DNJB2_HUMAN Loading...

DnaJ homolog subfamily B member 2

Functions as a co-chaperone, regulating the substrate binding and activating the ATPase activity of chaperones of the HSP70/heat shock protein 70 family^1,2. In parallel, also contributes to the ubiquitin-dependent proteasomal degradation of misfolded proteins^3,4. Thereby, may regulate the aggregation and promote the functional recovery of misfolded proteins like HTT, MC4R, PRKN, RHO and SOD1 and be crucial for many biological processes^5,6,7,8,9. Isoform 1 which is localized to the endoplasmic reticulum membranes may specifically function in ER-associated protein degradation of misfolded proteins¹⁰.

AlphaFold DB , UniProt , Accession P25686, Species HUMAN (Homo sapiens, Human), Gene DNAJB2, Length 324 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	61.7	Low	88.9	Confident	192 Å²	192	54.8 Å²	54.8	95%	0.946	30%	0.302	S	S	*	.				0	169	0	-67.2	70.5	162.2	0	0	108.5
2	A	78.9	Confident	89.1	Confident	46 Å²	46	64 Å²	64	38%	0.38	33%	0.329	S	S	.	.			trans	-70.6	154.2	170.8	0	0	0	0	0	111.5	E6 I7	A2-E6 VanDerWaalsContact CA-OE2 3.28Å; A2-E6 WeakPolarHBondContact CA-OE2 3.28Å; A2-E6 HydrophobicContact CB-CB 4.43Å; A2-I7 HydrophobicContact CB-CD1 4.46Å; A2-I7 HydrophobicContact CB-CG1 4.1Å
3	S	90	Very high	89.3	Confident	14 Å²	14	67.5 Å²	67.5	10%	0.098	36%	0.362	C	S	.	.			trans	-73.1	151.9	167.9	-53.6	0	0	0	0	110.8	Y5 E6 I7 R12 Y65	S3-Y5 PolarHBondContact O-N 3.11Å; S3-E6 VanDerWaalsContact CB-CD 3.46Å; S3-E6 WeakPolarHBondContact CB-OE1 3.39Å; S3-E6 VanDerWaalsContact N-CD 3.3Å; S3-E6 PolarHBondContact N-OE2 2.85Å; S3-E6 WeakPolarHBondContact O-CA 3.33Å; S3-E6 WeakPolarHBondContact O-CB 3.36Å; S3-E6 PolarHBondContact O-N 2.87Å; S3-E6 PolarHBondContact OG-OE1 2.8Å; S3-I7 PolarHBondContact O-N 3.46Å; S3-R12 PolarHBondContact OG-NH2 3.36Å; S3-Y65 VanDerWaalsContact CA-OH 3.28Å; S3-Y65 WeakPolarHBondContact CA-OH 2.99Å; S3-Y65 WeakPolarHBondContact CB-OH 3.5Å
4	Y	92.8	Very high	89.4	Confident	5 Å²	5	63.1 Å²	63.1	2%	0.02	34%	0.339	C	S	.	.	H	α-helix	trans	-59.4	-34.5	171.8	-65.1	-46.4	0	0	0	112.2	E6 I7 L8 E51 A52 V55 Y65 R70 L73	Y4-E6 VanDerWaalsContact C-N 3.32Å; Y4-E6 PolarHBondContact O-N 2.78Å; Y4-I7 HydrophobicContact CD1-CD1 4.09Å; Y4-I7 PolarHBondContact O-N 2.9Å; Y4-L8 PolarHBondContact O-N 2.7Å; Y4-E51 HydrophobicContact CE1-CG 3.96Å; Y4-E51 WeakPolarHBondContact CE1-OE1 3.47Å; Y4-E51 VanDerWaalsContact CZ-OE1 3.29Å; Y4-E51 PolarHBondContact OH-OE1 3.11Å; Y4-A52 VanDerWaalsContact CD1-CA 3.47Å; Y4-A52 HydrophobicContact CD1-CB 3.66Å; Y4-A52 HydrophobicContact CG-CB 4.05Å; Y4-V55 HydrophobicContact CD2-CB 3.99Å; Y4-V55 HydrophobicContact CD2-CG1 3.73Å; Y4-V55 HydrophobicContact CD2-CG2 4.34Å; Y4-V55 HydrophobicContact CE2-CB 3.93Å; Y4-V55 HydrophobicContact CE2-CG1 3.73Å; Y4-V55 HydrophobicContact CE2-CG2 3.78Å; Y4-Y65 AromaticContact CD2-CD1 3.92Å; Y4-Y65 HydrophobicContact CD2-CD1 3.92Å; Y4-Y65 AromaticContact CD2-CD2 3.61Å; Y4-Y65 HydrophobicContact CD2-CD2 3.61Å; Y4-Y65 AromaticContact CD2-CE1 3.67Å; Y4-Y65 HydrophobicContact CD2-CE1 3.67Å; Y4-Y65 AromaticContact CD2-CE2 3.41Å; Y4-Y65 HydrophobicContact CD2-CE2 3.41Å; Y4-Y65 VanDerWaalsContact CD2-CE2 3.41Å; Y4-Y65 AromaticContact CD2-CG 3.89Å; Y4-Y65 HydrophobicContact CD2-CG 3.89Å; Y4-Y65 AromaticContact CD2-CZ 3.43Å; Y4-Y65 VanDerWaalsContact CD2-CZ 3.43Å; Y4-Y65 AromaticContact CE2-CD2 3.68Å; Y4-Y65 HydrophobicContact CE2-CD2 3.68Å; Y4-Y65 AromaticContact CE2-CE2 3.68Å; Y4-Y65 HydrophobicContact CE2-CE2 3.68Å; Y4-Y65 HydrophobicContact CE2-CG 4.27Å; Y4-Y65 HydrophobicContact CG-CE1 4.25Å; Y4-Y65 HydrophobicContact CG-CE2 4.34Å; Y4-Y65 PolarHBondContact N-OH 2.9Å; Y4-R70 HydrophobicContact CD2-CG 4.39Å; Y4-R70 HydrophobicContact CE1-CG 4.39Å; Y4-R70 HydrophobicContact CE2-CB 4.38Å; Y4-R70 HydrophobicContact CE2-CG 3.68Å; Y4-L73 HydrophobicContact CE2-CD1 3.84Å
5	Y	94	Very high	89.7	Confident	5 Å²	5	62.3 Å²	62.3	2%	0.02	34%	0.341	C	S	.	.	H	α-helix	trans	-60.2	-38.1	171.5	-62.3	-71.2	0	0	0	112.9	S3 D9 V10 R12 L56 R62 Y65 D66	S3-Y5 PolarHBondContact O-N 3.11Å; Y5-D9 PolarHBondContact O-N 3.46Å; Y5-V10 HydrophobicContact CD1-CG2 4.08Å; Y5-V10 PolarHBondContact O-N 3.24Å; Y5-R12 HydrophobicContact CD1-CG 4.44Å; Y5-R12 HydrophobicContact CD2-CB 4.34Å; Y5-R12 HydrophobicContact CD2-CG 3.67Å; Y5-R12 HydrophobicContact CE1-CB 4.44Å; Y5-R12 HydrophobicContact CE2-CB 4.25Å; Y5-R12 HydrophobicContact CE2-CG 3.98Å; Y5-R12 HydrophobicContact CG-CB 4.46Å; Y5-R12 HydrophobicContact CG-CG 3.92Å; Y5-L56 HydrophobicContact CD1-CD1 3.81Å; Y5-L56 HydrophobicContact CD1-CD2 4.24Å; Y5-L56 HydrophobicContact CE1-CD1 4.02Å; Y5-L56 HydrophobicContact CE1-CD2 3.68Å; Y5-L56 HydrophobicContact CE1-CG 4.49Å; Y5-L56 HydrophobicContact CE2-CD2 4.05Å; Y5-L56 HydrophobicContact CG-CD1 4.22Å; Y5-R62 PolarHBondContact OH-NE 3.04Å; Y5-Y65 AromaticContact CD2-CE1 3.75Å; Y5-Y65 HydrophobicContact CD2-CE1 3.75Å; Y5-Y65 AromaticContact CE2-CD1 3.96Å; Y5-Y65 HydrophobicContact CE2-CD1 3.96Å; Y5-Y65 AromaticContact CE2-CE1 3.54Å; Y5-Y65 HydrophobicContact CE2-CE1 3.54Å; Y5-D66 VanDerWaalsContact CE2-OD1 3.22Å; Y5-D66 WeakPolarHBondContact CE2-OD1 3.5Å; Y5-D66 VanDerWaalsContact OH-CG 3.23Å; Y5-D66 PolarHBondContact OH-OD1 2.87Å; Y5-D66 PolarHBondContact OH-OD2 2.93Å
6	E	93.5	Very high	89.8	Confident	102 Å²	102	62 Å²	62	48%	0.477	35%	0.349	S	S	.	.	H	α-helix	trans	-73.7	-38.6	176.9	-67.4	149.4	-143.8	0	0	111.4	A2 S3 Y4 L8 D9	A2-E6 VanDerWaalsContact CA-OE2 3.28Å; A2-E6 WeakPolarHBondContact CA-OE2 3.28Å; A2-E6 HydrophobicContact CB-CB 4.43Å; S3-E6 VanDerWaalsContact CB-CD 3.46Å; S3-E6 WeakPolarHBondContact CB-OE1 3.39Å; S3-E6 VanDerWaalsContact N-CD 3.3Å; S3-E6 PolarHBondContact N-OE2 2.85Å; S3-E6 WeakPolarHBondContact O-CA 3.33Å; S3-E6 WeakPolarHBondContact O-CB 3.36Å; S3-E6 PolarHBondContact O-N 2.87Å; S3-E6 PolarHBondContact OG-OE1 2.8Å; Y4-E6 VanDerWaalsContact C-N 3.32Å; Y4-E6 PolarHBondContact O-N 2.78Å; E6-L8 PolarHBondContact O-N 2.79Å; E6-D9 PolarHBondContact O-N 3.25Å; E6-D9 VanDerWaalsContact O-N 3.14Å
7	I	93.3	Very high	89.9	Confident	26 Å²	26	64.8 Å²	64.8	13%	0.133	36%	0.363	C	S	.	.	H	α-helix	trans	-59.5	-37.1	177.4	-70.1	164.1	0	0	0	111.1	A2 S3 Y4 K26 E48 V49 A52	A2-I7 HydrophobicContact CB-CD1 4.46Å; A2-I7 HydrophobicContact CB-CG1 4.1Å; S3-I7 PolarHBondContact O-N 3.46Å; Y4-I7 HydrophobicContact CD1-CD1 4.09Å; Y4-I7 PolarHBondContact O-N 2.9Å; I7-K26 WeakPolarHBondContact O-CD 3.44Å; I7-K26 VanDerWaalsContact O-CE 3.24Å; I7-K26 WeakPolarHBondContact O-CE 3.18Å; I7-K26 PolarHBondContact O-NZ 2.83Å; I7-E48 HydrophobicContact CD1-CB 4.39Å; I7-E48 HydrophobicContact CG2-CB 4.16Å; I7-V49 HydrophobicContact CG2-CB 4.44Å; I7-V49 HydrophobicContact CG2-CG2 3.75Å; I7-A52 HydrophobicContact CB-CB 4.17Å; I7-A52 HydrophobicContact CG2-CB 3.94Å
8	L	93.4	Very high	90.1	Very high	1 Å²	1	65.7 Å²	65.7	1%	0.005	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-2.9	177.9	-65.4	-177.6	0	0	0	115	Y4 E6 V10 I19 A22 K26 V49 A52 L56	Y4-L8 PolarHBondContact O-N 2.7Å; E6-L8 PolarHBondContact O-N 2.79Å; L8-V10 HydrophobicContact CB-CG1 4.44Å; L8-V10 HydrophobicContact CB-CG2 3.98Å; L8-I19 HydrophobicContact CD1-CG2 4.02Å; L8-A22 HydrophobicContact CB-CB 4.21Å; L8-A22 WeakPolarHBondContact O-CB 3.41Å; L8-K26 HydrophobicContact CD2-CB 4.47Å; L8-K26 HydrophobicContact CD2-CG 4.44Å; L8-V49 HydrophobicContact CD2-CG1 3.99Å; L8-A52 HydrophobicContact CD1-CB 4.24Å; L8-A52 HydrophobicContact CD2-CB 4.35Å; L8-A52 HydrophobicContact CG-CB 3.95Å; L8-L56 HydrophobicContact CD1-CD1 4.14Å
9	D	93.1	Very high	90.3	Very high	110 Å²	110	62.2 Å²	62.2	59%	0.588	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	41.4	-169.6	-53.9	-19.8	0	0	0	114.3	Y5 E6 K26	Y5-D9 PolarHBondContact O-N 3.46Å; E6-D9 PolarHBondContact O-N 3.25Å; E6-D9 VanDerWaalsContact O-N 3.14Å; D9-K26 IonicContact OD1-NZ 2.82Å; D9-K26 PolarHBondContact OD1-NZ 2.71Å; D9-K26 WeakPolarHBondContact OD2-CE 3.37Å; D9-K26 IonicContact OD2-NZ 2.74Å; D9-K26 PolarHBondContact OD2-NZ 2.91Å
10	V	94	Very high	90.4	Very high	21 Å²	21	62.3 Å²	62.3	13%	0.127	34%	0.344	C	S	.	.			trans	-118.1	147.5	178.6	-65.5	0	0	0	0	112.6	Y5 L8 A14 I19 A22	Y5-V10 HydrophobicContact CD1-CG2 4.08Å; Y5-V10 PolarHBondContact O-N 3.24Å; L8-V10 HydrophobicContact CB-CG1 4.44Å; L8-V10 HydrophobicContact CB-CG2 3.98Å; V10-A14 HydrophobicContact CB-CB 3.93Å; V10-A14 HydrophobicContact CG2-CB 4.33Å; V10-I19 HydrophobicContact CG2-CG1 4.38Å; V10-A22 HydrophobicContact CG1-CB 3.37Å
11	P	93.6	Very high	90.4	Very high	81 Å²	81	64.7 Å²	64.7	53%	0.526	35%	0.351	S	S	.	.			trans	-68.3	154.7	171.4	30.2	-35.5	0	0	0	111	S13 A14	P11-S13 PolarHBondContact O-N 2.97Å; P11-S13 VanDerWaalsContact O-N 3.08Å; P11-A14 HydrophobicContact CG-CB 4.25Å; P11-A14 WeakPolarHBondContact O-CB 3.3Å; P11-A14 PolarHBondContact O-N 2.94Å
12	R	90.8	Very high	91.9	Very high	165 Å²	165	55.7 Å²	55.7	62%	0.623	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-21.3	177.2	-58.8	-165.7	176.4	-174.1	-4.1	113.7	S3 Y5 A14 R62	S3-R12 PolarHBondContact OG-NH2 3.36Å; Y5-R12 HydrophobicContact CD1-CG 4.44Å; Y5-R12 HydrophobicContact CD2-CB 4.34Å; Y5-R12 HydrophobicContact CD2-CG 3.67Å; Y5-R12 HydrophobicContact CE1-CB 4.44Å; Y5-R12 HydrophobicContact CE2-CB 4.25Å; Y5-R12 HydrophobicContact CE2-CG 3.98Å; Y5-R12 HydrophobicContact CG-CB 4.46Å; Y5-R12 HydrophobicContact CG-CG 3.92Å; R12-A14 VanDerWaalsContact C-N 3.34Å; R12-R62 PolarHBondContact O-NH2 3.38Å
13	S	91.5	Very high	92.6	Very high	110 Å²	110	53.5 Å²	53.5	77%	0.769	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	2.6	174.5	53.9	0	0	0	0	114.9	P11	P11-S13 PolarHBondContact O-N 2.97Å; P11-S13 VanDerWaalsContact O-N 3.08Å
14	A	91.7	Very high	92.5	Very high	5 Å²	5	55.5 Å²	55.5	4%	0.041	30%	0.295	C	S	.	.			trans	-60.2	142.2	-177.6	0	0	0	0	0	113.3	V10 P11 R12 D18 I19 R62	V10-A14 HydrophobicContact CB-CB 3.93Å; V10-A14 HydrophobicContact CG2-CB 4.33Å; P11-A14 HydrophobicContact CG-CB 4.25Å; P11-A14 WeakPolarHBondContact O-CB 3.3Å; P11-A14 PolarHBondContact O-N 2.94Å; R12-A14 VanDerWaalsContact C-N 3.34Å; A14-D18 HydrophobicContact CB-CB 4.01Å; A14-I19 HydrophobicContact CB-CD1 4.39Å; A14-I19 HydrophobicContact CB-CG1 4.11Å; A14-R62 PolarHBondContact O-NH1 3.38Å; A14-R62 PolarHBondContact O-NH2 2.98Å
15	S	93.1	Very high	92.4	Very high	51 Å²	51	62.8 Å²	62.8	36%	0.357	32%	0.322	S	S	.	.			trans	-72.6	166.9	172.8	73.2	0	0	0	0	111.6	D17 D18 I19	S15-D17 PolarHBondContact O-N 2.95Å; S15-D17 PolarHBondContact OG-N 3.33Å; S15-D18 VanDerWaalsContact CB-OD2 3.27Å; S15-D18 WeakPolarHBondContact CB-OD2 3.49Å; S15-D18 PolarHBondContact N-OD2 2.74Å; S15-D18 PolarHBondContact O-N 2.82Å; S15-D18 PolarHBondContact OG-N 3.18Å; S15-D18 VanDerWaalsContact OG-N 3.11Å; S15-D18 PolarHBondContact OG-OD2 3.06Å; S15-I19 WeakPolarHBondContact O-CD1 3.43Å; S15-I19 WeakPolarHBondContact O-CG1 3.44Å; S15-I19 PolarHBondContact O-N 3.47Å
16	A	91.9	Very high	92.3	Very high	58 Å²	58	64 Å²	64	48%	0.479	33%	0.328	S	S	.	.	H	α-helix	trans	-61.1	-33.2	174.1	0	0	0	0	0	112.1	I19 K20	A16-I19 PolarHBondContact O-N 2.91Å; A16-K20 WeakPolarHBondContact O-CB 3.26Å; A16-K20 PolarHBondContact O-N 2.84Å
17	D	91.4	Very high	92.1	Very high	109 Å²	109	59.2 Å²	59.2	58%	0.583	31%	0.305	S	S	*	.	H	α-helix	trans	-72.2	-38	177.4	-63.5	-56.1	0	0	0	112.2	S15 I19 K20 K21	S15-D17 PolarHBondContact O-N 2.95Å; S15-D17 PolarHBondContact OG-N 3.33Å; D17-I19 VanDerWaalsContact C-N 3.35Å; D17-K20 PolarHBondContact O-N 2.8Å; D17-K21 WeakPolarHBondContact O-CB 3.39Å; D17-K21 WeakPolarHBondContact O-CG 3.26Å; D17-K21 PolarHBondContact O-N 2.79Å
18	D	93.9	Very high	91.8	Very high	81 Å²	81	60.2 Å²	60.2	43%	0.433	31%	0.311	S	S	.	.	H	α-helix	trans	-62.6	-43.4	172.7	-60.8	-51.9	0	0	0	111	A14 S15 K20 K21 A22	A14-D18 HydrophobicContact CB-CB 4.01Å; S15-D18 VanDerWaalsContact CB-OD2 3.27Å; S15-D18 WeakPolarHBondContact CB-OD2 3.49Å; S15-D18 PolarHBondContact N-OD2 2.74Å; S15-D18 PolarHBondContact O-N 2.82Å; S15-D18 PolarHBondContact OG-N 3.18Å; S15-D18 VanDerWaalsContact OG-N 3.11Å; S15-D18 PolarHBondContact OG-OD2 3.06Å; D18-K20 VanDerWaalsContact C-N 3.35Å; D18-K21 PolarHBondContact O-N 3.42Å; D18-A22 VanDerWaalsContact O-CB 3.23Å; D18-A22 WeakPolarHBondContact O-CB 3.38Å; D18-A22 PolarHBondContact O-N 2.71Å
19	I	93.5	Very high	91.6	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-63.2	-41.2	176.5	-70	159.5	0	0	0	110.6	L8 V10 A14 S15 A16 D17 A22 Y23 Y53 L56	L8-I19 HydrophobicContact CD1-CG2 4.02Å; V10-I19 HydrophobicContact CG2-CG1 4.38Å; A14-I19 HydrophobicContact CB-CD1 4.39Å; A14-I19 HydrophobicContact CB-CG1 4.11Å; S15-I19 WeakPolarHBondContact O-CD1 3.43Å; S15-I19 WeakPolarHBondContact O-CG1 3.44Å; S15-I19 PolarHBondContact O-N 3.47Å; A16-I19 PolarHBondContact O-N 2.91Å; D17-I19 VanDerWaalsContact C-N 3.35Å; I19-A22 PolarHBondContact O-N 2.84Å; I19-Y23 WeakPolarHBondContact O-CB 3.35Å; I19-Y23 PolarHBondContact O-N 2.72Å; I19-Y53 HydrophobicContact CG2-CD2 3.82Å; I19-Y53 HydrophobicContact CG2-CE2 3.92Å; I19-L56 HydrophobicContact CD1-CB 4.17Å; I19-L56 HydrophobicContact CG2-CB 3.95Å
20	K	91.2	Very high	91.5	Very high	63 Å²	63	63.2 Å²	63.2	27%	0.274	32%	0.319	S	S	.	.	H	α-helix	trans	-63.7	-43.6	173.6	177	169.1	-178.8	151.7	0	112.6	A16 D17 D18 R24 Y53 F106	A16-K20 WeakPolarHBondContact O-CB 3.26Å; A16-K20 PolarHBondContact O-N 2.84Å; D17-K20 PolarHBondContact O-N 2.8Å; D18-K20 VanDerWaalsContact C-N 3.35Å; K20-R24 WeakPolarHBondContact O-CG 3.45Å; K20-R24 PolarHBondContact O-N 2.84Å; K20-Y53 HydrophobicContact CB-CE2 4.42Å; K20-F106 HydrophobicContact CD-CE1 3.58Å; K20-F106 HydrophobicContact CD-CZ 3.92Å; K20-F106 VanDerWaalsContact CE-CE1 3.46Å; K20-F106 HydrophobicContact CG-CE1 3.92Å; K20-F106 VanDerWaalsContact NZ-CE1 3.34Å
21	K	91.2	Very high	91.2	Very high	113 Å²	113	64.6 Å²	64.6	49%	0.491	32%	0.324	S	S	.	.	H	α-helix	trans	-66.8	-39.6	175.7	-74.3	-174	177.2	-150.6	0	112	D17 D18 R24 R25 D119	D17-K21 WeakPolarHBondContact O-CB 3.39Å; D17-K21 WeakPolarHBondContact O-CG 3.26Å; D17-K21 PolarHBondContact O-N 2.79Å; D18-K21 PolarHBondContact O-N 3.42Å; K21-R24 PolarHBondContact O-N 2.82Å; K21-R25 WeakPolarHBondContact O-CG 3.42Å; K21-R25 PolarHBondContact O-N 2.85Å; K21-R25 VanDerWaalsContact O-N 3.12Å; K21-D119 IonicContact NZ-OD2 3.65Å
22	A	93.6	Very high	90.7	Very high	4 Å²	4	63 Å²	63	3%	0.033	31%	0.313	C	S	.	.	H	α-helix	trans	-66.1	-45	176.1	0	0	0	0	0	112.3	L8 V10 D18 I19 R25 K26	L8-A22 HydrophobicContact CB-CB 4.21Å; L8-A22 WeakPolarHBondContact O-CB 3.41Å; V10-A22 HydrophobicContact CG1-CB 3.37Å; D18-A22 VanDerWaalsContact O-CB 3.23Å; D18-A22 WeakPolarHBondContact O-CB 3.38Å; D18-A22 PolarHBondContact O-N 2.71Å; I19-A22 PolarHBondContact O-N 2.84Å; A22-R25 PolarHBondContact O-N 2.78Å; A22-K26 WeakPolarHBondContact O-CB 3.46Å; A22-K26 WeakPolarHBondContact O-CG 3.38Å; A22-K26 PolarHBondContact O-N 2.83Å
23	Y	92.5	Very high	90.5	Very high	0 Å²	0	61 Å²	61	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-58.2	-48	173.3	174.9	-123.6	0	0	0	111.6	I19 R25 K26 A27 V49 A50 Y53 F107	I19-Y23 WeakPolarHBondContact O-CB 3.35Å; I19-Y23 PolarHBondContact O-N 2.72Å; Y23-R25 VanDerWaalsContact C-N 3.34Å; Y23-R25 PolarHBondContact O-N 2.88Å; Y23-K26 PolarHBondContact O-N 2.79Å; Y23-A27 HydrophobicContact CD2-CB 4.48Å; Y23-A27 HydrophobicContact CE2-CB 4.28Å; Y23-A27 WeakPolarHBondContact O-CB 3.44Å; Y23-A27 PolarHBondContact O-N 2.82Å; Y23-V49 HydrophobicContact CD2-CG1 3.63Å; Y23-V49 HydrophobicContact CE2-CG1 3.95Å; Y23-A50 HydrophobicContact CE2-CB 4.37Å; Y23-Y53 AromaticContact CD1-CD1 3.46Å; Y23-Y53 HydrophobicContact CD1-CD1 3.46Å; Y23-Y53 VanDerWaalsContact CD1-CD1 3.46Å; Y23-Y53 AromaticContact CD1-CD2 3.77Å; Y23-Y53 HydrophobicContact CD1-CD2 3.77Å; Y23-Y53 AromaticContact CD1-CE1 3.8Å; Y23-Y53 HydrophobicContact CD1-CE1 3.8Å; Y23-Y53 HydrophobicContact CD1-CE2 4.08Å; Y23-Y53 AromaticContact CD1-CG 3.47Å; Y23-Y53 HydrophobicContact CD1-CG 3.47Å; Y23-Y53 VanDerWaalsContact CD1-CG 3.47Å; Y23-Y53 HydrophobicContact CD2-CD1 4.34Å; Y23-Y53 HydrophobicContact CD2-CD2 4.33Å; Y23-Y53 AromaticContact CD2-CG 3.79Å; Y23-Y53 HydrophobicContact CD2-CG 3.79Å; Y23-Y53 AromaticContact CE1-CD1 3.58Å; Y23-Y53 HydrophobicContact CE1-CD1 3.58Å; Y23-Y53 HydrophobicContact CE1-CE1 4Å; Y23-Y53 AromaticContact CE1-CG 3.98Å; Y23-Y53 HydrophobicContact CE1-CG 3.98Å; Y23-Y53 HydrophobicContact CE2-CD1 4.44Å; Y23-Y53 HydrophobicContact CE2-CG 4.27Å; Y23-Y53 AromaticContact CG-CD1 3.89Å; Y23-Y53 HydrophobicContact CG-CD1 3.89Å; Y23-Y53 AromaticContact CG-CD2 3.58Å; Y23-Y53 HydrophobicContact CG-CD2 3.58Å; Y23-Y53 HydrophobicContact CG-CE2 4.27Å; Y23-Y53 AromaticContact CG-CG 3.38Å; Y23-Y53 HydrophobicContact CG-CG 3.38Å; Y23-F107 AromaticContact CD1-CE2 3.83Å; Y23-F107 HydrophobicContact CD1-CE2 3.83Å; Y23-F107 AromaticContact CD1-CZ 3.73Å; Y23-F107 HydrophobicContact CD1-CZ 3.73Å; Y23-F107 AromaticContact CE1-CE2 3.5Å; Y23-F107 HydrophobicContact CE1-CE2 3.5Å; Y23-F107 AromaticContact CE1-CZ 3.87Å; Y23-F107 HydrophobicContact CE1-CZ 3.87Å
