I385 PolarHBondContact O-N 3.5Å; I385-L388 PolarHBondContact O-N 2.91Å; I385-I389 HydrophobicContact CG2-CD1 4.1Å; I385-I389 WeakPolarHBondContact O-CG1 3.35Å; I385-I389 PolarHBondContact O-N 3.05Å
386	R	96.3	Very high	95.7	Very high	72 Å²	72	40.3 Å²	40.3	27%	0.272	22%	0.22	S	C	.	.	H	α-helix	trans	-61.1	-48.7	175.2	-62.4	-177.5	176.7	-166.5	-6.4	110.7	L375 T380 I382 P383 L388 I389 S390	L375-R386 HydrophobicContact CD1-CG 3.85Å; T380-R386 WeakPolarHBondContact O-CG 3.31Å; T380-R386 PolarHBondContact O-NE 3.27Å; I382-R386 PolarHBondContact O-N 3.09Å; P383-R386 PolarHBondContact O-N 3.49Å; P383-R386 VanDerWaalsContact O-N 3.14Å; R386-L388 PolarHBondContact O-N 3.33Å; R386-I389 PolarHBondContact O-N 3.49Å; R386-S390 PolarHBondContact O-N 3.01Å; R386-S390 PolarHBondContact O-OG 3.42Å
387	T	97.3	Very high	95.8	Very high	63 Å²	63	40.7 Å²	40.7	39%	0.387	22%	0.223	S	C	.	.	H	α-helix	trans	-61.1	-42.5	178.1	-56.6	0	0	0	0	112	P383 I389 S390 E391	P383-T387 PolarHBondContact O-N 2.94Å; P383-T387 PolarHBondContact O-OG1 3.12Å; T387-I389 VanDerWaalsContact C-N 3.33Å; T387-I389 PolarHBondContact O-N 3.31Å; T387-S390 PolarHBondContact O-N 3.38Å; T387-E391 HydrophobicContact CG2-CG 4.18Å; T387-E391 VanDerWaalsContact CG2-OE1 3.32Å; T387-E391 WeakPolarHBondContact CG2-OE1 3.45Å; T387-E391 WeakPolarHBondContact O-CB 3.44Å; T387-E391 VanDerWaalsContact O-CG 3.22Å; T387-E391 WeakPolarHBondContact O-CG 3.34Å; T387-E391 PolarHBondContact O-N 2.83Å
388	L	97.8	Very high	95.8	Very high	7 Å²	7	42 Å²	42	4%	0.037	23%	0.228	C	C	.	.	H	α-helix	trans	-59.9	-42.5	176.5	178.1	69.6	0	0	0	112.1	F349 L350 L353 R384 I385 R386 Y392	F349-L388 HydrophobicContact CB-CD2 4.25Å; F349-L388 WeakPolarHBondContact O-CD2 3.14Å; L350-L388 HydrophobicContact CD2-CD1 4.04Å; L353-L388 HydrophobicContact CD1-CD1 3.88Å; L353-L388 HydrophobicContact CD1-CG 4.18Å; L353-L388 HydrophobicContact CD2-CG 4.34Å; L353-L388 HydrophobicContact CG-CD1 4.39Å; L353-L388 HydrophobicContact CG-CD2 4.18Å; L353-L388 HydrophobicContact CG-CG 4.19Å; R384-L388 VanDerWaalsContact O-CB 3.23Å; R384-L388 WeakPolarHBondContact O-CB 3.25Å; R384-L388 PolarHBondContact O-N 3.35Å; I385-L388 PolarHBondContact O-N 2.91Å; R386-L388 PolarHBondContact O-N 3.33Å; L388-Y392 WeakPolarHBondContact O-CB 3.38Å; L388-Y392 PolarHBondContact O-N 3.38Å
389	I	97.6	Very high	95.7	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-67.5	-45.2	177.1	-68.6	172.4	0	0	0	109.9	V224 I373 L375 I385 R386 T387 E391 Y392 F393 P397	V224-I389 HydrophobicContact CG1-CD1 4.24Å; I373-I389 HydrophobicContact CD1-CG2 4.27Å; I373-I389 HydrophobicContact CG2-CG2 3.88Å; L375-I389 HydrophobicContact CD2-CD1 3.55Å; I385-I389 HydrophobicContact CG2-CD1 4.1Å; I385-I389 WeakPolarHBondContact O-CG1 3.35Å; I385-I389 PolarHBondContact O-N 3.05Å; R386-I389 PolarHBondContact O-N 3.49Å; T387-I389 VanDerWaalsContact C-N 3.33Å; T387-I389 PolarHBondContact O-N 3.31Å; I389-E391 PolarHBondContact O-N 3.49Å; I389-Y392 PolarHBondContact O-N 2.73Å; I389-F393 HydrophobicContact CG2-CD2 3.98Å; I389-F393 HydrophobicContact CG2-CE2 4.39Å; I389-F393 WeakPolarHBondContact O-CD2 3.44Å; I389-F393 PolarHBondContact O-N 3.11Å; I389-P397 HydrophobicContact CG2-CB 4.31Å; I389-P397 HydrophobicContact CG2-CG 4.38Å
390	S	97.6	Very high	95.4	Very high	21 Å²	21	47.5 Å²	47.5	15%	0.147	26%	0.259	C	S	.	.	H	α-helix	trans	-58.7	-46.6	175.7	-63.5	0	0	0	0	112.4	R386 T387 Y392 G394 K395 D396 P397	R386-S390 PolarHBondContact O-N 3.01Å; R386-S390 PolarHBondContact O-OG 3.42Å; T387-S390 PolarHBondContact O-N 3.38Å; S390-Y392 VanDerWaalsContact C-N 3.33Å; S390-Y392 PolarHBondContact O-N 3.48Å; S390-G394 VanDerWaalsContact O-CA 3.29Å; S390-G394 WeakPolarHBondContact O-CA 3.47Å; S390-G394 PolarHBondContact O-N 3.21Å; S390-K395 WeakPolarHBondContact CA-O 3.33Å; S390-K395 PolarHBondContact O-N 3.05Å; S390-D396 WeakPolarHBondContact CB-OD1 3.42Å; S390-D396 PolarHBondContact OG-OD1 2.95Å; S390-P397 WeakPolarHBondContact OG-CD 3.28Å
