A0A3B3V5C7_9TELE Loading...

Elongation factor 1-alpha

This protein promotes the GTP-dependent binding of aminoacyl-tRNA to the A-site of ribosomes during protein biosynthesis. Translation elongation factor that catalyzes the GTP-dependent binding of aminoacyl-tRNA (aa-tRNA) to the A-site of ribosomes during the elongation phase of protein synthesis. Base pairing between the mRNA codon and the aa-tRNA anticodon promotes GTP hydrolysis, releasing the aa-tRNA from EEF1A1 and allowing its accommodation into the ribosome. The growing protein chain is subsequently transferred from the P-site peptidyl tRNA to the A-site aa-tRNA, extending it by one amino acid through ribosome-catalyzed peptide bond formation.

AlphaFold DB , UniProt , Accession A0A3B3V5C7, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 462 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	37.1	Very low	73.6	Confident	240 Å²	240	81.5 Å²	81.5	100%	1.182	43%	0.426	S	S	*	.				0	114.3	0	-72.3	167.4	83.4	0	0	107.1
2	G	46.7	Very low	75.1	Confident	78 Å²	78	74.9 Å²	74.9	80%	0.804	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-61.7	138	176.6	0	0	0	0	0	109.6	E4	G2-E4 PolarHBondContact O-N 3.33Å
3	K	51.8	Low	76.4	Confident	204 Å²	204	69.2 Å²	69.2	89%	0.887	36%	0.363	S	S	*	.	P	Polyproline II helix	trans	-56.8	128.6	175.4	-77.9	-179.4	175.1	179	0	108.8	K5	K3-K5 PolarHBondContact O-N 3.43Å
4	E	75.9	Confident	77.3	Confident	185 Å²	185	64.3 Å²	64.3	86%	0.864	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-59.4	119.3	175.9	-163.9	172.9	-171.9	0	0	109.2	G2	G2-E4 PolarHBondContact O-N 3.33Å
5	K	82.4	Confident	78	Confident	61 Å²	61	62.8 Å²	62.8	27%	0.265	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-72	144	-178.3	-65.8	178.2	-176.7	175.3	0	109.6	K3 E81 T82 K84 Y86	K3-K5 PolarHBondContact O-N 3.43Å; K5-E81 IonicContact NZ-OE2 3.8Å; K5-E81 PolarHBondContact NZ-OE2 3.48Å; K5-T82 WeakPolarHBondContact CE-O 3.35Å; K5-T82 PolarHBondContact NZ-O 3.39Å; K5-K84 WeakPolarHBondContact CB-O 3.43Å; K5-Y86 HydrophobicContact CB-CD2 3.6Å; K5-Y86 HydrophobicContact CB-CE2 3.65Å; K5-Y86 HydrophobicContact CB-CG 4.32Å; K5-Y86 HydrophobicContact CG-CE2 4.42Å; K5-Y86 WeakPolarHBondContact O-CD2 3.41Å
6	T	83.5	Confident	78.3	Confident	57 Å²	57	60.7 Å²	60.7	35%	0.35	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	140.6	177.5	-59.4	0	0	0	0	110.2	Y85 Y86 P237	T6-Y85 HydrophobicContact CG2-CD1 4.42Å; T6-Y85 HydrophobicContact CG2-CE1 4.37Å; T6-Y85 CarbonylContact O-C 3.4Å; T6-Y85 VanDerWaalsContact O-CA 3.26Å; T6-Y85 WeakPolarHBondContact O-CA 3.3Å; T6-Y85 WeakPolarHBondContact O-CD1 3.39Å; T6-Y86 PolarHBondContact O-N 3.48Å; T6-P237 HydrophobicContact CG2-CB 4.44Å
7	H	81.3	Confident	78.7	Confident	58 Å²	58	63.4 Å²	63.4	27%	0.269	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	133.9	174.4	-168.7	-87.4	0	0	0	111.5	N9 Y86 T88 R240	H7-N9 PolarHBondContact CE1-OD1 2.7Å; H7-Y86 CarbonylContact C-O 3.51Å; H7-Y86 VanDerWaalsContact CA-O 3.29Å; H7-Y86 WeakPolarHBondContact CA-O 3.47Å; H7-T88 PolarHBondContact CE1-OG1 3.48Å; H7-T88 PolarHBondContact NE2-OG1 2.76Å; H7-R240 PolarHBondContact O-NH2 3.41Å
8	I	86.3	Confident	79.3	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	147.2	174	65.8	175.5	0	0	0	111.3	I10 Y85 Y86 V87 T88 D110 I235	I8-I10 HydrophobicContact CD1-CD1 3.98Å; I8-I10 HydrophobicContact CD1-CG1 4.26Å; I8-I10 HydrophobicContact CG1-CD1 4.49Å; I8-I10 HydrophobicContact CG1-CG1 4.38Å; I8-Y85 HydrophobicContact CD1-CD1 4.38Å; I8-Y85 HydrophobicContact CD1-CD2 3.69Å; I8-Y85 HydrophobicContact CD1-CE2 4.32Å; I8-Y85 HydrophobicContact CD1-CG 3.72Å; I8-Y85 HydrophobicContact CG1-CG 4.13Å; I8-Y85 HydrophobicContact CG2-CD1 3.75Å; I8-Y85 HydrophobicContact CG2-CE1 4.05Å; I8-Y85 HydrophobicContact CG2-CG 4.15Å; I8-Y86 PolarHBondContact N-O 3.48Å; I8-V87 HydrophobicContact CD1-CG2 4Å; I8-V87 HydrophobicContact CG1-CB 4.44Å; I8-V87 HydrophobicContact CG1-CG1 4.47Å; I8-V87 HydrophobicContact CG1-CG2 3.87Å; I8-V87 WeakPolarHBondContact O-CA 3.48Å; I8-T88 PolarHBondContact O-N 3.5Å; I8-D110 WeakPolarHBondContact CA-OD2 2.95Å; I8-I235 HydrophobicContact CD1-CB 4.31Å; I8-I235 HydrophobicContact CD1-CD1 3.87Å; I8-I235 HydrophobicContact CD1-CG2 4.21Å
9	N	84.9	Confident	79.9	Confident	13 Å²	13	57.6 Å²	57.6	7%	0.07	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	128.5	175.5	-65.6	-27.9	0	0	0	110.1	H7 T88 I90 Q108 D110 C111	H7-N9 PolarHBondContact CE1-OD1 2.7Å; N9-T88 WeakPolarHBondContact CA-O 3.36Å; N9-I90 HydrophobicContact CB-CD1 4.38Å; N9-Q108 WeakPolarHBondContact CB-O 3.5Å; N9-Q108 PolarHBondContact ND2-O 2.65Å; N9-D110 PolarHBondContact N-OD2 3.33Å; N9-D110 PolarHBondContact O-N 2.82Å; N9-C111 PolarHBondContact O-N 2.98Å
10	I	90.4	Very high	80.4	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	127.3	-179.4	-58.6	-173.2	0	0	0	109.5	I8 V87 T88 I89 I90 C111 V113 L232 I235	I8-I10 HydrophobicContact CD1-CD1 3.98Å; I8-I10 HydrophobicContact CD1-CG1 4.26Å; I8-I10 HydrophobicContact CG1-CD1 4.49Å; I8-I10 HydrophobicContact CG1-CG1 4.38Å; I10-V87 HydrophobicContact CB-CG1 4.3Å; I10-V87 HydrophobicContact CD1-CG1 3.57Å; I10-V87 HydrophobicContact CG1-CG1 3.84Å; I10-T88 PolarHBondContact N-O 2.95Å; I10-I89 CarbonylContact O-C 3.4Å; I10-I89 WeakPolarHBondContact O-CA 3.41Å; I10-I90 WeakPolarHBondContact O-CB 3.43Å; I10-I90 PolarHBondContact O-N 2.81Å; I10-C111 WeakPolarHBondContact CA-O 3.44Å; I10-V113 HydrophobicContact CG2-CB 4.47Å; I10-V113 HydrophobicContact CG2-CG2 3.57Å; I10-L232 HydrophobicContact CD1-CD1 4.37Å; I10-L232 HydrophobicContact CD1-CD2 3.76Å; I10-L232 HydrophobicContact CD1-CG 4.46Å; I10-I235 HydrophobicContact CD1-CD1 3.52Å; I10-I235 HydrophobicContact CG1-CD1 4.17Å
11	V	89.5	Confident	80.7	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	130.9	171.3	67.7	0	0	0	0	110.8	I13 I90 A92 T106 A109 C111 A112 V113	V11-I13 HydrophobicContact CG1-CG2 4.12Å; V11-I13 HydrophobicContact CG2-CG2 3.83Å; V11-I90 WeakPolarHBondContact CA-O 3.42Å; V11-I90 HydrophobicContact CB-CB 4.33Å; V11-I90 HydrophobicContact CG2-CB 4.32Å; V11-I90 HydrophobicContact CG2-CG2 4.19Å; V11-A92 HydrophobicContact CG2-CB 3.69Å; V11-T106 HydrophobicContact CG1-CG2 4.26Å; V11-A109 HydrophobicContact CB-CB 3.69Å; V11-A109 HydrophobicContact CG1-CB 3.52Å; V11-C111 PolarHBondContact N-O 3.3Å; V11-A112 HydrophobicContact CG1-CB 3.87Å; V11-A112 CarbonylContact O-C 3.56Å; V11-A112 WeakPolarHBondContact O-CA 3.37Å; V11-V113 PolarHBondContact O-N 3.38Å
12	V	91.3	Very high	83.2	Confident	3 Å²	3	43 Å²	43	2%	0.018	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	121.2	174.9	-173.9	0	0	0	0	108.9	K20 T24 I89 I90 A92 V113 I115	V12-K20 HydrophobicContact CG1-CB 3.98Å; V12-K20 HydrophobicContact CG1-CG 4.09Å; V12-T24 WeakPolarHBondContact CG2-OG1 3.36Å; V12-I89 HydrophobicContact CG2-CD1 3.68Å; V12-I89 HydrophobicContact CG2-CG1 3.66Å; V12-I90 PolarHBondContact N-O 3Å; V12-A92 WeakPolarHBondContact O-CB 3.35Å; V12-A92 PolarHBondContact O-N 3.09Å; V12-V113 WeakPolarHBondContact CA-O 3.29Å; V12-V113 HydrophobicContact CG2-CB 4.43Å; V12-I115 HydrophobicContact CG1-CG1 3.7Å
13	I	91.6	Very high	85.3	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	158.8	-172.5	61.9	168.3	0	0	0	110.8	V11 A92 M102 A112 V113 L114 I115 H136 A140	V11-I13 HydrophobicContact CG1-CG2 4.12Å; V11-I13 HydrophobicContact CG2-CG2 3.83Å; I13-A92 HydrophobicContact CG2-CB 4.35Å; I13-M102 HydrophobicContact CB-CE 4.24Å; I13-M102 HydrophobicContact CG2-CE 3.54Å; I13-M102 HydrophobicContact CG2-CG 4.49Å; I13-A112 HydrophobicContact CD1-CB 3.98Å; I13-A112 HydrophobicContact CG1-CB 4.38Å; I13-V113 PolarHBondContact N-O 3.04Å; I13-L114 HydrophobicContact CD1-CB 4.47Å; I13-L114 HydrophobicContact CD1-CD1 4.03Å; I13-L114 HydrophobicContact CG1-CB 4.21Å; I13-L114 HydrophobicContact CG1-CD1 3.84Å; I13-L114 CarbonylContact O-C 3.21Å; I13-L114 WeakPolarHBondContact O-CA 3.26Å; I13-I115 PolarHBondContact O-N 3.45Å; I13-H136 HydrophobicContact CB-CB 4.02Å; I13-H136 HydrophobicContact CD1-CB 4.07Å; I13-H136 HydrophobicContact CG1-CB 4.45Å; I13-A140 HydrophobicContact CD1-CB 3.97Å
14	G	90	Very high	87.1	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	150.2	169.4	-177.4	0	0	0	0	0	113	K20 H136	G14-K20 PolarHBondContact O-NZ 2.87Å; G14-H136 PolarHBondContact N-ND1 2.94Å; G14-H136 PolarHBondContact O-CE1 3.09Å; G14-H136 PolarHBondContact O-ND1 3.23Å; G14-H136 VanDerWaalsContact O-ND1 3.07Å
15	H	87.6	Confident	87.7	Confident	42 Å²	42	21.1 Å²	21.1	19%	0.194	12%	0.115	C	C	.	.			trans	-59	157.9	-179.3	-165.1	44.5	0	0	0	112.9	S18 K20 Q132	H15-S18 WeakPolarHBondContact O-CB 3.36Å; H15-S18 PolarHBondContact O-N 3.01Å; H15-S18 PolarHBondContact O-OG 2.74Å; H15-K20 PolarHBondContact O-NZ 2.98Å; H15-Q132 PolarHBondContact ND1-N 3.22Å; H15-Q132 PolarHBondContact ND1-OE1 3.14Å
16	V	83.1	Confident	88	Confident	29 Å²	29	18.5 Å²	18.5	18%	0.176	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	141.8	165.1	176.8	0	0	0	0	108.8	S18 I71 H95	V16-S18 PolarHBondContact O-N 3.5Å; V16-I71 HydrophobicContact CG1-CG2 4.42Å; V16-H95 HydrophobicContact CG2-CB 4.2Å
17	D	84.8	Confident	88.2	Confident	107 Å²	107	16 Å²	16	57%	0.572	9%	0.088	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.5	8	-177.9	-53.8	-30.7	0	0	0	117	G19 K154	D17-G19 PolarHBondContact O-N 3.28Å; D17-K154 WeakPolarHBondContact O-CE 3.38Å; D17-K154 PolarHBondContact O-NZ 2.8Å
18	S	90.1	Very high	88.4	Confident	3 Å²	3	13.3 Å²	13.3	2%	0.021	8%	0.075	C	C	.	.	S	Bend	trans	-67.7	-7.8	173.8	75.8	0	0	0	0	113.9	H15 V16 I115 N153	H15-S18 WeakPolarHBondContact O-CB 3.36Å; H15-S18 PolarHBondContact O-N 3.01Å; H15-S18 PolarHBondContact O-OG 2.74Å; V16-S18 PolarHBondContact O-N 3.5Å; S18-I115 WeakPolarHBondContact CB-O 3.46Å; S18-I115 WeakPolarHBondContact O-CG2 3.19Å; S18-I115 PolarHBondContact OG-O 3.2Å; S18-I115 VanDerWaalsContact OG-O 3.06Å; S18-N153 PolarHBondContact O-ND2 2.99Å
19	G	90.1	Very high	88.2	Confident	13 Å²	13	16.3 Å²	16.3	13%	0.134	9%	0.087	C	C	.	.			trans	86.2	27.2	178.6	0	0	0	0	0	114.5	D17 T23	D17-G19 PolarHBondContact O-N 3.28Å; G19-T23 VanDerWaalsContact O-CB 3.31Å; G19-T23 WeakPolarHBondContact O-CB 3.49Å; G19-T23 PolarHBondContact O-N 2.64Å; G19-T23 PolarHBondContact O-OG1 3.22Å
20	K	89.7	Confident	88.1	Confident	11 Å²	11	21.2 Å²	21.2	5%	0.048	11%	0.108	C	C	.	.	H	α-helix	trans	-50.2	-62.4	174.4	-66.7	-176.8	-64.1	-66.5	0	112	V12 G14 H15 T22 T23 T24 A92 I115	V12-K20 HydrophobicContact CG1-CB 3.98Å; V12-K20 HydrophobicContact CG1-CG 4.09Å; G14-K20 PolarHBondContact O-NZ 2.87Å; H15-K20 PolarHBondContact O-NZ 2.98Å; K20-T22 VanDerWaalsContact C-N 3.33Å; K20-T22 PolarHBondContact O-N 3.06Å; K20-T23 WeakPolarHBondContact O-CB 2.94Å; K20-T23 PolarHBondContact O-N 3.14Å; K20-T23 VanDerWaalsContact O-N 3.12Å; K20-T24 WeakPolarHBondContact O-CB 3.36Å; K20-T24 PolarHBondContact O-N 3Å; K20-T24 PolarHBondContact O-OG1 3.2Å; K20-A92 WeakPolarHBondContact CE-O 3.39Å; K20-I115 HydrophobicContact CG-CB 4.08Å; K20-I115 HydrophobicContact CG-CG1 4.27Å
21	S	86.8	Confident	87.7	Confident	12 Å²	12	22.6 Å²	22.6	8%	0.084	12%	0.117	C	C	.	.	H	α-helix	trans	-65.6	-35.4	-174.2	-48.6	0	0	0	0	112.6	G25 L60 T72 D91	S21-G25 PolarHBondContact O-N 2.86Å; S21-L60 WeakPolarHBondContact O-CD1 3.46Å; S21-T72 PolarHBondContact OG-OG1 3.14Å; S21-D91 WeakPolarHBondContact CB-OD2 3.44Å; S21-D91 PolarHBondContact OG-OD2 2.9Å
22	T	89.7	Confident	86.9	Confident	27 Å²	27	25.6 Å²	25.6	17%	0.166	15%	0.148	C	C	.	.	H	α-helix	trans	-61.4	-48.2	172.3	-51.2	0	0	0	0	111.4	K20 H26 Y56 W196	K20-T22 VanDerWaalsContact C-N 3.33Å; K20-T22 PolarHBondContact O-N 3.06Å; T22-H26 WeakPolarHBondContact O-CB 3.46Å; T22-H26 PolarHBondContact O-N 2.77Å; T22-Y56 HydrophobicContact CG2-CD2 4.26Å; T22-W196 HydrophobicContact CG2-CE3 3.87Å
23	T	91.6	Very high	85.8	Confident	4 Å²	4	27 Å²	27	3%	0.025	16%	0.164	C	C	.	.	H	α-helix	trans	-63.2	-47.5	179.9	-55.9	0	0	0	0	110.9	G19 K20 H26 L27 I115 N153 I193 M201 L228	G19-T23 VanDerWaalsContact O-CB 3.31Å; G19-T23 WeakPolarHBondContact O-CB 3.49Å; G19-T23 PolarHBondContact O-N 2.64Å; G19-T23 PolarHBondContact O-OG1 3.22Å; K20-T23 WeakPolarHBondContact O-CB 2.94Å; K20-T23 PolarHBondContact O-N 3.14Å; K20-T23 VanDerWaalsContact O-N 3.12Å; T23-H26 PolarHBondContact O-N 2.86Å; T23-L27 WeakPolarHBondContact O-CB 3.18Å; T23-L27 PolarHBondContact O-N 2.84Å; T23-I115 HydrophobicContact CG2-CD1 4.01Å; T23-N153 PolarHBondContact OG1-ND2 3.19Å; T23-I193 HydrophobicContact CG2-CD1 3.75Å; T23-M201 HydrophobicContact CG2-CE 3.51Å; T23-M201 HydrophobicContact CG2-SD 3.79Å; T23-M201 VanDerWaalsContact O-CE 3.3Å; T23-M201 WeakPolarHBondContact O-CE 3.37Å; T23-L228 HydrophobicContact CG2-CD2 4.07Å
24	T	89.6	Confident	84.9	Confident	2 Å²	2	27.6 Å²	27.6	1%	0.012	17%	0.167	C	C	.	.	H	α-helix	trans	-61.8	-48.6	178.1	-58.4	0	0	0	0	111.5	V12 K20 H26 L27 I28 L60 I89	V12-T24 WeakPolarHBondContact CG2-OG1 3.36Å; K20-T24 WeakPolarHBondContact O-CB 3.36Å; K20-T24 PolarHBondContact O-N 3Å; K20-T24 PolarHBondContact O-OG1 3.2Å; T24-H26 PolarHBondContact O-N 2.86Å; T24-L27 WeakPolarHBondContact O-CB 3.19Å; T24-L27 PolarHBondContact O-N 2.93Å; T24-I28 HydrophobicContact CG2-CD1 3.88Å; T24-I28 VanDerWaalsContact O-CG1 3.27Å; T24-I28 WeakPolarHBondContact O-CG1 3.43Å; T24-I28 PolarHBondContact O-N 2.93Å; T24-L60 VanDerWaalsContact CB-CD1 3.49Å; T24-L60 HydrophobicContact CG2-CD1 3.47Å; T24-L60 VanDerWaalsContact CG2-CD1 3.47Å; T24-L60 HydrophobicContact CG2-CD2 4Å; T24-L60 HydrophobicContact CG2-CG 4.36Å; T24-I89 HydrophobicContact CG2-CD1 3.74Å; T24-I89 HydrophobicContact CG2-CG1 3.91Å; T24-I89 HydrophobicContact CG2-CG2 3.88Å
25	G	86.9	Confident	84.1	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.8	-38.8	179.3	0	0	0	0	0	112.9	S21 I28 Y29 Y56	S21-G25 PolarHBondContact O-N 2.86Å; G25-I28 PolarHBondContact O-N 2.82Å; G25-Y29 WeakPolarHBondContact O-CB 3.37Å; G25-Y29 PolarHBondContact O-N 3.14Å; G25-Y56 WeakPolarHBondContact CA-O 3.28Å
26	H	88.9	Confident	83.6	Confident	7 Å²	7	36.2 Å²	36.2	3%	0.032	21%	0.208	C	C	.	.	H	α-helix	trans	-63.2	-46	174.2	-161.1	140.9	0	0	0	110.8	T22 T23 T24 I28 Y29 K30 Y56 G195 G198	T22-H26 WeakPolarHBondContact O-CB 3.46Å; T22-H26 PolarHBondContact O-N 2.77Å; T23-H26 PolarHBondContact O-N 2.86Å; T24-H26 PolarHBondContact O-N 2.86Å; H26-I28 PolarHBondContact O-N 3.08Å; H26-Y29 PolarHBondContact O-N 2.88Å; H26-K30 VanDerWaalsContact CD2-CG 3.43Å; H26-K30 WeakPolarHBondContact CD2-CG 3.48Å; H26-K30 WeakPolarHBondContact O-CB 3.39Å; H26-K30 PolarHBondContact O-N 2.89Å; H26-Y56 HydrophobicContact CB-CD1 4.42Å; H26-Y56 HydrophobicContact CB-CD2 4.39Å; H26-Y56 HydrophobicContact CB-CG 4.26Å; H26-Y56 AromaticContact ND1-CE2 3.74Å; H26-G195 WeakPolarHBondContact CB-O 3.37Å; H26-G195 PolarHBondContact ND1-O 2.66Å; H26-G198 WeakPolarHBondContact CE1-CA 3.42Å; H26-G198 PolarHBondContact CE1-N 3.4Å
27	L	87.9	Confident	83.4	Confident	5 Å²	5	44.6 Å²	44.6	3%	0.026	24%	0.236	C	C	.	.	H	α-helix	trans	-58.9	-47	178	-166.9	75.9	0	0	0	111.5	T23 T24 Y29 K30 C31 F80 I89 M201 L202 L232	T23-L27 WeakPolarHBondContact O-CB 3.18Å; T23-L27 PolarHBondContact O-N 2.84Å; T24-L27 WeakPolarHBondContact O-CB 3.19Å; T24-L27 PolarHBondContact O-N 2.93Å; L27-Y29 PolarHBondContact O-N 3.29Å; L27-K30 PolarHBondContact O-N 2.71Å; L27-C31 WeakPolarHBondContact O-CB 3.26Å; L27-C31 PolarHBondContact O-N 3.06Å; L27-C31 PolarHBondContact O-SG 2.99Å; L27-F80 HydrophobicContact CD2-CE1 3.82Å; L27-F80 HydrophobicContact CD2-CE2 3.91Å; L27-F80 HydrophobicContact CD2-CZ 3.34Å; L27-F80 HydrophobicContact CG-CE2 4.26Å; L27-F80 HydrophobicContact CG-CZ 4.12Å; L27-I89 HydrophobicContact CD2-CD1 4.27Å; L27-M201 HydrophobicContact CB-CE 4.02Å; L27-M201 HydrophobicContact CD1-CE 4.1Å; L27-L202 HydrophobicContact CD1-CD1 4.03Å; L27-L232 HydrophobicContact CD2-CD1 3.68Å
28	I	85.5	Confident	82.9	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61	-45.5	178.3	-63.7	160.8	0	0	0	110.6	T24 G25 H26 C31 G32 G33 I34 V59 L60 W78 F80 I89	T24-I28 HydrophobicContact CG2-CD1 3.88Å; T24-I28 VanDerWaalsContact O-CG1 3.27Å; T24-I28 WeakPolarHBondContact O-CG1 3.43Å; T24-I28 PolarHBondContact O-N 2.93Å; G25-I28 PolarHBondContact O-N 2.82Å; H26-I28 PolarHBondContact O-N 3.08Å; I28-C31 PolarHBondContact O-N 2.88Å; I28-G32 PolarHBondContact O-N 2.79Å; I28-G33 PolarHBondContact O-N 2.84Å; I28-I34 HydrophobicContact CB-CD1 4.3Å; I28-I34 HydrophobicContact CG2-CD1 3.49Å; I28-I34 VanDerWaalsContact CG2-CD1 3.49Å; I28-I34 HydrophobicContact CG2-CG1 3.68Å; I28-V59 HydrophobicContact CD1-CG1 4.34Å; I28-L60 HydrophobicContact CD1-CD2 3.72Å; I28-W78 HydrophobicContact CD1-CB 3.52Å; I28-W78 HydrophobicContact CD1-CD2 4.37Å; I28-W78 HydrophobicContact CD1-CG 3.75Å; I28-W78 HydrophobicContact CG1-CB 4.22Å; I28-W78 HydrophobicContact CG2-CE3 4.47Å; I28-F80 HydrophobicContact CG1-CD1 4.41Å; I28-I89 HydrophobicContact CD1-CG2 3.96Å; I28-I89 HydrophobicContact CG1-CG2 4.24Å
29	Y	83.3	Confident	82.2	Confident	64 Å²	64	42 Å²	42	25%	0.251	22%	0.223	S	C	.	.	H	α-helix	trans	-57.9	-53.4	177.9	170.3	-137.7	0	0	0	111.6	G25 H26 L27 C31 G32 I39 Y56	G25-Y29 WeakPolarHBondContact O-CB 3.37Å; G25-Y29 PolarHBondContact O-N 3.14Å; H26-Y29 PolarHBondContact O-N 2.88Å; L27-Y29 PolarHBondContact O-N 3.29Å; Y29-C31 VanDerWaalsContact C-N 3.31Å; Y29-C31 PolarHBondContact O-N 3.29Å; Y29-G32 PolarHBondContact O-N 3.43Å; Y29-G32 VanDerWaalsContact O-N 3.08Å; Y29-I39 HydrophobicContact CD1-CD1 4.11Å; Y29-I39 HydrophobicContact CD2-CD1 2.94Å; Y29-I39 HydrophobicContact CD2-CG1 4.38Å; Y29-I39 HydrophobicContact CE2-CD1 3.49Å; Y29-I39 VanDerWaalsContact CE2-CD1 3.49Å; Y29-I39 HydrophobicContact CG-CD1 3.26Å; Y29-Y56 AromaticContact CD1-CE1 3.81Å; Y29-Y56 HydrophobicContact CD1-CE1 3.81Å; Y29-Y56 HydrophobicContact CE1-CE1 4.43Å; Y29-Y56 HydrophobicContact CG-CE1 4.5Å
30	K	82.6	Confident	81.6	Confident	115 Å²	115	46.2 Å²	46.2	50%	0.5	24%	0.24	S	C	.	.	H	α-helix	trans	-69	-29.5	-174.6	-77.4	-74.3	-170	165.2	0	113	H26 L27 G32 L202	H26-K30 VanDerWaalsContact CD2-CG 3.43Å; H26-K30 WeakPolarHBondContact CD2-CG 3.48Å; H26-K30 WeakPolarHBondContact O-CB 3.39Å; H26-K30 PolarHBondContact O-N 2.89Å; L27-K30 PolarHBondContact O-N 2.71Å; K30-G32 PolarHBondContact O-N 3.24Å; K30-L202 HydrophobicContact CB-CD1 3.48Å; K30-L202 VanDerWaalsContact CB-CD1 3.48Å; K30-L202 HydrophobicContact CB-CD2 3.59Å; K30-L202 HydrophobicContact CB-CG 4.18Å; K30-L202 HydrophobicContact CG-CD1 4.09Å
31	C	81.4	Confident	81.2	Confident	30 Å²	30	51.4 Å²	51.4	20%	0.203	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	10.7	174.2	-59	0	0	0	0	113.1	L27 I28 Y29 G33 F80	L27-C31 WeakPolarHBondContact O-CB 3.26Å; L27-C31 PolarHBondContact O-N 3.06Å; L27-C31 PolarHBondContact O-SG 2.99Å; I28-C31 PolarHBondContact O-N 2.88Å; Y29-C31 VanDerWaalsContact C-N 3.31Å; Y29-C31 PolarHBondContact O-N 3.29Å; C31-G33 VanDerWaalsContact C-N 3.27Å; C31-G33 PolarHBondContact O-N 3.49Å; C31-F80 HydrophobicContact CB-CB 3.83Å; C31-F80 HydrophobicContact CB-CD2 3.74Å; C31-F80 HydrophobicContact CB-CG 4.1Å
32	G	71.6	Confident	80.8	Confident	63 Å²	63	52.3 Å²	52.3	65%	0.649	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.4	14.2	175.3	0	0	0	0	0	114.7	I28 Y29 K30 I34	I28-G32 PolarHBondContact O-N 2.79Å; Y29-G32 PolarHBondContact O-N 3.43Å; Y29-G32 VanDerWaalsContact O-N 3.08Å; K30-G32 PolarHBondContact O-N 3.24Å; G32-I34 PolarHBondContact O-N 2.79Å
33	G	68.8	Low	80.1	Confident	33 Å²	33	54.8 Å²	54.8	34%	0.34	28%	0.275	S	S	.	.	S	Bend	trans	-71.6	-12.1	178.2	0	0	0	0	0	113.7	I28 C31	I28-G33 PolarHBondContact O-N 2.84Å; C31-G33 VanDerWaalsContact C-N 3.27Å; C31-G33 PolarHBondContact O-N 3.49Å
34	I	72.1	Confident	79.6	Confident	13 Å²	13	61.1 Å²	61.1	7%	0.067	30%	0.302	C	S	.	.	S	Bend	trans	-138.1	135.3	178.6	-62.7	162.2	0	0	0	109.6	I28 G32 T38 I39 V59 W78	I28-I34 HydrophobicContact CB-CD1 4.3Å; I28-I34 HydrophobicContact CG2-CD1 3.49Å; I28-I34 VanDerWaalsContact CG2-CD1 3.49Å; I28-I34 HydrophobicContact CG2-CG1 3.68Å; G32-I34 PolarHBondContact O-N 2.79Å; I34-T38 HydrophobicContact CG2-CG2 3.9Å; I34-I39 HydrophobicContact CB-CD1 4.33Å; I34-I39 HydrophobicContact CG2-CD1 4.03Å; I34-I39 HydrophobicContact CG2-CG1 3.74Å; I34-V59 HydrophobicContact CD1-CB 4.04Å; I34-V59 HydrophobicContact CD1-CG1 3.1Å; I34-V59 HydrophobicContact CD1-CG2 3.77Å; I34-W78 HydrophobicContact CD1-CE3 4.47Å; I34-W78 HydrophobicContact CD1-CZ3 4.18Å; I34-W78 HydrophobicContact CG1-CE3 4.38Å; I34-W78 HydrophobicContact CG1-CZ3 3.93Å
35	D	74.6	Confident	79	Confident	87 Å²	87	63.5 Å²	63.5	47%	0.465	31%	0.313	S	S	.	.			trans	-71.6	149.1	176.4	71.5	-77.1	0	0	0	112.1	R37 T38 I39	D35-R37 VanDerWaalsContact C-N 3.26Å; D35-R37 PolarHBondContact O-N 2.9Å; D35-R37 WeakPolarHBondContact OD2-CB 3.44Å; D35-R37 PolarHBondContact OD2-N 3.43Å; D35-T38 VanDerWaalsContact CG-OG1 3.27Å; D35-T38 PolarHBondContact O-N 2.77Å; D35-T38 WeakPolarHBondContact OD1-CB 3.43Å; D35-T38 PolarHBondContact OD1-OG1 3.13Å; D35-T38 PolarHBondContact OD2-N 3.15Å; D35-T38 PolarHBondContact OD2-OG1 3.09Å; D35-I39 PolarHBondContact O-N 3.22Å
36	K	76.5	Confident	78.4	Confident	135 Å²	135	63.5 Å²	63.5	59%	0.587	31%	0.313	S	S	*	.	H	α-helix	trans	-57.9	-36.5	-175.5	-166.5	179.4	176.8	-175.4	0	113.1	I39 E40	K36-I39 PolarHBondContact O-N 2.95Å; K36-E40 WeakPolarHBondContact CE-OE1 3.39Å; K36-E40 WeakPolarHBondContact O-CG 3.49Å; K36-E40 PolarHBondContact O-N 2.98Å
37	R	78.6	Confident	77.8	Confident	205 Å²	205	66 Å²	66	77%	0.774	34%	0.335	S	S	*	.	H	α-helix	trans	-67.1	-38.9	-179.1	-177.5	-176.3	-179.8	-178.2	1	111.8	D35 I39 E40 K41	D35-R37 VanDerWaalsContact C-N 3.26Å; D35-R37 PolarHBondContact O-N 2.9Å; D35-R37 WeakPolarHBondContact OD2-CB 3.44Å; D35-R37 PolarHBondContact OD2-N 3.43Å; R37-I39 VanDerWaalsContact C-N 3.31Å; R37-I39 PolarHBondContact O-N 3.15Å; R37-E40 PolarHBondContact O-N 2.81Å; R37-K41 PolarHBondContact O-N 2.88Å; R37-K41 VanDerWaalsContact O-N 3.07Å
38	T	74.6	Confident	77.4	Confident	46 Å²	46	72.3 Å²	72.3	28%	0.282	36%	0.364	S	S	.	.	H	α-helix	trans	-63.9	-36.9	175.7	-66.5	0	0	0	0	111.7	I34 D35 K41 F42	I34-T38 HydrophobicContact CG2-CG2 3.9Å; D35-T38 VanDerWaalsContact CG-OG1 3.27Å; D35-T38 PolarHBondContact O-N 2.77Å; D35-T38 WeakPolarHBondContact OD1-CB 3.43Å; D35-T38 PolarHBondContact OD1-OG1 3.13Å; D35-T38 PolarHBondContact OD2-N 3.15Å; D35-T38 PolarHBondContact OD2-OG1 3.09Å; T38-K41 WeakPolarHBondContact O-CB 3.39Å; T38-K41 PolarHBondContact O-N 3.03Å; T38-F42 HydrophobicContact CG2-CD2 3.99Å; T38-F42 HydrophobicContact CG2-CE2 3.41Å; T38-F42 VanDerWaalsContact CG2-CE2 3.41Å; T38-F42 HydrophobicContact CG2-CZ 3.86Å; T38-F42 WeakPolarHBondContact O-CD2 3.44Å; T38-F42 WeakPolarHBondContact O-CG 3.01Å; T38-F42 PolarHBondContact O-N 3.43Å; T38-F42 VanDerWaalsContact O-N 3.1Å
39	I	74.5	Confident	76.6	Confident	9 Å²	9	77 Å²	77	5%	0.046	39%	0.387	C	S	.	.	H	α-helix	trans	-71.8	-42.2	176.6	-75.7	174.4	0	0	0	112.4	Y29 I34 D35 K36 R37 K41 F42 E43	Y29-I39 HydrophobicContact CD1-CD1 4.11Å; Y29-I39 HydrophobicContact CD2-CD1 2.94Å; Y29-I39 HydrophobicContact CD2-CG1 4.38Å; Y29-I39 HydrophobicContact CE2-CD1 3.49Å; Y29-I39 VanDerWaalsContact CE2-CD1 3.49Å; Y29-I39 HydrophobicContact CG-CD1 3.26Å; I34-I39 HydrophobicContact CB-CD1 4.33Å; I34-I39 HydrophobicContact CG2-CD1 4.03Å; I34-I39 HydrophobicContact CG2-CG1 3.74Å; D35-I39 PolarHBondContact O-N 3.22Å; K36-I39 PolarHBondContact O-N 2.95Å; R37-I39 VanDerWaalsContact C-N 3.31Å; R37-I39 PolarHBondContact O-N 3.15Å; I39-K41 PolarHBondContact O-N 2.83Å; I39-F42 PolarHBondContact O-N 2.63Å; I39-E43 WeakPolarHBondContact O-CB 3.43Å; I39-E43 PolarHBondContact O-N 3.4Å
40	E	79.4	Confident	76	Confident	103 Å²	103	77.3 Å²	77.3	48%	0.481	41%	0.41	S	S	.	.	H	α-helix	trans	-58.2	-37.5	175.3	-73	169.7	-176	0	0	111.2	K36 R37 K44	K36-E40 WeakPolarHBondContact CE-OE1 3.39Å; K36-E40 WeakPolarHBondContact O-CG 3.49Å; K36-E40 PolarHBondContact O-N 2.98Å; R37-E40 PolarHBondContact O-N 2.81Å; E40-K44 WeakPolarHBondContact O-CB 3.49Å; E40-K44 PolarHBondContact O-N 2.89Å; E40-K44 VanDerWaalsContact O-N 3.07Å
41	K	80.6	Confident	75.3	Confident	120 Å²	120	73.9 Å²	73.9	52%	0.522	40%	0.395	S	S	.	.	H	α-helix	trans	-61.7	-49.7	171.7	179.6	-178.6	170	-178.1	0	111.9	R37 T38 I39 E43 K44 E45	R37-K41 PolarHBondContact O-N 2.88Å; R37-K41 VanDerWaalsContact O-N 3.07Å; T38-K41 WeakPolarHBondContact O-CB 3.39Å; T38-K41 PolarHBondContact O-N 3.03Å; I39-K41 PolarHBondContact O-N 2.83Å; K41-E43 VanDerWaalsContact C-N 3.34Å; K41-E43 PolarHBondContact O-N 3.36Å; K41-K44 PolarHBondContact O-N 2.98Å; K41-E45 WeakPolarHBondContact CE-OE1 3.45Å; K41-E45 IonicContact NZ-OE1 2.78Å; K41-E45 WeakPolarHBondContact O-CG 3.28Å; K41-E45 PolarHBondContact O-N 3.16Å
42	F	77.8	Confident	74.3	Confident	30 Å²	30	74.1 Å²	74.1	13%	0.132	40%	0.402	C	S	.	.	H	α-helix	trans	-66.2	-34.7	179.4	-66.9	-36.9	0	0	0	113.2	T38 I39 K44 E45 A46 W58 V59	T38-F42 HydrophobicContact CG2-CD2 3.99Å; T38-F42 HydrophobicContact CG2-CE2 3.41Å; T38-F42 VanDerWaalsContact CG2-CE2 3.41Å; T38-F42 HydrophobicContact CG2-CZ 3.86Å; T38-F42 WeakPolarHBondContact O-CD2 3.44Å; T38-F42 WeakPolarHBondContact O-CG 3.01Å; T38-F42 PolarHBondContact O-N 3.43Å; T38-F42 VanDerWaalsContact O-N 3.1Å; I39-F42 PolarHBondContact O-N 2.63Å; F42-K44 VanDerWaalsContact C-N 3.33Å; F42-E45 PolarHBondContact O-N 3.47Å; F42-A46 WeakPolarHBondContact O-CB 3.4Å; F42-A46 PolarHBondContact O-N 2.85Å; F42-W58 HydrophobicContact CB-CB 4.32Å; F42-V59 HydrophobicContact CD2-CG2 4.34Å
43	E	75.8	Confident	73.8	Confident	80 Å²	80	74.7 Å²	74.7	37%	0.374	40%	0.396	S	S	.	.	H	α-helix	trans	-63.4	-41.9	174.7	-173.2	162.5	-145.1	0	0	110.8	I39 K41 A47 K55	I39-E43 WeakPolarHBondContact O-CB 3.43Å; I39-E43 PolarHBondContact O-N 3.4Å; K41-E43 VanDerWaalsContact C-N 3.34Å; K41-E43 PolarHBondContact O-N 3.36Å; E43-A47 VanDerWaalsContact O-CB 3.32Å; E43-A47 WeakPolarHBondContact O-CB 3.46Å; E43-A47 PolarHBondContact O-N 2.84Å; E43-K55 HydrophobicContact CB-CB 4.32Å; E43-K55 HydrophobicContact CG-CB 4.38Å; E43-K55 HydrophobicContact CG-CD 4.1Å; E43-K55 WeakPolarHBondContact OE1-CD 3.17Å; E43-K55 IonicContact OE1-NZ 2.75Å; E43-K55 PolarHBondContact OE1-NZ 2.99Å
44	K	80.2	Confident	73.5	Confident	137 Å²	137	76 Å²	76	60%	0.596	39%	0.393	S	S	*	.	H	α-helix	trans	-64.7	-49.1	174.6	-166.9	-178.3	179.6	-170.8	0	112.3	E40 K41 F42 A46 A47 E48	E40-K44 WeakPolarHBondContact O-CB 3.49Å; E40-K44 PolarHBondContact O-N 2.89Å; E40-K44 VanDerWaalsContact O-N 3.07Å; K41-K44 PolarHBondContact O-N 2.98Å; F42-K44 VanDerWaalsContact C-N 3.33Å; K44-A46 VanDerWaalsContact C-N 3.34Å; K44-A46 PolarHBondContact O-N 2.89Å; K44-A47 PolarHBondContact O-N 3.49Å; K44-E48 VanDerWaalsContact CE-OE1 3.24Å; K44-E48 WeakPolarHBondContact CE-OE1 3.35Å; K44-E48 WeakPolarHBondContact O-CG 3.41Å; K44-E48 PolarHBondContact O-N 3.46Å
45	E	77.6	Confident	73.5	Confident	52 Å²	52	77.4 Å²	77.4	24%	0.243	40%	0.398	C	S	.	.	H	α-helix	trans	-61.9	-40.8	178.6	-69.3	179.5	-175.8	0	0	112	K41 F42 E48 M49 W58 R67	K41-E45 WeakPolarHBondContact CE-OE1 3.45Å; K41-E45 IonicContact NZ-OE1 2.78Å; K41-E45 WeakPolarHBondContact O-CG 3.28Å; K41-E45 PolarHBondContact O-N 3.16Å; F42-E45 PolarHBondContact O-N 3.47Å; E45-E48 PolarHBondContact O-N 3.24Å; E45-M49 PolarHBondContact O-N 3.26Å; E45-W58 HydrophobicContact CB-CE3 4.15Å; E45-W58 HydrophobicContact CB-CH2 3.98Å; E45-W58 HydrophobicContact CB-CZ3 3.42Å; E45-W58 VanDerWaalsContact CB-CZ3 3.42Å; E45-W58 HydrophobicContact CG-CZ3 4.47Å; E45-W58 WeakPolarHBondContact OE2-CZ3 2.98Å; E45-R67 IonicContact OE2-NH1 3.35Å; E45-R67 PolarHBondContact OE2-NH1 2.79Å
46	A	75.1	Confident	73.5	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-66.2	-38.8	177.6	0	0	0	0	0	111.9	F42 K44 M49 G50 K51 G52 W58	F42-A46 WeakPolarHBondContact O-CB 3.4Å; F42-A46 PolarHBondContact O-N 2.85Å; K44-A46 VanDerWaalsContact C-N 3.34Å; K44-A46 PolarHBondContact O-N 2.89Å; A46-M49 PolarHBondContact O-N 2.65Å; A46-G50 PolarHBondContact O-N 3.37Å; A46-K51 CarbonylContact O-C 3.34Å; A46-K51 WeakPolarHBondContact O-CA 3.2Å; A46-K51 PolarHBondContact O-N 2.99Å; A46-G52 PolarHBondContact O-N 2.78Å; A46-W58 HydrophobicContact CB-CD2 3.97Å; A46-W58 HydrophobicContact CB-CG 4.21Å; A46-W58 HydrophobicContact CB-CZ2 4.18Å
47	A	76.3	Confident	73	Confident	59 Å²	59	68 Å²	68	49%	0.488	35%	0.354	S	S	.	.	H	α-helix	trans	-66.4	-42.5	175.4	0	0	0	0	0	112.2	E43 K44 M49 G50	E43-A47 VanDerWaalsContact O-CB 3.32Å; E43-A47 WeakPolarHBondContact O-CB 3.46Å; E43-A47 PolarHBondContact O-N 2.84Å; K44-A47 PolarHBondContact O-N 3.49Å; A47-M49 PolarHBondContact O-N 2.57Å; A47-G50 PolarHBondContact O-N 2.87Å
48	E	79.3	Confident	72.7	Confident	138 Å²	138	58.4 Å²	58.4	65%	0.645	32%	0.318	S	S	*	.	H	α-helix	trans	-60.9	-29.7	176.4	-74.6	173.9	-175.6	0	0	112.5	K44 E45 G50	K44-E48 VanDerWaalsContact CE-OE1 3.24Å; K44-E48 WeakPolarHBondContact CE-OE1 3.35Å; K44-E48 WeakPolarHBondContact O-CG 3.41Å; K44-E48 PolarHBondContact O-N 3.46Å; E45-E48 PolarHBondContact O-N 3.24Å; E48-G50 VanDerWaalsContact C-N 3.33Å
49	M	68	Low	72.5	Confident	97 Å²	97	56.3 Å²	56.3	48%	0.478	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	9	174.9	-68	-169.4	65.3	0	0	114.3	E45 A46 A47 K51 W58	E45-M49 PolarHBondContact O-N 3.26Å; A46-M49 PolarHBondContact O-N 2.65Å; A47-M49 PolarHBondContact O-N 2.57Å; M49-K51 PolarHBondContact O-N 2.73Å; M49-W58 HydrophobicContact CB-CZ2 4.35Å; M49-W58 HydrophobicContact CG-CH2 4.18Å; M49-W58 HydrophobicContact CG-CZ2 4.4Å; M49-W58 HydrophobicContact SD-CH2 3.39Å; M49-W58 WeakPolarHBondContact SD-CH2 3.48Å; M49-W58 HydrophobicContact SD-CZ2 3.7Å
50	G	70.9	Confident	72.1	Confident	71 Å²	71	56 Å²	56	73%	0.732	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	70	15.6	-179.1	0	0	0	0	0	114.2	A46 A47 E48	A46-G50 PolarHBondContact O-N 3.37Å; A47-G50 PolarHBondContact O-N 2.87Å; E48-G50 VanDerWaalsContact C-N 3.33Å
51	K	66.9	Low	71.7	Confident	44 Å²	44	51.3 Å²	51.3	19%	0.191	28%	0.281	C	S	.	.			trans	-118.9	40	-175.9	-68.8	-165.7	-178	-170.8	0	112	A46 M49 S53 F54 R67 E68	A46-K51 CarbonylContact O-C 3.34Å; A46-K51 WeakPolarHBondContact O-CA 3.2Å; A46-K51 PolarHBondContact O-N 2.99Å; M49-K51 PolarHBondContact O-N 2.73Å; K51-S53 PolarHBondContact O-N 3.19Å; K51-F54 HydrophobicContact CB-CB 4.49Å; K51-F54 HydrophobicContact CB-CD2 3.72Å; K51-F54 HydrophobicContact CB-CE2 4.37Å; K51-F54 HydrophobicContact CB-CG 4.41Å; K51-F54 HydrophobicContact CD-CD2 4.29Å; K51-F54 HydrophobicContact CD-CE2 4.4Å; K51-F54 HydrophobicContact CG-CD2 4.25Å; K51-F54 HydrophobicContact CG-CE2 4.45Å; K51-F54 WeakPolarHBondContact O-CB 3.34Å; K51-F54 PolarHBondContact O-N 3.1Å; K51-R67 PolarHBondContact NZ-O 2.75Å; K51-E68 VanDerWaalsContact NZ-C 3.25Å; K51-E68 PolarHBondContact NZ-O 2.79Å
52	G	60.6	Low	71.1	Confident	35 Å²	35	52.5 Å²	52.5	36%	0.361	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-55.5	-25.3	-178.2	0	0	0	0	0	114.5	A46 F54	A46-G52 PolarHBondContact O-N 2.78Å; G52-F54 PolarHBondContact O-N 2.83Å
53	S	62.4	Low	70.4	Confident	74 Å²	74	54.7 Å²	54.7	52%	0.517	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-69.3	-2.1	173.6	53.7	0	0	0	0	114.9	K51 W196	K51-S53 PolarHBondContact O-N 3.19Å; S53-W196 WeakPolarHBondContact O-CH2 3.4Å; S53-W196 WeakPolarHBondContact O-CZ3 3.03Å
54	F	62.8	Low	69.9	Low	62 Å²	62	58.5 Å²	58.5	27%	0.272	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-109.4	11.3	-175.7	-69.6	-97.5	0	0	0	114.4	K51 G52 Y56 A57 W58	K51-F54 HydrophobicContact CB-CB 4.49Å; K51-F54 HydrophobicContact CB-CD2 3.72Å; K51-F54 HydrophobicContact CB-CE2 4.37Å; K51-F54 HydrophobicContact CB-CG 4.41Å; K51-F54 HydrophobicContact CD-CD2 4.29Å; K51-F54 HydrophobicContact CD-CE2 4.4Å; K51-F54 HydrophobicContact CG-CD2 4.25Å; K51-F54 HydrophobicContact CG-CE2 4.45Å; K51-F54 WeakPolarHBondContact O-CB 3.34Å; K51-F54 PolarHBondContact O-N 3.1Å; G52-F54 PolarHBondContact O-N 2.83Å; F54-Y56 PolarHBondContact O-N 2.85Å; F54-A57 HydrophobicContact CB-CB 4.4Å; F54-A57 HydrophobicContact CD1-CB 4.19Å; F54-A57 PolarHBondContact O-N 2.82Å; F54-W58 VanDerWaalsContact O-CD1 3.25Å; F54-W58 PolarHBondContact O-N 2.99Å
55	K	71.1	Confident	69	Low	41 Å²	41	53.9 Å²	53.9	18%	0.178	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-38.1	-173.2	69.4	-178.8	178.4	177.4	0	115.1	E43 W196	E43-K55 HydrophobicContact CB-CB 4.32Å; E43-K55 HydrophobicContact CG-CB 4.38Å; E43-K55 HydrophobicContact CG-CD 4.1Å; E43-K55 WeakPolarHBondContact OE1-CD 3.17Å; E43-K55 IonicContact OE1-NZ 2.75Å; E43-K55 PolarHBondContact OE1-NZ 2.99Å; K55-W196 HydrophobicContact CD-CH2 4.38Å; K55-W196 HydrophobicContact CG-CH2 4.05Å; K55-W196 HydrophobicContact CG-CZ3 4.08Å
56	Y	73.9	Confident	68.4	Low	22 Å²	22	51.6 Å²	51.6	9%	0.086	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-30.7	177	-61.6	-56.8	0	0	0	113.1	T22 G25 H26 Y29 F54 W58 V59 W196	T22-Y56 HydrophobicContact CG2-CD2 4.26Å; G25-Y56 WeakPolarHBondContact CA-O 3.28Å; H26-Y56 HydrophobicContact CB-CD1 4.42Å; H26-Y56 HydrophobicContact CB-CD2 4.39Å; H26-Y56 HydrophobicContact CB-CG 4.26Å; H26-Y56 AromaticContact ND1-CE2 3.74Å; Y29-Y56 AromaticContact CD1-CE1 3.81Å; Y29-Y56 HydrophobicContact CD1-CE1 3.81Å; Y29-Y56 HydrophobicContact CE1-CE1 4.43Å; Y29-Y56 HydrophobicContact CG-CE1 4.5Å; F54-Y56 PolarHBondContact O-N 2.85Å; Y56-W58 VanDerWaalsContact C-N 3.34Å; Y56-V59 VanDerWaalsContact O-CB 3.32Å; Y56-V59 WeakPolarHBondContact O-CB 3.17Å; Y56-V59 PolarHBondContact O-N 2.88Å; Y56-W196 HydrophobicContact CD2-CE3 4.06Å; Y56-W196 HydrophobicContact CD2-CZ3 4.08Å; Y56-W196 HydrophobicContact CE2-CE3 4.43Å; Y56-W196 HydrophobicContact CE2-CZ3 4.49Å
57	A	67.4	Low	68.2	Low	4 Å²	4	53.9 Å²	53.9	3%	0.033	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-69.4	-34	175.9	0	0	0	0	0	111.9	F54 V59 L60 D61	F54-A57 HydrophobicContact CB-CB 4.4Å; F54-A57 HydrophobicContact CD1-CB 4.19Å; F54-A57 PolarHBondContact O-N 2.82Å; A57-V59 PolarHBondContact O-N 2.99Å; A57-V59 VanDerWaalsContact O-N 3.15Å; A57-L60 PolarHBondContact O-N 2.85Å; A57-D61 PolarHBondContact O-N 3.24Å
58	W	72.2	Confident	67.9	Low	3 Å²	3	55.9 Å²	55.9	1%	0.011	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-62.3	-20.2	177.9	-87.7	55	0	0	0	115.1	F42 E45 A46 M49 F54 Y56 L60 R67	F42-W58 HydrophobicContact CB-CB 4.32Å; E45-W58 HydrophobicContact CB-CE3 4.15Å; E45-W58 HydrophobicContact CB-CH2 3.98Å; E45-W58 HydrophobicContact CB-CZ3 3.42Å; E45-W58 VanDerWaalsContact CB-CZ3 3.42Å; E45-W58 HydrophobicContact CG-CZ3 4.47Å; E45-W58 WeakPolarHBondContact OE2-CZ3 2.98Å; A46-W58 HydrophobicContact CB-CD2 3.97Å; A46-W58 HydrophobicContact CB-CG 4.21Å; A46-W58 HydrophobicContact CB-CZ2 4.18Å; M49-W58 HydrophobicContact CB-CZ2 4.35Å; M49-W58 HydrophobicContact CG-CH2 4.18Å; M49-W58 HydrophobicContact CG-CZ2 4.4Å; M49-W58 HydrophobicContact SD-CH2 3.39Å; M49-W58 WeakPolarHBondContact SD-CH2 3.48Å; M49-W58 HydrophobicContact SD-CZ2 3.7Å; F54-W58 VanDerWaalsContact O-CD1 3.25Å; F54-W58 PolarHBondContact O-N 2.99Å; Y56-W58 VanDerWaalsContact C-N 3.34Å; W58-L60 PolarHBondContact O-N 2.85Å; W58-R67 HydrophobicContact CD2-CG 4.36Å; W58-R67 HydrophobicContact CZ2-CB 4.19Å; W58-R67 HydrophobicContact CZ2-CG 4.33Å; W58-R67 VanDerWaalsContact CZ3-NH1 3.27Å
59	V	70.7	Confident	67.2	Low	2 Å²	2	57.6 Å²	57.6	1%	0.012	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-57.4	-40.3	168.9	165.8	0	0	0	0	110.8	I28 I34 F42 Y56 A57 W78	I28-V59 HydrophobicContact CD1-CG1 4.34Å; I34-V59 HydrophobicContact CD1-CB 4.04Å; I34-V59 HydrophobicContact CD1-CG1 3.1Å; I34-V59 HydrophobicContact CD1-CG2 3.77Å; F42-V59 HydrophobicContact CD2-CG2 4.34Å; Y56-V59 VanDerWaalsContact O-CB 3.32Å; Y56-V59 WeakPolarHBondContact O-CB 3.17Å; Y56-V59 PolarHBondContact O-N 2.88Å; A57-V59 PolarHBondContact O-N 2.99Å; A57-V59 VanDerWaalsContact O-N 3.15Å; V59-W78 HydrophobicContact CG1-CZ2 4.27Å; V59-W78 WeakPolarHBondContact O-CZ2 3.43Å