24	R	88.2	Confident	90.2	Very high	55 Å²	55	61.3 Å²	61.3	21%	0.208	30%	0.303	C	S	.	.	H	α-helix	trans	-51.7	-49.4	173.3	-76.7	179.2	169.5	-175.6	-5.7	112.1	K20 K21 L28 F107 E115	K20-R24 WeakPolarHBondContact O-CG 3.45Å; K20-R24 PolarHBondContact O-N 2.84Å; K21-R24 PolarHBondContact O-N 2.82Å; R24-L28 WeakPolarHBondContact O-CB 3.38Å; R24-L28 PolarHBondContact O-N 3.49Å; R24-F107 HydrophobicContact CG-CE1 3.81Å; R24-F107 HydrophobicContact CG-CE2 4.2Å; R24-F107 HydrophobicContact CG-CZ 3.44Å; R24-F107 VanDerWaalsContact CG-CZ 3.44Å; R24-E115 IonicContact CZ-OE2 3.21Å; R24-E115 IonicContact NH1-OE2 2.82Å; R24-E115 IonicContact NH2-OE2 2.75Å; R24-E115 PolarHBondContact NH2-OE2 3.43Å
25	R	90.8	Very high	90	Very high	158 Å²	158	62.3 Å²	62.3	60%	0.596	31%	0.307	S	S	*	.	H	α-helix	trans	-64	-43.3	179.6	-72.5	170.7	60.3	-142.4	-5.9	113.1	K21 A22 Y23 Q29	K21-R25 WeakPolarHBondContact O-CG 3.42Å; K21-R25 PolarHBondContact O-N 2.85Å; K21-R25 VanDerWaalsContact O-N 3.12Å; A22-R25 PolarHBondContact O-N 2.78Å; Y23-R25 VanDerWaalsContact C-N 3.34Å; Y23-R25 PolarHBondContact O-N 2.88Å; R25-Q29 WeakPolarHBondContact O-CB 3.32Å; R25-Q29 PolarHBondContact O-N 2.9Å
26	K	92.2	Very high	89.7	Confident	32 Å²	32	64.3 Å²	64.3	14%	0.139	32%	0.319	C	S	.	.	H	α-helix	trans	-74.4	-38.8	-178.4	-72.7	-88.5	-177.8	152.4	0	112.4	I7 L8 D9 A22 Y23 L28 Q29 W30 V49	I7-K26 WeakPolarHBondContact O-CD 3.44Å; I7-K26 VanDerWaalsContact O-CE 3.24Å; I7-K26 WeakPolarHBondContact O-CE 3.18Å; I7-K26 PolarHBondContact O-NZ 2.83Å; L8-K26 HydrophobicContact CD2-CB 4.47Å; L8-K26 HydrophobicContact CD2-CG 4.44Å; D9-K26 IonicContact OD1-NZ 2.82Å; D9-K26 PolarHBondContact OD1-NZ 2.71Å; D9-K26 WeakPolarHBondContact OD2-CE 3.37Å; D9-K26 IonicContact OD2-NZ 2.74Å; D9-K26 PolarHBondContact OD2-NZ 2.91Å; A22-K26 WeakPolarHBondContact O-CB 3.46Å; A22-K26 WeakPolarHBondContact O-CG 3.38Å; A22-K26 PolarHBondContact O-N 2.83Å; Y23-K26 PolarHBondContact O-N 2.79Å; K26-L28 VanDerWaalsContact C-N 3.34Å; K26-Q29 PolarHBondContact O-N 2.94Å; K26-W30 VanDerWaalsContact O-CD1 3.31Å; K26-W30 PolarHBondContact O-N 3.08Å; K26-V49 HydrophobicContact CB-CB 4.39Å; K26-V49 HydrophobicContact CB-CG1 3.59Å; K26-V49 HydrophobicContact CB-CG2 3.82Å; K26-V49 HydrophobicContact CD-CG2 4.31Å; K26-V49 HydrophobicContact CG-CG2 4.45Å
27	A	90.2	Very high	89.5	Confident	1 Å²	1	68.5 Å²	68.5	1%	0.008	33%	0.333	C	S	.	.	H	α-helix	trans	-58.9	-46.2	171.5	0	0	0	0	0	110.7	Y23 Q29 W30 H31 F46 F103	Y23-A27 HydrophobicContact CD2-CB 4.48Å; Y23-A27 HydrophobicContact CE2-CB 4.28Å; Y23-A27 WeakPolarHBondContact O-CB 3.44Å; Y23-A27 PolarHBondContact O-N 2.82Å; A27-Q29 PolarHBondContact O-N 3.5Å; A27-W30 PolarHBondContact O-N 3.3Å; A27-H31 WeakPolarHBondContact O-CB 2.98Å; A27-H31 PolarHBondContact O-N 3.44Å; A27-F46 HydrophobicContact CB-CD2 4.43Å; A27-F46 HydrophobicContact CB-CE2 3.85Å; A27-F103 HydrophobicContact CB-CD2 4.22Å; A27-F103 HydrophobicContact CB-CE2 3.97Å
28	L	86.7	Confident	89.5	Confident	47 Å²	47	68 Å²	68	25%	0.246	33%	0.33	C	S	.	.	H	α-helix	trans	-61.3	-42.4	174.6	-174.4	65.3	0	0	0	112.5	R24 K26 W30 K34 F113 L116	R24-L28 WeakPolarHBondContact O-CB 3.38Å; R24-L28 PolarHBondContact O-N 3.49Å; K26-L28 VanDerWaalsContact C-N 3.34Å; L28-W30 VanDerWaalsContact C-N 3.34Å; L28-W30 PolarHBondContact O-N 2.77Å; L28-K34 HydrophobicContact CD1-CD 3.91Å; L28-K34 VanDerWaalsContact CD1-CE 3.45Å; L28-K34 HydrophobicContact CG-CD 4.34Å; L28-K34 WeakPolarHBondContact O-CD 3.3Å; L28-F113 HydrophobicContact CD1-CD1 3.47Å; L28-F113 VanDerWaalsContact CD1-CD1 3.47Å; L28-F113 HydrophobicContact CD1-CE1 3.24Å; L28-F113 HydrophobicContact CD1-CZ 4.25Å; L28-L116 HydrophobicContact CD2-CD2 3.61Å
29	Q	88.9	Confident	89.3	Confident	115 Å²	115	69 Å²	69	54%	0.537	33%	0.331	S	S	.	.	H	α-helix	trans	-65.4	-34.8	-179.7	-177	59.5	84.9	0	0	113.1	R25 K26 A27 N35	R25-Q29 WeakPolarHBondContact O-CB 3.32Å; R25-Q29 PolarHBondContact O-N 2.9Å; K26-Q29 PolarHBondContact O-N 2.94Å; A27-Q29 PolarHBondContact O-N 3.5Å; Q29-N35 PolarHBondContact O-ND2 2.9Å
30	W	91.1	Very high	89.1	Confident	58 Å²	58	75.5 Å²	75.5	22%	0.22	36%	0.361	C	S	.	.	H	α-helix	trans	-109.5	10.7	-174.6	-60.8	118.4	0	0	0	114.5	K26 A27 L28 F41 A42 K45 F46	K26-W30 VanDerWaalsContact O-CD1 3.31Å; K26-W30 PolarHBondContact O-N 3.08Å; A27-W30 PolarHBondContact O-N 3.3Å; L28-W30 VanDerWaalsContact C-N 3.34Å; L28-W30 PolarHBondContact O-N 2.77Å; W30-F41 HydrophobicContact CH2-CD1 4.2Å; W30-F41 AromaticContact CH2-CE1 3.69Å; W30-F41 HydrophobicContact CH2-CE1 3.69Å; W30-F41 HydrophobicContact CZ2-CE1 4.44Å; W30-F41 AromaticContact CZ3-CD1 3.84Å; W30-F41 HydrophobicContact CZ3-CD1 3.84Å; W30-F41 AromaticContact CZ3-CE1 3.82Å; W30-F41 HydrophobicContact CZ3-CE1 3.82Å; W30-A42 HydrophobicContact CE3-CB 4.25Å; W30-K45 HydrophobicContact CB-CB 4.04Å; W30-K45 HydrophobicContact CD2-CB 3.51Å; W30-K45 HydrophobicContact CD2-CG 4.03Å; W30-K45 HydrophobicContact CE3-CB 4.06Å; W30-K45 HydrophobicContact CE3-CG 4.33Å; W30-K45 HydrophobicContact CG-CB 3.49Å; W30-K45 VanDerWaalsContact CG-CB 3.49Å; W30-K45 HydrophobicContact CG-CG 4.48Å; W30-K45 HydrophobicContact CZ2-CG 4.25Å; W30-F46 HydrophobicContact CB-CB 4.22Å
31	H	87	Confident	89.1	Confident	51 Å²	51	77.8 Å²	77.8	24%	0.236	37%	0.371	C	S	.	.			trans	-62.3	135.3	174.5	-162.1	-110.2	0	0	0	110.2	A27 D33 K34 N35	A27-H31 WeakPolarHBondContact O-CB 2.98Å; A27-H31 PolarHBondContact O-N 3.44Å; H31-D33 VanDerWaalsContact C-N 3.29Å; H31-D33 VanDerWaalsContact ND1-CB 3.33Å; H31-D33 WeakPolarHBondContact ND1-CB 3.46Å; H31-D33 PolarHBondContact O-N 3.02Å; H31-K34 PolarHBondContact O-N 3.48Å; H31-N35 PolarHBondContact O-N 3.32Å; H31-N35 PolarHBondContact O-ND2 3.28Å
32	P	84.1	Confident	89	Confident	46 Å²	46	72.4 Å²	72.4	30%	0.299	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-61.2	-34.8	-175	21.6	-33.2	0	0	0	113.2	K34 N35 K39	P32-K34 PolarHBondContact O-N 3.25Å; P32-N35 CarbonylContact O-C 3.5Å; P32-N35 PolarHBondContact O-N 3.08Å; P32-K39 HydrophobicContact CB-CG 4.24Å
33	D	84.8	Confident	88.8	Confident	125 Å²	125	77.2 Å²	77.2	67%	0.668	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-55.9	-31.6	173.4	-178.1	71.8	0	0	0	113.4	H31	H31-D33 VanDerWaalsContact C-N 3.29Å; H31-D33 VanDerWaalsContact ND1-CB 3.33Å; H31-D33 WeakPolarHBondContact ND1-CB 3.46Å; H31-D33 PolarHBondContact O-N 3.02Å
34	K	86	Confident	88.8	Confident	116 Å²	116	83.5 Å²	83.5	50%	0.504	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-92	-4.3	179	-73	-170.7	172	-56.5	0	114.1	L28 H31 P32 P36	L28-K34 HydrophobicContact CD1-CD 3.91Å; L28-K34 VanDerWaalsContact CD1-CE 3.45Å; L28-K34 HydrophobicContact CG-CD 4.34Å; L28-K34 WeakPolarHBondContact O-CD 3.3Å; H31-K34 PolarHBondContact O-N 3.48Å; P32-K34 PolarHBondContact O-N 3.25Å; K34-P36 VanDerWaalsContact C-CD 3.49Å
35	N	87.9	Confident	88.9	Confident	26 Å²	26	83.6 Å²	83.6	14%	0.139	40%	0.399	C	S	.	.			trans	-135.4	51.7	-176.1	-61.9	-91.3	0	0	0	111.5	Q29 H31 P32 D37 N38 K39 A42	Q29-N35 PolarHBondContact O-ND2 2.9Å; H31-N35 PolarHBondContact O-N 3.32Å; H31-N35 PolarHBondContact O-ND2 3.28Å; P32-N35 CarbonylContact O-C 3.5Å; P32-N35 PolarHBondContact O-N 3.08Å; N35-D37 VanDerWaalsContact C-N 3.25Å; N35-D37 PolarHBondContact O-N 3.35Å; N35-N38 CarbonylContact O-C 3.6Å; N35-N38 PolarHBondContact O-N 3.09Å; N35-N38 VanDerWaalsContact O-N 3.15Å; N35-K39 PolarHBondContact O-N 3.34Å; N35-A42 HydrophobicContact CB-CB 3.48Å; N35-A42 VanDerWaalsContact CB-CB 3.48Å
36	P	86.1	Confident	88.9	Confident	92 Å²	92	76.3 Å²	76.3	60%	0.597	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-59	-36	-174.1	25.4	-35.2	0	0	0	112.8	K34 N38	K34-P36 VanDerWaalsContact C-CD 3.49Å; P36-N38 VanDerWaalsContact C-N 3.33Å; P36-N38 PolarHBondContact O-N 3.24Å
37	D	89.2	Confident	88.8	Confident	146 Å²	146	81.2 Å²	81.2	78%	0.781	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-78.5	-12.1	-177.3	-46.1	-57.6	0	0	0	114.1	N35	N35-D37 VanDerWaalsContact C-N 3.25Å; N35-D37 PolarHBondContact O-N 3.35Å
38	N	89.7	Confident	88.9	Confident	99 Å²	99	83.4 Å²	83.4	53%	0.529	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-139.7	38.6	-172.4	-74	-87.2	0	0	0	111.3	N35 P36 E40 F41 A42	N35-N38 CarbonylContact O-C 3.6Å; N35-N38 PolarHBondContact O-N 3.09Å; N35-N38 VanDerWaalsContact O-N 3.15Å; P36-N38 VanDerWaalsContact C-N 3.33Å; P36-N38 PolarHBondContact O-N 3.24Å; N38-E40 VanDerWaalsContact C-N 3.31Å; N38-E40 PolarHBondContact O-N 2.97Å; N38-F41 PolarHBondContact O-N 3.44Å; N38-A42 WeakPolarHBondContact O-CB 3.47Å; N38-A42 PolarHBondContact O-N 2.82Å
39	K	89.9	Confident	89.2	Confident	101 Å²	101	81.2 Å²	81.2	44%	0.439	39%	0.392	S	S	.	.	H	α-helix	trans	-55	-43.3	-168.7	-173.6	-169.1	168.6	-161.9	0	112.8	P32 N35 F41 A42 E43	P32-K39 HydrophobicContact CB-CG 4.24Å; N35-K39 PolarHBondContact O-N 3.34Å; K39-F41 PolarHBondContact O-N 2.8Å; K39-A42 PolarHBondContact O-N 2.77Å; K39-E43 VanDerWaalsContact O-CB 3.29Å; K39-E43 WeakPolarHBondContact O-CB 3.45Å; K39-E43 PolarHBondContact O-N 2.83Å
40	E	89.7	Confident	89.3	Confident	138 Å²	138	75.9 Å²	75.9	65%	0.645	37%	0.367	S	S	*	.	H	α-helix	trans	-68.2	-37.4	-175.5	-59.7	65.8	-143	0	0	111.5	N38 K44	N38-E40 VanDerWaalsContact C-N 3.31Å; N38-E40 PolarHBondContact O-N 2.97Å; E40-K44 WeakPolarHBondContact O-CB 3.29Å; E40-K44 PolarHBondContact O-N 3.31Å; E40-K44 VanDerWaalsContact O-N 3.09Å
41	F	90.7	Very high	89.3	Confident	110 Å²	110	75.9 Å²	75.9	48%	0.482	37%	0.37	S	S	.	.	H	α-helix	trans	-72.3	-40.3	175.3	-172.8	-92.9	0	0	0	111.2	W30 N38 K39 K45	W30-F41 HydrophobicContact CH2-CD1 4.2Å; W30-F41 AromaticContact CH2-CE1 3.69Å; W30-F41 HydrophobicContact CH2-CE1 3.69Å; W30-F41 HydrophobicContact CZ2-CE1 4.44Å; W30-F41 AromaticContact CZ3-CD1 3.84Å; W30-F41 HydrophobicContact CZ3-CD1 3.84Å; W30-F41 AromaticContact CZ3-CE1 3.82Å; W30-F41 HydrophobicContact CZ3-CE1 3.82Å; N38-F41 PolarHBondContact O-N 3.44Å; K39-F41 PolarHBondContact O-N 2.8Å; F41-K45 HydrophobicContact CD1-CG 4.15Å; F41-K45 HydrophobicContact CE1-CG 3.81Å; F41-K45 HydrophobicContact CZ-CG 4.2Å; F41-K45 WeakPolarHBondContact O-CB 3.36Å; F41-K45 WeakPolarHBondContact O-CG 3.31Å; F41-K45 PolarHBondContact O-N 2.73Å
42	A	90.4	Very high	89.6	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-64	-47.8	175.6	0	0	0	0	0	111.6	W30 N35 N38 K39 K44 K45 F46	W30-A42 HydrophobicContact CE3-CB 4.25Å; N35-A42 HydrophobicContact CB-CB 3.48Å; N35-A42 VanDerWaalsContact CB-CB 3.48Å; N38-A42 WeakPolarHBondContact O-CB 3.47Å; N38-A42 PolarHBondContact O-N 2.82Å; K39-A42 PolarHBondContact O-N 2.77Å; A42-K44 PolarHBondContact O-N 2.76Å; A42-K45 CarbonylContact O-C 3.55Å; A42-K45 PolarHBondContact O-N 2.7Å; A42-K45 VanDerWaalsContact O-N 3.12Å; A42-F46 VanDerWaalsContact O-CB 3.32Å; A42-F46 WeakPolarHBondContact O-CB 3.29Å; A42-F46 PolarHBondContact O-N 2.92Å
43	E	89.7	Confident	90	Very high	105 Å²	105	71.6 Å²	71.6	49%	0.491	35%	0.346	S	S	.	.	H	α-helix	trans	-58.7	-45.7	175.9	-172.2	-178.5	135	0	0	111.5	K39 K45 F46 K47	K39-E43 VanDerWaalsContact O-CB 3.29Å; K39-E43 WeakPolarHBondContact O-CB 3.45Å; K39-E43 PolarHBondContact O-N 2.83Å; E43-K45 VanDerWaalsContact C-N 3.33Å; E43-K45 PolarHBondContact O-N 2.94Å; E43-F46 PolarHBondContact O-N 2.81Å; E43-K47 WeakPolarHBondContact O-CB 3.4Å; E43-K47 PolarHBondContact O-N 2.92Å
44	K	91	Very high	90.2	Very high	133 Å²	133	67 Å²	67	58%	0.578	32%	0.32	S	S	*	.	H	α-helix	trans	-59	-43.4	174.2	-177	174	-179.1	173.6	0	112.1	E40 A42 K47 E48	E40-K44 WeakPolarHBondContact O-CB 3.29Å; E40-K44 PolarHBondContact O-N 3.31Å; E40-K44 VanDerWaalsContact O-N 3.09Å; A42-K44 PolarHBondContact O-N 2.76Å; K44-K47 PolarHBondContact O-N 3.02Å; K44-E48 WeakPolarHBondContact O-CG 3.33Å; K44-E48 PolarHBondContact O-N 2.77Å
45	K	90.8	Very high	90.5	Very high	57 Å²	57	61.5 Å²	61.5	25%	0.248	30%	0.296	C	S	.	.	H	α-helix	trans	-70.1	-37.5	177.7	-74	-72.2	158.1	-155.5	0	112.8	W30 F41 A42 E43 K47 E48 V49	W30-K45 HydrophobicContact CB-CB 4.04Å; W30-K45 HydrophobicContact CD2-CB 3.51Å; W30-K45 HydrophobicContact CD2-CG 4.03Å; W30-K45 HydrophobicContact CE3-CB 4.06Å; W30-K45 HydrophobicContact CE3-CG 4.33Å; W30-K45 HydrophobicContact CG-CB 3.49Å; W30-K45 VanDerWaalsContact CG-CB 3.49Å; W30-K45 HydrophobicContact CG-CG 4.48Å; W30-K45 HydrophobicContact CZ2-CG 4.25Å; F41-K45 HydrophobicContact CD1-CG 4.15Å; F41-K45 HydrophobicContact CE1-CG 3.81Å; F41-K45 HydrophobicContact CZ-CG 4.2Å; F41-K45 WeakPolarHBondContact O-CB 3.36Å; F41-K45 WeakPolarHBondContact O-CG 3.31Å; F41-K45 PolarHBondContact O-N 2.73Å; A42-K45 CarbonylContact O-C 3.55Å; A42-K45 PolarHBondContact O-N 2.7Å; A42-K45 VanDerWaalsContact O-N 3.12Å; E43-K45 VanDerWaalsContact C-N 3.33Å; E43-K45 PolarHBondContact O-N 2.94Å; K45-K47 VanDerWaalsContact C-N 3.33Å; K45-E48 IonicContact NZ-OE1 3.66Å; K45-E48 IonicContact NZ-OE2 3.82Å; K45-E48 PolarHBondContact NZ-OE2 2.93Å; K45-E48 PolarHBondContact O-N 3.5Å; K45-V49 VanDerWaalsContact O-CB 3.26Å; K45-V49 WeakPolarHBondContact O-CB 3.22Å; K45-V49 WeakPolarHBondContact O-CG2 3.47Å; K45-V49 PolarHBondContact O-N 3.04Å
46	F	91	Very high	90.7	Very high	4 Å²	4	60.3 Å²	60.3	2%	0.018	29%	0.29	C	S	.	.	H	α-helix	trans	-62.2	-41.3	174.5	-171.1	-113.4	0	0	0	111.1	A27 W30 A42 E43 V49 A50 P99 E100 F103	A27-F46 HydrophobicContact CB-CD2 4.43Å; A27-F46 HydrophobicContact CB-CE2 3.85Å; W30-F46 HydrophobicContact CB-CB 4.22Å; A42-F46 VanDerWaalsContact O-CB 3.32Å; A42-F46 WeakPolarHBondContact O-CB 3.29Å; A42-F46 PolarHBondContact O-N 2.92Å; E43-F46 PolarHBondContact O-N 2.81Å; F46-V49 PolarHBondContact O-N 2.99Å; F46-A50 WeakPolarHBondContact O-CB 3.29Å; F46-A50 PolarHBondContact O-N 2.81Å; F46-P99 HydrophobicContact CD1-CB 3.52Å; F46-P99 HydrophobicContact CD1-CG 4.41Å; F46-P99 HydrophobicContact CE1-CB 3.46Å; F46-P99 VanDerWaalsContact CE1-CB 3.46Å; F46-P99 HydrophobicContact CZ-CB 4.43Å; F46-E100 HydrophobicContact CE1-CG 4.38Å; F46-E100 WeakPolarHBondContact CE1-OE1 3.3Å; F46-F103 HydrophobicContact CZ-CD2 4.44Å
47	K	91	Very high	90.8	Very high	136 Å²	136	58.1 Å²	58.1	59%	0.591	28%	0.277	S	S	*	.	H	α-helix	trans	-64.7	-48.5	174.2	-169.7	169.3	-175.3	170	0	112.9	E43 K44 K45 V49 A50 E51 P99	E43-K47 WeakPolarHBondContact O-CB 3.4Å; E43-K47 PolarHBondContact O-N 2.92Å; K44-K47 PolarHBondContact O-N 3.02Å; K45-K47 VanDerWaalsContact C-N 3.33Å; K47-V49 PolarHBondContact O-N 3.15Å; K47-A50 PolarHBondContact O-N 3.37Å; K47-E51 WeakPolarHBondContact O-CB 3.49Å; K47-E51 PolarHBondContact O-N 2.97Å; K47-P99 HydrophobicContact CB-CG 4.05Å; K47-P99 HydrophobicContact CG-CG 4.04Å
48	E	91.7	Very high	90.9	Very high	46 Å²	46	54.4 Å²	54.4	22%	0.215	26%	0.257	C	S	.	.	H	α-helix	trans	-56.1	-40.5	173.1	-73.4	173.7	-161.6	0	0	111.7	I7 K44 K45 A52	I7-E48 HydrophobicContact CD1-CB 4.39Å; I7-E48 HydrophobicContact CG2-CB 4.16Å; K44-E48 WeakPolarHBondContact O-CG 3.33Å; K44-E48 PolarHBondContact O-N 2.77Å; K45-E48 IonicContact NZ-OE1 3.66Å; K45-E48 IonicContact NZ-OE2 3.82Å; K45-E48 PolarHBondContact NZ-OE2 2.93Å; K45-E48 PolarHBondContact O-N 3.5Å; E48-A52 WeakPolarHBondContact O-CB 3.32Å; E48-A52 PolarHBondContact O-N 3.42Å
49	V	92.7	Very high	90.9	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.006	27%	0.268	C	S	.	.	H	α-helix	trans	-70.4	-38.1	-180	161	0	0	0	0	112.7	I7 L8 Y23 K26 K45 F46 K47 Y53	I7-V49 HydrophobicContact CG2-CB 4.44Å; I7-V49 HydrophobicContact CG2-CG2 3.75Å; L8-V49 HydrophobicContact CD2-CG1 3.99Å; Y23-V49 HydrophobicContact CD2-CG1 3.63Å; Y23-V49 HydrophobicContact CE2-CG1 3.95Å; K26-V49 HydrophobicContact CB-CB 4.39Å; K26-V49 HydrophobicContact CB-CG1 3.59Å; K26-V49 HydrophobicContact CB-CG2 3.82Å; K26-V49 HydrophobicContact CD-CG2 4.31Å; K26-V49 HydrophobicContact CG-CG2 4.45Å; K45-V49 VanDerWaalsContact O-CB 3.26Å; K45-V49 WeakPolarHBondContact O-CB 3.22Å; K45-V49 WeakPolarHBondContact O-CG2 3.47Å; K45-V49 PolarHBondContact O-N 3.04Å; F46-V49 PolarHBondContact O-N 2.99Å; K47-V49 PolarHBondContact O-N 3.15Å; V49-Y53 WeakPolarHBondContact O-CB 3.22Å; V49-Y53 PolarHBondContact O-N 3.33Å; V49-Y53 VanDerWaalsContact O-N 3.07Å