391	E	97.6	Very high	95.1	Very high	111 Å²	111	48.6 Å²	48.6	52%	0.519	27%	0.266	S	S	.	.	H	α-helix	trans	-59.5	-43.2	177	-76.4	168.6	-177.1	0	0	111.3	R384 T387 I389	R384-E391 IonicContact CZ-OE2 3.89Å; R384-E391 IonicContact NH1-OE1 3.48Å; R384-E391 PolarHBondContact NH1-OE1 2.71Å; R384-E391 VanDerWaalsContact NH1-OE1 3.08Å; R384-E391 IonicContact NH1-OE2 2.85Å; R384-E391 PolarHBondContact NH1-OE2 2.71Å; R384-E391 IonicContact NH2-OE2 3.42Å; R384-E391 PolarHBondContact NH2-OE2 2.83Å; T387-E391 HydrophobicContact CG2-CG 4.18Å; T387-E391 VanDerWaalsContact CG2-OE1 3.32Å; T387-E391 WeakPolarHBondContact CG2-OE1 3.45Å; T387-E391 WeakPolarHBondContact O-CB 3.44Å; T387-E391 VanDerWaalsContact O-CG 3.22Å; T387-E391 WeakPolarHBondContact O-CG 3.34Å; T387-E391 PolarHBondContact O-N 2.83Å; I389-E391 PolarHBondContact O-N 3.49Å
392	Y	98.1	Very high	94.9	Very high	50 Å²	50	47.5 Å²	47.5	20%	0.196	27%	0.267	C	S	.	.	H	α-helix	trans	-67.1	-48	-178.4	-178.8	-104	0	0	0	112	L353 V356 K357 L360 K367 L388 I389 S390	L353-Y392 HydrophobicContact CD1-CD2 4.01Å; L353-Y392 HydrophobicContact CD1-CG 4.25Å; L353-Y392 HydrophobicContact CD2-CD1 4.13Å; L353-Y392 HydrophobicContact CD2-CD2 4.29Å; L353-Y392 HydrophobicContact CD2-CG 3.81Å; V356-Y392 HydrophobicContact CG1-CD1 4.27Å; V356-Y392 HydrophobicContact CG1-CE1 3.89Å; K357-Y392 HydrophobicContact CD-CE2 4.48Å; K357-Y392 HydrophobicContact CG-CE2 4.24Å; K357-Y392 VanDerWaalsContact CG-OH 3.25Å; K357-Y392 WeakPolarHBondContact CG-OH 3.34Å; L360-Y392 HydrophobicContact CD1-CE1 4.12Å; K367-Y392 HydrophobicContact CB-CE1 4.33Å; K367-Y392 WeakPolarHBondContact CD-O 3.28Å; K367-Y392 PolarHBondContact NZ-O 2.93Å; L388-Y392 WeakPolarHBondContact O-CB 3.38Å; L388-Y392 PolarHBondContact O-N 3.38Å; I389-Y392 PolarHBondContact O-N 2.73Å; S390-Y392 VanDerWaalsContact C-N 3.33Å; S390-Y392 PolarHBondContact O-N 3.48Å
393	F	97.6	Very high	94.5	Very high	13 Å²	13	47.5 Å²	47.5	6%	0.057	27%	0.267	C	S	.	.	H	α-helix	trans	-86	-16.2	-176.5	-76.8	-79.3	0	0	0	114.6	L222 V356 L360 K367 V370 I373 I389 K395	L222-F393 HydrophobicContact CD2-CE1 4.34Å; L222-F393 HydrophobicContact CD2-CE2 3.65Å; L222-F393 HydrophobicContact CD2-CZ 3.38Å; V356-F393 HydrophobicContact CG1-CE2 3.72Å; V356-F393 HydrophobicContact CG1-CZ 3.54Å; L360-F393 HydrophobicContact CD1-CE1 4.07Å; L360-F393 HydrophobicContact CD1-CZ 4.11Å; K367-F393 HydrophobicContact CB-CD1 3.78Å; K367-F393 HydrophobicContact CB-CE1 3.85Å; V370-F393 HydrophobicContact CB-CE1 4.23Å; V370-F393 HydrophobicContact CG2-CE1 3.88Å; I373-F393 HydrophobicContact CD1-CB 3.61Å; I373-F393 HydrophobicContact CD1-CD1 3.95Å; I373-F393 HydrophobicContact CD1-CD2 3.43Å; I373-F393 VanDerWaalsContact CD1-CD2 3.43Å; I373-F393 HydrophobicContact CD1-CE2 4.08Å; I373-F393 HydrophobicContact CD1-CG 3.38Å; I373-F393 HydrophobicContact CG1-CD2 4.36Å; I373-F393 HydrophobicContact CG1-CG 4.42Å; I389-F393 HydrophobicContact CG2-CD2 3.98Å; I389-F393 HydrophobicContact CG2-CE2 4.39Å; I389-F393 WeakPolarHBondContact O-CD2 3.44Å; I389-F393 PolarHBondContact O-N 3.11Å; F393-K395 VanDerWaalsContact C-N 3.25Å; F393-K395 HydrophobicContact CB-CG 4.05Å; F393-K395 PolarHBondContact O-N 2.87Å
394	G	97	Very high	94.1	Very high	71 Å²	71	49.7 Å²	49.7	73%	0.732	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	18.6	-173.8	0	0	0	0	0	114	S390	S390-G394 VanDerWaalsContact O-CA 3.29Å; S390-G394 WeakPolarHBondContact O-CA 3.47Å; S390-G394 PolarHBondContact O-N 3.21Å
395	K	95.4	Very high	93.8	Very high	68 Å²	68	47.9 Å²	47.9	30%	0.296	27%	0.272	S	S	.	.	S	Bend	trans	-154.9	153.7	177.8	60.5	173.7	171.3	-175.7	0	111.3	V370 D371 I373 S390 F393	V370-K395 PolarHBondContact O-NZ 2.95Å; D371-K395 PolarHBondContact O-NZ 2.87Å; I373-K395 HydrophobicContact CD1-CG 4.21Å; S390-K395 WeakPolarHBondContact CA-O 3.33Å; S390-K395 PolarHBondContact O-N 3.05Å; F393-K395 VanDerWaalsContact C-N 3.25Å; F393-K395 HydrophobicContact CB-CG 4.05Å; F393-K395 PolarHBondContact O-N 2.87Å
396	D	95	Very high	93.7	Very high	131 Å²	131	47.9 Å²	47.9	70%	0.701	27%	0.272	S	S	*	.	P	Polyproline II helix	trans	-75.5	140	-177	-68	-40.2	0	0	0	112.7	S390	S390-D396 WeakPolarHBondContact CB-OD1 3.42Å; S390-D396 PolarHBondContact OG-OD1 2.95Å