60	L	66.3	Low	67	Low	3 Å²	3	53.7 Å²	53.7	2%	0.016	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-38.8	-171.7	-61.1	166.3	0	0	0	111	S21 T24 I28 A57 W58 K62 A76 W78 D91	S21-L60 WeakPolarHBondContact O-CD1 3.46Å; T24-L60 VanDerWaalsContact CB-CD1 3.49Å; T24-L60 HydrophobicContact CG2-CD1 3.47Å; T24-L60 VanDerWaalsContact CG2-CD1 3.47Å; T24-L60 HydrophobicContact CG2-CD2 4Å; T24-L60 HydrophobicContact CG2-CG 4.36Å; I28-L60 HydrophobicContact CD1-CD2 3.72Å; A57-L60 PolarHBondContact O-N 2.85Å; W58-L60 PolarHBondContact O-N 2.85Å; L60-K62 PolarHBondContact O-N 3Å; L60-K62 VanDerWaalsContact O-N 3.09Å; L60-A76 HydrophobicContact CB-CB 4.3Å; L60-A76 HydrophobicContact CD2-CB 4.15Å; L60-W78 HydrophobicContact CD2-CG 3.96Å; L60-W78 VanDerWaalsContact CD2-NE1 3.34Å; L60-D91 HydrophobicContact CD1-CB 4.18Å; L60-D91 WeakPolarHBondContact CD1-OD2 3.41Å; L60-D91 HydrophobicContact CD2-CB 4.43Å
61	D	69.9	Low	67	Low	4 Å²	4	51.9 Å²	51.9	2%	0.021	26%	0.257	C	S	.	.			trans	-76.7	94.2	-177.4	-65.7	-21.8	0	0	0	111.3	A57 E66 R67	A57-D61 PolarHBondContact O-N 3.24Å; D61-E66 WeakPolarHBondContact CA-OE2 3.49Å; D61-E66 HydrophobicContact CB-CB 3.76Å; D61-R67 HydrophobicContact CB-CG 4.27Å; D61-R67 PolarHBondContact O-NE 2.89Å; D61-R67 PolarHBondContact O-NH2 2.69Å
62	K	67.9	Low	66.4	Low	144 Å²	144	50.2 Å²	50.2	63%	0.626	25%	0.251	S	S	*	.			trans	-91.9	-26.9	-179.7	-70	-173.5	-179.2	177.8	0	112.7	L60 E66	L60-K62 PolarHBondContact O-N 3Å; L60-K62 VanDerWaalsContact O-N 3.09Å; K62-E66 PolarHBondContact N-OE2 2.94Å; K62-E66 VanDerWaalsContact N-OE2 3.08Å
63	L	63.2	Low	66.2	Low	76 Å²	76	49.7 Å²	49.7	40%	0.398	24%	0.24	S	C	.	.	S	Bend	trans	-79.4	139	-177.9	-60.6	171.6	0	0	0	110.4	A65 E66 R67 I73 D74	L63-A65 PolarHBondContact O-N 3.06Å; L63-E66 HydrophobicContact CB-CB 4.3Å; L63-E66 HydrophobicContact CB-CG 3.87Å; L63-E66 WeakPolarHBondContact CB-OE2 3.21Å; L63-E66 HydrophobicContact CD1-CG 4.34Å; L63-E66 PolarHBondContact N-OE2 2.85Å; L63-E66 WeakPolarHBondContact O-CB 3.48Å; L63-E66 PolarHBondContact O-N 3Å; L63-R67 PolarHBondContact O-N 3.42Å; L63-R67 VanDerWaalsContact O-N 3.16Å; L63-I73 HydrophobicContact CD1-CB 4.45Å; L63-I73 HydrophobicContact CD1-CG2 4.34Å; L63-D74 HydrophobicContact CD1-CB 3.91Å
64	K	65.6	Low	65.8	Low	160 Å²	160	50 Å²	50	70%	0.696	24%	0.236	S	C	*	.	H	α-helix	trans	-53.9	-40.1	175.8	-169.3	-178.9	-176.9	-166.2	0	111.8	E66 R67 E68	K64-E66 PolarHBondContact O-N 2.93Å; K64-R67 PolarHBondContact O-N 2.84Å; K64-E68 WeakPolarHBondContact CE-OE1 3.48Å; K64-E68 HydrophobicContact CG-CG 4.49Å; K64-E68 IonicContact NZ-OE1 3.88Å; K64-E68 WeakPolarHBondContact O-CB 3.39Å; K64-E68 WeakPolarHBondContact O-CG 3.46Å; K64-E68 PolarHBondContact O-N 2.84Å
65	A	61.6	Low	65.6	Low	40 Å²	40	49.1 Å²	49.1	33%	0.331	23%	0.233	S	C	.	.	H	α-helix	trans	-67.1	-31	177.4	0	0	0	0	0	113.9	L63 R69 I73	L63-A65 PolarHBondContact O-N 3.06Å; A65-R69 WeakPolarHBondContact O-CB 3.5Å; A65-R69 WeakPolarHBondContact O-CG 3.38Å; A65-R69 PolarHBondContact O-N 2.9Å; A65-R69 VanDerWaalsContact O-N 3.14Å; A65-I73 HydrophobicContact CB-CD1 3.86Å
66	E	65.2	Low	65.1	Low	5 Å²	5	47.7 Å²	47.7	2%	0.023	23%	0.229	C	C	.	.	H	α-helix	trans	-66.3	-49.8	173.4	-71	171.7	148.9	0	0	109.7	D61 K62 L63 K64 E68 R69 G70 I71 I73 D74	D61-E66 WeakPolarHBondContact CA-OE2 3.49Å; D61-E66 HydrophobicContact CB-CB 3.76Å; K62-E66 PolarHBondContact N-OE2 2.94Å; K62-E66 VanDerWaalsContact N-OE2 3.08Å; L63-E66 HydrophobicContact CB-CB 4.3Å; L63-E66 HydrophobicContact CB-CG 3.87Å; L63-E66 WeakPolarHBondContact CB-OE2 3.21Å; L63-E66 HydrophobicContact CD1-CG 4.34Å; L63-E66 PolarHBondContact N-OE2 2.85Å; L63-E66 WeakPolarHBondContact O-CB 3.48Å; L63-E66 PolarHBondContact O-N 3Å; K64-E66 PolarHBondContact O-N 2.93Å; E66-E68 PolarHBondContact O-N 3.39Å; E66-R69 PolarHBondContact O-N 2.75Å; E66-G70 WeakPolarHBondContact O-CA 3.27Å; E66-G70 PolarHBondContact O-N 3Å; E66-I71 WeakPolarHBondContact CA-O 2.94Å; E66-I71 WeakPolarHBondContact CB-O 3.15Å; E66-I71 PolarHBondContact O-N 3.35Å; E66-I73 HydrophobicContact CG-CB 3.55Å; E66-I73 HydrophobicContact CG-CD1 3.81Å; E66-I73 HydrophobicContact CG-CG1 3.61Å; E66-I73 WeakPolarHBondContact OE1-CA 3.33Å; E66-I73 PolarHBondContact OE1-N 3.32Å; E66-D74 PolarHBondContact OE1-N 3.35Å
67	R	70.4	Confident	64.6	Low	47 Å²	47	51.7 Å²	51.7	18%	0.177	25%	0.251	C	S	.	.	H	α-helix	trans	-62	-41.9	179.6	-64.4	179.2	178.8	-160.1	-8.4	112.5	E45 K51 W58 D61 L63 K64	E45-R67 IonicContact OE2-NH1 3.35Å; E45-R67 PolarHBondContact OE2-NH1 2.79Å; K51-R67 PolarHBondContact NZ-O 2.75Å; W58-R67 HydrophobicContact CD2-CG 4.36Å; W58-R67 HydrophobicContact CZ2-CB 4.19Å; W58-R67 HydrophobicContact CZ2-CG 4.33Å; W58-R67 VanDerWaalsContact CZ3-NH1 3.27Å; D61-R67 HydrophobicContact CB-CG 4.27Å; D61-R67 PolarHBondContact O-NE 2.89Å; D61-R67 PolarHBondContact O-NH2 2.69Å; L63-R67 PolarHBondContact O-N 3.42Å; L63-R67 VanDerWaalsContact O-N 3.16Å; K64-R67 PolarHBondContact O-N 2.84Å
68	E	68.7	Low	65	Low	101 Å²	101	53.9 Å²	53.9	47%	0.472	26%	0.259	S	S	.	.	H	α-helix	trans	-66.6	-39.1	177.8	-77.4	175.2	178.7	0	0	112.4	K51 K64 E66	K51-E68 VanDerWaalsContact NZ-C 3.25Å; K51-E68 PolarHBondContact NZ-O 2.79Å; K64-E68 WeakPolarHBondContact CE-OE1 3.48Å; K64-E68 HydrophobicContact CG-CG 4.49Å; K64-E68 IonicContact NZ-OE1 3.88Å; K64-E68 WeakPolarHBondContact O-CB 3.39Å; K64-E68 WeakPolarHBondContact O-CG 3.46Å; K64-E68 PolarHBondContact O-N 2.84Å; E66-E68 PolarHBondContact O-N 3.39Å
69	R	65.6	Low	65.2	Low	174 Å²	174	59.6 Å²	59.6	66%	0.657	28%	0.284	S	S	*	.	H	α-helix	trans	-91.2	-16.9	-176.9	-64.5	179.7	-178.5	-164.4	-0.6	114.3	A65 E66 I71	A65-R69 WeakPolarHBondContact O-CB 3.5Å; A65-R69 WeakPolarHBondContact O-CG 3.38Å; A65-R69 PolarHBondContact O-N 2.9Å; A65-R69 VanDerWaalsContact O-N 3.14Å; E66-R69 PolarHBondContact O-N 2.75Å; R69-I71 VanDerWaalsContact C-N 3.28Å; R69-I71 HydrophobicContact CB-CD1 4.29Å; R69-I71 HydrophobicContact CB-CG1 3.84Å
70	G	64.7	Low	65.8	Low	15 Å²	15	59.9 Å²	59.9	16%	0.155	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	24.4	-175.7	0	0	0	0	0	113.7	E66	E66-G70 WeakPolarHBondContact O-CA 3.27Å; E66-G70 PolarHBondContact O-N 3Å
71	I	69.1	Low	66.7	Low	33 Å²	33	64.1 Å²	64.1	17%	0.169	31%	0.305	C	S	.	.	S	Bend	trans	-131.1	141.7	179.2	64.6	177.8	0	0	0	110.1	V16 E66 R69 I73 F98	V16-I71 HydrophobicContact CG1-CG2 4.42Å; E66-I71 WeakPolarHBondContact CA-O 2.94Å; E66-I71 WeakPolarHBondContact CB-O 3.15Å; E66-I71 PolarHBondContact O-N 3.35Å; R69-I71 VanDerWaalsContact C-N 3.28Å; R69-I71 HydrophobicContact CB-CD1 4.29Å; R69-I71 HydrophobicContact CB-CG1 3.84Å; I71-I73 HydrophobicContact CG1-CG1 4.4Å; I71-F98 HydrophobicContact CD1-CE2 4.36Å
72	T	55.5	Low	67.5	Low	10 Å²	10	64.3 Å²	64.3	6%	0.061	31%	0.306	C	S	.	.			trans	-69.6	131.9	171.9	-38.6	0	0	0	0	110.4	S21 P93	S21-T72 PolarHBondContact OG-OG1 3.14Å; T72-P93 WeakPolarHBondContact O-CB 3.5Å
73	I	55.6	Low	68.3	Low	24 Å²	24	60.3 Å²	60.3	12%	0.123	31%	0.306	C	S	.	.			trans	-114.7	-48.3	-176.2	-66.1	176.5	0	0	0	110.3	L63 A65 E66 I71 F98 N101	L63-I73 HydrophobicContact CD1-CB 4.45Å; L63-I73 HydrophobicContact CD1-CG2 4.34Å; A65-I73 HydrophobicContact CB-CD1 3.86Å; E66-I73 HydrophobicContact CG-CB 3.55Å; E66-I73 HydrophobicContact CG-CD1 3.81Å; E66-I73 HydrophobicContact CG-CG1 3.61Å; E66-I73 WeakPolarHBondContact OE1-CA 3.33Å; E66-I73 PolarHBondContact OE1-N 3.32Å; I71-I73 HydrophobicContact CG1-CG1 4.4Å; I73-F98 HydrophobicContact CB-CD2 4.45Å; I73-F98 HydrophobicContact CB-CE2 4.2Å; I73-F98 HydrophobicContact CB-CZ 4.25Å; I73-F98 HydrophobicContact CD1-CZ 4.39Å; I73-F98 HydrophobicContact CG1-CD2 4.34Å; I73-F98 HydrophobicContact CG1-CE2 3.71Å; I73-F98 HydrophobicContact CG1-CZ 3.89Å; I73-F98 HydrophobicContact CG2-CD1 4.04Å; I73-F98 HydrophobicContact CG2-CD2 4.48Å; I73-F98 HydrophobicContact CG2-CE1 3.66Å; I73-F98 HydrophobicContact CG2-CE2 4.17Å; I73-F98 HydrophobicContact CG2-CG 4.46Å; I73-F98 HydrophobicContact CG2-CZ 3.75Å; I73-N101 PolarHBondContact O-ND2 3.19Å
74	D	55.3	Low	69.4	Low	80 Å²	80	62.6 Å²	62.6	43%	0.428	31%	0.313	S	S	.	.	S	Bend	trans	-111.9	164.1	-179	-154.3	7.8	0	0	0	112.1	L63 E66 A76 N101	L63-D74 HydrophobicContact CD1-CB 3.91Å; E66-D74 PolarHBondContact OE1-N 3.35Å; D74-A76 PolarHBondContact O-N 2.9Å; D74-N101 PolarHBondContact OD1-ND2 2.53Å
75	I	56.8	Low	70.5	Confident	44 Å²	44	55.7 Å²	55.7	23%	0.226	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-76.4	123.4	179.1	-57.5	170.1	0	0	0	109	L77 I90 N101 T104	I75-L77 HydrophobicContact CG2-CD2 4.14Å; I75-I90 HydrophobicContact CG2-CG2 3.4Å; I75-N101 HydrophobicContact CD1-CB 4.38Å; I75-N101 WeakPolarHBondContact CD1-O 3.42Å; I75-N101 HydrophobicContact CG1-CB 4.05Å; I75-T104 WeakPolarHBondContact CD1-OG1 3.3Å
76	A	61.4	Low	71.5	Confident	11 Å²	11	58.6 Å²	58.6	9%	0.091	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	126.7	167.7	0	0	0	0	0	110	L60 D74 D91	L60-A76 HydrophobicContact CB-CB 4.3Å; L60-A76 HydrophobicContact CD2-CB 4.15Å; D74-A76 PolarHBondContact O-N 2.9Å; A76-D91 PolarHBondContact O-N 3.29Å
77	L	64.1	Low	72.5	Confident	105 Å²	105	58.4 Å²	58.4	55%	0.55	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	120	172.7	-62.1	177.5	0	0	0	109.3	I75 T88 I89 I90	I75-L77 HydrophobicContact CG2-CD2 4.14Å; L77-T88 HydrophobicContact CD2-CG2 4.12Å; L77-I89 WeakPolarHBondContact CA-O 3.32Å; L77-I90 HydrophobicContact CD2-CB 4.41Å; L77-I90 HydrophobicContact CD2-CG1 3.77Å; L77-I90 HydrophobicContact CD2-CG2 4.47Å
78	W	75.6	Confident	73.1	Confident	50 Å²	50	56.7 Å²	56.7	19%	0.189	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	150	175.9	-71.5	88	0	0	0	110.6	I28 I34 V59 L60 T88 I89	I28-W78 HydrophobicContact CD1-CB 3.52Å; I28-W78 HydrophobicContact CD1-CD2 4.37Å; I28-W78 HydrophobicContact CD1-CG 3.75Å; I28-W78 HydrophobicContact CG1-CB 4.22Å; I28-W78 HydrophobicContact CG2-CE3 4.47Å; I34-W78 HydrophobicContact CD1-CE3 4.47Å; I34-W78 HydrophobicContact CD1-CZ3 4.18Å; I34-W78 HydrophobicContact CG1-CE3 4.38Å; I34-W78 HydrophobicContact CG1-CZ3 3.93Å; V59-W78 HydrophobicContact CG1-CZ2 4.27Å; V59-W78 WeakPolarHBondContact O-CZ2 3.43Å; L60-W78 HydrophobicContact CD2-CG 3.96Å; L60-W78 VanDerWaalsContact CD2-NE1 3.34Å; W78-T88 CarbonylContact O-C 3.57Å; W78-T88 WeakPolarHBondContact O-CA 3.2Å; W78-I89 HydrophobicContact CB-CG2 3.77Å; W78-I89 PolarHBondContact N-O 2.82Å; W78-I89 VanDerWaalsContact N-O 3.11Å; W78-I89 PolarHBondContact O-N 3.28Å
79	K	77.1	Confident	73.8	Confident	123 Å²	123	52.1 Å²	52.1	54%	0.535	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	138.5	-179.2	-62.9	-175.5	-179.6	-177.6	0	110	V87	K79-V87 VanDerWaalsContact CA-O 3.27Å; K79-V87 WeakPolarHBondContact CA-O 3.26Å
80	F	82.8	Confident	74.6	Confident	8 Å²	8	43.9 Å²	43.9	4%	0.035	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	169	166.2	69.1	-85.9	0	0	0	109.7	L27 I28 C31 T82 V87 I89 L229 L232	L27-F80 HydrophobicContact CD2-CE1 3.82Å; L27-F80 HydrophobicContact CD2-CE2 3.91Å; L27-F80 HydrophobicContact CD2-CZ 3.34Å; L27-F80 HydrophobicContact CG-CE2 4.26Å; L27-F80 HydrophobicContact CG-CZ 4.12Å; I28-F80 HydrophobicContact CG1-CD1 4.41Å; C31-F80 HydrophobicContact CB-CB 3.83Å; C31-F80 HydrophobicContact CB-CD2 3.74Å; C31-F80 HydrophobicContact CB-CG 4.1Å; F80-T82 HydrophobicContact CD2-CG2 4.33Å; F80-T82 HydrophobicContact CE2-CG2 3.75Å; F80-V87 HydrophobicContact CD1-CB 4.16Å; F80-V87 HydrophobicContact CD1-CG1 4.25Å; F80-V87 HydrophobicContact CD2-CB 4.35Å; F80-V87 HydrophobicContact CE1-CB 3.8Å; F80-V87 HydrophobicContact CE1-CG1 3.5Å; F80-V87 VanDerWaalsContact CE1-CG1 3.5Å; F80-V87 HydrophobicContact CE2-CB 4.01Å; F80-V87 HydrophobicContact CE2-CG1 4.32Å; F80-V87 HydrophobicContact CE2-CG2 4.07Å; F80-V87 HydrophobicContact CG-CB 4.42Å; F80-V87 HydrophobicContact CZ-CB 3.71Å; F80-V87 HydrophobicContact CZ-CG1 3.53Å; F80-V87 HydrophobicContact CZ-CG2 4.07Å; F80-V87 PolarHBondContact N-O 3.19Å; F80-V87 PolarHBondContact O-N 2.85Å; F80-I89 HydrophobicContact CE1-CB 4.09Å; F80-I89 HydrophobicContact CE1-CD1 3.96Å; F80-I89 HydrophobicContact CE1-CG2 4.43Å; F80-L229 HydrophobicContact CE2-CD1 4.48Å; F80-L232 HydrophobicContact CE2-CD1 4.25Å; F80-L232 HydrophobicContact CZ-CD1 3.84Å
81	E	84.1	Confident	75.1	Confident	93 Å²	93	43.2 Å²	43.2	44%	0.435	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	142.1	-179.6	-66.2	-173.6	-148.8	0	0	111.2	K5 Y86	K5-E81 IonicContact NZ-OE2 3.8Å; K5-E81 PolarHBondContact NZ-OE2 3.48Å; E81-Y86 HydrophobicContact CG-CD1 3.58Å; E81-Y86 HydrophobicContact CG-CE1 3.61Å; E81-Y86 WeakPolarHBondContact OE1-CE1 3.34Å
82	T	86.6	Confident	75.3	Confident	7 Å²	7	41.7 Å²	41.7	4%	0.043	21%	0.212	C	C	.	.			trans	-106.8	-172.9	166.4	71.4	0	0	0	0	110.1	K5 F80 K84 Y85 V87 L229 D233	K5-T82 WeakPolarHBondContact CE-O 3.35Å; K5-T82 PolarHBondContact NZ-O 3.39Å; F80-T82 HydrophobicContact CD2-CG2 4.33Å; F80-T82 HydrophobicContact CE2-CG2 3.75Å; T82-K84 PolarHBondContact O-N 2.84Å; T82-K84 PolarHBondContact OG1-N 3.21Å; T82-Y85 PolarHBondContact N-O 2.81Å; T82-Y85 PolarHBondContact OG1-N 3.42Å; T82-Y85 PolarHBondContact OG1-O 2.78Å; T82-V87 HydrophobicContact CG2-CG2 3.72Å; T82-L229 HydrophobicContact CG2-CD1 3.74Å; T82-D233 WeakPolarHBondContact CB-OD1 3.5Å; T82-D233 PolarHBondContact OG1-OD1 3.41Å
83	G	85	Confident	76	Confident	61 Å²	61	41.2 Å²	41.2	63%	0.629	21%	0.209	S	C	*	.	S	Bend	trans	-60.3	-34.6	172.9	0	0	0	0	0	112.4	D233	G83-D233 PolarHBondContact N-OD2 2.84Å
84	K	87.2	Confident	76.3	Confident	124 Å²	124	40.2 Å²	40.2	54%	0.539	21%	0.205	S	C	.	.	S	Bend	trans	-112.5	-25.4	-173.9	-63.7	-179.5	-171.3	165.2	0	115.6	K5 T82 D233	K5-K84 WeakPolarHBondContact CB-O 3.43Å; T82-K84 PolarHBondContact O-N 2.84Å; T82-K84 PolarHBondContact OG1-N 3.21Å; K84-D233 WeakPolarHBondContact CD-O 3.16Å; K84-D233 PolarHBondContact N-OD1 3.1Å; K84-D233 PolarHBondContact NZ-O 2.74Å; K84-D233 VanDerWaalsContact NZ-O 3.08Å
85	Y	87.6	Confident	76.9	Confident	14 Å²	14	39.3 Å²	39.3	6%	0.055	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	148.6	-165.6	-61.7	-62.8	0	0	0	113.6	T6 I8 T82 I235 P237	T6-Y85 HydrophobicContact CG2-CD1 4.42Å; T6-Y85 HydrophobicContact CG2-CE1 4.37Å; T6-Y85 CarbonylContact O-C 3.4Å; T6-Y85 VanDerWaalsContact O-CA 3.26Å; T6-Y85 WeakPolarHBondContact O-CA 3.3Å; T6-Y85 WeakPolarHBondContact O-CD1 3.39Å; I8-Y85 HydrophobicContact CD1-CD1 4.38Å; I8-Y85 HydrophobicContact CD1-CD2 3.69Å; I8-Y85 HydrophobicContact CD1-CE2 4.32Å; I8-Y85 HydrophobicContact CD1-CG 3.72Å; I8-Y85 HydrophobicContact CG1-CG 4.13Å; I8-Y85 HydrophobicContact CG2-CD1 3.75Å; I8-Y85 HydrophobicContact CG2-CE1 4.05Å; I8-Y85 HydrophobicContact CG2-CG 4.15Å; T82-Y85 PolarHBondContact N-O 2.81Å; T82-Y85 PolarHBondContact OG1-N 3.42Å; T82-Y85 PolarHBondContact OG1-O 2.78Å; Y85-I235 HydrophobicContact CE2-CB 4.44Å; Y85-I235 WeakPolarHBondContact CE2-O 3.31Å; Y85-I235 PolarHBondContact OH-O 2.82Å; Y85-P237 HydrophobicContact CE1-CG 4.13Å; Y85-P237 WeakPolarHBondContact OH-CD 3.43Å; Y85-P237 VanDerWaalsContact OH-CG 3.32Å; Y85-P237 WeakPolarHBondContact OH-CG 3.28Å
86	Y	84.3	Confident	77.2	Confident	101 Å²	101	41.5 Å²	41.5	40%	0.396	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	118.3	152.8	-73.2	-69.7	0	0	0	107.6	K5 T6 H7 I8 E81	K5-Y86 HydrophobicContact CB-CD2 3.6Å; K5-Y86 HydrophobicContact CB-CE2 3.65Å; K5-Y86 HydrophobicContact CB-CG 4.32Å; K5-Y86 HydrophobicContact CG-CE2 4.42Å; K5-Y86 WeakPolarHBondContact O-CD2 3.41Å; T6-Y86 PolarHBondContact O-N 3.48Å; H7-Y86 CarbonylContact C-O 3.51Å; H7-Y86 VanDerWaalsContact CA-O 3.29Å; H7-Y86 WeakPolarHBondContact CA-O 3.47Å; I8-Y86 PolarHBondContact N-O 3.48Å; E81-Y86 HydrophobicContact CG-CD1 3.58Å; E81-Y86 HydrophobicContact CG-CE1 3.61Å; E81-Y86 WeakPolarHBondContact OE1-CE1 3.34Å
87	V	85.7	Confident	77.1	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.006	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	122.8	-176.6	-177.3	0	0	0	0	109.4	I8 I10 K79 F80 T82	I8-V87 HydrophobicContact CD1-CG2 4Å; I8-V87 HydrophobicContact CG1-CB 4.44Å; I8-V87 HydrophobicContact CG1-CG1 4.47Å; I8-V87 HydrophobicContact CG1-CG2 3.87Å; I8-V87 WeakPolarHBondContact O-CA 3.48Å; I10-V87 HydrophobicContact CB-CG1 4.3Å; I10-V87 HydrophobicContact CD1-CG1 3.57Å; I10-V87 HydrophobicContact CG1-CG1 3.84Å; K79-V87 VanDerWaalsContact CA-O 3.27Å; K79-V87 WeakPolarHBondContact CA-O 3.26Å; F80-V87 HydrophobicContact CD1-CB 4.16Å; F80-V87 HydrophobicContact CD1-CG1 4.25Å; F80-V87 HydrophobicContact CD2-CB 4.35Å; F80-V87 HydrophobicContact CE1-CB 3.8Å; F80-V87 HydrophobicContact CE1-CG1 3.5Å; F80-V87 VanDerWaalsContact CE1-CG1 3.5Å; F80-V87 HydrophobicContact CE2-CB 4.01Å; F80-V87 HydrophobicContact CE2-CG1 4.32Å; F80-V87 HydrophobicContact CE2-CG2 4.07Å; F80-V87 HydrophobicContact CG-CB 4.42Å; F80-V87 HydrophobicContact CZ-CB 3.71Å; F80-V87 HydrophobicContact CZ-CG1 3.53Å; F80-V87 HydrophobicContact CZ-CG2 4.07Å; F80-V87 PolarHBondContact N-O 3.19Å; F80-V87 PolarHBondContact O-N 2.85Å; T82-V87 HydrophobicContact CG2-CG2 3.72Å
88	T	82.3	Confident	76.9	Confident	12 Å²	12	41.8 Å²	41.8	7%	0.074	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	115.8	159.7	-68.3	0	0	0	0	108.6	H7 I8 N9 I10 L77 W78	H7-T88 PolarHBondContact CE1-OG1 3.48Å; H7-T88 PolarHBondContact NE2-OG1 2.76Å; I8-T88 PolarHBondContact O-N 3.5Å; N9-T88 WeakPolarHBondContact CA-O 3.36Å; I10-T88 PolarHBondContact N-O 2.95Å; L77-T88 HydrophobicContact CD2-CG2 4.12Å; W78-T88 CarbonylContact O-C 3.57Å; W78-T88 WeakPolarHBondContact O-CA 3.2Å
89	I	84.1	Confident	76.5	Confident	4 Å²	4	39.6 Å²	39.6	2%	0.021	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	133.9	175.4	-157.7	150.1	0	0	0	110.1	I10 V12 T24 L27 I28 L77 W78 F80	I10-I89 CarbonylContact O-C 3.4Å; I10-I89 WeakPolarHBondContact O-CA 3.41Å; V12-I89 HydrophobicContact CG2-CD1 3.68Å; V12-I89 HydrophobicContact CG2-CG1 3.66Å; T24-I89 HydrophobicContact CG2-CD1 3.74Å; T24-I89 HydrophobicContact CG2-CG1 3.91Å; T24-I89 HydrophobicContact CG2-CG2 3.88Å; L27-I89 HydrophobicContact CD2-CD1 4.27Å; I28-I89 HydrophobicContact CD1-CG2 3.96Å; I28-I89 HydrophobicContact CG1-CG2 4.24Å; L77-I89 WeakPolarHBondContact CA-O 3.32Å; W78-I89 HydrophobicContact CB-CG2 3.77Å; W78-I89 PolarHBondContact N-O 2.82Å; W78-I89 VanDerWaalsContact N-O 3.11Å; W78-I89 PolarHBondContact O-N 3.28Å; F80-I89 HydrophobicContact CE1-CB 4.09Å; F80-I89 HydrophobicContact CE1-CD1 3.96Å; F80-I89 HydrophobicContact CE1-CG2 4.43Å
90	I	81.4	Confident	75.8	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.01	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	98.3	-178.3	-53.9	179.6	0	0	0	105.4	N9 I10 V11 V12 I75 L77 A92 G105 Q108	N9-I90 HydrophobicContact CB-CD1 4.38Å; I10-I90 WeakPolarHBondContact O-CB 3.43Å; I10-I90 PolarHBondContact O-N 2.81Å; V11-I90 WeakPolarHBondContact CA-O 3.42Å; V11-I90 HydrophobicContact CB-CB 4.33Å; V11-I90 HydrophobicContact CG2-CB 4.32Å; V11-I90 HydrophobicContact CG2-CG2 4.19Å; V12-I90 PolarHBondContact N-O 3Å; I75-I90 HydrophobicContact CG2-CG2 3.4Å; L77-I90 HydrophobicContact CD2-CB 4.41Å; L77-I90 HydrophobicContact CD2-CG1 3.77Å; L77-I90 HydrophobicContact CD2-CG2 4.47Å; I90-A92 PolarHBondContact O-N 3.44Å; I90-G105 WeakPolarHBondContact CD1-O 3.35Å; I90-Q108 HydrophobicContact CD1-CB 4.19Å
91	D	76.4	Confident	75	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	111.4	174.4	-163.4	29.3	0	0	0	108.4	S21 L60 A76	S21-D91 WeakPolarHBondContact CB-OD2 3.44Å; S21-D91 PolarHBondContact OG-OD2 2.9Å; L60-D91 HydrophobicContact CD1-CB 4.18Å; L60-D91 WeakPolarHBondContact CD1-OD2 3.41Å; L60-D91 HydrophobicContact CD2-CB 4.43Å; A76-D91 PolarHBondContact O-N 3.29Å
92	A	72.1	Confident	74.3	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.008	17%	0.172	C	C	.	.			trans	-96.1	138.5	-177.9	0	0	0	0	0	110.6	V11 V12 I13 K20 I90 G94 M102	V11-A92 HydrophobicContact CG2-CB 3.69Å; V12-A92 WeakPolarHBondContact O-CB 3.35Å; V12-A92 PolarHBondContact O-N 3.09Å; I13-A92 HydrophobicContact CG2-CB 4.35Å; K20-A92 WeakPolarHBondContact CE-O 3.39Å; I90-A92 PolarHBondContact O-N 3.44Å; A92-G94 PolarHBondContact O-N 3.06Å; A92-M102 HydrophobicContact CB-CB 4.11Å; A92-M102 HydrophobicContact CB-CG 3.82Å
93	P	69.8	Low	73.5	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.172	C	C	.	.			trans	-65.5	139.8	-176.6	27.2	-35	0	0	0	111.4	T72 F98 N101	T72-P93 WeakPolarHBondContact O-CB 3.5Å; P93-F98 HydrophobicContact CB-CB 3.62Å; P93-F98 HydrophobicContact CB-CD2 4.38Å; P93-F98 HydrophobicContact CB-CG 4.39Å; P93-F98 HydrophobicContact CG-CB 3.47Å; P93-F98 VanDerWaalsContact CG-CB 3.47Å; P93-F98 WeakPolarHBondContact CG-O 3.47Å; P93-N101 HydrophobicContact CG-CB 3.9Å
94	G	61.9	Low	72.6	Confident	4 Å²	4	33.8 Å²	33.8	4%	0.041	16%	0.156	C	C	.	.			trans	-76.6	-29.7	178.1	0	0	0	0	0	113.2	A92 Q132	A92-G94 PolarHBondContact O-N 3.06Å; G94-Q132 PolarHBondContact O-NE2 2.95Å; G94-Q132 PolarHBondContact O-OE1 2.96Å
95	H	69.1	Low	71.8	Confident	61 Å²	61	28 Å²	28	28%	0.282	13%	0.13	S	C	.	.	S	Bend	trans	-78.3	145.9	-166.4	-166.1	-90.4	0	0	0	113.1	V16 D97 F98	V16-H95 HydrophobicContact CG2-CB 4.2Å; H95-D97 VanDerWaalsContact C-N 3.27Å; H95-D97 IonicContact CE1-OD2 2.81Å; H95-D97 PolarHBondContact CE1-OD2 3.08Å; H95-D97 PolarHBondContact ND1-N 2.86Å; H95-D97 IonicContact ND1-OD2 2.84Å; H95-D97 PolarHBondContact O-N 3.45Å; H95-F98 HydrophobicContact CB-CD2 3.81Å; H95-F98 HydrophobicContact CB-CE2 4.21Å; H95-F98 PolarHBondContact O-N 3.06Å
96	R	62.7	Low	71.1	Confident	89 Å²	89	27.3 Å²	27.3	34%	0.336	13%	0.128	S	C	.	.	G	3₁₀ helix	trans	-56.1	-39.3	-176.3	-70.8	-175.3	174	-175.1	-4	113.2	F98 I99 N130 Q132	R96-F98 PolarHBondContact O-N 3.23Å; R96-F98 VanDerWaalsContact O-N 3.16Å; R96-I99 WeakPolarHBondContact O-CG1 3.32Å; R96-I99 PolarHBondContact O-N 3.1Å; R96-N130 VanDerWaalsContact NH2-C 3.34Å; R96-N130 PolarHBondContact NH2-O 3.19Å; R96-N130 PolarHBondContact NH2-OD1 2.62Å; R96-N130 VanDerWaalsContact NH2-OD1 3.15Å; R96-Q132 HydrophobicContact CG-CG 4.39Å
97	D	59.2	Low	70.3	Confident	88 Å²	88	24.6 Å²	24.6	47%	0.471	12%	0.124	S	C	.	.	G	3₁₀ helix	trans	-65.4	-18.5	-178	-63.1	-15.9	0	0	0	113.6	H95	H95-D97 VanDerWaalsContact C-N 3.27Å; H95-D97 IonicContact CE1-OD2 2.81Å; H95-D97 PolarHBondContact CE1-OD2 3.08Å; H95-D97 PolarHBondContact ND1-N 2.86Å; H95-D97 IonicContact ND1-OD2 2.84Å; H95-D97 PolarHBondContact O-N 3.45Å
98	F	61	Low	69.5	Low	34 Å²	34	26.7 Å²	26.7	15%	0.149	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-111.9	14.5	-174.6	-52	-55.9	0	0	0	113.4	I71 I73 P93 H95 R96 K100 N101 M102	I71-F98 HydrophobicContact CD1-CE2 4.36Å; I73-F98 HydrophobicContact CB-CD2 4.45Å; I73-F98 HydrophobicContact CB-CE2 4.2Å; I73-F98 HydrophobicContact CB-CZ 4.25Å; I73-F98 HydrophobicContact CD1-CZ 4.39Å; I73-F98 HydrophobicContact CG1-CD2 4.34Å; I73-F98 HydrophobicContact CG1-CE2 3.71Å; I73-F98 HydrophobicContact CG1-CZ 3.89Å; I73-F98 HydrophobicContact CG2-CD1 4.04Å; I73-F98 HydrophobicContact CG2-CD2 4.48Å; I73-F98 HydrophobicContact CG2-CE1 3.66Å; I73-F98 HydrophobicContact CG2-CE2 4.17Å; I73-F98 HydrophobicContact CG2-CG 4.46Å; I73-F98 HydrophobicContact CG2-CZ 3.75Å; P93-F98 HydrophobicContact CB-CB 3.62Å; P93-F98 HydrophobicContact CB-CD2 4.38Å; P93-F98 HydrophobicContact CB-CG 4.39Å; P93-F98 HydrophobicContact CG-CB 3.47Å; P93-F98 VanDerWaalsContact CG-CB 3.47Å; P93-F98 WeakPolarHBondContact CG-O 3.47Å; H95-F98 HydrophobicContact CB-CD2 3.81Å; H95-F98 HydrophobicContact CB-CE2 4.21Å; H95-F98 PolarHBondContact O-N 3.06Å; R96-F98 PolarHBondContact O-N 3.23Å; R96-F98 VanDerWaalsContact O-N 3.16Å; F98-K100 PolarHBondContact O-N 3.37Å; F98-N101 WeakPolarHBondContact O-CB 3.47Å; F98-N101 PolarHBondContact O-N 3.3Å; F98-M102 PolarHBondContact O-N 2.95Å
99	I	65.1	Low	69.5	Low	5 Å²	5	26.7 Å²	26.7	3%	0.026	14%	0.135	C	C	.	.	H	α-helix	trans	-55.7	-29.4	176.1	-69.7	172.6	0	0	0	112	R96 N101 M102 I103 E135 L139 T432	R96-I99 WeakPolarHBondContact O-CG1 3.32Å; R96-I99 PolarHBondContact O-N 3.1Å; I99-N101 PolarHBondContact O-N 2.7Å; I99-M102 CarbonylContact O-C 3.58Å; I99-M102 WeakPolarHBondContact O-CB 3.45Å; I99-M102 PolarHBondContact O-N 3.24Å; I99-M102 VanDerWaalsContact O-N 3.14Å; I99-I103 HydrophobicContact CG2-CD1 3.78Å; I99-I103 HydrophobicContact CG2-CG1 4.16Å; I99-I103 WeakPolarHBondContact O-CD1 3.27Å; I99-I103 WeakPolarHBondContact O-CG1 3.42Å; I99-I103 PolarHBondContact O-N 3.27Å; I99-E135 HydrophobicContact CD1-CG 4.48Å; I99-E135 VanDerWaalsContact CD1-OE1 3.28Å; I99-E135 WeakPolarHBondContact CD1-OE1 3.45Å; I99-L139 HydrophobicContact CG2-CD1 3.66Å; I99-T432 HydrophobicContact CG2-CG2 4.49Å; I99-T432 VanDerWaalsContact CG2-OG1 3.23Å; I99-T432 WeakPolarHBondContact CG2-OG1 3.31Å
100	K	63.7	Low	69.5	Low	91 Å²	91	28 Å²	28	40%	0.396	14%	0.142	S	C	.	.	H	α-helix	trans	-54.6	-41.7	173.4	57.6	159.3	-166.6	174.6	0	113	F98 I103 T104	F98-K100 PolarHBondContact O-N 3.37Å; K100-I103 PolarHBondContact O-N 3.28Å; K100-T104 PolarHBondContact O-N 2.99Å; K100-T104 VanDerWaalsContact O-N 3.16Å; K100-T104 PolarHBondContact O-OG1 2.86Å
101	N	66.4	Low	70	Confident	24 Å²	24	28 Å²	28	13%	0.128	14%	0.142	C	C	.	.	H	α-helix	trans	-73.9	-39.3	-178.7	-69.6	-1.1	0	0	0	108.6	I73 D74 I75 P93 F98 I99 I103 T104 G105	I73-N101 PolarHBondContact O-ND2 3.19Å; D74-N101 PolarHBondContact OD1-ND2 2.53Å; I75-N101 HydrophobicContact CD1-CB 4.38Å; I75-N101 WeakPolarHBondContact CD1-O 3.42Å; I75-N101 HydrophobicContact CG1-CB 4.05Å; P93-N101 HydrophobicContact CG-CB 3.9Å; F98-N101 WeakPolarHBondContact O-CB 3.47Å; F98-N101 PolarHBondContact O-N 3.3Å; I99-N101 PolarHBondContact O-N 2.7Å; N101-I103 VanDerWaalsContact C-N 3.34Å; N101-I103 PolarHBondContact O-N 3.19Å; N101-T104 WeakPolarHBondContact CA-OG1 3.48Å; N101-T104 PolarHBondContact O-N 2.92Å; N101-T104 PolarHBondContact O-OG1 2.83Å; N101-G105 PolarHBondContact O-N 2.9Å
102	M	69.8	Low	70.9	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-59.3	-41.3	171.9	-175.3	-101.6	179.3	0	0	112.4	I13 A92 F98 I99 G105 T106 H136 L139	I13-M102 HydrophobicContact CB-CE 4.24Å; I13-M102 HydrophobicContact CG2-CE 3.54Å; I13-M102 HydrophobicContact CG2-CG 4.49Å; A92-M102 HydrophobicContact CB-CB 4.11Å; A92-M102 HydrophobicContact CB-CG 3.82Å; F98-M102 PolarHBondContact O-N 2.95Å; I99-M102 CarbonylContact O-C 3.58Å; I99-M102 WeakPolarHBondContact O-CB 3.45Å; I99-M102 PolarHBondContact O-N 3.24Å; I99-M102 VanDerWaalsContact O-N 3.14Å; M102-G105 PolarHBondContact O-N 2.72Å; M102-T106 WeakPolarHBondContact O-CB 3.47Å; M102-T106 PolarHBondContact O-N 2.83Å; M102-T106 PolarHBondContact O-OG1 2.85Å; M102-H136 HydrophobicContact CE-CB 3.72Å; M102-L139 HydrophobicContact CE-CB 4Å; M102-L139 HydrophobicContact CE-CD1 4.42Å; M102-L139 HydrophobicContact SD-CB 4Å; M102-L139 HydrophobicContact SD-CD1 3.62Å; M102-L139 HydrophobicContact SD-CG 4.47Å
103	I	68	Low	72	Confident	9 Å²	9	28.3 Å²	28.3	5%	0.046	14%	0.143	C	C	.	.	H	α-helix	trans	-62.1	-48.4	176.5	-69.5	153.9	0	0	0	111.2	I99 K100 N101 G105 T106 S107 L143 A425 T432	I99-I103 HydrophobicContact CG2-CD1 3.78Å; I99-I103 HydrophobicContact CG2-CG1 4.16Å; I99-I103 WeakPolarHBondContact O-CD1 3.27Å; I99-I103 WeakPolarHBondContact O-CG1 3.42Å; I99-I103 PolarHBondContact O-N 3.27Å; K100-I103 PolarHBondContact O-N 3.28Å; N101-I103 VanDerWaalsContact C-N 3.34Å; N101-I103 PolarHBondContact O-N 3.19Å; I103-G105 VanDerWaalsContact C-N 3.3Å; I103-G105 PolarHBondContact O-N 2.93Å; I103-T106 PolarHBondContact O-N 3.48Å; I103-S107 WeakPolarHBondContact O-CB 3.34Å; I103-S107 PolarHBondContact O-N 2.91Å; I103-S107 PolarHBondContact O-OG 2.91Å; I103-L143 HydrophobicContact CB-CD1 4.24Å; I103-L143 HydrophobicContact CG1-CD1 4.28Å; I103-L143 HydrophobicContact CG2-CD1 4.05Å; I103-L143 HydrophobicContact CG2-CD2 4.26Å; I103-A425 HydrophobicContact CD1-CB 3.31Å; I103-A425 HydrophobicContact CG1-CB 4.1Å; I103-A425 HydrophobicContact CG2-CB 4.06Å; I103-T432 HydrophobicContact CD1-CG2 4.14Å
104	T	67.3	Low	73.3	Confident	46 Å²	46	28.3 Å²	28.3	28%	0.282	14%	0.144	S	C	.	.	H	α-helix	trans	-66.6	-29.8	179.6	48.4	0	0	0	0	113.5	I75 K100 N101 S107 Q108	I75-T104 WeakPolarHBondContact CD1-OG1 3.3Å; K100-T104 PolarHBondContact O-N 2.99Å; K100-T104 VanDerWaalsContact O-N 3.16Å; K100-T104 PolarHBondContact O-OG1 2.86Å; N101-T104 WeakPolarHBondContact CA-OG1 3.48Å; N101-T104 PolarHBondContact O-N 2.92Å; N101-T104 PolarHBondContact O-OG1 2.83Å; T104-S107 PolarHBondContact O-OG 3.46Å; T104-Q108 PolarHBondContact O-NE2 3.27Å
105	G	69.8	Low	74.9	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.01	14%	0.142	C	C	.	.	H	α-helix	trans	-77.1	-44	174.4	0	0	0	0	0	112.2	I90 N101 M102 I103 S107 Q108	I90-G105 WeakPolarHBondContact CD1-O 3.35Å; N101-G105 PolarHBondContact O-N 2.9Å; M102-G105 PolarHBondContact O-N 2.72Å; I103-G105 VanDerWaalsContact C-N 3.3Å; I103-G105 PolarHBondContact O-N 2.93Å; G105-S107 VanDerWaalsContact C-N 3.32Å; G105-S107 PolarHBondContact O-N 2.78Å; G105-Q108 PolarHBondContact O-N 2.81Å
106	T	73.3	Confident	76.2	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-67.5	-31.4	-178.9	-57.1	0	0	0	0	112.2	V11 M102 I103 Q108 A109 A140 L143 V145	V11-T106 HydrophobicContact CG1-CG2 4.26Å; M102-T106 WeakPolarHBondContact O-CB 3.47Å; M102-T106 PolarHBondContact O-N 2.83Å; M102-T106 PolarHBondContact O-OG1 2.85Å; I103-T106 PolarHBondContact O-N 3.48Å; T106-Q108 PolarHBondContact O-N 2.84Å; T106-A109 PolarHBondContact O-N 3.35Å; T106-A109 VanDerWaalsContact O-N 3.15Å; T106-A140 HydrophobicContact CG2-CB 4.03Å; T106-L143 HydrophobicContact CG2-CB 3.86Å; T106-L143 HydrophobicContact CG2-CD1 3.67Å; T106-L143 HydrophobicContact CG2-CG 4.42Å; T106-V145 HydrophobicContact CG2-CG2 3.67Å; T106-V145 WeakPolarHBondContact O-CG2 3.48Å
107	S	67.9	Low	77.8	Confident	44 Å²	44	21.4 Å²	21.4	31%	0.308	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-21.4	176.2	63.9	0	0	0	0	113.7	I103 T104 G105	I103-S107 WeakPolarHBondContact O-CB 3.34Å; I103-S107 PolarHBondContact O-N 2.91Å; I103-S107 PolarHBondContact O-OG 2.91Å; T104-S107 PolarHBondContact O-OG 3.46Å; G105-S107 VanDerWaalsContact C-N 3.32Å; G105-S107 PolarHBondContact O-N 2.78Å
108	Q	68.2	Low	79.5	Confident	46 Å²	46	17.2 Å²	17.2	22%	0.215	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-6.8	178.8	-59.2	-179.6	39.8	0	0	113	N9 I90 T104 G105 T106	N9-Q108 WeakPolarHBondContact CB-O 3.5Å; N9-Q108 PolarHBondContact ND2-O 2.65Å; I90-Q108 HydrophobicContact CD1-CB 4.19Å; T104-Q108 PolarHBondContact O-NE2 3.27Å; G105-Q108 PolarHBondContact O-N 2.81Å; T106-Q108 PolarHBondContact O-N 2.84Å
109	A	81.8	Confident	81	Confident	12 Å²	12	15.8 Å²	15.8	10%	0.099	9%	0.088	C	C	.	.			trans	-86.1	137.8	-171	0	0	0	0	0	112.6	V11 T106 V145	V11-A109 HydrophobicContact CB-CB 3.69Å; V11-A109 HydrophobicContact CG1-CB 3.52Å; T106-A109 PolarHBondContact O-N 3.35Å; T106-A109 VanDerWaalsContact O-N 3.15Å; A109-V145 HydrophobicContact CB-CG2 4.15Å
110	D	85.3	Confident	82.2	Confident	32 Å²	32	20.1 Å²	20.1	17%	0.171	11%	0.114	C	C	.	.	S	Bend	trans	-88.2	-28.6	173.8	-56.6	-55.4	0	0	0	111.4	I8 N9 P238	I8-D110 WeakPolarHBondContact CA-OD2 2.95Å; N9-D110 PolarHBondContact N-OD2 3.33Å; N9-D110 PolarHBondContact O-N 2.82Å; D110-P238 HydrophobicContact CB-CB 4.22Å; D110-P238 HydrophobicContact CB-CG 4.18Å; D110-P238 VanDerWaalsContact OD1-CB 3.29Å; D110-P238 WeakPolarHBondContact OD1-CB 3.48Å; D110-P238 WeakPolarHBondContact OD1-CG 3.46Å
111	C	91.8	Very high	83.4	Confident	1 Å²	1	17.8 Å²	17.8	1%	0.007	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	148.6	176.4	-172.7	0	0	0	0	110.8	N9 I10 V11 V145 Q147 I235	N9-C111 PolarHBondContact O-N 2.98Å; I10-C111 WeakPolarHBondContact CA-O 3.44Å; V11-C111 PolarHBondContact N-O 3.3Å; C111-V145 VanDerWaalsContact C-CG1 3.45Å; C111-Q147 WeakPolarHBondContact CA-O 3.4Å; C111-Q147 HydrophobicContact CB-CB 4.05Å; C111-Q147 PolarHBondContact SG-O 3.1Å; C111-Q147 VanDerWaalsContact SG-O 3.39Å; C111-I235 HydrophobicContact CB-CD1 3.64Å; C111-I235 HydrophobicContact CB-CG1 4.05Å; C111-I235 HydrophobicContact CB-CG2 4.18Å
112	A	94.1	Very high	84.5	Confident	0 Å²	0	20 Å²	20	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	138.7	170.9	0	0	0	0	0	110.3	V11 I13 A140 V145 Q147 L148 I149	V11-A112 HydrophobicContact CG1-CB 3.87Å; V11-A112 CarbonylContact O-C 3.56Å; V11-A112 WeakPolarHBondContact O-CA 3.37Å; I13-A112 HydrophobicContact CD1-CB 3.98Å; I13-A112 HydrophobicContact CG1-CB 4.38Å; A112-A140 HydrophobicContact CB-CB 4.21Å; A112-V145 HydrophobicContact CB-CG1 3.8Å; A112-V145 VanDerWaalsContact N-CG1 3.31Å; A112-Q147 PolarHBondContact N-O 3.47Å; A112-L148 HydrophobicContact CB-CD1 3.82Å; A112-L148 WeakPolarHBondContact O-CA 3.15Å; A112-I149 PolarHBondContact O-N 2.8Å
113	V	96.2	Very high	85.6	Confident	7 Å²	7	20.2 Å²	20.2	4%	0.042	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	109.4	168.5	179.5	0	0	0	0	107.7	I10 V11 V12 I13 I115 I149 L232	I10-V113 HydrophobicContact CG2-CB 4.47Å; I10-V113 HydrophobicContact CG2-CG2 3.57Å; V11-V113 PolarHBondContact O-N 3.38Å; V12-V113 WeakPolarHBondContact CA-O 3.29Å; V12-V113 HydrophobicContact CG2-CB 4.43Å; I13-V113 PolarHBondContact N-O 3.04Å; V113-I115 HydrophobicContact CG1-CD1 3.67Å; V113-I115 HydrophobicContact CG1-CG1 4.34Å; V113-I149 CarbonylContact C-O 3.5Å; V113-I149 WeakPolarHBondContact CA-O 3.2Å; V113-I149 HydrophobicContact CG2-CB 4.4Å; V113-L232 HydrophobicContact CG2-CD2 3.85Å
114	L	96.1	Very high	86.7	Confident	1 Å²	1	23.3 Å²	23.3	1%	0.005	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	108.6	177.6	-178.3	66.8	0	0	0	110.2	I13 V116 T133 A137 L148 I149 V150 G151	I13-L114 HydrophobicContact CD1-CB 4.47Å; I13-L114 HydrophobicContact CD1-CD1 4.03Å; I13-L114 HydrophobicContact CG1-CB 4.21Å; I13-L114 HydrophobicContact CG1-CD1 3.84Å; I13-L114 CarbonylContact O-C 3.21Å; I13-L114 WeakPolarHBondContact O-CA 3.26Å; L114-V116 HydrophobicContact CD2-CG2 4.22Å; L114-V116 HydrophobicContact CG-CG2 3.97Å; L114-T133 HydrophobicContact CD1-CG2 4.02Å; L114-T133 HydrophobicContact CD2-CG2 4.04Å; L114-T133 HydrophobicContact CG-CG2 4.3Å; L114-A137 HydrophobicContact CD2-CB 4.3Å; L114-L148 HydrophobicContact CB-CD1 3.97Å; L114-I149 PolarHBondContact N-O 2.75Å; L114-V150 HydrophobicContact CB-CG2 4.36Å; L114-V150 HydrophobicContact CD2-CG2 4.38Å; L114-V150 WeakPolarHBondContact O-CA 3.15Å; L114-G151 PolarHBondContact O-N 2.82Å
115	I	96.2	Very high	87.7	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	117.6	176.7	-56	-59.1	0	0	0	109.7	V12 I13 S18 K20 T23 V113 G151 N153 I193	V12-I115 HydrophobicContact CG1-CG1 3.7Å; I13-I115 PolarHBondContact O-N 3.45Å; S18-I115 WeakPolarHBondContact CB-O 3.46Å; S18-I115 WeakPolarHBondContact O-CG2 3.19Å; S18-I115 PolarHBondContact OG-O 3.2Å; S18-I115 VanDerWaalsContact OG-O 3.06Å; K20-I115 HydrophobicContact CG-CB 4.08Å; K20-I115 HydrophobicContact CG-CG1 4.27Å; T23-I115 HydrophobicContact CG2-CD1 4.01Å; V113-I115 HydrophobicContact CG1-CD1 3.67Å; V113-I115 HydrophobicContact CG1-CG1 4.34Å; I115-G151 WeakPolarHBondContact CA-O 3.34Å; I115-N153 HydrophobicContact CG2-CB 3.69Å; I115-I193 HydrophobicContact CD1-CD1 4.28Å
116	V	95.9	Very high	88.4	Confident	2 Å²	2	23.3 Å²	23.3	1%	0.012	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	122	-178.6	-177.9	0	0	0	0	108.5	L114 F123 T133 V150 G151 V152 N153 I170 V174	L114-V116 HydrophobicContact CD2-CG2 4.22Å; L114-V116 HydrophobicContact CG-CG2 3.97Å; V116-F123 HydrophobicContact CG1-CD2 3.51Å; V116-F123 HydrophobicContact CG1-CE2 3.78Å; V116-T133 HydrophobicContact CG2-CG2 4Å; V116-V150 HydrophobicContact CG2-CG1 4.06Å; V116-G151 PolarHBondContact N-O 3.4Å; V116-V152 CarbonylContact O-C 3.57Å; V116-V152 WeakPolarHBondContact O-CA 3.27Å; V116-N153 PolarHBondContact O-N 3.38Å; V116-I170 HydrophobicContact CG1-CG2 3.98Å; V116-V174 HydrophobicContact CG1-CG2 4.42Å; V116-V174 HydrophobicContact CG2-CG2 4.45Å
117	A	95.9	Very high	89	Confident	6 Å²	6	23.9 Å²	23.9	5%	0.05	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	139.5	175.8	0	0	0	0	0	111.6	E122 F123 N153 K154	A117-E122 HydrophobicContact CB-CB 3.85Å; A117-E122 WeakPolarHBondContact CB-OE2 3.49Å; A117-F123 WeakPolarHBondContact O-CB 3.48Å; A117-N153 CarbonylContact C-O 3.57Å; A117-K154 HydrophobicContact CB-CD 4.26Å
