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CDK-activating kinase assembly factor MAT1

Stabilizes the cyclin H-CDK7 complex to form a functional CDK-activating kinase (CAK) enzymatic complex. CAK activates the cyclin-associated kinases CDK1, CDK2, CDK4 and CDK6 by threonine phosphorylation. CAK complexed to the core-TFIIH basal transcription factor activates RNA polymerase II by serine phosphorylation of the repetitive C-terminal domain (CTD) of its large subunit (POLR2A), allowing its escape from the promoter and elongation of the transcripts. Involved in cell cycle control and in RNA transcription by RNA polymerase II.

AlphaFold DB , UniProt , Accession P51948, Species HUMAN (Homo sapiens, Human), Gene MNAT1, Length 309 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	52.5	Low	77.8	Confident	228 Å²	228	94.8 Å²	94.8	100%	1.123	49%	0.485	S	S	*	.				0	112	0	-67.8	-171.2	-173.9	0	0	105.6	D3	M1-D3 PolarHBondContact O-N 3.28Å
2	D	56.9	Low	78.5	Confident	166 Å²	166	88.6 Å²	88.6	89%	0.888	46%	0.455	S	S	*	.			trans	-70.2	118.3	176	-70	-38.9	0	0	0	108.1	Q4	D2-Q4 PolarHBondContact O-N 3.5Å
3	D	66.9	Low	78.9	Confident	116 Å²	116	93.2 Å²	93.2	62%	0.62	47%	0.469	S	S	*	.			trans	-59.9	113.6	-178.2	-83.9	-28.2	0	0	0	109.9	M1 G5 T12	M1-D3 PolarHBondContact O-N 3.28Å; D3-G5 PolarHBondContact O-N 3.11Å; D3-G5 VanDerWaalsContact O-N 3.12Å; D3-T12 HydrophobicContact CB-CG2 3.75Å
4	Q	73.1	Confident	79.2	Confident	81 Å²	81	100.9 Å²	100.9	38%	0.379	49%	0.492	S	S	.	.			trans	-58.5	118.7	172.3	-71.7	161.4	30.1	0	0	109.5	D2 L21 E64	D2-Q4 PolarHBondContact O-N 3.5Å; Q4-L21 HydrophobicContact CB-CD1 3.94Å; Q4-E64 VanDerWaalsContact NE2-C 3.31Å; Q4-E64 PolarHBondContact NE2-O 3.35Å; Q4-E64 PolarHBondContact OE1-O 3.25Å; Q4-E64 VanDerWaalsContact OE1-O 3.14Å
5	G	82.9	Confident	79.7	Confident	21 Å²	21	107.2 Å²	107.2	22%	0.216	51%	0.509	C	S	.	.	B	Isolated β-bridge	trans	-140.3	156.5	179.9	0	0	0	0	0	110.7	D3 T11	D3-G5 PolarHBondContact O-N 3.11Å; D3-G5 VanDerWaalsContact O-N 3.12Å; G5-T11 WeakPolarHBondContact CA-O 3.48Å
6	C	88.5	Confident	80	Confident	1 Å²	1	104.1 Å²	104.1	1%	0.007	50%	0.496	C	S	.	.			trans	-65.8	127.6	176	171.5	0	0	0	0	109.6	R8 C9 K10 T11 L21 C31	C6-R8 PolarHBondContact O-N 3.25Å; C6-R8 VanDerWaalsContact O-N 3.14Å; C6-C9 WeakPolarHBondContact CB-SG 3.45Å; C6-C9 VanDerWaalsContact SG-SG 3.67Å; C6-K10 WeakPolarHBondContact O-CA 3.31Å; C6-K10 PolarHBondContact O-N 3.12Å; C6-T11 PolarHBondContact N-O 2.77Å; C6-L21 HydrophobicContact CB-CD2 4.26Å; C6-C31 HydrophobicContact CB-CB 3.84Å; C6-C31 PolarHBondContact SG-N 3.1Å; C6-C31 VanDerWaalsContact SG-N 3.4Å