397	P	94.4	Very high	93.6	Very high	13 Å²	13	45 Å²	45	8%	0.084	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-69	149.2	170.4	30	-33.7	0	0	0	110.7	I373 L375 I389 S390 T399	I373-P397 HydrophobicContact CB-CB 4.15Å; I373-P397 HydrophobicContact CG2-CB 3.99Å; L375-P397 HydrophobicContact CD1-CB 3.82Å; L375-P397 HydrophobicContact CD1-CG 3.72Å; L375-P397 HydrophobicContact CD2-CB 4.11Å; L375-P397 HydrophobicContact CG-CB 3.79Å; L375-P397 HydrophobicContact CG-CG 4.28Å; I389-P397 HydrophobicContact CG2-CB 4.31Å; I389-P397 HydrophobicContact CG2-CG 4.38Å; S390-P397 WeakPolarHBondContact OG-CD 3.28Å; P397-T399 PolarHBondContact O-N 2.81Å
398	N	90	Very high	93.5	Very high	37 Å²	37	42 Å²	42	20%	0.198	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-74.7	119.9	177.3	-166.7	-28.9	0	0	0	110.2	Y211 I373 S400	Y211-N398 HydrophobicContact CD1-CB 3.95Å; Y211-N398 VanDerWaalsContact CD1-CG 3.42Å; Y211-N398 VanDerWaalsContact CD1-OD1 3.28Å; Y211-N398 WeakPolarHBondContact CD1-OD1 3.4Å; Y211-N398 HydrophobicContact CE1-CB 4.14Å; Y211-N398 WeakPolarHBondContact CE1-O 3.5Å; I373-N398 PolarHBondContact O-N 2.97Å; N398-S400 VanDerWaalsContact OD1-CB 3.31Å; N398-S400 WeakPolarHBondContact OD1-CB 3.44Å; N398-S400 PolarHBondContact OD1-N 2.95Å; N398-S400 PolarHBondContact OD1-OG 3.23Å
399	T	86.5	Confident	93.4	Very high	63 Å²	63	42.8 Å²	42.8	39%	0.387	25%	0.249	S	C	.	.			trans	-120.2	24.1	178.7	67.9	0	0	0	0	112.4	L375 P397 V401	L375-T399 HydrophobicContact CD1-CG2 4.35Å; P397-T399 PolarHBondContact O-N 2.81Å; T399-V401 VanDerWaalsContact C-N 3.27Å; T399-V401 PolarHBondContact O-N 3.4Å
400	S	87.6	Confident	93.2	Very high	89 Å²	89	42.7 Å²	42.7	62%	0.622	25%	0.248	S	C	*	.	S	Bend	trans	-69.8	-22.4	-179.3	57.2	0	0	0	0	113.9	Y211 N398	Y211-S400 WeakPolarHBondContact CD1-OG 3.5Å; N398-S400 VanDerWaalsContact OD1-CB 3.31Å; N398-S400 WeakPolarHBondContact OD1-CB 3.44Å; N398-S400 PolarHBondContact OD1-N 2.95Å; N398-S400 PolarHBondContact OD1-OG 3.23Å
401	V	88.6	Confident	93.1	Very high	23 Å²	23	41.7 Å²	41.7	14%	0.139	24%	0.241	C	C	.	.	S	Bend	trans	-106.4	144.9	175.1	-173.5	0	0	0	0	109.3	A210 Y211 T399 A406	A210-V401 HydrophobicContact CB-CG1 4.27Å; A210-V401 HydrophobicContact CB-CG2 4.47Å; A210-V401 WeakPolarHBondContact O-CG2 3.4Å; Y211-V401 HydrophobicContact CD1-CB 4.16Å; Y211-V401 HydrophobicContact CD1-CG2 3.75Å; Y211-V401 HydrophobicContact CD2-CB 4.13Å; Y211-V401 HydrophobicContact CD2-CG2 3.94Å; Y211-V401 HydrophobicContact CE1-CB 3.78Å; Y211-V401 HydrophobicContact CE1-CG2 3.91Å; Y211-V401 HydrophobicContact CE2-CB 3.71Å; Y211-V401 HydrophobicContact CE2-CG1 4.41Å; Y211-V401 HydrophobicContact CE2-CG2 4.05Å; Y211-V401 HydrophobicContact CG-CB 4.35Å; Y211-V401 HydrophobicContact CG-CG2 3.8Å; Y211-V401 PolarHBondContact OH-O 3.45Å; T399-V401 VanDerWaalsContact C-N 3.27Å; T399-V401 PolarHBondContact O-N 3.4Å; V401-A406 HydrophobicContact CG1-CB 4.09Å
402	D	90.7	Very high	93	Very high	63 Å²	63	36.4 Å²	36.4	34%	0.337	22%	0.217	S	C	.	.			trans	-60.9	121.4	170.7	-173.7	-51.6	0	0	0	109.7	R381 D404 L405 A406	R381-D402 IonicContact CZ-OD1 3.67Å; R381-D402 IonicContact CZ-OD2 2.78Å; R381-D402 IonicContact NH1-OD2 2.93Å; R381-D402 IonicContact NH2-OD1 3.38Å; R381-D402 PolarHBondContact NH2-OD1 3.24Å; R381-D402 IonicContact NH2-OD2 3.78Å; R381-D402 PolarHBondContact NH2-OD2 3.43Å; D402-D404 PolarHBondContact O-N 2.96Å; D402-D404 WeakPolarHBondContact OD1-CB 3.43Å; D402-D404 PolarHBondContact OD1-N 3.38Å; D402-L405 HydrophobicContact CB-CB 4.13Å; D402-L405 HydrophobicContact CB-CD1 4.13Å; D402-L405 HydrophobicContact CB-CG 4.11Å; D402-L405 CarbonylContact O-C 3.51Å; D402-L405 PolarHBondContact O-N 3.21Å; D402-A406 PolarHBondContact O-N 2.7Å
403	P	89.8	Confident	92.7	Very high	6 Å²	6	34.6 Å²	34.6	4%	0.039	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-24.6	-174	27	-35.8	0	0	0	113.4	G377 R381 L405	G377-P403 PolarHBondContact N-O 3.03Å; R381-P403 HydrophobicContact CG-CG 3.91Å; P403-L405 VanDerWaalsContact C-N 3.34Å
404	D	87.4	Confident	92.4	Very high	80 Å²	80	34 Å²	34	43%	0.428	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-19.1	177.1	-62	-57.5	0	0	0	111.8	G378 R381 D402	G378-D404 WeakPolarHBondContact CA-OD1 3.46Å; G378-D404 PolarHBondContact N-OD1 2.94Å; R381-D404 IonicContact CZ-OD2 3.1Å; R381-D404 IonicContact NE-OD2 2.86Å; R381-D404 PolarHBondContact NE-OD2 2.94Å; R381-D404 VanDerWaalsContact NE-OD2 3.16Å; R381-D404 IonicContact NH2-OD2 3.48Å; R381-D404 PolarHBondContact NH2-OD2 2.91Å; D402-D404 PolarHBondContact O-N 2.96Å; D402-D404 WeakPolarHBondContact OD1-CB 3.43Å; D402-D404 PolarHBondContact OD1-N 3.38Å