118	A	96.6	Very high	89.7	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	15%	0.148	C	C	.	.			trans	-93.7	-13.4	-179.7	0	0	0	0	0	114.6	V152 N153 M155 T158 R166 I170	A118-V152 HydrophobicContact CB-CG1 3.86Å; A118-N153 VanDerWaalsContact CB-O 3.28Å; A118-N153 WeakPolarHBondContact CB-O 3.44Å; A118-N153 PolarHBondContact N-O 3.41Å; A118-M155 HydrophobicContact CB-SD 3.81Å; A118-T158 HydrophobicContact CB-CG2 3.61Å; A118-R166 PolarHBondContact O-NE 3.46Å; A118-I170 HydrophobicContact CB-CD1 3.7Å
119	G	92.1	Very high	89.9	Confident	4 Å²	4	31 Å²	31	4%	0.041	18%	0.178	C	C	.	.	S	Bend	trans	-54.8	149.1	178.4	0	0	0	0	0	112.6	G121 E122 F123 R166	G119-G121 PolarHBondContact O-N 2.92Å; G119-E122 PolarHBondContact O-N 3.3Å; G119-F123 PolarHBondContact O-N 2.95Å; G119-R166 PolarHBondContact O-NH2 3.48Å
120	V	89.3	Confident	89.4	Confident	97 Å²	97	35.2 Å²	35.2	59%	0.588	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	129	177.2	-177.2	0	0	0	0	109	E122 E159	V120-E122 PolarHBondContact O-N 3.41Å; V120-E159 HydrophobicContact CG2-CG 4.49Å
121	G	88.9	Confident	89	Confident	41 Å²	41	33.9 Å²	33.9	42%	0.423	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.3	-34.6	-176.8	0	0	0	0	0	113.8	G119 E124 A125	G119-G121 PolarHBondContact O-N 2.92Å; G121-E124 WeakPolarHBondContact CA-OE2 3.3Å; G121-E124 PolarHBondContact N-OE2 3.29Å; G121-A125 VanDerWaalsContact O-CB 3.25Å; G121-A125 WeakPolarHBondContact O-CB 3.21Å; G121-A125 PolarHBondContact O-N 3.35Å
122	E	90.5	Very high	88.4	Confident	72 Å²	72	34.2 Å²	34.2	34%	0.336	20%	0.195	S	C	.	.	H	α-helix	trans	-68.8	-43.8	178.2	-64.3	-167.2	-166.4	0	0	112.4	A117 G119 V120 A125 G126 K154	A117-E122 HydrophobicContact CB-CB 3.85Å; A117-E122 WeakPolarHBondContact CB-OE2 3.49Å; G119-E122 PolarHBondContact O-N 3.3Å; V120-E122 PolarHBondContact O-N 3.41Å; E122-A125 PolarHBondContact O-N 3.08Å; E122-G126 PolarHBondContact O-N 2.65Å; E122-K154 IonicContact OE1-NZ 2.96Å; E122-K154 PolarHBondContact OE1-NZ 3.27Å; E122-K154 WeakPolarHBondContact OE2-CD 3.33Å; E122-K154 WeakPolarHBondContact OE2-CE 3.19Å; E122-K154 IonicContact OE2-NZ 2.92Å; E122-K154 PolarHBondContact OE2-NZ 3.23Å
123	F	92.6	Very high	87.9	Confident	3 Å²	3	34.6 Å²	34.6	1%	0.013	20%	0.197	C	C	.	.	H	α-helix	trans	-61.3	-49.3	176.6	174	-116.5	0	0	0	110.9	V116 A117 G119 A125 G126 I127 R166 I170 E173 V174	V116-F123 HydrophobicContact CG1-CD2 3.51Å; V116-F123 HydrophobicContact CG1-CE2 3.78Å; A117-F123 WeakPolarHBondContact O-CB 3.48Å; G119-F123 PolarHBondContact O-N 2.95Å; F123-A125 VanDerWaalsContact C-N 3.33Å; F123-A125 PolarHBondContact O-N 3.37Å; F123-G126 PolarHBondContact O-N 3.07Å; F123-G126 VanDerWaalsContact O-N 3.16Å; F123-I127 HydrophobicContact CE1-CG2 4.3Å; F123-I127 HydrophobicContact CE2-CB 4.43Å; F123-I127 HydrophobicContact CE2-CD1 4.1Å; F123-I127 HydrophobicContact CZ-CB 4.47Å; F123-I127 HydrophobicContact CZ-CD1 3.83Å; F123-I127 HydrophobicContact CZ-CG2 4.21Å; F123-I127 WeakPolarHBondContact O-CG2 3.19Å; F123-I127 PolarHBondContact O-N 3.2Å; F123-R166 VanDerWaalsContact CB-NH2 3.34Å; F123-I170 HydrophobicContact CD1-CG1 4.04Å; F123-I170 HydrophobicContact CD2-CD1 4.43Å; F123-I170 HydrophobicContact CD2-CG1 3.95Å; F123-I170 HydrophobicContact CD2-CG2 4.08Å; F123-I170 HydrophobicContact CE1-CG1 4.16Å; F123-I170 HydrophobicContact CE2-CB 4.28Å; F123-I170 HydrophobicContact CE2-CG1 4.09Å; F123-I170 HydrophobicContact CE2-CG2 3.75Å; F123-I170 HydrophobicContact CG-CD1 4.37Å; F123-I170 HydrophobicContact CG-CG1 3.94Å; F123-I170 HydrophobicContact CZ-CB 4.4Å; F123-I170 HydrophobicContact CZ-CG1 4.19Å; F123-I170 HydrophobicContact CZ-CG2 4.29Å; F123-E173 HydrophobicContact CE1-CB 4.3Å; F123-E173 WeakPolarHBondContact CE1-OE2 3.5Å; F123-E173 HydrophobicContact CZ-CB 3.83Å; F123-V174 HydrophobicContact CE2-CG2 3.8Å; F123-V174 HydrophobicContact CZ-CG2 4.25Å
124	E	92	Very high	87.2	Confident	75 Å²	75	38.5 Å²	38.5	35%	0.35	21%	0.211	S	C	.	.	H	α-helix	trans	-62.5	-41	-178	-66.6	74.3	-162.9	0	0	110.7	G121 S128 R166	G121-E124 WeakPolarHBondContact CA-OE2 3.3Å; G121-E124 PolarHBondContact N-OE2 3.29Å; E124-S128 WeakPolarHBondContact O-CB 3.49Å; E124-S128 PolarHBondContact O-N 2.61Å; E124-R166 IonicContact OE1-CZ 3.62Å; E124-R166 IonicContact OE1-NH1 3.19Å; E124-R166 PolarHBondContact OE1-NH1 3.07Å; E124-R166 IonicContact OE1-NH2 2.59Å; E124-R166 PolarHBondContact OE1-NH2 3.04Å; E124-R166 IonicContact OE2-NH2 2.73Å; E124-R166 PolarHBondContact OE2-NH2 3.27Å
125	A	87.9	Confident	86.4	Confident	44 Å²	44	40 Å²	40	36%	0.364	22%	0.217	S	C	.	.	H	α-helix	trans	-61.1	-47.2	173.4	0	0	0	0	0	111.7	G121 E122 F123 I127 S128 G131	G121-A125 VanDerWaalsContact O-CB 3.25Å; G121-A125 WeakPolarHBondContact O-CB 3.21Å; G121-A125 PolarHBondContact O-N 3.35Å; E122-A125 PolarHBondContact O-N 3.08Å; F123-A125 VanDerWaalsContact C-N 3.33Å; F123-A125 PolarHBondContact O-N 3.37Å; A125-I127 PolarHBondContact O-N 3.17Å; A125-S128 WeakPolarHBondContact O-CB 3.37Å; A125-S128 PolarHBondContact O-N 3.27Å; A125-S128 PolarHBondContact O-OG 2.98Å; A125-G131 VanDerWaalsContact O-CA 3.29Å; A125-G131 WeakPolarHBondContact O-CA 3.27Å
126	G	84.4	Confident	85.9	Confident	2 Å²	2	40 Å²	40	2%	0.021	22%	0.217	C	C	.	.	H	α-helix	trans	-66.6	-33.3	-178.7	0	0	0	0	0	114.3	E122 F123 G131 T133	E122-G126 PolarHBondContact O-N 2.65Å; F123-G126 PolarHBondContact O-N 3.07Å; F123-G126 VanDerWaalsContact O-N 3.16Å; G126-G131 CarbonylContact O-C 3.53Å; G126-G131 VanDerWaalsContact O-CA 3.24Å; G126-G131 WeakPolarHBondContact O-CA 3.35Å; G126-T133 WeakPolarHBondContact O-CB 3.46Å; G126-T133 PolarHBondContact O-N 3.4Å; G126-T133 PolarHBondContact O-OG1 3.36Å
127	I	85.8	Confident	85.5	Confident	12 Å²	12	39.9 Å²	39.9	6%	0.062	22%	0.217	C	C	.	.	H	α-helix	trans	-94.4	-2.1	177.2	-151.2	161.9	0	0	0	113.3	F123 A125 R134 E173 V174	F123-I127 HydrophobicContact CE1-CG2 4.3Å; F123-I127 HydrophobicContact CE2-CB 4.43Å; F123-I127 HydrophobicContact CE2-CD1 4.1Å; F123-I127 HydrophobicContact CZ-CB 4.47Å; F123-I127 HydrophobicContact CZ-CD1 3.83Å; F123-I127 HydrophobicContact CZ-CG2 4.21Å; F123-I127 WeakPolarHBondContact O-CG2 3.19Å; F123-I127 PolarHBondContact O-N 3.2Å; A125-I127 PolarHBondContact O-N 3.17Å; I127-R134 HydrophobicContact CG1-CG 4.08Å; I127-R134 VanDerWaalsContact O-CD 3.25Å; I127-R134 WeakPolarHBondContact O-CD 3.21Å; I127-R134 PolarHBondContact O-NE 2.92Å; I127-R134 PolarHBondContact O-NH1 3.29Å; I127-R134 PolarHBondContact O-NH2 2.59Å; I127-R134 VanDerWaalsContact O-NH2 3.08Å; I127-E173 HydrophobicContact CD1-CB 4.44Å; I127-V174 HydrophobicContact CD1-CG2 4.4Å
128	S	82.7	Confident	84.8	Confident	44 Å²	44	40 Å²	40	31%	0.308	22%	0.216	S	C	.	.	S	Bend	trans	-61.8	171.1	175.7	76.2	0	0	0	0	112.2	E124 A125 N130 G131	E124-S128 WeakPolarHBondContact O-CB 3.49Å; E124-S128 PolarHBondContact O-N 2.61Å; A125-S128 WeakPolarHBondContact O-CB 3.37Å; A125-S128 PolarHBondContact O-N 3.27Å; A125-S128 PolarHBondContact O-OG 2.98Å; S128-N130 PolarHBondContact O-N 3.4Å; S128-N130 VanDerWaalsContact O-N 3.16Å; S128-N130 PolarHBondContact OG-N 3.46Å; S128-G131 PolarHBondContact O-N 3.11Å; S128-G131 PolarHBondContact OG-N 2.8Å
129	K	71.3	Confident	84.1	Confident	197 Å²	197	40 Å²	40	86%	0.857	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58	-27.6	173	-170.1	-179.2	178.7	-174.4	0	112.3
130	N	72.7	Confident	83.8	Confident	100 Å²	100	39.8 Å²	39.8	54%	0.535	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-9.1	178.8	-75.1	-36.2	0	0	0	113.5	R96 S128	R96-N130 VanDerWaalsContact NH2-C 3.34Å; R96-N130 PolarHBondContact NH2-O 3.19Å; R96-N130 PolarHBondContact NH2-OD1 2.62Å; R96-N130 VanDerWaalsContact NH2-OD1 3.15Å; S128-N130 PolarHBondContact O-N 3.4Å; S128-N130 VanDerWaalsContact O-N 3.16Å; S128-N130 PolarHBondContact OG-N 3.46Å
131	G	75.3	Confident	83.6	Confident	4 Å²	4	39.4 Å²	39.4	4%	0.041	20%	0.203	C	C	.	.			trans	-76.4	146	-177.7	0	0	0	0	0	112.6	A125 G126 S128	A125-G131 VanDerWaalsContact O-CA 3.29Å; A125-G131 WeakPolarHBondContact O-CA 3.27Å; G126-G131 CarbonylContact O-C 3.53Å; G126-G131 VanDerWaalsContact O-CA 3.24Å; G126-G131 WeakPolarHBondContact O-CA 3.35Å; S128-G131 PolarHBondContact O-N 3.11Å; S128-G131 PolarHBondContact OG-N 2.8Å
132	Q	79.8	Confident	83	Confident	8 Å²	8	38.2 Å²	38.2	4%	0.037	19%	0.188	C	C	.	.	H	α-helix	trans	-87.1	-13.1	-176.5	-59.7	130	-15.9	0	0	113.5	H15 G94 R96 R134 E135 H136	H15-Q132 PolarHBondContact ND1-N 3.22Å; H15-Q132 PolarHBondContact ND1-OE1 3.14Å; G94-Q132 PolarHBondContact O-NE2 2.95Å; G94-Q132 PolarHBondContact O-OE1 2.96Å; R96-Q132 HydrophobicContact CG-CG 4.39Å; Q132-R134 PolarHBondContact O-N 3.19Å; Q132-E135 PolarHBondContact O-N 3.37Å; Q132-H136 VanDerWaalsContact O-CB 3.27Å; Q132-H136 WeakPolarHBondContact O-CB 3.47Å; Q132-H136 PolarHBondContact O-N 2.78Å
133	T	84.4	Confident	82.3	Confident	7 Å²	7	35 Å²	35	4%	0.043	17%	0.173	C	C	.	.	H	α-helix	trans	-55	-40.8	176.3	-56.1	0	0	0	0	110.2	L114 V116 G126 A137	L114-T133 HydrophobicContact CD1-CG2 4.02Å; L114-T133 HydrophobicContact CD2-CG2 4.04Å; L114-T133 HydrophobicContact CG-CG2 4.3Å; V116-T133 HydrophobicContact CG2-CG2 4Å; G126-T133 WeakPolarHBondContact O-CB 3.46Å; G126-T133 PolarHBondContact O-N 3.4Å; G126-T133 PolarHBondContact O-OG1 3.36Å; T133-A137 WeakPolarHBondContact O-CB 3.38Å; T133-A137 PolarHBondContact O-N 2.81Å
134	R	81.4	Confident	81.4	Confident	89 Å²	89	35.7 Å²	35.7	34%	0.336	18%	0.18	S	C	.	.	H	α-helix	trans	-66.8	-50.9	177.9	-74	-160.8	168.1	165	14.1	113	I127 Q132 L138 Y177	I127-R134 HydrophobicContact CG1-CG 4.08Å; I127-R134 VanDerWaalsContact O-CD 3.25Å; I127-R134 WeakPolarHBondContact O-CD 3.21Å; I127-R134 PolarHBondContact O-NE 2.92Å; I127-R134 PolarHBondContact O-NH1 3.29Å; I127-R134 PolarHBondContact O-NH2 2.59Å; I127-R134 VanDerWaalsContact O-NH2 3.08Å; Q132-R134 PolarHBondContact O-N 3.19Å; R134-L138 WeakPolarHBondContact O-CB 3.35Å; R134-L138 PolarHBondContact O-N 2.8Å; R134-Y177 VanDerWaalsContact CA-CE1 3.44Å; R134-Y177 WeakPolarHBondContact CA-OH 3.5Å; R134-Y177 HydrophobicContact CB-CE1 3.8Å; R134-Y177 HydrophobicContact CB-CE2 4.12Å; R134-Y177 VanDerWaalsContact CB-CZ 3.43Å; R134-Y177 WeakPolarHBondContact CB-OH 3.4Å; R134-Y177 HydrophobicContact CG-CD1 4.18Å; R134-Y177 HydrophobicContact CG-CD2 4.1Å; R134-Y177 HydrophobicContact CG-CE1 3.61Å; R134-Y177 HydrophobicContact CG-CE2 3.54Å; R134-Y177 HydrophobicContact CG-CG 4.41Å; R134-Y177 VanDerWaalsContact NE-CE2 3.3Å; R134-Y177 PolarHBondContact O-OH 3.15Å
135	E	79.1	Confident	81.2	Confident	32 Å²	32	32.2 Å²	32.2	15%	0.15	16%	0.164	C	C	.	.	H	α-helix	trans	-62.2	-48.3	-179.6	-174.8	168.6	-156.9	0	0	111.3	I99 Q132 A137 L138 L139	I99-E135 HydrophobicContact CD1-CG 4.48Å; I99-E135 VanDerWaalsContact CD1-OE1 3.28Å; I99-E135 WeakPolarHBondContact CD1-OE1 3.45Å; Q132-E135 PolarHBondContact O-N 3.37Å; E135-A137 PolarHBondContact O-N 3.04Å; E135-L138 WeakPolarHBondContact O-CB 3.5Å; E135-L138 PolarHBondContact O-N 2.88Å; E135-L139 HydrophobicContact CG-CD1 3.95Å; E135-L139 HydrophobicContact CG-CG 4.34Å; E135-L139 WeakPolarHBondContact O-CB 3.05Å; E135-L139 VanDerWaalsContact O-CG 3.25Å; E135-L139 WeakPolarHBondContact O-CG 3.38Å; E135-L139 PolarHBondContact O-N 3.21Å
136	H	84.8	Confident	81.1	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-63.7	-42.7	-179.1	-68.5	167.2	0	0	0	113.2	I13 G14 M102 Q132 L138 L139 A140	I13-H136 HydrophobicContact CB-CB 4.02Å; I13-H136 HydrophobicContact CD1-CB 4.07Å; I13-H136 HydrophobicContact CG1-CB 4.45Å; G14-H136 PolarHBondContact N-ND1 2.94Å; G14-H136 PolarHBondContact O-CE1 3.09Å; G14-H136 PolarHBondContact O-ND1 3.23Å; G14-H136 VanDerWaalsContact O-ND1 3.07Å; M102-H136 HydrophobicContact CE-CB 3.72Å; Q132-H136 VanDerWaalsContact O-CB 3.27Å; Q132-H136 WeakPolarHBondContact O-CB 3.47Å; Q132-H136 PolarHBondContact O-N 2.78Å; H136-L138 VanDerWaalsContact C-N 3.3Å; H136-L138 PolarHBondContact O-N 3.15Å; H136-L139 PolarHBondContact O-N 2.87Å; H136-A140 WeakPolarHBondContact O-CB 3.42Å; H136-A140 PolarHBondContact O-N 3.21Å
137	A	87.1	Confident	81.5	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63.8	-38.4	177	0	0	0	0	0	111.6	L114 T133 E135 Y141 I181	L114-A137 HydrophobicContact CD2-CB 4.3Å; T133-A137 WeakPolarHBondContact O-CB 3.38Å; T133-A137 PolarHBondContact O-N 2.81Å; E135-A137 PolarHBondContact O-N 3.04Å; A137-Y141 PolarHBondContact O-N 3.32Å; A137-I181 HydrophobicContact CB-CD1 3.51Å
138	L	83.1	Confident	82	Confident	8 Å²	8	37.8 Å²	37.8	4%	0.042	18%	0.18	C	C	.	.	H	α-helix	trans	-66.9	-43.2	174.1	172.5	56	0	0	0	112.4	R134 E135 H136 Y141 T142 I181 I345 L347 R381	R134-L138 WeakPolarHBondContact O-CB 3.35Å; R134-L138 PolarHBondContact O-N 2.8Å; E135-L138 WeakPolarHBondContact O-CB 3.5Å; E135-L138 PolarHBondContact O-N 2.88Å; H136-L138 VanDerWaalsContact C-N 3.3Å; H136-L138 PolarHBondContact O-N 3.15Å; L138-Y141 PolarHBondContact O-N 2.9Å; L138-T142 WeakPolarHBondContact O-CB 3.29Å; L138-T142 PolarHBondContact O-N 3.35Å; L138-T142 PolarHBondContact O-OG1 2.95Å; L138-I181 HydrophobicContact CB-CD1 4.35Å; L138-I181 HydrophobicContact CB-CG1 4.47Å; L138-I181 HydrophobicContact CD1-CG2 4.27Å; L138-I345 HydrophobicContact CD1-CD1 4.49Å; L138-L347 HydrophobicContact CD2-CD2 3.38Å; L138-L347 HydrophobicContact CG-CD2 4.32Å; L138-R381 VanDerWaalsContact CD2-NH2 3.29Å
139	L	80.6	Confident	82.7	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-61.8	-47.7	176.7	-72.3	175.6	0	0	0	110.1	I99 M102 E135 H136 Y141 T142 L143 L347 V435	I99-L139 HydrophobicContact CG2-CD1 3.66Å; M102-L139 HydrophobicContact CE-CB 4Å; M102-L139 HydrophobicContact CE-CD1 4.42Å; M102-L139 HydrophobicContact SD-CB 4Å; M102-L139 HydrophobicContact SD-CD1 3.62Å; M102-L139 HydrophobicContact SD-CG 4.47Å; E135-L139 HydrophobicContact CG-CD1 3.95Å; E135-L139 HydrophobicContact CG-CG 4.34Å; E135-L139 WeakPolarHBondContact O-CB 3.05Å; E135-L139 VanDerWaalsContact O-CG 3.25Å; E135-L139 WeakPolarHBondContact O-CG 3.38Å; E135-L139 PolarHBondContact O-N 3.21Å; H136-L139 PolarHBondContact O-N 2.87Å; L139-Y141 VanDerWaalsContact C-N 3.33Å; L139-Y141 PolarHBondContact O-N 2.98Å; L139-T142 PolarHBondContact O-N 3.16Å; L139-L143 WeakPolarHBondContact O-CB 3.42Å; L139-L143 WeakPolarHBondContact O-CG 3.47Å; L139-L143 PolarHBondContact O-N 3.4Å; L139-L347 HydrophobicContact CD2-CD1 3.91Å; L139-V435 HydrophobicContact CD2-CB 4.47Å; L139-V435 HydrophobicContact CD2-CG1 3.32Å; L139-V435 HydrophobicContact CD2-CG2 4.44Å
140	A	85.6	Confident	83.9	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-56.8	-44.5	175.7	0	0	0	0	0	112.7	I13 T106 A112 H136 L143 G144 V145	I13-A140 HydrophobicContact CD1-CB 3.97Å; T106-A140 HydrophobicContact CG2-CB 4.03Å; A112-A140 HydrophobicContact CB-CB 4.21Å; H136-A140 WeakPolarHBondContact O-CB 3.42Å; H136-A140 PolarHBondContact O-N 3.21Å; A140-L143 CarbonylContact O-C 3.58Å; A140-L143 PolarHBondContact O-N 3.41Å; A140-G144 PolarHBondContact O-N 2.97Å; A140-V145 HydrophobicContact CB-CB 4.31Å; A140-V145 WeakPolarHBondContact O-CB 3.49Å; A140-V145 PolarHBondContact O-N 3.47Å
141	Y	85.1	Confident	85.1	Confident	90 Å²	90	21.6 Å²	21.6	35%	0.353	10%	0.099	S	C	.	.	H	α-helix	trans	-67.7	-42.2	178.8	-171.8	-99.3	0	0	0	112.5	A137 L138 L139 L143 G144 I181 G182 Y183	A137-Y141 PolarHBondContact O-N 3.32Å; L138-Y141 PolarHBondContact O-N 2.9Å; L139-Y141 VanDerWaalsContact C-N 3.33Å; L139-Y141 PolarHBondContact O-N 2.98Å; Y141-L143 VanDerWaalsContact C-N 3.33Å; Y141-G144 WeakPolarHBondContact O-CA 3.12Å; Y141-G144 PolarHBondContact O-N 3.49Å; Y141-I181 VanDerWaalsContact CB-CG2 3.47Å; Y141-I181 HydrophobicContact CD1-CG2 3.9Å; Y141-I181 HydrophobicContact CD2-CG2 4.37Å; Y141-I181 HydrophobicContact CG-CG2 3.66Å; Y141-G182 PolarHBondContact OH-O 2.85Å; Y141-Y183 WeakPolarHBondContact CA-OH 3.44Å; Y141-Y183 HydrophobicContact CD2-CD1 4.02Å; Y141-Y183 HydrophobicContact CD2-CD2 4.02Å; Y141-Y183 AromaticContact CD2-CE1 3.83Å; Y141-Y183 HydrophobicContact CD2-CE1 3.83Å; Y141-Y183 AromaticContact CD2-CE2 3.85Å; Y141-Y183 HydrophobicContact CD2-CE2 3.85Å; Y141-Y183 HydrophobicContact CD2-CG 4.12Å; Y141-Y183 AromaticContact CD2-CZ 3.75Å; Y141-Y183 HydrophobicContact CG-CE2 4.15Å; Y141-Y183 PolarHBondContact N-OH 2.89Å; Y141-Y183 VanDerWaalsContact N-OH 3.14Å
142	T	76.3	Confident	86.2	Confident	15 Å²	15	21.4 Å²	21.4	9%	0.092	10%	0.097	C	C	.	.	H	α-helix	trans	-67.1	-38.7	177.5	-52	0	0	0	0	111.2	L138 L139 G144 R423 V435 V437	L138-T142 WeakPolarHBondContact O-CB 3.29Å; L138-T142 PolarHBondContact O-N 3.35Å; L138-T142 PolarHBondContact O-OG1 2.95Å; L139-T142 PolarHBondContact O-N 3.16Å; T142-G144 PolarHBondContact O-N 3.4Å; T142-G144 VanDerWaalsContact O-N 3.15Å; T142-R423 WeakPolarHBondContact O-CD 3.48Å; T142-V435 HydrophobicContact CG2-CB 3.81Å; T142-V435 HydrophobicContact CG2-CG2 3.67Å; T142-V437 HydrophobicContact CG2-CG1 4.18Å
143	L	75.4	Confident	87	Confident	5 Å²	5	21.2 Å²	21.2	3%	0.026	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	6.2	170.1	-64.3	175.6	0	0	0	112.3	I103 T106 L139 A140 Y141 V145 R423	I103-L143 HydrophobicContact CB-CD1 4.24Å; I103-L143 HydrophobicContact CG1-CD1 4.28Å; I103-L143 HydrophobicContact CG2-CD1 4.05Å; I103-L143 HydrophobicContact CG2-CD2 4.26Å; T106-L143 HydrophobicContact CG2-CB 3.86Å; T106-L143 HydrophobicContact CG2-CD1 3.67Å; T106-L143 HydrophobicContact CG2-CG 4.42Å; L139-L143 WeakPolarHBondContact O-CB 3.42Å; L139-L143 WeakPolarHBondContact O-CG 3.47Å; L139-L143 PolarHBondContact O-N 3.4Å; A140-L143 CarbonylContact O-C 3.58Å; A140-L143 PolarHBondContact O-N 3.41Å; Y141-L143 VanDerWaalsContact C-N 3.33Å; L143-V145 VanDerWaalsContact C-N 3.28Å; L143-V145 PolarHBondContact O-N 2.97Å; L143-R423 VanDerWaalsContact C-CZ 3.47Å; L143-R423 HydrophobicContact CD2-CB 4.28Å; L143-R423 WeakPolarHBondContact O-CD 3.34Å; L143-R423 PolarHBondContact O-NE 3.27Å; L143-R423 PolarHBondContact O-NH1 3.09Å
144	G	75.6	Confident	87.6	Confident	17 Å²	17	23 Å²	23	18%	0.175	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	32	171.5	0	0	0	0	0	116.7	A140 Y141 T142 K146 R423	A140-G144 PolarHBondContact O-N 2.97Å; Y141-G144 WeakPolarHBondContact O-CA 3.12Å; Y141-G144 PolarHBondContact O-N 3.49Å; T142-G144 PolarHBondContact O-N 3.4Å; T142-G144 VanDerWaalsContact O-N 3.15Å; G144-K146 PolarHBondContact O-N 3.45Å; G144-R423 VanDerWaalsContact CA-NH2 3.32Å
145	V	86.3	Confident	88.4	Confident	2 Å²	2	18.8 Å²	18.8	1%	0.012	9%	0.088	C	C	.	.			trans	-71	99.4	156.6	-172.1	0	0	0	0	106.8	T106 A109 C111 A112 A140 L143 Y183	T106-V145 HydrophobicContact CG2-CG2 3.67Å; T106-V145 WeakPolarHBondContact O-CG2 3.48Å; A109-V145 HydrophobicContact CB-CG2 4.15Å; C111-V145 VanDerWaalsContact C-CG1 3.45Å; A112-V145 HydrophobicContact CB-CG1 3.8Å; A112-V145 VanDerWaalsContact N-CG1 3.31Å; A140-V145 HydrophobicContact CB-CB 4.31Å; A140-V145 WeakPolarHBondContact O-CB 3.49Å; A140-V145 PolarHBondContact O-N 3.47Å; L143-V145 VanDerWaalsContact C-N 3.28Å; L143-V145 PolarHBondContact O-N 2.97Å; V145-Y183 WeakPolarHBondContact O-CE1 3.37Å; V145-Y183 PolarHBondContact O-OH 2.83Å
146	K	86.8	Confident	89.2	Confident	151 Å²	151	18.9 Å²	18.9	66%	0.657	9%	0.089	S	C	*	.			trans	-88.1	-16.4	-175.3	-66.3	-173.7	-179.2	-179.4	0	113.3	G144	G144-K146 PolarHBondContact O-N 3.45Å
147	Q	92.1	Very high	89.6	Confident	24 Å²	24	21.8 Å²	21.8	11%	0.112	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	125.9	177.5	-58.2	-169.4	89.3	0	0	109.1	C111 A112 M236	C111-Q147 WeakPolarHBondContact CA-O 3.4Å; C111-Q147 HydrophobicContact CB-CB 4.05Å; C111-Q147 PolarHBondContact SG-O 3.1Å; C111-Q147 VanDerWaalsContact SG-O 3.39Å; A112-Q147 PolarHBondContact N-O 3.47Å; Q147-M236 PolarHBondContact NE2-O 2.91Å
148	L	95.9	Very high	90.1	Very high	1 Å²	1	22 Å²	22	1%	0.005	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	136.9	-177.5	-176.1	69.9	0	0	0	109.2	A112 L114 V150 I178 Y183 V188	A112-L148 HydrophobicContact CB-CD1 3.82Å; A112-L148 WeakPolarHBondContact O-CA 3.15Å; L114-L148 HydrophobicContact CB-CD1 3.97Å; L148-V150 HydrophobicContact CD2-CG2 4.38Å; L148-V150 HydrophobicContact CG-CG2 4.45Å; L148-I178 HydrophobicContact CD2-CB 4.47Å; L148-I178 HydrophobicContact CD2-CD1 4.36Å; L148-I178 HydrophobicContact CD2-CG2 4Å; L148-Y183 HydrophobicContact CB-CD1 4.04Å; L148-Y183 HydrophobicContact CB-CE1 3.83Å; L148-Y183 HydrophobicContact CD2-CD1 4.37Å; L148-Y183 HydrophobicContact CD2-CD2 4.04Å; L148-Y183 HydrophobicContact CD2-CE1 4.37Å; L148-Y183 HydrophobicContact CD2-CE2 4.02Å; L148-Y183 HydrophobicContact CD2-CG 4.2Å; L148-V188 HydrophobicContact CB-CG1 4.48Å; L148-V188 HydrophobicContact CB-CG2 4.07Å; L148-V188 HydrophobicContact CD2-CG1 4.42Å; L148-V188 HydrophobicContact CD2-CG2 4.47Å; L148-V188 HydrophobicContact CG-CG1 4.34Å; L148-V188 WeakPolarHBondContact O-CG1 3.42Å
149	I	97.4	Very high	90.5	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	139.7	168.7	-64.7	166.5	0	0	0	106.9	A112 V113 L114 L228 A231 L232 I235	A112-I149 PolarHBondContact O-N 2.8Å; V113-I149 CarbonylContact C-O 3.5Å; V113-I149 WeakPolarHBondContact CA-O 3.2Å; V113-I149 HydrophobicContact CG2-CB 4.4Å; L114-I149 PolarHBondContact N-O 2.75Å; I149-L228 HydrophobicContact CG2-CD1 3.89Å; I149-A231 HydrophobicContact CD1-CB 4.13Å; I149-A231 WeakPolarHBondContact CD1-O 3.45Å; I149-A231 HydrophobicContact CG2-CB 4.07Å; I149-L232 HydrophobicContact CD1-CD2 3.74Å; I149-I235 HydrophobicContact CD1-CD1 4.13Å; I149-I235 HydrophobicContact CD1-CG1 4Å
150	V	97.9	Very high	91.2	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	115.8	178	179.5	0	0	0	0	109	L114 V116 L148 V152 V174 V188 A189 F190 V191	L114-V150 HydrophobicContact CB-CG2 4.36Å; L114-V150 HydrophobicContact CD2-CG2 4.38Å; L114-V150 WeakPolarHBondContact O-CA 3.15Å; V116-V150 HydrophobicContact CG2-CG1 4.06Å; L148-V150 HydrophobicContact CD2-CG2 4.38Å; L148-V150 HydrophobicContact CG-CG2 4.45Å; V150-V152 HydrophobicContact CG1-CG2 4.24Å; V150-V174 HydrophobicContact CG1-CG1 4.33Å; V150-V174 HydrophobicContact CG2-CG1 4.29Å; V150-V188 HydrophobicContact CB-CG1 4.49Å; V150-V188 HydrophobicContact CG2-CG1 3.72Å; V150-A189 PolarHBondContact N-O 3.25Å; V150-F190 HydrophobicContact CB-CD1 3.69Å; V150-F190 HydrophobicContact CB-CE1 3.8Å; V150-F190 HydrophobicContact CB-CG 4.24Å; V150-F190 HydrophobicContact CB-CZ 4.44Å; V150-F190 HydrophobicContact CG1-CD1 3.69Å; V150-F190 HydrophobicContact CG1-CE1 3.77Å; V150-F190 HydrophobicContact CG2-CD1 4.24Å; V150-F190 HydrophobicContact CG2-CE1 3.85Å; V150-F190 HydrophobicContact CG2-CZ 4.11Å; V150-F190 WeakPolarHBondContact O-CA 3.18Å; V150-V191 PolarHBondContact O-N 3Å
151	G	97.7	Very high	91.6	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	109	169.8	0	0	0	0	0	109.7	L114 I115 V116 N153 V191	L114-G151 PolarHBondContact O-N 2.82Å; I115-G151 WeakPolarHBondContact CA-O 3.34Å; V116-G151 PolarHBondContact N-O 3.4Å; G151-N153 PolarHBondContact O-N 2.95Å; G151-V191 CarbonylContact C-O 3.56Å; G151-V191 WeakPolarHBondContact CA-O 3.27Å
152	V	97.9	Very high	92.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	93.9	172.8	-177	0	0	0	0	107.2	V116 A118 V150 M155 F167 I170 V191 I193	V116-V152 CarbonylContact O-C 3.57Å; V116-V152 WeakPolarHBondContact O-CA 3.27Å; A118-V152 HydrophobicContact CB-CG1 3.86Å; V150-V152 HydrophobicContact CG1-CG2 4.24Å; V152-M155 HydrophobicContact CG1-SD 3.86Å; V152-M155 WeakPolarHBondContact O-CG 3.32Å; V152-F167 HydrophobicContact CB-CD2 3.83Å; V152-F167 HydrophobicContact CB-CE2 3.94Å; V152-F167 HydrophobicContact CG1-CD2 3.98Å; V152-F167 HydrophobicContact CG2-CD2 3.87Å; V152-F167 HydrophobicContact CG2-CE2 3.69Å; V152-I170 HydrophobicContact CG1-CB 4.5Å; V152-I170 HydrophobicContact CG1-CD1 3.92Å; V152-I170 HydrophobicContact CG1-CG2 4.07Å; V152-I170 HydrophobicContact CG2-CG2 3.98Å; V152-V191 PolarHBondContact N-O 2.95Å; V152-I193 PolarHBondContact O-N 2.87Å
153	N	97.5	Very high	93.2	Very high	5 Å²	5	34.6 Å²	34.6	3%	0.027	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	166.4	-170.3	-168.9	28.4	0	0	0	112.5	S18 T23 I115 V116 A117 A118 G151 M155 I193 G195	S18-N153 PolarHBondContact O-ND2 2.99Å; T23-N153 PolarHBondContact OG1-ND2 3.19Å; I115-N153 HydrophobicContact CG2-CB 3.69Å; V116-N153 PolarHBondContact O-N 3.38Å; A117-N153 CarbonylContact C-O 3.57Å; A118-N153 VanDerWaalsContact CB-O 3.28Å; A118-N153 WeakPolarHBondContact CB-O 3.44Å; A118-N153 PolarHBondContact N-O 3.41Å; G151-N153 PolarHBondContact O-N 2.95Å; N153-M155 VanDerWaalsContact C-N 3.3Å; N153-M155 PolarHBondContact O-N 3.04Å; N153-I193 CarbonylContact C-O 3.58Å; N153-I193 WeakPolarHBondContact CA-O 3.49Å; N153-I193 HydrophobicContact CB-CD1 4.26Å; N153-I193 HydrophobicContact CB-CG1 3.98Å; N153-G195 PolarHBondContact OD1-N 3.24Å
154	K	96.8	Very high	94.2	Very high	45 Å²	45	38.3 Å²	38.3	20%	0.196	21%	0.205	C	C	.	.			trans	59.8	36.9	-176.6	-50.1	-170.2	-175.7	177.7	0	112.9	D17 A117 E122 D156 S157 I193	D17-K154 WeakPolarHBondContact O-CE 3.38Å; D17-K154 PolarHBondContact O-NZ 2.8Å; A117-K154 HydrophobicContact CB-CD 4.26Å; E122-K154 IonicContact OE1-NZ 2.96Å; E122-K154 PolarHBondContact OE1-NZ 3.27Å; E122-K154 WeakPolarHBondContact OE2-CD 3.33Å; E122-K154 WeakPolarHBondContact OE2-CE 3.19Å; E122-K154 IonicContact OE2-NZ 2.92Å; E122-K154 PolarHBondContact OE2-NZ 3.23Å; K154-D156 WeakPolarHBondContact CA-OD1 3.09Å; K154-D156 PolarHBondContact O-N 3.48Å; K154-S157 PolarHBondContact O-N 3.42Å; K154-I193 PolarHBondContact N-O 3.45Å
155	M	97.7	Very high	95.3	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-60.9	-27.4	175.3	-73.5	-60.9	-56.9	0	0	112.6	A118 V152 N153 S157 T158 Y162 F167 P192 I193 M208 W210	A118-M155 HydrophobicContact CB-SD 3.81Å; V152-M155 HydrophobicContact CG1-SD 3.86Å; V152-M155 WeakPolarHBondContact O-CG 3.32Å; N153-M155 VanDerWaalsContact C-N 3.3Å; N153-M155 PolarHBondContact O-N 3.04Å; M155-S157 PolarHBondContact O-N 2.87Å; M155-T158 HydrophobicContact CE-CG2 4.3Å; M155-T158 PolarHBondContact O-N 3.01Å; M155-T158 PolarHBondContact O-OG1 3.5Å; M155-T158 VanDerWaalsContact O-OG1 3.09Å; M155-T158 HydrophobicContact SD-CG2 4.23Å; M155-Y162 HydrophobicContact CB-CD1 3.93Å; M155-Y162 HydrophobicContact CB-CE1 4.33Å; M155-Y162 WeakPolarHBondContact O-CA 3.1Å; M155-Y162 PolarHBondContact O-N 3.45Å; M155-F167 HydrophobicContact CE-CB 3.96Å; M155-F167 HydrophobicContact SD-CB 4.34Å; M155-P192 HydrophobicContact CE-CB 4.4Å; M155-P192 HydrophobicContact CG-CB 3.85Å; M155-P192 HydrophobicContact SD-CB 4.19Å; M155-I193 WeakPolarHBondContact CG-O 3.04Å; M155-I193 PolarHBondContact N-O 2.99Å; M155-M208 HydrophobicContact CB-SD 4.14Å; M155-M208 HydrophobicContact CG-SD 4.22Å; M155-W210 HydrophobicContact CE-CH2 4.21Å; M155-W210 HydrophobicContact CE-CZ2 3.94Å
156	D	95.6	Very high	95.8	Very high	34 Å²	34	46.5 Å²	46.5	18%	0.182	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-60.3	-26.6	171	53.8	-83.9	0	0	0	113.7	K154 P161 Y162 S194	K154-D156 WeakPolarHBondContact CA-OD1 3.09Å; K154-D156 PolarHBondContact O-N 3.48Å; D156-P161 WeakPolarHBondContact O-CB 3.2Å; D156-Y162 HydrophobicContact CB-CE1 4.3Å; D156-Y162 HydrophobicContact CB-CE2 4.04Å; D156-S194 WeakPolarHBondContact OD1-CB 3.49Å; D156-S194 PolarHBondContact OD1-OG 2.98Å
157	S	94.3	Very high	96.3	Very high	61 Å²	61	40.1 Å²	40.1	43%	0.427	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-100.7	11.2	-174.6	-58.5	0	0	0	0	113.1	K154 M155	K154-S157 PolarHBondContact O-N 3.42Å; M155-S157 PolarHBondContact O-N 2.87Å
158	T	95.8	Very high	96.6	Very high	3 Å²	3	43.9 Å²	43.9	2%	0.018	23%	0.225	C	C	.	.	S	Bend	trans	-75.4	164.6	172.6	63.6	0	0	0	0	110.8	A118 M155 P160 P161 Y162 S163 R166	A118-T158 HydrophobicContact CB-CG2 3.61Å; M155-T158 HydrophobicContact CE-CG2 4.3Å; M155-T158 PolarHBondContact O-N 3.01Å; M155-T158 PolarHBondContact O-OG1 3.5Å; M155-T158 VanDerWaalsContact O-OG1 3.09Å; M155-T158 HydrophobicContact SD-CG2 4.23Å; T158-P160 VanDerWaalsContact C-C 3.4Å; T158-P160 CarbonylContact C-O 3.57Å; T158-P160 WeakPolarHBondContact CB-O 3.24Å; T158-P160 CarbonylContact O-C 2.94Å; T158-P160 VanDerWaalsContact O-O 3.12Å; T158-P160 PolarHBondContact OG1-O 2.8Å; T158-P161 VanDerWaalsContact O-CA 3.27Å; T158-P161 WeakPolarHBondContact O-CA 3.33Å; T158-Y162 PolarHBondContact OG1-N 2.85Å; T158-S163 PolarHBondContact OG1-N 2.98Å; T158-R166 HydrophobicContact CG2-CB 4.28Å; T158-R166 HydrophobicContact CG2-CG 3.86Å
159	E	92.4	Very high	96.6	Very high	158 Å²	158	47.8 Å²	47.8	74%	0.738	24%	0.243	S	C	*	.	S	Bend	trans	-117.2	108.8	175.4	-67.5	-179.1	-166.7	0	0	110.1	V120	V120-E159 HydrophobicContact CG2-CG 4.49Å
160	P	94.9	Very high	96.6	Very high	92 Å²	92	47.8 Å²	47.8	60%	0.597	24%	0.243	S	C	*	.	S	Bend	cis	-67.7	164.5	-8.7	31.7	-36.8	0	0	0	112.6	T158 S163	T158-P160 VanDerWaalsContact C-C 3.4Å; T158-P160 CarbonylContact C-O 3.57Å; T158-P160 WeakPolarHBondContact CB-O 3.24Å; T158-P160 CarbonylContact O-C 2.94Å; T158-P160 VanDerWaalsContact O-O 3.12Å; T158-P160 PolarHBondContact OG1-O 2.8Å; P160-S163 WeakPolarHBondContact O-CB 3.44Å; P160-S163 PolarHBondContact O-N 3.11Å
161	P	95.5	Very high	96.5	Very high	85 Å²	85	49.1 Å²	49.1	55%	0.552	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	140.3	177.2	-30.4	37.4	0	0	0	112.6	D156 T158 S163	D156-P161 WeakPolarHBondContact O-CB 3.2Å; T158-P161 VanDerWaalsContact O-CA 3.27Å; T158-P161 WeakPolarHBondContact O-CA 3.33Å; P161-S163 VanDerWaalsContact C-N 3.32Å; P161-S163 PolarHBondContact O-N 3.18Å
162	Y	96.5	Very high	96.4	Very high	27 Å²	27	57.1 Å²	57.1	11%	0.106	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	37.6	-178.6	-55.4	-86.3	0	0	0	114.1	M155 D156 T158 Q164 D199 K207 M208 W210	M155-Y162 HydrophobicContact CB-CD1 3.93Å; M155-Y162 HydrophobicContact CB-CE1 4.33Å; M155-Y162 WeakPolarHBondContact O-CA 3.1Å; M155-Y162 PolarHBondContact O-N 3.45Å; D156-Y162 HydrophobicContact CB-CE1 4.3Å; D156-Y162 HydrophobicContact CB-CE2 4.04Å; T158-Y162 PolarHBondContact OG1-N 2.85Å; Y162-Q164 PolarHBondContact O-N 3.08Å; Y162-D199 HydrophobicContact CE1-CB 4.24Å; Y162-D199 WeakPolarHBondContact CE1-OD2 2.9Å; Y162-D199 PolarHBondContact OH-OD2 3.44Å; Y162-K207 HydrophobicContact CD1-CB 4.11Å; Y162-K207 HydrophobicContact CD2-CB 4.04Å; Y162-K207 HydrophobicContact CD2-CD 4.09Å; Y162-K207 HydrophobicContact CE1-CB 4.2Å; Y162-K207 HydrophobicContact CE1-CD 3.99Å; Y162-K207 HydrophobicContact CE2-CB 4.17Å; Y162-K207 HydrophobicContact CE2-CD 3.39Å; Y162-K207 HydrophobicContact CE2-CG 4.39Å; Y162-K207 HydrophobicContact CG-CB 4Å; Y162-K207 VanDerWaalsContact OH-CD 3.28Å; Y162-K207 WeakPolarHBondContact OH-CD 3.46Å; Y162-K207 PolarHBondContact OH-NZ 3.41Å; Y162-M208 HydrophobicContact CD1-CE 3.97Å; Y162-M208 HydrophobicContact CD1-CG 3.66Å; Y162-M208 HydrophobicContact CD1-SD 3.82Å; Y162-M208 HydrophobicContact CE1-CE 4.17Å; Y162-M208 HydrophobicContact CG-CG 4.19Å; Y162-W210 PolarHBondContact O-NE1 3.09Å
163	S	97.4	Very high	96.3	Very high	17 Å²	17	61.1 Å²	61.1	12%	0.119	31%	0.305	C	S	.	.			trans	-70.1	117.1	-176.1	173.4	0	0	0	0	113.2	T158 P160 P161 K165 R166 F167	T158-S163 PolarHBondContact OG1-N 2.98Å; P160-S163 WeakPolarHBondContact O-CB 3.44Å; P160-S163 PolarHBondContact O-N 3.11Å; P161-S163 VanDerWaalsContact C-N 3.32Å; P161-S163 PolarHBondContact O-N 3.18Å; S163-K165 VanDerWaalsContact C-N 3.32Å; S163-K165 PolarHBondContact O-N 3.21Å; S163-R166 PolarHBondContact O-N 3.43Å; S163-R166 PolarHBondContact OG-N 3.23Å; S163-F167 PolarHBondContact O-N 3.1Å
164	Q	97.2	Very high	96.1	Very high	83 Å²	83	61 Å²	61	39%	0.388	30%	0.304	S	S	.	.	H	α-helix	trans	-56.7	-45.2	171.6	-179.7	174.7	-1.1	0	0	112	Y162 R166 F167 E168 W210	Y162-Q164 PolarHBondContact O-N 3.08Å; Q164-R166 VanDerWaalsContact C-N 3.29Å; Q164-R166 PolarHBondContact O-N 2.85Å; Q164-F167 WeakPolarHBondContact O-CB 3.44Å; Q164-F167 PolarHBondContact O-N 3.38Å; Q164-F167 VanDerWaalsContact O-N 3.14Å; Q164-E168 HydrophobicContact CG-CG 4.33Å; Q164-E168 WeakPolarHBondContact CG-OE1 3.41Å; Q164-E168 PolarHBondContact NE2-OE1 2.7Å; Q164-E168 WeakPolarHBondContact O-CG 3.34Å; Q164-E168 PolarHBondContact O-N 3.17Å; Q164-W210 HydrophobicContact CB-CD2 3.53Å; Q164-W210 HydrophobicContact CB-CE3 3.73Å; Q164-W210 HydrophobicContact CB-CG 3.9Å; Q164-W210 HydrophobicContact CB-CH2 4.41Å; Q164-W210 HydrophobicContact CB-CZ2 4.21Å; Q164-W210 HydrophobicContact CB-CZ3 4.17Å; Q164-W210 HydrophobicContact CG-CD2 3.84Å; Q164-W210 HydrophobicContact CG-CE3 3.52Å; Q164-W210 HydrophobicContact CG-CG 4.32Å; Q164-W210 HydrophobicContact CG-CZ3 3.97Å
165	K	97.4	Very high	96.1	Very high	169 Å²	169	60 Å²	60	74%	0.735	30%	0.303	S	S	*	.	H	α-helix	trans	-58.5	-42.1	-178.2	-177.5	-177.7	175.6	-173.9	0	111.5	S163 E168 E169	S163-K165 VanDerWaalsContact C-N 3.32Å; S163-K165 PolarHBondContact O-N 3.21Å; K165-E168 PolarHBondContact O-N 2.82Å; K165-E169 WeakPolarHBondContact O-CB 3.37Å; K165-E169 PolarHBondContact O-N 3.42Å
166	R	97.1	Very high	95.9	Very high	22 Å²	22	62.3 Å²	62.3	8%	0.083	32%	0.322	C	S	.	.	H	α-helix	trans	-67.4	-41.3	177.8	-177.4	54.3	169.8	-178.9	-3.9	111.6	A118 G119 F123 E124 T158 S163 Q164 E168 E169 I170	A118-R166 PolarHBondContact O-NE 3.46Å; G119-R166 PolarHBondContact O-NH2 3.48Å; F123-R166 VanDerWaalsContact CB-NH2 3.34Å; E124-R166 IonicContact OE1-CZ 3.62Å; E124-R166 IonicContact OE1-NH1 3.19Å; E124-R166 PolarHBondContact OE1-NH1 3.07Å; E124-R166 IonicContact OE1-NH2 2.59Å; E124-R166 PolarHBondContact OE1-NH2 3.04Å; E124-R166 IonicContact OE2-NH2 2.73Å; E124-R166 PolarHBondContact OE2-NH2 3.27Å; T158-R166 HydrophobicContact CG2-CB 4.28Å; T158-R166 HydrophobicContact CG2-CG 3.86Å; S163-R166 PolarHBondContact O-N 3.43Å; S163-R166 PolarHBondContact OG-N 3.23Å; Q164-R166 VanDerWaalsContact C-N 3.29Å; Q164-R166 PolarHBondContact O-N 2.85Å; R166-E168 PolarHBondContact O-N 2.84Å; R166-E169 VanDerWaalsContact CD-OE2 3.32Å; R166-E169 WeakPolarHBondContact CD-OE2 3.19Å; R166-E169 IonicContact CZ-OE2 3.2Å; R166-E169 IonicContact NE-OE2 3.9Å; R166-E169 IonicContact NH1-OE1 2.68Å; R166-E169 IonicContact NH1-OE2 2.79Å; R166-E169 PolarHBondContact NH1-OE2 3.37Å; R166-E169 PolarHBondContact O-N 2.87Å; R166-I170 HydrophobicContact CG-CD1 3.97Å; R166-I170 VanDerWaalsContact O-CG1 3.31Å; R166-I170 WeakPolarHBondContact O-CG1 3.38Å; R166-I170 PolarHBondContact O-N 3.05Å
167	F	97.9	Very high	95.5	Very high	17 Å²	17	62.5 Å²	62.5	8%	0.075	32%	0.321	C	S	.	.	H	α-helix	trans	-61	-43.5	175.2	173.6	-104.9	0	0	0	112.5	V152 M155 S163 Q164 I170 T171 F190 P192 W210 F211	V152-F167 HydrophobicContact CB-CD2 3.83Å; V152-F167 HydrophobicContact CB-CE2 3.94Å; V152-F167 HydrophobicContact CG1-CD2 3.98Å; V152-F167 HydrophobicContact CG2-CD2 3.87Å; V152-F167 HydrophobicContact CG2-CE2 3.69Å; M155-F167 HydrophobicContact CE-CB 3.96Å; M155-F167 HydrophobicContact SD-CB 4.34Å; S163-F167 PolarHBondContact O-N 3.1Å; Q164-F167 WeakPolarHBondContact O-CB 3.44Å; Q164-F167 PolarHBondContact O-N 3.38Å; Q164-F167 VanDerWaalsContact O-N 3.14Å; F167-I170 PolarHBondContact O-N 3.46Å; F167-T171 VanDerWaalsContact O-CB 3.27Å; F167-T171 WeakPolarHBondContact O-CB 3.27Å; F167-T171 PolarHBondContact O-N 2.86Å; F167-T171 PolarHBondContact O-OG1 3.5Å; F167-F190 HydrophobicContact CE2-CB 4.46Å; F167-F190 HydrophobicContact CZ-CB 4.06Å; F167-P192 HydrophobicContact CD2-CB 3.62Å; F167-P192 HydrophobicContact CD2-CG 4.22Å; F167-P192 HydrophobicContact CE2-CB 3.69Å; F167-P192 HydrophobicContact CE2-CG 3.94Å; F167-P192 HydrophobicContact CG-CB 4.23Å; F167-P192 HydrophobicContact CZ-CB 4.35Å; F167-P192 HydrophobicContact CZ-CG 4.1Å; F167-W210 HydrophobicContact CB-CH2 3.67Å; F167-W210 HydrophobicContact CB-CZ3 4.29Å; F167-W210 AromaticContact CD1-CH2 3.77Å; F167-W210 HydrophobicContact CD1-CH2 3.77Å; F167-W210 AromaticContact CD1-CZ3 3.63Å; F167-W210 HydrophobicContact CD1-CZ3 3.63Å; F167-W210 HydrophobicContact CE1-CZ3 4.26Å; F167-W210 AromaticContact CG-CH2 3.77Å; F167-W210 HydrophobicContact CG-CH2 3.77Å; F167-W210 HydrophobicContact CG-CZ3 4.13Å; F167-F211 HydrophobicContact CE1-CD2 4.14Å; F167-F211 HydrophobicContact CE1-CE2 4.02Å; F167-F211 HydrophobicContact CZ-CD2 4.43Å; F167-F211 AromaticContact CZ-CE2 3.98Å; F167-F211 HydrophobicContact CZ-CE2 3.98Å