50	A	91.4	Very high	90.8	Very high	3 Å²	3	57.7 Å²	57.7	3%	0.025	27%	0.268	C	S	.	.	H	α-helix	trans	-71.1	-41.6	174.4	0	0	0	0	0	112.1	Y23 F46 K47 A52 Y53 E54 P99	Y23-A50 HydrophobicContact CE2-CB 4.37Å; F46-A50 WeakPolarHBondContact O-CB 3.29Å; F46-A50 PolarHBondContact O-N 2.81Å; K47-A50 PolarHBondContact O-N 3.37Å; A50-A52 PolarHBondContact O-N 3.18Å; A50-Y53 PolarHBondContact O-N 3.06Å; A50-Y53 VanDerWaalsContact O-N 3.16Å; A50-E54 PolarHBondContact O-N 3.19Å; A50-P99 HydrophobicContact CB-CB 3.65Å; A50-P99 HydrophobicContact CB-CG 4.08Å
51	E	90.9	Very high	90.8	Very high	59 Å²	59	53.3 Å²	53.3	28%	0.276	25%	0.246	S	C	.	.	H	α-helix	trans	-57.3	-48.4	173.3	-169	-165.9	139	0	0	110.7	Y4 K47 Y53 E54 V55 F96	Y4-E51 HydrophobicContact CE1-CG 3.96Å; Y4-E51 WeakPolarHBondContact CE1-OE1 3.47Å; Y4-E51 VanDerWaalsContact CZ-OE1 3.29Å; Y4-E51 PolarHBondContact OH-OE1 3.11Å; K47-E51 WeakPolarHBondContact O-CB 3.49Å; K47-E51 PolarHBondContact O-N 2.97Å; E51-Y53 VanDerWaalsContact C-N 3.3Å; E51-Y53 PolarHBondContact O-N 3.35Å; E51-E54 PolarHBondContact O-N 3.13Å; E51-V55 WeakPolarHBondContact O-CG2 3.45Å; E51-V55 PolarHBondContact O-N 2.98Å; E51-F96 HydrophobicContact CG-CD1 3.97Å; E51-F96 HydrophobicContact CG-CE1 3.51Å; E51-F96 HydrophobicContact CG-CZ 3.93Å
52	A	92.4	Very high	90.8	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-59.7	-38.6	175.8	0	0	0	0	0	112.8	Y4 I7 L8 E48 A50 L56	Y4-A52 VanDerWaalsContact CD1-CA 3.47Å; Y4-A52 HydrophobicContact CD1-CB 3.66Å; Y4-A52 HydrophobicContact CG-CB 4.05Å; I7-A52 HydrophobicContact CB-CB 4.17Å; I7-A52 HydrophobicContact CG2-CB 3.94Å; L8-A52 HydrophobicContact CD1-CB 4.24Å; L8-A52 HydrophobicContact CD2-CB 4.35Å; L8-A52 HydrophobicContact CG-CB 3.95Å; E48-A52 WeakPolarHBondContact O-CB 3.32Å; E48-A52 PolarHBondContact O-N 3.42Å; A50-A52 PolarHBondContact O-N 3.18Å; A52-L56 VanDerWaalsContact O-CB 3.28Å; A52-L56 WeakPolarHBondContact O-CB 3.39Å; A52-L56 VanDerWaalsContact O-CG 3.29Å; A52-L56 WeakPolarHBondContact O-CG 3.45Å; A52-L56 PolarHBondContact O-N 3.01Å; A52-L56 VanDerWaalsContact O-N 3.09Å
53	Y	92.8	Very high	90.8	Very high	7 Å²	7	54.7 Å²	54.7	3%	0.027	25%	0.253	C	S	.	.	H	α-helix	trans	-71.9	-43.5	178.5	-175.3	-107.9	0	0	0	112.9	I19 K20 Y23 V49 A50 E51 V55 L56 S57 V102 F106	I19-Y53 HydrophobicContact CG2-CD2 3.82Å; I19-Y53 HydrophobicContact CG2-CE2 3.92Å; K20-Y53 HydrophobicContact CB-CE2 4.42Å; Y23-Y53 AromaticContact CD1-CD1 3.46Å; Y23-Y53 HydrophobicContact CD1-CD1 3.46Å; Y23-Y53 VanDerWaalsContact CD1-CD1 3.46Å; Y23-Y53 AromaticContact CD1-CD2 3.77Å; Y23-Y53 HydrophobicContact CD1-CD2 3.77Å; Y23-Y53 AromaticContact CD1-CE1 3.8Å; Y23-Y53 HydrophobicContact CD1-CE1 3.8Å; Y23-Y53 HydrophobicContact CD1-CE2 4.08Å; Y23-Y53 AromaticContact CD1-CG 3.47Å; Y23-Y53 HydrophobicContact CD1-CG 3.47Å; Y23-Y53 VanDerWaalsContact CD1-CG 3.47Å; Y23-Y53 HydrophobicContact CD2-CD1 4.34Å; Y23-Y53 HydrophobicContact CD2-CD2 4.33Å; Y23-Y53 AromaticContact CD2-CG 3.79Å; Y23-Y53 HydrophobicContact CD2-CG 3.79Å; Y23-Y53 AromaticContact CE1-CD1 3.58Å; Y23-Y53 HydrophobicContact CE1-CD1 3.58Å; Y23-Y53 HydrophobicContact CE1-CE1 4Å; Y23-Y53 AromaticContact CE1-CG 3.98Å; Y23-Y53 HydrophobicContact CE1-CG 3.98Å; Y23-Y53 HydrophobicContact CE2-CD1 4.44Å; Y23-Y53 HydrophobicContact CE2-CG 4.27Å; Y23-Y53 AromaticContact CG-CD1 3.89Å; Y23-Y53 HydrophobicContact CG-CD1 3.89Å; Y23-Y53 AromaticContact CG-CD2 3.58Å; Y23-Y53 HydrophobicContact CG-CD2 3.58Å; Y23-Y53 HydrophobicContact CG-CE2 4.27Å; Y23-Y53 AromaticContact CG-CG 3.38Å; Y23-Y53 HydrophobicContact CG-CG 3.38Å; V49-Y53 WeakPolarHBondContact O-CB 3.22Å; V49-Y53 PolarHBondContact O-N 3.33Å; V49-Y53 VanDerWaalsContact O-N 3.07Å; A50-Y53 PolarHBondContact O-N 3.06Å; A50-Y53 VanDerWaalsContact O-N 3.16Å; E51-Y53 VanDerWaalsContact C-N 3.3Å; E51-Y53 PolarHBondContact O-N 3.35Å; Y53-V55 PolarHBondContact O-N 2.93Å; Y53-L56 PolarHBondContact O-N 3.12Å; Y53-S57 VanDerWaalsContact O-CB 3.22Å; Y53-S57 WeakPolarHBondContact O-CB 3.37Å; Y53-S57 PolarHBondContact O-N 3.03Å; Y53-S57 PolarHBondContact O-OG 3.33Å; Y53-V102 HydrophobicContact CD1-CG1 4.16Å; Y53-F106 AromaticContact CE1-CD1 3.96Å; Y53-F106 HydrophobicContact CE1-CD1 3.96Å; Y53-F106 HydrophobicContact CE1-CD2 4.43Å; Y53-F106 HydrophobicContact CE1-CE1 4.3Å; Y53-F106 HydrophobicContact CE1-CG 4.04Å; Y53-F106 AromaticContact CZ-CE1 3.88Å; Y53-F106 WeakPolarHBondContact OH-CD1 3.41Å; Y53-F106 WeakPolarHBondContact OH-CE1 3.49Å; Y53-F106 WeakPolarHBondContact OH-CZ 3.35Å
54	E	90.3	Very high	90.7	Very high	28 Å²	28	51.8 Å²	51.8	13%	0.131	24%	0.24	C	C	.	.	H	α-helix	trans	-61.7	-34.1	-180	-155.2	-154.5	117.3	0	0	111.9	A50 E51 K61 F94 R97	A50-E54 PolarHBondContact O-N 3.19Å; E51-E54 PolarHBondContact O-N 3.13Å; E54-K61 VanDerWaalsContact O-CD 3.29Å; E54-K61 WeakPolarHBondContact O-CD 3.47Å; E54-K61 IonicContact OE1-NZ 2.77Å; E54-K61 PolarHBondContact OE1-NZ 3.26Å; E54-F94 VanDerWaalsContact OE1-CE1 3.23Å; E54-F94 WeakPolarHBondContact OE1-CE1 3.37Å; E54-R97 PolarHBondContact OE2-N 3.13Å
55	V	91.2	Very high	90.6	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-78.2	-44.3	176.3	174.9	0	0	0	0	112.6	Y4 E51 Y53 K61 R62 Y65 L73 F94 F96	Y4-V55 HydrophobicContact CD2-CB 3.99Å; Y4-V55 HydrophobicContact CD2-CG1 3.73Å; Y4-V55 HydrophobicContact CD2-CG2 4.34Å; Y4-V55 HydrophobicContact CE2-CB 3.93Å; Y4-V55 HydrophobicContact CE2-CG1 3.73Å; Y4-V55 HydrophobicContact CE2-CG2 3.78Å; E51-V55 WeakPolarHBondContact O-CG2 3.45Å; E51-V55 PolarHBondContact O-N 2.98Å; Y53-V55 PolarHBondContact O-N 2.93Å; V55-K61 CarbonylContact O-C 3.54Å; V55-K61 WeakPolarHBondContact O-CB 3.48Å; V55-R62 PolarHBondContact O-N 3.48Å; V55-R62 VanDerWaalsContact O-N 3.11Å; V55-Y65 HydrophobicContact CG1-CD1 4.45Å; V55-Y65 HydrophobicContact CG1-CG 3.98Å; V55-L73 HydrophobicContact CB-CD1 4.31Å; V55-L73 HydrophobicContact CG1-CD1 3.46Å; V55-L73 VanDerWaalsContact CG1-CD1 3.46Å; V55-L73 HydrophobicContact CG1-CD2 4.32Å; V55-L73 HydrophobicContact CG2-CD1 3.8Å; V55-F94 HydrophobicContact CG2-CE1 4.37Å; V55-F94 HydrophobicContact CG2-CZ 4.02Å; V55-F96 HydrophobicContact CG2-CE1 4.04Å; V55-F96 HydrophobicContact CG2-CZ 4.35Å
56	L	92	Very high	90.6	Very high	2 Å²	2	48 Å²	48	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-85.4	-16.9	-171.4	-68.3	-179.8	0	0	0	114.7	Y5 L8 I19 A52 Y53 R62 Y65	Y5-L56 HydrophobicContact CD1-CD1 3.81Å; Y5-L56 HydrophobicContact CD1-CD2 4.24Å; Y5-L56 HydrophobicContact CE1-CD1 4.02Å; Y5-L56 HydrophobicContact CE1-CD2 3.68Å; Y5-L56 HydrophobicContact CE1-CG 4.49Å; Y5-L56 HydrophobicContact CE2-CD2 4.05Å; Y5-L56 HydrophobicContact CG-CD1 4.22Å; L8-L56 HydrophobicContact CD1-CD1 4.14Å; I19-L56 HydrophobicContact CD1-CB 4.17Å; I19-L56 HydrophobicContact CG2-CB 3.95Å; A52-L56 VanDerWaalsContact O-CB 3.28Å; A52-L56 WeakPolarHBondContact O-CB 3.39Å; A52-L56 VanDerWaalsContact O-CG 3.29Å; A52-L56 WeakPolarHBondContact O-CG 3.45Å; A52-L56 PolarHBondContact O-N 3.01Å; A52-L56 VanDerWaalsContact O-N 3.09Å; Y53-L56 PolarHBondContact O-N 3.12Å; L56-R62 HydrophobicContact CD2-CG 4.02Å; L56-Y65 HydrophobicContact CD2-CD1 3.7Å; L56-Y65 HydrophobicContact CD2-CE1 4.05Å
57	S	89.3	Confident	90.4	Very high	46 Å²	46	54.9 Å²	54.9	32%	0.322	25%	0.253	S	S	.	.	H	α-helix	trans	-78.9	-38.6	178.1	55.7	0	0	0	0	113.4	Y53	Y53-S57 VanDerWaalsContact O-CB 3.22Å; Y53-S57 WeakPolarHBondContact O-CB 3.37Å; Y53-S57 PolarHBondContact O-N 3.03Å; Y53-S57 PolarHBondContact O-OG 3.33Å
58	D	90.3	Very high	90.1	Very high	67 Å²	67	55.1 Å²	55.1	36%	0.358	25%	0.251	S	S	.	.	S	Bend	trans	-81.8	123.5	173.8	-179.7	-15.3	0	0	0	110.3	H60 K61 R62	D58-H60 VanDerWaalsContact C-N 3.26Å; D58-H60 PolarHBondContact O-N 2.79Å; D58-H60 WeakPolarHBondContact OD1-CB 3.18Å; D58-H60 PolarHBondContact OD1-N 3.27Å; D58-K61 HydrophobicContact CB-CB 3.96Å; D58-K61 HydrophobicContact CB-CD 3.66Å; D58-K61 HydrophobicContact CB-CG 3.79Å; D58-K61 PolarHBondContact O-N 2.93Å; D58-K61 WeakPolarHBondContact OD2-CD 3.18Å; D58-K61 WeakPolarHBondContact OD2-CG 3.43Å; D58-R62 VanDerWaalsContact O-CB 3.32Å; D58-R62 WeakPolarHBondContact O-CB 3.35Å; D58-R62 PolarHBondContact O-N 3.21Å
59	K	90.5	Very high	89.8	Confident	177 Å²	177	54 Å²	54	77%	0.77	25%	0.252	S	S	*	.	H	α-helix	trans	-56.7	-36.2	178.8	-176.4	179.1	175.6	-175.5	0	113	E63	K59-E63 WeakPolarHBondContact O-CB 3.4Å; K59-E63 PolarHBondContact O-N 2.99Å
60	H	87.9	Confident	89.2	Confident	93 Å²	93	56.6 Å²	56.6	43%	0.431	26%	0.262	S	S	.	.	H	α-helix	trans	-74.5	-45.5	-179.2	-173.2	48.7	0	0	0	111.5	D58 R62 E63 I64	D58-H60 VanDerWaalsContact C-N 3.26Å; D58-H60 PolarHBondContact O-N 2.79Å; D58-H60 WeakPolarHBondContact OD1-CB 3.18Å; D58-H60 PolarHBondContact OD1-N 3.27Å; H60-R62 VanDerWaalsContact C-N 3.32Å; H60-R62 PolarHBondContact O-N 3.01Å; H60-E63 PolarHBondContact O-N 3.2Å; H60-I64 WeakPolarHBondContact O-CG1 3.21Å; H60-I64 PolarHBondContact O-N 3.46Å
61	K	89.5	Confident	88.5	Confident	45 Å²	45	61.8 Å²	61.8	20%	0.196	29%	0.286	C	S	.	.	H	α-helix	trans	-60.7	-41.9	175	-60.7	177.1	161.3	-174.1	0	111	E54 V55 D58 I64 Y65 L73 F94	E54-K61 VanDerWaalsContact O-CD 3.29Å; E54-K61 WeakPolarHBondContact O-CD 3.47Å; E54-K61 IonicContact OE1-NZ 2.77Å; E54-K61 PolarHBondContact OE1-NZ 3.26Å; V55-K61 CarbonylContact O-C 3.54Å; V55-K61 WeakPolarHBondContact O-CB 3.48Å; D58-K61 HydrophobicContact CB-CB 3.96Å; D58-K61 HydrophobicContact CB-CD 3.66Å; D58-K61 HydrophobicContact CB-CG 3.79Å; D58-K61 PolarHBondContact O-N 2.93Å; D58-K61 WeakPolarHBondContact OD2-CD 3.18Å; D58-K61 WeakPolarHBondContact OD2-CG 3.43Å; K61-I64 PolarHBondContact O-N 2.89Å; K61-Y65 WeakPolarHBondContact O-CB 3.33Å; K61-Y65 PolarHBondContact O-N 2.93Å; K61-L73 HydrophobicContact CB-CD2 4.38Å; K61-F94 HydrophobicContact CB-CE2 4.17Å; K61-F94 HydrophobicContact CB-CZ 4.14Å; K61-F94 HydrophobicContact CD-CE1 4.19Å; K61-F94 HydrophobicContact CD-CE2 3.71Å; K61-F94 HydrophobicContact CD-CZ 3.33Å; K61-F94 HydrophobicContact CG-CE2 3.6Å; K61-F94 HydrophobicContact CG-CZ 3.7Å
62	R	90.8	Very high	87.6	Confident	45 Å²	45	60.7 Å²	60.7	17%	0.17	29%	0.29	C	S	.	.	H	α-helix	trans	-63.7	-40.8	174.2	-175.3	172.4	177.4	-179.9	0.1	113.1	Y5 R12 A14 V55 L56 D58 H60 Y65 D66	Y5-R62 PolarHBondContact OH-NE 3.04Å; R12-R62 PolarHBondContact O-NH2 3.38Å; A14-R62 PolarHBondContact O-NH1 3.38Å; A14-R62 PolarHBondContact O-NH2 2.98Å; V55-R62 PolarHBondContact O-N 3.48Å; V55-R62 VanDerWaalsContact O-N 3.11Å; L56-R62 HydrophobicContact CD2-CG 4.02Å; D58-R62 VanDerWaalsContact O-CB 3.32Å; D58-R62 WeakPolarHBondContact O-CB 3.35Å; D58-R62 PolarHBondContact O-N 3.21Å; H60-R62 VanDerWaalsContact C-N 3.32Å; H60-R62 PolarHBondContact O-N 3.01Å; R62-Y65 WeakPolarHBondContact O-CB 3.48Å; R62-Y65 PolarHBondContact O-N 3.49Å; R62-D66 IonicContact NE-OD2 3.92Å; R62-D66 WeakPolarHBondContact O-CB 3.42Å; R62-D66 PolarHBondContact O-N 3.24Å
63	E	89.2	Confident	86.5	Confident	95 Å²	95	60.9 Å²	60.9	44%	0.444	29%	0.291	S	S	.	.	H	α-helix	trans	-66.4	-38.3	177	-167.2	-174	160.9	0	0	112.3	K59 H60 R67	K59-E63 WeakPolarHBondContact O-CB 3.4Å; K59-E63 PolarHBondContact O-N 2.99Å; H60-E63 PolarHBondContact O-N 3.2Å; E63-R67 VanDerWaalsContact O-CB 3.29Å; E63-R67 WeakPolarHBondContact O-CB 3.41Å; E63-R67 PolarHBondContact O-N 3.03Å; E63-R67 IonicContact OE1-CZ 2.76Å; E63-R67 IonicContact OE1-NH2 2.71Å; E63-R67 PolarHBondContact OE1-NH2 3.38Å
64	I	88	Confident	85.1	Confident	43 Å²	43	63.9 Å²	63.9	22%	0.221	31%	0.31	C	S	.	.	H	α-helix	trans	-62.8	-45.7	172.2	-67.3	167.6	0	0	0	109.8	H60 K61 R67 Y68 G72 L73	H60-I64 WeakPolarHBondContact O-CG1 3.21Å; H60-I64 PolarHBondContact O-N 3.46Å; K61-I64 PolarHBondContact O-N 2.89Å; I64-R67 PolarHBondContact O-N 3.41Å; I64-Y68 HydrophobicContact CG2-CD2 4.18Å; I64-Y68 PolarHBondContact O-N 3.45Å; I64-G72 WeakPolarHBondContact CG2-O 3.37Å; I64-L73 HydrophobicContact CB-CD2 4.27Å; I64-L73 HydrophobicContact CG2-CD2 3.94Å; I64-L73 HydrophobicContact CG2-CG 4.18Å
65	Y	89.7	Confident	83.4	Confident	19 Å²	19	66.3 Å²	66.3	8%	0.075	34%	0.343	C	S	.	.	H	α-helix	trans	-59.4	-50.6	178	-179.1	-124.1	0	0	0	113.2	S3 Y4 Y5 V55 L56 K61 R62 R67 G69 R70 L73	S3-Y65 VanDerWaalsContact CA-OH 3.28Å; S3-Y65 WeakPolarHBondContact CA-OH 2.99Å; S3-Y65 WeakPolarHBondContact CB-OH 3.5Å; Y4-Y65 AromaticContact CD2-CD1 3.92Å; Y4-Y65 HydrophobicContact CD2-CD1 3.92Å; Y4-Y65 AromaticContact CD2-CD2 3.61Å; Y4-Y65 HydrophobicContact CD2-CD2 3.61Å; Y4-Y65 AromaticContact CD2-CE1 3.67Å; Y4-Y65 HydrophobicContact CD2-CE1 3.67Å; Y4-Y65 AromaticContact CD2-CE2 3.41Å; Y4-Y65 HydrophobicContact CD2-CE2 3.41Å; Y4-Y65 VanDerWaalsContact CD2-CE2 3.41Å; Y4-Y65 AromaticContact CD2-CG 3.89Å; Y4-Y65 HydrophobicContact CD2-CG 3.89Å; Y4-Y65 AromaticContact CD2-CZ 3.43Å; Y4-Y65 VanDerWaalsContact CD2-CZ 3.43Å; Y4-Y65 AromaticContact CE2-CD2 3.68Å; Y4-Y65 HydrophobicContact CE2-CD2 3.68Å; Y4-Y65 AromaticContact CE2-CE2 3.68Å; Y4-Y65 HydrophobicContact CE2-CE2 3.68Å; Y4-Y65 HydrophobicContact CE2-CG 4.27Å; Y4-Y65 HydrophobicContact CG-CE1 4.25Å; Y4-Y65 HydrophobicContact CG-CE2 4.34Å; Y4-Y65 PolarHBondContact N-OH 2.9Å; Y5-Y65 AromaticContact CD2-CE1 3.75Å; Y5-Y65 HydrophobicContact CD2-CE1 3.75Å; Y5-Y65 AromaticContact CE2-CD1 3.96Å; Y5-Y65 HydrophobicContact CE2-CD1 3.96Å; Y5-Y65 AromaticContact CE2-CE1 3.54Å; Y5-Y65 HydrophobicContact CE2-CE1 3.54Å; V55-Y65 HydrophobicContact CG1-CD1 4.45Å; V55-Y65 HydrophobicContact CG1-CG 3.98Å; L56-Y65 HydrophobicContact CD2-CD1 3.7Å; L56-Y65 HydrophobicContact CD2-CE1 4.05Å; K61-Y65 WeakPolarHBondContact O-CB 3.33Å; K61-Y65 PolarHBondContact O-N 2.93Å; R62-Y65 WeakPolarHBondContact O-CB 3.48Å; R62-Y65 PolarHBondContact O-N 3.49Å; Y65-R67 PolarHBondContact O-N 3.26Å; Y65-G69 VanDerWaalsContact O-CA 3.31Å; Y65-G69 WeakPolarHBondContact O-CA 3.18Å; Y65-G69 PolarHBondContact O-N 3.15Å; Y65-R70 HydrophobicContact CD2-CG 4.24Å; Y65-R70 HydrophobicContact CE2-CG 3.58Å; Y65-L73 HydrophobicContact CD2-CD1 3.96Å; Y65-L73 HydrophobicContact CG-CD1 4.33Å
66	D	89.6	Confident	81.1	Confident	91 Å²	91	71.3 Å²	71.3	49%	0.487	37%	0.373	S	S	.	.	H	α-helix	trans	-66.1	-20.7	-178	-72	-26.5	0	0	0	112.2	Y5 R62	Y5-D66 VanDerWaalsContact CE2-OD1 3.22Å; Y5-D66 WeakPolarHBondContact CE2-OD1 3.5Å; Y5-D66 VanDerWaalsContact OH-CG 3.23Å; Y5-D66 PolarHBondContact OH-OD1 2.87Å; Y5-D66 PolarHBondContact OH-OD2 2.93Å; R62-D66 IonicContact NE-OD2 3.92Å; R62-D66 WeakPolarHBondContact O-CB 3.42Å; R62-D66 PolarHBondContact O-N 3.24Å
67	R	87.4	Confident	78.6	Confident	150 Å²	150	74.5 Å²	74.5	57%	0.566	41%	0.406	S	S	*	.	H	α-helix	trans	-96.6	-36.8	-179.7	-160	-167.5	-58.4	171.9	-2.5	114.4	E63 I64 Y65	E63-R67 VanDerWaalsContact O-CB 3.29Å; E63-R67 WeakPolarHBondContact O-CB 3.41Å; E63-R67 PolarHBondContact O-N 3.03Å; E63-R67 IonicContact OE1-CZ 2.76Å; E63-R67 IonicContact OE1-NH2 2.71Å; E63-R67 PolarHBondContact OE1-NH2 3.38Å; I64-R67 PolarHBondContact O-N 3.41Å; Y65-R67 PolarHBondContact O-N 3.26Å
68	Y	85.3	Confident	76.1	Confident	140 Å²	140	79.8 Å²	79.8	55%	0.549	44%	0.437	S	S	.	.	H	α-helix	trans	-122.4	-4.4	-171	-61.9	-71	0	0	0	114.7	I64	I64-Y68 HydrophobicContact CG2-CD2 4.18Å; I64-Y68 PolarHBondContact O-N 3.45Å
69	G	85.2	Confident	73.6	Confident	22 Å²	22	78.8 Å²	78.8	23%	0.227	44%	0.443	C	S	.	.			trans	76.5	-164.6	-170.7	0	0	0	0	0	112.7	Y65 E71	Y65-G69 VanDerWaalsContact O-CA 3.31Å; Y65-G69 WeakPolarHBondContact O-CA 3.18Å; Y65-G69 PolarHBondContact O-N 3.15Å; G69-E71 PolarHBondContact O-N 3.12Å
70	R	80.7	Confident	71	Confident	57 Å²	57	77 Å²	77	22%	0.215	45%	0.449	C	S	.	.	G	3₁₀ helix	trans	-71.6	-27.1	178	-52.5	178	-58.6	114.8	29.2	111.1	Y4 Y65 G72 L73 T74	Y4-R70 HydrophobicContact CD2-CG 4.39Å; Y4-R70 HydrophobicContact CE1-CG 4.39Å; Y4-R70 HydrophobicContact CE2-CB 4.38Å; Y4-R70 HydrophobicContact CE2-CG 3.68Å; Y65-R70 HydrophobicContact CD2-CG 4.24Å; Y65-R70 HydrophobicContact CE2-CG 3.58Å; R70-G72 PolarHBondContact O-N 3.23Å; R70-L73 WeakPolarHBondContact O-CB 3.35Å; R70-L73 PolarHBondContact O-N 3.33Å; R70-T74 PolarHBondContact O-N 3.5Å
71	E	76.8	Confident	68.6	Low	112 Å²	112	77.9 Å²	77.9	52%	0.523	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-65.3	-22.4	-178.3	-61.5	65.7	-146	0	0	111.8	G69 T74	G69-E71 PolarHBondContact O-N 3.12Å; E71-T74 WeakPolarHBondContact CA-OG1 3.45Å; E71-T74 PolarHBondContact O-OG1 3.04Å