405	L	91.5	Very high	92.2	Very high	24 Å²	24	30.6 Å²	30.6	13%	0.126	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.2	-6.1	-178.6	-52.7	-179	0	0	0	113.1	V57 K65 D402 P403 V407 V408 T409	V57-L405 HydrophobicContact CG1-CD2 4.34Å; V57-L405 HydrophobicContact CG2-CB 4.49Å; V57-L405 HydrophobicContact CG2-CD1 4.41Å; K65-L405 HydrophobicContact CB-CD2 4Å; K65-L405 HydrophobicContact CD-CD1 3.71Å; D402-L405 HydrophobicContact CB-CB 4.13Å; D402-L405 HydrophobicContact CB-CD1 4.13Å; D402-L405 HydrophobicContact CB-CG 4.11Å; D402-L405 CarbonylContact O-C 3.51Å; D402-L405 PolarHBondContact O-N 3.21Å; P403-L405 VanDerWaalsContact C-N 3.34Å; L405-V407 VanDerWaalsContact C-N 3.32Å; L405-V407 PolarHBondContact O-N 2.74Å; L405-V408 HydrophobicContact CB-CG1 4.23Å; L405-V408 HydrophobicContact CD2-CG1 4.44Å; L405-V408 VanDerWaalsContact O-CG1 3.24Å; L405-V408 WeakPolarHBondContact O-CG1 3.17Å; L405-V408 PolarHBondContact O-N 3.29Å; L405-T409 VanDerWaalsContact O-CB 3.27Å; L405-T409 WeakPolarHBondContact O-CB 3.36Å; L405-T409 PolarHBondContact O-N 3.33Å; L405-T409 PolarHBondContact O-OG1 2.83Å
406	A	93.8	Very high	92	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-55.8	-44.6	-174.6	0	0	0	0	0	112.7	A207 A210 Y211 V376 V401 D402 G410	A207-A406 HydrophobicContact CB-CB 4.43Å; A210-A406 WeakPolarHBondContact CB-O 3.41Å; Y211-A406 HydrophobicContact CE2-CB 3.91Å; V376-A406 HydrophobicContact CG2-CB 4.3Å; V401-A406 HydrophobicContact CG1-CB 4.09Å; D402-A406 PolarHBondContact O-N 2.7Å; A406-G410 PolarHBondContact O-N 2.94Å
407	V	94.2	Very high	91.6	Very high	10 Å²	10	22.4 Å²	22.4	6%	0.061	13%	0.133	C	C	.	.	H	α-helix	trans	-64.2	-57.9	179.7	178.5	0	0	0	0	110.5	D37 E203 A206 V376 L405 T409 G410 V411	D37-V407 HydrophobicContact CB-CG1 4.14Å; E203-V407 HydrophobicContact CB-CG1 4.33Å; E203-V407 HydrophobicContact CB-CG2 4.39Å; E203-V407 HydrophobicContact CG-CG1 4Å; A206-V407 HydrophobicContact CB-CG1 4.32Å; V376-V407 HydrophobicContact CG1-CG2 3.99Å; L405-V407 VanDerWaalsContact C-N 3.32Å; L405-V407 PolarHBondContact O-N 2.74Å; V407-T409 PolarHBondContact O-N 2.83Å; V407-G410 PolarHBondContact O-N 3.24Å; V407-V411 HydrophobicContact CG1-CG2 4.23Å; V407-V411 VanDerWaalsContact O-CG2 3.3Å; V407-V411 WeakPolarHBondContact O-CG2 3.27Å; V407-V411 PolarHBondContact O-N 2.92Å
408	V	96.1	Very high	91.3	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-58.4	-36.6	-178.9	66.1	0	0	0	0	112.3	D37 V45 G46 V57 L405 V411 A412	D37-V408 HydrophobicContact CB-CB 3.91Å; D37-V408 HydrophobicContact CB-CG2 4.43Å; V45-V408 VanDerWaalsContact C-CG2 3.47Å; G46-V408 VanDerWaalsContact N-CG2 3.32Å; V57-V408 HydrophobicContact CG1-CG1 4.14Å; V57-V408 HydrophobicContact CG2-CG1 3.89Å; L405-V408 HydrophobicContact CB-CG1 4.23Å; L405-V408 HydrophobicContact CD2-CG1 4.44Å; L405-V408 VanDerWaalsContact O-CG1 3.24Å; L405-V408 WeakPolarHBondContact O-CG1 3.17Å; L405-V408 PolarHBondContact O-N 3.29Å; V408-V411 PolarHBondContact O-N 3.09Å; V408-A412 VanDerWaalsContact O-CB 3.31Å; V408-A412 WeakPolarHBondContact O-CB 3.44Å; V408-A412 PolarHBondContact O-N 3.13Å
409	T	95.2	Very high	91	Very high	24 Å²	24	24.4 Å²	24.4	15%	0.147	15%	0.151	C	C	.	.	H	α-helix	trans	-61.6	-46.8	175.5	-67.7	0	0	0	0	111.2	V55 A210 L405 V407 A412 I413	V55-T409 HydrophobicContact CB-CG2 4.13Å; V55-T409 HydrophobicContact CG1-CG2 4.03Å; V55-T409 HydrophobicContact CG2-CG2 4.16Å; A210-T409 HydrophobicContact CB-CG2 3.76Å; L405-T409 VanDerWaalsContact O-CB 3.27Å; L405-T409 WeakPolarHBondContact O-CB 3.36Å; L405-T409 PolarHBondContact O-N 3.33Å; L405-T409 PolarHBondContact O-OG1 2.83Å; V407-T409 PolarHBondContact O-N 2.83Å; T409-A412 PolarHBondContact O-N 3.3Å; T409-I413 HydrophobicContact CG2-CD1 4.4Å; T409-I413 WeakPolarHBondContact O-CG1 3.28Å; T409-I413 PolarHBondContact O-N 3.47Å