168	E	97.4	Very high	95.4	Very high	103 Å²	103	59.6 Å²	59.6	48%	0.481	30%	0.3	S	S	.	.	H	α-helix	trans	-66	-40.4	178.6	-72	174.2	179.7	0	0	112.4	Q164 K165 R166 T171 K172	Q164-E168 HydrophobicContact CG-CG 4.33Å; Q164-E168 WeakPolarHBondContact CG-OE1 3.41Å; Q164-E168 PolarHBondContact NE2-OE1 2.7Å; Q164-E168 WeakPolarHBondContact O-CG 3.34Å; Q164-E168 PolarHBondContact O-N 3.17Å; K165-E168 PolarHBondContact O-N 2.82Å; R166-E168 PolarHBondContact O-N 2.84Å; E168-T171 PolarHBondContact O-N 3.33Å; E168-K172 WeakPolarHBondContact O-CB 3.33Å; E168-K172 PolarHBondContact O-N 3.45Å
169	E	96.6	Very high	95.3	Very high	83 Å²	83	66.5 Å²	66.5	39%	0.388	33%	0.33	S	S	.	.	H	α-helix	trans	-57.4	-54.5	173.1	178.7	-173.8	-159	0	0	111.2	K165 R166 T171 K172 E173	K165-E169 WeakPolarHBondContact O-CB 3.37Å; K165-E169 PolarHBondContact O-N 3.42Å; R166-E169 VanDerWaalsContact CD-OE2 3.32Å; R166-E169 WeakPolarHBondContact CD-OE2 3.19Å; R166-E169 IonicContact CZ-OE2 3.2Å; R166-E169 IonicContact NE-OE2 3.9Å; R166-E169 IonicContact NH1-OE1 2.68Å; R166-E169 IonicContact NH1-OE2 2.79Å; R166-E169 PolarHBondContact NH1-OE2 3.37Å; R166-E169 PolarHBondContact O-N 2.87Å; E169-T171 VanDerWaalsContact C-N 3.32Å; E169-T171 PolarHBondContact O-N 3.18Å; E169-K172 PolarHBondContact O-N 2.98Å; E169-E173 PolarHBondContact O-N 3.44Å
170	I	96.4	Very high	94.9	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-59.4	-45.7	178.9	-68.7	167.7	0	0	0	110.4	V116 A118 F123 V152 R166 F167 K172 E173 V174	V116-I170 HydrophobicContact CG1-CG2 3.98Å; A118-I170 HydrophobicContact CB-CD1 3.7Å; F123-I170 HydrophobicContact CD1-CG1 4.04Å; F123-I170 HydrophobicContact CD2-CD1 4.43Å; F123-I170 HydrophobicContact CD2-CG1 3.95Å; F123-I170 HydrophobicContact CD2-CG2 4.08Å; F123-I170 HydrophobicContact CE1-CG1 4.16Å; F123-I170 HydrophobicContact CE2-CB 4.28Å; F123-I170 HydrophobicContact CE2-CG1 4.09Å; F123-I170 HydrophobicContact CE2-CG2 3.75Å; F123-I170 HydrophobicContact CG-CD1 4.37Å; F123-I170 HydrophobicContact CG-CG1 3.94Å; F123-I170 HydrophobicContact CZ-CB 4.4Å; F123-I170 HydrophobicContact CZ-CG1 4.19Å; F123-I170 HydrophobicContact CZ-CG2 4.29Å; V152-I170 HydrophobicContact CG1-CB 4.5Å; V152-I170 HydrophobicContact CG1-CD1 3.92Å; V152-I170 HydrophobicContact CG1-CG2 4.07Å; V152-I170 HydrophobicContact CG2-CG2 3.98Å; R166-I170 HydrophobicContact CG-CD1 3.97Å; R166-I170 VanDerWaalsContact O-CG1 3.31Å; R166-I170 WeakPolarHBondContact O-CG1 3.38Å; R166-I170 PolarHBondContact O-N 3.05Å; F167-I170 PolarHBondContact O-N 3.46Å; I170-K172 VanDerWaalsContact C-N 3.31Å; I170-K172 PolarHBondContact O-N 2.84Å; I170-E173 PolarHBondContact O-N 3.06Å; I170-V174 HydrophobicContact CG2-CG2 3.99Å; I170-V174 VanDerWaalsContact O-CB 3.31Å; I170-V174 WeakPolarHBondContact O-CB 3.35Å; I170-V174 VanDerWaalsContact O-CG2 3.25Å; I170-V174 WeakPolarHBondContact O-CG2 3.43Å; I170-V174 PolarHBondContact O-N 3.06Å
171	T	96.3	Very high	94.4	Very high	28 Å²	28	60.5 Å²	60.5	17%	0.172	29%	0.293	C	S	.	.	H	α-helix	trans	-59.3	-43.9	179.5	-63.1	0	0	0	0	111	F167 E168 E169 S175 F190	F167-T171 VanDerWaalsContact O-CB 3.27Å; F167-T171 WeakPolarHBondContact O-CB 3.27Å; F167-T171 PolarHBondContact O-N 2.86Å; F167-T171 PolarHBondContact O-OG1 3.5Å; E168-T171 PolarHBondContact O-N 3.33Å; E169-T171 VanDerWaalsContact C-N 3.32Å; E169-T171 PolarHBondContact O-N 3.18Å; T171-S175 WeakPolarHBondContact O-CB 3.34Å; T171-S175 PolarHBondContact O-N 2.97Å; T171-S175 PolarHBondContact O-OG 3.36Å; T171-F190 HydrophobicContact CG2-CB 4.25Å; T171-F190 HydrophobicContact CG2-CD1 3.84Å; T171-F190 HydrophobicContact CG2-CD2 4.14Å; T171-F190 HydrophobicContact CG2-CE1 4.19Å; T171-F190 HydrophobicContact CG2-CE2 4.46Å; T171-F190 HydrophobicContact CG2-CG 3.81Å; T171-F190 HydrophobicContact CG2-CZ 4.48Å
172	K	96.6	Very high	94	Very high	168 Å²	168	58.2 Å²	58.2	73%	0.73	28%	0.284	S	S	*	.	H	α-helix	trans	-63.2	-47.7	177.9	-177.1	-179.5	179.5	-178.6	0	111.8	E168 E169 I170 A176	E168-K172 WeakPolarHBondContact O-CB 3.33Å; E168-K172 PolarHBondContact O-N 3.45Å; E169-K172 PolarHBondContact O-N 2.98Å; I170-K172 VanDerWaalsContact C-N 3.31Å; I170-K172 PolarHBondContact O-N 2.84Å; K172-A176 WeakPolarHBondContact O-CB 3.35Å; K172-A176 PolarHBondContact O-N 3.37Å
173	E	94.6	Very high	93.8	Very high	83 Å²	83	57.3 Å²	57.3	39%	0.388	28%	0.281	S	S	.	.	H	α-helix	trans	-66.9	-47.4	-179.2	-75.7	-156.6	-168.3	0	0	112.9	F123 I127 E169 I170 S175 A176 Y177	F123-E173 HydrophobicContact CE1-CB 4.3Å; F123-E173 WeakPolarHBondContact CE1-OE2 3.5Å; F123-E173 HydrophobicContact CZ-CB 3.83Å; I127-E173 HydrophobicContact CD1-CB 4.44Å; E169-E173 PolarHBondContact O-N 3.44Å; I170-E173 PolarHBondContact O-N 3.06Å; E173-S175 VanDerWaalsContact C-N 3.33Å; E173-S175 PolarHBondContact O-N 3.03Å; E173-A176 PolarHBondContact O-N 3.01Å; E173-Y177 WeakPolarHBondContact O-CB 3.19Å; E173-Y177 PolarHBondContact O-N 3.15Å
174	V	94.9	Very high	93.5	Very high	3 Å²	3	60.8 Å²	60.8	2%	0.018	30%	0.298	C	S	.	.	H	α-helix	trans	-64.3	-41.4	177.9	175.7	0	0	0	0	109.9	V116 F123 I127 V150 I170 A176 Y177 I178 F190	V116-V174 HydrophobicContact CG1-CG2 4.42Å; V116-V174 HydrophobicContact CG2-CG2 4.45Å; F123-V174 HydrophobicContact CE2-CG2 3.8Å; F123-V174 HydrophobicContact CZ-CG2 4.25Å; I127-V174 HydrophobicContact CD1-CG2 4.4Å; V150-V174 HydrophobicContact CG1-CG1 4.33Å; V150-V174 HydrophobicContact CG2-CG1 4.29Å; I170-V174 HydrophobicContact CG2-CG2 3.99Å; I170-V174 VanDerWaalsContact O-CB 3.31Å; I170-V174 WeakPolarHBondContact O-CB 3.35Å; I170-V174 VanDerWaalsContact O-CG2 3.25Å; I170-V174 WeakPolarHBondContact O-CG2 3.43Å; I170-V174 PolarHBondContact O-N 3.06Å; V174-A176 PolarHBondContact O-N 3.09Å; V174-Y177 WeakPolarHBondContact O-CB 3.1Å; V174-Y177 PolarHBondContact O-N 2.91Å; V174-Y177 VanDerWaalsContact O-N 3.08Å; V174-I178 HydrophobicContact CG1-CG2 4.07Å; V174-I178 WeakPolarHBondContact O-CG1 3.37Å; V174-I178 WeakPolarHBondContact O-CG2 3.41Å; V174-I178 PolarHBondContact O-N 3.39Å; V174-F190 HydrophobicContact CB-CE1 3.95Å; V174-F190 HydrophobicContact CG1-CE1 3.76Å; V174-F190 HydrophobicContact CG1-CZ 4.16Å
175	S	95.4	Very high	93.4	Very high	25 Å²	25	58 Å²	58	18%	0.175	29%	0.287	C	S	.	.	H	α-helix	trans	-58	-47.4	174.2	-70.2	0	0	0	0	112.2	T171 E173 Y177 I178 K179 P185 F190	T171-S175 WeakPolarHBondContact O-CB 3.34Å; T171-S175 PolarHBondContact O-N 2.97Å; T171-S175 PolarHBondContact O-OG 3.36Å; E173-S175 VanDerWaalsContact C-N 3.33Å; E173-S175 PolarHBondContact O-N 3.03Å; S175-Y177 PolarHBondContact O-N 3.14Å; S175-I178 WeakPolarHBondContact O-CG1 3.47Å; S175-K179 VanDerWaalsContact O-CB 3.24Å; S175-K179 WeakPolarHBondContact O-CB 3.37Å; S175-K179 PolarHBondContact O-N 3.07Å; S175-P185 WeakPolarHBondContact O-CG 3.42Å; S175-F190 VanDerWaalsContact OG-CZ 3.27Å; S175-F190 WeakPolarHBondContact OG-CZ 3.38Å
176	A	93.4	Very high	93.3	Very high	48 Å²	48	52 Å²	52	40%	0.397	27%	0.269	S	S	.	.	H	α-helix	trans	-61.3	-35.9	176.2	0	0	0	0	0	111.4	K172 E173 V174 K180	K172-A176 WeakPolarHBondContact O-CB 3.35Å; K172-A176 PolarHBondContact O-N 3.37Å; E173-A176 PolarHBondContact O-N 3.01Å; V174-A176 PolarHBondContact O-N 3.09Å; A176-K180 VanDerWaalsContact O-CG 3.26Å; A176-K180 WeakPolarHBondContact O-CG 3.31Å; A176-K180 PolarHBondContact O-N 2.94Å
177	Y	88.3	Confident	93.2	Very high	37 Å²	37	52.3 Å²	52.3	15%	0.145	27%	0.274	C	S	.	.	H	α-helix	trans	-73.6	-49.7	-179.6	-174.1	-97.8	0	0	0	113.3	R134 E173 V174 S175 K179 K180 I181	R134-Y177 VanDerWaalsContact CA-CE1 3.44Å; R134-Y177 WeakPolarHBondContact CA-OH 3.5Å; R134-Y177 HydrophobicContact CB-CE1 3.8Å; R134-Y177 HydrophobicContact CB-CE2 4.12Å; R134-Y177 VanDerWaalsContact CB-CZ 3.43Å; R134-Y177 WeakPolarHBondContact CB-OH 3.4Å; R134-Y177 HydrophobicContact CG-CD1 4.18Å; R134-Y177 HydrophobicContact CG-CD2 4.1Å; R134-Y177 HydrophobicContact CG-CE1 3.61Å; R134-Y177 HydrophobicContact CG-CE2 3.54Å; R134-Y177 HydrophobicContact CG-CG 4.41Å; R134-Y177 VanDerWaalsContact NE-CE2 3.3Å; R134-Y177 PolarHBondContact O-OH 3.15Å; E173-Y177 WeakPolarHBondContact O-CB 3.19Å; E173-Y177 PolarHBondContact O-N 3.15Å; V174-Y177 WeakPolarHBondContact O-CB 3.1Å; V174-Y177 PolarHBondContact O-N 2.91Å; V174-Y177 VanDerWaalsContact O-N 3.08Å; S175-Y177 PolarHBondContact O-N 3.14Å; Y177-K179 PolarHBondContact O-N 2.76Å; Y177-K180 WeakPolarHBondContact O-CA 3.34Å; Y177-K180 WeakPolarHBondContact O-CB 3.41Å; Y177-K180 PolarHBondContact O-N 2.85Å; Y177-I181 HydrophobicContact CD1-CD1 3.77Å; Y177-I181 HydrophobicContact CD1-CG1 4.48Å; Y177-I181 HydrophobicContact CE1-CD1 3.17Å; Y177-I181 HydrophobicContact CE1-CG1 3.89Å; Y177-I181 PolarHBondContact O-N 3.42Å; Y177-I181 VanDerWaalsContact O-N 3.14Å
178	I	92.6	Very high	93.1	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-65.2	-31.2	179.1	68.1	-177	0	0	0	111.4	L148 V174 S175 K180 I181 G182 Y183 P185 V188 F190	L148-I178 HydrophobicContact CD2-CB 4.47Å; L148-I178 HydrophobicContact CD2-CD1 4.36Å; L148-I178 HydrophobicContact CD2-CG2 4Å; V174-I178 HydrophobicContact CG1-CG2 4.07Å; V174-I178 WeakPolarHBondContact O-CG1 3.37Å; V174-I178 WeakPolarHBondContact O-CG2 3.41Å; V174-I178 PolarHBondContact O-N 3.39Å; S175-I178 WeakPolarHBondContact O-CG1 3.47Å; I178-K180 VanDerWaalsContact C-N 3.32Å; I178-K180 PolarHBondContact O-N 2.87Å; I178-I181 WeakPolarHBondContact O-CB 3.33Å; I178-I181 PolarHBondContact O-N 2.93Å; I178-I181 VanDerWaalsContact O-N 3.15Å; I178-G182 PolarHBondContact O-N 2.87Å; I178-Y183 HydrophobicContact CB-CD2 4.05Å; I178-Y183 HydrophobicContact CB-CG 4.49Å; I178-Y183 PolarHBondContact O-N 3.35Å; I178-P185 HydrophobicContact CD1-CB 4.37Å; I178-P185 HydrophobicContact CD1-CG 4.47Å; I178-P185 HydrophobicContact CG1-CG 4.15Å; I178-V188 HydrophobicContact CD1-CB 4.25Å; I178-V188 HydrophobicContact CD1-CG1 4.12Å; I178-V188 HydrophobicContact CD1-CG2 4.09Å; I178-F190 HydrophobicContact CD1-CE2 4.34Å; I178-F190 HydrophobicContact CD1-CZ 3.9Å
179	K	92.4	Very high	93.1	Very high	148 Å²	148	46.8 Å²	46.8	64%	0.643	25%	0.248	S	C	*	.	H	α-helix	trans	-61.3	-39.5	170	-169.4	172.8	-177.8	174.8	0	112.4	S175 Y177 I181 G182 Y183 P185	S175-K179 VanDerWaalsContact O-CB 3.24Å; S175-K179 WeakPolarHBondContact O-CB 3.37Å; S175-K179 PolarHBondContact O-N 3.07Å; Y177-K179 PolarHBondContact O-N 2.76Å; K179-I181 VanDerWaalsContact C-N 3.28Å; K179-I181 PolarHBondContact O-N 2.89Å; K179-G182 PolarHBondContact O-N 3.26Å; K179-Y183 WeakPolarHBondContact CA-O 3.44Å; K179-P185 HydrophobicContact CB-CG 3.76Å; K179-P185 HydrophobicContact CD-CG 4.39Å; K179-P185 HydrophobicContact CG-CG 4.34Å
180	K	84.6	Confident	93.2	Very high	109 Å²	109	43.7 Å²	43.7	47%	0.474	23%	0.234	S	C	.	.	H	α-helix	trans	-69.6	-24.6	175.9	-71.2	172.6	179.6	176.5	0	112.9	A176 Y177 I178 R382	A176-K180 VanDerWaalsContact O-CG 3.26Å; A176-K180 WeakPolarHBondContact O-CG 3.31Å; A176-K180 PolarHBondContact O-N 2.94Å; Y177-K180 WeakPolarHBondContact O-CA 3.34Å; Y177-K180 WeakPolarHBondContact O-CB 3.41Å; Y177-K180 PolarHBondContact O-N 2.85Å; I178-K180 VanDerWaalsContact C-N 3.32Å; I178-K180 PolarHBondContact O-N 2.87Å; K180-R382 VanDerWaalsContact CG-NH2 3.28Å; K180-R382 PolarHBondContact O-NE 2.74Å
181	I	84.8	Confident	93.3	Very high	15 Å²	15	43.7 Å²	43.7	8%	0.077	23%	0.234	C	C	.	.	H	α-helix	trans	-75.5	-43.3	173.8	-69.8	167	0	0	0	110.9	A137 L138 Y141 Y177 I178 K179 Y183	A137-I181 HydrophobicContact CB-CD1 3.51Å; L138-I181 HydrophobicContact CB-CD1 4.35Å; L138-I181 HydrophobicContact CB-CG1 4.47Å; L138-I181 HydrophobicContact CD1-CG2 4.27Å; Y141-I181 VanDerWaalsContact CB-CG2 3.47Å; Y141-I181 HydrophobicContact CD1-CG2 3.9Å; Y141-I181 HydrophobicContact CD2-CG2 4.37Å; Y141-I181 HydrophobicContact CG-CG2 3.66Å; Y177-I181 HydrophobicContact CD1-CD1 3.77Å; Y177-I181 HydrophobicContact CD1-CG1 4.48Å; Y177-I181 HydrophobicContact CE1-CD1 3.17Å; Y177-I181 HydrophobicContact CE1-CG1 3.89Å; Y177-I181 PolarHBondContact O-N 3.42Å; Y177-I181 VanDerWaalsContact O-N 3.14Å; I178-I181 WeakPolarHBondContact O-CB 3.33Å; I178-I181 PolarHBondContact O-N 2.93Å; I178-I181 VanDerWaalsContact O-N 3.15Å; K179-I181 VanDerWaalsContact C-N 3.28Å; K179-I181 PolarHBondContact O-N 2.89Å; I181-Y183 HydrophobicContact CB-CD2 4.4Å; I181-Y183 HydrophobicContact CG2-CD2 4.13Å; I181-Y183 HydrophobicContact CG2-CE2 4.1Å
182	G	85.4	Confident	93.3	Very high	36 Å²	36	42.4 Å²	42.4	37%	0.371	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	139	-6.1	-178.8	0	0	0	0	0	114.7	Y141 I178 K179	Y141-G182 PolarHBondContact OH-O 2.85Å; I178-G182 PolarHBondContact O-N 2.87Å; K179-G182 PolarHBondContact O-N 3.26Å
183	Y	92.3	Very high	93.4	Very high	8 Å²	8	34.4 Å²	34.4	3%	0.031	19%	0.191	C	C	.	.			trans	-69.3	149	171.3	-65.3	-79.7	0	0	0	110.8	Y141 V145 L148 I178 K179 I181 P185	Y141-Y183 WeakPolarHBondContact CA-OH 3.44Å; Y141-Y183 HydrophobicContact CD2-CD1 4.02Å; Y141-Y183 HydrophobicContact CD2-CD2 4.02Å; Y141-Y183 AromaticContact CD2-CE1 3.83Å; Y141-Y183 HydrophobicContact CD2-CE1 3.83Å; Y141-Y183 AromaticContact CD2-CE2 3.85Å; Y141-Y183 HydrophobicContact CD2-CE2 3.85Å; Y141-Y183 HydrophobicContact CD2-CG 4.12Å; Y141-Y183 AromaticContact CD2-CZ 3.75Å; Y141-Y183 HydrophobicContact CG-CE2 4.15Å; Y141-Y183 PolarHBondContact N-OH 2.89Å; Y141-Y183 VanDerWaalsContact N-OH 3.14Å; V145-Y183 WeakPolarHBondContact O-CE1 3.37Å; V145-Y183 PolarHBondContact O-OH 2.83Å; L148-Y183 HydrophobicContact CB-CD1 4.04Å; L148-Y183 HydrophobicContact CB-CE1 3.83Å; L148-Y183 HydrophobicContact CD2-CD1 4.37Å; L148-Y183 HydrophobicContact CD2-CD2 4.04Å; L148-Y183 HydrophobicContact CD2-CE1 4.37Å; L148-Y183 HydrophobicContact CD2-CE2 4.02Å; L148-Y183 HydrophobicContact CD2-CG 4.2Å; I178-Y183 HydrophobicContact CB-CD2 4.05Å; I178-Y183 HydrophobicContact CB-CG 4.49Å; I178-Y183 PolarHBondContact O-N 3.35Å; K179-Y183 WeakPolarHBondContact CA-O 3.44Å; I181-Y183 HydrophobicContact CB-CD2 4.4Å; I181-Y183 HydrophobicContact CG2-CD2 4.13Å; I181-Y183 HydrophobicContact CG2-CE2 4.1Å; Y183-P185 WeakPolarHBondContact O-CD 3.49Å
184	N	93	Very high	93.5	Very high	90 Å²	90	30.4 Å²	30.4	48%	0.481	17%	0.172	S	C	.	.			trans	-87.6	113.8	166.1	-178.2	3.4	0	0	0	108.9	A186 T187	N184-A186 PolarHBondContact O-N 2.86Å; N184-A186 VanDerWaalsContact O-N 3.12Å; N184-A186 PolarHBondContact OD1-N 2.99Å; N184-T187 HydrophobicContact CB-CG2 3.84Å; N184-T187 PolarHBondContact O-N 2.9Å; N184-T187 PolarHBondContact O-OG1 3.01Å
185	P	94.8	Very high	93.4	Very high	25 Å²	25	30.3 Å²	30.3	16%	0.162	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-57.9	-28.4	-179.7	-24.9	34.9	0	0	0	113.8	S175 I178 K179 Y183 T187 V188	S175-P185 WeakPolarHBondContact O-CG 3.42Å; I178-P185 HydrophobicContact CD1-CB 4.37Å; I178-P185 HydrophobicContact CD1-CG 4.47Å; I178-P185 HydrophobicContact CG1-CG 4.15Å; K179-P185 HydrophobicContact CB-CG 3.76Å; K179-P185 HydrophobicContact CD-CG 4.39Å; K179-P185 HydrophobicContact CG-CG 4.34Å; Y183-P185 WeakPolarHBondContact O-CD 3.49Å; P185-T187 PolarHBondContact O-N 3.39Å; P185-V188 PolarHBondContact O-N 2.78Å
186	A	94.4	Very high	93.2	Very high	43 Å²	43	33.6 Å²	33.6	36%	0.355	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-66.3	-19.4	177.5	0	0	0	0	0	113.3	N184 I216 E217	N184-A186 PolarHBondContact O-N 2.86Å; N184-A186 VanDerWaalsContact O-N 3.12Å; N184-A186 PolarHBondContact OD1-N 2.99Å; A186-I216 CarbonylContact O-C 3.56Å; A186-I216 VanDerWaalsContact O-CA 3.31Å; A186-I216 WeakPolarHBondContact O-CA 3.5Å; A186-E217 PolarHBondContact O-N 3.07Å
187	T	94.6	Very high	93.1	Very high	29 Å²	29	36.1 Å²	36.1	18%	0.178	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-93.2	-0.4	179.2	68.7	0	0	0	0	112.9	N184 P185 E217 R218	N184-T187 HydrophobicContact CB-CG2 3.84Å; N184-T187 PolarHBondContact O-N 2.9Å; N184-T187 PolarHBondContact O-OG1 3.01Å; P185-T187 PolarHBondContact O-N 3.39Å; T187-E217 VanDerWaalsContact CG2-O 3.26Å; T187-E217 WeakPolarHBondContact CG2-O 3.49Å; T187-R218 HydrophobicContact CG2-CG 3.91Å; T187-R218 PolarHBondContact O-NE 3.47Å; T187-R218 PolarHBondContact O-NH2 2.87Å
188	V	96.5	Very high	93.3	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.018	19%	0.186	C	C	.	.	S	Bend	trans	-111.6	123.2	-169.8	175.4	0	0	0	0	109.6	L148 V150 I178 P185 F190	L148-V188 HydrophobicContact CB-CG1 4.48Å; L148-V188 HydrophobicContact CB-CG2 4.07Å; L148-V188 HydrophobicContact CD2-CG1 4.42Å; L148-V188 HydrophobicContact CD2-CG2 4.47Å; L148-V188 HydrophobicContact CG-CG1 4.34Å; L148-V188 WeakPolarHBondContact O-CG1 3.42Å; V150-V188 HydrophobicContact CB-CG1 4.49Å; V150-V188 HydrophobicContact CG2-CG1 3.72Å; I178-V188 HydrophobicContact CD1-CB 4.25Å; I178-V188 HydrophobicContact CD1-CG1 4.12Å; I178-V188 HydrophobicContact CD1-CG2 4.09Å; P185-V188 PolarHBondContact O-N 2.78Å; V188-F190 HydrophobicContact CB-CE2 4.2Å; V188-F190 HydrophobicContact CG1-CD2 4.26Å; V188-F190 HydrophobicContact CG1-CE2 3.84Å; V188-F190 HydrophobicContact CG1-CZ 4.3Å; V188-F190 WeakPolarHBondContact O-CD2 3.42Å
189	A	97.3	Very high	93.4	Very high	1 Å²	1	36 Å²	36	1%	0.008	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	129.1	174.8	0	0	0	0	0	109.9	V150 V191 W214 I216 A231	V150-A189 PolarHBondContact N-O 3.25Å; A189-V191 HydrophobicContact CB-CG2 4.46Å; A189-W214 HydrophobicContact CB-CB 4.2Å; A189-W214 HydrophobicContact CB-CD2 3.73Å; A189-W214 HydrophobicContact CB-CE3 3.7Å; A189-W214 HydrophobicContact CB-CG 3.95Å; A189-W214 HydrophobicContact CB-CZ3 4.4Å; A189-I216 HydrophobicContact CB-CG2 3.92Å; A189-A231 HydrophobicContact CB-CB 4.08Å
190	F	98.1	Very high	93.6	Very high	18 Å²	18	29.1 Å²	29.1	8%	0.079	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	114.8	171.4	-74.3	-98.4	0	0	0	108.8	V150 F167 T171 V174 S175 I178 V188	V150-F190 HydrophobicContact CB-CD1 3.69Å; V150-F190 HydrophobicContact CB-CE1 3.8Å; V150-F190 HydrophobicContact CB-CG 4.24Å; V150-F190 HydrophobicContact CB-CZ 4.44Å; V150-F190 HydrophobicContact CG1-CD1 3.69Å; V150-F190 HydrophobicContact CG1-CE1 3.77Å; V150-F190 HydrophobicContact CG2-CD1 4.24Å; V150-F190 HydrophobicContact CG2-CE1 3.85Å; V150-F190 HydrophobicContact CG2-CZ 4.11Å; V150-F190 WeakPolarHBondContact O-CA 3.18Å; F167-F190 HydrophobicContact CE2-CB 4.46Å; F167-F190 HydrophobicContact CZ-CB 4.06Å; T171-F190 HydrophobicContact CG2-CB 4.25Å; T171-F190 HydrophobicContact CG2-CD1 3.84Å; T171-F190 HydrophobicContact CG2-CD2 4.14Å; T171-F190 HydrophobicContact CG2-CE1 4.19Å; T171-F190 HydrophobicContact CG2-CE2 4.46Å; T171-F190 HydrophobicContact CG2-CG 3.81Å; T171-F190 HydrophobicContact CG2-CZ 4.48Å; V174-F190 HydrophobicContact CB-CE1 3.95Å; V174-F190 HydrophobicContact CG1-CE1 3.76Å; V174-F190 HydrophobicContact CG1-CZ 4.16Å; S175-F190 VanDerWaalsContact OG-CZ 3.27Å; S175-F190 WeakPolarHBondContact OG-CZ 3.38Å; I178-F190 HydrophobicContact CD1-CE2 4.34Å; I178-F190 HydrophobicContact CD1-CZ 3.9Å; V188-F190 HydrophobicContact CB-CE2 4.2Å; V188-F190 HydrophobicContact CG1-CD2 4.26Å; V188-F190 HydrophobicContact CG1-CE2 3.84Å; V188-F190 HydrophobicContact CG1-CZ 4.3Å; V188-F190 WeakPolarHBondContact O-CD2 3.42Å
191	V	98.3	Very high	94	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	116.7	-174.6	-164.5	0	0	0	0	109.1	V150 G151 V152 A189 I193 N200 W214 L228 A231	V150-V191 PolarHBondContact O-N 3Å; G151-V191 CarbonylContact C-O 3.56Å; G151-V191 WeakPolarHBondContact CA-O 3.27Å; V152-V191 PolarHBondContact N-O 2.95Å; A189-V191 HydrophobicContact CB-CG2 4.46Å; V191-I193 HydrophobicContact CB-CG2 4.18Å; V191-I193 HydrophobicContact CG1-CG2 3.68Å; V191-I193 PolarHBondContact O-N 3.28Å; V191-N200 HydrophobicContact CG1-CB 4.46Å; V191-W214 HydrophobicContact CG2-CG 4.24Å; V191-L228 HydrophobicContact CG1-CB 4.42Å; V191-A231 HydrophobicContact CG2-CB 4.04Å
192	P	98.1	Very high	94.4	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	121.7	171.4	28.4	-27	0	0	0	108.9	M155 F167 N200 M208 W210 F211	M155-P192 HydrophobicContact CE-CB 4.4Å; M155-P192 HydrophobicContact CG-CB 3.85Å; M155-P192 HydrophobicContact SD-CB 4.19Å; F167-P192 HydrophobicContact CD2-CB 3.62Å; F167-P192 HydrophobicContact CD2-CG 4.22Å; F167-P192 HydrophobicContact CE2-CB 3.69Å; F167-P192 HydrophobicContact CE2-CG 3.94Å; F167-P192 HydrophobicContact CG-CB 4.23Å; F167-P192 HydrophobicContact CZ-CB 4.35Å; F167-P192 HydrophobicContact CZ-CG 4.1Å; P192-N200 WeakPolarHBondContact O-CB 3.29Å; P192-N200 PolarHBondContact O-ND2 3.45Å; P192-M208 HydrophobicContact CB-SD 3.76Å; P192-M208 HydrophobicContact CG-SD 4.09Å; P192-W210 HydrophobicContact CB-CH2 4.21Å; P192-W210 HydrophobicContact CG-CH2 4.13Å; P192-F211 VanDerWaalsContact CD-CE2 3.43Å; P192-F211 HydrophobicContact CG-CB 4.19Å; P192-F211 HydrophobicContact CG-CD1 3.8Å; P192-F211 HydrophobicContact CG-CD2 3.6Å; P192-F211 HydrophobicContact CG-CE1 4.02Å; P192-F211 HydrophobicContact CG-CE2 3.84Å; P192-F211 HydrophobicContact CG-CG 3.58Å; P192-F211 HydrophobicContact CG-CZ 4.04Å
193	I	97.9	Very high	94.7	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.162	C	C	.	.			trans	-134	160.9	-174.4	64.8	178	0	0	0	112.1	T23 I115 V152 N153 K154 M155 V191 D199 N200 M201 L228	T23-I193 HydrophobicContact CG2-CD1 3.75Å; I115-I193 HydrophobicContact CD1-CD1 4.28Å; V152-I193 PolarHBondContact O-N 2.87Å; N153-I193 CarbonylContact C-O 3.58Å; N153-I193 WeakPolarHBondContact CA-O 3.49Å; N153-I193 HydrophobicContact CB-CD1 4.26Å; N153-I193 HydrophobicContact CB-CG1 3.98Å; K154-I193 PolarHBondContact N-O 3.45Å; M155-I193 WeakPolarHBondContact CG-O 3.04Å; M155-I193 PolarHBondContact N-O 2.99Å; V191-I193 HydrophobicContact CB-CG2 4.18Å; V191-I193 HydrophobicContact CG1-CG2 3.68Å; V191-I193 PolarHBondContact O-N 3.28Å; I193-D199 WeakPolarHBondContact CA-O 3.48Å; I193-N200 HydrophobicContact CG2-CB 4.17Å; I193-M201 HydrophobicContact CB-SD 4.14Å; I193-M201 HydrophobicContact CD1-SD 3.94Å; I193-M201 HydrophobicContact CG2-SD 4.28Å; I193-L228 HydrophobicContact CD1-CD2 4.12Å; I193-L228 HydrophobicContact CG2-CB 4.28Å
194	S	96.8	Very high	94.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.185	C	C	.	.			trans	-123.5	104.4	157.7	-179.8	0	0	0	0	108.8	D156 W196 H197 G198 D199	D156-S194 WeakPolarHBondContact OD1-CB 3.49Å; D156-S194 PolarHBondContact OD1-OG 2.98Å; S194-W196 PolarHBondContact O-N 3.16Å; S194-H197 PolarHBondContact O-N 3.32Å; S194-H197 PolarHBondContact OG-CD2 3.39Å; S194-H197 PolarHBondContact OG-N 2.84Å; S194-G198 WeakPolarHBondContact O-CA 3.47Å; S194-G198 PolarHBondContact O-N 2.88Å; S194-D199 WeakPolarHBondContact CB-OD2 3.41Å; S194-D199 PolarHBondContact N-O 2.97Å; S194-D199 VanDerWaalsContact N-O 3.14Å; S194-D199 PolarHBondContact O-N 2.81Å
195	G	92.8	Very high	94.9	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-23.2	177.5	0	0	0	0	0	113	H26 N153	H26-G195 WeakPolarHBondContact CB-O 3.37Å; H26-G195 PolarHBondContact ND1-O 2.66Å; N153-G195 PolarHBondContact OD1-N 3.24Å
196	W	90.5	Very high	94.8	Very high	94 Å²	94	36.3 Å²	36.3	36%	0.356	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-50.5	176.7	-175.2	-112	0	0	0	112	T22 S53 K55 Y56 S194	T22-W196 HydrophobicContact CG2-CE3 3.87Å; S53-W196 WeakPolarHBondContact O-CH2 3.4Å; S53-W196 WeakPolarHBondContact O-CZ3 3.03Å; K55-W196 HydrophobicContact CD-CH2 4.38Å; K55-W196 HydrophobicContact CG-CH2 4.05Å; K55-W196 HydrophobicContact CG-CZ3 4.08Å; Y56-W196 HydrophobicContact CD2-CE3 4.06Å; Y56-W196 HydrophobicContact CD2-CZ3 4.08Å; Y56-W196 HydrophobicContact CE2-CE3 4.43Å; Y56-W196 HydrophobicContact CE2-CZ3 4.49Å; S194-W196 PolarHBondContact O-N 3.16Å
197	H	91.9	Very high	94.8	Very high	102 Å²	102	39.3 Å²	39.3	47%	0.472	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-15.2	-176.1	-66.8	-64.8	0	0	0	114.1	S194 D199	S194-H197 PolarHBondContact O-N 3.32Å; S194-H197 PolarHBondContact OG-CD2 3.39Å; S194-H197 PolarHBondContact OG-N 2.84Å; H197-D199 VanDerWaalsContact CB-OD2 3.25Å; H197-D199 WeakPolarHBondContact CB-OD2 3.26Å
198	G	92.2	Very high	94.8	Very high	19 Å²	19	38.1 Å²	38.1	20%	0.196	20%	0.197	C	C	.	.			trans	86.4	4.9	-178.4	0	0	0	0	0	114.5	H26 S194 N200 M201	H26-G198 WeakPolarHBondContact CE1-CA 3.42Å; H26-G198 PolarHBondContact CE1-N 3.4Å; S194-G198 WeakPolarHBondContact O-CA 3.47Å; S194-G198 PolarHBondContact O-N 2.88Å; G198-N200 PolarHBondContact O-N 2.95Å; G198-M201 WeakPolarHBondContact O-CB 3.35Å; G198-M201 PolarHBondContact O-N 2.86Å; G198-M201 VanDerWaalsContact O-N 3.17Å
199	D	95.9	Very high	94.6	Very high	17 Å²	17	42.2 Å²	42.2	9%	0.091	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	126.7	-178.9	-65.8	-70.9	0	0	0	111.2	Y162 I193 S194 H197 M201 S205 K207 M208	Y162-D199 HydrophobicContact CE1-CB 4.24Å; Y162-D199 WeakPolarHBondContact CE1-OD2 2.9Å; Y162-D199 PolarHBondContact OH-OD2 3.44Å; I193-D199 WeakPolarHBondContact CA-O 3.48Å; S194-D199 WeakPolarHBondContact CB-OD2 3.41Å; S194-D199 PolarHBondContact N-O 2.97Å; S194-D199 VanDerWaalsContact N-O 3.14Å; S194-D199 PolarHBondContact O-N 2.81Å; H197-D199 VanDerWaalsContact CB-OD2 3.25Å; H197-D199 WeakPolarHBondContact CB-OD2 3.26Å; D199-M201 PolarHBondContact O-N 2.82Å; D199-M201 VanDerWaalsContact O-N 3.12Å; D199-S205 WeakPolarHBondContact OD1-CB 3.31Å; D199-S205 PolarHBondContact OD1-OG 2.92Å; D199-K207 IonicContact OD1-NZ 3.63Å; D199-K207 IonicContact OD2-NZ 3.32Å; D199-M208 HydrophobicContact CB-CE 3.71Å
200	N	95.8	Very high	94.6	Very high	3 Å²	3	44.7 Å²	44.7	2%	0.016	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	17.9	-177.8	-70.9	-17.1	0	0	0	115.1	V191 P192 I193 G198 E203 A204 S205 M208 T227 L228	V191-N200 HydrophobicContact CG1-CB 4.46Å; P192-N200 WeakPolarHBondContact O-CB 3.29Å; P192-N200 PolarHBondContact O-ND2 3.45Å; I193-N200 HydrophobicContact CG2-CB 4.17Å; G198-N200 PolarHBondContact O-N 2.95Å; N200-E203 WeakPolarHBondContact CA-O 3.45Å; N200-E203 PolarHBondContact N-O 2.75Å; N200-A204 WeakPolarHBondContact OD1-CA 3.48Å; N200-S205 PolarHBondContact OD1-N 3.29Å; N200-M208 HydrophobicContact CB-CE 4.3Å; N200-M208 WeakPolarHBondContact ND2-CE 3.02Å; N200-T227 CarbonylContact O-C 3.55Å; N200-T227 VanDerWaalsContact O-CA 3.28Å; N200-T227 WeakPolarHBondContact O-CA 3.44Å; N200-T227 WeakPolarHBondContact O-CB 3.45Å; N200-L228 PolarHBondContact O-N 2.73Å
201	M	93.6	Very high	94.5	Very high	1 Å²	1	45 Å²	45	1%	0.005	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-59.9	177.8	-71.6	-67.1	-67.4	0	0	111.5	T23 L27 I193 G198 D199 L228 L229	T23-M201 HydrophobicContact CG2-CE 3.51Å; T23-M201 HydrophobicContact CG2-SD 3.79Å; T23-M201 VanDerWaalsContact O-CE 3.3Å; T23-M201 WeakPolarHBondContact O-CE 3.37Å; L27-M201 HydrophobicContact CB-CE 4.02Å; L27-M201 HydrophobicContact CD1-CE 4.1Å; I193-M201 HydrophobicContact CB-SD 4.14Å; I193-M201 HydrophobicContact CD1-SD 3.94Å; I193-M201 HydrophobicContact CG2-SD 4.28Å; G198-M201 WeakPolarHBondContact O-CB 3.35Å; G198-M201 PolarHBondContact O-N 2.86Å; G198-M201 VanDerWaalsContact O-N 3.17Å; D199-M201 PolarHBondContact O-N 2.82Å; D199-M201 VanDerWaalsContact O-N 3.12Å; M201-L228 HydrophobicContact CE-CD2 3.92Å; M201-L228 PolarHBondContact O-N 3.25Å; M201-L228 HydrophobicContact SD-CD2 3.75Å; M201-L229 WeakPolarHBondContact O-CB 3.11Å; M201-L229 PolarHBondContact O-N 3.15Å
202	L	92	Very high	94.3	Very high	47 Å²	47	53.5 Å²	53.5	25%	0.246	27%	0.273	C	S	.	.	S	Bend	trans	-116.3	-32.6	176.6	-76.4	80.3	0	0	0	112.2	L27 K30 T227 L229	L27-L202 HydrophobicContact CD1-CD1 4.03Å; K30-L202 HydrophobicContact CB-CD1 3.48Å; K30-L202 VanDerWaalsContact CB-CD1 3.48Å; K30-L202 HydrophobicContact CB-CD2 3.59Å; K30-L202 HydrophobicContact CB-CG 4.18Å; K30-L202 HydrophobicContact CG-CD1 4.09Å; L202-T227 WeakPolarHBondContact O-CG2 3.42Å; L202-L229 HydrophobicContact CB-CD2 4.49Å; L202-L229 HydrophobicContact CD2-CD2 4.28Å; L202-L229 HydrophobicContact CG-CB 4.48Å; L202-L229 HydrophobicContact CG-CD2 4.05Å
203	E	92.9	Very high	94.1	Very high	151 Å²	151	54.7 Å²	54.7	71%	0.706	29%	0.285	S	S	*	.	S	Bend	trans	-122.2	151.4	-178.8	-67.1	169.7	-163.6	0	0	109	N200	N200-E203 WeakPolarHBondContact CA-O 3.45Å; N200-E203 PolarHBondContact N-O 2.75Å
204	A	93.9	Very high	94	Very high	63 Å²	63	55.3 Å²	55.3	52%	0.521	29%	0.288	S	S	.	.			trans	-64.8	140.3	176.3	0	0	0	0	0	110.6	N200 V226	N200-A204 WeakPolarHBondContact OD1-CA 3.48Å; A204-V226 HydrophobicContact CB-CG1 3.86Å
205	S	94	Very high	94	Very high	13 Å²	13	61.7 Å²	61.7	9%	0.091	32%	0.316	C	S	.	.			trans	-88.8	128.8	177.8	177.7	0	0	0	0	111.6	D199 N200 K207 M208	D199-S205 WeakPolarHBondContact OD1-CB 3.31Å; D199-S205 PolarHBondContact OD1-OG 2.92Å; N200-S205 PolarHBondContact OD1-N 3.29Å; S205-K207 PolarHBondContact O-N 3.05Å; S205-K207 PolarHBondContact OG-N 3.48Å; S205-M208 PolarHBondContact O-N 3.15Å
206	D	93.6	Very high	94.1	Very high	158 Å²	158	61.8 Å²	61.8	85%	0.845	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-64.7	-20.8	173	-61.3	-34.3	0	0	0	112.9	M208	D206-M208 VanDerWaalsContact C-N 3.29Å; D206-M208 PolarHBondContact O-N 2.68Å
207	K	94.3	Very high	94.1	Very high	107 Å²	107	62.4 Å²	62.4	47%	0.465	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-78.6	-14.5	-178.8	-56.6	175.5	-171.8	158.9	0	113	Y162 D199 S205	Y162-K207 HydrophobicContact CD1-CB 4.11Å; Y162-K207 HydrophobicContact CD2-CB 4.04Å; Y162-K207 HydrophobicContact CD2-CD 4.09Å; Y162-K207 HydrophobicContact CE1-CB 4.2Å; Y162-K207 HydrophobicContact CE1-CD 3.99Å; Y162-K207 HydrophobicContact CE2-CB 4.17Å; Y162-K207 HydrophobicContact CE2-CD 3.39Å; Y162-K207 HydrophobicContact CE2-CG 4.39Å; Y162-K207 HydrophobicContact CG-CB 4Å; Y162-K207 VanDerWaalsContact OH-CD 3.28Å; Y162-K207 WeakPolarHBondContact OH-CD 3.46Å; Y162-K207 PolarHBondContact OH-NZ 3.41Å; D199-K207 IonicContact OD1-NZ 3.63Å; D199-K207 IonicContact OD2-NZ 3.32Å; S205-K207 PolarHBondContact O-N 3.05Å; S205-K207 PolarHBondContact OG-N 3.48Å
208	M	94.6	Very high	93.9	Very high	3 Å²	3	59.3 Å²	59.3	2%	0.015	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-120.6	47.3	-179.3	-69.3	179.4	-78	0	0	111.1	M155 Y162 P192 D199 N200 S205 D206 W210 F211	M155-M208 HydrophobicContact CB-SD 4.14Å; M155-M208 HydrophobicContact CG-SD 4.22Å; Y162-M208 HydrophobicContact CD1-CE 3.97Å; Y162-M208 HydrophobicContact CD1-CG 3.66Å; Y162-M208 HydrophobicContact CD1-SD 3.82Å; Y162-M208 HydrophobicContact CE1-CE 4.17Å; Y162-M208 HydrophobicContact CG-CG 4.19Å; P192-M208 HydrophobicContact CB-SD 3.76Å; P192-M208 HydrophobicContact CG-SD 4.09Å; D199-M208 HydrophobicContact CB-CE 3.71Å; N200-M208 HydrophobicContact CB-CE 4.3Å; N200-M208 WeakPolarHBondContact ND2-CE 3.02Å; S205-M208 PolarHBondContact O-N 3.15Å; D206-M208 VanDerWaalsContact C-N 3.29Å; D206-M208 PolarHBondContact O-N 2.68Å; M208-W210 HydrophobicContact CB-CZ2 4.28Å; M208-W210 HydrophobicContact CG-CZ2 3.92Å; M208-W210 PolarHBondContact O-N 3.04Å; M208-W210 HydrophobicContact SD-CZ2 4.18Å; M208-F211 HydrophobicContact CB-CB 4.29Å; M208-F211 WeakPolarHBondContact O-CB 3.37Å; M208-F211 PolarHBondContact O-N 2.9Å
209	S	93.2	Very high	93.5	Very high	90 Å²	90	68.3 Å²	68.3	63%	0.629	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-19.5	179	63.1	0	0	0	0	114.3	F211 K212	S209-F211 VanDerWaalsContact C-N 3.33Å; S209-K212 PolarHBondContact O-NZ 2.82Å
210	W	95.9	Very high	92.8	Very high	53 Å²	53	74.1 Å²	74.1	20%	0.201	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-26.2	171.8	56.2	-102.5	0	0	0	113	M155 Y162 Q164 F167 P192 M208 K212	M155-W210 HydrophobicContact CE-CH2 4.21Å; M155-W210 HydrophobicContact CE-CZ2 3.94Å; Y162-W210 PolarHBondContact O-NE1 3.09Å; Q164-W210 HydrophobicContact CB-CD2 3.53Å; Q164-W210 HydrophobicContact CB-CE3 3.73Å; Q164-W210 HydrophobicContact CB-CG 3.9Å; Q164-W210 HydrophobicContact CB-CH2 4.41Å; Q164-W210 HydrophobicContact CB-CZ2 4.21Å; Q164-W210 HydrophobicContact CB-CZ3 4.17Å; Q164-W210 HydrophobicContact CG-CD2 3.84Å; Q164-W210 HydrophobicContact CG-CE3 3.52Å; Q164-W210 HydrophobicContact CG-CG 4.32Å; Q164-W210 HydrophobicContact CG-CZ3 3.97Å; F167-W210 HydrophobicContact CB-CH2 3.67Å; F167-W210 HydrophobicContact CB-CZ3 4.29Å; F167-W210 AromaticContact CD1-CH2 3.77Å; F167-W210 HydrophobicContact CD1-CH2 3.77Å; F167-W210 AromaticContact CD1-CZ3 3.63Å; F167-W210 HydrophobicContact CD1-CZ3 3.63Å; F167-W210 HydrophobicContact CE1-CZ3 4.26Å; F167-W210 AromaticContact CG-CH2 3.77Å; F167-W210 HydrophobicContact CG-CH2 3.77Å; F167-W210 HydrophobicContact CG-CZ3 4.13Å; P192-W210 HydrophobicContact CB-CH2 4.21Å; P192-W210 HydrophobicContact CG-CH2 4.13Å; M208-W210 HydrophobicContact CB-CZ2 4.28Å; M208-W210 HydrophobicContact CG-CZ2 3.92Å; M208-W210 PolarHBondContact O-N 3.04Å; M208-W210 HydrophobicContact SD-CZ2 4.18Å; W210-K212 PolarHBondContact O-N 3.43Å
211	F	96.4	Very high	92.1	Very high	23 Å²	23	76 Å²	76	10%	0.101	39%	0.388	C	S	.	.			trans	-80.3	105.1	180	-175.3	-112.7	0	0	0	110.2	F167 P192 M208 S209 G213 W214 V226	F167-F211 HydrophobicContact CE1-CD2 4.14Å; F167-F211 HydrophobicContact CE1-CE2 4.02Å; F167-F211 HydrophobicContact CZ-CD2 4.43Å; F167-F211 AromaticContact CZ-CE2 3.98Å; F167-F211 HydrophobicContact CZ-CE2 3.98Å; P192-F211 VanDerWaalsContact CD-CE2 3.43Å; P192-F211 HydrophobicContact CG-CB 4.19Å; P192-F211 HydrophobicContact CG-CD1 3.8Å; P192-F211 HydrophobicContact CG-CD2 3.6Å; P192-F211 HydrophobicContact CG-CE1 4.02Å; P192-F211 HydrophobicContact CG-CE2 3.84Å; P192-F211 HydrophobicContact CG-CG 3.58Å; P192-F211 HydrophobicContact CG-CZ 4.04Å; M208-F211 HydrophobicContact CB-CB 4.29Å; M208-F211 WeakPolarHBondContact O-CB 3.37Å; M208-F211 PolarHBondContact O-N 2.9Å; S209-F211 VanDerWaalsContact C-N 3.33Å; F211-G213 PolarHBondContact O-N 2.83Å; F211-W214 HydrophobicContact CZ-CB 4.18Å; F211-V226 HydrophobicContact CD1-CG1 4.08Å; F211-V226 HydrophobicContact CE1-CG1 4.19Å; F211-V226 WeakPolarHBondContact CE1-O 3.11Å
212	K	93.6	Very high	91.8	Very high	179 Å²	179	78.8 Å²	78.8	78%	0.778	42%	0.417	S	S	*	.			trans	-83	1.2	-179.6	-56.7	-51	-176.7	-166.5	0	114.1	S209 W210	S209-K212 PolarHBondContact O-NZ 2.82Å; W210-K212 PolarHBondContact O-N 3.43Å
213	G	94.2	Very high	91.8	Very high	25 Å²	25	78.1 Å²	78.1	26%	0.258	42%	0.418	S	S	.	.			trans	112.1	162.4	-176.7	0	0	0	0	0	113.3	F211 G225	F211-G213 PolarHBondContact O-N 2.83Å; G213-G225 CarbonylContact C-O 3.6Å; G213-G225 VanDerWaalsContact C-O 3.3Å; G213-G225 WeakPolarHBondContact CA-O 3.41Å
214	W	96.6	Very high	92	Very high	13 Å²	13	76 Å²	76	5%	0.049	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	153.2	170.4	53.3	-95.6	0	0	0	109.9	A189 V191 F211 I216 A223 T224 G225 T227 E230 A231	A189-W214 HydrophobicContact CB-CB 4.2Å; A189-W214 HydrophobicContact CB-CD2 3.73Å; A189-W214 HydrophobicContact CB-CE3 3.7Å; A189-W214 HydrophobicContact CB-CG 3.95Å; A189-W214 HydrophobicContact CB-CZ3 4.4Å; V191-W214 HydrophobicContact CG2-CG 4.24Å; F211-W214 HydrophobicContact CZ-CB 4.18Å; W214-I216 HydrophobicContact CE3-CG2 4.19Å; W214-I216 HydrophobicContact CZ3-CD1 4.25Å; W214-I216 HydrophobicContact CZ3-CG1 4.16Å; W214-I216 HydrophobicContact CZ3-CG2 4.44Å; W214-A223 HydrophobicContact CH2-CB 4.36Å; W214-A223 HydrophobicContact CZ3-CB 4.09Å; W214-T224 VanDerWaalsContact O-CA 3.29Å; W214-T224 WeakPolarHBondContact O-CA 3.39Å; W214-G225 VanDerWaalsContact CZ2-CA 3.45Å; W214-G225 PolarHBondContact N-O 3.3Å; W214-G225 VanDerWaalsContact NE1-C 3.3Å; W214-G225 PolarHBondContact NE1-O 2.93Å; W214-G225 PolarHBondContact O-N 3.49Å; W214-G225 VanDerWaalsContact O-N 3.15Å; W214-T227 PolarHBondContact NE1-O 3.07Å; W214-E230 VanDerWaalsContact CZ2-C 3.43Å; W214-E230 HydrophobicContact CZ2-CB 3.85Å; W214-A231 HydrophobicContact CD2-CB 4.49Å; W214-A231 HydrophobicContact CH2-CB 4.5Å; W214-A231 HydrophobicContact CZ2-CB 3.83Å; W214-A231 VanDerWaalsContact CZ2-N 3.25Å
215	K	95.4	Very high	92	Very high	135 Å²	135	73.5 Å²	73.5	59%	0.587	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134	136.8	174.9	-177.7	-177.6	-174	-150.4	0	108.9	E217 A223 T224	K215-E217 WeakPolarHBondContact CE-OE1 3.46Å; K215-E217 IonicContact NZ-OE1 3.82Å; K215-E217 PolarHBondContact NZ-OE1 3.3Å; K215-A223 WeakPolarHBondContact CA-O 3.35Å; K215-T224 HydrophobicContact CB-CG2 3.99Å; K215-T224 HydrophobicContact CD-CG2 4.45Å; K215-T224 HydrophobicContact CG-CG2 3.78Å