7	P	86.5	Confident	80.3	Confident	54 Å²	54	104.4 Å²	104.4	35%	0.351	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-27.9	-177.2	27.7	-39.1	0	0	0	112.6	T29 L30 E48	P7-T29 WeakPolarHBondContact CD-O 3.2Å; P7-T29 VanDerWaalsContact CG-O 3.23Å; P7-T29 WeakPolarHBondContact CG-O 3.26Å; P7-L30 HydrophobicContact CG-CD2 3.86Å; P7-E48 WeakPolarHBondContact CB-OE1 3.33Å; P7-E48 WeakPolarHBondContact CG-OE1 3.44Å
8	R	84.8	Confident	80.6	Confident	124 Å²	124	103.7 Å²	103.7	47%	0.468	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-56.8	-179.7	-174.1	-176.6	-177.2	-160.2	3.1	112.8	C6 L30 L38	C6-R8 PolarHBondContact O-N 3.25Å; C6-R8 VanDerWaalsContact O-N 3.14Å; R8-L30 HydrophobicContact CB-CD2 4.46Å; R8-L38 VanDerWaalsContact NH1-CG 3.29Å
9	C	89	Confident	81	Confident	51 Å²	51	99.5 Å²	99.5	35%	0.345	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-4.6	-175.7	65.8	0	0	0	0	113.6	C6 T11	C6-C9 WeakPolarHBondContact CB-SG 3.45Å; C6-C9 VanDerWaalsContact SG-SG 3.67Å; C9-T11 PolarHBondContact O-N 2.59Å; C9-T11 PolarHBondContact O-OG1 3.37Å; C9-T11 VanDerWaalsContact SG-CB 3.54Å; C9-T11 PolarHBondContact SG-OG1 3.23Å
10	K	86.6	Confident	81.4	Confident	164 Å²	164	99.7 Å²	99.7	71%	0.713	49%	0.493	S	S	*	.			trans	49.6	22.8	-176	-57.7	-174.8	178.5	-175.4	0	113.4	C6	C6-K10 WeakPolarHBondContact O-CA 3.31Å; C6-K10 PolarHBondContact O-N 3.12Å
11	T	87.8	Confident	81.9	Confident	37 Å²	37	95.9 Å²	95.9	23%	0.227	48%	0.475	C	S	.	.			trans	-82.7	128.1	176.9	-54.4	0	0	0	0	107.4	G5 C6 C9 R15 N16 L19	G5-T11 WeakPolarHBondContact CA-O 3.48Å; C6-T11 PolarHBondContact N-O 2.77Å; C9-T11 PolarHBondContact O-N 2.59Å; C9-T11 PolarHBondContact O-OG1 3.37Å; C9-T11 VanDerWaalsContact SG-CB 3.54Å; C9-T11 PolarHBondContact SG-OG1 3.23Å; T11-R15 HydrophobicContact CG2-CB 4.29Å; T11-N16 HydrophobicContact CG2-CB 4.02Å; T11-L19 HydrophobicContact CG2-CD1 4.11Å; T11-L19 HydrophobicContact CG2-CD2 4.13Å; T11-L19 VanDerWaalsContact O-CD2 3.27Å; T11-L19 WeakPolarHBondContact O-CD2 3.22Å
12	T	86.8	Confident	83.7	Confident	20 Å²	20	86.3 Å²	86.3	12%	0.123	43%	0.427	C	S	.	.	B	Isolated β-bridge	trans	-102.2	163.1	176.6	62.1	0	0	0	0	109.8	D3 Y14 R15 N16	D3-T12 HydrophobicContact CB-CG2 3.75Å; T12-Y14 PolarHBondContact O-N 2.75Å; T12-R15 PolarHBondContact O-N 3.41Å; T12-R15 VanDerWaalsContact O-N 3.08Å; T12-N16 PolarHBondContact O-N 3.48Å; T12-N16 VanDerWaalsContact O-N 3.14Å
13	K	83.4	Confident	85.3	Confident	148 Å²	148	78.4 Å²	78.4	64%	0.643	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-28.5	174.2	-167.4	176.9	-178.4	-179.3	0	112.6	N16 P17	K13-N16 CarbonylContact O-C 3.56Å; K13-N16 VanDerWaalsContact O-O 3.12Å; K13-P17 WeakPolarHBondContact O-CA 3.45Å