410	G	93.7	Very high	90.7	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-62.1	-44.6	176.9	0	0	0	0	0	113.8	A206 A406 V407 A412 I413 Q414	A206-G410 WeakPolarHBondContact O-CA 3.39Å; A406-G410 PolarHBondContact O-N 2.94Å; V407-G410 PolarHBondContact O-N 3.24Å; G410-A412 VanDerWaalsContact C-N 3.29Å; G410-A412 PolarHBondContact O-N 3.27Å; G410-I413 PolarHBondContact O-N 3.36Å; G410-Q414 PolarHBondContact O-N 2.9Å
411	V	95.3	Very high	89.8	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63.4	-38.3	176.9	-173.3	0	0	0	0	110.5	V171 I201 A206 V407 V408 Q414 A415	V171-V411 HydrophobicContact CB-CG1 3.94Å; V171-V411 HydrophobicContact CG1-CG1 3.72Å; V171-V411 VanDerWaalsContact O-CG1 3.24Å; V171-V411 WeakPolarHBondContact O-CG1 3.17Å; I201-V411 HydrophobicContact CG2-CG1 4.34Å; I201-V411 HydrophobicContact CG2-CG2 3.9Å; A206-V411 HydrophobicContact CB-CG2 3.74Å; V407-V411 HydrophobicContact CG1-CG2 4.23Å; V407-V411 VanDerWaalsContact O-CG2 3.3Å; V407-V411 WeakPolarHBondContact O-CG2 3.27Å; V407-V411 PolarHBondContact O-N 2.92Å; V408-V411 PolarHBondContact O-N 3.09Å; V411-Q414 PolarHBondContact O-N 3.16Å; V411-A415 WeakPolarHBondContact O-CB 3.37Å; V411-A415 PolarHBondContact O-N 3.2Å
412	A	95.2	Very high	88.7	Confident	0 Å²	0	23 Å²	23	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-64.7	-42	175.5	0	0	0	0	0	112	F48 V55 V408 T409 G410 Q414 A415 G416	F48-A412 WeakPolarHBondContact CB-O 3.37Å; V55-A412 HydrophobicContact CG1-CB 3.62Å; V55-A412 HydrophobicContact CG2-CB 4.48Å; V408-A412 VanDerWaalsContact O-CB 3.31Å; V408-A412 WeakPolarHBondContact O-CB 3.44Å; V408-A412 PolarHBondContact O-N 3.13Å; T409-A412 PolarHBondContact O-N 3.3Å; G410-A412 VanDerWaalsContact C-N 3.29Å; G410-A412 PolarHBondContact O-N 3.27Å; A412-Q414 VanDerWaalsContact C-N 3.31Å; A412-Q414 PolarHBondContact O-N 3.34Å; A412-A415 WeakPolarHBondContact O-CA 3.47Å; A412-A415 WeakPolarHBondContact O-CB 3.34Å; A412-A415 PolarHBondContact O-N 2.89Å; A412-A415 VanDerWaalsContact O-N 3.11Å; A412-G416 PolarHBondContact O-N 3.37Å
413	I	92	Very high	87	Confident	12 Å²	12	26 Å²	26	6%	0.062	17%	0.174	C	C	.	.	H	α-helix	trans	-56.7	-47.6	172.5	-65.1	167.3	0	0	0	110.2	V55 M209 T409 G410 A415 G416 I417 W422	V55-I413 HydrophobicContact CG2-CD1 4.25Å; V55-I413 HydrophobicContact CG2-CG1 3.48Å; V55-I413 VanDerWaalsContact CG2-CG1 3.48Å; M209-I413 HydrophobicContact CE-CB 4.35Å; M209-I413 HydrophobicContact CE-CG2 3.85Å; T409-I413 HydrophobicContact CG2-CD1 4.4Å; T409-I413 WeakPolarHBondContact O-CG1 3.28Å; T409-I413 PolarHBondContact O-N 3.47Å; G410-I413 PolarHBondContact O-N 3.36Å; I413-A415 VanDerWaalsContact C-N 3.3Å; I413-A415 PolarHBondContact O-N 3.37Å; I413-G416 PolarHBondContact O-N 3.11Å; I413-G416 VanDerWaalsContact O-N 3.12Å; I413-I417 HydrophobicContact CG2-CD1 4.04Å; I413-I417 WeakPolarHBondContact O-CG1 3.34Å; I413-I417 PolarHBondContact O-N 3.34Å; I413-W422 HydrophobicContact CG2-CZ2 4.47Å
414	Q	91.3	Very high	85.2	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-62.1	-37.8	177	-173.7	69.5	1.9	0	0	111.9	V171 I201 M209 G410 V411 A412 I417 M418 S427	V171-Q414 HydrophobicContact CG1-CB 4.18Å; V171-Q414 HydrophobicContact CG1-CG 3.88Å; V171-Q414 HydrophobicContact CG2-CG 4.42Å; I201-Q414 HydrophobicContact CD1-CB 4.34Å; I201-Q414 HydrophobicContact CD1-CG 4.29Å; M209-Q414 HydrophobicContact CE-CB 4.1Å; M209-Q414 HydrophobicContact SD-CB 4.37Å; G410-Q414 PolarHBondContact O-N 2.9Å; V411-Q414 PolarHBondContact O-N 3.16Å; A412-Q414 VanDerWaalsContact C-N 3.31Å; A412-Q414 PolarHBondContact O-N 3.34Å; Q414-I417 PolarHBondContact O-N 3.12Å; Q414-M418 WeakPolarHBondContact O-CG 3.35Å; Q414-M418 PolarHBondContact O-N 2.67Å; Q414-S427 PolarHBondContact NE2-OG 3.25Å
415	A	93.3	Very high	83.5	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-62.1	-41.1	172.9	0	0	0	0	0	112.2	V33 V171 V411 A412 I413 I417 M418 G419	V33-A415 HydrophobicContact CB-CB 4.28Å; V33-A415 HydrophobicContact CG1-CB 3.78Å; V171-A415 HydrophobicContact CB-CB 4.21Å; V171-A415 HydrophobicContact CG2-CB 3.97Å; V411-A415 WeakPolarHBondContact O-CB 3.37Å; V411-A415 PolarHBondContact O-N 3.2Å; A412-A415 WeakPolarHBondContact O-CA 3.47Å; A412-A415 WeakPolarHBondContact O-CB 3.34Å; A412-A415 PolarHBondContact O-N 2.89Å; A412-A415 VanDerWaalsContact O-N 3.11Å; I413-A415 VanDerWaalsContact C-N 3.3Å; I413-A415 PolarHBondContact O-N 3.37Å; A415-I417 PolarHBondContact O-N 3.41Å; A415-M418 PolarHBondContact O-N 3.21Å; A415-G419 PolarHBondContact O-N 2.95Å