216	I	94.6	Very high	92.1	Very high	2 Å²	2	74.8 Å²	74.8	1%	0.01	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	145.7	172.8	63.4	178	0	0	0	110.8	A186 A189 W214 R218 G222 A223	A186-I216 CarbonylContact O-C 3.56Å; A186-I216 VanDerWaalsContact O-CA 3.31Å; A186-I216 WeakPolarHBondContact O-CA 3.5Å; A189-I216 HydrophobicContact CB-CG2 3.92Å; W214-I216 HydrophobicContact CE3-CG2 4.19Å; W214-I216 HydrophobicContact CZ3-CD1 4.25Å; W214-I216 HydrophobicContact CZ3-CG1 4.16Å; W214-I216 HydrophobicContact CZ3-CG2 4.44Å; I216-R218 VanDerWaalsContact CD1-CZ 3.45Å; I216-G222 CarbonylContact O-C 3.51Å; I216-G222 WeakPolarHBondContact O-CA 3.28Å; I216-A223 HydrophobicContact CD1-CB 3.88Å; I216-A223 HydrophobicContact CG1-CB 3.77Å; I216-A223 WeakPolarHBondContact CG1-O 3.49Å; I216-A223 PolarHBondContact N-O 2.97Å; I216-A223 PolarHBondContact O-N 2.91Å; I216-A223 VanDerWaalsContact O-N 3.08Å
217	E	91.6	Very high	92.3	Very high	107 Å²	107	67.6 Å²	67.6	50%	0.5	37%	0.365	S	S	.	.			trans	-125.7	118	178.9	-64.9	-177.8	176.6	0	0	109.1	A186 T187 K215	A186-E217 PolarHBondContact O-N 3.07Å; T187-E217 VanDerWaalsContact CG2-O 3.26Å; T187-E217 WeakPolarHBondContact CG2-O 3.49Å; K215-E217 WeakPolarHBondContact CE-OE1 3.46Å; K215-E217 IonicContact NZ-OE1 3.82Å; K215-E217 PolarHBondContact NZ-OE1 3.3Å
218	R	88	Confident	92.4	Very high	37 Å²	37	62.7 Å²	62.7	14%	0.14	34%	0.344	C	S	.	.			trans	-132.8	162.6	-179.1	-58.5	177.6	178.3	159.1	3.3	109.7	T187 I216 E220 G221 S234	T187-R218 HydrophobicContact CG2-CG 3.91Å; T187-R218 PolarHBondContact O-NE 3.47Å; T187-R218 PolarHBondContact O-NH2 2.87Å; I216-R218 VanDerWaalsContact CD1-CZ 3.45Å; R218-E220 PolarHBondContact O-N 2.8Å; R218-G221 PolarHBondContact O-N 3.08Å; R218-S234 PolarHBondContact NH1-O 3.31Å
219	K	83.1	Confident	92.3	Very high	208 Å²	208	64.1 Å²	64.1	90%	0.904	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-31	178.7	-70.8	-176.4	176.6	-174.9	0	111.9	G221	K219-G221 VanDerWaalsContact C-N 3.32Å
220	E	80.8	Confident	92.4	Very high	138 Å²	138	64 Å²	64	65%	0.645	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-3.6	-176.3	-55.7	82.2	176.3	0	0	112.9	R218 M236	R218-E220 PolarHBondContact O-N 2.8Å; E220-M236 HydrophobicContact CB-SD 3.77Å; E220-M236 HydrophobicContact CG-SD 3.94Å
221	G	81.3	Confident	92.4	Very high	43 Å²	43	61.5 Å²	61.5	44%	0.443	33%	0.331	S	S	.	.			trans	128.8	143.4	-178.4	0	0	0	0	0	112.8	R218 K219	R218-G221 PolarHBondContact O-N 3.08Å; K219-G221 VanDerWaalsContact C-N 3.32Å
222	G	87.2	Confident	92.2	Very high	60 Å²	60	60.5 Å²	60.5	62%	0.619	33%	0.327	S	S	*	.			trans	-81	163	173.2	0	0	0	0	0	112.5	I216	I216-G222 CarbonylContact O-C 3.51Å; I216-G222 WeakPolarHBondContact O-CA 3.28Å
223	A	93.3	Very high	92.2	Very high	33 Å²	33	53.2 Å²	53.2	27%	0.273	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	154.9	170.4	0	0	0	0	0	110.4	W214 K215 I216	W214-A223 HydrophobicContact CH2-CB 4.36Å; W214-A223 HydrophobicContact CZ3-CB 4.09Å; K215-A223 WeakPolarHBondContact CA-O 3.35Å; I216-A223 HydrophobicContact CD1-CB 3.88Å; I216-A223 HydrophobicContact CG1-CB 3.77Å; I216-A223 WeakPolarHBondContact CG1-O 3.49Å; I216-A223 PolarHBondContact N-O 2.97Å; I216-A223 PolarHBondContact O-N 2.91Å; I216-A223 VanDerWaalsContact O-N 3.08Å
224	T	95.4	Very high	92.1	Very high	106 Å²	106	52.8 Å²	52.8	65%	0.65	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.8	150.6	175	52.2	0	0	0	0	109.1	W214 K215	W214-T224 VanDerWaalsContact O-CA 3.29Å; W214-T224 WeakPolarHBondContact O-CA 3.39Å; K215-T224 HydrophobicContact CB-CG2 3.99Å; K215-T224 HydrophobicContact CD-CG2 4.45Å; K215-T224 HydrophobicContact CG-CG2 3.78Å
225	G	94.9	Very high	91.9	Very high	11 Å²	11	52.3 Å²	52.3	11%	0.113	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.5	-179	173.2	0	0	0	0	0	110.2	G213 W214	G213-G225 CarbonylContact C-O 3.6Å; G213-G225 VanDerWaalsContact C-O 3.3Å; G213-G225 WeakPolarHBondContact CA-O 3.41Å; W214-G225 VanDerWaalsContact CZ2-CA 3.45Å; W214-G225 PolarHBondContact N-O 3.3Å; W214-G225 VanDerWaalsContact NE1-C 3.3Å; W214-G225 PolarHBondContact NE1-O 2.93Å; W214-G225 PolarHBondContact O-N 3.49Å; W214-G225 VanDerWaalsContact O-N 3.15Å
226	V	96.6	Very high	91.5	Very high	40 Å²	40	48.6 Å²	48.6	24%	0.242	27%	0.273	C	S	.	.	S	Bend	trans	-115.7	-38.4	-178.9	-176.9	0	0	0	0	110.6	A204 F211 E230	A204-V226 HydrophobicContact CB-CG1 3.86Å; F211-V226 HydrophobicContact CD1-CG1 4.08Å; F211-V226 HydrophobicContact CE1-CG1 4.19Å; F211-V226 WeakPolarHBondContact CE1-O 3.11Å; V226-E230 PolarHBondContact N-OE2 3.49Å
227	T	96.9	Very high	90.9	Very high	6 Å²	6	52 Å²	52	4%	0.037	30%	0.296	C	S	.	.	S	Bend	trans	-98.4	164.8	-169.7	74.1	0	0	0	0	112.6	N200 L202 W214 L229 E230 A231	N200-T227 CarbonylContact O-C 3.55Å; N200-T227 VanDerWaalsContact O-CA 3.28Å; N200-T227 WeakPolarHBondContact O-CA 3.44Å; N200-T227 WeakPolarHBondContact O-CB 3.45Å; L202-T227 WeakPolarHBondContact O-CG2 3.42Å; W214-T227 PolarHBondContact NE1-O 3.07Å; T227-L229 VanDerWaalsContact C-N 3.33Å; T227-E230 PolarHBondContact N-OE2 3.25Å; T227-E230 PolarHBondContact O-N 3.24Å; T227-E230 WeakPolarHBondContact OG1-CG 3.39Å; T227-E230 PolarHBondContact OG1-N 2.98Å; T227-E230 PolarHBondContact OG1-OE2 3.47Å; T227-A231 PolarHBondContact O-N 3.19Å; T227-A231 VanDerWaalsContact O-N 3.15Å
228	L	95.8	Very high	90.2	Very high	4 Å²	4	48.6 Å²	48.6	2%	0.021	28%	0.283	C	S	.	.	H	α-helix	trans	-65.1	-40.1	173	-178.5	60.9	0	0	0	110.6	T23 I149 V191 I193 N200 M201 E230 A231 L232	T23-L228 HydrophobicContact CG2-CD2 4.07Å; I149-L228 HydrophobicContact CG2-CD1 3.89Å; V191-L228 HydrophobicContact CG1-CB 4.42Å; I193-L228 HydrophobicContact CD1-CD2 4.12Å; I193-L228 HydrophobicContact CG2-CB 4.28Å; N200-L228 PolarHBondContact O-N 2.73Å; M201-L228 HydrophobicContact CE-CD2 3.92Å; M201-L228 PolarHBondContact O-N 3.25Å; M201-L228 HydrophobicContact SD-CD2 3.75Å; L228-E230 VanDerWaalsContact C-N 3.34Å; L228-E230 PolarHBondContact O-N 3.2Å; L228-A231 WeakPolarHBondContact O-CA 3.4Å; L228-A231 WeakPolarHBondContact O-CB 3.43Å; L228-A231 PolarHBondContact O-N 2.91Å; L228-A231 VanDerWaalsContact O-N 3.09Å; L228-L232 WeakPolarHBondContact O-CG 3.33Å; L228-L232 PolarHBondContact O-N 2.59Å
229	L	94.3	Very high	89.6	Confident	33 Å²	33	52.5 Å²	52.5	17%	0.173	32%	0.316	C	S	.	.	H	α-helix	trans	-59.4	-44.1	177	-173.7	67.7	0	0	0	111.8	F80 T82 M201 L202 T227 A231 L232 D233	F80-L229 HydrophobicContact CE2-CD1 4.48Å; T82-L229 HydrophobicContact CG2-CD1 3.74Å; M201-L229 WeakPolarHBondContact O-CB 3.11Å; M201-L229 PolarHBondContact O-N 3.15Å; L202-L229 HydrophobicContact CB-CD2 4.49Å; L202-L229 HydrophobicContact CD2-CD2 4.28Å; L202-L229 HydrophobicContact CG-CB 4.48Å; L202-L229 HydrophobicContact CG-CD2 4.05Å; T227-L229 VanDerWaalsContact C-N 3.33Å; L229-A231 VanDerWaalsContact C-N 3.27Å; L229-A231 PolarHBondContact O-N 3.2Å; L229-L232 WeakPolarHBondContact O-CB 3.36Å; L229-L232 PolarHBondContact O-N 2.75Å; L229-L232 VanDerWaalsContact O-N 3.14Å; L229-D233 PolarHBondContact O-N 3.08Å
230	E	95.1	Very high	89.3	Confident	88 Å²	88	45.9 Å²	45.9	41%	0.411	29%	0.285	S	S	.	.	H	α-helix	trans	-63.6	-35.5	175.2	-69.8	170.9	143.1	0	0	111.7	W214 V226 T227 L228 L232 D233 S234	W214-E230 VanDerWaalsContact CZ2-C 3.43Å; W214-E230 HydrophobicContact CZ2-CB 3.85Å; V226-E230 PolarHBondContact N-OE2 3.49Å; T227-E230 PolarHBondContact N-OE2 3.25Å; T227-E230 PolarHBondContact O-N 3.24Å; T227-E230 WeakPolarHBondContact OG1-CG 3.39Å; T227-E230 PolarHBondContact OG1-N 2.98Å; T227-E230 PolarHBondContact OG1-OE2 3.47Å; L228-E230 VanDerWaalsContact C-N 3.34Å; L228-E230 PolarHBondContact O-N 3.2Å; E230-L232 VanDerWaalsContact C-N 3.32Å; E230-D233 CarbonylContact O-C 3.58Å; E230-D233 PolarHBondContact O-N 3.12Å; E230-S234 PolarHBondContact O-N 3.05Å
231	A	95	Very high	89.4	Confident	0 Å²	0	41 Å²	41	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.7	-39.3	174.9	0	0	0	0	0	110.9	I149 A189 V191 W214 T227 L228 L229 S234	I149-A231 HydrophobicContact CD1-CB 4.13Å; I149-A231 WeakPolarHBondContact CD1-O 3.45Å; I149-A231 HydrophobicContact CG2-CB 4.07Å; A189-A231 HydrophobicContact CB-CB 4.08Å; V191-A231 HydrophobicContact CG2-CB 4.04Å; W214-A231 HydrophobicContact CD2-CB 4.49Å; W214-A231 HydrophobicContact CH2-CB 4.5Å; W214-A231 HydrophobicContact CZ2-CB 3.83Å; W214-A231 VanDerWaalsContact CZ2-N 3.25Å; T227-A231 PolarHBondContact O-N 3.19Å; T227-A231 VanDerWaalsContact O-N 3.15Å; L228-A231 WeakPolarHBondContact O-CA 3.4Å; L228-A231 WeakPolarHBondContact O-CB 3.43Å; L228-A231 PolarHBondContact O-N 2.91Å; L228-A231 VanDerWaalsContact O-N 3.09Å; L229-A231 VanDerWaalsContact C-N 3.27Å; L229-A231 PolarHBondContact O-N 3.2Å; A231-S234 WeakPolarHBondContact O-CB 3.14Å; A231-S234 PolarHBondContact O-N 3.04Å; A231-S234 VanDerWaalsContact O-N 3.17Å; A231-S234 PolarHBondContact O-OG 2.85Å
232	L	93.5	Very high	89.8	Confident	2 Å²	2	41.3 Å²	41.3	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-63.8	-40.9	172.9	-59.6	-173.7	0	0	0	111.8	I10 L27 F80 V113 I149 L228 L229 E230 S234 I235	I10-L232 HydrophobicContact CD1-CD1 4.37Å; I10-L232 HydrophobicContact CD1-CD2 3.76Å; I10-L232 HydrophobicContact CD1-CG 4.46Å; L27-L232 HydrophobicContact CD2-CD1 3.68Å; F80-L232 HydrophobicContact CE2-CD1 4.25Å; F80-L232 HydrophobicContact CZ-CD1 3.84Å; V113-L232 HydrophobicContact CG2-CD2 3.85Å; I149-L232 HydrophobicContact CD1-CD2 3.74Å; L228-L232 WeakPolarHBondContact O-CG 3.33Å; L228-L232 PolarHBondContact O-N 2.59Å; L229-L232 WeakPolarHBondContact O-CB 3.36Å; L229-L232 PolarHBondContact O-N 2.75Å; L229-L232 VanDerWaalsContact O-N 3.14Å; E230-L232 VanDerWaalsContact C-N 3.32Å; L232-S234 PolarHBondContact O-N 2.79Å; L232-I235 HydrophobicContact CB-CD1 4.41Å; L232-I235 HydrophobicContact CD2-CD1 4.14Å; L232-I235 VanDerWaalsContact O-CB 3.27Å; L232-I235 WeakPolarHBondContact O-CB 3.38Å; L232-I235 WeakPolarHBondContact O-CD1 3.18Å; L232-I235 WeakPolarHBondContact O-CG1 3.15Å; L232-I235 PolarHBondContact O-N 3.45Å; L232-I235 VanDerWaalsContact O-N 3.11Å
233	D	92.1	Very high	89.9	Confident	26 Å²	26	45.9 Å²	45.9	14%	0.139	27%	0.269	C	S	.	.	H	α-helix	trans	-68.7	-10.5	175	-89.1	-29.7	0	0	0	114	T82 G83 K84 L229 E230	T82-D233 WeakPolarHBondContact CB-OD1 3.5Å; T82-D233 PolarHBondContact OG1-OD1 3.41Å; G83-D233 PolarHBondContact N-OD2 2.84Å; K84-D233 WeakPolarHBondContact CD-O 3.16Å; K84-D233 PolarHBondContact N-OD1 3.1Å; K84-D233 PolarHBondContact NZ-O 2.74Å; K84-D233 VanDerWaalsContact NZ-O 3.08Å; L229-D233 PolarHBondContact O-N 3.08Å; E230-D233 CarbonylContact O-C 3.58Å; E230-D233 PolarHBondContact O-N 3.12Å
234	S	92.4	Very high	89.9	Confident	16 Å²	16	48 Å²	48	11%	0.112	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-1.9	173.1	84.9	0	0	0	0	113.9	R218 E230 A231 L232 M236	R218-S234 PolarHBondContact NH1-O 3.31Å; E230-S234 PolarHBondContact O-N 3.05Å; A231-S234 WeakPolarHBondContact O-CB 3.14Å; A231-S234 PolarHBondContact O-N 3.04Å; A231-S234 VanDerWaalsContact O-N 3.17Å; A231-S234 PolarHBondContact O-OG 2.85Å; L232-S234 PolarHBondContact O-N 2.79Å; S234-M236 PolarHBondContact O-N 2.87Å
235	I	91.6	Very high	90	Very high	3 Å²	3	44 Å²	44	2%	0.015	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-60.4	133	172.9	-67.5	168.8	0	0	0	108.2	I8 I10 Y85 C111 I149 L232	I8-I235 HydrophobicContact CD1-CB 4.31Å; I8-I235 HydrophobicContact CD1-CD1 3.87Å; I8-I235 HydrophobicContact CD1-CG2 4.21Å; I10-I235 HydrophobicContact CD1-CD1 3.52Å; I10-I235 HydrophobicContact CG1-CD1 4.17Å; Y85-I235 HydrophobicContact CE2-CB 4.44Å; Y85-I235 WeakPolarHBondContact CE2-O 3.31Å; Y85-I235 PolarHBondContact OH-O 2.82Å; C111-I235 HydrophobicContact CB-CD1 3.64Å; C111-I235 HydrophobicContact CB-CG1 4.05Å; C111-I235 HydrophobicContact CB-CG2 4.18Å; I149-I235 HydrophobicContact CD1-CD1 4.13Å; I149-I235 HydrophobicContact CD1-CG1 4Å; L232-I235 HydrophobicContact CB-CD1 4.41Å; L232-I235 HydrophobicContact CD2-CD1 4.14Å; L232-I235 VanDerWaalsContact O-CB 3.27Å; L232-I235 WeakPolarHBondContact O-CB 3.38Å; L232-I235 WeakPolarHBondContact O-CD1 3.18Å; L232-I235 WeakPolarHBondContact O-CG1 3.15Å; L232-I235 PolarHBondContact O-N 3.45Å; L232-I235 VanDerWaalsContact O-N 3.11Å
236	M	87.8	Confident	90.1	Very high	57 Å²	57	43.8 Å²	43.8	28%	0.281	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-75.6	134.8	171.5	-63.4	-175.7	-60.6	0	0	108.7	Q147 E220 S234	Q147-M236 PolarHBondContact NE2-O 2.91Å; E220-M236 HydrophobicContact CB-SD 3.77Å; E220-M236 HydrophobicContact CG-SD 3.94Å; S234-M236 PolarHBondContact O-N 2.87Å
237	P	82.6	Confident	90.2	Very high	75 Å²	75	41.9 Å²	41.9	49%	0.487	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-54.5	134.4	175.1	-21	30.4	0	0	0	110.1	T6 Y85 S239	T6-P237 HydrophobicContact CG2-CB 4.44Å; Y85-P237 HydrophobicContact CE1-CG 4.13Å; Y85-P237 WeakPolarHBondContact OH-CD 3.43Å; Y85-P237 VanDerWaalsContact OH-CG 3.32Å; Y85-P237 WeakPolarHBondContact OH-CG 3.28Å; P237-S239 PolarHBondContact O-N 3.17Å
238	P	76.8	Confident	90.2	Very high	34 Å²	34	41.6 Å²	41.6	22%	0.221	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-62.3	134.4	173	29	-36.3	0	0	0	109.1	D110 R240	D110-P238 HydrophobicContact CB-CB 4.22Å; D110-P238 HydrophobicContact CB-CG 4.18Å; D110-P238 VanDerWaalsContact OD1-CB 3.29Å; D110-P238 WeakPolarHBondContact OD1-CB 3.48Å; D110-P238 WeakPolarHBondContact OD1-CG 3.46Å; P238-R240 PolarHBondContact O-N 2.79Å
239	S	74.4	Confident	90.2	Very high	119 Å²	119	41.6 Å²	41.6	83%	0.832	23%	0.231	S	C	*	.			trans	-67.6	104.1	169.4	-175.6	0	0	0	0	108.2	P237 P241	P237-S239 PolarHBondContact O-N 3.17Å; S239-P241 VanDerWaalsContact O-CD 3.31Å; S239-P241 WeakPolarHBondContact O-CD 3.48Å
240	R	77.1	Confident	90.2	Very high	69 Å²	69	40 Å²	40	26%	0.26	22%	0.223	S	C	.	.			trans	-68.3	120.2	176.5	-66.9	-176.1	-171.9	-103.2	-2.6	108.5	H7 P238 T242 P304	H7-R240 PolarHBondContact O-NH2 3.41Å; P238-R240 PolarHBondContact O-N 2.79Å; R240-T242 HydrophobicContact CB-CG2 4.46Å; R240-T242 PolarHBondContact O-N 3.44Å; R240-P304 HydrophobicContact CB-CB 4.2Å; R240-P304 HydrophobicContact CB-CG 4.4Å; R240-P304 WeakPolarHBondContact CD-O 3.3Å; R240-P304 PolarHBondContact NH1-O 3.22Å
241	P	83.3	Confident	89.7	Confident	36 Å²	36	38.3 Å²	38.3	23%	0.234	22%	0.215	C	C	.	.			trans	-79.1	64.6	-174.7	30.6	-34.8	0	0	0	111.6	S239 D243 K244 E268 T269 G270 P304	S239-P241 VanDerWaalsContact O-CD 3.31Å; S239-P241 WeakPolarHBondContact O-CD 3.48Å; P241-D243 VanDerWaalsContact C-N 3.32Å; P241-K244 HydrophobicContact CB-CB 4.28Å; P241-K244 HydrophobicContact CB-CD 3.95Å; P241-K244 HydrophobicContact CB-CG 4.11Å; P241-K244 PolarHBondContact O-N 2.82Å; P241-E268 VanDerWaalsContact CG-O 3.27Å; P241-E268 WeakPolarHBondContact CG-O 3.46Å; P241-T269 HydrophobicContact CB-CG2 4.08Å; P241-T269 HydrophobicContact CG-CG2 3.67Å; P241-G270 PolarHBondContact O-N 3.42Å; P241-P304 HydrophobicContact CG-CB 4.22Å; P241-P304 HydrophobicContact CG-CG 4.37Å
242	T	89.4	Confident	89.2	Confident	50 Å²	50	41.4 Å²	41.4	31%	0.307	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-32.6	179	47.7	0	0	0	0	112.5	R240 K244 L303 P304	R240-T242 HydrophobicContact CB-CG2 4.46Å; R240-T242 PolarHBondContact O-N 3.44Å; T242-K244 VanDerWaalsContact C-N 3.28Å; T242-K244 PolarHBondContact O-N 2.79Å; T242-L303 HydrophobicContact CG2-CD2 4.43Å; T242-P304 HydrophobicContact CG2-CG 4.08Å
243	D	89.7	Confident	89	Confident	156 Å²	156	42.8 Å²	42.8	83%	0.834	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-10.8	-176.9	-51.6	-35.4	0	0	0	113	P241	P241-D243 VanDerWaalsContact C-N 3.32Å
244	K	93.6	Very high	88.9	Confident	77 Å²	77	47.2 Å²	47.2	34%	0.335	26%	0.255	S	S	.	.	S	Bend	trans	-80.6	154.9	175.5	-70.9	-167.7	178.6	-173.8	0	110.6	P241 T242 T269 G270 Q417 Y418	P241-K244 HydrophobicContact CB-CB 4.28Å; P241-K244 HydrophobicContact CB-CD 3.95Å; P241-K244 HydrophobicContact CB-CG 4.11Å; P241-K244 PolarHBondContact O-N 2.82Å; T242-K244 VanDerWaalsContact C-N 3.28Å; T242-K244 PolarHBondContact O-N 2.79Å; K244-T269 HydrophobicContact CB-CG2 4.39Å; K244-T269 HydrophobicContact CD-CG2 4.27Å; K244-G270 WeakPolarHBondContact O-CA 3.49Å; K244-G270 PolarHBondContact O-N 2.81Å; K244-Q417 PolarHBondContact NZ-O 3.17Å; K244-Y418 HydrophobicContact CB-CE1 4.48Å
245	P	96.9	Very high	88.8	Confident	23 Å²	23	54.7 Å²	54.7	15%	0.149	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-58.2	154.6	172.7	-25.5	35.8	0	0	0	113.1	R247 T269 N331 D332 Y418	P245-R247 PolarHBondContact O-N 2.85Å; P245-T269 CarbonylContact O-C 3.57Å; P245-T269 WeakPolarHBondContact O-CB 3.44Å; P245-T269 PolarHBondContact O-OG1 2.79Å; P245-N331 WeakPolarHBondContact CB-O 3.25Å; P245-D332 HydrophobicContact CB-CB 4.13Å; P245-D332 HydrophobicContact CG-CB 3.98Å; P245-Y418 HydrophobicContact CB-CE1 4.42Å; P245-Y418 VanDerWaalsContact CB-OH 3.3Å; P245-Y418 WeakPolarHBondContact CB-OH 3.49Å; P245-Y418 WeakPolarHBondContact CD-OH 3.44Å; P245-Y418 WeakPolarHBondContact CG-OH 3.4Å
246	L	97.7	Very high	88.7	Confident	5 Å²	5	58 Å²	58	3%	0.026	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-63.8	127.5	-176	177.1	67.3	0	0	0	111.3	L248 V267 T269 L272 M276 V278 G327 D328	L246-L248 HydrophobicContact CD1-CB 4.46Å; L246-V267 HydrophobicContact CD1-CG1 4.03Å; L246-T269 CarbonylContact C-O 3.52Å; L246-T269 VanDerWaalsContact CA-O 3.26Å; L246-T269 WeakPolarHBondContact CA-O 3.33Å; L246-T269 WeakPolarHBondContact CD1-O 3.4Å; L246-L272 HydrophobicContact CD1-CB 4.15Å; L246-L272 HydrophobicContact CD2-CB 4.38Å; L246-L272 HydrophobicContact CD2-CD1 3.82Å; L246-M276 HydrophobicContact CD2-CE 4.38Å; L246-V278 HydrophobicContact CD2-CG1 4.17Å; L246-G327 WeakPolarHBondContact O-CA 3.23Å; L246-D328 HydrophobicContact CB-CB 4.24Å
247	R	97.8	Very high	88.7	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	33%	0.326	C	S	.	.	B	Isolated β-bridge	trans	-134	119.2	164.6	-66	-66.1	-177.1	-82.5	-0	109.5	P245 E268 T269 V325 D332 E413 Y418 L421	P245-R247 PolarHBondContact O-N 2.85Å; R247-E268 WeakPolarHBondContact O-CB 3.36Å; R247-E268 PolarHBondContact O-N 3.46Å; R247-T269 WeakPolarHBondContact CB-OG1 3Å; R247-T269 WeakPolarHBondContact CG-OG1 3.28Å; R247-T269 PolarHBondContact N-O 3.44Å; R247-T269 PolarHBondContact N-OG1 2.79Å; R247-T269 PolarHBondContact O-N 2.73Å; R247-V325 HydrophobicContact CB-CG1 4.5Å; R247-D332 VanDerWaalsContact CZ-O 3.26Å; R247-D332 IonicContact CZ-OD2 2.78Å; R247-D332 PolarHBondContact NH1-O 2.83Å; R247-D332 PolarHBondContact NH2-O 3.47Å; R247-D332 IonicContact NH2-OD1 3.63Å; R247-D332 IonicContact NH2-OD2 3.82Å; R247-D332 PolarHBondContact NH2-OD2 2.99Å; R247-E413 IonicContact CZ-OE1 3.16Å; R247-E413 VanDerWaalsContact CZ-OE1 3.26Å; R247-E413 IonicContact NE-OE1 3.53Å; R247-E413 PolarHBondContact NE-OE1 3.3Å; R247-E413 IonicContact NH2-OE1 2.63Å; R247-E413 PolarHBondContact NH2-OE1 2.88Å; R247-Y418 HydrophobicContact CG-CD1 3.58Å; R247-Y418 HydrophobicContact CG-CE1 3.8Å; R247-Y418 HydrophobicContact CG-CG 4.09Å; R247-L421 HydrophobicContact CB-CD1 4.11Å; R247-L421 HydrophobicContact CB-CD2 4.11Å; R247-L421 HydrophobicContact CG-CD2 4.12Å
248	L	97.5	Very high	89	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	93.4	179.7	-165.1	173.3	0	0	0	108.9	L246 L250 V267 L272 V308 F310 A326	L246-L248 HydrophobicContact CD1-CB 4.46Å; L248-L250 HydrophobicContact CD2-CD2 3.94Å; L248-L250 PolarHBondContact O-N 3.25Å; L248-V267 HydrophobicContact CD1-CG2 3.93Å; L248-V267 HydrophobicContact CG-CG2 4.36Å; L248-L272 HydrophobicContact CD1-CD2 3.77Å; L248-V308 HydrophobicContact CD1-CG2 4.17Å; L248-F310 HydrophobicContact CD1-CD1 4.14Å; L248-F310 HydrophobicContact CD1-CE1 3.68Å; L248-F310 HydrophobicContact CD1-CZ 4.33Å; L248-F310 HydrophobicContact CD2-CE1 3.9Å; L248-F310 HydrophobicContact CG-CE1 4.45Å; L248-A326 HydrophobicContact CB-CB 4.33Å; L248-A326 PolarHBondContact N-O 3.47Å; L248-A326 PolarHBondContact O-N 2.76Å
249	P	95.8	Very high	89.6	Confident	4 Å²	4	62 Å²	62	3%	0.026	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	128.1	172.8	-20.2	33.8	0	0	0	111.4	Q251 E268 N324 V325 H364 T365 L421	P249-Q251 PolarHBondContact O-N 3.34Å; P249-E268 HydrophobicContact CG-CG 4.03Å; P249-N324 CarbonylContact C-O 3.57Å; P249-N324 WeakPolarHBondContact CA-O 3.48Å; P249-V325 HydrophobicContact CB-CG2 4.49Å; P249-H364 HydrophobicContact CB-CB 4.08Å; P249-H364 HydrophobicContact CG-CB 4.03Å; P249-T365 HydrophobicContact CB-CG2 4.05Å; P249-T365 WeakPolarHBondContact CB-OG1 3.47Å; P249-L421 HydrophobicContact CG-CD1 3.79Å; P249-L421 HydrophobicContact CG-CG 4.21Å
250	L	94.9	Very high	90.4	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	126.9	-179.8	-56	-166.4	0	0	0	110.4	L248 V253 P263 F280 F310 I320 G323 N324 A326 T365	L248-L250 HydrophobicContact CD2-CD2 3.94Å; L248-L250 PolarHBondContact O-N 3.25Å; L250-V253 HydrophobicContact CD1-CG2 4.02Å; L250-P263 HydrophobicContact CD1-CB 3.98Å; L250-P263 HydrophobicContact CD2-CB 3.78Å; L250-P263 HydrophobicContact CG-CB 4.48Å; L250-F280 HydrophobicContact CD1-CD1 4.03Å; L250-F280 HydrophobicContact CD1-CE1 3.92Å; L250-F280 HydrophobicContact CD2-CE1 4.26Å; L250-F310 HydrophobicContact CD2-CE1 4.21Å; L250-F310 HydrophobicContact CD2-CZ 4.04Å; L250-I320 HydrophobicContact CD1-CB 4.3Å; L250-I320 HydrophobicContact CD1-CD1 4.23Å; L250-G323 PolarHBondContact O-N 3.39Å; L250-N324 HydrophobicContact CD1-CB 4.1Å; L250-N324 HydrophobicContact CG-CB 4.32Å; L250-N324 WeakPolarHBondContact CG-O 3.31Å; L250-N324 PolarHBondContact N-O 3.27Å; L250-A326 HydrophobicContact CD2-CB 4.5Å; L250-T365 WeakPolarHBondContact O-CB 3.35Å; L250-T365 PolarHBondContact O-OG1 3.17Å
251	Q	83.7	Confident	91.3	Very high	52 Å²	52	55 Å²	55	24%	0.243	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	-49.3	171.1	-68.6	173.8	-0.8	0	0	109.9	P249 V264 R322 T365	P249-Q251 PolarHBondContact O-N 3.34Å; Q251-V264 PolarHBondContact N-O 2.81Å; Q251-R322 VanDerWaalsContact O-CB 3.24Å; Q251-R322 WeakPolarHBondContact O-CB 3.43Å; Q251-R322 WeakPolarHBondContact O-CD 3.35Å; Q251-R322 WeakPolarHBondContact O-CG 3.19Å; Q251-T365 HydrophobicContact CG-CG2 3.75Å
252	D	84.2	Confident	91.9	Very high	65 Å²	65	54 Å²	54	35%	0.348	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	164.9	-179.2	-75.1	-59.3	0	0	0	111.6	Y254 P263 V264	D252-Y254 HydrophobicContact CB-CE2 3.73Å; D252-P263 WeakPolarHBondContact O-CA 3.46Å; D252-V264 PolarHBondContact N-O 3.03Å; D252-V264 PolarHBondContact O-N 3.3Å
253	V	90.3	Very high	92.2	Very high	31 Å²	31	51.7 Å²	51.7	19%	0.188	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	119.7	177.4	-175.2	0	0	0	0	109.4	L250 T261 P263 V317 I320	L250-V253 HydrophobicContact CD1-CG2 4.02Å; V253-T261 HydrophobicContact CG1-CG2 3.8Å; V253-P263 HydrophobicContact CG2-CB 4.44Å; V253-V317 HydrophobicContact CG1-CB 4.21Å; V253-V317 HydrophobicContact CG1-CG1 4.01Å; V253-I320 HydrophobicContact CG1-CD1 3.79Å; V253-I320 HydrophobicContact CG1-CG1 3.88Å; V253-I320 HydrophobicContact CG2-CD1 4.07Å; V253-I320 HydrophobicContact CG2-CG1 4.06Å
254	Y	89.4	Confident	92.2	Very high	119 Å²	119	45.9 Å²	45.9	47%	0.467	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	153.3	-178.3	-59.2	-79.2	0	0	0	112.2	D252 T261 V262 V264	D252-Y254 HydrophobicContact CB-CE2 3.73Å; Y254-T261 WeakPolarHBondContact O-CA 3.41Å; Y254-V262 PolarHBondContact N-O 3.46Å; Y254-V262 PolarHBondContact O-N 3.22Å; Y254-V264 HydrophobicContact CD2-CG2 3.75Å; Y254-V264 HydrophobicContact CE2-CB 4.32Å; Y254-V264 HydrophobicContact CE2-CG2 3.72Å
255	K	91.4	Very high	91.9	Very high	174 Å²	174	42.2 Å²	42.2	76%	0.757	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.4	110.1	165.4	-172.7	179.7	179.7	-175	0	107.9	G260 V317	K255-G260 WeakPolarHBondContact CA-O 3.33Å; K255-V317 HydrophobicContact CB-CG1 3.75Å
256	I	88.8	Confident	91.5	Very high	73 Å²	73	42.2 Å²	42.2	37%	0.374	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	127.4	179.7	-53.7	-177	0	0	0	108.8	G258 I259 G260 V262	I256-G258 PolarHBondContact O-N 3.14Å; I256-I259 HydrophobicContact CB-CB 4.03Å; I256-I259 HydrophobicContact CB-CG2 4.44Å; I256-I259 HydrophobicContact CG2-CB 4.06Å; I256-I259 HydrophobicContact CG2-CD1 3.92Å; I256-I259 HydrophobicContact CG2-CG1 4.23Å; I256-I259 PolarHBondContact O-N 2.81Å; I256-G260 PolarHBondContact N-O 3.12Å; I256-G260 PolarHBondContact O-N 2.85Å; I256-V262 HydrophobicContact CD1-CB 4.08Å; I256-V262 HydrophobicContact CD1-CG1 4.46Å; I256-V262 HydrophobicContact CD1-CG2 3.78Å; I256-V262 HydrophobicContact CG1-CB 4.47Å; I256-V262 HydrophobicContact CG1-CG2 4.16Å
257	G	88.6	Confident	91.2	Very high	74 Å²	74	42 Å²	42	76%	0.763	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	134.4	177.3	0	0	0	0	0	111.2	I259	G257-I259 PolarHBondContact O-N 2.84Å
258	G	87.5	Confident	90.9	Very high	95 Å²	95	43.3 Å²	43.3	98%	0.979	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	-24.8	-177.6	0	0	0	0	0	115.7	I256	I256-G258 PolarHBondContact O-N 3.14Å
259	I	89.4	Confident	90.7	Very high	81 Å²	81	43.3 Å²	43.3	42%	0.415	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-44.5	-177.7	-67.4	-178.4	0	0	0	111.4	I256 G257 V262 N311	I256-I259 HydrophobicContact CB-CB 4.03Å; I256-I259 HydrophobicContact CB-CG2 4.44Å; I256-I259 HydrophobicContact CG2-CB 4.06Å; I256-I259 HydrophobicContact CG2-CD1 3.92Å; I256-I259 HydrophobicContact CG2-CG1 4.23Å; I256-I259 PolarHBondContact O-N 2.81Å; G257-I259 PolarHBondContact O-N 2.84Å; I259-V262 HydrophobicContact CG2-CG2 3.71Å; I259-N311 HydrophobicContact CG2-CB 4.45Å; I259-N311 WeakPolarHBondContact CG2-ND2 3.25Å; I259-N311 PolarHBondContact O-ND2 2.85Å
260	G	92.1	Very high	90.7	Very high	30 Å²	30	43.2 Å²	43.2	31%	0.309	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	108.3	-138.6	-178.1	0	0	0	0	0	112.9	K255 I256	K255-G260 WeakPolarHBondContact CA-O 3.33Å; I256-G260 PolarHBondContact N-O 3.12Å; I256-G260 PolarHBondContact O-N 2.85Å
261	T	95.9	Very high	90.7	Very high	11 Å²	11	45.4 Å²	45.4	7%	0.067	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	126.5	-176.4	-71.8	0	0	0	0	110.8	V253 Y254 V312 V315 V317 I320	V253-T261 HydrophobicContact CG1-CG2 3.8Å; Y254-T261 WeakPolarHBondContact O-CA 3.41Å; T261-V312 HydrophobicContact CG2-CG2 3.96Å; T261-V312 WeakPolarHBondContact O-CG2 3.45Å; T261-V312 PolarHBondContact O-N 3.46Å; T261-V312 VanDerWaalsContact O-N 3.08Å; T261-V315 WeakPolarHBondContact CB-O 3.45Å; T261-V315 PolarHBondContact OG1-O 3.22Å; T261-V317 HydrophobicContact CG2-CG1 3.96Å; T261-V317 WeakPolarHBondContact OG1-CG1 3.33Å; T261-I320 HydrophobicContact CG2-CD1 4.01Å
262	V	95.4	Very high	91.4	Very high	15 Å²	15	43 Å²	43	9%	0.091	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	93.3	-177.6	-177.2	0	0	0	0	109.1	Y254 I256 I259	Y254-V262 PolarHBondContact N-O 3.46Å; Y254-V262 PolarHBondContact O-N 3.22Å; I256-V262 HydrophobicContact CD1-CB 4.08Å; I256-V262 HydrophobicContact CD1-CG1 4.46Å; I256-V262 HydrophobicContact CD1-CG2 3.78Å; I256-V262 HydrophobicContact CG1-CB 4.47Å; I256-V262 HydrophobicContact CG1-CG2 4.16Å; I259-V262 HydrophobicContact CG2-CG2 3.71Å
263	P	95.3	Very high	91.9	Very high	0 Å²	0	44 Å²	44	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	146.6	161.6	25.1	-36.4	0	0	0	112	L250 D252 V253 F280 G309 F310 V312 I320	L250-P263 HydrophobicContact CD1-CB 3.98Å; L250-P263 HydrophobicContact CD2-CB 3.78Å; L250-P263 HydrophobicContact CG-CB 4.48Å; D252-P263 WeakPolarHBondContact O-CA 3.46Å; V253-P263 HydrophobicContact CG2-CB 4.44Å; P263-F280 HydrophobicContact CG-CE1 4.48Å; P263-F280 HydrophobicContact CG-CZ 4.31Å; P263-G309 WeakPolarHBondContact O-CA 3.33Å; P263-F310 HydrophobicContact CB-CE1 3.88Å; P263-F310 HydrophobicContact CB-CE2 4.32Å; P263-F310 HydrophobicContact CB-CZ 3.78Å; P263-F310 WeakPolarHBondContact CD-O 3.5Å; P263-F310 HydrophobicContact CG-CD1 4.07Å; P263-F310 HydrophobicContact CG-CD2 3.77Å; P263-F310 HydrophobicContact CG-CE1 3.7Å; P263-F310 HydrophobicContact CG-CE2 3.39Å; P263-F310 HydrophobicContact CG-CG 4.11Å; P263-F310 HydrophobicContact CG-CZ 3.35Å; P263-F310 WeakPolarHBondContact CG-O 3.37Å; P263-F310 PolarHBondContact O-N 2.93Å; P263-V312 HydrophobicContact CG-CG1 4.44Å; P263-V312 HydrophobicContact CG-CG2 4.3Å; P263-I320 HydrophobicContact CB-CD1 4.2Å; P263-I320 HydrophobicContact CG-CD1 4.3Å
264	V	89.4	Confident	92.2	Very high	34 Å²	34	44.9 Å²	44.9	21%	0.206	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	138.1	175.8	179	0	0	0	0	109.3	Q251 D252 Y254 V308	Q251-V264 PolarHBondContact N-O 2.81Å; D252-V264 PolarHBondContact N-O 3.03Å; D252-V264 PolarHBondContact O-N 3.3Å; Y254-V264 HydrophobicContact CD2-CG2 3.75Å; Y254-V264 HydrophobicContact CE2-CB 4.32Å; Y254-V264 HydrophobicContact CE2-CG2 3.72Å; V264-V308 WeakPolarHBondContact CA-O 3.38Å
265	G	88.6	Confident	92.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.8	178.1	173.8	0	0	0	0	0	112.9	V308	G265-V308 PolarHBondContact N-O 3.2Å; G265-V308 PolarHBondContact O-N 3.27Å
266	R	87.4	Confident	92.7	Very high	24 Å²	24	34.6 Å²	34.6	9%	0.091	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	133	177.2	-171.6	173.7	176.3	-102.5	3.4	110.2	E268 G305 D306 N307	R266-E268 IonicContact CZ-OE1 2.87Å; R266-E268 IonicContact NH1-OE1 3.52Å; R266-E268 PolarHBondContact NH1-OE1 2.78Å; R266-E268 IonicContact NH1-OE2 3.82Å; R266-E268 PolarHBondContact NH1-OE2 3.35Å; R266-E268 PolarHBondContact O-N 2.83Å; R266-G305 PolarHBondContact NE-O 3.19Å; R266-D306 WeakPolarHBondContact CA-O 3.19Å; R266-N307 WeakPolarHBondContact CB-OD1 3.45Å
267	V	92.6	Very high	93.1	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	22%	0.221	C	C	.	.			trans	-70.9	115.3	169.3	-175.1	0	0	0	0	107.8	L246 L248 G270 A302 L303 P304 G305 D306 V308	L246-V267 HydrophobicContact CD1-CG1 4.03Å; L248-V267 HydrophobicContact CD1-CG2 3.93Å; L248-V267 HydrophobicContact CG-CG2 4.36Å; V267-G270 WeakPolarHBondContact CG1-O 3.32Å; V267-A302 HydrophobicContact CG2-CB 4.06Å; V267-L303 WeakPolarHBondContact CB-O 3.13Å; V267-P304 CarbonylContact O-C 3.55Å; V267-P304 WeakPolarHBondContact O-CA 3.41Å; V267-G305 PolarHBondContact O-N 3.14Å; V267-D306 PolarHBondContact N-O 3.43Å; V267-V308 HydrophobicContact CG2-CG2 4.14Å
268	E	90.1	Very high	93.4	Very high	27 Å²	27	27.9 Å²	27.9	13%	0.126	19%	0.185	C	C	.	.			trans	-92.4	-40.1	-179.6	-70.9	-60.1	155.1	0	0	111.9	P241 R247 P249 R266 P420 L421	P241-E268 VanDerWaalsContact CG-O 3.27Å; P241-E268 WeakPolarHBondContact CG-O 3.46Å; R247-E268 WeakPolarHBondContact O-CB 3.36Å; R247-E268 PolarHBondContact O-N 3.46Å; P249-E268 HydrophobicContact CG-CG 4.03Å; R266-E268 IonicContact CZ-OE1 2.87Å; R266-E268 IonicContact NH1-OE1 3.52Å; R266-E268 PolarHBondContact NH1-OE1 2.78Å; R266-E268 IonicContact NH1-OE2 3.82Å; R266-E268 PolarHBondContact NH1-OE2 3.35Å; R266-E268 PolarHBondContact O-N 2.83Å; E268-P420 HydrophobicContact CB-CB 3.97Å; E268-P420 HydrophobicContact CB-CG 4.03Å; E268-P420 HydrophobicContact CG-CB 3.8Å; E268-P420 HydrophobicContact CG-CG 4.33Å; E268-P420 WeakPolarHBondContact OE2-CB 3.31Å; E268-P420 WeakPolarHBondContact OE2-CG 3.25Å; E268-L421 HydrophobicContact CB-CD1 4.2Å; E268-L421 HydrophobicContact CG-CD1 4.24Å
269	T	94.1	Very high	93.9	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.006	14%	0.14	C	C	.	.	B	Isolated β-bridge	trans	-143.3	156.3	175.4	63.7	0	0	0	0	111	P241 K244 P245 L246 R247 Y418	P241-T269 HydrophobicContact CB-CG2 4.08Å; P241-T269 HydrophobicContact CG-CG2 3.67Å; K244-T269 HydrophobicContact CB-CG2 4.39Å; K244-T269 HydrophobicContact CD-CG2 4.27Å; P245-T269 CarbonylContact O-C 3.57Å; P245-T269 WeakPolarHBondContact O-CB 3.44Å; P245-T269 PolarHBondContact O-OG1 2.79Å; L246-T269 CarbonylContact C-O 3.52Å; L246-T269 VanDerWaalsContact CA-O 3.26Å; L246-T269 WeakPolarHBondContact CA-O 3.33Å; L246-T269 WeakPolarHBondContact CD1-O 3.4Å; R247-T269 WeakPolarHBondContact CB-OG1 3Å; R247-T269 WeakPolarHBondContact CG-OG1 3.28Å; R247-T269 PolarHBondContact N-O 3.44Å; R247-T269 PolarHBondContact N-OG1 2.79Å; R247-T269 PolarHBondContact O-N 2.73Å; T269-Y418 HydrophobicContact CG2-CD1 3.96Å; T269-Y418 WeakPolarHBondContact OG1-CD1 3.14Å
270	G	95.3	Very high	94.3	Very high	2 Å²	2	19.8 Å²	19.8	2%	0.021	12%	0.121	C	C	.	.	S	Bend	trans	70.6	-167.7	179.9	0	0	0	0	0	113.9	P241 K244 V267 P304	P241-G270 PolarHBondContact O-N 3.42Å; K244-G270 WeakPolarHBondContact O-CA 3.49Å; K244-G270 PolarHBondContact O-N 2.81Å; V267-G270 WeakPolarHBondContact CG1-O 3.32Å; G270-P304 WeakPolarHBondContact O-CD 3.37Å; G270-P304 VanDerWaalsContact O-CG 3.27Å; G270-P304 WeakPolarHBondContact O-CG 3.4Å
271	I	95.6	Very high	94.5	Very high	45 Å²	45	18.4 Å²	18.4	23%	0.231	11%	0.106	C	C	.	.			trans	-123.9	138.1	-176.7	-56.3	177.4	0	0	0	108.4	K273 E301 A302 L303	I271-K273 HydrophobicContact CG2-CD 4.48Å; I271-K273 HydrophobicContact CG2-CG 3.94Å; I271-E301 HydrophobicContact CG2-CB 3.87Å; I271-A302 WeakPolarHBondContact CA-O 3.47Å; I271-A302 WeakPolarHBondContact CG2-O 3.47Å; I271-L303 HydrophobicContact CD1-CD2 3.97Å; I271-L303 HydrophobicContact CG1-CD2 3.93Å; I271-L303 HydrophobicContact CG2-CD2 4.21Å
272	L	97.1	Very high	94.5	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.005	11%	0.109	C	C	.	.	B	Isolated β-bridge	trans	-107.4	126.9	171.9	177.9	72.2	0	0	0	109.4	L246 L248 V278 V289 V292 E301 A302 V308 F310	L246-L272 HydrophobicContact CD1-CB 4.15Å; L246-L272 HydrophobicContact CD2-CB 4.38Å; L246-L272 HydrophobicContact CD2-CD1 3.82Å; L248-L272 HydrophobicContact CD1-CD2 3.77Å; L272-V278 HydrophobicContact CD1-CG1 4.12Å; L272-V289 HydrophobicContact CD1-CG2 4.03Å; L272-V292 HydrophobicContact CD2-CG1 4.13Å; L272-V292 HydrophobicContact CD2-CG2 3.87Å; L272-V292 HydrophobicContact CG-CG2 3.93Å; L272-E301 CarbonylContact O-C 3.52Å; L272-E301 WeakPolarHBondContact O-CA 3.24Å; L272-A302 HydrophobicContact CB-CB 4.31Å; L272-A302 PolarHBondContact N-O 3.43Å; L272-A302 PolarHBondContact O-N 2.78Å; L272-V308 HydrophobicContact CD2-CG2 4.12Å; L272-F310 HydrophobicContact CD2-CB 3.96Å; L272-F310 HydrophobicContact CD2-CD1 3.93Å; L272-F310 HydrophobicContact CD2-CD2 4.39Å; L272-F310 HydrophobicContact CD2-CG 3.86Å
273	K	96.5	Very high	94.4	Very high	86 Å²	86	20.9 Å²	20.9	37%	0.374	12%	0.123	S	C	.	.			trans	-126.6	148	177	-51.6	-167.2	-179.7	-159.8	0	111.3	I271 G275 M276 E301	I271-K273 HydrophobicContact CG2-CD 4.48Å; I271-K273 HydrophobicContact CG2-CG 3.94Å; K273-G275 PolarHBondContact O-N 3.12Å; K273-M276 HydrophobicContact CB-CG 4.01Å; K273-M276 HydrophobicContact CB-SD 3.9Å; K273-M276 HydrophobicContact CG-SD 4.1Å; K273-M276 PolarHBondContact N-SD 3.3Å; K273-M276 WeakPolarHBondContact O-CB 3.44Å; K273-M276 WeakPolarHBondContact O-CG 3.44Å; K273-M276 PolarHBondContact O-N 2.7Å; K273-E301 HydrophobicContact CD-CB 4.17Å; K273-E301 WeakPolarHBondContact CE-OE2 3.38Å; K273-E301 HydrophobicContact CG-CB 3.8Å; K273-E301 IonicContact NZ-OE2 2.65Å; K273-E301 PolarHBondContact NZ-OE2 3.37Å
274	P	96.4	Very high	94.4	Very high	50 Å²	50	23 Å²	23	33%	0.325	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	139.1	162.7	-24.3	35.2	0	0	0	111.2	M276 V292 P300	P274-M276 VanDerWaalsContact C-N 3.32Å; P274-M276 PolarHBondContact O-N 2.96Å; P274-V292 HydrophobicContact CG-CB 4.48Å; P274-V292 HydrophobicContact CG-CG2 4.13Å; P274-P300 WeakPolarHBondContact CD-O 3.06Å
275	G	94.5	Very high	94.6	Very high	41 Å²	41	21.7 Å²	21.7	42%	0.423	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.7	-8.9	-177.6	0	0	0	0	0	115.2	K273 V289	K273-G275 PolarHBondContact O-N 3.12Å; G275-V289 WeakPolarHBondContact CA-O 3.45Å; G275-V289 PolarHBondContact N-O 3.35Å
276	M	95.8	Very high	94.9	Very high	36 Å²	36	22.4 Å²	22.4	18%	0.177	13%	0.13	C	C	.	.			trans	-65.6	145.6	173.5	-72.5	-177.9	69.8	0	0	111.5	L246 K273 P274 V278 E288 V289 D328	L246-M276 HydrophobicContact CD2-CE 4.38Å; K273-M276 HydrophobicContact CB-CG 4.01Å; K273-M276 HydrophobicContact CB-SD 3.9Å; K273-M276 HydrophobicContact CG-SD 4.1Å; K273-M276 PolarHBondContact N-SD 3.3Å; K273-M276 WeakPolarHBondContact O-CB 3.44Å; K273-M276 WeakPolarHBondContact O-CG 3.44Å; K273-M276 PolarHBondContact O-N 2.7Å; P274-M276 VanDerWaalsContact C-N 3.32Å; P274-M276 PolarHBondContact O-N 2.96Å; M276-V278 HydrophobicContact CB-CG1 4.41Å; M276-E288 WeakPolarHBondContact O-CA 3.49Å; M276-V289 PolarHBondContact O-N 3.22Å; M276-D328 HydrophobicContact CE-CB 3.88Å; M276-D328 WeakPolarHBondContact CE-OD2 3.4Å