72	G	70.5	Confident	66	Low	35 Å²	35	84.8 Å²	84.8	36%	0.361	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-87	-7.4	170.6	0	0	0	0	0	115.6	I64 R70	I64-G72 WeakPolarHBondContact CG2-O 3.37Å; R70-G72 PolarHBondContact O-N 3.23Å
73	L	69.8	Low	63.2	Low	5 Å²	5	87.8 Å²	87.8	3%	0.026	53%	0.525	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-30.4	176	-64.6	155.8	0	0	0	111.3	Y4 V55 K61 I64 Y65 R70 G75 F94	Y4-L73 HydrophobicContact CE2-CD1 3.84Å; V55-L73 HydrophobicContact CB-CD1 4.31Å; V55-L73 HydrophobicContact CG1-CD1 3.46Å; V55-L73 VanDerWaalsContact CG1-CD1 3.46Å; V55-L73 HydrophobicContact CG1-CD2 4.32Å; V55-L73 HydrophobicContact CG2-CD1 3.8Å; K61-L73 HydrophobicContact CB-CD2 4.38Å; I64-L73 HydrophobicContact CB-CD2 4.27Å; I64-L73 HydrophobicContact CG2-CD2 3.94Å; I64-L73 HydrophobicContact CG2-CG 4.18Å; Y65-L73 HydrophobicContact CD2-CD1 3.96Å; Y65-L73 HydrophobicContact CG-CD1 4.33Å; R70-L73 WeakPolarHBondContact O-CB 3.35Å; R70-L73 PolarHBondContact O-N 3.33Å; L73-G75 PolarHBondContact O-N 3.27Å; L73-G75 VanDerWaalsContact O-N 3.11Å; L73-F94 HydrophobicContact CB-CE2 4.44Å; L73-F94 HydrophobicContact CD2-CD2 4.17Å; L73-F94 HydrophobicContact CD2-CE2 3.38Å; L73-F94 HydrophobicContact CD2-CZ 3.85Å; L73-F94 HydrophobicContact CG-CE2 4.49Å
74	T	64.6	Low	60.6	Low	70 Å²	70	90.1 Å²	90.1	43%	0.429	54%	0.536	S	S	.	.	S	Bend	trans	-66.2	104.5	165	47.5	0	0	0	0	109.7	R70 E71 T76	R70-T74 PolarHBondContact O-N 3.5Å; E71-T74 WeakPolarHBondContact CA-OG1 3.45Å; E71-T74 PolarHBondContact O-OG1 3.04Å; T74-T76 PolarHBondContact O-N 3.49Å
75	G	53.1	Low	58	Low	79 Å²	79	93.3 Å²	93.3	81%	0.814	57%	0.569	S	S	*	*	S	Bend	trans	-60.9	0.3	-178.2	0	0	0	0	0	116.2	L73 G77	L73-G75 PolarHBondContact O-N 3.27Å; L73-G75 VanDerWaalsContact O-N 3.11Å; G75-G77 PolarHBondContact O-N 3.06Å
76	T	44.3	Very low	55.1	Low	105 Å²	105	96.3 Å²	96.3	64%	0.644	61%	0.605	S	S	*	*			trans	-73.2	71.5	166.8	50.7	0	0	0	0	111.1	T74 T78	T74-T76 PolarHBondContact O-N 3.49Å; T76-T78 PolarHBondContact O-N 2.96Å
77	G	37.8	Very low	52.5	Low	68 Å²	68	98 Å²	98	70%	0.701	62%	0.624	S	S	*	*			trans	-62.9	103.5	169.6	0	0	0	0	0	110.6	G75 G79	G75-G77 PolarHBondContact O-N 3.06Å; G77-G79 PolarHBondContact O-N 3.46Å
78	T	37.4	Very low	49.8	Very low	157 Å²	157	94.8 Å²	94.8	96%	0.963	64%	0.638	S	S	*	*			trans	-74.8	62.1	178.4	23.2	0	0	0	0	112.1	T76	T76-T78 PolarHBondContact O-N 2.96Å
79	G	37	Very low	47.5	Very low	47 Å²	47	91 Å²	91	49%	0.485	64%	0.641	S	S	.	*	S	Bend	trans	-129.5	135.2	171.3	0	0	0	0	0	110.5	G77 S81	G77-G79 PolarHBondContact O-N 3.46Å; G79-S81 PolarHBondContact O-N 3.4Å
80	P	36.5	Very low	45.3	Very low	138 Å²	138	95.8 Å²	95.8	90%	0.896	67%	0.669	S	S	*	*			trans	-74.3	95.6	-177.8	30.1	-34.2	0	0	0	110.7
81	S	37.1	Very low	43.2	Very low	113 Å²	113	96 Å²	96	79%	0.79	69%	0.688	S	S	*	*			trans	-129.1	86.2	173.6	-73	0	0	0	0	112.1	G79	G79-S81 PolarHBondContact O-N 3.4Å
82	R	35.7	Very low	41.6	Very low	190 Å²	190	98.6 Å²	98.6	72%	0.717	70%	0.698	S	S	*	*			trans	38.5	105	138.3	-179.3	177.1	168.4	120.9	-4.5	116	E84	R82-E84 IonicContact CZ-OE1 3.93Å; R82-E84 IonicContact CZ-OE2 3.71Å; R82-E84 IonicContact NE-OE1 3.31Å; R82-E84 IonicContact NE-OE2 3.9Å; R82-E84 PolarHBondContact NE-OE2 3.29Å; R82-E84 IonicContact NH2-OE1 2.7Å; R82-E84 PolarHBondContact NH2-OE1 3.07Å; R82-E84 IonicContact NH2-OE2 2.8Å; R82-E84 PolarHBondContact NH2-OE2 2.88Å; R82-E84 PolarHBondContact O-N 3.06Å; R82-E84 VanDerWaalsContact O-N 3.16Å
83	A	31.7	Very low	40.2	Very low	108 Å²	108	102.6 Å²	102.6	89%	0.893	72%	0.715	S	S	*	*			trans	-62	114.2	162.6	0	0	0	0	0	110.7
84	E	34.7	Very low	39.4	Very low	143 Å²	143	104.5 Å²	104.5	67%	0.668	72%	0.724	S	S	*	*			trans	-135.4	133.9	158.3	-96.9	179.3	145	0	0	108.9	R82	R82-E84 IonicContact CZ-OE1 3.93Å; R82-E84 IonicContact CZ-OE2 3.71Å; R82-E84 IonicContact NE-OE1 3.31Å; R82-E84 IonicContact NE-OE2 3.9Å; R82-E84 PolarHBondContact NE-OE2 3.29Å; R82-E84 IonicContact NH2-OE1 2.7Å; R82-E84 PolarHBondContact NH2-OE1 3.07Å; R82-E84 IonicContact NH2-OE2 2.8Å; R82-E84 PolarHBondContact NH2-OE2 2.88Å; R82-E84 PolarHBondContact O-N 3.06Å; R82-E84 VanDerWaalsContact O-N 3.16Å
85	A	33.4	Very low	39.1	Very low	111 Å²	111	106.3 Å²	106.3	92%	0.917	74%	0.735	S	S	*	*			trans	-86	127.9	-179.1	0	0	0	0	0	110.6
86	G	29.2	Very low	39.6	Very low	81 Å²	81	106.3 Å²	106.3	84%	0.835	71%	0.712	S	S	*	*			trans	102.3	89.1	162.4	0	0	0	0	0	116.5
87	S	35.4	Very low	40.8	Very low	126 Å²	126	106.6 Å²	106.6	88%	0.881	70%	0.702	S	S	*	*			trans	-155.1	141.5	133.3	-166.5	0	0	0	0	110
88	G	29.5	Very low	42.4	Very low	84 Å²	84	105.6 Å²	105.6	87%	0.866	68%	0.684	S	S	*	*			trans	-86.1	118.9	-175.4	0	0	0	0	0	112.8
89	G	36.5	Very low	44.1	Very low	60 Å²	60	98.9 Å²	98.9	62%	0.619	64%	0.643	S	S	*	*			trans	-152.6	154.5	166.6	0	0	0	0	0	109.6	G91	G89-G91 PolarHBondContact O-N 2.73Å
90	P	40.3	Very low	45.8	Very low	123 Å²	123	100.7 Å²	100.7	80%	0.799	64%	0.639	S	S	*	*			trans	-71.6	92.7	-175.6	29.1	-34.5	0	0	0	110.9	F92	P90-F92 PolarHBondContact O-N 3.48Å
91	G	35.9	Very low	47.6	Very low	60 Å²	60	97.3 Å²	97.3	62%	0.619	61%	0.611	S	S	*	*			trans	-64.5	116.6	168.7	0	0	0	0	0	109.7	G89 T93	G89-G91 PolarHBondContact O-N 2.73Å; G91-T93 PolarHBondContact O-N 2.91Å
92	F	42.5	Very low	49.3	Very low	167 Å²	167	92.7 Å²	92.7	73%	0.732	58%	0.578	S	S	*	*			trans	-72.2	76.4	175.6	-89.5	-98.6	0	0	0	110.5	P90 F94	P90-F92 PolarHBondContact O-N 3.48Å; F92-F94 PolarHBondContact O-N 3.06Å
93	T	41.3	Very low	51	Low	119 Å²	119	85 Å²	85	73%	0.73	55%	0.55	S	S	*	*			trans	-71	107	169.3	52.9	0	0	0	0	109	G91 T95	G91-T93 PolarHBondContact O-N 2.91Å; T93-T95 VanDerWaalsContact C-N 3.31Å; T93-T95 PolarHBondContact O-N 3.26Å
94	F	54.1	Low	53.2	Low	46 Å²	46	86.8 Å²	86.8	20%	0.202	53%	0.534	C	S	.	.			trans	-79.4	77.6	-176.7	-145.3	-67.2	0	0	0	110.8	E54 V55 K61 L73 F92 F96	E54-F94 VanDerWaalsContact OE1-CE1 3.23Å; E54-F94 WeakPolarHBondContact OE1-CE1 3.37Å; V55-F94 HydrophobicContact CG2-CE1 4.37Å; V55-F94 HydrophobicContact CG2-CZ 4.02Å; K61-F94 HydrophobicContact CB-CE2 4.17Å; K61-F94 HydrophobicContact CB-CZ 4.14Å; K61-F94 HydrophobicContact CD-CE1 4.19Å; K61-F94 HydrophobicContact CD-CE2 3.71Å; K61-F94 HydrophobicContact CD-CZ 3.33Å; K61-F94 HydrophobicContact CG-CE2 3.6Å; K61-F94 HydrophobicContact CG-CZ 3.7Å; L73-F94 HydrophobicContact CB-CE2 4.44Å; L73-F94 HydrophobicContact CD2-CD2 4.17Å; L73-F94 HydrophobicContact CD2-CE2 3.38Å; L73-F94 HydrophobicContact CD2-CZ 3.85Å; L73-F94 HydrophobicContact CG-CE2 4.49Å; F92-F94 PolarHBondContact O-N 3.06Å; F94-F96 HydrophobicContact CD1-CD1 4.18Å; F94-F96 HydrophobicContact CD1-CD2 4.26Å; F94-F96 AromaticContact CD1-CE1 3.91Å; F94-F96 HydrophobicContact CD1-CE1 3.91Å; F94-F96 AromaticContact CD1-CE2 4Å; F94-F96 HydrophobicContact CD1-CE2 4Å; F94-F96 HydrophobicContact CD1-CG 4.36Å; F94-F96 AromaticContact CD1-CZ 3.82Å; F94-F96 HydrophobicContact CD1-CZ 3.82Å; F94-F96 AromaticContact CE1-CD1 4Å; F94-F96 HydrophobicContact CE1-CD1 4Å; F94-F96 AromaticContact CE1-CE1 3.5Å; F94-F96 HydrophobicContact CE1-CE1 3.5Å; F94-F96 VanDerWaalsContact CE1-CE1 3.5Å; F94-F96 HydrophobicContact CE1-CE2 4.35Å; F94-F96 AromaticContact CE1-CZ 3.7Å; F94-F96 HydrophobicContact CE1-CZ 3.7Å; F94-F96 HydrophobicContact CZ-CE1 4.45Å; F94-F96 PolarHBondContact O-N 2.82Å
95	T	58.1	Low	55.1	Low	107 Å²	107	86 Å²	86	66%	0.656	53%	0.53	S	S	*	.			trans	-77.2	89.6	176.2	-51.1	0	0	0	0	109.7	T93 R97	T93-T95 VanDerWaalsContact C-N 3.31Å; T93-T95 PolarHBondContact O-N 3.26Å; T95-R97 PolarHBondContact O-N 2.96Å
96	F	62.8	Low	56.7	Low	79 Å²	79	84.7 Å²	84.7	35%	0.346	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-53.1	123.4	169.1	-73.1	-73.5	0	0	0	109.9	E51 V55 F94	E51-F96 HydrophobicContact CG-CD1 3.97Å; E51-F96 HydrophobicContact CG-CE1 3.51Å; E51-F96 HydrophobicContact CG-CZ 3.93Å; V55-F96 HydrophobicContact CG2-CE1 4.04Å; V55-F96 HydrophobicContact CG2-CZ 4.35Å; F94-F96 HydrophobicContact CD1-CD1 4.18Å; F94-F96 HydrophobicContact CD1-CD2 4.26Å; F94-F96 AromaticContact CD1-CE1 3.91Å; F94-F96 HydrophobicContact CD1-CE1 3.91Å; F94-F96 AromaticContact CD1-CE2 4Å; F94-F96 HydrophobicContact CD1-CE2 4Å; F94-F96 HydrophobicContact CD1-CG 4.36Å; F94-F96 AromaticContact CD1-CZ 3.82Å; F94-F96 HydrophobicContact CD1-CZ 3.82Å; F94-F96 AromaticContact CE1-CD1 4Å; F94-F96 HydrophobicContact CE1-CD1 4Å; F94-F96 AromaticContact CE1-CE1 3.5Å; F94-F96 HydrophobicContact CE1-CE1 3.5Å; F94-F96 VanDerWaalsContact CE1-CE1 3.5Å; F94-F96 HydrophobicContact CE1-CE2 4.35Å; F94-F96 AromaticContact CE1-CZ 3.7Å; F94-F96 HydrophobicContact CE1-CZ 3.7Å; F94-F96 HydrophobicContact CZ-CE1 4.45Å; F94-F96 PolarHBondContact O-N 2.82Å
97	R	69.6	Low	58.5	Low	111 Å²	111	82.1 Å²	82.1	42%	0.419	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-84.3	172	-177.2	-60	-140	-149	144.5	27.8	112	E54 T95 E101 V102 E105	E54-R97 PolarHBondContact OE2-N 3.13Å; T95-R97 PolarHBondContact O-N 2.96Å; R97-E101 WeakPolarHBondContact CD-OE1 3.19Å; R97-E101 IonicContact CZ-OE1 2.67Å; R97-E101 IonicContact NE-OE1 3.83Å; R97-E101 IonicContact NH1-OE1 3.18Å; R97-E101 PolarHBondContact NH1-OE1 2.9Å; R97-V102 HydrophobicContact CB-CG2 4.03Å; R97-E105 IonicContact CZ-OE2 3.53Å; R97-E105 IonicContact NH1-OE2 3.86Å; R97-E105 PolarHBondContact NH1-OE2 2.79Å; R97-E105 VanDerWaalsContact NH2-CD 3.33Å; R97-E105 IonicContact NH2-OE1 2.64Å; R97-E105 PolarHBondContact NH2-OE1 3.46Å; R97-E105 IonicContact NH2-OE2 2.65Å; R97-E105 PolarHBondContact NH2-OE2 3.25Å
98	S	72.9	Confident	59.9	Low	48 Å²	48	77.9 Å²	77.9	34%	0.336	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-61.2	135	171.8	58.6	0	0	0	0	109.9	E100 E101 V102	S98-E100 PolarHBondContact O-N 2.94Å; S98-E100 VanDerWaalsContact O-N 3.1Å; S98-E101 WeakPolarHBondContact O-CA 3.45Å; S98-E101 WeakPolarHBondContact O-CB 3.46Å; S98-E101 PolarHBondContact O-N 2.75Å; S98-E101 WeakPolarHBondContact OG-CB 3.12Å; S98-E101 PolarHBondContact OG-N 2.91Å; S98-E101 PolarHBondContact OG-OE2 3.14Å; S98-V102 PolarHBondContact O-N 2.97Å
99	P	73	Confident	61.6	Low	15 Å²	15	79.7 Å²	79.7	10%	0.097	45%	0.445	C	S	.	.	H	α-helix	trans	-52.3	-34	179.7	-31.4	38.7	0	0	0	113.6	F46 K47 A50 V102 F103	F46-P99 HydrophobicContact CD1-CB 3.52Å; F46-P99 HydrophobicContact CD1-CG 4.41Å; F46-P99 HydrophobicContact CE1-CB 3.46Å; F46-P99 VanDerWaalsContact CE1-CB 3.46Å; F46-P99 HydrophobicContact CZ-CB 4.43Å; K47-P99 HydrophobicContact CB-CG 4.05Å; K47-P99 HydrophobicContact CG-CG 4.04Å; A50-P99 HydrophobicContact CB-CB 3.65Å; A50-P99 HydrophobicContact CB-CG 4.08Å; P99-V102 PolarHBondContact O-N 3.31Å; P99-F103 VanDerWaalsContact O-CB 3.32Å; P99-F103 WeakPolarHBondContact O-CB 3.32Å; P99-F103 PolarHBondContact O-N 3.19Å
100	E	72.7	Confident	62.6	Low	85 Å²	85	78.9 Å²	78.9	40%	0.397	44%	0.437	S	S	.	.	H	α-helix	trans	-71.8	-30.1	177.9	-55.8	67	-142.9	0	0	111.8	F46 S98 R104	F46-E100 HydrophobicContact CE1-CG 4.38Å; F46-E100 WeakPolarHBondContact CE1-OE1 3.3Å; S98-E100 PolarHBondContact O-N 2.94Å; S98-E100 VanDerWaalsContact O-N 3.1Å; E100-R104 VanDerWaalsContact O-CB 3.32Å; E100-R104 WeakPolarHBondContact O-CB 3.44Å; E100-R104 WeakPolarHBondContact O-CG 3.32Å; E100-R104 PolarHBondContact O-N 3.31Å; E100-R104 PolarHBondContact O-NE 2.94Å
101	E	73.4	Confident	63.7	Low	67 Å²	67	78 Å²	78	31%	0.313	43%	0.426	S	S	.	.	H	α-helix	trans	-78.2	-40.2	171.9	-176.7	-176.5	177.8	0	0	112	R97 S98 F103 R104 E105	R97-E101 WeakPolarHBondContact CD-OE1 3.19Å; R97-E101 IonicContact CZ-OE1 2.67Å; R97-E101 IonicContact NE-OE1 3.83Å; R97-E101 IonicContact NH1-OE1 3.18Å; R97-E101 PolarHBondContact NH1-OE1 2.9Å; S98-E101 WeakPolarHBondContact O-CA 3.45Å; S98-E101 WeakPolarHBondContact O-CB 3.46Å; S98-E101 PolarHBondContact O-N 2.75Å; S98-E101 WeakPolarHBondContact OG-CB 3.12Å; S98-E101 PolarHBondContact OG-N 2.91Å; S98-E101 PolarHBondContact OG-OE2 3.14Å; E101-F103 VanDerWaalsContact C-N 3.26Å; E101-F103 PolarHBondContact O-N 3.48Å; E101-R104 PolarHBondContact O-N 2.81Å; E101-E105 VanDerWaalsContact O-CB 3.25Å; E101-E105 WeakPolarHBondContact O-CB 2.93Å; E101-E105 PolarHBondContact O-N 2.89Å
102	V	71.9	Confident	64.9	Low	17 Å²	17	75.8 Å²	75.8	10%	0.103	40%	0.4	C	S	.	.	H	α-helix	trans	-57.8	-43.5	171.4	178.3	0	0	0	0	110.3	Y53 R97 S98 P99 F106	Y53-V102 HydrophobicContact CD1-CG1 4.16Å; R97-V102 HydrophobicContact CB-CG2 4.03Å; S98-V102 PolarHBondContact O-N 2.97Å; P99-V102 PolarHBondContact O-N 3.31Å; V102-F106 VanDerWaalsContact O-CB 3.32Å; V102-F106 WeakPolarHBondContact O-CB 3.24Å; V102-F106 PolarHBondContact O-N 2.98Å; V102-F106 VanDerWaalsContact O-N 3.14Å
103	F	72.1	Confident	65.7	Low	29 Å²	29	70.5 Å²	70.5	13%	0.127	38%	0.377	C	S	.	.	H	α-helix	trans	-62.9	-48.3	175.7	-170.2	-91.1	0	0	0	112.3	A27 F46 P99 E101 F106 F107 P112 F113	A27-F103 HydrophobicContact CB-CD2 4.22Å; A27-F103 HydrophobicContact CB-CE2 3.97Å; F46-F103 HydrophobicContact CZ-CD2 4.44Å; P99-F103 VanDerWaalsContact O-CB 3.32Å; P99-F103 WeakPolarHBondContact O-CB 3.32Å; P99-F103 PolarHBondContact O-N 3.19Å; E101-F103 VanDerWaalsContact C-N 3.26Å; E101-F103 PolarHBondContact O-N 3.48Å; F103-F106 PolarHBondContact O-N 3.24Å; F103-F107 HydrophobicContact CD1-CD2 4.39Å; F103-F107 AromaticContact CD2-CD2 3.79Å; F103-F107 HydrophobicContact CD2-CD2 3.79Å; F103-F107 AromaticContact CD2-CE2 3.91Å; F103-F107 HydrophobicContact CD2-CE2 3.91Å; F103-F107 AromaticContact CE2-CD2 3.96Å; F103-F107 HydrophobicContact CE2-CD2 3.96Å; F103-F107 HydrophobicContact CE2-CE2 4.09Å; F103-F107 HydrophobicContact CG-CD2 4.05Å; F103-F107 HydrophobicContact CZ-CD2 4.35Å; F103-F107 WeakPolarHBondContact O-CB 3.46Å; F103-F107 PolarHBondContact O-N 3.29Å; F103-P112 HydrophobicContact CE1-CG 3.93Å; F103-P112 HydrophobicContact CE2-CG 3.86Å; F103-P112 HydrophobicContact CZ-CG 3.3Å; F103-F113 HydrophobicContact CZ-CE2 4.35Å
104	R	78.6	Confident	66.7	Low	144 Å²	144	67.5 Å²	67.5	54%	0.543	36%	0.364	S	S	.	.	H	α-helix	trans	-71.9	-30.3	179.5	-75.4	174.8	-63.5	152.9	4.8	114.3	E100 E101 G108	E100-R104 VanDerWaalsContact O-CB 3.32Å; E100-R104 WeakPolarHBondContact O-CB 3.44Å; E100-R104 WeakPolarHBondContact O-CG 3.32Å; E100-R104 PolarHBondContact O-N 3.31Å; E100-R104 PolarHBondContact O-NE 2.94Å; E101-R104 PolarHBondContact O-N 2.81Å; R104-G108 CarbonylContact O-C 3.56Å; R104-G108 WeakPolarHBondContact O-CA 3.23Å; R104-G108 PolarHBondContact O-N 2.75Å
105	E	75	Confident	66.9	Low	126 Å²	126	70.9 Å²	70.9	59%	0.589	38%	0.38	S	S	*	.	H	α-helix	trans	-71.2	-39	175.2	-177.8	163.2	136.8	0	0	110.5	R97 E101	R97-E105 IonicContact CZ-OE2 3.53Å; R97-E105 IonicContact NH1-OE2 3.86Å; R97-E105 PolarHBondContact NH1-OE2 2.79Å; R97-E105 VanDerWaalsContact NH2-CD 3.33Å; R97-E105 IonicContact NH2-OE1 2.64Å; R97-E105 PolarHBondContact NH2-OE1 3.46Å; R97-E105 IonicContact NH2-OE2 2.65Å; R97-E105 PolarHBondContact NH2-OE2 3.25Å; E101-E105 VanDerWaalsContact O-CB 3.25Å; E101-E105 WeakPolarHBondContact O-CB 2.93Å; E101-E105 PolarHBondContact O-N 2.89Å
106	F	65.7	Low	66.9	Low	85 Å²	85	67.4 Å²	67.4	37%	0.373	36%	0.358	S	S	.	.	H	α-helix	trans	-93.8	-21.7	-172.5	-161.5	-97	0	0	0	115.3	K20 Y53 V102 F103	K20-F106 HydrophobicContact CD-CE1 3.58Å; K20-F106 HydrophobicContact CD-CZ 3.92Å; K20-F106 VanDerWaalsContact CE-CE1 3.46Å; K20-F106 HydrophobicContact CG-CE1 3.92Å; K20-F106 VanDerWaalsContact NZ-CE1 3.34Å; Y53-F106 AromaticContact CE1-CD1 3.96Å; Y53-F106 HydrophobicContact CE1-CD1 3.96Å; Y53-F106 HydrophobicContact CE1-CD2 4.43Å; Y53-F106 HydrophobicContact CE1-CE1 4.3Å; Y53-F106 HydrophobicContact CE1-CG 4.04Å; Y53-F106 AromaticContact CZ-CE1 3.88Å; Y53-F106 WeakPolarHBondContact OH-CD1 3.41Å; Y53-F106 WeakPolarHBondContact OH-CE1 3.49Å; Y53-F106 WeakPolarHBondContact OH-CZ 3.35Å; V102-F106 VanDerWaalsContact O-CB 3.32Å; V102-F106 WeakPolarHBondContact O-CB 3.24Å; V102-F106 PolarHBondContact O-N 2.98Å; V102-F106 VanDerWaalsContact O-N 3.14Å; F103-F106 PolarHBondContact O-N 3.24Å