416	G	90.3	Very high	81.6	Confident	4 Å²	4	34.9 Å²	34.9	4%	0.041	21%	0.214	C	C	.	.	H	α-helix	trans	-59.6	-42.3	173.1	0	0	0	0	0	113.1	A412 I413 G419 G420 S421	A412-G416 PolarHBondContact O-N 3.37Å; I413-G416 PolarHBondContact O-N 3.11Å; I413-G416 VanDerWaalsContact O-N 3.12Å; G416-G419 PolarHBondContact O-N 2.92Å; G416-G420 PolarHBondContact O-N 2.92Å; G416-S421 PolarHBondContact O-N 3.2Å
417	I	87.6	Confident	79.8	Confident	23 Å²	23	36.1 Å²	36.1	12%	0.118	22%	0.223	C	C	.	.	H	α-helix	trans	-63.3	-48.6	174.9	-64.1	155.2	0	0	0	110.7	M209 I413 Q414 A415 G419 G420 W422 V426	M209-I417 HydrophobicContact CE-CD1 3.85Å; I413-I417 HydrophobicContact CG2-CD1 4.04Å; I413-I417 WeakPolarHBondContact O-CG1 3.34Å; I413-I417 PolarHBondContact O-N 3.34Å; Q414-I417 PolarHBondContact O-N 3.12Å; A415-I417 PolarHBondContact O-N 3.41Å; I417-G419 PolarHBondContact O-N 3.45Å; I417-G420 PolarHBondContact O-N 2.86Å; I417-G420 VanDerWaalsContact O-N 3.09Å; I417-W422 HydrophobicContact CG1-CB 3.79Å; I417-W422 HydrophobicContact CG1-CG 3.89Å; I417-V426 WeakPolarHBondContact CD1-O 3.37Å
418	M	87.5	Confident	78.2	Confident	54 Å²	54	35.8 Å²	35.8	27%	0.266	22%	0.221	S	C	.	.	H	α-helix	trans	-65.6	-28.6	178.2	-63.7	-62.8	93.6	0	0	112.6	V171 L198 R199 Q414 A415 G420	V171-M418 HydrophobicContact CG2-CB 4.4Å; V171-M418 HydrophobicContact CG2-CG 3.96Å; L198-M418 HydrophobicContact CB-CB 4.46Å; L198-M418 HydrophobicContact CD1-CB 3.97Å; R199-M418 HydrophobicContact CB-CG 4.41Å; R199-M418 HydrophobicContact CB-SD 4.45Å; Q414-M418 WeakPolarHBondContact O-CG 3.35Å; Q414-M418 PolarHBondContact O-N 2.67Å; A415-M418 PolarHBondContact O-N 3.21Å; M418-G420 VanDerWaalsContact C-N 3.27Å; M418-G420 PolarHBondContact O-N 2.89Å
419	G	84.6	Confident	76.7	Confident	38 Å²	38	39.5 Å²	39.5	39%	0.392	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	1.4	174.3	0	0	0	0	0	114.7	A415 G416 I417 S421	A415-G419 PolarHBondContact O-N 2.95Å; G416-G419 PolarHBondContact O-N 2.92Å; I417-G419 PolarHBondContact O-N 3.45Å; G419-S421 PolarHBondContact O-N 3.25Å; G419-S421 PolarHBondContact O-OG 2.97Å
420	G	79.5	Confident	75.4	Confident	71 Å²	71	40.2 Å²	40.2	73%	0.732	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.2	18.6	-177.6	0	0	0	0	0	114.1	G416 I417 M418	G416-G420 PolarHBondContact O-N 2.92Å; I417-G420 PolarHBondContact O-N 2.86Å; I417-G420 VanDerWaalsContact O-N 3.09Å; M418-G420 VanDerWaalsContact C-N 3.27Å; M418-G420 PolarHBondContact O-N 2.89Å
421	S	69.1	Low	73.9	Confident	40 Å²	40	44.4 Å²	44.4	28%	0.28	26%	0.264	S	S	.	.			trans	-97.1	-2.6	-174.6	-60.1	0	0	0	0	113.6	F48 G416 G419	F48-S421 WeakPolarHBondContact CE1-O 3.4Å; G416-S421 PolarHBondContact O-N 3.2Å; G419-S421 PolarHBondContact O-N 3.25Å; G419-S421 PolarHBondContact O-OG 2.97Å
422	W	64.3	Low	72.2	Confident	34 Å²	34	49.7 Å²	49.7	13%	0.129	30%	0.298	C	S	.	.	S	Bend	trans	-114.8	131.5	179.2	-169.8	-115	0	0	0	111.1	F48 G53 H214 K215 I413 I417 L424	F48-W422 HydrophobicContact CD2-CE3 4.38Å; F48-W422 HydrophobicContact CD2-CZ3 4.36Å; F48-W422 AromaticContact CE1-CE3 3.76Å; F48-W422 HydrophobicContact CE1-CE3 3.76Å; F48-W422 HydrophobicContact CE1-CZ3 4.3Å; F48-W422 HydrophobicContact CE2-CD2 4.31Å; F48-W422 AromaticContact CE2-CE3 3.32Å; F48-W422 HydrophobicContact CE2-CE3 3.32Å; F48-W422 AromaticContact CE2-CH2 3.98Å; F48-W422 HydrophobicContact CE2-CH2 3.98Å; F48-W422 AromaticContact CE2-CZ3 3.13Å; F48-W422 HydrophobicContact CE2-CZ3 3.13Å; F48-W422 HydrophobicContact CZ-CD2 4.1Å; F48-W422 AromaticContact CZ-CE3 2.96Å; F48-W422 HydrophobicContact CZ-CE3 2.96Å; F48-W422 HydrophobicContact CZ-CH2 4.33Å; F48-W422 AromaticContact CZ-CZ3 3.13Å; F48-W422 HydrophobicContact CZ-CZ3 3.13Å; G53-W422 WeakPolarHBondContact O-CZ3 3.33Å; H214-W422 AromaticContact NE2-CZ2 3.77Å; K215-W422 VanDerWaalsContact NZ-CH2 3.31Å; I413-W422 HydrophobicContact CG2-CZ2 4.47Å; I417-W422 HydrophobicContact CG1-CB 3.79Å; I417-W422 HydrophobicContact CG1-CG 3.89Å; W422-L424 VanDerWaalsContact C-N 3.25Å; W422-L424 PolarHBondContact O-N 3.35Å