277	V	96.6	Very high	95.3	Very high	6 Å²	6	21.3 Å²	21.3	4%	0.036	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	119.7	169.8	-175.1	0	0	0	0	107.4	T286 T287 S329 A455 A458	V277-T286 HydrophobicContact CG1-CG2 3.42Å; V277-T286 VanDerWaalsContact CG1-CG2 3.42Å; V277-T287 CarbonylContact C-O 3.53Å; V277-T287 WeakPolarHBondContact CA-O 2.94Å; V277-S329 WeakPolarHBondContact CB-OG 3.32Å; V277-S329 VanDerWaalsContact CG1-OG 3.28Å; V277-S329 WeakPolarHBondContact CG1-OG 3.34Å; V277-S329 PolarHBondContact O-N 3.29Å; V277-S329 PolarHBondContact O-OG 3.49Å; V277-A455 HydrophobicContact CG1-CB 3.75Å; V277-A458 HydrophobicContact CG2-CB 3.68Å
278	V	96.9	Very high	95.5	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	144.4	-175.4	-62.1	0	0	0	0	111	L246 L272 M276 F280 T286 T287 V289 G327	L246-V278 HydrophobicContact CD2-CG1 4.17Å; L272-V278 HydrophobicContact CD1-CG1 4.12Å; M276-V278 HydrophobicContact CB-CG1 4.41Å; V278-F280 HydrophobicContact CG2-CE2 4.09Å; V278-F280 HydrophobicContact CG2-CZ 4.26Å; V278-T286 CarbonylContact O-C 3.54Å; V278-T286 VanDerWaalsContact O-CA 3.28Å; V278-T286 WeakPolarHBondContact O-CA 3.4Å; V278-T287 HydrophobicContact CG2-CG2 4.21Å; V278-T287 PolarHBondContact N-O 2.78Å; V278-T287 PolarHBondContact O-N 3.01Å; V278-V289 HydrophobicContact CB-CG2 4.29Å; V278-V289 HydrophobicContact CG1-CG2 3.63Å; V278-V289 HydrophobicContact CG2-CG2 3.64Å; V278-G327 CarbonylContact C-O 3.58Å; V278-G327 WeakPolarHBondContact CA-O 3.33Å; V278-G327 WeakPolarHBondContact CB-O 3.47Å
279	T	97.2	Very high	95.8	Very high	7 Å²	7	21.4 Å²	21.4	4%	0.043	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	132.4	174	-58.9	0	0	0	0	109.9	L285 T286 A326 G327 S329	T279-L285 CarbonylContact C-O 3.33Å; T279-L285 WeakPolarHBondContact CA-O 3.46Å; T279-T286 PolarHBondContact OG1-OG1 3.05Å; T279-A326 WeakPolarHBondContact O-CA 3.43Å; T279-G327 PolarHBondContact N-O 3.33Å; T279-G327 PolarHBondContact O-N 2.7Å; T279-S329 WeakPolarHBondContact OG1-CB 3.48Å
280	F	97.6	Very high	95.9	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	121.2	175	-65.2	-83.5	0	0	0	110.7	L250 P263 V278 N284 L285 T287 F310 V312 I320 V325 A326	L250-F280 HydrophobicContact CD1-CD1 4.03Å; L250-F280 HydrophobicContact CD1-CE1 3.92Å; L250-F280 HydrophobicContact CD2-CE1 4.26Å; P263-F280 HydrophobicContact CG-CE1 4.48Å; P263-F280 HydrophobicContact CG-CZ 4.31Å; V278-F280 HydrophobicContact CG2-CE2 4.09Å; V278-F280 HydrophobicContact CG2-CZ 4.26Å; F280-N284 WeakPolarHBondContact O-CA 3.38Å; F280-N284 PolarHBondContact O-N 2.88Å; F280-L285 HydrophobicContact CD2-CD2 3.91Å; F280-L285 HydrophobicContact CE2-CD2 4.4Å; F280-L285 PolarHBondContact N-O 3.39Å; F280-L285 PolarHBondContact O-N 3.14Å; F280-T287 HydrophobicContact CE2-CG2 3.78Å; F280-F310 HydrophobicContact CE1-CE2 4.23Å; F280-F310 HydrophobicContact CE1-CZ 4.1Å; F280-F310 AromaticContact CZ-CE2 3.91Å; F280-F310 HydrophobicContact CZ-CE2 3.91Å; F280-F310 HydrophobicContact CZ-CZ 4.25Å; F280-V312 HydrophobicContact CE2-CG1 4.37Å; F280-V312 HydrophobicContact CZ-CG1 4.09Å; F280-I320 HydrophobicContact CB-CG2 4.05Å; F280-I320 HydrophobicContact CD1-CG2 4.11Å; F280-I320 HydrophobicContact CD2-CG2 4.11Å; F280-I320 HydrophobicContact CE1-CD1 4.32Å; F280-I320 HydrophobicContact CG-CG2 3.84Å; F280-I320 HydrophobicContact CZ-CD1 4.31Å; F280-V325 WeakPolarHBondContact CA-O 3.38Å; F280-A326 HydrophobicContact CD1-CB 3.79Å; F280-A326 HydrophobicContact CE1-CB 3.66Å; F280-A326 HydrophobicContact CZ-CB 4.46Å
281	A	96.9	Very high	95.9	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.008	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	150.2	171.7	0	0	0	0	0	111.4	N324 V325 P334 C411	A281-N324 CarbonylContact O-C 3.56Å; A281-N324 WeakPolarHBondContact O-CA 3.48Å; A281-N324 VanDerWaalsContact O-CB 3.3Å; A281-N324 WeakPolarHBondContact O-CB 3.38Å; A281-V325 PolarHBondContact N-O 3.05Å; A281-V325 PolarHBondContact O-N 2.86Å; A281-P334 HydrophobicContact CB-CB 3.78Å; A281-P334 HydrophobicContact CB-CG 4.03Å; A281-P334 WeakPolarHBondContact CB-O 3.47Å; A281-C411 HydrophobicContact CB-CB 3.86Å
282	P	95	Very high	95.9	Very high	21 Å²	21	24.1 Å²	24.1	14%	0.136	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	cis	-76.4	-7.1	-6.2	34.3	-40.3	0	0	0	118.3	N284 A336 P409	P282-N284 PolarHBondContact O-N 3.37Å; P282-A336 HydrophobicContact CB-CB 3.58Å; P282-P409 HydrophobicContact CB-CB 3.75Å; P282-P409 HydrophobicContact CG-CB 3.66Å
283	P	94.2	Very high	95.4	Very high	57 Å²	57	27.4 Å²	27.4	37%	0.37	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-14.6	-178	-27	35.7	0	0	0	116.3	L285	P283-L285 VanDerWaalsContact C-N 3.31Å; P283-L285 HydrophobicContact CB-CB 4.43Å; P283-L285 PolarHBondContact O-N 3.07Å
284	N	93.7	Very high	94.7	Very high	45 Å²	45	25.9 Å²	25.9	24%	0.241	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	46.5	-174.2	-162	23	0	0	0	112	F280 P282 S447 G449 K450	F280-N284 WeakPolarHBondContact O-CA 3.38Å; F280-N284 PolarHBondContact O-N 2.88Å; P282-N284 PolarHBondContact O-N 3.37Å; N284-S447 PolarHBondContact ND2-O 3.47Å; N284-S447 VanDerWaalsContact ND2-O 3.09Å; N284-G449 WeakPolarHBondContact ND2-CA 3.21Å; N284-G449 PolarHBondContact ND2-N 3.34Å; N284-G449 CarbonylContact O-C 3.53Å; N284-G449 WeakPolarHBondContact O-CA 3.23Å; N284-K450 PolarHBondContact O-N 2.86Å
285	L	94.3	Very high	93.5	Very high	6 Å²	6	30.3 Å²	30.3	3%	0.031	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	129	179.3	-175.3	154.6	0	0	0	109.4	T279 F280 P283 T287 V315 E319 K450 T452	T279-L285 CarbonylContact C-O 3.33Å; T279-L285 WeakPolarHBondContact CA-O 3.46Å; F280-L285 HydrophobicContact CD2-CD2 3.91Å; F280-L285 HydrophobicContact CE2-CD2 4.4Å; F280-L285 PolarHBondContact N-O 3.39Å; F280-L285 PolarHBondContact O-N 3.14Å; P283-L285 VanDerWaalsContact C-N 3.31Å; P283-L285 HydrophobicContact CB-CB 4.43Å; P283-L285 PolarHBondContact O-N 3.07Å; L285-T287 HydrophobicContact CD2-CG2 4.5Å; L285-V315 HydrophobicContact CD1-CG1 3.98Å; L285-V315 HydrophobicContact CD1-CG2 4.39Å; L285-V315 HydrophobicContact CD2-CB 4.39Å; L285-V315 HydrophobicContact CD2-CG1 4.09Å; L285-V315 HydrophobicContact CD2-CG2 3.42Å; L285-V315 VanDerWaalsContact CD2-CG2 3.42Å; L285-E319 HydrophobicContact CD1-CB 3.96Å; L285-K450 WeakPolarHBondContact CA-O 3.32Å; L285-K450 HydrophobicContact CD1-CD 4.11Å; L285-T452 HydrophobicContact CD2-CG2 4.41Å
286	T	95.6	Very high	92.6	Very high	15 Å²	15	37 Å²	37	9%	0.092	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	131	-178.6	-59.9	0	0	0	0	111.9	V277 V278 T279 K450 T452 A455	V277-T286 HydrophobicContact CG1-CG2 3.42Å; V277-T286 VanDerWaalsContact CG1-CG2 3.42Å; V278-T286 CarbonylContact O-C 3.54Å; V278-T286 VanDerWaalsContact O-CA 3.28Å; V278-T286 WeakPolarHBondContact O-CA 3.4Å; T279-T286 PolarHBondContact OG1-OG1 3.05Å; T286-K450 PolarHBondContact N-O 3.16Å; T286-T452 WeakPolarHBondContact O-CG2 3.5Å; T286-T452 PolarHBondContact O-N 2.88Å; T286-T452 PolarHBondContact O-OG1 2.92Å; T286-A455 HydrophobicContact CG2-CB 4.08Å
287	T	96.3	Very high	91.8	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	167.9	-178.7	-159.1	0	0	0	0	113.6	V277 V278 F280 L285 V312 K313 V315 T452	V277-T287 CarbonylContact C-O 3.53Å; V277-T287 WeakPolarHBondContact CA-O 2.94Å; V278-T287 HydrophobicContact CG2-CG2 4.21Å; V278-T287 PolarHBondContact N-O 2.78Å; V278-T287 PolarHBondContact O-N 3.01Å; F280-T287 HydrophobicContact CE2-CG2 3.78Å; L285-T287 HydrophobicContact CD2-CG2 4.5Å; T287-V312 HydrophobicContact CG2-CB 3.65Å; T287-V312 HydrophobicContact CG2-CG1 3.7Å; T287-K313 PolarHBondContact OG1-O 2.78Å; T287-V315 HydrophobicContact CG2-CG2 3.8Å; T287-T452 WeakPolarHBondContact CA-OG1 3.44Å; T287-T452 WeakPolarHBondContact CB-OG1 3.27Å; T287-T452 PolarHBondContact OG1-OG1 3.08Å
288	E	95.6	Very high	91.4	Very high	30 Å²	30	46 Å²	46	14%	0.14	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	135	176.3	-167.6	-162.8	159.6	0	0	110.3	M276 K290 A458	M276-E288 WeakPolarHBondContact O-CA 3.49Å; E288-K290 IonicContact OE1-NZ 3.08Å; E288-K290 PolarHBondContact OE1-NZ 3.05Å; E288-K290 WeakPolarHBondContact OE2-CE 2.98Å; E288-K290 IonicContact OE2-NZ 2.7Å; E288-K290 PolarHBondContact OE2-NZ 2.89Å; E288-A458 HydrophobicContact CG-CB 4.15Å
289	V	96.8	Very high	90.9	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	130.3	172	-178.6	0	0	0	0	109	L272 G275 M276 V278 V292 F310 N311 V312	L272-V289 HydrophobicContact CD1-CG2 4.03Å; G275-V289 WeakPolarHBondContact CA-O 3.45Å; G275-V289 PolarHBondContact N-O 3.35Å; M276-V289 PolarHBondContact O-N 3.22Å; V278-V289 HydrophobicContact CB-CG2 4.29Å; V278-V289 HydrophobicContact CG1-CG2 3.63Å; V278-V289 HydrophobicContact CG2-CG2 3.64Å; V289-V292 HydrophobicContact CG1-CG2 3.89Å; V289-F310 HydrophobicContact CG1-CB 4.09Å; V289-F310 HydrophobicContact CG1-CD2 4.22Å; V289-F310 HydrophobicContact CG2-CD2 4.12Å; V289-N311 CarbonylContact C-O 3.52Å; V289-N311 WeakPolarHBondContact CA-O 3.27Å; V289-V312 HydrophobicContact CG2-CG1 4.49Å
290	K	95.6	Very high	90.7	Very high	76 Å²	76	52.3 Å²	52.3	33%	0.33	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	-42.6	-178.1	-73.3	-70.4	163	-157.6	0	114.6	E288 N311 K313	E288-K290 IonicContact OE1-NZ 3.08Å; E288-K290 PolarHBondContact OE1-NZ 3.05Å; E288-K290 WeakPolarHBondContact OE2-CE 2.98Å; E288-K290 IonicContact OE2-NZ 2.7Å; E288-K290 PolarHBondContact OE2-NZ 2.89Å; K290-N311 HydrophobicContact CB-CB 4.19Å; K290-N311 WeakPolarHBondContact CB-OD1 3.26Å; K290-N311 PolarHBondContact N-O 2.99Å; K290-K313 HydrophobicContact CD-CD 4.11Å; K290-K313 HydrophobicContact CD-CG 4.28Å; K290-K313 VanDerWaalsContact CE-CD 3.48Å; K290-K313 HydrophobicContact CG-CD 3.99Å; K290-K313 HydrophobicContact CG-CG 3.63Å
291	S	95.4	Very high	90.5	Very high	29 Å²	29	55.7 Å²	55.7	20%	0.203	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	154.6	177.6	59	0	0	0	0	108.4	F310 N311	S291-F310 CarbonylContact O-C 3.54Å; S291-F310 VanDerWaalsContact O-CA 3.26Å; S291-F310 WeakPolarHBondContact O-CA 3.41Å; S291-F310 WeakPolarHBondContact O-CB 2.98Å; S291-N311 PolarHBondContact O-N 3.01Å; S291-N311 WeakPolarHBondContact OG-CB 3.35Å
292	V	94.9	Very high	90.2	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	134.2	172.4	-175.7	0	0	0	0	106.2	L272 P274 V289 L299 A302 V308 F310	L272-V292 HydrophobicContact CD2-CG1 4.13Å; L272-V292 HydrophobicContact CD2-CG2 3.87Å; L272-V292 HydrophobicContact CG-CG2 3.93Å; P274-V292 HydrophobicContact CG-CB 4.48Å; P274-V292 HydrophobicContact CG-CG2 4.13Å; V289-V292 HydrophobicContact CG1-CG2 3.89Å; V292-L299 PolarHBondContact O-N 3.28Å; V292-A302 HydrophobicContact CG1-CB 3.88Å; V292-V308 HydrophobicContact CG1-CB 3.87Å; V292-V308 HydrophobicContact CG1-CG1 4.12Å; V292-V308 HydrophobicContact CG1-CG2 4.07Å; V292-F310 HydrophobicContact CG2-CB 4.11Å
293	E	88.3	Confident	90	Very high	69 Å²	69	57.5 Å²	57.5	32%	0.322	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	142.3	-176	-69.8	172.7	-145.7	0	0	110.7	E297 V308 G309	E293-E297 CarbonylContact C-O 3.46Å; E293-E297 WeakPolarHBondContact CA-O 3.41Å; E293-V308 WeakPolarHBondContact O-CA 3.44Å; E293-G309 PolarHBondContact N-O 3.43Å; E293-G309 PolarHBondContact O-N 3.48Å
294	M	80.4	Confident	89.8	Confident	55 Å²	55	55 Å²	55	27%	0.271	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	129.1	171.2	-175.6	172.4	69.1	0	0	108.2	H296 E297 L299 D306 N307 V308	M294-H296 PolarHBondContact O-N 2.88Å; M294-H296 VanDerWaalsContact O-N 3.15Å; M294-E297 PolarHBondContact N-O 3.16Å; M294-E297 PolarHBondContact O-N 3.46Å; M294-L299 HydrophobicContact CB-CD1 3.54Å; M294-L299 HydrophobicContact CB-CG 4.16Å; M294-L299 HydrophobicContact CE-CD1 4.36Å; M294-D306 HydrophobicContact SD-CB 4.19Å; M294-N307 WeakPolarHBondContact CG-O 3.5Å; M294-V308 HydrophobicContact CB-CG1 4.25Å
295	H	72.6	Confident	89.2	Confident	143 Å²	143	53.5 Å²	53.5	66%	0.662	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	35.9	-178.6	-61.1	-57.2	0	0	0	114.6	E297	H295-E297 PolarHBondContact O-N 3.37Å
296	H	74.6	Confident	88.6	Confident	180 Å²	180	54.9 Å²	54.9	83%	0.833	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.9	12.1	-176.9	-50.7	-68.9	0	0	0	115.8	M294	M294-H296 PolarHBondContact O-N 2.88Å; M294-H296 VanDerWaalsContact O-N 3.15Å
297	E	79.1	Confident	87.9	Confident	142 Å²	142	57.7 Å²	57.7	66%	0.664	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107	139.7	171.9	-63.7	-174.7	171.4	0	0	110.3	E293 M294 H295	E293-E297 CarbonylContact C-O 3.46Å; E293-E297 WeakPolarHBondContact CA-O 3.41Å; M294-E297 PolarHBondContact N-O 3.16Å; M294-E297 PolarHBondContact O-N 3.46Å; H295-E297 PolarHBondContact O-N 3.37Å
298	S	89.3	Confident	87.5	Confident	89 Å²	89	57.7 Å²	57.7	62%	0.622	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	134.2	178.9	-170.5	0	0	0	0	110.9
299	L	86.1	Confident	87.4	Confident	32 Å²	32	57 Å²	57	17%	0.168	30%	0.302	C	S	.	.			trans	-108	137	179.1	-64	-179.7	0	0	0	111.5	V292 M294 E301 A302 V308	V292-L299 PolarHBondContact O-N 3.28Å; M294-L299 HydrophobicContact CB-CD1 3.54Å; M294-L299 HydrophobicContact CB-CG 4.16Å; M294-L299 HydrophobicContact CE-CD1 4.36Å; L299-E301 VanDerWaalsContact C-N 3.3Å; L299-A302 HydrophobicContact CD1-CB 4.47Å; L299-V308 HydrophobicContact CD1-CG1 4.1Å
300	P	93.1	Very high	87.4	Confident	109 Å²	109	57 Å²	57	71%	0.708	30%	0.302	S	S	*	.	S	Bend	trans	-70.2	-30	171.4	28.8	-33.5	0	0	0	112	P274	P274-P300 WeakPolarHBondContact CD-O 3.06Å
301	E	93.3	Very high	87.5	Confident	71 Å²	71	54 Å²	54	33%	0.332	29%	0.29	S	S	.	.			trans	-154.7	152.5	173.1	62.1	-176.5	-160.3	0	0	110.1	I271 L272 K273 L299 L303	I271-E301 HydrophobicContact CG2-CB 3.87Å; L272-E301 CarbonylContact O-C 3.52Å; L272-E301 WeakPolarHBondContact O-CA 3.24Å; K273-E301 HydrophobicContact CD-CB 4.17Å; K273-E301 WeakPolarHBondContact CE-OE2 3.38Å; K273-E301 HydrophobicContact CG-CB 3.8Å; K273-E301 IonicContact NZ-OE2 2.65Å; K273-E301 PolarHBondContact NZ-OE2 3.37Å; L299-E301 VanDerWaalsContact C-N 3.3Å; E301-L303 HydrophobicContact CG-CD2 4.49Å
302	A	90.1	Very high	87.5	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-116.3	131.3	172.4	0	0	0	0	0	109.7	V267 I271 L272 V292 L299 D306 V308	V267-A302 HydrophobicContact CG2-CB 4.06Å; I271-A302 WeakPolarHBondContact CA-O 3.47Å; I271-A302 WeakPolarHBondContact CG2-O 3.47Å; L272-A302 HydrophobicContact CB-CB 4.31Å; L272-A302 PolarHBondContact N-O 3.43Å; L272-A302 PolarHBondContact O-N 2.78Å; V292-A302 HydrophobicContact CG1-CB 3.88Å; L299-A302 HydrophobicContact CD1-CB 4.47Å; A302-D306 HydrophobicContact CB-CB 4.45Å; A302-V308 HydrophobicContact CB-CB 4.49Å; A302-V308 HydrophobicContact CB-CG1 3.68Å; A302-V308 HydrophobicContact CB-CG2 4.24Å
303	L	91.6	Very high	87.1	Confident	60 Å²	60	57.6 Å²	57.6	31%	0.314	30%	0.302	S	S	.	.			trans	-102.8	163.3	-173.1	-60.4	178.1	0	0	0	110.7	T242 V267 I271 E301 G305 D306	T242-L303 HydrophobicContact CG2-CD2 4.43Å; V267-L303 WeakPolarHBondContact CB-O 3.13Å; I271-L303 HydrophobicContact CD1-CD2 3.97Å; I271-L303 HydrophobicContact CG1-CD2 3.93Å; I271-L303 HydrophobicContact CG2-CD2 4.21Å; E301-L303 HydrophobicContact CG-CD2 4.49Å; L303-G305 PolarHBondContact O-N 2.97Å; L303-D306 PolarHBondContact N-OD2 2.95Å; L303-D306 WeakPolarHBondContact O-CB 3.38Å; L303-D306 PolarHBondContact O-N 3.48Å; L303-D306 VanDerWaalsContact O-N 3.1Å
304	P	89.6	Confident	87.1	Confident	4 Å²	4	59 Å²	59	3%	0.026	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	126.5	175.7	-24.3	33.6	0	0	0	111.2	R240 P241 T242 V267 G270	R240-P304 HydrophobicContact CB-CB 4.2Å; R240-P304 HydrophobicContact CB-CG 4.4Å; R240-P304 WeakPolarHBondContact CD-O 3.3Å; R240-P304 PolarHBondContact NH1-O 3.22Å; P241-P304 HydrophobicContact CG-CB 4.22Å; P241-P304 HydrophobicContact CG-CG 4.37Å; T242-P304 HydrophobicContact CG2-CG 4.08Å; V267-P304 CarbonylContact O-C 3.55Å; V267-P304 WeakPolarHBondContact O-CA 3.41Å; G270-P304 WeakPolarHBondContact O-CD 3.37Å; G270-P304 VanDerWaalsContact O-CG 3.27Å; G270-P304 WeakPolarHBondContact O-CG 3.4Å
305	G	80.4	Confident	87.7	Confident	13 Å²	13	56.8 Å²	56.8	13%	0.134	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	109.5	-22.3	-176.7	0	0	0	0	0	114.6	R266 V267 L303	R266-G305 PolarHBondContact NE-O 3.19Å; V267-G305 PolarHBondContact O-N 3.14Å; L303-G305 PolarHBondContact O-N 2.97Å
306	D	82.7	Confident	88.7	Confident	35 Å²	35	52.5 Å²	52.5	19%	0.187	29%	0.287	C	S	.	.			trans	-74.9	135.6	-177.3	-61	-18.5	0	0	0	110.9	R266 V267 M294 A302 L303 V308	R266-D306 WeakPolarHBondContact CA-O 3.19Å; V267-D306 PolarHBondContact N-O 3.43Å; M294-D306 HydrophobicContact SD-CB 4.19Å; A302-D306 HydrophobicContact CB-CB 4.45Å; L303-D306 PolarHBondContact N-OD2 2.95Å; L303-D306 WeakPolarHBondContact O-CB 3.38Å; L303-D306 PolarHBondContact O-N 3.48Å; L303-D306 VanDerWaalsContact O-N 3.1Å; D306-V308 HydrophobicContact CB-CG1 3.84Å
307	N	80.9	Confident	89.5	Confident	74 Å²	74	46.2 Å²	46.2	40%	0.396	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	107.6	172	-72	-76.6	0	0	0	108.4	R266 M294	R266-N307 WeakPolarHBondContact CB-OD1 3.45Å; M294-N307 WeakPolarHBondContact CG-O 3.5Å
308	V	87.9	Confident	90.2	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.006	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	146.2	-169.5	-59.3	0	0	0	0	112.2	L248 V264 G265 V267 L272 V292 E293 M294 L299 A302 D306	L248-V308 HydrophobicContact CD1-CG2 4.17Å; V264-V308 WeakPolarHBondContact CA-O 3.38Å; G265-V308 PolarHBondContact N-O 3.2Å; G265-V308 PolarHBondContact O-N 3.27Å; V267-V308 HydrophobicContact CG2-CG2 4.14Å; L272-V308 HydrophobicContact CD2-CG2 4.12Å; V292-V308 HydrophobicContact CG1-CB 3.87Å; V292-V308 HydrophobicContact CG1-CG1 4.12Å; V292-V308 HydrophobicContact CG1-CG2 4.07Å; E293-V308 WeakPolarHBondContact O-CA 3.44Å; M294-V308 HydrophobicContact CB-CG1 4.25Å; L299-V308 HydrophobicContact CD1-CG1 4.1Å; A302-V308 HydrophobicContact CB-CB 4.49Å; A302-V308 HydrophobicContact CB-CG1 3.68Å; A302-V308 HydrophobicContact CB-CG2 4.24Å; D306-V308 HydrophobicContact CB-CG1 3.84Å
309	G	93.7	Very high	90.4	Very high	16 Å²	16	47.5 Å²	47.5	17%	0.165	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	137	160.1	0	0	0	0	0	109.3	P263 E293	P263-G309 WeakPolarHBondContact O-CA 3.33Å; E293-G309 PolarHBondContact N-O 3.43Å; E293-G309 PolarHBondContact O-N 3.48Å
310	F	97.1	Very high	90.9	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	133.1	178.9	60.8	-81.4	0	0	0	111.7	L248 L250 P263 L272 F280 V289 S291 V292 V312 A326	L248-F310 HydrophobicContact CD1-CD1 4.14Å; L248-F310 HydrophobicContact CD1-CE1 3.68Å; L248-F310 HydrophobicContact CD1-CZ 4.33Å; L248-F310 HydrophobicContact CD2-CE1 3.9Å; L248-F310 HydrophobicContact CG-CE1 4.45Å; L250-F310 HydrophobicContact CD2-CE1 4.21Å; L250-F310 HydrophobicContact CD2-CZ 4.04Å; P263-F310 HydrophobicContact CB-CE1 3.88Å; P263-F310 HydrophobicContact CB-CE2 4.32Å; P263-F310 HydrophobicContact CB-CZ 3.78Å; P263-F310 WeakPolarHBondContact CD-O 3.5Å; P263-F310 HydrophobicContact CG-CD1 4.07Å; P263-F310 HydrophobicContact CG-CD2 3.77Å; P263-F310 HydrophobicContact CG-CE1 3.7Å; P263-F310 HydrophobicContact CG-CE2 3.39Å; P263-F310 HydrophobicContact CG-CG 4.11Å; P263-F310 HydrophobicContact CG-CZ 3.35Å; P263-F310 WeakPolarHBondContact CG-O 3.37Å; P263-F310 PolarHBondContact O-N 2.93Å; L272-F310 HydrophobicContact CD2-CB 3.96Å; L272-F310 HydrophobicContact CD2-CD1 3.93Å; L272-F310 HydrophobicContact CD2-CD2 4.39Å; L272-F310 HydrophobicContact CD2-CG 3.86Å; F280-F310 HydrophobicContact CE1-CE2 4.23Å; F280-F310 HydrophobicContact CE1-CZ 4.1Å; F280-F310 AromaticContact CZ-CE2 3.91Å; F280-F310 HydrophobicContact CZ-CE2 3.91Å; F280-F310 HydrophobicContact CZ-CZ 4.25Å; V289-F310 HydrophobicContact CG1-CB 4.09Å; V289-F310 HydrophobicContact CG1-CD2 4.22Å; V289-F310 HydrophobicContact CG2-CD2 4.12Å; S291-F310 CarbonylContact O-C 3.54Å; S291-F310 VanDerWaalsContact O-CA 3.26Å; S291-F310 WeakPolarHBondContact O-CA 3.41Å; S291-F310 WeakPolarHBondContact O-CB 2.98Å; V292-F310 HydrophobicContact CG2-CB 4.11Å; F310-V312 HydrophobicContact CD2-CG1 3.82Å; F310-V312 HydrophobicContact CE2-CG1 3.88Å; F310-A326 HydrophobicContact CZ-CB 4.13Å
311	N	96.2	Very high	90.9	Very high	13 Å²	13	47.5 Å²	47.5	7%	0.07	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	132.6	-179.3	-178.7	-85.9	0	0	0	111	I259 V289 K290 S291	I259-N311 HydrophobicContact CG2-CB 4.45Å; I259-N311 WeakPolarHBondContact CG2-ND2 3.25Å; I259-N311 PolarHBondContact O-ND2 2.85Å; V289-N311 CarbonylContact C-O 3.52Å; V289-N311 WeakPolarHBondContact CA-O 3.27Å; K290-N311 HydrophobicContact CB-CB 4.19Å; K290-N311 WeakPolarHBondContact CB-OD1 3.26Å; K290-N311 PolarHBondContact N-O 2.99Å; S291-N311 PolarHBondContact O-N 3.01Å; S291-N311 WeakPolarHBondContact OG-CB 3.35Å
312	V	95.1	Very high	90.8	Very high	3 Å²	3	51.2 Å²	51.2	2%	0.018	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	139.6	173	-67.7	0	0	0	0	111.8	T261 P263 F280 T287 V289 F310 V315	T261-V312 HydrophobicContact CG2-CG2 3.96Å; T261-V312 WeakPolarHBondContact O-CG2 3.45Å; T261-V312 PolarHBondContact O-N 3.46Å; T261-V312 VanDerWaalsContact O-N 3.08Å; P263-V312 HydrophobicContact CG-CG1 4.44Å; P263-V312 HydrophobicContact CG-CG2 4.3Å; F280-V312 HydrophobicContact CE2-CG1 4.37Å; F280-V312 HydrophobicContact CZ-CG1 4.09Å; T287-V312 HydrophobicContact CG2-CB 3.65Å; T287-V312 HydrophobicContact CG2-CG1 3.7Å; V289-V312 HydrophobicContact CG2-CG1 4.49Å; F310-V312 HydrophobicContact CD2-CG1 3.82Å; F310-V312 HydrophobicContact CE2-CG1 3.88Å; V312-V315 HydrophobicContact CG2-CB 4.12Å; V312-V315 HydrophobicContact CG2-CG2 4.26Å
313	K	86.7	Confident	90.9	Very high	101 Å²	101	51.5 Å²	51.5	44%	0.439	25%	0.253	S	S	.	.	S	Bend	trans	-90.5	150.1	178.9	-69.4	-156.8	179.2	-175	0	112.8	T287 K290 V315	T287-K313 PolarHBondContact OG1-O 2.78Å; K290-K313 HydrophobicContact CD-CD 4.11Å; K290-K313 HydrophobicContact CD-CG 4.28Å; K290-K313 VanDerWaalsContact CE-CD 3.48Å; K290-K313 HydrophobicContact CG-CD 3.99Å; K290-K313 HydrophobicContact CG-CG 3.63Å; K313-V315 WeakPolarHBondContact O-CG2 3.28Å; K313-V315 PolarHBondContact O-N 3.43Å; K313-V315 VanDerWaalsContact O-N 3.14Å
314	N	88.9	Confident	91.2	Very high	97 Å²	97	48.9 Å²	48.9	52%	0.519	24%	0.239	S	C	.	.	S	Bend	trans	57.9	26.8	169.9	-53.6	-48.4	0	0	0	114.6	T452 S454	N314-T452 HydrophobicContact CB-CG2 4.03Å; N314-S454 PolarHBondContact ND2-OG 2.64Å
315	V	93.7	Very high	91.6	Very high	10 Å²	10	48.7 Å²	48.7	6%	0.061	24%	0.238	C	C	.	.			trans	-119	131.1	173	-174.6	0	0	0	0	107.5	T261 L285 T287 V312 K313 E319 I320 T452	T261-V315 WeakPolarHBondContact CB-O 3.45Å; T261-V315 PolarHBondContact OG1-O 3.22Å; L285-V315 HydrophobicContact CD1-CG1 3.98Å; L285-V315 HydrophobicContact CD1-CG2 4.39Å; L285-V315 HydrophobicContact CD2-CB 4.39Å; L285-V315 HydrophobicContact CD2-CG1 4.09Å; L285-V315 HydrophobicContact CD2-CG2 3.42Å; L285-V315 VanDerWaalsContact CD2-CG2 3.42Å; T287-V315 HydrophobicContact CG2-CG2 3.8Å; V312-V315 HydrophobicContact CG2-CB 4.12Å; V312-V315 HydrophobicContact CG2-CG2 4.26Å; K313-V315 WeakPolarHBondContact O-CG2 3.28Å; K313-V315 PolarHBondContact O-N 3.43Å; K313-V315 VanDerWaalsContact O-N 3.14Å; V315-E319 HydrophobicContact CG1-CB 4.28Å; V315-I320 HydrophobicContact CG1-CD1 4.2Å; V315-I320 HydrophobicContact CG1-CG1 4.13Å; V315-I320 HydrophobicContact CG1-CG2 4.12Å; V315-T452 HydrophobicContact CG2-CG2 4.15Å
316	S	93.2	Very high	92.4	Very high	52 Å²	52	48.1 Å²	48.1	36%	0.364	23%	0.232	S	C	.	.			trans	-85.3	147.1	172	174.9	0	0	0	0	110.4	K318 E319	S316-K318 PolarHBondContact O-N 3.13Å; S316-K318 PolarHBondContact OG-N 2.71Å; S316-E319 WeakPolarHBondContact CB-OE2 3.48Å; S316-E319 PolarHBondContact N-OE2 2.79Å; S316-E319 WeakPolarHBondContact O-CB 3.2Å; S316-E319 PolarHBondContact O-N 3.18Å
317	V	91.8	Very high	93.1	Very high	48 Å²	48	46.5 Å²	46.5	29%	0.291	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-14.7	172.8	-62	0	0	0	0	114	V253 K255 T261	V253-V317 HydrophobicContact CG1-CB 4.21Å; V253-V317 HydrophobicContact CG1-CG1 4.01Å; K255-V317 HydrophobicContact CB-CG1 3.75Å; T261-V317 HydrophobicContact CG2-CG1 3.96Å; T261-V317 WeakPolarHBondContact OG1-CG1 3.33Å
318	K	93.3	Very high	93.8	Very high	193 Å²	193	44.5 Å²	44.5	84%	0.839	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-16.9	175.2	-62.4	-175.5	179.4	-177.4	0	113.3	S316	S316-K318 PolarHBondContact O-N 3.13Å; S316-K318 PolarHBondContact OG-N 2.71Å
319	E	94	Very high	94.1	Very high	66 Å²	66	45.9 Å²	45.9	31%	0.308	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-20.3	-175.2	-64.6	179.6	106.1	0	0	112.8	L285 V315 S316 K450	L285-E319 HydrophobicContact CD1-CB 3.96Å; V315-E319 HydrophobicContact CG1-CB 4.28Å; S316-E319 WeakPolarHBondContact CB-OE2 3.48Å; S316-E319 PolarHBondContact N-OE2 2.79Å; S316-E319 WeakPolarHBondContact O-CB 3.2Å; S316-E319 PolarHBondContact O-N 3.18Å; E319-K450 VanDerWaalsContact CD-NZ 3.3Å; E319-K450 WeakPolarHBondContact OE1-CD 3.38Å; E319-K450 IonicContact OE1-NZ 2.64Å; E319-K450 PolarHBondContact OE1-NZ 3.42Å; E319-K450 IonicContact OE2-NZ 2.74Å; E319-K450 PolarHBondContact OE2-NZ 2.98Å; E319-K450 VanDerWaalsContact OE2-NZ 3.16Å
320	I	95.9	Very high	94.1	Very high	3 Å²	3	50.2 Å²	50.2	2%	0.015	24%	0.236	C	C	.	.			trans	-129.1	151.2	177	56.7	167.7	0	0	0	109.4	L250 V253 T261 P263 F280 V315 N324	L250-I320 HydrophobicContact CD1-CB 4.3Å; L250-I320 HydrophobicContact CD1-CD1 4.23Å; V253-I320 HydrophobicContact CG1-CD1 3.79Å; V253-I320 HydrophobicContact CG1-CG1 3.88Å; V253-I320 HydrophobicContact CG2-CD1 4.07Å; V253-I320 HydrophobicContact CG2-CG1 4.06Å; T261-I320 HydrophobicContact CG2-CD1 4.01Å; P263-I320 HydrophobicContact CB-CD1 4.2Å; P263-I320 HydrophobicContact CG-CD1 4.3Å; F280-I320 HydrophobicContact CB-CG2 4.05Å; F280-I320 HydrophobicContact CD1-CG2 4.11Å; F280-I320 HydrophobicContact CD2-CG2 4.11Å; F280-I320 HydrophobicContact CE1-CD1 4.32Å; F280-I320 HydrophobicContact CG-CG2 3.84Å; F280-I320 HydrophobicContact CZ-CD1 4.31Å; V315-I320 HydrophobicContact CG1-CD1 4.2Å; V315-I320 HydrophobicContact CG1-CG1 4.13Å; V315-I320 HydrophobicContact CG1-CG2 4.12Å; I320-N324 WeakPolarHBondContact CA-OD1 3.47Å
321	R	93.8	Very high	93.9	Very high	137 Å²	137	54 Å²	54	52%	0.517	26%	0.257	S	S	.	.			trans	-150.6	169.7	-177.6	62.4	176.6	-173.7	-153.2	-2.6	112	G323 N324	R321-G323 PolarHBondContact O-N 2.81Å; R321-N324 PolarHBondContact N-OD1 2.8Å; R321-N324 VanDerWaalsContact O-CB 3.27Å; R321-N324 WeakPolarHBondContact O-CB 3.36Å; R321-N324 VanDerWaalsContact O-CG 3.25Å; R321-N324 PolarHBondContact O-N 3.5Å; R321-N324 PolarHBondContact O-OD1 3.24Å
322	R	91	Very high	93.8	Very high	149 Å²	149	56.2 Å²	56.2	56%	0.562	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47	136.4	166.7	179.9	171.5	178.5	156.2	-0.7	111.3	Q251 N324	Q251-R322 VanDerWaalsContact O-CB 3.24Å; Q251-R322 WeakPolarHBondContact O-CB 3.43Å; Q251-R322 WeakPolarHBondContact O-CD 3.35Å; Q251-R322 WeakPolarHBondContact O-CG 3.19Å; R322-N324 VanDerWaalsContact C-N 3.31Å
323	G	91.1	Very high	93.8	Very high	7 Å²	7	57.8 Å²	57.8	7%	0.072	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.6	-6.5	-176.9	0	0	0	0	0	114.7	L250 R321 H364 T365	L250-G323 PolarHBondContact O-N 3.39Å; R321-G323 PolarHBondContact O-N 2.81Å; G323-H364 PolarHBondContact O-CE1 2.83Å; G323-T365 WeakPolarHBondContact CA-OG1 3.39Å; G323-T365 PolarHBondContact N-OG1 2.74Å
324	N	97.4	Very high	94.3	Very high	5 Å²	5	53.1 Å²	53.1	3%	0.027	26%	0.258	C	S	.	.			trans	-73.7	157.6	165.3	-63.6	169.1	0	0	0	110.2	P249 L250 A281 I320 R321 R322	P249-N324 CarbonylContact C-O 3.57Å; P249-N324 WeakPolarHBondContact CA-O 3.48Å; L250-N324 HydrophobicContact CD1-CB 4.1Å; L250-N324 HydrophobicContact CG-CB 4.32Å; L250-N324 WeakPolarHBondContact CG-O 3.31Å; L250-N324 PolarHBondContact N-O 3.27Å; A281-N324 CarbonylContact O-C 3.56Å; A281-N324 WeakPolarHBondContact O-CA 3.48Å; A281-N324 VanDerWaalsContact O-CB 3.3Å; A281-N324 WeakPolarHBondContact O-CB 3.38Å; I320-N324 WeakPolarHBondContact CA-OD1 3.47Å; R321-N324 PolarHBondContact N-OD1 2.8Å; R321-N324 VanDerWaalsContact O-CB 3.27Å; R321-N324 WeakPolarHBondContact O-CB 3.36Å; R321-N324 VanDerWaalsContact O-CG 3.25Å; R321-N324 PolarHBondContact O-N 3.5Å; R321-N324 PolarHBondContact O-OD1 3.24Å; R322-N324 VanDerWaalsContact C-N 3.31Å
325	V	98	Very high	94.7	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	123.3	-179.3	179.7	0	0	0	0	108.4	R247 P249 F280 A281 P334 C411 L421	R247-V325 HydrophobicContact CB-CG1 4.5Å; P249-V325 HydrophobicContact CB-CG2 4.49Å; F280-V325 WeakPolarHBondContact CA-O 3.38Å; A281-V325 PolarHBondContact N-O 3.05Å; A281-V325 PolarHBondContact O-N 2.86Å; V325-P334 HydrophobicContact CB-CB 4.34Å; V325-P334 HydrophobicContact CG1-CB 3.98Å; V325-P334 HydrophobicContact CG1-CG 4.2Å; V325-C411 HydrophobicContact CB-CB 4.25Å; V325-C411 HydrophobicContact CG2-CB 3.94Å; V325-L421 HydrophobicContact CB-CD2 4.48Å; V325-L421 HydrophobicContact CG1-CD2 3.71Å; V325-L421 HydrophobicContact CG2-CD2 3.95Å
326	A	97.9	Very high	94.8	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.008	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	142.5	169.7	0	0	0	0	0	110.2	L248 L250 T279 F280 F310	L248-A326 HydrophobicContact CB-CB 4.33Å; L248-A326 PolarHBondContact N-O 3.47Å; L248-A326 PolarHBondContact O-N 2.76Å; L250-A326 HydrophobicContact CD2-CB 4.5Å; T279-A326 WeakPolarHBondContact O-CA 3.43Å; F280-A326 HydrophobicContact CD1-CB 3.79Å; F280-A326 HydrophobicContact CE1-CB 3.66Å; F280-A326 HydrophobicContact CZ-CB 4.46Å; F310-A326 HydrophobicContact CZ-CB 4.13Å
327	G	97.6	Very high	94.9	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	169.6	170.7	0	0	0	0	0	111.5	L246 V278 T279 S329	L246-G327 WeakPolarHBondContact O-CA 3.23Å; V278-G327 CarbonylContact C-O 3.58Å; V278-G327 WeakPolarHBondContact CA-O 3.33Å; V278-G327 WeakPolarHBondContact CB-O 3.47Å; T279-G327 PolarHBondContact N-O 3.33Å; T279-G327 PolarHBondContact O-N 2.7Å; G327-S329 PolarHBondContact O-N 3.06Å
328	D	95.9	Very high	95.1	Very high	33 Å²	33	52 Å²	52	18%	0.176	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	127.6	-179.8	-174.5	-14.3	0	0	0	109.5	L246 M276 K330 N331 P333	L246-D328 HydrophobicContact CB-CB 4.24Å; M276-D328 HydrophobicContact CE-CB 3.88Å; M276-D328 WeakPolarHBondContact CE-OD2 3.4Å; D328-K330 PolarHBondContact O-N 2.87Å; D328-K330 WeakPolarHBondContact OD1-CB 3.17Å; D328-K330 PolarHBondContact OD1-N 3.46Å; D328-N331 HydrophobicContact CB-CB 4.33Å; D328-N331 PolarHBondContact O-N 3.08Å; D328-P333 WeakPolarHBondContact O-CA 3.48Å
329	S	93.8	Very high	95.3	Very high	30 Å²	30	44.5 Å²	44.5	21%	0.21	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-19.6	179.5	69.3	0	0	0	0	112.9	V277 T279 G327	V277-S329 WeakPolarHBondContact CB-OG 3.32Å; V277-S329 VanDerWaalsContact CG1-OG 3.28Å; V277-S329 WeakPolarHBondContact CG1-OG 3.34Å; V277-S329 PolarHBondContact O-N 3.29Å; V277-S329 PolarHBondContact O-OG 3.49Å; T279-S329 WeakPolarHBondContact OG1-CB 3.48Å; G327-S329 PolarHBondContact O-N 3.06Å
330	K	92.8	Very high	95.5	Very high	107 Å²	107	41.4 Å²	41.4	47%	0.465	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-11.7	-174.1	-59.8	-174.5	-178.6	-173.6	0	113.8	D328 D459	D328-K330 PolarHBondContact O-N 2.87Å; D328-K330 WeakPolarHBondContact OD1-CB 3.17Å; D328-K330 PolarHBondContact OD1-N 3.46Å; K330-D459 WeakPolarHBondContact CE-OD1 3.37Å; K330-D459 IonicContact NZ-OD1 2.75Å; K330-D459 PolarHBondContact NZ-OD1 2.74Å
331	N	93.4	Very high	95.6	Very high	80 Å²	80	42 Å²	42	43%	0.428	20%	0.203	S	C	.	.	S	Bend	trans	-137.4	98.3	-175.8	-173.4	13.6	0	0	0	109.7	P245 D328	P245-N331 WeakPolarHBondContact CB-O 3.25Å; D328-N331 HydrophobicContact CB-CB 4.33Å; D328-N331 PolarHBondContact O-N 3.08Å
332	D	94.7	Very high	95.7	Very high	58 Å²	58	35.4 Å²	35.4	31%	0.31	18%	0.178	S	C	.	.	S	Bend	trans	40.5	69.6	-176.4	-179.4	40.8	0	0	0	113.1	P245 R247 Y418 K443	P245-D332 HydrophobicContact CB-CB 4.13Å; P245-D332 HydrophobicContact CG-CB 3.98Å; R247-D332 VanDerWaalsContact CZ-O 3.26Å; R247-D332 IonicContact CZ-OD2 2.78Å; R247-D332 PolarHBondContact NH1-O 2.83Å; R247-D332 PolarHBondContact NH2-O 3.47Å; R247-D332 IonicContact NH2-OD1 3.63Å; R247-D332 IonicContact NH2-OD2 3.82Å; R247-D332 PolarHBondContact NH2-OD2 2.99Å; D332-Y418 WeakPolarHBondContact OD2-CE2 3.21Å; D332-Y418 PolarHBondContact OD2-OH 2.89Å; D332-K443 IonicContact OD1-NZ 3.78Å
333	P	95.8	Very high	95.8	Very high	37 Å²	37	30 Å²	30	24%	0.24	16%	0.16	C	C	.	.			trans	-60.5	141.9	179.4	23	-32.4	0	0	0	111.5	D328	D328-P333 WeakPolarHBondContact O-CA 3.48Å
334	P	96.8	Very high	95.9	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.013	16%	0.156	C	C	.	.			trans	-63.3	147.9	176.2	28.3	-35.3	0	0	0	110.1	A281 V325	A281-P334 HydrophobicContact CB-CB 3.78Å; A281-P334 HydrophobicContact CB-CG 4.03Å; A281-P334 WeakPolarHBondContact CB-O 3.47Å; V325-P334 HydrophobicContact CB-CB 4.34Å; V325-P334 HydrophobicContact CG1-CB 3.98Å; V325-P334 HydrophobicContact CG1-CG 4.2Å
335	Q	96.3	Very high	95.5	Very high	56 Å²	56	30.3 Å²	30.3	26%	0.262	16%	0.159	S	C	.	.			trans	-132.8	161.9	-178.3	-62.9	177.7	9.5	0	0	110.9	C411 K443	Q335-C411 PolarHBondContact O-SG 3.05Å; Q335-K443 HydrophobicContact CB-CB 4.17Å; Q335-K443 HydrophobicContact CB-CD 4.05Å; Q335-K443 HydrophobicContact CB-CG 4.26Å; Q335-K443 HydrophobicContact CG-CD 4.37Å
336	A	96	Very high	95.1	Very high	18 Å²	18	30.3 Å²	30.3	15%	0.149	16%	0.159	C	C	.	.			trans	-67.8	139.6	171.7	0	0	0	0	0	110	P282 M410 K444	P282-A336 HydrophobicContact CB-CB 3.58Å; A336-M410 CarbonylContact C-O 3.6Å; A336-M410 WeakPolarHBondContact CA-O 3.37Å; A336-K444 HydrophobicContact CB-CB 4.25Å; A336-K444 PolarHBondContact O-N 3.43Å
337	A	96.5	Very high	94.4	Very high	8 Å²	8	31.5 Å²	31.5	7%	0.066	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	129.6	169.5	0	0	0	0	0	109.5	M410 V412 V441	A337-M410 PolarHBondContact N-O 3.29Å; A337-V412 HydrophobicContact CB-CG2 3.62Å; A337-V441 HydrophobicContact CB-CG1 3.64Å
338	E	95.9	Very high	93.4	Very high	103 Å²	103	34.8 Å²	34.8	48%	0.481	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-50.2	168.2	177.5	158.8	-169.1	0	0	110	E442 K444	E338-E442 PolarHBondContact N-O 2.83Å; E338-K444 HydrophobicContact CB-CB 4.25Å
339	N	97.1	Very high	92.7	Very high	34 Å²	34	34.3 Å²	34.3	18%	0.182	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	170.4	167.6	68	67.3	0	0	0	109.4	T403 M404 V405 E442	N339-T403 HydrophobicContact CB-CG2 4.48Å; N339-M404 VanDerWaalsContact CA-O 3.31Å; N339-M404 WeakPolarHBondContact CA-O 3.41Å; N339-M404 WeakPolarHBondContact CB-O 3.46Å; N339-V405 HydrophobicContact CB-CG2 4.04Å; N339-E442 PolarHBondContact ND2-OE2 3.44Å; N339-E442 PolarHBondContact O-N 3.16Å
340	F	98.1	Very high	91.9	Very high	1 Å²	1	38.5 Å²	38.5	0%	0.004	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	147.9	173.9	58.4	-87	0	0	0	111	A342 L361 M404 P406 V412 F424 I438 T440 V441	F340-A342 HydrophobicContact CD2-CB 4.3Å; F340-A342 HydrophobicContact CE2-CB 4.44Å; F340-L361 HydrophobicContact CE2-CD2 4.23Å; F340-L361 HydrophobicContact CZ-CD2 3.74Å; F340-M404 HydrophobicContact CD1-CB 4.46Å; F340-M404 HydrophobicContact CD2-CB 4.15Å; F340-M404 HydrophobicContact CD2-SD 4.31Å; F340-M404 HydrophobicContact CE1-CB 4.03Å; F340-M404 HydrophobicContact CE2-CB 3.71Å; F340-M404 HydrophobicContact CE2-CG 4.17Å; F340-M404 HydrophobicContact CE2-SD 3.41Å; F340-M404 WeakPolarHBondContact CE2-SD 3.2Å; F340-M404 HydrophobicContact CZ-CB 3.63Å; F340-M404 HydrophobicContact CZ-CG 4.39Å; F340-M404 HydrophobicContact CZ-SD 3.84Å; F340-M404 PolarHBondContact N-O 3.47Å; F340-M404 PolarHBondContact O-N 3.33Å; F340-P406 HydrophobicContact CD1-CG 4.37Å; F340-P406 HydrophobicContact CE1-CG 3.98Å; F340-V412 HydrophobicContact CB-CG2 4.42Å; F340-V412 HydrophobicContact CD1-CG2 3.84Å; F340-V412 HydrophobicContact CE1-CG2 4.29Å; F340-V412 HydrophobicContact CG-CG2 4.14Å; F340-F424 HydrophobicContact CE2-CE1 4.12Å; F340-F424 HydrophobicContact CE2-CZ 4.34Å; F340-I438 HydrophobicContact CB-CG2 4.13Å; F340-I438 HydrophobicContact CD2-CD1 3.95Å; F340-I438 HydrophobicContact CD2-CG1 3.9Å; F340-I438 HydrophobicContact CD2-CG2 4.27Å; F340-I438 HydrophobicContact CE2-CD1 4.12Å; F340-I438 HydrophobicContact CE2-CG1 4.18Å; F340-I438 HydrophobicContact CG-CD1 4.44Å; F340-T440 CarbonylContact C-O 3.6Å; F340-T440 WeakPolarHBondContact CA-O 3.09Å; F340-T440 WeakPolarHBondContact CB-O 3.29Å; F340-V441 HydrophobicContact CB-CB 4.36Å; F340-V441 HydrophobicContact CB-CG1 4.39Å; F340-V441 HydrophobicContact CB-CG2 3.99Å