107	F	66.5	Low	66.5	Low	27 Å²	27	72 Å²	72	12%	0.118	38%	0.378	C	S	.	.	H	α-helix	trans	-113.1	-4.6	171.9	-54.9	-52	0	0	0	113.6	Y23 R24 F103 G110 P112	Y23-F107 AromaticContact CD1-CE2 3.83Å; Y23-F107 HydrophobicContact CD1-CE2 3.83Å; Y23-F107 AromaticContact CD1-CZ 3.73Å; Y23-F107 HydrophobicContact CD1-CZ 3.73Å; Y23-F107 AromaticContact CE1-CE2 3.5Å; Y23-F107 HydrophobicContact CE1-CE2 3.5Å; Y23-F107 AromaticContact CE1-CZ 3.87Å; Y23-F107 HydrophobicContact CE1-CZ 3.87Å; R24-F107 HydrophobicContact CG-CE1 3.81Å; R24-F107 HydrophobicContact CG-CE2 4.2Å; R24-F107 HydrophobicContact CG-CZ 3.44Å; R24-F107 VanDerWaalsContact CG-CZ 3.44Å; F103-F107 HydrophobicContact CD1-CD2 4.39Å; F103-F107 AromaticContact CD2-CD2 3.79Å; F103-F107 HydrophobicContact CD2-CD2 3.79Å; F103-F107 AromaticContact CD2-CE2 3.91Å; F103-F107 HydrophobicContact CD2-CE2 3.91Å; F103-F107 AromaticContact CE2-CD2 3.96Å; F103-F107 HydrophobicContact CE2-CD2 3.96Å; F103-F107 HydrophobicContact CE2-CE2 4.09Å; F103-F107 HydrophobicContact CG-CD2 4.05Å; F103-F107 HydrophobicContact CZ-CD2 4.35Å; F103-F107 WeakPolarHBondContact O-CB 3.46Å; F103-F107 PolarHBondContact O-N 3.29Å; F107-G110 PolarHBondContact O-N 2.79Å; F107-P112 HydrophobicContact CB-CB 4.33Å; F107-P112 HydrophobicContact CB-CG 4.32Å; F107-P112 HydrophobicContact CD1-CB 4.26Å; F107-P112 HydrophobicContact CD2-CB 4.08Å; F107-P112 HydrophobicContact CD2-CG 3.9Å; F107-P112 HydrophobicContact CE2-CB 4.49Å; F107-P112 HydrophobicContact CE2-CG 4.47Å; F107-P112 HydrophobicContact CG-CB 3.96Å; F107-P112 HydrophobicContact CG-CG 4.13Å
108	G	66.4	Low	66	Low	36 Å²	36	72.5 Å²	72.5	37%	0.371	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	-155.3	-176	0	0	0	0	0	112.4	R104	R104-G108 CarbonylContact O-C 3.56Å; R104-G108 WeakPolarHBondContact O-CA 3.23Å; R104-G108 PolarHBondContact O-N 2.75Å
109	S	63.7	Low	65.3	Low	122 Å²	122	75.5 Å²	75.5	85%	0.853	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	13	162.3	64	0	0	0	0	112.6
110	G	59.2	Low	64.4	Low	43 Å²	43	80.6 Å²	80.6	44%	0.443	43%	0.427	S	S	.	.	S	Bend	trans	-87.9	128.9	174.9	0	0	0	0	0	109.8	F107 P112	F107-G110 PolarHBondContact O-N 2.79Å; G110-P112 WeakPolarHBondContact O-CD 3.49Å
111	D	61.9	Low	63.2	Low	106 Å²	106	77.9 Å²	77.9	57%	0.567	42%	0.422	S	S	*	.			trans	-62.8	114.1	176.9	-94.7	-34.1	0	0	0	110.6	F113 A114	D111-F113 HydrophobicContact CB-CB 4.23Å; D111-F113 HydrophobicContact CB-CD2 3.83Å; D111-F113 PolarHBondContact O-N 3.44Å; D111-F113 WeakPolarHBondContact OD1-CD2 3.38Å; D111-F113 WeakPolarHBondContact OD1-CE2 3.41Å; D111-A114 PolarHBondContact O-N 2.59Å
112	P	60.7	Low	62.1	Low	12 Å²	12	81.3 Å²	81.3	8%	0.078	45%	0.45	C	S	.	.	H	α-helix	trans	-67.9	-5.7	171.7	30.6	-35	0	0	0	112.1	F103 F107 G110 L116	F103-P112 HydrophobicContact CE1-CG 3.93Å; F103-P112 HydrophobicContact CE2-CG 3.86Å; F103-P112 HydrophobicContact CZ-CG 3.3Å; F107-P112 HydrophobicContact CB-CB 4.33Å; F107-P112 HydrophobicContact CB-CG 4.32Å; F107-P112 HydrophobicContact CD1-CB 4.26Å; F107-P112 HydrophobicContact CD2-CB 4.08Å; F107-P112 HydrophobicContact CD2-CG 3.9Å; F107-P112 HydrophobicContact CE2-CB 4.49Å; F107-P112 HydrophobicContact CE2-CG 4.47Å; F107-P112 HydrophobicContact CG-CB 3.96Å; F107-P112 HydrophobicContact CG-CG 4.13Å; G110-P112 WeakPolarHBondContact O-CD 3.49Å; P112-L116 PolarHBondContact O-N 3.36Å
113	F	59.3	Low	60.9	Low	56 Å²	56	87 Å²	87	25%	0.246	47%	0.474	C	S	.	.	H	α-helix	trans	-65.2	-38.5	168.2	-52.3	-104.2	0	0	0	111.9	L28 F103 D111 L116 F117	L28-F113 HydrophobicContact CD1-CD1 3.47Å; L28-F113 VanDerWaalsContact CD1-CD1 3.47Å; L28-F113 HydrophobicContact CD1-CE1 3.24Å; L28-F113 HydrophobicContact CD1-CZ 4.25Å; F103-F113 HydrophobicContact CZ-CE2 4.35Å; D111-F113 HydrophobicContact CB-CB 4.23Å; D111-F113 HydrophobicContact CB-CD2 3.83Å; D111-F113 PolarHBondContact O-N 3.44Å; D111-F113 WeakPolarHBondContact OD1-CD2 3.38Å; D111-F113 WeakPolarHBondContact OD1-CE2 3.41Å; F113-L116 PolarHBondContact O-N 3.12Å; F113-F117 WeakPolarHBondContact O-CD2 3.29Å; F113-F117 PolarHBondContact O-N 3.11Å; F113-F117 VanDerWaalsContact O-N 3.11Å
114	A	63.2	Low	59.9	Low	57 Å²	57	88.7 Å²	88.7	47%	0.471	49%	0.489	S	S	.	.	H	α-helix	trans	-64.1	-54.2	-177.5	0	0	0	0	0	111.2	D111 L116 F117 D118	D111-A114 PolarHBondContact O-N 2.59Å; A114-L116 PolarHBondContact O-N 2.93Å; A114-L116 VanDerWaalsContact O-N 3.13Å; A114-F117 PolarHBondContact O-N 2.84Å; A114-D118 PolarHBondContact O-N 3.31Å; A114-D118 VanDerWaalsContact O-N 3.12Å
115	E	57.8	Low	58.3	Low	116 Å²	116	91.4 Å²	91.4	54%	0.542	51%	0.508	S	S	.	.	H	α-helix	trans	-54.6	-32.4	175.9	-63.6	-103.9	132	0	0	113.2	R24 D119	R24-E115 IonicContact CZ-OE2 3.21Å; R24-E115 IonicContact NH1-OE2 2.82Å; R24-E115 IonicContact NH2-OE2 2.75Å; R24-E115 PolarHBondContact NH2-OE2 3.43Å; E115-D119 WeakPolarHBondContact O-CB 3.27Å; E115-D119 PolarHBondContact O-N 2.92Å; E115-D119 VanDerWaalsContact O-N 3.13Å
116	L	57.8	Low	57	Low	35 Å²	35	92 Å²	92	18%	0.183	51%	0.514	C	S	.	.	H	α-helix	trans	-79.4	-28.4	179	-168.3	68	0	0	0	112.5	L28 P112 F113 A114 L120	L28-L116 HydrophobicContact CD2-CD2 3.61Å; P112-L116 PolarHBondContact O-N 3.36Å; F113-L116 PolarHBondContact O-N 3.12Å; A114-L116 PolarHBondContact O-N 2.93Å; A114-L116 VanDerWaalsContact O-N 3.13Å; L116-L120 HydrophobicContact CD1-CD1 3.74Å; L116-L120 HydrophobicContact CD1-CG 3.9Å; L116-L120 HydrophobicContact CD2-CD1 4.32Å; L116-L120 HydrophobicContact CG-CD1 3.79Å; L116-L120 HydrophobicContact CG-CG 4.16Å; L116-L120 VanDerWaalsContact O-CB 3.22Å; L116-L120 WeakPolarHBondContact O-CB 3.33Å; L116-L120 WeakPolarHBondContact O-CG 3.32Å; L116-L120 PolarHBondContact O-N 3.48Å
117	F	55.7	Low	56.4	Low	175 Å²	175	94.9 Å²	94.9	77%	0.768	53%	0.529	S	S	*	.	H	α-helix	trans	-74.8	-30.3	172.3	-94.8	-88.5	0	0	0	112.4	F113 A114 G121	F113-F117 WeakPolarHBondContact O-CD2 3.29Å; F113-F117 PolarHBondContact O-N 3.11Å; F113-F117 VanDerWaalsContact O-N 3.11Å; A114-F117 PolarHBondContact O-N 2.84Å; F117-G121 PolarHBondContact O-N 3.07Å
118	D	58.3	Low	55.6	Low	122 Å²	122	101.1 Å²	101.1	65%	0.652	56%	0.563	S	S	*	*	H	α-helix	trans	-69.7	-43.9	169.6	-82.1	-44.3	0	0	0	112.5	A114 S124	A114-D118 PolarHBondContact O-N 3.31Å; A114-D118 VanDerWaalsContact O-N 3.12Å; D118-S124 PolarHBondContact O-OG 2.88Å; D118-S124 VanDerWaalsContact O-OG 3.09Å
119	D	57.5	Low	54.5	Low	110 Å²	110	110.7 Å²	110.7	59%	0.588	59%	0.588	S	S	*	*	H	α-helix	trans	-77.3	-24.1	-178.3	-160.6	45.4	0	0	0	113.3	K21 E115	K21-D119 IonicContact NZ-OD2 3.65Å; E115-D119 WeakPolarHBondContact O-CB 3.27Å; E115-D119 PolarHBondContact O-N 2.92Å; E115-D119 VanDerWaalsContact O-N 3.13Å
120	L	54.8	Low	53.2	Low	122 Å²	122	108.5 Å²	108.5	64%	0.639	59%	0.586	S	S	*	*	S	Bend	trans	-105.5	6	177.3	-59.9	-174.6	0	0	0	114.7	L116 P122	L116-L120 HydrophobicContact CD1-CD1 3.74Å; L116-L120 HydrophobicContact CD1-CG 3.9Å; L116-L120 HydrophobicContact CD2-CD1 4.32Å; L116-L120 HydrophobicContact CG-CD1 3.79Å; L116-L120 HydrophobicContact CG-CG 4.16Å; L116-L120 VanDerWaalsContact O-CB 3.22Å; L116-L120 WeakPolarHBondContact O-CB 3.33Å; L116-L120 WeakPolarHBondContact O-CG 3.32Å; L116-L120 PolarHBondContact O-N 3.48Å; L120-P122 VanDerWaalsContact O-CD 3.29Å; L120-P122 WeakPolarHBondContact O-CD 3.38Å
121	G	47.6	Very low	52.5	Low	28 Å²	28	111.4 Å²	111.4	29%	0.289	60%	0.599	S	S	.	*			trans	-69.6	116.3	171.8	0	0	0	0	0	111.5	F117 F123 S124	F117-G121 PolarHBondContact O-N 3.07Å; G121-F123 PolarHBondContact O-N 3.3Å; G121-S124 PolarHBondContact O-N 2.89Å; G121-S124 PolarHBondContact O-OG 3.38Å
122	P	50.2	Low	51.6	Low	140 Å²	140	117.3 Å²	117.3	91%	0.909	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	43.5	-179.3	34.7	-37.4	0	0	0	112.4	L120	L120-P122 VanDerWaalsContact O-CD 3.29Å; L120-P122 WeakPolarHBondContact O-CD 3.38Å
123	F	47.5	Very low	50.8	Low	136 Å²	136	125.6 Å²	125.6	60%	0.596	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147.8	-17.7	-174.7	-166.7	-107.8	0	0	0	112.7	G121 E125 L126	G121-F123 PolarHBondContact O-N 3.3Å; F123-E125 PolarHBondContact O-N 2.98Å; F123-E125 VanDerWaalsContact O-N 3.08Å; F123-L126 PolarHBondContact O-N 3.14Å
124	S	50	Low	50	Low	65 Å²	65	129 Å²	129	46%	0.455	68%	0.681	S	S	.	*	G	3₁₀ helix	trans	-61.6	-19.6	-176.5	-52.1	0	0	0	0	114	D118 G121 L126	D118-S124 PolarHBondContact O-OG 2.88Å; D118-S124 VanDerWaalsContact O-OG 3.09Å; G121-S124 PolarHBondContact O-N 2.89Å; G121-S124 PolarHBondContact O-OG 3.38Å; S124-L126 PolarHBondContact O-N 3.48Å
125	E	45.2	Very low	49.3	Very low	201 Å²	201	129.3 Å²	129.3	94%	0.939	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-70.3	-13	-178.8	-145.6	-179.8	152.8	0	0	114.2	F123	F123-E125 PolarHBondContact O-N 2.98Å; F123-E125 VanDerWaalsContact O-N 3.08Å
126	L	48.3	Very low	48.9	Very low	137 Å²	137	129.5 Å²	129.5	72%	0.717	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-92	-22.3	-178.3	-159.4	68.5	0	0	0	114.5	F123 S124	F123-L126 PolarHBondContact O-N 3.14Å; S124-L126 PolarHBondContact O-N 3.48Å
127	Q	52	Low	48.2	Very low	147 Å²	147	136.4 Å²	136.4	69%	0.687	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	-16.8	-167.8	-66.9	-166.9	-2.9	0	0	115.3	R129	Q127-R129 VanDerWaalsContact C-N 3.27Å; Q127-R129 PolarHBondContact O-N 2.96Å
128	N	51	Low	47.5	Very low	157 Å²	157	137.6 Å²	137.6	84%	0.84	74%	0.736	S	S	*	*	S	Bend	trans	-87.7	28	-177.6	-153.3	5.4	0	0	0	114.9
129	R	41.9	Very low	46.5	Very low	237 Å²	237	138.1 Å²	138.1	89%	0.894	74%	0.744	S	S	*	*			trans	-125.6	46.6	166.7	-79.2	-166.5	171.2	-159.6	0.3	111.6	Q127	Q127-R129 VanDerWaalsContact C-N 3.27Å; Q127-R129 PolarHBondContact O-N 2.96Å
130	G	36.5	Very low	45.7	Very low	77 Å²	77	141.7 Å²	141.7	79%	0.794	75%	0.754	S	S	*	*			trans	-96	15.8	-172.5	0	0	0	0	0	117.4
131	S	46	Very low	44.9	Very low	104 Å²	104	140.1 Å²	140.1	73%	0.727	75%	0.754	S	S	*	*	S	Bend	trans	-109	114.6	-179.4	-153.3	0	0	0	0	112.6
132	R	42.7	Very low	44.8	Very low	230 Å²	230	142.6 Å²	142.6	87%	0.868	77%	0.766	S	S	*	*	S	Bend	trans	73.4	78.5	167.4	-46.4	174.2	-169.9	-168.8	0.9	118.2
133	H	44.1	Very low	44.6	Very low	185 Å²	185	140.8 Å²	140.8	86%	0.856	76%	0.757	S	S	*	*			trans	-161.1	145.4	132.7	39.6	45.1	0	0	0	113.5
134	S	42.9	Very low	44.7	Very low	127 Å²	127	143.6 Å²	143.6	89%	0.888	77%	0.769	S	S	*	*			trans	-70.8	148.7	-177.6	-175.4	0	0	0	0	113.5
135	G	47.2	Very low	44.3	Very low	65 Å²	65	146.6 Å²	146.6	67%	0.67	79%	0.787	S	S	*	*			trans	161.4	103.9	171.2	0	0	0	0	0	112.8
136	P	49	Very low	44.3	Very low	120 Å²	120	140.3 Å²	140.3	78%	0.779	78%	0.777	S	S	*	*			trans	-101.4	138.9	-172.8	35.6	-31.6	0	0	0	114.1
137	F	44.3	Very low	44.1	Very low	179 Å²	179	142 Å²	142	79%	0.785	78%	0.78	S	S	*	*			trans	-157.8	141.9	149.4	48.6	-98.8	0	0	0	114.1
138	F	40	Very low	43.5	Very low	200 Å²	200	139.3 Å²	139.3	88%	0.877	78%	0.778	S	S	*	*			trans	56.5	92	165.2	-50.4	-53.3	0	0	0	120.2
139	T	38	Very low	43	Very low	133 Å²	133	139.4 Å²	139.4	82%	0.816	78%	0.779	S	S	*	*			trans	-85.8	139.5	156.7	-25.2	0	0	0	0	110.7	S141	T139-S141 WeakPolarHBondContact CG2-OG 3.41Å
140	F	41	Very low	43.1	Very low	185 Å²	185	138 Å²	138	81%	0.811	78%	0.78	S	S	*	*			trans	-114	132.2	154.6	173.7	-102.1	0	0	0	108.3
141	S	37.1	Very low	43	Very low	90 Å²	90	139.4 Å²	139.4	63%	0.629	78%	0.777	S	S	*	*			trans	-139.8	125.3	-177	-57.1	0	0	0	0	110.5	T139	T139-S141 WeakPolarHBondContact CG2-OG 3.41Å
142	S	46.5	Very low	42.7	Very low	79 Å²	79	139.7 Å²	139.7	55%	0.552	78%	0.779	S	S	*	*			trans	-128.2	100.1	173	56.3	0	0	0	0	109
143	S	46.3	Very low	42.6	Very low	102 Å²	102	133.9 Å²	133.9	71%	0.713	77%	0.773	S	S	*	*			trans	-89.5	141.4	-174.9	-51	0	0	0	0	112.4
144	F	48.7	Very low	42.3	Very low	195 Å²	195	131 Å²	131	86%	0.855	78%	0.775	S	S	*	*			trans	-137.4	113.4	166.2	-58.8	-70.2	0	0	0	110.5
145	P	41.7	Very low	42.4	Very low	128 Å²	128	133.5 Å²	133.5	83%	0.831	77%	0.769	S	S	*	*			trans	-117.6	144.7	174.1	37	-26.7	0	0	0	114
146	G	44.5	Very low	41.9	Very low	70 Å²	70	136.7 Å²	136.7	72%	0.722	78%	0.782	S	S	*	*			trans	118	152.8	173.7	0	0	0	0	0	113.8
147	H	44	Very low	41.6	Very low	171 Å²	171	138.3 Å²	138.3	79%	0.792	78%	0.777	S	S	*	*			cis	-164.3	150.2	-3.4	46.3	53.3	0	0	0	112.6
148	S	39.9	Very low	41.8	Very low	91 Å²	91	134.5 Å²	134.5	64%	0.636	77%	0.772	S	S	*	*			trans	49.9	102.9	155	65.2	0	0	0	0	121.2
149	D	41	Very low	41.9	Very low	160 Å²	160	131.4 Å²	131.4	86%	0.856	77%	0.772	S	S	*	*				29	126.9	120.5	-46	-58.6	0	0	0	121.3
150	F	43.4	Very low	42.2	Very low	208 Å²	208	128.2 Å²	128.2	91%	0.912	77%	0.766	S	S	*	*			trans	-147.1	159	136.2	68.7	-93.8	0	0	0	111.6
151	S	35.1	Very low	42.8	Very low	105 Å²	105	123.1 Å²	123.1	73%	0.734	76%	0.758	S	S	*	*			trans	-90.3	147.2	-156.4	-57.3	0	0	0	0	117.1
152	S	39.7	Very low	43.7	Very low	110 Å²	110	122.5 Å²	122.5	77%	0.769	77%	0.765	S	S	*	*			trans	55	105.9	139.1	63.9	0	0	0	0	120.3
153	S	40.7	Very low	44.5	Very low	108 Å²	108	121.6 Å²	121.6	76%	0.755	76%	0.763	S	S	*	*				-148.7	136.2	112.4	51.6	0	0	0	0	109.8
154	S	37.6	Very low	45.5	Very low	126 Å²	126	123.5 Å²	123.5	88%	0.881	76%	0.758	S	S	*	*			trans	-94	115.4	-167.3	-55.2	0	0	0	0	112.3
155	F	44.9	Very low	47.3	Very low	178 Å²	178	122.3 Å²	122.3	78%	0.781	75%	0.748	S	S	*	*			trans	-131.5	123.5	156.5	63.1	-87.9	0	0	0	109.5	F157	F155-F157 PolarHBondContact O-N 2.88Å
156	S	37	Very low	49.5	Very low	132 Å²	132	119 Å²	119	92%	0.923	73%	0.728	S	S	*	*			trans	-85.3	100.7	-173.7	-55.3	0	0	0	0	110.6
157	F	42.8	Very low	51.7	Low	155 Å²	155	119 Å²	119	68%	0.68	71%	0.714	S	S	*	*			trans	-101.7	127.1	170.9	-174.6	-101.4	0	0	0	110.7	F155	F155-F157 PolarHBondContact O-N 2.88Å
158	S	48.5	Very low	54	Low	98 Å²	98	114.2 Å²	114.2	69%	0.685	70%	0.7	S	S	*	*			trans	-73	125	-179.7	-59.1	0	0	0	0	111.4	G160	S158-G160 PolarHBondContact O-N 3.43Å; S158-G160 VanDerWaalsContact O-N 3.15Å
159	P	41.3	Very low	56.6	Low	135 Å²	135	113.8 Å²	113.8	88%	0.877	69%	0.694	S	S	*	*	S	Bend	trans	-75.8	105.1	179.3	30.2	-33.3	0	0	0	110.7
160	G	45.4	Very low	58.9	Low	67 Å²	67	109.3 Å²	109.3	69%	0.691	68%	0.675	S	S	*	*			trans	168.7	7	175.9	0	0	0	0	0	117.8	S158	S158-G160 PolarHBondContact O-N 3.43Å; S158-G160 VanDerWaalsContact O-N 3.15Å
161	A	54	Low	61.3	Low	78 Å²	78	102.7 Å²	102.7	65%	0.645	65%	0.651	S	S	*	*	S	Bend	trans	-127.4	83.4	-171.1	0	0	0	0	0	113.7
162	G	55.1	Low	64.1	Low	76 Å²	76	100.9 Å²	100.9	78%	0.784	64%	0.636	S	S	*	*			trans	72.6	176.6	157.3	0	0	0	0	0	118.1	F164	G162-F164 PolarHBondContact O-N 3.1Å
163	A	62.3	Low	66.6	Low	60 Å²	60	103 Å²	103	50%	0.496	63%	0.631	S	S	.	*	S	Bend	trans	-58.9	131.5	166.7	0	0	0	0	0	110.1	R165 N187	A163-R165 PolarHBondContact O-N 3.3Å; A163-N187 WeakPolarHBondContact CB-OD1 3.26Å
164	F	68.5	Low	69	Low	142 Å²	142	101 Å²	101	62%	0.623	62%	0.615	S	S	*	*			trans	-68.7	110.3	176.6	61.6	-87.9	0	0	0	109.6	G162 N187 G188	G162-F164 PolarHBondContact O-N 3.1Å; F164-N187 PolarHBondContact O-N 3.04Å; F164-G188 VanDerWaalsContact CZ-N 3.3Å
165	R	87	Confident	71.5	Confident	171 Å²	171	104 Å²	104	65%	0.645	62%	0.615	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-117.1	112.1	173	175.6	174	153.6	-93.4	-1.3	109.1	A163 V167 M185 E186	A163-R165 PolarHBondContact O-N 3.3Å; R165-V167 HydrophobicContact CG-CG2 4.48Å; R165-M185 CarbonylContact C-O 3.58Å; R165-M185 VanDerWaalsContact CA-O 3.31Å; R165-M185 WeakPolarHBondContact CA-O 3.13Å; R165-E186 HydrophobicContact CB-CG 4.38Å; R165-E186 WeakPolarHBondContact CD-OE2 3.16Å; R165-E186 HydrophobicContact CG-CB 4.48Å; R165-E186 HydrophobicContact CG-CG 4.5Å
166	S	86.1	Confident	73.6	Confident	58 Å²	58	98.9 Å²	98.9	41%	0.406	61%	0.612	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-111.7	140.3	174.2	-175.4	0	0	0	0	109.7	I184 M185	S166-I184 CarbonylContact O-C 3.58Å; S166-I184 WeakPolarHBondContact O-CA 3.08Å; S166-M185 PolarHBondContact N-O 3.43Å; S166-M185 PolarHBondContact O-N 3.33Å
167	V	92.7	Very high	76	Confident	69 Å²	69	98.4 Å²	98.4	42%	0.418	59%	0.59	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-131.8	120.3	177.3	-175.8	0	0	0	0	108.4	R165 R183 I184	R165-V167 HydrophobicContact CG-CG2 4.48Å; V167-R183 WeakPolarHBondContact CA-O 3.25Å; V167-I184 HydrophobicContact CG1-CG1 4.21Å; V167-I184 HydrophobicContact CG2-CG1 4.29Å; V167-I184 HydrophobicContact CG2-CG2 4.38Å
168	S	90.4	Very high	78.3	Confident	72 Å²	72	95.9 Å²	95.9	50%	0.503	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.1	119.7	176.5	-178.5	0	0	0	0	109.4	R182 R183	S168-R182 CarbonylContact O-C 3.39Å; S168-R183 PolarHBondContact N-O 2.94Å; S168-R183 PolarHBondContact O-N 3.21Å
169	T	94.5	Very high	80.5	Confident	82 Å²	82	93 Å²	93	50%	0.503	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.9	125.1	179.7	-59	0	0	0	0	109.4	T180 T181 R182	T169-T180 HydrophobicContact CG2-CG2 3.73Å; T169-T181 WeakPolarHBondContact CA-O 3.03Å; T169-R182 HydrophobicContact CG2-CG 4.13Å
170	S	91.2	Very high	83	Confident	66 Å²	66	87.2 Å²	87.2	46%	0.462	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	135	175.4	-176.9	0	0	0	0	109.5	T180 T181	S170-T180 CarbonylContact O-C 3.49Å; S170-T180 WeakPolarHBondContact O-CA 3.47Å; S170-T181 PolarHBondContact N-O 2.65Å; S170-T181 PolarHBondContact O-N 2.79Å