423	P	55	Low	70.7	Confident	127 Å²	127	52.7 Å²	52.7	83%	0.825	31%	0.314	S	S	*	.	S	Bend	trans	-73.5	-9.1	-175.4	26.1	-32	0	0	0	114.7
424	L	53.3	Low	69.4	Low	71 Å²	71	63.2 Å²	63.2	37%	0.372	35%	0.353	S	S	.	.			trans	-95.9	129.8	177	-65.6	163.5	0	0	0	111.4	K215 W422 V426	K215-L424 HydrophobicContact CD-CD1 4.25Å; K215-L424 HydrophobicContact CG-CD1 4.12Å; W422-L424 VanDerWaalsContact C-N 3.25Å; W422-L424 PolarHBondContact O-N 3.35Å; L424-V426 HydrophobicContact CB-CG2 4.29Å; L424-V426 PolarHBondContact O-N 3.03Å
425	Q	50.6	Low	68.2	Low	201 Å²	201	71 Å²	71	94%	0.939	39%	0.389	S	S	*	.			trans	-78.4	50.4	165	-69.6	-176.3	-12.3	0	0	111.4
426	V	52.3	Low	67.2	Low	23 Å²	23	73.1 Å²	73.1	14%	0.139	40%	0.4	C	S	.	.			trans	-101.8	86.1	168.3	179.3	0	0	0	0	106.7	H214 I417 L424	H214-V426 HydrophobicContact CB-CG1 4.08Å; I417-V426 WeakPolarHBondContact CD1-O 3.37Å; L424-V426 HydrophobicContact CB-CG2 4.29Å; L424-V426 PolarHBondContact O-N 3.03Å
427	S	56.5	Low	66.4	Low	26 Å²	26	83 Å²	83	18%	0.182	44%	0.436	C	S	.	.			trans	-78.8	120.8	164.5	-169.6	0	0	0	0	106.5	Q414 I429	Q414-S427 PolarHBondContact NE2-OG 3.25Å; S427-I429 PolarHBondContact O-N 3.22Å
428	A	59.4	Low	66.1	Low	3 Å²	3	83.3 Å²	83.3	3%	0.025	44%	0.437	C	S	.	.			trans	-61.9	95.8	165.9	0	0	0	0	0	107.7	I201 T205 M209 F243	I201-A428 HydrophobicContact CD1-CB 4.02Å; T205-A428 HydrophobicContact CG2-CB 4.02Å; M209-A428 HydrophobicContact CE-CB 4.28Å; M209-A428 HydrophobicContact CG-CB 4.43Å; M209-A428 HydrophobicContact SD-CB 3.45Å; M209-A428 WeakPolarHBondContact SD-CB 3.4Å; F243-A428 HydrophobicContact CD2-CB 4.11Å
429	I	64.1	Low	66	Low	79 Å²	79	83 Å²	83	41%	0.405	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	120.3	172.7	-60.7	172.1	0	0	0	105.7	M242 F243 S427	M242-I429 HydrophobicContact CG-CB 4.18Å; F243-I429 PolarHBondContact N-O 2.93Å; S427-I429 PolarHBondContact O-N 3.22Å
430	E	67.6	Low	65.9	Low	39 Å²	39	85.1 Å²	85.1	18%	0.182	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	133.3	175.5	-60.5	-175.5	157.5	0	0	109	R183 N202 T205 P432	R183-E430 IonicContact NH1-OE2 3.84Å; N202-E430 WeakPolarHBondContact CA-OE1 3.35Å; N202-E430 WeakPolarHBondContact CB-OE1 3.17Å; N202-E430 PolarHBondContact N-OE1 3.14Å; N202-E430 PolarHBondContact N-OE2 2.93Å; N202-E430 VanDerWaalsContact ND2-CD 3.3Å; N202-E430 PolarHBondContact ND2-OE1 2.95Å; N202-E430 PolarHBondContact ND2-OE2 3.28Å; N202-E430 PolarHBondContact OD1-OE2 3.15Å; N202-E430 VanDerWaalsContact OD1-OE2 3.08Å; T205-E430 WeakPolarHBondContact CB-OE1 3.41Å; T205-E430 HydrophobicContact CG2-CG 4.48Å; T205-E430 PolarHBondContact OG1-OE1 3.22Å; E430-P432 WeakPolarHBondContact O-CD 2.9Å
431	I	62.2	Low	66	Low	88 Å²	88	84.9 Å²	84.9	45%	0.451	42%	0.419	S	S	.	.			trans	-93.5	115.6	170.9	-59.6	173.8	0	0	0	106.7	L244 N433	L244-I431 HydrophobicContact CD1-CB 3.98Å; L244-I431 HydrophobicContact CD1-CG2 4.41Å; I431-N433 PolarHBondContact O-N 3.26Å; I431-N433 VanDerWaalsContact O-N 3.1Å
432	P	59.6	Low	65.8	Low	111 Å²	111	89.1 Å²	89.1	72%	0.721	45%	0.449	S	S	*	.			trans	-61.8	116.6	178	-19.3	30.6	0	0	0	109.9	E430 R434	E430-P432 WeakPolarHBondContact O-CD 2.9Å; P432-R434 PolarHBondContact O-N 3.4Å
433	N	65.5	Low	65.9	Low	62 Å²	62	91.9 Å²	91.9	33%	0.332	47%	0.465	S	S	.	.			trans	-89.8	96.3	171.6	-177.4	-3.3	0	0	0	108.9	I431 H435 L436	I431-N433 PolarHBondContact O-N 3.26Å; I431-N433 VanDerWaalsContact O-N 3.1Å; N433-H435 PolarHBondContact O-N 2.84Å; N433-H435 PolarHBondContact OD1-N 3.41Å; N433-H435 VanDerWaalsContact OD1-N 3.17Å; N433-L436 HydrophobicContact CB-CB 3.9Å; N433-L436 VanDerWaalsContact O-CB 3.23Å; N433-L436 WeakPolarHBondContact O-CB 3.13Å; N433-L436 PolarHBondContact O-N 2.78Å; N433-L436 PolarHBondContact OD1-N 3Å
434	R	63	Low	66.4	Low	233 Å²	233	90 Å²	90	88%	0.879	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-15	-178.5	-68.7	-175.7	175.8	-177.4	-2	114.2	P432	P432-R434 PolarHBondContact O-N 3.4Å
435	H	65.9	Low	67.2	Low	165 Å²	165	91.1 Å²	91.1	76%	0.764	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	-2	177.9	-60.8	-65.3	0	0	0	113	N433 R437	N433-H435 PolarHBondContact O-N 2.84Å; N433-H435 PolarHBondContact OD1-N 3.41Å; N433-H435 VanDerWaalsContact OD1-N 3.17Å; H435-R437 PolarHBondContact O-N 3.09Å