341	T	97.9	Very high	91.6	Very high	15 Å²	15	35.1 Å²	35.1	9%	0.092	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	128.4	173.9	-59	0	0	0	0	109	K376 I401 I402 K439 T440	T341-K376 HydrophobicContact CG2-CD 4.34Å; T341-K376 PolarHBondContact OG1-NZ 3.28Å; T341-I401 HydrophobicContact CG2-CG2 3.37Å; T341-I402 WeakPolarHBondContact CA-O 3.32Å; T341-K439 PolarHBondContact O-N 2.76Å; T341-T440 WeakPolarHBondContact CB-OG1 3.48Å; T341-T440 PolarHBondContact N-O 2.92Å; T341-T440 PolarHBondContact O-N 3.44Å
342	A	96.6	Very high	91.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	148.2	-177.3	0	0	0	0	0	112.1	F340 V344 I401 I402 M404 F424 V437 I438	F340-A342 HydrophobicContact CD2-CB 4.3Å; F340-A342 HydrophobicContact CE2-CB 4.44Å; A342-V344 HydrophobicContact CB-CG2 4.14Å; A342-I401 CarbonylContact O-C 3.55Å; A342-I401 WeakPolarHBondContact O-CA 3.28Å; A342-I402 PolarHBondContact N-O 3.32Å; A342-I402 PolarHBondContact O-N 2.79Å; A342-M404 HydrophobicContact CB-SD 4.36Å; A342-F424 HydrophobicContact CB-CE1 3.49Å; A342-F424 VanDerWaalsContact CB-CE1 3.49Å; A342-F424 HydrophobicContact CB-CZ 3.49Å; A342-F424 VanDerWaalsContact CB-CZ 3.49Å; A342-V437 CarbonylContact C-O 3.52Å; A342-V437 WeakPolarHBondContact CA-O 3.35Å; A342-I438 HydrophobicContact CB-CG1 4.45Å
343	Q	92.5	Very high	91.4	Very high	35 Å²	35	35.7 Å²	35.7	16%	0.164	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	120.4	164.4	177	177.3	-10.4	0	0	108.3	I379 A400 I401 G436 V437 K439	Q343-I379 HydrophobicContact CG-CD1 3.68Å; Q343-A400 CarbonylContact C-O 3.57Å; Q343-A400 WeakPolarHBondContact CA-O 3.37Å; Q343-I401 HydrophobicContact CB-CD1 3.72Å; Q343-I401 HydrophobicContact CG-CD1 4.09Å; Q343-G436 CarbonylContact O-C 3.56Å; Q343-G436 WeakPolarHBondContact O-CA 3.35Å; Q343-V437 HydrophobicContact CB-CG2 3.97Å; Q343-V437 PolarHBondContact N-O 2.69Å; Q343-V437 PolarHBondContact O-N 2.85Å; Q343-K439 HydrophobicContact CB-CG 4.37Å
344	V	92.7	Very high	91.3	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	134.6	-173.4	-174.6	0	0	0	0	109.4	A342 I346 A399 A400 I402 M404 F424 A434 V435	A342-V344 HydrophobicContact CB-CG2 4.14Å; V344-I346 HydrophobicContact CG1-CD1 3.98Å; V344-A399 CarbonylContact O-C 3.51Å; V344-A399 VanDerWaalsContact O-CA 3.25Å; V344-A399 WeakPolarHBondContact O-CA 3.17Å; V344-A400 PolarHBondContact N-O 3.15Å; V344-A400 PolarHBondContact O-N 3.27Å; V344-I402 HydrophobicContact CB-CD1 3.84Å; V344-I402 HydrophobicContact CB-CG1 4.42Å; V344-I402 HydrophobicContact CG1-CD1 4.29Å; V344-I402 HydrophobicContact CG2-CB 4.26Å; V344-I402 HydrophobicContact CG2-CD1 3.92Å; V344-I402 HydrophobicContact CG2-CG1 4.23Å; V344-M404 HydrophobicContact CG2-CE 3.61Å; V344-F424 HydrophobicContact CG2-CE2 4.37Å; V344-F424 HydrophobicContact CG2-CZ 3.97Å; V344-A434 HydrophobicContact CG1-CB 3.57Å; V344-V435 CarbonylContact C-O 3.59Å; V344-V435 WeakPolarHBondContact CA-O 3.13Å
345	I	88.9	Confident	91.3	Very high	18 Å²	18	42.5 Å²	42.5	9%	0.092	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	117.6	173.8	-56.1	174.5	0	0	0	107.4	L138 L347 R381 A399 A434 V435	L138-I345 HydrophobicContact CD1-CD1 4.49Å; I345-L347 HydrophobicContact CG2-CD2 4.37Å; I345-L347 PolarHBondContact O-N 3.14Å; I345-R381 HydrophobicContact CD1-CG 4.04Å; I345-R381 HydrophobicContact CG1-CG 4.47Å; I345-R381 HydrophobicContact CG2-CG 4.5Å; I345-A399 HydrophobicContact CG1-CB 4.22Å; I345-A434 WeakPolarHBondContact O-CA 3.47Å; I345-A434 VanDerWaalsContact O-CB 3.28Å; I345-A434 WeakPolarHBondContact O-CB 3.46Å; I345-V435 HydrophobicContact CB-CG2 4.39Å; I345-V435 PolarHBondContact N-O 2.87Å; I345-V435 PolarHBondContact O-N 3.35Å
346	I	90.4	Very high	91.1	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	122.7	176.3	-47.3	-51	0	0	0	108.1	V344 H349 I353 L394 K395 G397 D398 A434	V344-I346 HydrophobicContact CG1-CD1 3.98Å; I346-H349 HydrophobicContact CG2-CB 4.18Å; I346-I353 HydrophobicContact CD1-CD1 3.82Å; I346-I353 HydrophobicContact CG1-CD1 4.4Å; I346-I353 HydrophobicContact CG2-CD1 3.9Å; I346-L394 HydrophobicContact CD1-CD1 4.34Å; I346-L394 HydrophobicContact CG1-CB 4.07Å; I346-L394 HydrophobicContact CG1-CD1 4.42Å; I346-K395 WeakPolarHBondContact CB-O 3.4Å; I346-G397 WeakPolarHBondContact O-CA 3.2Å; I346-G397 PolarHBondContact O-N 3.39Å; I346-D398 PolarHBondContact N-O 2.71Å; I346-A434 HydrophobicContact CD1-CB 3.79Å
347	L	83.4	Confident	91.1	Very high	25 Å²	25	42.4 Å²	42.4	13%	0.131	24%	0.24	C	C	.	.			trans	-88.4	-100.1	-178.6	-61.4	-177.4	0	0	0	109.2	L138 L139 I345 S396 T432 V433 V435	L138-L347 HydrophobicContact CD2-CD2 3.38Å; L138-L347 HydrophobicContact CG-CD2 4.32Å; L139-L347 HydrophobicContact CD2-CD1 3.91Å; I345-L347 HydrophobicContact CG2-CD2 4.37Å; I345-L347 PolarHBondContact O-N 3.14Å; L347-S396 WeakPolarHBondContact O-CA 3.32Å; L347-S396 WeakPolarHBondContact O-CB 3.34Å; L347-S396 PolarHBondContact O-OG 2.84Å; L347-T432 HydrophobicContact CD1-CG2 4.05Å; L347-V433 PolarHBondContact N-O 3.48Å; L347-V435 HydrophobicContact CD1-CG1 4.23Å; L347-V435 HydrophobicContact CD1-CG2 4.3Å; L347-V435 HydrophobicContact CD2-CG2 4.3Å; L347-V435 HydrophobicContact CG-CG2 4.4Å
348	N	75.1	Confident	91.1	Very high	70 Å²	70	45 Å²	45	37%	0.374	26%	0.261	S	S	.	.			trans	-122.6	91	-175.3	-158.6	16.5	0	0	0	109.2
349	H	82.4	Confident	91	Very high	23 Å²	23	40.3 Å²	40.3	11%	0.106	24%	0.24	C	C	.	.			trans	-112.2	131.2	174.1	-173.9	-89.2	0	0	0	109.1	I346 G351 I353 S396 V433	I346-H349 HydrophobicContact CG2-CB 4.18Å; H349-G351 VanDerWaalsContact C-N 3.32Å; H349-G351 PolarHBondContact ND1-N 3.38Å; H349-G351 VanDerWaalsContact ND1-N 3.16Å; H349-G351 PolarHBondContact ND1-O 3.23Å; H349-G351 PolarHBondContact O-N 2.83Å; H349-I353 HydrophobicContact CB-CD1 4.33Å; H349-S396 PolarHBondContact N-OG 3.45Å; H349-S396 PolarHBondContact O-OG 3.21Å; H349-V433 HydrophobicContact CB-CB 4.32Å
350	P	76.1	Confident	90.8	Very high	117 Å²	117	40.8 Å²	40.8	76%	0.76	24%	0.244	S	C	*	.	S	Bend	trans	-73	-23.8	-173.6	28.3	-34.8	0	0	0	113.5
351	G	86.8	Confident	90.6	Very high	36 Å²	36	40.8 Å²	40.8	37%	0.371	24%	0.244	S	C	.	.	S	Bend	trans	-116.2	-153	178.1	0	0	0	0	0	112.8	H349	H349-G351 VanDerWaalsContact C-N 3.32Å; H349-G351 PolarHBondContact ND1-N 3.38Å; H349-G351 VanDerWaalsContact ND1-N 3.16Å; H349-G351 PolarHBondContact ND1-O 3.23Å; H349-G351 PolarHBondContact O-N 2.83Å
352	Q	90.4	Very high	90.2	Very high	149 Å²	149	41.3 Å²	41.3	70%	0.696	25%	0.246	S	C	*	.			trans	-105.9	145	174.2	-64.1	179.5	7.2	0	0	110.3	A393 L394	Q352-A393 HydrophobicContact CB-CB 4.13Å; Q352-L394 WeakPolarHBondContact CA-O 3.46Å
353	I	93.8	Very high	89.9	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	116.8	175	-66.8	168.4	0	0	0	107.8	I346 H349 Y357 F372 A393 L394	I346-I353 HydrophobicContact CD1-CD1 3.82Å; I346-I353 HydrophobicContact CG1-CD1 4.4Å; I346-I353 HydrophobicContact CG2-CD1 3.9Å; H349-I353 HydrophobicContact CB-CD1 4.33Å; I353-Y357 HydrophobicContact CB-CD1 4.37Å; I353-Y357 HydrophobicContact CD1-CD1 4.39Å; I353-Y357 HydrophobicContact CD1-CE1 4.02Å; I353-Y357 HydrophobicContact CG1-CD1 4.1Å; I353-Y357 HydrophobicContact CG1-CE1 3.99Å; I353-Y357 HydrophobicContact CG2-CD1 3.49Å; I353-Y357 VanDerWaalsContact CG2-CD1 3.49Å; I353-Y357 HydrophobicContact CG2-CE1 4.21Å; I353-Y357 HydrophobicContact CG2-CG 3.93Å; I353-F372 HydrophobicContact CG2-CD2 3.94Å; I353-F372 HydrophobicContact CG2-CE2 4.06Å; I353-A393 CarbonylContact O-C 3.17Å; I353-A393 VanDerWaalsContact O-CA 3.29Å; I353-A393 WeakPolarHBondContact O-CA 3.41Å; I353-L394 HydrophobicContact CB-CB 4.36Å; I353-L394 PolarHBondContact N-O 2.91Å; I353-L394 PolarHBondContact O-N 3.18Å
354	A	94.4	Very high	89.7	Confident	46 Å²	46	41.3 Å²	41.3	38%	0.38	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	169.2	177.2	0	0	0	0	0	111.3	G356 Y357	A354-G356 PolarHBondContact O-N 3.47Å; A354-Y357 VanDerWaalsContact O-CB 3.24Å; A354-Y357 WeakPolarHBondContact O-CB 3.37Å; A354-Y357 PolarHBondContact O-N 3.23Å
355	Q	95.3	Very high	89.5	Confident	136 Å²	136	42.4 Å²	42.4	64%	0.636	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	136.7	172.7	-169.6	-178.5	-0.6	0	0	110.7	S373	Q355-S373 WeakPolarHBondContact CG-O 3.44Å; Q355-S373 PolarHBondContact NE2-O 3.26Å
356	G	93.8	Very high	89.6	Confident	33 Å²	33	41.7 Å²	41.7	34%	0.34	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.9	-7.7	-176.3	0	0	0	0	0	115	A354 A358 F372	A354-G356 PolarHBondContact O-N 3.47Å; G356-A358 PolarHBondContact O-N 2.89Å; G356-F372 PolarHBondContact N-O 3.22Å
357	Y	95.3	Very high	89.6	Confident	40 Å²	40	47.2 Å²	47.2	16%	0.157	28%	0.276	C	S	.	.			trans	-54	129.5	170.3	-177.9	-125	0	0	0	110.9	I353 A354 P359 F372 D428	I353-Y357 HydrophobicContact CB-CD1 4.37Å; I353-Y357 HydrophobicContact CD1-CD1 4.39Å; I353-Y357 HydrophobicContact CD1-CE1 4.02Å; I353-Y357 HydrophobicContact CG1-CD1 4.1Å; I353-Y357 HydrophobicContact CG1-CE1 3.99Å; I353-Y357 HydrophobicContact CG2-CD1 3.49Å; I353-Y357 VanDerWaalsContact CG2-CD1 3.49Å; I353-Y357 HydrophobicContact CG2-CE1 4.21Å; I353-Y357 HydrophobicContact CG2-CG 3.93Å; A354-Y357 VanDerWaalsContact O-CB 3.24Å; A354-Y357 WeakPolarHBondContact O-CB 3.37Å; A354-Y357 PolarHBondContact O-N 3.23Å; Y357-P359 VanDerWaalsContact C-CD 3.41Å; Y357-P359 HydrophobicContact CD1-CB 4.38Å; Y357-P359 VanDerWaalsContact CD1-CD 3.45Å; Y357-P359 HydrophobicContact CD1-CG 3.73Å; Y357-P359 HydrophobicContact CE1-CB 3.7Å; Y357-P359 HydrophobicContact CE1-CG 3.44Å; Y357-P359 VanDerWaalsContact CE1-CG 3.44Å; Y357-P359 WeakPolarHBondContact O-CD 3.14Å; Y357-F372 HydrophobicContact CD1-CD1 4.36Å; Y357-F372 HydrophobicContact CD1-CD2 4.22Å; Y357-F372 HydrophobicContact CD1-CE1 4.26Å; Y357-F372 HydrophobicContact CD1-CE2 4.14Å; Y357-F372 HydrophobicContact CD1-CG 4.35Å; Y357-F372 HydrophobicContact CD1-CZ 4.17Å; Y357-F372 HydrophobicContact CE1-CZ 4.5Å; Y357-F372 WeakPolarHBondContact O-CB 3.41Å; Y357-F372 WeakPolarHBondContact O-CD1 3.48Å; Y357-F372 PolarHBondContact O-N 2.79Å; Y357-D428 VanDerWaalsContact CE2-OD2 3.28Å; Y357-D428 WeakPolarHBondContact CE2-OD2 3.39Å; Y357-D428 WeakPolarHBondContact OH-CB 3.35Å; Y357-D428 PolarHBondContact OH-OD2 3.27Å
358	A	95.5	Very high	90.1	Very high	62 Å²	62	46.9 Å²	46.9	51%	0.512	27%	0.273	S	S	.	.			trans	-127.5	64.3	-171.2	0	0	0	0	0	112.9	G356 C370 K371	G356-A358 PolarHBondContact O-N 2.89Å; A358-C370 WeakPolarHBondContact CA-O 3.45Å; A358-K371 HydrophobicContact CB-CB 4.46Å
359	P	94.7	Very high	91.1	Very high	4 Å²	4	45.7 Å²	45.7	3%	0.026	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-74.9	172.4	178.4	34.5	-38.4	0	0	0	111.7	Y357 L361 A369 C370 F372 V426 R427 D428	Y357-P359 VanDerWaalsContact C-CD 3.41Å; Y357-P359 HydrophobicContact CD1-CB 4.38Å; Y357-P359 VanDerWaalsContact CD1-CD 3.45Å; Y357-P359 HydrophobicContact CD1-CG 3.73Å; Y357-P359 HydrophobicContact CE1-CB 3.7Å; Y357-P359 HydrophobicContact CE1-CG 3.44Å; Y357-P359 VanDerWaalsContact CE1-CG 3.44Å; Y357-P359 WeakPolarHBondContact O-CD 3.14Å; P359-L361 HydrophobicContact CG-CD1 4.17Å; P359-A369 WeakPolarHBondContact O-CA 3.24Å; P359-C370 WeakPolarHBondContact CD-O 3.47Å; P359-C370 PolarHBondContact O-N 2.91Å; P359-F372 HydrophobicContact CG-CD1 4.06Å; P359-F372 HydrophobicContact CG-CE1 3.34Å; P359-F372 HydrophobicContact CG-CZ 3.94Å; P359-V426 HydrophobicContact CB-CG1 3.49Å; P359-V426 VanDerWaalsContact CB-CG1 3.49Å; P359-V426 HydrophobicContact CG-CG1 3.22Å; P359-R427 WeakPolarHBondContact CB-O 3.44Å; P359-D428 HydrophobicContact CB-CB 4.42Å
360	V	93.9	Very high	91.8	Very high	44 Å²	44	44.6 Å²	44.6	27%	0.267	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	132.9	172.6	-173.3	0	0	0	0	110.6	H367 A369 R427	V360-H367 WeakPolarHBondContact CG1-CE1 3.27Å; V360-H367 WeakPolarHBondContact CG1-NE2 3.43Å; V360-A369 HydrophobicContact CG2-CB 4.5Å; V360-R427 PolarHBondContact N-O 2.82Å; V360-R427 PolarHBondContact O-N 3.49Å
361	L	93.8	Very high	92.9	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	126.9	173.6	-86	62.1	0	0	0	110.3	F340 P359 H367 I368 C370 F372 M404 F424 A425 V426	F340-L361 HydrophobicContact CE2-CD2 4.23Å; F340-L361 HydrophobicContact CZ-CD2 3.74Å; P359-L361 HydrophobicContact CG-CD1 4.17Å; L361-H367 WeakPolarHBondContact O-CA 3.36Å; L361-I368 PolarHBondContact N-O 3.21Å; L361-I368 PolarHBondContact O-N 2.83Å; L361-C370 HydrophobicContact CD1-CB 3.84Å; L361-C370 HydrophobicContact CD2-CB 3.89Å; L361-C370 HydrophobicContact CG-CB 4.34Å; L361-F372 HydrophobicContact CD1-CE1 4.46Å; L361-M404 HydrophobicContact CD2-SD 3.82Å; L361-F424 HydrophobicContact CD2-CD2 3.57Å; L361-F424 HydrophobicContact CD2-CE2 3.69Å; L361-F424 HydrophobicContact CD2-CG 4.1Å; L361-F424 HydrophobicContact CD2-CZ 4.31Å; L361-F424 HydrophobicContact CG-CD2 3.72Å; L361-F424 HydrophobicContact CG-CE2 4.12Å; L361-F424 HydrophobicContact CG-CG 4.46Å; L361-A425 WeakPolarHBondContact CA-O 3.37Å; L361-V426 HydrophobicContact CD1-CG1 4.22Å; L361-V426 HydrophobicContact CD1-CG2 4.13Å; L361-V426 HydrophobicContact CG-CG2 4.26Å
362	D	88.8	Confident	93.4	Very high	27 Å²	27	42.9 Å²	42.9	14%	0.144	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	108.1	166.3	-73	-56.2	0	0	0	108	A366 H367 F424 A425 R427	D362-A366 WeakPolarHBondContact CA-O 3.37Å; D362-H367 IonicContact OD1-CE1 2.69Å; D362-H367 IonicContact OD1-CG 3.26Å; D362-H367 IonicContact OD1-ND1 3.99Å; D362-H367 PolarHBondContact OD1-ND1 2.62Å; D362-H367 IonicContact OD2-ND1 2.79Å; D362-F424 CarbonylContact O-C 3.51Å; D362-F424 WeakPolarHBondContact O-CA 3.29Å; D362-F424 VanDerWaalsContact O-CB 3.31Å; D362-F424 WeakPolarHBondContact O-CB 3.28Å; D362-A425 HydrophobicContact CB-CB 4.44Å; D362-A425 PolarHBondContact N-O 3.31Å; D362-A425 PolarHBondContact O-N 3.34Å; D362-R427 WeakPolarHBondContact OD2-CD 3.05Å
363	C	90.3	Very high	93.7	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.007	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	126.7	177.1	-168.4	0	0	0	0	108	T365 A366 M410 V412 L421 R423 F424	C363-T365 PolarHBondContact O-N 3.2Å; C363-T365 VanDerWaalsContact O-N 3.1Å; C363-A366 PolarHBondContact N-O 2.63Å; C363-A366 WeakPolarHBondContact O-CA 3.24Å; C363-A366 WeakPolarHBondContact O-CB 3.37Å; C363-A366 PolarHBondContact O-N 3.28Å; C363-M410 HydrophobicContact CB-CE 3.52Å; C363-V412 HydrophobicContact CB-CG1 4.36Å; C363-L421 PolarHBondContact SG-O 2.89Å; C363-L421 VanDerWaalsContact SG-O 3.35Å; C363-R423 PolarHBondContact SG-O 2.79Å; C363-F424 HydrophobicContact CB-CB 3.79Å
364	H	88.4	Confident	93.8	Very high	33 Å²	33	40.9 Å²	40.9	15%	0.153	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.1	-114.9	-169.6	56.2	87.5	0	0	0	112.2	P249 G323 A366 C411	P249-H364 HydrophobicContact CB-CB 4.08Å; P249-H364 HydrophobicContact CG-CB 4.03Å; G323-H364 PolarHBondContact O-CE1 2.83Å; H364-A366 WeakPolarHBondContact CE1-CB 3.4Å; H364-A366 PolarHBondContact ND1-N 3.32Å; H364-C411 PolarHBondContact NE2-O 3.31Å
365	T	87.3	Confident	93.9	Very high	23 Å²	23	39 Å²	39	14%	0.141	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-4.9	174.7	58.5	0	0	0	0	113.7	P249 L250 Q251 G323 C363	P249-T365 HydrophobicContact CB-CG2 4.05Å; P249-T365 WeakPolarHBondContact CB-OG1 3.47Å; L250-T365 WeakPolarHBondContact O-CB 3.35Å; L250-T365 PolarHBondContact O-OG1 3.17Å; Q251-T365 HydrophobicContact CG-CG2 3.75Å; G323-T365 WeakPolarHBondContact CA-OG1 3.39Å; G323-T365 PolarHBondContact N-OG1 2.74Å; C363-T365 PolarHBondContact O-N 3.2Å; C363-T365 VanDerWaalsContact O-N 3.1Å
366	A	91.1	Very high	93.9	Very high	4 Å²	4	35.8 Å²	35.8	3%	0.033	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	144.3	178.8	0	0	0	0	0	112.4	D362 C363 H364 M410	D362-A366 WeakPolarHBondContact CA-O 3.37Å; C363-A366 PolarHBondContact N-O 2.63Å; C363-A366 WeakPolarHBondContact O-CA 3.24Å; C363-A366 WeakPolarHBondContact O-CB 3.37Å; C363-A366 PolarHBondContact O-N 3.28Å; H364-A366 WeakPolarHBondContact CE1-CB 3.4Å; H364-A366 PolarHBondContact ND1-N 3.32Å; A366-M410 HydrophobicContact CB-CE 4.17Å
367	H	90.8	Very high	94	Very high	117 Å²	117	37 Å²	37	54%	0.542	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	92.7	179.6	-176	78.1	0	0	0	108.5	V360 L361 D362	V360-H367 WeakPolarHBondContact CG1-CE1 3.27Å; V360-H367 WeakPolarHBondContact CG1-NE2 3.43Å; L361-H367 WeakPolarHBondContact O-CA 3.36Å; D362-H367 IonicContact OD1-CE1 2.69Å; D362-H367 IonicContact OD1-CG 3.26Å; D362-H367 IonicContact OD1-ND1 3.99Å; D362-H367 PolarHBondContact OD1-ND1 2.62Å; D362-H367 IonicContact OD2-ND1 2.79Å
368	I	94.8	Very high	93.9	Very high	17 Å²	17	36.7 Å²	36.7	9%	0.087	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	132	-168.4	-65.1	179.1	0	0	0	110.8	L361 C370 P406 K408 P409 M410	L361-I368 PolarHBondContact N-O 3.21Å; L361-I368 PolarHBondContact O-N 2.83Å; I368-C370 PolarHBondContact O-N 3.06Å; I368-C370 PolarHBondContact O-SG 3.22Å; I368-P406 HydrophobicContact CG2-CB 4.4Å; I368-K408 HydrophobicContact CG2-CB 4.14Å; I368-P409 WeakPolarHBondContact CD1-O 3.33Å; I368-M410 HydrophobicContact CB-SD 4.17Å; I368-M410 HydrophobicContact CD1-CB 3.66Å; I368-M410 HydrophobicContact CD1-CG 3.81Å; I368-M410 HydrophobicContact CD1-SD 4.37Å; I368-M410 HydrophobicContact CG2-SD 4.43Å
369	A	96.3	Very high	93.6	Very high	46 Å²	46	34.1 Å²	34.1	38%	0.38	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	127.9	171.6	0	0	0	0	0	110.7	P359 V360 G407	P359-A369 WeakPolarHBondContact O-CA 3.24Å; V360-A369 HydrophobicContact CG2-CB 4.5Å; A369-G407 PolarHBondContact O-N 3.43Å
370	C	97.3	Very high	92.8	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	131.3	178.8	-58.9	0	0	0	0	110.1	A358 P359 L361 I368 V405	A358-C370 WeakPolarHBondContact CA-O 3.45Å; P359-C370 WeakPolarHBondContact CD-O 3.47Å; P359-C370 PolarHBondContact O-N 2.91Å; L361-C370 HydrophobicContact CD1-CB 3.84Å; L361-C370 HydrophobicContact CD2-CB 3.89Å; L361-C370 HydrophobicContact CG-CB 4.34Å; I368-C370 PolarHBondContact O-N 3.06Å; I368-C370 PolarHBondContact O-SG 3.22Å; C370-V405 CarbonylContact C-O 3.52Å; C370-V405 WeakPolarHBondContact CA-O 3.36Å
371	K	97.8	Very high	91.9	Very high	117 Å²	117	38.3 Å²	38.3	51%	0.509	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	130.5	177	-174.6	179	-179.5	-178.6	0	109.6	A358 S373 M404 V405	A358-K371 HydrophobicContact CB-CB 4.46Å; K371-S373 VanDerWaalsContact C-N 3.31Å; K371-S373 PolarHBondContact O-N 3.2Å; K371-M404 CarbonylContact O-C 3.3Å; K371-M404 VanDerWaalsContact O-CA 3.28Å; K371-M404 WeakPolarHBondContact O-CA 3.37Å; K371-V405 PolarHBondContact N-O 2.92Å; K371-V405 PolarHBondContact O-N 3.39Å
372	F	97.2	Very high	90.5	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	88.8	170.3	-73	35.4	0	0	0	106.3	I353 G356 Y357 P359 L361 L375 I402 M404 V426	I353-F372 HydrophobicContact CG2-CD2 3.94Å; I353-F372 HydrophobicContact CG2-CE2 4.06Å; G356-F372 PolarHBondContact N-O 3.22Å; Y357-F372 HydrophobicContact CD1-CD1 4.36Å; Y357-F372 HydrophobicContact CD1-CD2 4.22Å; Y357-F372 HydrophobicContact CD1-CE1 4.26Å; Y357-F372 HydrophobicContact CD1-CE2 4.14Å; Y357-F372 HydrophobicContact CD1-CG 4.35Å; Y357-F372 HydrophobicContact CD1-CZ 4.17Å; Y357-F372 HydrophobicContact CE1-CZ 4.5Å; Y357-F372 WeakPolarHBondContact O-CB 3.41Å; Y357-F372 WeakPolarHBondContact O-CD1 3.48Å; Y357-F372 PolarHBondContact O-N 2.79Å; P359-F372 HydrophobicContact CG-CD1 4.06Å; P359-F372 HydrophobicContact CG-CE1 3.34Å; P359-F372 HydrophobicContact CG-CZ 3.94Å; L361-F372 HydrophobicContact CD1-CE1 4.46Å; F372-L375 HydrophobicContact CB-CD2 4.47Å; F372-L375 HydrophobicContact CD2-CD2 4.16Å; F372-I402 HydrophobicContact CB-CG2 4.02Å; F372-I402 HydrophobicContact CD2-CD1 3.66Å; F372-I402 HydrophobicContact CD2-CG2 3.78Å; F372-I402 HydrophobicContact CE2-CD1 3.56Å; F372-I402 HydrophobicContact CE2-CG2 4.42Å; F372-I402 HydrophobicContact CG-CG2 3.93Å; F372-M404 HydrophobicContact CD1-CE 3.89Å; F372-M404 HydrophobicContact CD1-CG 4.34Å; F372-M404 HydrophobicContact CD2-CE 4.44Å; F372-M404 HydrophobicContact CE1-CE 3.37Å; F372-M404 HydrophobicContact CE2-CE 3.97Å; F372-M404 HydrophobicContact CG-CE 4.4Å; F372-M404 HydrophobicContact CZ-CE 3.4Å; F372-V426 HydrophobicContact CE1-CG1 4.3Å; F372-V426 HydrophobicContact CZ-CG1 4.02Å; F372-V426 HydrophobicContact CZ-CG2 4.23Å
373	S	96.7	Very high	89.5	Confident	32 Å²	32	49.1 Å²	49.1	22%	0.224	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	-33.5	-171	58	0	0	0	0	111.9	Q355 K371 T403	Q355-S373 WeakPolarHBondContact CG-O 3.44Å; Q355-S373 PolarHBondContact NE2-O 3.26Å; K371-S373 VanDerWaalsContact C-N 3.31Å; K371-S373 PolarHBondContact O-N 3.2Å; S373-T403 PolarHBondContact N-O 2.94Å; S373-T403 WeakPolarHBondContact OG-CB 3.28Å; S373-T403 WeakPolarHBondContact OG-CG2 2.94Å; S373-T403 PolarHBondContact OG-O 3.47Å
374	E	96.8	Very high	88.5	Confident	76 Å²	76	50.9 Å²	50.9	36%	0.355	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	128.2	-177.2	-172.1	-175.5	-161.9	0	0	110	K376 I402 T403	E374-K376 HydrophobicContact CG-CG 3.95Å; E374-K376 PolarHBondContact O-N 2.82Å; E374-K376 WeakPolarHBondContact OE2-CE 3.25Å; E374-I402 WeakPolarHBondContact O-CA 3.02Å; E374-T403 PolarHBondContact N-O 3.49Å; E374-T403 PolarHBondContact O-N 3.14Å; E374-T403 PolarHBondContact OE2-OG1 2.87Å
375	L	96.9	Very high	88	Confident	7 Å²	7	56.6 Å²	56.6	4%	0.037	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	91.5	170.7	-52.9	-179.2	0	0	0	106.9	F372 N390 P391 L394 I402	F372-L375 HydrophobicContact CB-CD2 4.47Å; F372-L375 HydrophobicContact CD2-CD2 4.16Å; L375-N390 WeakPolarHBondContact O-CA 3.49Å; L375-P391 HydrophobicContact CB-CG 4.11Å; L375-P391 WeakPolarHBondContact CD1-O 3.49Å; L375-P391 WeakPolarHBondContact O-CD 3.38Å; L375-L394 HydrophobicContact CD1-CD1 4.37Å; L375-L394 HydrophobicContact CD1-CG 4.18Å; L375-L394 HydrophobicContact CD2-CD1 3.95Å; L375-I402 HydrophobicContact CD2-CD1 3.89Å; L375-I402 HydrophobicContact CD2-CG1 3.96Å; L375-I402 HydrophobicContact CD2-CG2 4.01Å
376	K	94.9	Very high	88.1	Confident	67 Å²	67	59.4 Å²	59.4	29%	0.291	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	-50.4	-170.5	-74.3	-179.6	161.4	159.4	0	112.7	T341 E374 N390 I401 T403	T341-K376 HydrophobicContact CG2-CD 4.34Å; T341-K376 PolarHBondContact OG1-NZ 3.28Å; E374-K376 HydrophobicContact CG-CG 3.95Å; E374-K376 PolarHBondContact O-N 2.82Å; E374-K376 WeakPolarHBondContact OE2-CE 3.25Å; K376-N390 PolarHBondContact O-N 3.18Å; K376-N390 PolarHBondContact O-OD1 3.46Å; K376-I401 HydrophobicContact CB-CB 4.44Å; K376-I401 HydrophobicContact CB-CG2 4.32Å; K376-I401 WeakPolarHBondContact CB-O 3.35Å; K376-I401 HydrophobicContact CD-CG2 4.41Å; K376-I401 PolarHBondContact N-O 3.41Å; K376-T403 WeakPolarHBondContact CD-OG1 3.47Å; K376-T403 WeakPolarHBondContact CE-OG1 3.41Å; K376-T403 PolarHBondContact NZ-OG1 3.4Å
377	E	95.3	Very high	88	Confident	58 Å²	58	64.4 Å²	64.4	27%	0.271	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	140.8	-172.9	-57.5	-175.4	157.7	0	0	110.3	I379 K386 E388 A400 I401	E377-I379 HydrophobicContact CB-CG2 4.23Å; E377-K386 HydrophobicContact CB-CG 4.46Å; E377-K386 HydrophobicContact CG-CD 4.25Å; E377-K386 WeakPolarHBondContact OE1-CD 3.49Å; E377-K386 VanDerWaalsContact OE1-CE 3.26Å; E377-K386 WeakPolarHBondContact OE1-CE 3.41Å; E377-K386 IonicContact OE1-NZ 2.85Å; E377-K386 PolarHBondContact OE1-NZ 2.85Å; E377-E388 CarbonylContact C-O 3.48Å; E377-E388 WeakPolarHBondContact CA-O 3.32Å; E377-A400 CarbonylContact O-C 3.54Å; E377-A400 WeakPolarHBondContact O-CA 3.41Å; E377-A400 VanDerWaalsContact O-CB 3.24Å; E377-A400 WeakPolarHBondContact O-CB 3.21Å; E377-I401 HydrophobicContact CB-CB 4.18Å; E377-I401 HydrophobicContact CB-CG1 4.26Å; E377-I401 PolarHBondContact N-O 3.2Å; E377-I401 PolarHBondContact O-N 3.47Å
378	K	94	Very high	88.1	Confident	35 Å²	35	63.2 Å²	63.2	15%	0.152	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	134.3	160.1	-169.4	171.9	174.2	154.3	0	108.5	L387 E388 P391 D398	K378-L387 PolarHBondContact O-N 3.29Å; K378-E388 HydrophobicContact CB-CB 3.84Å; K378-E388 PolarHBondContact N-O 2.84Å; K378-E388 PolarHBondContact O-N 3.27Å; K378-P391 HydrophobicContact CB-CB 4.34Å; K378-P391 HydrophobicContact CB-CG 4.11Å; K378-D398 WeakPolarHBondContact CE-OD1 3.47Å; K378-D398 WeakPolarHBondContact CE-OD2 3.41Å; K378-D398 IonicContact NZ-OD1 3.85Å; K378-D398 PolarHBondContact NZ-OD1 2.59Å; K378-D398 IonicContact NZ-OD2 3.64Å; K378-D398 PolarHBondContact NZ-OD2 2.85Å
379	I	88.5	Confident	88.1	Confident	7 Å²	7	67 Å²	67	4%	0.036	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	153.8	-177	66.1	173.6	0	0	0	111	Q343 E377 R381 K385 A399 I401	Q343-I379 HydrophobicContact CG-CD1 3.68Å; E377-I379 HydrophobicContact CB-CG2 4.23Å; I379-R381 PolarHBondContact O-N 3.04Å; I379-K385 CarbonylContact C-O 3.53Å; I379-K385 WeakPolarHBondContact CA-O 3.25Å; I379-A399 HydrophobicContact CD1-CB 4.31Å; I379-A399 HydrophobicContact CG1-CB 3.71Å; I379-A399 PolarHBondContact N-O 2.98Å; I379-A399 VanDerWaalsContact O-O 3.13Å; I379-I401 HydrophobicContact CD1-CD1 4.02Å; I379-I401 HydrophobicContact CD1-CG1 4.48Å; I379-I401 HydrophobicContact CG2-CG1 4.09Å
380	D	78.9	Confident	88	Confident	57 Å²	57	69.3 Å²	69.3	31%	0.305	34%	0.341	S	S	.	.			trans	-69.2	128.6	166.7	175	-104.8	0	0	0	109.5	R382 S383 G384 K385 L387	D380-R382 PolarHBondContact O-N 3.01Å; D380-R382 PolarHBondContact OD1-N 3.26Å; D380-R382 VanDerWaalsContact OD1-N 3.13Å; D380-S383 WeakPolarHBondContact CB-OG 3.38Å; D380-S383 WeakPolarHBondContact OD1-CB 3.15Å; D380-S383 PolarHBondContact OD1-N 3Å; D380-S383 PolarHBondContact OD1-OG 3.07Å; D380-G384 VanDerWaalsContact O-CA 3.23Å; D380-G384 WeakPolarHBondContact O-CA 3.47Å; D380-G384 PolarHBondContact O-N 3.07Å; D380-K385 PolarHBondContact N-O 3.45Å; D380-L387 HydrophobicContact CB-CD1 4.21Å; D380-L387 HydrophobicContact CB-CD2 4.32Å; D380-L387 HydrophobicContact CB-CG 4.32Å
381	R	73.7	Confident	87.9	Confident	79 Å²	79	69.5 Å²	69.5	30%	0.298	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-27.8	-173.7	176	177.9	160.1	-165.2	-12.5	113.7	L138 I345 I379 A399	L138-R381 VanDerWaalsContact CD2-NH2 3.29Å; I345-R381 HydrophobicContact CD1-CG 4.04Å; I345-R381 HydrophobicContact CG1-CG 4.47Å; I345-R381 HydrophobicContact CG2-CG 4.5Å; I379-R381 PolarHBondContact O-N 3.04Å; R381-A399 HydrophobicContact CB-CB 3.99Å
382	R	64.6	Low	87.7	Confident	171 Å²	171	73.2 Å²	73.2	65%	0.645	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-51.6	-174.2	-66.8	-172.5	-173.2	145.4	17.6	112.4	K180 D380	K180-R382 VanDerWaalsContact CG-NH2 3.28Å; K180-R382 PolarHBondContact O-NE 2.74Å; D380-R382 PolarHBondContact O-N 3.01Å; D380-R382 PolarHBondContact OD1-N 3.26Å; D380-R382 VanDerWaalsContact OD1-N 3.13Å
383	S	68.8	Low	87.6	Confident	84 Å²	84	74.7 Å²	74.7	59%	0.587	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-19.7	-177.1	61	0	0	0	0	112.6	D380 K385	D380-S383 WeakPolarHBondContact CB-OG 3.38Å; D380-S383 WeakPolarHBondContact OD1-CB 3.15Å; D380-S383 PolarHBondContact OD1-N 3Å; D380-S383 PolarHBondContact OD1-OG 3.07Å; S383-K385 PolarHBondContact O-N 3.18Å; S383-K385 WeakPolarHBondContact OG-CB 3.47Å; S383-K385 PolarHBondContact OG-N 2.78Å
384	G	68.9	Low	87.5	Confident	38 Å²	38	73.2 Å²	73.2	39%	0.392	36%	0.36	S	S	.	.			trans	68.5	6.9	-169.8	0	0	0	0	0	113	D380 K386	D380-G384 VanDerWaalsContact O-CA 3.23Å; D380-G384 WeakPolarHBondContact O-CA 3.47Å; D380-G384 PolarHBondContact O-N 3.07Å; G384-K386 PolarHBondContact O-N 2.87Å
385	K	77.3	Confident	87.3	Confident	153 Å²	153	75.7 Å²	75.7	67%	0.665	37%	0.369	S	S	*	.			trans	-68.1	132.4	-180	-172.3	178.6	176.8	-178.8	0	109.5	I379 D380 S383 L387	I379-K385 CarbonylContact C-O 3.53Å; I379-K385 WeakPolarHBondContact CA-O 3.25Å; D380-K385 PolarHBondContact N-O 3.45Å; S383-K385 PolarHBondContact O-N 3.18Å; S383-K385 WeakPolarHBondContact OG-CB 3.47Å; S383-K385 PolarHBondContact OG-N 2.78Å; K385-L387 PolarHBondContact O-N 2.6Å
386	K	90.1	Very high	86.9	Confident	83 Å²	83	77.6 Å²	77.6	36%	0.361	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	132.7	174.2	-173.4	174.1	-179	167	0	111.5	E377 G384 D389	E377-K386 HydrophobicContact CB-CG 4.46Å; E377-K386 HydrophobicContact CG-CD 4.25Å; E377-K386 WeakPolarHBondContact OE1-CD 3.49Å; E377-K386 VanDerWaalsContact OE1-CE 3.26Å; E377-K386 WeakPolarHBondContact OE1-CE 3.41Å; E377-K386 IonicContact OE1-NZ 2.85Å; E377-K386 PolarHBondContact OE1-NZ 2.85Å; G384-K386 PolarHBondContact O-N 2.87Å; K386-D389 WeakPolarHBondContact CE-OD1 3.25Å; K386-D389 WeakPolarHBondContact CE-OD2 3.44Å; K386-D389 IonicContact NZ-OD1 2.88Å; K386-D389 PolarHBondContact NZ-OD1 2.8Å; K386-D389 IonicContact NZ-OD2 3.68Å; K386-D389 PolarHBondContact NZ-OD2 3.21Å; K386-D389 VanDerWaalsContact NZ-OD2 3.08Å
387	L	88.9	Confident	86.3	Confident	109 Å²	109	76.6 Å²	76.6	57%	0.571	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.3	-40.6	179.4	-62.4	178.4	0	0	0	111.7	K378 D380 K385	K378-L387 PolarHBondContact O-N 3.29Å; D380-L387 HydrophobicContact CB-CD1 4.21Å; D380-L387 HydrophobicContact CB-CD2 4.32Å; D380-L387 HydrophobicContact CB-CG 4.32Å; K385-L387 PolarHBondContact O-N 2.6Å
388	E	93.1	Very high	86.1	Confident	91 Å²	91	74.7 Å²	74.7	43%	0.425	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	139.5	-175	-169.5	-176.7	164.8	0	0	110.1	E377 K378	E377-E388 CarbonylContact C-O 3.48Å; E377-E388 WeakPolarHBondContact CA-O 3.32Å; K378-E388 HydrophobicContact CB-CB 3.84Å; K378-E388 PolarHBondContact N-O 2.84Å; K378-E388 PolarHBondContact O-N 3.27Å
389	D	94.9	Very high	85.8	Confident	96 Å²	96	73.1 Å²	73.1	51%	0.513	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	134.4	170.3	-90.9	-64.7	0	0	0	110.7	K386	K386-D389 WeakPolarHBondContact CE-OD1 3.25Å; K386-D389 WeakPolarHBondContact CE-OD2 3.44Å; K386-D389 IonicContact NZ-OD1 2.88Å; K386-D389 PolarHBondContact NZ-OD1 2.8Å; K386-D389 IonicContact NZ-OD2 3.68Å; K386-D389 PolarHBondContact NZ-OD2 3.21Å; K386-D389 VanDerWaalsContact NZ-OD2 3.08Å
390	N	94.2	Very high	86.2	Confident	96 Å²	96	72.8 Å²	72.8	51%	0.513	38%	0.375	S	S	.	.	S	Bend	trans	48.1	56.4	174.2	-57.9	-56.7	0	0	0	114.3	L375 K376 K392	L375-N390 WeakPolarHBondContact O-CA 3.49Å; K376-N390 PolarHBondContact O-N 3.18Å; K376-N390 PolarHBondContact O-OD1 3.46Å; N390-K392 PolarHBondContact O-N 3Å
391	P	94.9	Very high	87	Confident	4 Å²	4	71.3 Å²	71.3	3%	0.026	37%	0.367	C	S	.	.			trans	-59.4	134.5	-178.6	27.3	-37.3	0	0	0	111	L375 K378 A393 L394	L375-P391 HydrophobicContact CB-CG 4.11Å; L375-P391 WeakPolarHBondContact CD1-O 3.49Å; L375-P391 WeakPolarHBondContact O-CD 3.38Å; K378-P391 HydrophobicContact CB-CB 4.34Å; K378-P391 HydrophobicContact CB-CG 4.11Å; P391-A393 VanDerWaalsContact C-N 3.27Å; P391-A393 PolarHBondContact O-N 3.03Å; P391-L394 HydrophobicContact CB-CD2 4.33Å; P391-L394 HydrophobicContact CG-CD2 3.99Å
392	K	94	Very high	88.1	Confident	195 Å²	195	67.5 Å²	67.5	85%	0.848	35%	0.353	S	S	*	.	S	Bend	trans	-64	-33.1	179.4	-69.3	-175.8	178.7	-179.8	0	112.9	N390	N390-K392 PolarHBondContact O-N 3Å
393	A	94.1	Very high	89.7	Confident	31 Å²	31	59.9 Å²	59.9	26%	0.256	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	153.8	179.6	0	0	0	0	0	111.7	Q352 I353 P391	Q352-A393 HydrophobicContact CB-CB 4.13Å; I353-A393 CarbonylContact O-C 3.17Å; I353-A393 VanDerWaalsContact O-CA 3.29Å; I353-A393 WeakPolarHBondContact O-CA 3.41Å; P391-A393 VanDerWaalsContact C-N 3.27Å; P391-A393 PolarHBondContact O-N 3.03Å
394	L	95.1	Very high	91.1	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.005	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	146.4	174.8	-58.7	172.4	0	0	0	110.3	I346 Q352 I353 L375 P391 D398 A400 I402	I346-L394 HydrophobicContact CD1-CD1 4.34Å; I346-L394 HydrophobicContact CG1-CB 4.07Å; I346-L394 HydrophobicContact CG1-CD1 4.42Å; Q352-L394 WeakPolarHBondContact CA-O 3.46Å; I353-L394 HydrophobicContact CB-CB 4.36Å; I353-L394 PolarHBondContact N-O 2.91Å; I353-L394 PolarHBondContact O-N 3.18Å; L375-L394 HydrophobicContact CD1-CD1 4.37Å; L375-L394 HydrophobicContact CD1-CG 4.18Å; L375-L394 HydrophobicContact CD2-CD1 3.95Å; P391-L394 HydrophobicContact CB-CD2 4.33Å; P391-L394 HydrophobicContact CG-CD2 3.99Å; L394-D398 HydrophobicContact CD2-CB 4.32Å; L394-A400 HydrophobicContact CD1-CB 3.47Å; L394-A400 VanDerWaalsContact CD1-CB 3.47Å; L394-A400 HydrophobicContact CD2-CB 3.74Å; L394-A400 HydrophobicContact CG-CB 4.26Å; L394-I402 HydrophobicContact CD1-CD1 3.68Å; L394-I402 HydrophobicContact CD1-CG1 4.38Å
395	K	92.5	Very high	92.5	Very high	127 Å²	127	56.9 Å²	56.9	55%	0.552	30%	0.295	S	S	*	.			trans	-124.9	167.9	175.9	61.9	-179.7	177.5	-171.9	0	111.6	I346 G397 D398	I346-K395 WeakPolarHBondContact CB-O 3.4Å; K395-G397 PolarHBondContact O-N 3.31Å; K395-D398 WeakPolarHBondContact CG-OD2 3.2Å; K395-D398 PolarHBondContact N-OD2 2.78Å; K395-D398 VanDerWaalsContact O-CB 3.25Å; K395-D398 WeakPolarHBondContact O-CB 3.24Å; K395-D398 PolarHBondContact O-N 2.86Å
396	S	88.4	Confident	93.4	Very high	47 Å²	47	50.4 Å²	50.4	33%	0.329	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.6	126.2	174.5	-66.4	0	0	0	0	112.4	L347 H349	L347-S396 WeakPolarHBondContact O-CA 3.32Å; L347-S396 WeakPolarHBondContact O-CB 3.34Å; L347-S396 PolarHBondContact O-OG 2.84Å; H349-S396 PolarHBondContact N-OG 3.45Å; H349-S396 PolarHBondContact O-OG 3.21Å
397	G	82.5	Confident	93.7	Very high	46 Å²	46	49.6 Å²	49.6	47%	0.474	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.2	-15.2	-177.1	0	0	0	0	0	115.3	I346 K395	I346-G397 WeakPolarHBondContact O-CA 3.2Å; I346-G397 PolarHBondContact O-N 3.39Å; K395-G397 PolarHBondContact O-N 3.31Å
398	D	89.8	Confident	94	Very high	19 Å²	19	51 Å²	51	10%	0.102	29%	0.286	C	S	.	.			trans	-70.5	148.4	176	-69.1	-20	0	0	0	111.1	I346 K378 L394 K395	I346-D398 PolarHBondContact N-O 2.71Å; K378-D398 WeakPolarHBondContact CE-OD1 3.47Å; K378-D398 WeakPolarHBondContact CE-OD2 3.41Å; K378-D398 IonicContact NZ-OD1 3.85Å; K378-D398 PolarHBondContact NZ-OD1 2.59Å; K378-D398 IonicContact NZ-OD2 3.64Å; K378-D398 PolarHBondContact NZ-OD2 2.85Å; L394-D398 HydrophobicContact CD2-CB 4.32Å; K395-D398 WeakPolarHBondContact CG-OD2 3.2Å; K395-D398 PolarHBondContact N-OD2 2.78Å; K395-D398 VanDerWaalsContact O-CB 3.25Å; K395-D398 WeakPolarHBondContact O-CB 3.24Å; K395-D398 PolarHBondContact O-N 2.86Å
399	A	89.1	Confident	94.1	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.008	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	143.7	163.9	0	0	0	0	0	109	V344 I345 I379 R381	V344-A399 CarbonylContact O-C 3.51Å; V344-A399 VanDerWaalsContact O-CA 3.25Å; V344-A399 WeakPolarHBondContact O-CA 3.17Å; I345-A399 HydrophobicContact CG1-CB 4.22Å; I379-A399 HydrophobicContact CD1-CB 4.31Å; I379-A399 HydrophobicContact CG1-CB 3.71Å; I379-A399 PolarHBondContact N-O 2.98Å; I379-A399 VanDerWaalsContact O-O 3.13Å; R381-A399 HydrophobicContact CB-CB 3.99Å
400	A	95.4	Very high	94.2	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	155.3	-176.7	0	0	0	0	0	112.5	Q343 V344 E377 L394 I402	Q343-A400 CarbonylContact C-O 3.57Å; Q343-A400 WeakPolarHBondContact CA-O 3.37Å; V344-A400 PolarHBondContact N-O 3.15Å; V344-A400 PolarHBondContact O-N 3.27Å; E377-A400 CarbonylContact O-C 3.54Å; E377-A400 WeakPolarHBondContact O-CA 3.41Å; E377-A400 VanDerWaalsContact O-CB 3.24Å; E377-A400 WeakPolarHBondContact O-CB 3.21Å; L394-A400 HydrophobicContact CD1-CB 3.47Å; L394-A400 VanDerWaalsContact CD1-CB 3.47Å; L394-A400 HydrophobicContact CD2-CB 3.74Å; L394-A400 HydrophobicContact CG-CB 4.26Å; A400-I402 HydrophobicContact CB-CD1 4.2Å; A400-I402 HydrophobicContact CB-CG1 3.95Å