14	Y	83.9	Confident	86.5	Confident	202 Å²	202	72.9 Å²	72.9	79%	0.792	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-42.4	173.9	-176.1	-95.9	0	0	0	112.7	T12	T12-Y14 PolarHBondContact O-N 2.75Å
15	R	85.4	Confident	87.1	Confident	195 Å²	195	72 Å²	72	74%	0.736	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-30.8	179.9	-68.6	-175.2	-176.8	-166.3	0.5	112.9	T11 T12	T11-R15 HydrophobicContact CG2-CB 4.29Å; T12-R15 PolarHBondContact O-N 3.41Å; T12-R15 VanDerWaalsContact O-N 3.08Å
16	N	84.9	Confident	87.3	Confident	57 Å²	57	72 Å²	72	31%	0.305	35%	0.352	S	S	.	.			trans	-138.3	101	174.6	-179.5	-3.9	0	0	0	109.6	T11 T12 K13 S18 L19	T11-N16 HydrophobicContact CG2-CB 4.02Å; T12-N16 PolarHBondContact O-N 3.48Å; T12-N16 VanDerWaalsContact O-N 3.14Å; K13-N16 CarbonylContact O-C 3.56Å; K13-N16 VanDerWaalsContact O-O 3.12Å; N16-S18 PolarHBondContact O-N 3.02Å; N16-S18 VanDerWaalsContact O-N 3.16Å; N16-S18 PolarHBondContact OD1-N 2.84Å; N16-S18 PolarHBondContact OD1-OG 3.32Å; N16-L19 HydrophobicContact CB-CB 4.15Å; N16-L19 WeakPolarHBondContact O-CB 3.47Å; N16-L19 PolarHBondContact O-N 3.36Å
17	P	85.2	Confident	87.2	Confident	109 Å²	109	72.3 Å²	72.3	71%	0.708	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-24	179.6	-26.5	35.6	0	0	0	114.3	K13 L19	K13-P17 WeakPolarHBondContact O-CA 3.45Å; P17-L19 VanDerWaalsContact C-N 3.31Å
18	S	86.7	Confident	87.4	Confident	93 Å²	93	72.4 Å²	72.4	65%	0.65	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	2	176.8	70.2	0	0	0	0	113.9	N16 K20	N16-S18 PolarHBondContact O-N 3.02Å; N16-S18 VanDerWaalsContact O-N 3.16Å; N16-S18 PolarHBondContact OD1-N 2.84Å; N16-S18 PolarHBondContact OD1-OG 3.32Å; S18-K20 PolarHBondContact O-N 3.49Å
19	L	87	Confident	87.7	Confident	23 Å²	23	67.4 Å²	67.4	12%	0.12	34%	0.335	C	S	.	.			trans	-65.5	115.7	-179.8	-169.9	78.4	0	0	0	110.6	T11 N16 P17 L21 C31	T11-L19 HydrophobicContact CG2-CD1 4.11Å; T11-L19 HydrophobicContact CG2-CD2 4.13Å; T11-L19 VanDerWaalsContact O-CD2 3.27Å; T11-L19 WeakPolarHBondContact O-CD2 3.22Å; N16-L19 HydrophobicContact CB-CB 4.15Å; N16-L19 WeakPolarHBondContact O-CB 3.47Å; N16-L19 PolarHBondContact O-N 3.36Å; P17-L19 VanDerWaalsContact C-N 3.31Å; L19-L21 HydrophobicContact CD2-CD2 4.32Å; L19-C31 HydrophobicContact CD1-CB 3.45Å; L19-C31 VanDerWaalsContact CD1-CB 3.45Å; L19-C31 HydrophobicContact CG-CB 4.03Å
20	K	89.3	Confident	87.8	Confident	104 Å²	104	65.2 Å²	65.2	45%	0.452	32%	0.319	S	S	.	.			trans	-94	119.3	168.9	-60.7	-175.7	-164.6	159.6	0	109.8	S18 C31 E32	S18-K20 PolarHBondContact O-N 3.49Å; K20-C31 CarbonylContact O-C 3.48Å; K20-C31 VanDerWaalsContact O-CA 3.3Å; K20-C31 WeakPolarHBondContact O-CA 3.4Å; K20-E32 HydrophobicContact CB-CB 4.41Å; K20-E32 WeakPolarHBondContact CD-OE2 3.44Å; K20-E32 IonicContact NZ-OE2 2.65Å; K20-E32 PolarHBondContact O-N 3.43Å