171	T	93.7	Very high	85.3	Confident	68 Å²	68	86.4 Å²	86.4	42%	0.417	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	126	175.9	-59.8	0	0	0	0	109.6	R178 I179 T180	T171-R178 HydrophobicContact CG2-CG 3.49Å; T171-R178 VanDerWaalsContact CG2-CG 3.49Å; T171-I179 CarbonylContact C-O 3.6Å; T171-I179 VanDerWaalsContact CA-O 3.29Å; T171-I179 WeakPolarHBondContact CA-O 3.39Å; T171-T180 WeakPolarHBondContact CG2-OG1 3.43Å; T171-T180 PolarHBondContact OG1-OG1 3.3Å
172	T	92.4	Very high	87.3	Confident	67 Å²	67	87 Å²	87	41%	0.411	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	151.9	179.8	60.8	0	0	0	0	110.3	I179	T172-I179 PolarHBondContact N-O 3.25Å; T172-I179 PolarHBondContact O-N 2.74Å
173	F	92.7	Very high	89.1	Confident	154 Å²	154	88.9 Å²	88.9	68%	0.675	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.3	119	174.6	-71.9	-91.6	0	0	0	109.6	R177 R178	F173-R177 CarbonylContact C-O 3.59Å; F173-R177 WeakPolarHBondContact CA-O 2.94Å; F173-R178 HydrophobicContact CD1-CB 4.1Å; F173-R178 HydrophobicContact CE1-CB 3.68Å; F173-R178 HydrophobicContact CE1-CG 4.04Å; F173-R178 HydrophobicContact CZ-CB 4.21Å; F173-R178 HydrophobicContact CZ-CG 4.05Å
174	V	90.7	Very high	90.6	Very high	67 Å²	67	87.6 Å²	87.6	41%	0.406	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	123.6	-176.2	-179.2	0	0	0	0	108.4	G176 R177 I179	V174-G176 PolarHBondContact O-N 2.79Å; V174-G176 VanDerWaalsContact O-N 3.08Å; V174-R177 PolarHBondContact N-O 2.75Å; V174-R177 PolarHBondContact O-N 2.67Å; V174-I179 HydrophobicContact CB-CD1 3.76Å; V174-I179 HydrophobicContact CB-CG1 4.36Å; V174-I179 HydrophobicContact CG1-CD1 4.35Å; V174-I179 HydrophobicContact CG2-CD1 3.9Å; V174-I179 HydrophobicContact CG2-CG1 4.48Å
175	Q	89.9	Confident	91.6	Very high	188 Å²	188	84.2 Å²	84.2	88%	0.879	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	30.8	-176.5	-60	180	-3.1	0	0	114	R177	Q175-R177 VanDerWaalsContact C-N 3.32Å; Q175-R177 PolarHBondContact O-N 3.07Å
176	G	88.8	Confident	91.6	Very high	71 Å²	71	80 Å²	80	73%	0.732	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.9	-7.1	-177.8	0	0	0	0	0	115.4	V174	V174-G176 PolarHBondContact O-N 2.79Å; V174-G176 VanDerWaalsContact O-N 3.08Å
177	R	88.6	Confident	91.6	Very high	122 Å²	122	82.2 Å²	82.2	46%	0.46	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	146	176.8	-57.3	-170.1	-168.3	159.9	7.2	111.5	F173 V174 Q175 I179 E196 D197	F173-R177 CarbonylContact C-O 3.59Å; F173-R177 WeakPolarHBondContact CA-O 2.94Å; V174-R177 PolarHBondContact N-O 2.75Å; V174-R177 PolarHBondContact O-N 2.67Å; Q175-R177 VanDerWaalsContact C-N 3.32Å; Q175-R177 PolarHBondContact O-N 3.07Å; R177-I179 PolarHBondContact O-N 3.14Å; R177-E196 HydrophobicContact CB-CG 4.06Å; R177-E196 WeakPolarHBondContact CD-OE1 3.45Å; R177-E196 IonicContact CZ-OE1 3.53Å; R177-E196 IonicContact NE-OE1 3.7Å; R177-E196 IonicContact NH1-OE1 2.79Å; R177-E196 PolarHBondContact NH1-OE1 3.34Å; R177-D197 WeakPolarHBondContact CA-OD1 3.33Å; R177-D197 WeakPolarHBondContact CB-OD2 2.99Å; R177-D197 WeakPolarHBondContact CD-OD2 3.32Å; R177-D197 VanDerWaalsContact CG-OD2 3.3Å; R177-D197 WeakPolarHBondContact CG-OD2 3.45Å
178	R	91.7	Very high	91.1	Very high	102 Å²	102	81.7 Å²	81.7	39%	0.385	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	104.1	177.5	-177.5	-173.9	65.5	-143.3	-4.5	109.8	T171 F173 E196 D197	T171-R178 HydrophobicContact CG2-CG 3.49Å; T171-R178 VanDerWaalsContact CG2-CG 3.49Å; F173-R178 HydrophobicContact CD1-CB 4.1Å; F173-R178 HydrophobicContact CE1-CB 3.68Å; F173-R178 HydrophobicContact CE1-CG 4.04Å; F173-R178 HydrophobicContact CZ-CB 4.21Å; F173-R178 HydrophobicContact CZ-CG 4.05Å; R178-E196 CarbonylContact O-C 3.37Å; R178-E196 WeakPolarHBondContact O-CA 3.28Å; R178-D197 PolarHBondContact N-OD1 3.24Å; R178-D197 PolarHBondContact NH2-O 3.45Å; R178-D197 PolarHBondContact O-N 3.31Å
179	I	94.2	Very high	91	Very high	39 Å²	39	83.9 Å²	83.9	20%	0.2	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	121	172.3	-57	-174.8	0	0	0	108.7	T171 T172 V174 R177 V194 E195 E196	T171-I179 CarbonylContact C-O 3.6Å; T171-I179 VanDerWaalsContact CA-O 3.29Å; T171-I179 WeakPolarHBondContact CA-O 3.39Å; T172-I179 PolarHBondContact N-O 3.25Å; T172-I179 PolarHBondContact O-N 2.74Å; V174-I179 HydrophobicContact CB-CD1 3.76Å; V174-I179 HydrophobicContact CB-CG1 4.36Å; V174-I179 HydrophobicContact CG1-CD1 4.35Å; V174-I179 HydrophobicContact CG2-CD1 3.9Å; V174-I179 HydrophobicContact CG2-CG1 4.48Å; R177-I179 PolarHBondContact O-N 3.14Å; I179-V194 HydrophobicContact CG2-CG1 3.68Å; I179-E195 CarbonylContact C-O 3.55Å; I179-E195 VanDerWaalsContact CA-O 3.32Å; I179-E195 WeakPolarHBondContact CA-O 3.29Å; I179-E196 HydrophobicContact CG1-CG 4.43Å
180	T	93.6	Very high	90.8	Very high	13 Å²	13	82.4 Å²	82.4	8%	0.08	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	114.7	172.3	-62.6	0	0	0	0	109.3	T169 S170 T171 R182 E195	T169-T180 HydrophobicContact CG2-CG2 3.73Å; S170-T180 CarbonylContact O-C 3.49Å; S170-T180 WeakPolarHBondContact O-CA 3.47Å; T171-T180 WeakPolarHBondContact CG2-OG1 3.43Å; T171-T180 PolarHBondContact OG1-OG1 3.3Å; T180-R182 HydrophobicContact CG2-CG 4.34Å; T180-E195 PolarHBondContact N-O 3.29Å; T180-E195 PolarHBondContact O-N 2.88Å
181	T	94.1	Very high	90.9	Very high	49 Å²	49	82 Å²	82	30%	0.301	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	123	175.5	-58	0	0	0	0	109.6	T169 S170 V192 E193 V194	T169-T181 WeakPolarHBondContact CA-O 3.03Å; S170-T181 PolarHBondContact N-O 2.65Å; S170-T181 PolarHBondContact O-N 2.79Å; T181-V192 HydrophobicContact CG2-CG1 3.74Å; T181-E193 CarbonylContact C-O 3.56Å; T181-E193 WeakPolarHBondContact CA-O 3.34Å; T181-V194 HydrophobicContact CG2-CG2 4.32Å
182	R	94.7	Very high	91	Very high	92 Å²	92	80.1 Å²	80.1	35%	0.347	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	118.9	174.2	-53.3	178.9	-171.5	-156.5	4.9	109.1	S168 T169 T180 V192 E193 E195	S168-R182 CarbonylContact O-C 3.39Å; T169-R182 HydrophobicContact CG2-CG 4.13Å; T180-R182 HydrophobicContact CG2-CG 4.34Å; R182-V192 CarbonylContact O-C 3.51Å; R182-V192 WeakPolarHBondContact O-CA 3.41Å; R182-E193 HydrophobicContact CB-CB 4.32Å; R182-E193 PolarHBondContact N-O 2.94Å; R182-E193 PolarHBondContact O-N 3.01Å; R182-E195 IonicContact CZ-OE1 2.67Å; R182-E195 IonicContact CZ-OE2 2.79Å; R182-E195 IonicContact NE-OE1 3.91Å; R182-E195 PolarHBondContact NE-OE1 2.95Å; R182-E195 IonicContact NE-OE2 2.8Å; R182-E195 PolarHBondContact NE-OE2 2.92Å; R182-E195 IonicContact NH1-OE1 3.75Å; R182-E195 IonicContact NH2-OE1 3.07Å; R182-E195 PolarHBondContact NH2-OE1 2.68Å; R182-E195 IonicContact NH2-OE2 3.07Å; R182-E195 PolarHBondContact NH2-OE2 2.99Å
183	R	93.6	Very high	91.1	Very high	115 Å²	115	77.2 Å²	77.2	43%	0.434	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	109.9	175.1	-174.8	-180	-161.2	-154	-1.3	108.8	V167 S168 E190 V192	V167-R183 WeakPolarHBondContact CA-O 3.25Å; S168-R183 PolarHBondContact N-O 2.94Å; S168-R183 PolarHBondContact O-N 3.21Å; R183-E190 HydrophobicContact CG-CG 4.27Å; R183-E190 IonicContact CZ-OE1 3.09Å; R183-E190 IonicContact CZ-OE2 3.02Å; R183-E190 IonicContact NE-OE1 3.98Å; R183-E190 PolarHBondContact NE-OE1 2.97Å; R183-E190 IonicContact NE-OE2 2.94Å; R183-E190 PolarHBondContact NE-OE2 3.09Å; R183-E190 VanDerWaalsContact NH2-CD 3.29Å; R183-E190 IonicContact NH2-OE1 2.93Å; R183-E190 PolarHBondContact NH2-OE1 2.94Å; R183-E190 IonicContact NH2-OE2 3.54Å; R183-E190 PolarHBondContact NH2-OE2 3.16Å; R183-V192 HydrophobicContact CB-CG2 4.49Å; R183-V192 HydrophobicContact CG-CG2 4.19Å
184	I	92.8	Very high	91.2	Very high	32 Å²	32	71.6 Å²	71.6	16%	0.164	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	123.2	178.9	-57.7	164.5	0	0	0	107	S166 V167 E186 E190 R191	S166-I184 CarbonylContact O-C 3.58Å; S166-I184 WeakPolarHBondContact O-CA 3.08Å; V167-I184 HydrophobicContact CG1-CG1 4.21Å; V167-I184 HydrophobicContact CG2-CG1 4.29Å; V167-I184 HydrophobicContact CG2-CG2 4.38Å; I184-E186 HydrophobicContact CG2-CB 4.44Å; I184-E190 CarbonylContact O-C 3.48Å; I184-E190 WeakPolarHBondContact O-CA 3.34Å; I184-R191 HydrophobicContact CB-CB 4.35Å; I184-R191 PolarHBondContact N-O 3.07Å; I184-R191 PolarHBondContact O-N 3.33Å
185	M	90.6	Very high	91.3	Very high	71 Å²	71	69 Å²	69	35%	0.35	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	117.5	171.5	-61.9	-177.2	-59.6	0	0	108	R165 S166 Q189	R165-M185 CarbonylContact C-O 3.58Å; R165-M185 VanDerWaalsContact CA-O 3.31Å; R165-M185 WeakPolarHBondContact CA-O 3.13Å; S166-M185 PolarHBondContact N-O 3.43Å; S166-M185 PolarHBondContact O-N 3.33Å; M185-Q189 CarbonylContact C-O 3.55Å; M185-Q189 WeakPolarHBondContact CA-O 3.42Å
186	E	87.3	Confident	91.4	Very high	83 Å²	83	61.8 Å²	61.8	39%	0.388	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	127.3	-173.5	-178.5	166.7	173.6	0	0	110	R165 I184 G188 Q189	R165-E186 HydrophobicContact CB-CG 4.38Å; R165-E186 WeakPolarHBondContact CD-OE2 3.16Å; R165-E186 HydrophobicContact CG-CB 4.48Å; R165-E186 HydrophobicContact CG-CG 4.5Å; I184-E186 HydrophobicContact CG2-CB 4.44Å; E186-G188 PolarHBondContact O-N 3.4Å; E186-Q189 PolarHBondContact N-O 2.9Å; E186-Q189 PolarHBondContact O-N 3.48Å
187	N	85.4	Confident	91.4	Very high	105 Å²	105	62.3 Å²	62.3	56%	0.561	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	27	-176.9	-63.7	-55.8	0	0	0	114.5	A163 F164 Q189	A163-N187 WeakPolarHBondContact CB-OD1 3.26Å; F164-N187 PolarHBondContact O-N 3.04Å; N187-Q189 VanDerWaalsContact C-N 3.29Å; N187-Q189 PolarHBondContact O-N 3.09Å
188	G	83	Confident	91.4	Very high	57 Å²	57	58.7 Å²	58.7	59%	0.588	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	81	-1.8	-175.9	0	0	0	0	0	115.2	F164 E186	F164-G188 VanDerWaalsContact CZ-N 3.3Å; E186-G188 PolarHBondContact O-N 3.4Å
189	Q	87	Confident	91.3	Very high	119 Å²	119	60.8 Å²	60.8	56%	0.556	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	142.7	169	-57.6	-173.1	15.7	0	0	110.2	M185 E186 N187	M185-Q189 CarbonylContact C-O 3.55Å; M185-Q189 WeakPolarHBondContact CA-O 3.42Å; E186-Q189 PolarHBondContact N-O 2.9Å; E186-Q189 PolarHBondContact O-N 3.48Å; N187-Q189 VanDerWaalsContact C-N 3.29Å; N187-Q189 PolarHBondContact O-N 3.09Å
190	E	91.4	Very high	91.2	Very high	50 Å²	50	59.6 Å²	59.6	23%	0.234	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	126.5	173.8	178.7	176.7	167	0	0	110.3	R183 I184 V192 I205 N206	R183-E190 HydrophobicContact CG-CG 4.27Å; R183-E190 IonicContact CZ-OE1 3.09Å; R183-E190 IonicContact CZ-OE2 3.02Å; R183-E190 IonicContact NE-OE1 3.98Å; R183-E190 PolarHBondContact NE-OE1 2.97Å; R183-E190 IonicContact NE-OE2 2.94Å; R183-E190 PolarHBondContact NE-OE2 3.09Å; R183-E190 VanDerWaalsContact NH2-CD 3.29Å; R183-E190 IonicContact NH2-OE1 2.93Å; R183-E190 PolarHBondContact NH2-OE1 2.94Å; R183-E190 IonicContact NH2-OE2 3.54Å; R183-E190 PolarHBondContact NH2-OE2 3.16Å; I184-E190 CarbonylContact O-C 3.48Å; I184-E190 WeakPolarHBondContact O-CA 3.34Å; E190-V192 HydrophobicContact CG-CG2 4.07Å; E190-V192 VanDerWaalsContact OE1-CG2 3.26Å; E190-V192 WeakPolarHBondContact OE1-CG2 3.38Å; E190-I205 CarbonylContact O-C 3.53Å; E190-I205 VanDerWaalsContact O-CA 3.3Å; E190-I205 WeakPolarHBondContact O-CA 3.4Å; E190-N206 PolarHBondContact N-OD1 3.17Å; E190-N206 PolarHBondContact O-N 3.04Å
191	R	93	Very high	91.1	Very high	58 Å²	58	63.8 Å²	63.8	22%	0.219	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	121.3	169.3	174.3	179.2	170.8	118.7	-1.8	109	I184 E193 V203 T204 E217	I184-R191 HydrophobicContact CB-CB 4.35Å; I184-R191 PolarHBondContact N-O 3.07Å; I184-R191 PolarHBondContact O-N 3.33Å; R191-E193 HydrophobicContact CG-CG 4.39Å; R191-E193 IonicContact CZ-OE1 3.46Å; R191-E193 IonicContact NE-OE1 3.25Å; R191-E193 PolarHBondContact NE-OE1 3.37Å; R191-E193 IonicContact NH2-OE1 3.39Å; R191-E193 PolarHBondContact NH2-OE1 3.48Å; R191-V203 HydrophobicContact CG-CG1 4.14Å; R191-T204 CarbonylContact C-O 3.5Å; R191-T204 WeakPolarHBondContact CA-O 3.22Å; R191-E217 IonicContact NH2-OE2 3.61Å
192	V	94.9	Very high	91	Very high	28 Å²	28	63.4 Å²	63.4	17%	0.17	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	126.3	173.8	-177.6	0	0	0	0	109.3	T181 R182 R183 E190 V194 V203 T204	T181-V192 HydrophobicContact CG2-CG1 3.74Å; R182-V192 CarbonylContact O-C 3.51Å; R182-V192 WeakPolarHBondContact O-CA 3.41Å; R183-V192 HydrophobicContact CB-CG2 4.49Å; R183-V192 HydrophobicContact CG-CG2 4.19Å; E190-V192 HydrophobicContact CG-CG2 4.07Å; E190-V192 VanDerWaalsContact OE1-CG2 3.26Å; E190-V192 WeakPolarHBondContact OE1-CG2 3.38Å; V192-V194 HydrophobicContact CG1-CG2 4.28Å; V192-V203 CarbonylContact O-C 3.58Å; V192-V203 WeakPolarHBondContact O-CA 3.45Å; V192-T204 PolarHBondContact N-O 3.36Å; V192-T204 PolarHBondContact O-N 3.34Å
193	E	94.5	Very high	90.9	Very high	7 Å²	7	59.1 Å²	59.1	3%	0.033	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	134	172.5	-53.6	-172.9	165.2	0	0	108.9	T181 R182 R191 L200 S202 V203 R221	T181-E193 CarbonylContact C-O 3.56Å; T181-E193 WeakPolarHBondContact CA-O 3.34Å; R182-E193 HydrophobicContact CB-CB 4.32Å; R182-E193 PolarHBondContact N-O 2.94Å; R182-E193 PolarHBondContact O-N 3.01Å; R191-E193 HydrophobicContact CG-CG 4.39Å; R191-E193 IonicContact CZ-OE1 3.46Å; R191-E193 IonicContact NE-OE1 3.25Å; R191-E193 PolarHBondContact NE-OE1 3.37Å; R191-E193 IonicContact NH2-OE1 3.39Å; R191-E193 PolarHBondContact NH2-OE1 3.48Å; E193-L200 HydrophobicContact CB-CD1 3.88Å; E193-S202 WeakPolarHBondContact CA-O 3.4Å; E193-V203 HydrophobicContact CG-CG2 4.33Å; E193-R221 IonicContact OE1-NH2 3.57Å; E193-R221 IonicContact OE2-CZ 2.71Å; E193-R221 IonicContact OE2-NH2 3.65Å; E193-R221 PolarHBondContact OE2-NH2 2.89Å
194	V	94.6	Very high	90.9	Very high	36 Å²	36	55.1 Å²	55.1	22%	0.218	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	117.8	175.1	-170.7	0	0	0	0	109.8	I179 T181 V192 K201 S202	I179-V194 HydrophobicContact CG2-CG1 3.68Å; T181-V194 HydrophobicContact CG2-CG2 4.32Å; V192-V194 HydrophobicContact CG1-CG2 4.28Å; V194-K201 PolarHBondContact O-N 3.15Å; V194-S202 WeakPolarHBondContact CB-OG 3.5Å; V194-S202 WeakPolarHBondContact CG2-OG 3.49Å; V194-S202 PolarHBondContact N-O 3.5Å; V194-S202 PolarHBondContact O-N 3.23Å
195	E	93.5	Very high	90.8	Very high	12 Å²	12	55.6 Å²	55.6	6%	0.056	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	137.6	175.9	-61.5	163.3	175	0	0	109.3	I179 T180 R182 Q199 L200 R221	I179-E195 CarbonylContact C-O 3.55Å; I179-E195 VanDerWaalsContact CA-O 3.32Å; I179-E195 WeakPolarHBondContact CA-O 3.29Å; T180-E195 PolarHBondContact N-O 3.29Å; T180-E195 PolarHBondContact O-N 2.88Å; R182-E195 IonicContact CZ-OE1 2.67Å; R182-E195 IonicContact CZ-OE2 2.79Å; R182-E195 IonicContact NE-OE1 3.91Å; R182-E195 PolarHBondContact NE-OE1 2.95Å; R182-E195 IonicContact NE-OE2 2.8Å; R182-E195 PolarHBondContact NE-OE2 2.92Å; R182-E195 IonicContact NH1-OE1 3.75Å; R182-E195 IonicContact NH2-OE1 3.07Å; R182-E195 PolarHBondContact NH2-OE1 2.68Å; R182-E195 IonicContact NH2-OE2 3.07Å; R182-E195 PolarHBondContact NH2-OE2 2.99Å; E195-Q199 CarbonylContact C-O 3.56Å; E195-Q199 VanDerWaalsContact CA-O 3.22Å; E195-Q199 WeakPolarHBondContact CA-O 3.42Å; E195-L200 HydrophobicContact CG-CD1 4.21Å; E195-R221 IonicContact OE1-CZ 2.74Å; E195-R221 IonicContact OE1-NH1 3.76Å; E195-R221 PolarHBondContact OE1-NH1 3.33Å; E195-R221 IonicContact OE1-NH2 3.9Å
196	E	92.7	Very high	90.8	Very high	36 Å²	36	56.8 Å²	56.8	17%	0.168	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	123.8	172.1	-171.6	-173	118.8	0	0	108.8	R177 R178 I179 G198 Q199 K201	R177-E196 HydrophobicContact CB-CG 4.06Å; R177-E196 WeakPolarHBondContact CD-OE1 3.45Å; R177-E196 IonicContact CZ-OE1 3.53Å; R177-E196 IonicContact NE-OE1 3.7Å; R177-E196 IonicContact NH1-OE1 2.79Å; R177-E196 PolarHBondContact NH1-OE1 3.34Å; R178-E196 CarbonylContact O-C 3.37Å; R178-E196 WeakPolarHBondContact O-CA 3.28Å; I179-E196 HydrophobicContact CG1-CG 4.43Å; E196-G198 PolarHBondContact O-N 3.05Å; E196-Q199 PolarHBondContact N-O 3.37Å; E196-Q199 PolarHBondContact O-N 2.8Å; E196-K201 HydrophobicContact CB-CD 3.73Å; E196-K201 HydrophobicContact CB-CG 4.19Å; E196-K201 IonicContact OE1-NZ 3.49Å; E196-K201 PolarHBondContact OE1-NZ 3.29Å; E196-K201 WeakPolarHBondContact OE2-CD 3.22Å; E196-K201 WeakPolarHBondContact OE2-CE 3.45Å; E196-K201 IonicContact OE2-NZ 2.7Å; E196-K201 PolarHBondContact OE2-NZ 3.4Å