401	I	96.2	Very high	94.3	Very high	26 Å²	26	41.6 Å²	41.6	13%	0.133	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	121.3	164.9	-55.9	-57.1	0	0	0	107.6	T341 A342 Q343 K376 E377 I379	T341-I401 HydrophobicContact CG2-CG2 3.37Å; A342-I401 CarbonylContact O-C 3.55Å; A342-I401 WeakPolarHBondContact O-CA 3.28Å; Q343-I401 HydrophobicContact CB-CD1 3.72Å; Q343-I401 HydrophobicContact CG-CD1 4.09Å; K376-I401 HydrophobicContact CB-CB 4.44Å; K376-I401 HydrophobicContact CB-CG2 4.32Å; K376-I401 WeakPolarHBondContact CB-O 3.35Å; K376-I401 HydrophobicContact CD-CG2 4.41Å; K376-I401 PolarHBondContact N-O 3.41Å; E377-I401 HydrophobicContact CB-CB 4.18Å; E377-I401 HydrophobicContact CB-CG1 4.26Å; E377-I401 PolarHBondContact N-O 3.2Å; E377-I401 PolarHBondContact O-N 3.47Å; I379-I401 HydrophobicContact CD1-CD1 4.02Å; I379-I401 HydrophobicContact CD1-CG1 4.48Å; I379-I401 HydrophobicContact CG2-CG1 4.09Å
402	I	97.7	Very high	94.4	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	130	-171.9	-54.9	-178.4	0	0	0	109	T341 A342 V344 F372 E374 L375 L394 A400 M404	T341-I402 WeakPolarHBondContact CA-O 3.32Å; A342-I402 PolarHBondContact N-O 3.32Å; A342-I402 PolarHBondContact O-N 2.79Å; V344-I402 HydrophobicContact CB-CD1 3.84Å; V344-I402 HydrophobicContact CB-CG1 4.42Å; V344-I402 HydrophobicContact CG1-CD1 4.29Å; V344-I402 HydrophobicContact CG2-CB 4.26Å; V344-I402 HydrophobicContact CG2-CD1 3.92Å; V344-I402 HydrophobicContact CG2-CG1 4.23Å; F372-I402 HydrophobicContact CB-CG2 4.02Å; F372-I402 HydrophobicContact CD2-CD1 3.66Å; F372-I402 HydrophobicContact CD2-CG2 3.78Å; F372-I402 HydrophobicContact CE2-CD1 3.56Å; F372-I402 HydrophobicContact CE2-CG2 4.42Å; F372-I402 HydrophobicContact CG-CG2 3.93Å; E374-I402 WeakPolarHBondContact O-CA 3.02Å; L375-I402 HydrophobicContact CD2-CD1 3.89Å; L375-I402 HydrophobicContact CD2-CG1 3.96Å; L375-I402 HydrophobicContact CD2-CG2 4.01Å; L394-I402 HydrophobicContact CD1-CD1 3.68Å; L394-I402 HydrophobicContact CD1-CG1 4.38Å; A400-I402 HydrophobicContact CB-CD1 4.2Å; A400-I402 HydrophobicContact CB-CG1 3.95Å; I402-M404 HydrophobicContact CB-CE 4.42Å; I402-M404 HydrophobicContact CG2-CE 4.18Å; I402-M404 HydrophobicContact CG2-CG 3.98Å
403	T	98	Very high	94.6	Very high	10 Å²	10	32.2 Å²	32.2	6%	0.061	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	131.7	165.6	-49.1	0	0	0	0	108.7	N339 S373 E374 K376	N339-T403 HydrophobicContact CB-CG2 4.48Å; S373-T403 PolarHBondContact N-O 2.94Å; S373-T403 WeakPolarHBondContact OG-CB 3.28Å; S373-T403 WeakPolarHBondContact OG-CG2 2.94Å; S373-T403 PolarHBondContact OG-O 3.47Å; E374-T403 PolarHBondContact N-O 3.49Å; E374-T403 PolarHBondContact O-N 3.14Å; E374-T403 PolarHBondContact OE2-OG1 2.87Å; K376-T403 WeakPolarHBondContact CD-OG1 3.47Å; K376-T403 WeakPolarHBondContact CE-OG1 3.41Å; K376-T403 PolarHBondContact NZ-OG1 3.4Å
404	M	97.9	Very high	94.6	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	140.6	-176.7	-67.7	169.3	164.7	0	0	110.7	N339 F340 A342 V344 L361 K371 F372 I402 F424	N339-M404 VanDerWaalsContact CA-O 3.31Å; N339-M404 WeakPolarHBondContact CA-O 3.41Å; N339-M404 WeakPolarHBondContact CB-O 3.46Å; F340-M404 HydrophobicContact CD1-CB 4.46Å; F340-M404 HydrophobicContact CD2-CB 4.15Å; F340-M404 HydrophobicContact CD2-SD 4.31Å; F340-M404 HydrophobicContact CE1-CB 4.03Å; F340-M404 HydrophobicContact CE2-CB 3.71Å; F340-M404 HydrophobicContact CE2-CG 4.17Å; F340-M404 HydrophobicContact CE2-SD 3.41Å; F340-M404 WeakPolarHBondContact CE2-SD 3.2Å; F340-M404 HydrophobicContact CZ-CB 3.63Å; F340-M404 HydrophobicContact CZ-CG 4.39Å; F340-M404 HydrophobicContact CZ-SD 3.84Å; F340-M404 PolarHBondContact N-O 3.47Å; F340-M404 PolarHBondContact O-N 3.33Å; A342-M404 HydrophobicContact CB-SD 4.36Å; V344-M404 HydrophobicContact CG2-CE 3.61Å; L361-M404 HydrophobicContact CD2-SD 3.82Å; K371-M404 CarbonylContact O-C 3.3Å; K371-M404 VanDerWaalsContact O-CA 3.28Å; K371-M404 WeakPolarHBondContact O-CA 3.37Å; F372-M404 HydrophobicContact CD1-CE 3.89Å; F372-M404 HydrophobicContact CD1-CG 4.34Å; F372-M404 HydrophobicContact CD2-CE 4.44Å; F372-M404 HydrophobicContact CE1-CE 3.37Å; F372-M404 HydrophobicContact CE2-CE 3.97Å; F372-M404 HydrophobicContact CG-CE 4.4Å; F372-M404 HydrophobicContact CZ-CE 3.4Å; I402-M404 HydrophobicContact CB-CE 4.42Å; I402-M404 HydrophobicContact CG2-CE 4.18Å; I402-M404 HydrophobicContact CG2-CG 3.98Å; M404-F424 HydrophobicContact CE-CE2 3.83Å; M404-F424 HydrophobicContact CE-CZ 3.85Å; M404-F424 HydrophobicContact SD-CE2 3.97Å; M404-F424 HydrophobicContact SD-CZ 3.66Å
405	V	97.9	Very high	94.4	Very high	59 Å²	59	34.1 Å²	34.1	36%	0.358	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	117.8	176.9	-179.1	0	0	0	0	108.9	N339 C370 K371 G407	N339-V405 HydrophobicContact CB-CG2 4.04Å; C370-V405 CarbonylContact C-O 3.52Å; C370-V405 WeakPolarHBondContact CA-O 3.36Å; K371-V405 PolarHBondContact N-O 2.92Å; K371-V405 PolarHBondContact O-N 3.39Å; V405-G407 PolarHBondContact O-N 3.4Å
406	P	97.3	Very high	94.1	Very high	18 Å²	18	32.4 Å²	32.4	12%	0.117	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61	132.4	174.1	-19.8	29.7	0	0	0	112.2	F340 I368 K408 M410	F340-P406 HydrophobicContact CD1-CG 4.37Å; F340-P406 HydrophobicContact CE1-CG 3.98Å; I368-P406 HydrophobicContact CG2-CB 4.4Å; P406-K408 VanDerWaalsContact C-N 3.26Å; P406-K408 WeakPolarHBondContact CB-O 3.37Å; P406-K408 PolarHBondContact O-N 3.22Å; P406-M410 HydrophobicContact CB-CB 3.88Å; P406-M410 HydrophobicContact CG-CB 3.99Å; P406-M410 HydrophobicContact CG-SD 4.43Å
407	G	95.8	Very high	94.2	Very high	66 Å²	66	35 Å²	35	68%	0.68	22%	0.217	S	C	*	.	S	Bend	trans	-75.2	-14.8	174	0	0	0	0	0	113.8	A369 V405	A369-G407 PolarHBondContact O-N 3.43Å; V405-G407 PolarHBondContact O-N 3.4Å
408	K	95.6	Very high	94.6	Very high	138 Å²	138	33.3 Å²	33.3	60%	0.6	20%	0.196	S	C	*	.	S	Bend	trans	-135.4	156.1	171.8	-67.5	-178.6	-177.8	175.2	0	108.8	I368 P406 M410	I368-K408 HydrophobicContact CG2-CB 4.14Å; P406-K408 VanDerWaalsContact C-N 3.26Å; P406-K408 WeakPolarHBondContact CB-O 3.37Å; P406-K408 PolarHBondContact O-N 3.22Å; K408-M410 PolarHBondContact O-N 2.85Å
409	P	95.3	Very high	94.5	Very high	84 Å²	84	34 Å²	34	55%	0.545	20%	0.202	S	C	.	.			trans	-51	127.7	175.7	-27	34.6	0	0	0	111.2	P282 I368	P282-P409 HydrophobicContact CB-CB 3.75Å; P282-P409 HydrophobicContact CG-CB 3.66Å; I368-P409 WeakPolarHBondContact CD1-O 3.33Å
410	M	96.1	Very high	94.4	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.01	21%	0.211	C	C	.	.			trans	-137.3	145.9	-175.3	-173.7	175	-168.5	0	0	108.8	A336 A337 C363 A366 I368 P406 K408 V412	A336-M410 CarbonylContact C-O 3.6Å; A336-M410 WeakPolarHBondContact CA-O 3.37Å; A337-M410 PolarHBondContact N-O 3.29Å; C363-M410 HydrophobicContact CB-CE 3.52Å; A366-M410 HydrophobicContact CB-CE 4.17Å; I368-M410 HydrophobicContact CB-SD 4.17Å; I368-M410 HydrophobicContact CD1-CB 3.66Å; I368-M410 HydrophobicContact CD1-CG 3.81Å; I368-M410 HydrophobicContact CD1-SD 4.37Å; I368-M410 HydrophobicContact CG2-SD 4.43Å; P406-M410 HydrophobicContact CB-CB 3.88Å; P406-M410 HydrophobicContact CG-CB 3.99Å; P406-M410 HydrophobicContact CG-SD 4.43Å; K408-M410 PolarHBondContact O-N 2.85Å; M410-V412 HydrophobicContact CE-CG1 3.47Å; M410-V412 VanDerWaalsContact CE-CG1 3.47Å; M410-V412 HydrophobicContact CG-CG1 3.98Å; M410-V412 HydrophobicContact SD-CG1 3.91Å
411	C	97.1	Very high	94.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	21%	0.211	C	C	.	.			trans	-109.7	126.7	168.2	-179.3	0	0	0	0	107.3	A281 V325 Q335 H364	A281-C411 HydrophobicContact CB-CB 3.86Å; V325-C411 HydrophobicContact CB-CB 4.25Å; V325-C411 HydrophobicContact CG2-CB 3.94Å; Q335-C411 PolarHBondContact O-SG 3.05Å; H364-C411 PolarHBondContact NE2-O 3.31Å
412	V	97.3	Very high	94.1	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.006	21%	0.205	C	C	.	.			trans	-143.5	161.7	174	-72.3	0	0	0	0	108.2	A337 F340 C363 M410 I438 V441	A337-V412 HydrophobicContact CB-CG2 3.62Å; F340-V412 HydrophobicContact CB-CG2 4.42Å; F340-V412 HydrophobicContact CD1-CG2 3.84Å; F340-V412 HydrophobicContact CE1-CG2 4.29Å; F340-V412 HydrophobicContact CG-CG2 4.14Å; C363-V412 HydrophobicContact CB-CG1 4.36Å; M410-V412 HydrophobicContact CE-CG1 3.47Å; M410-V412 VanDerWaalsContact CE-CG1 3.47Å; M410-V412 HydrophobicContact CG-CG1 3.98Å; M410-V412 HydrophobicContact SD-CG1 3.91Å; V412-I438 HydrophobicContact CB-CD1 3.52Å; V412-I438 HydrophobicContact CG1-CD1 3.89Å; V412-I438 HydrophobicContact CG2-CD1 3.83Å; V412-V441 HydrophobicContact CG2-CG1 4.23Å; V412-V441 HydrophobicContact CG2-CG2 4.13Å
413	E	97	Very high	93.7	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.212	C	C	.	.			trans	-130.4	160.6	-178.3	-65.4	-70.1	-172.5	0	0	111.2	R247 F415 Y418 L421 G422 I438 K443	R247-E413 IonicContact CZ-OE1 3.16Å; R247-E413 VanDerWaalsContact CZ-OE1 3.26Å; R247-E413 IonicContact NE-OE1 3.53Å; R247-E413 PolarHBondContact NE-OE1 3.3Å; R247-E413 IonicContact NH2-OE1 2.63Å; R247-E413 PolarHBondContact NH2-OE1 2.88Å; E413-F415 PolarHBondContact O-N 3Å; E413-Y418 HydrophobicContact CB-CD2 3.77Å; E413-Y418 HydrophobicContact CB-CG 4.16Å; E413-Y418 HydrophobicContact CG-CD2 3.68Å; E413-Y418 HydrophobicContact CG-CE2 4.49Å; E413-Y418 HydrophobicContact CG-CG 4.1Å; E413-L421 HydrophobicContact CB-CB 3.9Å; E413-L421 HydrophobicContact CG-CB 3.99Å; E413-L421 HydrophobicContact CG-CD2 3.88Å; E413-L421 PolarHBondContact N-O 3Å; E413-G422 WeakPolarHBondContact O-CA 3.46Å; E413-I438 WeakPolarHBondContact O-CB 3.47Å; E413-K443 IonicContact OE1-NZ 2.8Å; E413-K443 WeakPolarHBondContact OE2-CE 3.44Å; E413-K443 IonicContact OE2-NZ 3.21Å; E413-K443 PolarHBondContact OE2-NZ 2.99Å
414	S	95.4	Very high	93.3	Very high	11 Å²	11	35.7 Å²	35.7	8%	0.077	21%	0.209	C	C	.	.			trans	-63.3	136.4	170	178.6	0	0	0	0	110.3	S416 Q417 Y418 K439	S414-S416 PolarHBondContact O-N 2.79Å; S414-S416 PolarHBondContact OG-OG 2.88Å; S414-S416 VanDerWaalsContact OG-OG 3.1Å; S414-Q417 PolarHBondContact O-N 3.34Å; S414-Y418 PolarHBondContact O-N 2.8Å; S414-K439 WeakPolarHBondContact CB-O 3.27Å; S414-K439 PolarHBondContact OG-O 2.95Å
415	F	89.5	Confident	92.7	Very high	61 Å²	61	35.7 Å²	35.7	27%	0.268	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-35.2	178.7	175.5	-110.9	0	0	0	113.1	E413 Q417 P419 R423 V437 I438	E413-F415 PolarHBondContact O-N 3Å; F415-Q417 VanDerWaalsContact C-N 3.31Å; F415-P419 HydrophobicContact CD2-CB 4.13Å; F415-P419 HydrophobicContact CE2-CB 3.64Å; F415-P419 HydrophobicContact CE2-CG 4.39Å; F415-P419 HydrophobicContact CZ-CB 4.44Å; F415-P419 WeakPolarHBondContact O-CA 3.31Å; F415-P419 WeakPolarHBondContact O-CD 3.26Å; F415-P419 WeakPolarHBondContact O-CG 3.43Å; F415-R423 HydrophobicContact CD2-CG 3.6Å; F415-R423 HydrophobicContact CE2-CG 3.75Å; F415-R423 VanDerWaalsContact CE2-CZ 3.4Å; F415-V437 HydrophobicContact CB-CB 4.27Å; F415-V437 HydrophobicContact CD1-CB 4.45Å; F415-V437 HydrophobicContact CG-CB 4.16Å; F415-V437 HydrophobicContact CG-CG1 4.48Å; F415-I438 WeakPolarHBondContact CB-O 3.25Å; F415-I438 PolarHBondContact N-O 2.8Å
416	S	85.9	Confident	92.4	Very high	91 Å²	91	32.9 Å²	32.9	64%	0.636	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-31.6	179.4	56.8	0	0	0	0	112.4	S414	S414-S416 PolarHBondContact O-N 2.79Å; S414-S416 PolarHBondContact OG-OG 2.88Å; S414-S416 VanDerWaalsContact OG-OG 3.1Å
417	Q	90.5	Very high	91.8	Very high	102 Å²	102	33.7 Å²	33.7	48%	0.477	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-56.2	-178.1	-66.6	178.9	-24.1	0	0	111.1	K244 S414 F415 P419	K244-Q417 PolarHBondContact NZ-O 3.17Å; S414-Q417 PolarHBondContact O-N 3.34Å; F415-Q417 VanDerWaalsContact C-N 3.31Å; Q417-P419 WeakPolarHBondContact O-CD 3.5Å
418	Y	92.4	Very high	91.2	Very high	11 Å²	11	32.8 Å²	32.8	4%	0.043	17%	0.173	C	C	.	.			trans	-129	80.7	-177.3	-57.4	-82.1	0	0	0	110	K244 P245 R247 T269 D332 E413 S414 P420 L421 G422	K244-Y418 HydrophobicContact CB-CE1 4.48Å; P245-Y418 HydrophobicContact CB-CE1 4.42Å; P245-Y418 VanDerWaalsContact CB-OH 3.3Å; P245-Y418 WeakPolarHBondContact CB-OH 3.49Å; P245-Y418 WeakPolarHBondContact CD-OH 3.44Å; P245-Y418 WeakPolarHBondContact CG-OH 3.4Å; R247-Y418 HydrophobicContact CG-CD1 3.58Å; R247-Y418 HydrophobicContact CG-CE1 3.8Å; R247-Y418 HydrophobicContact CG-CG 4.09Å; T269-Y418 HydrophobicContact CG2-CD1 3.96Å; T269-Y418 WeakPolarHBondContact OG1-CD1 3.14Å; D332-Y418 WeakPolarHBondContact OD2-CE2 3.21Å; D332-Y418 PolarHBondContact OD2-OH 2.89Å; E413-Y418 HydrophobicContact CB-CD2 3.77Å; E413-Y418 HydrophobicContact CB-CG 4.16Å; E413-Y418 HydrophobicContact CG-CD2 3.68Å; E413-Y418 HydrophobicContact CG-CE2 4.49Å; E413-Y418 HydrophobicContact CG-CG 4.1Å; S414-Y418 PolarHBondContact O-N 2.8Å; Y418-P420 VanDerWaalsContact C-N 3.31Å; Y418-P420 VanDerWaalsContact O-N 3.13Å; Y418-L421 PolarHBondContact O-N 3Å; Y418-G422 PolarHBondContact O-N 3.29Å
419	P	87.4	Confident	90.1	Very high	33 Å²	33	33.7 Å²	33.7	21%	0.214	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-45.9	-44	-176.6	-28.7	32.7	0	0	0	115.1	F415 Q417 L421 G422 R423	F415-P419 HydrophobicContact CD2-CB 4.13Å; F415-P419 HydrophobicContact CE2-CB 3.64Å; F415-P419 HydrophobicContact CE2-CG 4.39Å; F415-P419 HydrophobicContact CZ-CB 4.44Å; F415-P419 WeakPolarHBondContact O-CA 3.31Å; F415-P419 WeakPolarHBondContact O-CD 3.26Å; F415-P419 WeakPolarHBondContact O-CG 3.43Å; Q417-P419 WeakPolarHBondContact O-CD 3.5Å; P419-L421 VanDerWaalsContact C-N 3.26Å; P419-L421 PolarHBondContact O-N 3Å; P419-G422 PolarHBondContact O-N 2.8Å; P419-R423 WeakPolarHBondContact O-CG 3.34Å
420	P	87.1	Confident	88.9	Confident	32 Å²	32	39.6 Å²	39.6	21%	0.208	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-68.2	-21.1	-177.6	-22.6	37.5	0	0	0	114.7	E268 Y418	E268-P420 HydrophobicContact CB-CB 3.97Å; E268-P420 HydrophobicContact CB-CG 4.03Å; E268-P420 HydrophobicContact CG-CB 3.8Å; E268-P420 HydrophobicContact CG-CG 4.33Å; E268-P420 WeakPolarHBondContact OE2-CB 3.31Å; E268-P420 WeakPolarHBondContact OE2-CG 3.25Å; Y418-P420 VanDerWaalsContact C-N 3.31Å; Y418-P420 VanDerWaalsContact O-N 3.13Å
421	L	93.3	Very high	87.8	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-102.7	-3	179.5	-78.3	70.7	0	0	0	112.9	R247 P249 E268 V325 C363 E413 Y418 P419	R247-L421 HydrophobicContact CB-CD1 4.11Å; R247-L421 HydrophobicContact CB-CD2 4.11Å; R247-L421 HydrophobicContact CG-CD2 4.12Å; P249-L421 HydrophobicContact CG-CD1 3.79Å; P249-L421 HydrophobicContact CG-CG 4.21Å; E268-L421 HydrophobicContact CB-CD1 4.2Å; E268-L421 HydrophobicContact CG-CD1 4.24Å; V325-L421 HydrophobicContact CB-CD2 4.48Å; V325-L421 HydrophobicContact CG1-CD2 3.71Å; V325-L421 HydrophobicContact CG2-CD2 3.95Å; C363-L421 PolarHBondContact SG-O 2.89Å; C363-L421 VanDerWaalsContact SG-O 3.35Å; E413-L421 HydrophobicContact CB-CB 3.9Å; E413-L421 HydrophobicContact CG-CB 3.99Å; E413-L421 HydrophobicContact CG-CD2 3.88Å; E413-L421 PolarHBondContact N-O 3Å; Y418-L421 PolarHBondContact O-N 3Å; P419-L421 VanDerWaalsContact C-N 3.26Å; P419-L421 PolarHBondContact O-N 3Å
422	G	92.1	Very high	87	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.213	C	C	.	.	S	Bend	trans	-109.1	7.3	-177	0	0	0	0	0	114.4	E413 Y418 P419 V437 I438	E413-G422 WeakPolarHBondContact O-CA 3.46Å; Y418-G422 PolarHBondContact O-N 3.29Å; P419-G422 PolarHBondContact O-N 2.8Å; G422-V437 CarbonylContact O-C 3.54Å; G422-V437 WeakPolarHBondContact O-CA 3.42Å; G422-I438 PolarHBondContact O-N 3.35Å
423	R	88.6	Confident	86.5	Confident	39 Å²	39	44.1 Å²	44.1	15%	0.147	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	135.2	177.6	-57.4	179.5	-179	132.6	9.7	109.3	T142 L143 G144 C363 F415 P419 V437	T142-R423 WeakPolarHBondContact O-CD 3.48Å; L143-R423 VanDerWaalsContact C-CZ 3.47Å; L143-R423 HydrophobicContact CD2-CB 4.28Å; L143-R423 WeakPolarHBondContact O-CD 3.34Å; L143-R423 PolarHBondContact O-NE 3.27Å; L143-R423 PolarHBondContact O-NH1 3.09Å; G144-R423 VanDerWaalsContact CA-NH2 3.32Å; C363-R423 PolarHBondContact SG-O 2.79Å; F415-R423 HydrophobicContact CD2-CG 3.6Å; F415-R423 HydrophobicContact CE2-CG 3.75Å; F415-R423 VanDerWaalsContact CE2-CZ 3.4Å; P419-R423 WeakPolarHBondContact O-CG 3.34Å; R423-V437 HydrophobicContact CG-CG1 4.24Å
424	F	90.1	Very high	86.2	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.009	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	156.9	-179.6	62.9	-89.6	0	0	0	112.3	F340 A342 V344 L361 D362 C363 M404 V426 V435 G436 I438	F340-F424 HydrophobicContact CE2-CE1 4.12Å; F340-F424 HydrophobicContact CE2-CZ 4.34Å; A342-F424 HydrophobicContact CB-CE1 3.49Å; A342-F424 VanDerWaalsContact CB-CE1 3.49Å; A342-F424 HydrophobicContact CB-CZ 3.49Å; A342-F424 VanDerWaalsContact CB-CZ 3.49Å; V344-F424 HydrophobicContact CG2-CE2 4.37Å; V344-F424 HydrophobicContact CG2-CZ 3.97Å; L361-F424 HydrophobicContact CD2-CD2 3.57Å; L361-F424 HydrophobicContact CD2-CE2 3.69Å; L361-F424 HydrophobicContact CD2-CG 4.1Å; L361-F424 HydrophobicContact CD2-CZ 4.31Å; L361-F424 HydrophobicContact CG-CD2 3.72Å; L361-F424 HydrophobicContact CG-CE2 4.12Å; L361-F424 HydrophobicContact CG-CG 4.46Å; D362-F424 CarbonylContact O-C 3.51Å; D362-F424 WeakPolarHBondContact O-CA 3.29Å; D362-F424 VanDerWaalsContact O-CB 3.31Å; D362-F424 WeakPolarHBondContact O-CB 3.28Å; C363-F424 HydrophobicContact CB-CB 3.79Å; M404-F424 HydrophobicContact CE-CE2 3.83Å; M404-F424 HydrophobicContact CE-CZ 3.85Å; M404-F424 HydrophobicContact SD-CE2 3.97Å; M404-F424 HydrophobicContact SD-CZ 3.66Å; F424-V426 HydrophobicContact CD2-CG2 3.86Å; F424-V426 HydrophobicContact CE2-CG2 3.62Å; F424-V435 WeakPolarHBondContact O-CA 3.28Å; F424-G436 PolarHBondContact N-O 2.87Å; F424-G436 PolarHBondContact O-N 3.42Å; F424-I438 HydrophobicContact CD1-CD1 4.16Å; F424-I438 HydrophobicContact CD1-CG1 3.72Å; F424-I438 HydrophobicContact CE1-CD1 4.4Å; F424-I438 HydrophobicContact CE1-CG1 3.6Å
425	A	85.9	Confident	85.8	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	144.4	167.2	0	0	0	0	0	110.1	I103 L361 D362 T432 V435	I103-A425 HydrophobicContact CD1-CB 3.31Å; I103-A425 HydrophobicContact CG1-CB 4.1Å; I103-A425 HydrophobicContact CG2-CB 4.06Å; L361-A425 WeakPolarHBondContact CA-O 3.37Å; D362-A425 HydrophobicContact CB-CB 4.44Å; D362-A425 PolarHBondContact N-O 3.31Å; D362-A425 PolarHBondContact O-N 3.34Å; A425-T432 HydrophobicContact CB-CG2 4.23Å; A425-V435 HydrophobicContact CB-CG1 4.2Å
426	V	91.1	Very high	85.9	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	124.7	176.5	-175.4	0	0	0	0	107.6	P359 L361 F372 F424 T432 V433 A434	P359-V426 HydrophobicContact CB-CG1 3.49Å; P359-V426 VanDerWaalsContact CB-CG1 3.49Å; P359-V426 HydrophobicContact CG-CG1 3.22Å; L361-V426 HydrophobicContact CD1-CG1 4.22Å; L361-V426 HydrophobicContact CD1-CG2 4.13Å; L361-V426 HydrophobicContact CG-CG2 4.26Å; F372-V426 HydrophobicContact CE1-CG1 4.3Å; F372-V426 HydrophobicContact CZ-CG1 4.02Å; F372-V426 HydrophobicContact CZ-CG2 4.23Å; F424-V426 HydrophobicContact CD2-CG2 3.86Å; F424-V426 HydrophobicContact CE2-CG2 3.62Å; V426-T432 CarbonylContact O-C 3.6Å; V426-T432 WeakPolarHBondContact O-CA 3.42Å; V426-V433 HydrophobicContact CB-CG2 4.14Å; V426-V433 HydrophobicContact CG1-CG2 3.67Å; V426-V433 WeakPolarHBondContact O-CG2 3.24Å; V426-V433 PolarHBondContact O-N 3.48Å; V426-A434 HydrophobicContact CB-CB 3.84Å; V426-A434 HydrophobicContact CG2-CB 3.95Å; V426-A434 PolarHBondContact N-O 3.16Å; V426-A434 PolarHBondContact O-N 3.04Å
427	R	85	Confident	86.1	Confident	34 Å²	34	37.5 Å²	37.5	13%	0.128	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	138.8	-177.7	-62.3	-164.9	69.7	-146.8	1.5	111.9	P359 V360 D362 R430 Q431	P359-R427 WeakPolarHBondContact CB-O 3.44Å; V360-R427 PolarHBondContact N-O 2.82Å; V360-R427 PolarHBondContact O-N 3.49Å; D362-R427 WeakPolarHBondContact OD2-CD 3.05Å; R427-R430 PolarHBondContact NH2-O 2.97Å; R427-Q431 VanDerWaalsContact CA-O 3.25Å; R427-Q431 WeakPolarHBondContact CA-O 3.22Å
428	D	83.7	Confident	86.3	Confident	48 Å²	48	32.7 Å²	32.7	26%	0.257	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	146	174.9	-168.6	8.3	0	0	0	109.5	Y357 P359 R430 Q431 V433	Y357-D428 VanDerWaalsContact CE2-OD2 3.28Å; Y357-D428 WeakPolarHBondContact CE2-OD2 3.39Å; Y357-D428 WeakPolarHBondContact OH-CB 3.35Å; Y357-D428 PolarHBondContact OH-OD2 3.27Å; P359-D428 HydrophobicContact CB-CB 4.42Å; D428-R430 PolarHBondContact O-N 2.8Å; D428-Q431 PolarHBondContact N-O 3.16Å; D428-Q431 PolarHBondContact O-N 2.92Å; D428-Q431 VanDerWaalsContact O-O 3.08Å; D428-V433 HydrophobicContact CB-CG1 4.01Å; D428-V433 HydrophobicContact CB-CG2 4.19Å
429	M	72.4	Confident	86.4	Confident	156 Å²	156	36.7 Å²	36.7	77%	0.768	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.5	37.3	-178.2	-58	-171.5	179.6	0	0	114.3	Q431	M429-Q431 PolarHBondContact O-N 3.46Å
430	R	69.9	Low	86.9	Confident	209 Å²	209	39 Å²	39	79%	0.789	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.6	7.1	-175.4	-52.4	179	176.9	-179.5	-0.6	115.7	R427 D428	R427-R430 PolarHBondContact NH2-O 2.97Å; D428-R430 PolarHBondContact O-N 2.8Å
431	Q	72.9	Confident	87.4	Confident	91 Å²	91	39 Å²	39	43%	0.425	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	153.1	175.6	-62.3	-177.2	2	0	0	111	R427 D428 M429 V433	R427-Q431 VanDerWaalsContact CA-O 3.25Å; R427-Q431 WeakPolarHBondContact CA-O 3.22Å; D428-Q431 PolarHBondContact N-O 3.16Å; D428-Q431 PolarHBondContact O-N 2.92Å; D428-Q431 VanDerWaalsContact O-O 3.08Å; M429-Q431 PolarHBondContact O-N 3.46Å; Q431-V433 PolarHBondContact O-N 3.02Å
432	T	79.3	Confident	87.5	Confident	5 Å²	5	44 Å²	44	3%	0.031	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	107.4	170.1	-58.1	0	0	0	0	108.1	I99 I103 L347 A425 V426 V435	I99-T432 HydrophobicContact CG2-CG2 4.49Å; I99-T432 VanDerWaalsContact CG2-OG1 3.23Å; I99-T432 WeakPolarHBondContact CG2-OG1 3.31Å; I103-T432 HydrophobicContact CD1-CG2 4.14Å; L347-T432 HydrophobicContact CD1-CG2 4.05Å; A425-T432 HydrophobicContact CB-CG2 4.23Å; V426-T432 CarbonylContact O-C 3.6Å; V426-T432 WeakPolarHBondContact O-CA 3.42Å; T432-V435 HydrophobicContact CG2-CG1 4.28Å
433	V	87.9	Confident	87.6	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.012	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	-24.4	-173.2	-63	0	0	0	0	112.1	L347 H349 V426 D428 Q431	L347-V433 PolarHBondContact N-O 3.48Å; H349-V433 HydrophobicContact CB-CB 4.32Å; V426-V433 HydrophobicContact CB-CG2 4.14Å; V426-V433 HydrophobicContact CG1-CG2 3.67Å; V426-V433 WeakPolarHBondContact O-CG2 3.24Å; V426-V433 PolarHBondContact O-N 3.48Å; D428-V433 HydrophobicContact CB-CG1 4.01Å; D428-V433 HydrophobicContact CB-CG2 4.19Å; Q431-V433 PolarHBondContact O-N 3.02Å
434	A	89.8	Confident	87.6	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	165.9	174.7	0	0	0	0	0	111.7	V344 I345 I346 V426	V344-A434 HydrophobicContact CG1-CB 3.57Å; I345-A434 WeakPolarHBondContact O-CA 3.47Å; I345-A434 VanDerWaalsContact O-CB 3.28Å; I345-A434 WeakPolarHBondContact O-CB 3.46Å; I346-A434 HydrophobicContact CD1-CB 3.79Å; V426-A434 HydrophobicContact CB-CB 3.84Å; V426-A434 HydrophobicContact CG2-CB 3.95Å; V426-A434 PolarHBondContact N-O 3.16Å; V426-A434 PolarHBondContact O-N 3.04Å
435	V	87.8	Confident	86.9	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	149.5	167.5	-76.1	0	0	0	0	109.5	L139 T142 V344 I345 L347 F424 A425 T432	L139-V435 HydrophobicContact CD2-CB 4.47Å; L139-V435 HydrophobicContact CD2-CG1 3.32Å; L139-V435 HydrophobicContact CD2-CG2 4.44Å; T142-V435 HydrophobicContact CG2-CB 3.81Å; T142-V435 HydrophobicContact CG2-CG2 3.67Å; V344-V435 CarbonylContact C-O 3.59Å; V344-V435 WeakPolarHBondContact CA-O 3.13Å; I345-V435 HydrophobicContact CB-CG2 4.39Å; I345-V435 PolarHBondContact N-O 2.87Å; I345-V435 PolarHBondContact O-N 3.35Å; L347-V435 HydrophobicContact CD1-CG1 4.23Å; L347-V435 HydrophobicContact CD1-CG2 4.3Å; L347-V435 HydrophobicContact CD2-CG2 4.3Å; L347-V435 HydrophobicContact CG-CG2 4.4Å; F424-V435 WeakPolarHBondContact O-CA 3.28Å; A425-V435 HydrophobicContact CB-CG1 4.2Å; T432-V435 HydrophobicContact CG2-CG1 4.28Å
436	G	90.4	Very high	86	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.01	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	157.6	-176.1	0	0	0	0	0	114.5	Q343 F424	Q343-G436 CarbonylContact O-C 3.56Å; Q343-G436 WeakPolarHBondContact O-CA 3.35Å; F424-G436 PolarHBondContact N-O 2.87Å; F424-G436 PolarHBondContact O-N 3.42Å
437	V	90.1	Very high	84.5	Confident	22 Å²	22	62.3 Å²	62.3	13%	0.133	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	126.7	171.4	-62.1	0	0	0	0	109	T142 A342 Q343 F415 G422 R423 K439	T142-V437 HydrophobicContact CG2-CG1 4.18Å; A342-V437 CarbonylContact C-O 3.52Å; A342-V437 WeakPolarHBondContact CA-O 3.35Å; Q343-V437 HydrophobicContact CB-CG2 3.97Å; Q343-V437 PolarHBondContact N-O 2.69Å; Q343-V437 PolarHBondContact O-N 2.85Å; F415-V437 HydrophobicContact CB-CB 4.27Å; F415-V437 HydrophobicContact CD1-CB 4.45Å; F415-V437 HydrophobicContact CG-CB 4.16Å; F415-V437 HydrophobicContact CG-CG1 4.48Å; G422-V437 CarbonylContact O-C 3.54Å; G422-V437 WeakPolarHBondContact O-CA 3.42Å; R423-V437 HydrophobicContact CG-CG1 4.24Å; V437-K439 PolarHBondContact O-N 3.15Å
438	I	95.8	Very high	83.5	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.005	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	125	-178.2	-59.7	179.9	0	0	0	108.7	F340 A342 V412 E413 F415 G422 F424 V441	F340-I438 HydrophobicContact CB-CG2 4.13Å; F340-I438 HydrophobicContact CD2-CD1 3.95Å; F340-I438 HydrophobicContact CD2-CG1 3.9Å; F340-I438 HydrophobicContact CD2-CG2 4.27Å; F340-I438 HydrophobicContact CE2-CD1 4.12Å; F340-I438 HydrophobicContact CE2-CG1 4.18Å; F340-I438 HydrophobicContact CG-CD1 4.44Å; A342-I438 HydrophobicContact CB-CG1 4.45Å; V412-I438 HydrophobicContact CB-CD1 3.52Å; V412-I438 HydrophobicContact CG1-CD1 3.89Å; V412-I438 HydrophobicContact CG2-CD1 3.83Å; E413-I438 WeakPolarHBondContact O-CB 3.47Å; F415-I438 WeakPolarHBondContact CB-O 3.25Å; F415-I438 PolarHBondContact N-O 2.8Å; G422-I438 PolarHBondContact O-N 3.35Å; F424-I438 HydrophobicContact CD1-CD1 4.16Å; F424-I438 HydrophobicContact CD1-CG1 3.72Å; F424-I438 HydrophobicContact CE1-CD1 4.4Å; F424-I438 HydrophobicContact CE1-CG1 3.6Å; I438-V441 HydrophobicContact CG2-CG2 3.46Å; I438-V441 VanDerWaalsContact CG2-CG2 3.46Å
439	K	93.9	Very high	83.1	Confident	96 Å²	96	63.9 Å²	63.9	42%	0.417	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	-48.8	177.9	-64.7	-69.3	-175.9	171.9	0	110.5	T341 Q343 S414 V437	T341-K439 PolarHBondContact O-N 2.76Å; Q343-K439 HydrophobicContact CB-CG 4.37Å; S414-K439 WeakPolarHBondContact CB-O 3.27Å; S414-K439 PolarHBondContact OG-O 2.95Å; V437-K439 PolarHBondContact O-N 3.15Å
440	T	97.1	Very high	83.7	Confident	81 Å²	81	61.3 Å²	61.3	50%	0.497	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	149.8	-178.8	57.9	0	0	0	0	110.2	F340 T341	F340-T440 CarbonylContact C-O 3.6Å; F340-T440 WeakPolarHBondContact CA-O 3.09Å; F340-T440 WeakPolarHBondContact CB-O 3.29Å; T341-T440 WeakPolarHBondContact CB-OG1 3.48Å; T341-T440 PolarHBondContact N-O 2.92Å; T341-T440 PolarHBondContact O-N 3.44Å
441	V	97.5	Very high	84.5	Confident	31 Å²	31	54.4 Å²	54.4	19%	0.188	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	127.7	177.2	-178.1	0	0	0	0	107.6	A337 F340 V412 I438 K443	A337-V441 HydrophobicContact CB-CG1 3.64Å; F340-V441 HydrophobicContact CB-CB 4.36Å; F340-V441 HydrophobicContact CB-CG1 4.39Å; F340-V441 HydrophobicContact CB-CG2 3.99Å; V412-V441 HydrophobicContact CG2-CG1 4.23Å; V412-V441 HydrophobicContact CG2-CG2 4.13Å; I438-V441 HydrophobicContact CG2-CG2 3.46Å; I438-V441 VanDerWaalsContact CG2-CG2 3.46Å; V441-K443 HydrophobicContact CG1-CG 4.32Å
442	E	96.8	Very high	85.1	Confident	105 Å²	105	50.2 Å²	50.2	49%	0.491	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	107.4	166	-170.8	166.2	-170.2	0	0	107.5	E338 N339	E338-E442 PolarHBondContact N-O 2.83Å; N339-E442 PolarHBondContact ND2-OE2 3.44Å; N339-E442 PolarHBondContact O-N 3.16Å
443	K	93.5	Very high	85.3	Confident	58 Å²	58	57.6 Å²	57.6	25%	0.252	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	131.3	-179.4	-67.8	-178.7	173.5	-173.8	0	108.8	D332 Q335 E413 V441 A445	D332-K443 IonicContact OD1-NZ 3.78Å; Q335-K443 HydrophobicContact CB-CB 4.17Å; Q335-K443 HydrophobicContact CB-CD 4.05Å; Q335-K443 HydrophobicContact CB-CG 4.26Å; Q335-K443 HydrophobicContact CG-CD 4.37Å; E413-K443 IonicContact OE1-NZ 2.8Å; E413-K443 WeakPolarHBondContact OE2-CE 3.44Å; E413-K443 IonicContact OE2-NZ 3.21Å; E413-K443 PolarHBondContact OE2-NZ 2.99Å; V441-K443 HydrophobicContact CG1-CG 4.32Å; K443-A445 PolarHBondContact O-N 3.06Å
444	K	89.1	Confident	85	Confident	114 Å²	114	57.9 Å²	57.9	50%	0.496	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-64.9	131.1	175.2	-169.2	173.8	-175.1	174.2	0	108.9	A336 E338	A336-K444 HydrophobicContact CB-CB 4.25Å; A336-K444 PolarHBondContact O-N 3.43Å; E338-K444 HydrophobicContact CB-CB 4.25Å
445	A	75.8	Confident	84.6	Confident	76 Å²	76	57.9 Å²	57.9	63%	0.628	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-52.7	137	176.7	0	0	0	0	0	110.4	K443 S447	K443-A445 PolarHBondContact O-N 3.06Å; A445-S447 PolarHBondContact O-N 3.31Å
446	P	66.5	Low	84.4	Confident	93 Å²	93	62.8 Å²	62.8	60%	0.604	36%	0.362	S	S	*	.			trans	-65.4	96	-177.5	22.8	-30.1	0	0	0	110.3
447	S	59.9	Low	83.9	Confident	85 Å²	85	69.8 Å²	69.8	59%	0.594	39%	0.392	S	S	*	.			trans	-73.5	134.1	165.7	58.1	0	0	0	0	108.7	N284 A445 G449	N284-S447 PolarHBondContact ND2-O 3.47Å; N284-S447 VanDerWaalsContact ND2-O 3.09Å; A445-S447 PolarHBondContact O-N 3.31Å; S447-G449 PolarHBondContact O-N 3.35Å; S447-G449 VanDerWaalsContact O-N 3.15Å
448	G	62.7	Low	83.5	Confident	87 Å²	87	69.6 Å²	69.6	90%	0.897	39%	0.393	S	S	*	.			trans	-24.7	106.9	-171.5	0	0	0	0	0	115.6
449	G	74.9	Confident	82.6	Confident	29 Å²	29	72.7 Å²	72.7	30%	0.299	41%	0.409	S	S	.	.			trans	-86.9	145.1	180	0	0	0	0	0	112.7	N284 S447 V451	N284-G449 WeakPolarHBondContact ND2-CA 3.21Å; N284-G449 PolarHBondContact ND2-N 3.34Å; N284-G449 CarbonylContact O-C 3.53Å; N284-G449 WeakPolarHBondContact O-CA 3.23Å; S447-G449 PolarHBondContact O-N 3.35Å; S447-G449 VanDerWaalsContact O-N 3.15Å; G449-V451 PolarHBondContact O-N 3.01Å; G449-V451 VanDerWaalsContact O-N 3.13Å
450	K	85.8	Confident	81.5	Confident	101 Å²	101	76.7 Å²	76.7	44%	0.439	43%	0.427	S	S	.	.			trans	-68.9	110.4	174.2	-176.6	-171.2	-179.7	-169.4	0	109.1	N284 L285 T286 E319	N284-K450 PolarHBondContact O-N 2.86Å; L285-K450 WeakPolarHBondContact CA-O 3.32Å; L285-K450 HydrophobicContact CD1-CD 4.11Å; T286-K450 PolarHBondContact N-O 3.16Å; E319-K450 VanDerWaalsContact CD-NZ 3.3Å; E319-K450 WeakPolarHBondContact OE1-CD 3.38Å; E319-K450 IonicContact OE1-NZ 2.64Å; E319-K450 PolarHBondContact OE1-NZ 3.42Å; E319-K450 IonicContact OE2-NZ 2.74Å; E319-K450 PolarHBondContact OE2-NZ 2.98Å; E319-K450 VanDerWaalsContact OE2-NZ 3.16Å
451	V	86.6	Confident	79.7	Confident	64 Å²	64	81.8 Å²	81.8	39%	0.388	44%	0.442	S	S	.	.	B	Isolated β-bridge	trans	-95.1	120.3	170.3	-171.7	0	0	0	0	108.7	G449 A455 Q456	G449-V451 PolarHBondContact O-N 3.01Å; G449-V451 VanDerWaalsContact O-N 3.13Å; V451-A455 HydrophobicContact CG1-CB 3.73Å; V451-Q456 HydrophobicContact CB-CG 4.48Å; V451-Q456 HydrophobicContact CG1-CG 3.83Å
452	T	85.4	Confident	77.4	Confident	4 Å²	4	91 Å²	91	3%	0.025	48%	0.48	C	S	.	.			trans	-70.6	155.2	-178.9	67.6	0	0	0	0	111.8	L285 T286 T287 N314 V315 S454 A455 Q456	L285-T452 HydrophobicContact CD2-CG2 4.41Å; T286-T452 WeakPolarHBondContact O-CG2 3.5Å; T286-T452 PolarHBondContact O-N 2.88Å; T286-T452 PolarHBondContact O-OG1 2.92Å; T287-T452 WeakPolarHBondContact CA-OG1 3.44Å; T287-T452 WeakPolarHBondContact CB-OG1 3.27Å; T287-T452 PolarHBondContact OG1-OG1 3.08Å; N314-T452 HydrophobicContact CB-CG2 4.03Å; V315-T452 HydrophobicContact CG2-CG2 4.15Å; T452-S454 PolarHBondContact O-N 3.39Å; T452-S454 VanDerWaalsContact O-N 3.14Å; T452-S454 PolarHBondContact OG1-OG 3.2Å; T452-A455 PolarHBondContact O-N 2.79Å; T452-A455 PolarHBondContact OG1-N 3.27Å; T452-Q456 PolarHBondContact O-N 3.37Å
453	K	83.9	Confident	76.4	Confident	159 Å²	159	90.4 Å²	90.4	69%	0.691	48%	0.479	S	S	*	.	H	α-helix	trans	-55.5	-31	173.6	-68.2	-177	179.5	179.5	0	112.5	K457	K453-K457 WeakPolarHBondContact O-CB 3.47Å; K453-K457 VanDerWaalsContact O-CG 3.3Å; K453-K457 WeakPolarHBondContact O-CG 3.2Å; K453-K457 PolarHBondContact O-N 3.36Å; K453-K457 VanDerWaalsContact O-N 3.09Å
454	S	81	Confident	75.5	Confident	8 Å²	8	92.1 Å²	92.1	6%	0.056	49%	0.491	C	S	.	.	H	α-helix	trans	-67.1	-47.5	175.1	24.4	0	0	0	0	111.9	N314 T452 Q456 K457 A458	N314-S454 PolarHBondContact ND2-OG 2.64Å; T452-S454 PolarHBondContact O-N 3.39Å; T452-S454 VanDerWaalsContact O-N 3.14Å; T452-S454 PolarHBondContact OG1-OG 3.2Å; S454-Q456 PolarHBondContact O-N 3.43Å; S454-K457 PolarHBondContact O-N 3.43Å; S454-A458 WeakPolarHBondContact O-CB 3.34Å; S454-A458 PolarHBondContact O-N 3.5Å
455	A	81.4	Confident	74.8	Confident	0 Å²	0	90.8 Å²	90.8	0%	0	49%	0.491	C	S	.	.	H	α-helix	trans	-59.7	-47.6	174.8	0	0	0	0	0	111.6	V277 T286 V451 T452 K457 A458 D459	V277-A455 HydrophobicContact CG1-CB 3.75Å; T286-A455 HydrophobicContact CG2-CB 4.08Å; V451-A455 HydrophobicContact CG1-CB 3.73Å; T452-A455 PolarHBondContact O-N 2.79Å; T452-A455 PolarHBondContact OG1-N 3.27Å; A455-K457 VanDerWaalsContact C-N 3.25Å; A455-K457 PolarHBondContact O-N 2.82Å; A455-A458 PolarHBondContact O-N 2.97Å; A455-A458 VanDerWaalsContact O-N 3.09Å; A455-D459 PolarHBondContact O-N 2.94Å
456	Q	84.1	Confident	74.7	Confident	103 Å²	103	91.7 Å²	91.7	48%	0.481	48%	0.483	S	S	.	.	H	α-helix	trans	-57.5	-37.1	176.9	-68.1	176.4	-17.6	0	0	113	V451 T452 S454 K460	V451-Q456 HydrophobicContact CB-CG 4.48Å; V451-Q456 HydrophobicContact CG1-CG 3.83Å; T452-Q456 PolarHBondContact O-N 3.37Å; S454-Q456 PolarHBondContact O-N 3.43Å; Q456-K460 WeakPolarHBondContact O-CG 3.25Å; Q456-K460 PolarHBondContact O-N 3.05Å
457	K	80.8	Confident	75.2	Confident	148 Å²	148	91.6 Å²	91.6	64%	0.643	48%	0.475	S	S	*	.	H	α-helix	trans	-73.1	-38.2	176.4	-77.9	-178.4	179.8	-170	0	112.4	K453 S454 A455 D459 K460 K461	K453-K457 WeakPolarHBondContact O-CB 3.47Å; K453-K457 VanDerWaalsContact O-CG 3.3Å; K453-K457 WeakPolarHBondContact O-CG 3.2Å; K453-K457 PolarHBondContact O-N 3.36Å; K453-K457 VanDerWaalsContact O-N 3.09Å; S454-K457 PolarHBondContact O-N 3.43Å; A455-K457 VanDerWaalsContact C-N 3.25Å; A455-K457 PolarHBondContact O-N 2.82Å; K457-D459 VanDerWaalsContact C-N 3.34Å; K457-K460 PolarHBondContact O-N 3.25Å; K457-K461 PolarHBondContact O-N 2.96Å
458	A	80.1	Confident	76.3	Confident	19 Å²	19	92.1 Å²	92.1	16%	0.157	47%	0.467	C	S	.	.	H	α-helix	trans	-66.5	-37.4	178.1	0	0	0	0	0	111.5	V277 E288 S454 A455 K460 K461	V277-A458 HydrophobicContact CG2-CB 3.68Å; E288-A458 HydrophobicContact CG-CB 4.15Å; S454-A458 WeakPolarHBondContact O-CB 3.34Å; S454-A458 PolarHBondContact O-N 3.5Å; A455-A458 PolarHBondContact O-N 2.97Å; A455-A458 VanDerWaalsContact O-N 3.09Å; A458-K460 VanDerWaalsContact C-N 3.33Å; A458-K460 PolarHBondContact O-N 3.29Å; A458-K461 PolarHBondContact O-N 3.2Å
459	D	76.9	Confident	77.2	Confident	66 Å²	66	92.4 Å²	92.4	35%	0.353	44%	0.436	S	S	.	.	H	α-helix	trans	-68.8	-29.3	176.2	-75.3	-27.4	0	0	0	113.6	K330 A455 K457 K461	K330-D459 WeakPolarHBondContact CE-OD1 3.37Å; K330-D459 IonicContact NZ-OD1 2.75Å; K330-D459 PolarHBondContact NZ-OD1 2.74Å; A455-D459 PolarHBondContact O-N 2.94Å; K457-D459 VanDerWaalsContact C-N 3.34Å; D459-K461 VanDerWaalsContact C-N 3.33Å
460	K	71.8	Confident	77.4	Confident	179 Å²	179	97.3 Å²	97.3	78%	0.778	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-7.2	176	-71.5	-178.2	-179	-168.4	0	114.8	Q456 K457 A458	Q456-K460 WeakPolarHBondContact O-CG 3.25Å; Q456-K460 PolarHBondContact O-N 3.05Å; K457-K460 PolarHBondContact O-N 3.25Å; A458-K460 VanDerWaalsContact C-N 3.33Å; A458-K460 PolarHBondContact O-N 3.29Å
461	K	59.1	Low	76.7	Confident	188 Å²	188	97 Å²	97	82%	0.817	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	0	-177.2	-85.5	-172.5	173.5	-166.3	0	113.8	K457 A458 D459	K457-K461 PolarHBondContact O-N 2.96Å; A458-K461 PolarHBondContact O-N 3.2Å; D459-K461 VanDerWaalsContact C-N 3.33Å
462	K	49.2	Very low	75.8	Confident	226 Å²	226	100 Å²	100	98%	0.983	45%	0.453	S	S	*	.			trans	-102.7	0	164.4	-76.7	-174.1	172.6	-170.1	0	108.1

Retrieved 462 of 462 residues in 1134.6 ms (Link to these results)

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