436	L	72.4	Confident	68.1	Low	43 Å²	43	84.6 Å²	84.6	23%	0.225	42%	0.421	C	S	.	.			trans	-64.9	120.2	177.4	-167.3	70	0	0	0	109.1	T245 M248 N433	T245-L436 HydrophobicContact CG2-CD1 4.28Å; T245-L436 HydrophobicContact CG2-CD2 3.71Å; M248-L436 HydrophobicContact CG-CD1 4.33Å; M248-L436 HydrophobicContact CG-CD2 4.17Å; M248-L436 HydrophobicContact CG-CG 4.45Å; M248-L436 HydrophobicContact SD-CD2 3.63Å; M248-L436 HydrophobicContact SD-CG 4.26Å; N433-L436 HydrophobicContact CB-CB 3.9Å; N433-L436 VanDerWaalsContact O-CB 3.23Å; N433-L436 WeakPolarHBondContact O-CB 3.13Å; N433-L436 PolarHBondContact O-N 2.78Å; N433-L436 PolarHBondContact OD1-N 3Å
437	R	75.2	Confident	69.1	Low	211 Å²	211	88.4 Å²	88.4	80%	0.796	44%	0.439	S	S	*	.			trans	-126.3	132.7	172.3	-68.2	-175.2	177.8	-173	-0.8	107.4	H435 T439	H435-R437 PolarHBondContact O-N 3.09Å; R437-T439 PolarHBondContact O-N 3.2Å
438	K	80.8	Confident	70	Confident	31 Å²	31	92.6 Å²	92.6	14%	0.135	46%	0.456	C	S	.	.			trans	-76.2	116.3	174.3	-176.5	-178.5	-179.4	-177.1	0	109.1	E177 D232 M248 N440	E177-K438 HydrophobicContact CB-CB 4.27Å; E177-K438 HydrophobicContact CB-CD 4.35Å; E177-K438 HydrophobicContact CG-CD 4.27Å; E177-K438 WeakPolarHBondContact OE1-CD 3.39Å; E177-K438 IonicContact OE1-NZ 3.47Å; E177-K438 PolarHBondContact OE1-NZ 3.37Å; D232-K438 VanDerWaalsContact CG-NZ 3.25Å; D232-K438 WeakPolarHBondContact OD1-CE 3.47Å; D232-K438 IonicContact OD1-NZ 3.08Å; D232-K438 PolarHBondContact OD1-NZ 2.81Å; D232-K438 IonicContact OD2-NZ 3.43Å; D232-K438 PolarHBondContact OD2-NZ 3.24Å; M248-K438 HydrophobicContact CB-CB 4.44Å; M248-K438 HydrophobicContact CB-CG 4.47Å; M248-K438 WeakPolarHBondContact O-CA 3.4Å; K438-N440 VanDerWaalsContact CE-OD1 3.3Å; K438-N440 WeakPolarHBondContact CE-OD1 3.24Å; K438-N440 PolarHBondContact O-N 2.92Å
439	T	84.8	Confident	70.7	Confident	48 Å²	48	99 Å²	99	29%	0.294	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	112.5	171.4	-61.9	0	0	0	0	108.6	M248 A249 G250 T358 E362 R437 F441	M248-T439 PolarHBondContact O-N 2.81Å; M248-T439 VanDerWaalsContact O-N 3.16Å; A249-T439 CarbonylContact C-O 3.44Å; A249-T439 WeakPolarHBondContact CA-O 3.49Å; G250-T439 PolarHBondContact N-O 3.23Å; T358-T439 HydrophobicContact CG2-CG2 4.22Å; E362-T439 PolarHBondContact OE1-OG1 2.87Å; R437-T439 PolarHBondContact O-N 3.2Å; T439-F441 HydrophobicContact CG2-CE1 4.43Å; T439-F441 HydrophobicContact CG2-CE2 4.04Å; T439-F441 HydrophobicContact CG2-CZ 3.81Å
440	N	82.3	Confident	71.2	Confident	81 Å²	81	100.5 Å²	100.5	43%	0.433	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	128.4	-179.7	-76.7	-46.3	0	0	0	111.5	G250 N252 K438	G250-N440 CarbonylContact O-C 3.36Å; G250-N440 WeakPolarHBondContact O-CA 3.47Å; N252-N440 PolarHBondContact ND2-ND2 2.82Å; K438-N440 VanDerWaalsContact CE-OD1 3.3Å; K438-N440 WeakPolarHBondContact CE-OD1 3.24Å; K438-N440 PolarHBondContact O-N 2.92Å
441	F	81.9	Confident	71.5	Confident	66 Å²	66	105.7 Å²	105.7	29%	0.289	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	154.4	173	-61.1	-80	0	0	0	111.1	A249 G250 N251 V354 P355 T358 T439	A249-F441 HydrophobicContact CB-CE2 4.16Å; G250-F441 WeakPolarHBondContact O-CD2 3.42Å; G250-F441 PolarHBondContact O-N 3.38Å; N251-F441 HydrophobicContact CB-CB 4.4Å; N251-F441 PolarHBondContact OD1-O 3.33Å; V354-F441 HydrophobicContact CG1-CD1 3.8Å; V354-F441 HydrophobicContact CG1-CD2 4.02Å; V354-F441 HydrophobicContact CG1-CE1 3.72Å; V354-F441 HydrophobicContact CG1-CE2 3.95Å; V354-F441 HydrophobicContact CG1-CG 3.96Å; V354-F441 HydrophobicContact CG1-CZ 3.82Å; P355-F441 HydrophobicContact CB-CD2 4.32Å; P355-F441 HydrophobicContact CB-CE2 4.27Å; T358-F441 HydrophobicContact CG2-CE2 4.26Å; T358-F441 HydrophobicContact CG2-CZ 4Å; T358-F441 WeakPolarHBondContact OG1-CZ 3.18Å; T439-F441 HydrophobicContact CG2-CE1 4.43Å; T439-F441 HydrophobicContact CG2-CE2 4.04Å; T439-F441 HydrophobicContact CG2-CZ 3.81Å
442	S	64.6	Low	72.4	Confident	129 Å²	129	107.3 Å²	107.3	90%	0.902	53%	0.525	S	S	*	.			trans	-105.6	0	178	61.8	0	0	0	0	112.3

Retrieved 442 of 442 residues in 983.8 ms (Link to these results)

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