197	D	89.1	Confident	90.9	Very high	83 Å²	83	55.8 Å²	55.8	44%	0.444	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.5	14.6	-173.4	-62.1	-41.8	0	0	0	115	R177 R178	R177-D197 WeakPolarHBondContact CA-OD1 3.33Å; R177-D197 WeakPolarHBondContact CB-OD2 2.99Å; R177-D197 WeakPolarHBondContact CD-OD2 3.32Å; R177-D197 VanDerWaalsContact CG-OD2 3.3Å; R177-D197 WeakPolarHBondContact CG-OD2 3.45Å; R178-D197 PolarHBondContact N-OD1 3.24Å; R178-D197 PolarHBondContact NH2-O 3.45Å; R178-D197 PolarHBondContact O-N 3.31Å
198	G	88	Confident	91.2	Very high	46 Å²	46	55.4 Å²	55.4	47%	0.474	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.6	-5.4	-178	0	0	0	0	0	114.7	E196	E196-G198 PolarHBondContact O-N 3.05Å
199	Q	89.5	Confident	91.6	Very high	146 Å²	146	57 Å²	57	68%	0.682	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.6	128.7	174.1	-61.7	180	-1.9	0	0	110	E195 E196 K201	E195-Q199 CarbonylContact C-O 3.56Å; E195-Q199 VanDerWaalsContact CA-O 3.22Å; E195-Q199 WeakPolarHBondContact CA-O 3.42Å; E196-Q199 PolarHBondContact N-O 3.37Å; E196-Q199 PolarHBondContact O-N 2.8Å; Q199-K201 PolarHBondContact O-N 3.44Å
200	L	91.6	Very high	91.8	Very high	13 Å²	13	53.8 Å²	53.8	7%	0.068	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	126.2	174.8	-178.9	65.2	0	0	0	109.7	E193 E195 V203 E217 L218	E193-L200 HydrophobicContact CB-CD1 3.88Å; E195-L200 HydrophobicContact CG-CD1 4.21Å; L200-V203 HydrophobicContact CD1-CG2 4.1Å; L200-V203 HydrophobicContact CD2-CG2 3.85Å; L200-V203 HydrophobicContact CG-CG2 4.26Å; L200-E217 HydrophobicContact CD2-CB 3.87Å; L200-E217 HydrophobicContact CD2-CG 3.69Å; L200-L218 HydrophobicContact CB-CD2 3.93Å
201	K	91.7	Very high	91.8	Very high	102 Å²	102	57.5 Å²	57.5	44%	0.443	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	-27.3	-176.3	-76.4	-158.3	174.8	-176.7	0	115	V194 E196 Q199	V194-K201 PolarHBondContact O-N 3.15Å; E196-K201 HydrophobicContact CB-CD 3.73Å; E196-K201 HydrophobicContact CB-CG 4.19Å; E196-K201 IonicContact OE1-NZ 3.49Å; E196-K201 PolarHBondContact OE1-NZ 3.29Å; E196-K201 WeakPolarHBondContact OE2-CD 3.22Å; E196-K201 WeakPolarHBondContact OE2-CE 3.45Å; E196-K201 IonicContact OE2-NZ 2.7Å; E196-K201 PolarHBondContact OE2-NZ 3.4Å; Q199-K201 PolarHBondContact O-N 3.44Å
202	S	91.4	Very high	91.5	Very high	41 Å²	41	60.6 Å²	60.6	29%	0.287	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	148.8	171.2	62.1	0	0	0	0	111.9	E193 V194	E193-S202 WeakPolarHBondContact CA-O 3.4Å; V194-S202 WeakPolarHBondContact CB-OG 3.5Å; V194-S202 WeakPolarHBondContact CG2-OG 3.49Å; V194-S202 PolarHBondContact N-O 3.5Å; V194-S202 PolarHBondContact O-N 3.23Å
203	V	92.8	Very high	91.2	Very high	2 Å²	2	59.7 Å²	59.7	1%	0.012	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	133.6	164.6	-178	0	0	0	0	107.3	R191 V192 E193 L200 D210 A213 L214	R191-V203 HydrophobicContact CG-CG1 4.14Å; V192-V203 CarbonylContact O-C 3.58Å; V192-V203 WeakPolarHBondContact O-CA 3.45Å; E193-V203 HydrophobicContact CG-CG2 4.33Å; L200-V203 HydrophobicContact CD1-CG2 4.1Å; L200-V203 HydrophobicContact CD2-CG2 3.85Å; L200-V203 HydrophobicContact CG-CG2 4.26Å; V203-D210 PolarHBondContact O-N 3.45Å; V203-A213 HydrophobicContact CB-CB 4.38Å; V203-A213 HydrophobicContact CG1-CB 3.79Å; V203-L214 HydrophobicContact CB-CB 4.13Å; V203-L214 HydrophobicContact CG2-CB 4.02Å
204	T	93.3	Very high	91	Very high	31 Å²	31	61 Å²	61	19%	0.19	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	126.8	-175.5	-58.5	0	0	0	0	108.5	R191 V192 V208	R191-T204 CarbonylContact C-O 3.5Å; R191-T204 WeakPolarHBondContact CA-O 3.22Å; V192-T204 PolarHBondContact N-O 3.36Å; V192-T204 PolarHBondContact O-N 3.34Å; T204-V208 CarbonylContact C-O 3.44Å; T204-V208 VanDerWaalsContact CA-O 3.28Å; T204-V208 WeakPolarHBondContact CA-O 3.32Å; T204-V208 WeakPolarHBondContact CG2-O 3.47Å
205	I	92.3	Very high	90.8	Very high	42 Å²	42	61 Å²	61	22%	0.215	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	123.5	177.4	-55.1	-174.7	0	0	0	109.2	E190 G207 V208 D210 A213	E190-I205 CarbonylContact O-C 3.53Å; E190-I205 VanDerWaalsContact O-CA 3.3Å; E190-I205 WeakPolarHBondContact O-CA 3.4Å; I205-G207 PolarHBondContact O-N 3.21Å; I205-G207 VanDerWaalsContact O-N 3.11Å; I205-V208 PolarHBondContact N-O 3.35Å; I205-V208 WeakPolarHBondContact O-CB 3.18Å; I205-V208 PolarHBondContact O-N 3.09Å; I205-D210 HydrophobicContact CD1-CB 4.34Å; I205-D210 WeakPolarHBondContact CD1-OD2 3.33Å; I205-D210 HydrophobicContact CG1-CB 4.26Å; I205-A213 HydrophobicContact CD1-CB 4.14Å
206	N	90	Very high	90.6	Very high	95 Å²	95	66 Å²	66	51%	0.508	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	33.3	-176.9	-56.9	-39.7	0	0	0	114	E190	E190-N206 PolarHBondContact N-OD1 3.17Å; E190-N206 PolarHBondContact O-N 3.04Å
207	G	89.2	Confident	90.2	Very high	62 Å²	62	65.2 Å²	65.2	64%	0.639	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.9	-6	-176.9	0	0	0	0	0	115.7	I205	I205-G207 PolarHBondContact O-N 3.21Å; I205-G207 VanDerWaalsContact O-N 3.11Å
208	V	90.8	Very high	90.2	Very high	97 Å²	97	65 Å²	65	59%	0.588	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.6	129.5	176.7	-174	0	0	0	0	109.7	T204 I205	T204-V208 CarbonylContact C-O 3.44Å; T204-V208 VanDerWaalsContact CA-O 3.28Å; T204-V208 WeakPolarHBondContact CA-O 3.32Å; T204-V208 WeakPolarHBondContact CG2-O 3.47Å; I205-V208 PolarHBondContact N-O 3.35Å; I205-V208 WeakPolarHBondContact O-CB 3.18Å; I205-V208 PolarHBondContact O-N 3.09Å
209	P	92.2	Very high	90.1	Very high	92 Å²	92	65.1 Å²	65.1	60%	0.597	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.8	139.3	174.4	28.2	-34.4	0	0	0	110.8
210	D	92.2	Very high	90.1	Very high	50 Å²	50	65.7 Å²	65.7	27%	0.267	37%	0.373	S	S	.	.			trans	-128.4	96	-179	-175	-14.8	0	0	0	110.6	V203 I205 L212 A213 L214	V203-D210 PolarHBondContact O-N 3.45Å; I205-D210 HydrophobicContact CD1-CB 4.34Å; I205-D210 WeakPolarHBondContact CD1-OD2 3.33Å; I205-D210 HydrophobicContact CG1-CB 4.26Å; D210-L212 PolarHBondContact O-N 3.1Å; D210-L212 WeakPolarHBondContact OD1-CA 3.23Å; D210-L212 WeakPolarHBondContact OD1-CB 3.48Å; D210-L212 PolarHBondContact OD1-N 3.32Å; D210-A213 HydrophobicContact CB-CB 3.83Å; D210-A213 PolarHBondContact O-N 3.42Å; D210-A213 PolarHBondContact OD1-N 3.38Å; D210-A213 WeakPolarHBondContact OD2-CB 3.29Å; D210-L214 WeakPolarHBondContact O-CB 3.47Å; D210-L214 PolarHBondContact O-N 2.94Å
211	D	90.5	Very high	89.7	Confident	129 Å²	129	68.8 Å²	68.8	69%	0.69	38%	0.383	S	S	*	.	H	α-helix	trans	-65.4	-25.1	179.1	-61.2	-47.9	0	0	0	112.8	G215	D211-G215 PolarHBondContact O-N 3.1Å
212	L	87.4	Confident	89.2	Confident	123 Å²	123	71.7 Å²	71.7	64%	0.644	40%	0.399	S	S	*	.	H	α-helix	trans	-76.4	-46	176.5	178	63	0	0	0	110.3	D210 L214 G215 L216	D210-L212 PolarHBondContact O-N 3.1Å; D210-L212 WeakPolarHBondContact OD1-CA 3.23Å; D210-L212 WeakPolarHBondContact OD1-CB 3.48Å; D210-L212 PolarHBondContact OD1-N 3.32Å; L212-L214 PolarHBondContact O-N 3.02Å; L212-G215 PolarHBondContact O-N 3.08Å; L212-L216 HydrophobicContact CD1-CD1 4.23Å; L212-L216 HydrophobicContact CD1-CG 4.25Å; L212-L216 HydrophobicContact CG-CD1 4.07Å; L212-L216 WeakPolarHBondContact O-CB 3.49Å; L212-L216 VanDerWaalsContact O-CG 3.26Å; L212-L216 WeakPolarHBondContact O-CG 3.4Å; L212-L216 PolarHBondContact O-N 3.38Å
213	A	88.6	Confident	88.4	Confident	8 Å²	8	76.8 Å²	76.8	7%	0.066	42%	0.418	C	S	.	.	H	α-helix	trans	-62.5	-32.5	173.7	0	0	0	0	0	112.6	V203 I205 D210 E217	V203-A213 HydrophobicContact CB-CB 4.38Å; V203-A213 HydrophobicContact CG1-CB 3.79Å; I205-A213 HydrophobicContact CD1-CB 4.14Å; D210-A213 HydrophobicContact CB-CB 3.83Å; D210-A213 PolarHBondContact O-N 3.42Å; D210-A213 PolarHBondContact OD1-N 3.38Å; D210-A213 WeakPolarHBondContact OD2-CB 3.29Å; A213-E217 VanDerWaalsContact O-CB 3.29Å; A213-E217 WeakPolarHBondContact O-CB 3.12Å; A213-E217 PolarHBondContact O-N 2.96Å
214	L	90.6	Very high	86.8	Confident	35 Å²	35	83.7 Å²	83.7	18%	0.183	45%	0.45	C	S	.	.	H	α-helix	trans	-65.3	-53.5	170.2	-175.8	163.2	0	0	0	111.1	V203 D210 L212 L216 E217 L218	V203-L214 HydrophobicContact CB-CB 4.13Å; V203-L214 HydrophobicContact CG2-CB 4.02Å; D210-L214 WeakPolarHBondContact O-CB 3.47Å; D210-L214 PolarHBondContact O-N 2.94Å; L212-L214 PolarHBondContact O-N 3.02Å; L214-L216 PolarHBondContact O-N 3.33Å; L214-E217 PolarHBondContact O-N 3.26Å; L214-L218 HydrophobicContact CD2-CD1 3.54Å; L214-L218 HydrophobicContact CD2-CG 4.11Å; L214-L218 WeakPolarHBondContact O-CG 3.45Å; L214-L218 PolarHBondContact O-N 3.42Å
215	G	89.1	Confident	84.6	Confident	37 Å²	37	88 Å²	88	38%	0.381	48%	0.479	S	S	.	.	H	α-helix	trans	-61.7	-41.1	-178.8	0	0	0	0	0	113.7	D211 L212 L218 S219	D211-G215 PolarHBondContact O-N 3.1Å; L212-G215 PolarHBondContact O-N 3.08Å; G215-L218 PolarHBondContact O-N 3.08Å; G215-S219 PolarHBondContact O-N 2.85Å
216	L	88.6	Confident	82.3	Confident	115 Å²	115	90.5 Å²	90.5	60%	0.602	50%	0.5	S	S	*	.	H	α-helix	trans	-62.9	-44.4	175.4	-71.2	170.7	0	0	0	112	L212 L214 S219 R220	L212-L216 HydrophobicContact CD1-CD1 4.23Å; L212-L216 HydrophobicContact CD1-CG 4.25Å; L212-L216 HydrophobicContact CG-CD1 4.07Å; L212-L216 WeakPolarHBondContact O-CB 3.49Å; L212-L216 VanDerWaalsContact O-CG 3.26Å; L212-L216 WeakPolarHBondContact O-CG 3.4Å; L212-L216 PolarHBondContact O-N 3.38Å; L214-L216 PolarHBondContact O-N 3.33Å; L216-S219 PolarHBondContact O-N 2.99Å; L216-R220 VanDerWaalsContact O-CB 3.3Å; L216-R220 WeakPolarHBondContact O-CB 3.28Å; L216-R220 PolarHBondContact O-N 3.45Å
217	E	86	Confident	79.9	Confident	20 Å²	20	92.9 Å²	92.9	9%	0.093	52%	0.517	C	S	.	.	H	α-helix	trans	-75.1	-28.1	-178.8	-172.1	61.7	-156.4	0	0	112.4	R191 L200 A213 L214 R220 R221	R191-E217 IonicContact NH2-OE2 3.61Å; L200-E217 HydrophobicContact CD2-CB 3.87Å; L200-E217 HydrophobicContact CD2-CG 3.69Å; A213-E217 VanDerWaalsContact O-CB 3.29Å; A213-E217 WeakPolarHBondContact O-CB 3.12Å; A213-E217 PolarHBondContact O-N 2.96Å; L214-E217 PolarHBondContact O-N 3.26Å; E217-R220 IonicContact OE1-NH1 3.21Å; E217-R220 WeakPolarHBondContact OE2-CD 3.27Å; E217-R220 IonicContact OE2-CZ 4Å; E217-R220 IonicContact OE2-NE 2.9Å; E217-R220 IonicContact OE2-NH1 3.38Å; E217-R220 PolarHBondContact OE2-NH1 3Å; E217-R221 WeakPolarHBondContact O-CB 3.44Å; E217-R221 WeakPolarHBondContact O-CD 3.28Å; E217-R221 WeakPolarHBondContact O-CG 3.4Å; E217-R221 PolarHBondContact O-N 3.38Å; E217-R221 IonicContact OE1-CZ 2.71Å; E217-R221 IonicContact OE1-NE 2.73Å; E217-R221 PolarHBondContact OE1-NE 3.26Å; E217-R221 IonicContact OE1-NH2 2.72Å; E217-R221 PolarHBondContact OE1-NH2 3.11Å
218	L	89	Confident	77.4	Confident	78 Å²	78	95.1 Å²	95.1	41%	0.408	52%	0.519	S	S	.	.	H	α-helix	trans	-63.7	-52.5	166.5	-77.2	-178.6	0	0	0	111.6	L200 L214 G215 R220 R221 E222	L200-L218 HydrophobicContact CB-CD2 3.93Å; L214-L218 HydrophobicContact CD2-CD1 3.54Å; L214-L218 HydrophobicContact CD2-CG 4.11Å; L214-L218 WeakPolarHBondContact O-CG 3.45Å; L214-L218 PolarHBondContact O-N 3.42Å; G215-L218 PolarHBondContact O-N 3.08Å; L218-R220 VanDerWaalsContact C-N 3.28Å; L218-R220 PolarHBondContact O-N 3.22Å; L218-R221 PolarHBondContact O-N 2.59Å; L218-E222 PolarHBondContact O-N 3.45Å
219	S	86.2	Confident	75	Confident	49 Å²	49	95.7 Å²	95.7	34%	0.343	53%	0.527	S	S	.	.	H	α-helix	trans	-62	-37	-179.2	-171.4	0	0	0	0	112.1	G215 L216 R221 E222 Q223	G215-S219 PolarHBondContact O-N 2.85Å; L216-S219 PolarHBondContact O-N 2.99Å; S219-R221 VanDerWaalsContact C-N 3.31Å; S219-R221 PolarHBondContact O-N 3.03Å; S219-E222 PolarHBondContact O-N 2.94Å; S219-Q223 WeakPolarHBondContact O-CG 3.31Å; S219-Q223 PolarHBondContact O-N 3.03Å; S219-Q223 PolarHBondContact OG-NE2 2.65Å
220	R	88	Confident	72.3	Confident	158 Å²	158	102.9 Å²	102.9	60%	0.596	54%	0.542	S	S	*	.	H	α-helix	trans	-60.3	-37.4	172.3	-174.6	-167.9	-175.7	-171.7	3.2	113	L216 E217 L218	L216-R220 VanDerWaalsContact O-CB 3.3Å; L216-R220 WeakPolarHBondContact O-CB 3.28Å; L216-R220 PolarHBondContact O-N 3.45Å; E217-R220 IonicContact OE1-NH1 3.21Å; E217-R220 WeakPolarHBondContact OE2-CD 3.27Å; E217-R220 IonicContact OE2-CZ 4Å; E217-R220 IonicContact OE2-NE 2.9Å; E217-R220 IonicContact OE2-NH1 3.38Å; E217-R220 PolarHBondContact OE2-NH1 3Å; L218-R220 VanDerWaalsContact C-N 3.28Å; L218-R220 PolarHBondContact O-N 3.22Å
221	R	84.6	Confident	69.8	Low	78 Å²	78	106.4 Å²	106.4	29%	0.294	57%	0.571	S	S	.	*	H	α-helix	trans	-79.7	-29.3	179.2	-71.1	169.9	-169.1	-161.2	5.4	112.3	E193 E195 E217 L218 S219 Q224	E193-R221 IonicContact OE1-NH2 3.57Å; E193-R221 IonicContact OE2-CZ 2.71Å; E193-R221 IonicContact OE2-NH2 3.65Å; E193-R221 PolarHBondContact OE2-NH2 2.89Å; E195-R221 IonicContact OE1-CZ 2.74Å; E195-R221 IonicContact OE1-NH1 3.76Å; E195-R221 PolarHBondContact OE1-NH1 3.33Å; E195-R221 IonicContact OE1-NH2 3.9Å; E217-R221 WeakPolarHBondContact O-CB 3.44Å; E217-R221 WeakPolarHBondContact O-CD 3.28Å; E217-R221 WeakPolarHBondContact O-CG 3.4Å; E217-R221 PolarHBondContact O-N 3.38Å; E217-R221 IonicContact OE1-CZ 2.71Å; E217-R221 IonicContact OE1-NE 2.73Å; E217-R221 PolarHBondContact OE1-NE 3.26Å; E217-R221 IonicContact OE1-NH2 2.72Å; E217-R221 PolarHBondContact OE1-NH2 3.11Å; L218-R221 PolarHBondContact O-N 2.59Å; S219-R221 VanDerWaalsContact C-N 3.31Å; S219-R221 PolarHBondContact O-N 3.03Å; R221-Q224 PolarHBondContact O-N 2.8Å
222	E	81.4	Confident	67.5	Low	164 Å²	164	104 Å²	104	77%	0.766	58%	0.576	S	S	*	*	H	α-helix	trans	-68.3	-37.4	171.7	-175.3	174.7	-156	0	0	112.2	L218 S219 Q224	L218-E222 PolarHBondContact O-N 3.45Å; S219-E222 PolarHBondContact O-N 2.94Å; E222-Q224 PolarHBondContact O-N 2.64Å
223	Q	73.4	Confident	65	Low	148 Å²	148	101.5 Å²	101.5	69%	0.692	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-8.8	177.2	-71.5	174.7	41.7	0	0	114.4	S219 P225	S219-Q223 WeakPolarHBondContact O-CG 3.31Å; S219-Q223 PolarHBondContact O-N 3.03Å; S219-Q223 PolarHBondContact OG-NE2 2.65Å; Q223-P225 WeakPolarHBondContact O-CD 3.42Å
224	Q	58.4	Low	62.8	Low	146 Å²	146	108.1 Å²	108.1	68%	0.682	62%	0.621	S	S	*	*	S	Bend	trans	-98.4	109.9	170.9	-68.1	-157.1	-21.8	0	0	110.3	R221 E222 S226	R221-Q224 PolarHBondContact O-N 2.8Å; E222-Q224 PolarHBondContact O-N 2.64Å; Q224-S226 PolarHBondContact O-N 3.05Å
225	P	48.6	Very low	60.6	Low	122 Å²	122	114.5 Å²	114.5	79%	0.792	65%	0.65	S	S	*	*			trans	-63.4	111.2	176.1	26.1	-33.1	0	0	0	109.5	Q223 V227	Q223-P225 WeakPolarHBondContact O-CD 3.42Å; P225-V227 PolarHBondContact O-N 2.97Å
226	S	43.9	Very low	58.2	Low	95 Å²	95	118.6 Å²	118.6	66%	0.664	67%	0.667	S	S	*	*			trans	-68.9	120.9	-174.8	50.2	0	0	0	0	111.1	Q224 T228	Q224-S226 PolarHBondContact O-N 3.05Å; S226-T228 PolarHBondContact O-N 3.47Å; S226-T228 PolarHBondContact O-OG1 2.84Å; S226-T228 PolarHBondContact OG-OG1 2.95Å
227	V	39.6	Very low	55.9	Low	144 Å²	144	120.5 Å²	120.5	87%	0.873	67%	0.673	S	S	*	*			trans	-66	78.3	172.5	-76.5	0	0	0	0	110.6	P225 S229	P225-V227 PolarHBondContact O-N 2.97Å; V227-S229 VanDerWaalsContact C-N 3.33Å; V227-S229 PolarHBondContact O-N 2.56Å
228	T	36.2	Very low	53.6	Low	109 Å²	109	126.5 Å²	126.5	67%	0.669	70%	0.701	S	S	*	*			trans	-83.8	74.3	-167.9	-54.8	0	0	0	0	110.5	S226 R230	S226-T228 PolarHBondContact O-N 3.47Å; S226-T228 PolarHBondContact O-OG1 2.84Å; S226-T228 PolarHBondContact OG-OG1 2.95Å; T228-R230 PolarHBondContact O-N 3.36Å; T228-R230 VanDerWaalsContact O-N 3.14Å
229	S	39.9	Very low	51.1	Low	110 Å²	110	129 Å²	129	77%	0.769	72%	0.72	S	S	*	*			trans	-66.9	108.7	177.6	47.1	0	0	0	0	111.2	V227 S231	V227-S229 VanDerWaalsContact C-N 3.33Å; V227-S229 PolarHBondContact O-N 2.56Å; S229-S231 PolarHBondContact O-N 2.95Å
230	R	36.9	Very low	49.1	Very low	242 Å²	242	132.6 Å²	132.6	91%	0.913	74%	0.741	S	S	*	*			trans	-65.2	93.4	-177.2	-79	161.6	49	-164.7	-5.6	112.3	T228 G232	T228-R230 PolarHBondContact O-N 3.36Å; T228-R230 VanDerWaalsContact O-N 3.14Å; R230-G232 PolarHBondContact O-N 3.39Å
231	S	38.1	Very low	46.9	Very low	124 Å²	124	129.6 Å²	129.6	87%	0.867	75%	0.751	S	S	*	*			trans	-75.5	68.2	170.9	64.7	0	0	0	0	112.3	S229	S229-S231 PolarHBondContact O-N 2.95Å
232	G	42.7	Very low	44.8	Very low	78 Å²	78	131.4 Å²	131.4	80%	0.804	78%	0.775	S	S	*	*			trans	-88.9	100.4	171.7	0	0	0	0	0	111.3	R230	R230-G232 PolarHBondContact O-N 3.39Å
233	G	36	Very low	42.6	Very low	72 Å²	72	129.4 Å²	129.4	74%	0.742	78%	0.778	S	S	*	*			trans	-92.4	145.5	178.5	0	0	0	0	0	113.8
234	T	41	Very low	41.1	Very low	146 Å²	146	127.4 Å²	127.4	90%	0.896	78%	0.778	S	S	*	*			trans	-158.4	155.5	149.4	-72.1	0	0	0	0	109.3
235	Q	44.1	Very low	40.2	Very low	170 Å²	170	127.7 Å²	127.7	79%	0.794	78%	0.783	S	S	*	*			trans	-55.7	148.2	-161.2	-59.5	-177.7	31.6	0	0	119.7
236	V	38.9	Very low	39.8	Very low	122 Å²	122	127.8 Å²	127.8	74%	0.739	78%	0.777	S	S	*	*				38.3	122.3	123.7	-165.8	0	0	0	0	117
237	Q	40.9	Very low	40	Very low	155 Å²	155	127.9 Å²	127.9	72%	0.724	78%	0.778	S	S	*	*				-174.3	129.4	77.2	-164.7	159.6	-25.7	0	0	115.7
238	Q	38.8	Very low	40	Very low	146 Å²	146	128.6 Å²	128.6	68%	0.682	78%	0.777	S	S	*	*			trans	55.8	101.9	147	-66.5	170.4	-27.3	0	0	125.7
239	T	34.9	Very low	40.7	Very low	132 Å²	132	131.3 Å²	131.3	81%	0.81	79%	0.786	S	S	*	*				74.6	172.4	125.3	75.8	0	0	0	0	119.5
240	P	44	Very low	41.6	Very low	123 Å²	123	128.6 Å²	128.6	80%	0.799	77%	0.767	S	S	*	*				-139.6	151.5	-95.5	37.9	-16.7	0	0	0	117.7
241	A	41.8	Very low	42.8	Very low	96 Å²	96	125.7 Å²	125.7	79%	0.793	76%	0.764	S	S	*	*			trans	-154.7	139.8	165.1	0	0	0	0	0	114.6
242	S	41.8	Very low	44.3	Very low	115 Å²	115	124.7 Å²	124.7	80%	0.804	75%	0.749	S	S	*	*			trans	41.9	109.6	155.7	54.3	0	0	0	0	121.4
243	C	34.3	Very low	45.6	Very low	123 Å²	123	127.8 Å²	127.8	83%	0.831	74%	0.743	S	S	*	*			trans	-79.1	-171.3	149.6	-45.6	0	0	0	0	109.9
244	P	41.5	Very low	47.3	Very low	106 Å²	106	130.5 Å²	130.5	69%	0.688	74%	0.74	S	S	*	*			cis	-140.8	169.8	0.5	43.5	-26.2	0	0	0	117.8
245	L	40.6	Very low	49.1	Very low	152 Å²	152	128.7 Å²	128.7	80%	0.796	73%	0.725	S	S	*	*			trans	60.5	161.5	159.5	-91.3	68.8	0	0	0	116.3
246	D	39.9	Very low	50.6	Low	124 Å²	124	126.3 Å²	126.3	66%	0.663	71%	0.713	S	S	*	*			cis	-154.3	164.8	23.1	-143.2	-47.5	0	0	0	113.7
247	S	48.3	Very low	52.7	Low	97 Å²	97	125.9 Å²	125.9	68%	0.678	71%	0.706	S	S	*	*			trans	63.6	133.2	149	-66.2	0	0	0	0	123.2
248	D	39.8	Very low	54.5	Low	159 Å²	159	121 Å²	121	85%	0.85	69%	0.692	S	S	*	*			trans	-75.1	131.9	174.9	-47.1	-111.9	0	0	0	114
249	L	50.9	Low	56.5	Low	165 Å²	165	119.4 Å²	119.4	86%	0.864	69%	0.686	S	S	*	*			trans	-155.2	143.2	165	-65.3	175	0	0	0	108
250	S	57.6	Low	58.6	Low	54 Å²	54	115.8 Å²	115.8	38%	0.378	67%	0.67	S	S	.	*			cis	-166.6	120	-25.9	42.7	0	0	0	0	106	D252 E253	S250-D252 PolarHBondContact O-N 3.33Å; S250-E253 PolarHBondContact O-N 2.93Å
251	E	63.1	Low	60.3	Low	180 Å²	180	118.2 Å²	118.2	84%	0.841	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-12.8	-167.7	-58.2	179.7	133.4	0	0	114.1	E253	E251-E253 PolarHBondContact O-N 3.05Å
252	D	68.9	Low	62	Low	103 Å²	103	117 Å²	117	55%	0.551	65%	0.65	S	S	*	*	H	α-helix	trans	-69	-24.5	178.8	-58.3	-81.5	0	0	0	115.1	S250 Q256	S250-D252 PolarHBondContact O-N 3.33Å; D252-Q256 WeakPolarHBondContact O-CB 3.43Å; D252-Q256 VanDerWaalsContact O-CG 3.27Å; D252-Q256 WeakPolarHBondContact O-CG 3.42Å; D252-Q256 PolarHBondContact O-N 3.49Å; D252-Q256 PolarHBondContact O-NE2 2.87Å
253	E	69.8	Low	63.2	Low	144 Å²	144	117.3 Å²	117.3	67%	0.673	64%	0.642	S	S	*	*	H	α-helix	trans	-73	-45.7	-177.6	-69.5	-155.2	107.6	0	0	112.1	S250 E251 L255 Q256 L257	S250-E253 PolarHBondContact O-N 2.93Å; E251-E253 PolarHBondContact O-N 3.05Å; E253-L255 VanDerWaalsContact C-N 3.3Å; E253-L255 PolarHBondContact O-N 3.27Å; E253-Q256 PolarHBondContact O-N 2.85Å; E253-L257 PolarHBondContact O-N 3.21Å
254	D	71.9	Confident	65	Low	128 Å²	128	115.3 Å²	115.3	68%	0.684	63%	0.629	S	S	*	*	H	α-helix	trans	-63	-37.2	175.4	-78.5	-39.6	0	0	0	111.5	L257 A258	D254-L257 PolarHBondContact O-N 2.97Å; D254-A258 WeakPolarHBondContact O-CB 3.29Å; D254-A258 PolarHBondContact O-N 3.06Å
255	L	79.3	Confident	65.9	Low	109 Å²	109	116.9 Å²	116.9	57%	0.571	63%	0.627	S	S	*	*	H	α-helix	trans	-66.3	-40.9	176	-177	59.8	0	0	0	112.1	E253 A258 M259	E253-L255 VanDerWaalsContact C-N 3.3Å; E253-L255 PolarHBondContact O-N 3.27Å; L255-A258 PolarHBondContact O-N 3.33Å; L255-M259 WeakPolarHBondContact O-CG 3.47Å; L255-M259 PolarHBondContact O-N 3.4Å; L255-M259 VanDerWaalsContact O-N 3.08Å
256	Q	76.1	Confident	66.7	Low	119 Å²	119	116.7 Å²	116.7	56%	0.556	62%	0.624	S	S	*	*	H	α-helix	trans	-65.6	-40.2	174.4	-77.5	170	81.9	0	0	111.9	D252 E253 M259 A260	D252-Q256 WeakPolarHBondContact O-CB 3.43Å; D252-Q256 VanDerWaalsContact O-CG 3.27Å; D252-Q256 WeakPolarHBondContact O-CG 3.42Å; D252-Q256 PolarHBondContact O-N 3.49Å; D252-Q256 PolarHBondContact O-NE2 2.87Å; E253-Q256 PolarHBondContact O-N 2.85Å; Q256-M259 PolarHBondContact O-N 3.24Å; Q256-A260 WeakPolarHBondContact O-CB 3.44Å; Q256-A260 PolarHBondContact O-N 3.2Å
257	L	82.1	Confident	67.5	Low	114 Å²	114	118.9 Å²	118.9	60%	0.597	63%	0.63	S	S	*	*	H	α-helix	trans	-63.9	-40.4	175.8	-175.8	59.6	0	0	0	111.8	E253 D254 A260 Y261	E253-L257 PolarHBondContact O-N 3.21Å; D254-L257 PolarHBondContact O-N 2.97Å; L257-A260 PolarHBondContact O-N 3.25Å; L257-Y261 PolarHBondContact O-N 3.23Å
258	A	79.3	Confident	68	Low	52 Å²	52	118.7 Å²	118.7	43%	0.43	64%	0.635	S	S	.	*	H	α-helix	trans	-62	-46.1	174.7	0	0	0	0	0	112.2	D254 L255 A260 Y261 S262	D254-A258 WeakPolarHBondContact O-CB 3.29Å; D254-A258 PolarHBondContact O-N 3.06Å; L255-A258 PolarHBondContact O-N 3.33Å; A258-A260 PolarHBondContact O-N 2.84Å; A258-Y261 PolarHBondContact O-N 3.3Å; A258-S262 PolarHBondContact O-N 3.46Å; A258-S262 VanDerWaalsContact O-N 3.1Å; A258-S262 PolarHBondContact O-OG 2.89Å; A258-S262 VanDerWaalsContact O-OG 3.1Å
259	M	80.7	Confident	68.9	Low	112 Å²	112	114.8 Å²	114.8	55%	0.552	63%	0.625	S	S	*	*	H	α-helix	trans	-61.5	-42.2	175.1	-69.4	-159.8	-57	0	0	112.4	L255 Q256 Y261 S262 L263	L255-M259 WeakPolarHBondContact O-CG 3.47Å; L255-M259 PolarHBondContact O-N 3.4Å; L255-M259 VanDerWaalsContact O-N 3.08Å; Q256-M259 PolarHBondContact O-N 3.24Å; M259-Y261 VanDerWaalsContact C-N 3.33Å; M259-Y261 PolarHBondContact O-N 3.26Å; M259-S262 PolarHBondContact O-N 2.93Å; M259-L263 WeakPolarHBondContact O-CG 3.43Å; M259-L263 PolarHBondContact O-N 3.11Å; M259-L263 VanDerWaalsContact O-N 3.09Å
260	A	78.3	Confident	68.8	Low	57 Å²	57	110.3 Å²	110.3	47%	0.471	62%	0.619	S	S	.	*	H	α-helix	trans	-62.2	-39.5	178.3	0	0	0	0	0	112.1	Q256 L257 A258 S264	Q256-A260 WeakPolarHBondContact O-CB 3.44Å; Q256-A260 PolarHBondContact O-N 3.2Å; L257-A260 PolarHBondContact O-N 3.25Å; A258-A260 PolarHBondContact O-N 2.84Å; A260-S264 WeakPolarHBondContact O-CB 3.39Å; A260-S264 PolarHBondContact O-N 2.98Å
261	Y	80.9	Confident	68.6	Low	174 Å²	174	117.2 Å²	117.2	68%	0.682	64%	0.642	S	S	*	*	H	α-helix	trans	-64.9	-46.3	176.1	-150	-86	0	0	0	111.6	L257 A258 M259 L263 S264 E265	L257-Y261 PolarHBondContact O-N 3.23Å; A258-Y261 PolarHBondContact O-N 3.3Å; M259-Y261 VanDerWaalsContact C-N 3.33Å; M259-Y261 PolarHBondContact O-N 3.26Å; Y261-L263 VanDerWaalsContact C-N 3.34Å; Y261-L263 PolarHBondContact O-N 3.24Å; Y261-S264 PolarHBondContact O-N 3.29Å; Y261-E265 PolarHBondContact O-N 2.99Å
262	S	77	Confident	68.3	Low	70 Å²	70	117.6 Å²	117.6	49%	0.49	64%	0.641	S	S	.	*	H	α-helix	trans	-60.9	-38.3	179.1	-56.7	0	0	0	0	113.4	A258 M259 M266	A258-S262 PolarHBondContact O-N 3.46Å; A258-S262 VanDerWaalsContact O-N 3.1Å; A258-S262 PolarHBondContact O-OG 2.89Å; A258-S262 VanDerWaalsContact O-OG 3.1Å; M259-S262 PolarHBondContact O-N 2.93Å; S262-M266 PolarHBondContact O-N 2.85Å
263	L	68	Low	67.1	Low	122 Å²	122	119 Å²	119	64%	0.639	66%	0.655	S	S	*	*	H	α-helix	trans	-69.2	-39.9	176.2	-69.9	173.7	0	0	0	112.1	M259 Y261 M266 E267	M259-L263 WeakPolarHBondContact O-CG 3.43Å; M259-L263 PolarHBondContact O-N 3.11Å; M259-L263 VanDerWaalsContact O-N 3.09Å; Y261-L263 VanDerWaalsContact C-N 3.34Å; Y261-L263 PolarHBondContact O-N 3.24Å; L263-M266 PolarHBondContact O-N 2.67Å; L263-E267 PolarHBondContact O-N 2.89Å
264	S	70.2	Confident	66.1	Low	80 Å²	80	117.3 Å²	117.3	56%	0.559	67%	0.666	S	S	*	*	H	α-helix	trans	-64.2	-39	178.2	-165.7	0	0	0	0	112.3	A260 Y261 M266 E267 A268	A260-S264 WeakPolarHBondContact O-CB 3.39Å; A260-S264 PolarHBondContact O-N 2.98Å; Y261-S264 PolarHBondContact O-N 3.29Å; S264-M266 PolarHBondContact O-N 2.98Å; S264-E267 PolarHBondContact O-N 3.01Å; S264-A268 PolarHBondContact O-N 2.82Å
265	E	62.1	Low	64.8	Low	139 Å²	139	115.3 Å²	115.3	65%	0.65	68%	0.675	S	S	*	*	H	α-helix	trans	-67.2	-34.8	177.2	-169.8	167.7	-166.6	0	0	112.6	Y261	Y261-E265 PolarHBondContact O-N 2.99Å
266	M	56	Low	63.1	Low	149 Å²	149	113.6 Å²	113.6	73%	0.734	69%	0.685	S	S	*	*	H	α-helix	trans	-69.1	-36.6	175.1	-74	-177.2	61.8	0	0	113.3	S262 L263 S264 A269	S262-M266 PolarHBondContact O-N 2.85Å; L263-M266 PolarHBondContact O-N 2.67Å; S264-M266 PolarHBondContact O-N 2.98Å; M266-A269 PolarHBondContact O-N 2.98Å
267	E	58.1	Low	61.7	Low	169 Å²	169	118.6 Å²	118.6	79%	0.79	70%	0.698	S	S	*	*	H	α-helix	trans	-70.4	-33.8	179.3	-168.3	165.5	-155.6	0	0	112	L263 S264 A269 G270	L263-E267 PolarHBondContact O-N 2.89Å; S264-E267 PolarHBondContact O-N 3.01Å; E267-A269 PolarHBondContact O-N 3.16Å; E267-A269 VanDerWaalsContact O-N 3.15Å; E267-G270 PolarHBondContact O-N 2.82Å
268	A	58.9	Low	59.9	Low	94 Å²	94	121 Å²	121	78%	0.777	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	-19.6	177.1	0	0	0	0	0	114.5	S264	S264-A268 PolarHBondContact O-N 2.82Å
269	A	57.1	Low	58.5	Low	77 Å²	77	123.3 Å²	123.3	64%	0.636	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	-7.6	-176.5	0	0	0	0	0	115.1	M266 E267 K271	M266-A269 PolarHBondContact O-N 2.98Å; E267-A269 PolarHBondContact O-N 3.16Å; E267-A269 VanDerWaalsContact O-N 3.15Å; A269-K271 VanDerWaalsContact C-N 3.34Å; A269-K271 PolarHBondContact O-N 2.71Å
270	G	50.1	Low	57.1	Low	71 Å²	71	126.8 Å²	126.8	73%	0.732	74%	0.74	S	S	*	*			trans	-69.4	64.8	-168.4	0	0	0	0	0	117.2	E267 K272	E267-G270 PolarHBondContact O-N 2.82Å; G270-K272 PolarHBondContact O-N 2.8Å
271	K	53.7	Low	55.7	Low	199 Å²	199	131.6 Å²	131.6	87%	0.865	75%	0.753	S	S	*	*			trans	-85	85.4	-164.2	-152.6	160	-168.9	164.4	0	115.9	A269	A269-K271 VanDerWaalsContact C-N 3.34Å; A269-K271 PolarHBondContact O-N 2.71Å
272	K	56.1	Low	54.2	Low	188 Å²	188	133.1 Å²	133.1	82%	0.817	76%	0.757	S	S	*	*			trans	74.1	127.1	162.7	-60.9	-170.7	174.2	-173.2	0	118.6	G270	G270-K272 PolarHBondContact O-N 2.8Å
273	P	43.2	Very low	53	Low	132 Å²	132	140.2 Å²	140.2	86%	0.857	77%	0.773	S	S	*	*			trans	-85.4	150.3	159.6	35.2	-32.6	0	0	0	112
274	A	48.1	Very low	52.3	Low	108 Å²	108	143.7 Å²	143.7	89%	0.893	79%	0.786	S	S	*	*			trans	-142.1	119.3	164.7	0	0	0	0	0	108.9
275	G	44.7	Very low	51.1	Low	86 Å²	86	143.5 Å²	143.5	89%	0.887	80%	0.797	S	S	*	*			trans	-108.6	168.5	179.6	0	0	0	0	0	112.5
276	G	44.4	Very low	50.5	Low	74 Å²	74	148.8 Å²	148.8	76%	0.763	81%	0.811	S	S	*	*			trans	168.1	70.1	177.8	0	0	0	0	0	117.8
277	R	47.3	Very low	50.6	Low	224 Å²	224	147 Å²	147	85%	0.845	81%	0.811	S	S	*	*			trans	48.7	133.4	136.2	-76.3	174.3	172.5	-152.7	7.2	123
278	E	44.1	Very low	50.3	Low	164 Å²	164	148.8 Å²	148.8	77%	0.766	82%	0.816	S	S	*	*			trans	83.9	173.3	132.1	-72.2	178.7	87.7	0	0	121.7
279	A	48.7	Very low	50	Low	100 Å²	100	148.5 Å²	148.5	83%	0.826	81%	0.813	S	S	*	*			trans	76	83.7	176.2	0	0	0	0	0	118.7
280	Q	52.5	Low	49.7	Very low	185 Å²	185	153.4 Å²	153.4	86%	0.864	82%	0.823	S	S	*	*			trans	-57.4	149	156	-53.1	163.2	-4.9	0	0	111.6
281	H	49.5	Very low	49.9	Very low	159 Å²	159	157.8 Å²	157.8	74%	0.736	82%	0.824	S	S	*	*			trans	-164.1	140.6	137.3	-124.4	-133.4	0	0	0	115.7
282	R	48	Very low	49.8	Very low	205 Å²	205	155.6 Å²	155.6	77%	0.774	82%	0.817	S	S	*	*			trans	25.3	122.1	158.6	-64	179.4	178.3	-176.1	-2.8	120
283	R	52.6	Low	49.7	Very low	220 Å²	220	152.9 Å²	152.9	83%	0.83	81%	0.811	S	S	*	*				84.4	130.8	56	-85.4	-165.8	172.6	-164.5	0.2	116
284	Q	53	Low	50.5	Low	194 Å²	194	152.6 Å²	152.6	91%	0.907	81%	0.809	S	S	*	*			trans	85.4	144.1	161.9	-61.7	163.7	118.1	0	0	118.5
285	G	45.5	Very low	50.5	Low	76 Å²	76	150.6 Å²	150.6	78%	0.784	80%	0.8	S	S	*	*			trans	-166.9	175.8	172.1	0	0	0	0	0	109.8
286	R	49.9	Very low	51	Low	251 Å²	251	155.5 Å²	155.5	95%	0.947	80%	0.804	S	S	*	*			trans	-165.7	149.8	172.5	-146.7	170	-173.4	-159.1	2	111.9
287	P	58	Low	51.1	Low	112 Å²	112	155.6 Å²	155.6	73%	0.727	81%	0.805	S	S	*	*			trans	-111.8	164.2	-179.9	40	-34	0	0	0	114.7
288	K	51.7	Low	51.1	Low	206 Å²	206	148.5 Å²	148.5	90%	0.896	80%	0.802	S	S	*	*			trans	163.7	168.4	137.8	-96	-176.1	175.5	-167.3	0	114.6
289	A	51.2	Low	51.3	Low	88 Å²	88	147 Å²	147	73%	0.727	81%	0.805	S	S	*	*			trans	76.4	161.8	163.1	0	0	0	0	0	118.8
290	Q	51	Low	51.6	Low	179 Å²	179	149.5 Å²	149.5	84%	0.836	80%	0.799	S	S	*	*			cis	168.9	109.9	-47.5	-104.7	179.9	-50.7	0	0	110.5
291	H	54.9	Low	51.6	Low	164 Å²	164	148.9 Å²	148.9	76%	0.759	80%	0.796	S	S	*	*			trans	-167.3	146.7	163.3	-118	57.8	0	0	0	108.2
292	Q	52	Low	51.5	Low	152 Å²	152	144.3 Å²	144.3	71%	0.71	79%	0.792	S	S	*	*			cis	68.6	130.9	32.9	-67.5	179.5	130.4	0	0	112.5
293	D	54.6	Low	51.8	Low	131 Å²	131	139.7 Å²	139.7	70%	0.701	80%	0.798	S	S	*	*			cis	-142	171.4	12.2	-84.9	-55.8	0	0	0	113.3
294	P	60	Low	51.6	Low	126 Å²	126	141 Å²	141	82%	0.818	80%	0.803	S	S	*	*			trans	-105.5	152.8	174	38.5	-31.7	0	0	0	115.3
295	G	46.3	Very low	51.6	Low	67 Å²	67	135.3 Å²	135.3	69%	0.691	80%	0.796	S	S	*	*			trans	-165.4	118.9	166.5	0	0	0	0	0	110.7
296	L	55.1	Low	52	Low	188 Å²	188	140.5 Å²	140.5	98%	0.984	80%	0.8	S	S	*	*				79.9	119.6	77.5	-77.1	179.4	0	0	0	115.1
297	G	46.6	Very low	52.3	Low	76 Å²	76	132.2 Å²	132.2	78%	0.784	79%	0.785	S	S	*	*			trans	117	51.8	130.5	0	0	0	0	0	122.4
298	G	47.6	Very low	52.2	Low	76 Å²	76	131.9 Å²	131.9	78%	0.784	78%	0.781	S	S	*	*			trans	46.8	169.4	142.5	0	0	0	0	0	123.9
299	T	49.2	Very low	52.5	Low	132 Å²	132	130.7 Å²	130.7	81%	0.81	78%	0.776	S	S	*	*			trans	166.5	129.5	138.7	-71.9	0	0	0	0	111.3
300	Q	55	Low	52.5	Low	153 Å²	153	137.7 Å²	137.7	72%	0.715	78%	0.783	S	S	*	*			trans	15	134.6	151	-78	176.1	-55.4	0	0	121.9
301	E	51.3	Low	52.6	Low	171 Å²	171	134.1 Å²	134.1	80%	0.799	78%	0.778	S	S	*	*				76.4	137.4	84.3	-155.4	-177.5	158.2	0	0	112.4
302	G	47.7	Very low	52.8	Low	64 Å²	64	131.8 Å²	131.8	66%	0.66	78%	0.778	S	S	*	*			cis	178.4	-169.9	-1.6	0	0	0	0	0	109.5
303	A	53.8	Low	53	Low	107 Å²	107	128.6 Å²	128.6	88%	0.884	77%	0.772	S	S	*	*			trans	62.9	167.7	173.1	0	0	0	0	0	117.6
304	R	50.2	Low	53.2	Low	248 Å²	248	128.2 Å²	128.2	94%	0.936	78%	0.777	S	S	*	*			cis	-170.6	143.4	-47.1	-140.4	-176	-171.6	-148.2	4.3	108.6
305	G	52.5	Low	53.2	Low	74 Å²	74	130.2 Å²	130.2	76%	0.763	78%	0.775	S	S	*	*			trans	77.3	173.4	169.6	0	0	0	0	0	116.3
306	E	53.7	Low	53.6	Low	185 Å²	185	134.8 Å²	134.8	86%	0.864	78%	0.779	S	S	*	*			cis	-164.6	152.5	-14.9	-157.2	-174.5	105.7	0	0	110.7
307	A	55.9	Low	53.4	Low	77 Å²	77	136.3 Å²	136.3	64%	0.636	78%	0.777	S	S	*	*			trans	64.7	165.3	158.8	0	0	0	0	0	117.9
308	T	55.7	Low	53.6	Low	105 Å²	105	136.4 Å²	136.4	64%	0.644	77%	0.771	S	S	*	*			cis	-157.7	162.7	-24	19	0	0	0	0	111
309	K	58.6	Low	53.8	Low	181 Å²	181	137.7 Å²	137.7	79%	0.787	77%	0.768	S	S	*	*			trans	72.3	153.9	159.5	-63.4	142.7	-170.9	166.3	0	115.7
310	R	50	Low	54	Low	235 Å²	235	142.8 Å²	142.8	89%	0.887	77%	0.772	S	S	*	*			cis	-150.6	156	2.4	-134.7	171	-173	-176.2	0	111.8
311	S	53.8	Low	53.8	Low	104 Å²	104	141 Å²	141	73%	0.727	78%	0.775	S	S	*	*			trans	-96.9	-167.6	170.3	55.6	0	0	0	0	110.8
312	P	58.3	Low	53.8	Low	115 Å²	115	140.5 Å²	140.5	75%	0.747	78%	0.777	S	S	*	*			cis	-124.7	-153.6	-3.9	42.4	-22.3	0	0	0	111.7
313	S	57.7	Low	54.6	Low	86 Å²	86	143.7 Å²	143.7	60%	0.601	78%	0.778	S	S	*	*			cis	-158.3	157.4	0.3	-151.5	0	0	0	0	111
314	P	58.2	Low	54.8	Low	122 Å²	122	149.9 Å²	149.9	79%	0.792	80%	0.795	S	S	*	*			trans	-107.3	127.2	164.8	35.4	-24.9	0	0	0	112.8
315	E	60.7	Low	55	Low	169 Å²	169	145 Å²	145	79%	0.79	79%	0.788	S	S	*	*			trans	-146.1	127.9	178.4	-111.2	162.7	135.8	0	0	115.1
316	E	53.3	Low	55.1	Low	163 Å²	163	148.7 Å²	148.7	76%	0.762	79%	0.789	S	S	*	*			trans	37.7	104.1	141.5	-159.6	171.6	158.9	0	0	121.1
317	K	52	Low	55.2	Low	219 Å²	219	146.7 Å²	146.7	95%	0.952	79%	0.785	S	S	*	*			trans	-137.2	89.9	143.1	-76.1	-162.6	176.8	-179.5	0	111.8
318	A	50.5	Low	55.2	Low	78 Å²	78	150.8 Å²	150.8	65%	0.645	79%	0.794	S	S	*	*			trans	-126.5	164.1	164.8	0	0	0	0	0	109.8
319	S	52.6	Low	55.1	Low	103 Å²	103	153.7 Å²	153.7	72%	0.72	80%	0.803	S	S	*	*			trans	83.7	125	175.2	-52.3	0	0	0	0	118.8
320	R	53.1	Low	54.9	Low	240 Å²	240	151.9 Å²	151.9	91%	0.906	80%	0.804	S	S	*	*			trans	60.9	109.5	142.2	-64.6	172.3	173	140.5	-3	119.1
321	C	49.7	Very low	55.2	Low	115 Å²	115	145.9 Å²	145.9	78%	0.777	80%	0.798	S	S	*	*				-142.9	143.8	101	-139.4	0	0	0	0	111.2
322	L	52.8	Low	55.4	Low	161 Å²	161	149.2 Å²	149.2	84%	0.843	80%	0.804	S	S	*	*			trans	-132.1	110.7	173.6	-176	172.7	0	0	0	105.2
323	I	63.4	Low	55.1	Low	130 Å²	130	152 Å²	152	67%	0.667	81%	0.808	S	S	*	*			trans	-142.5	124.9	-178.8	-63.5	-177.7	0	0	0	108.4
324	L	57.6	Low	54.9	Low	238 Å²	238	158 Å²	158	100%	1.246	83%	0.827	S	S	*	*			trans	59.2	0	171.1	-66.5	164.2	0	0	0	115.7

Retrieved 324 of 324 residues in 566.6 ms (Link to these results)

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