21	L	91.1	Very high	88.1	Confident	19 Å²	19	57.5 Å²	57.5	10%	0.099	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	138.4	167.8	-67.2	172.9	0	0	0	109	Q4 C6 L19 C31 Q61	Q4-L21 HydrophobicContact CB-CD1 3.94Å; C6-L21 HydrophobicContact CB-CD2 4.26Å; L19-L21 HydrophobicContact CD2-CD2 4.32Å; L21-C31 HydrophobicContact CD2-CB 4.37Å; L21-Q61 HydrophobicContact CB-CB 4.17Å; L21-Q61 VanDerWaalsContact CB-OE1 3.26Å; L21-Q61 WeakPolarHBondContact O-CB 3.24Å; L21-Q61 PolarHBondContact O-N 3.38Å
22	M	91	Very high	88.3	Confident	27 Å²	27	59 Å²	59	13%	0.133	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	138.1	179.8	-64.7	-174.1	170.1	0	0	109.8	T29 L30 E32 V35 F58 R59	M22-T29 CarbonylContact O-C 3.12Å; M22-T29 WeakPolarHBondContact O-CA 3.25Å; M22-L30 WeakPolarHBondContact CA-O 3.34Å; M22-L30 WeakPolarHBondContact CB-O 3.47Å; M22-L30 PolarHBondContact N-O 2.99Å; M22-L30 PolarHBondContact O-N 2.94Å; M22-E32 HydrophobicContact CE-CB 3.75Å; M22-E32 HydrophobicContact CE-CG 3.56Å; M22-E32 HydrophobicContact SD-CB 4.32Å; M22-V35 HydrophobicContact CB-CG2 4.18Å; M22-V35 HydrophobicContact SD-CB 4.28Å; M22-V35 HydrophobicContact SD-CG1 4.41Å; M22-V35 HydrophobicContact SD-CG2 4.1Å; M22-F58 HydrophobicContact CB-CB 4.34Å; M22-F58 HydrophobicContact CB-CD1 4.19Å; M22-F58 HydrophobicContact SD-CB 4.24Å; M22-R59 CarbonylContact C-O 3.59Å; M22-R59 WeakPolarHBondContact CA-O 3.46Å; M22-R59 WeakPolarHBondContact CB-O 3.47Å
23	V	91.6	Very high	88.5	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	151.7	178.2	177.1	0	0	0	0	109.2	T29 R59 Q61 P66 D69	V23-T29 HydrophobicContact CG2-CG2 3.57Å; V23-R59 PolarHBondContact N-O 3.21Å; V23-R59 WeakPolarHBondContact O-CG 3.3Å; V23-R59 PolarHBondContact O-N 3.21Å; V23-Q61 HydrophobicContact CG2-CB 3.89Å; V23-Q61 HydrophobicContact CG2-CG 3.83Å; V23-P66 HydrophobicContact CG2-CB 4.32Å; V23-D69 HydrophobicContact CG1-CB 4.29Å
24	N	90.2	Very high	88.9	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.28	C	S	.	.			trans	-124.7	-170.3	173.9	-149.8	-44	0	0	0	110.9	C26 G27 L53 R54 N57 F58	N24-C26 PolarHBondContact O-N 2.95Å; N24-C26 VanDerWaalsContact O-N 3.15Å; N24-G27 PolarHBondContact O-N 3.19Å; N24-L53 HydrophobicContact CB-CD1 3.84Å; N24-L53 HydrophobicContact CB-CD2 4.04Å; N24-L53 HydrophobicContact CB-CG 4.47Å; N24-R54 PolarHBondContact ND2-O 3.16Å; N24-N57 PolarHBondContact OD1-O 3.08Å; N24-F58 HydrophobicContact CB-CD1 3.87Å; N24-F58 HydrophobicContact CB-CE1 3.77Å; N24-F58 HydrophobicContact CB-CG 4.36Å; N24-F58 HydrophobicContact CB-CZ 4.18Å; N24-F58 WeakPolarHBondContact ND2-CD2 3.3Å; N24-F58 WeakPolarHBondContact ND2-CE2 3.43Å; N24-F58 WeakPolarHBondContact ND2-CG 3.29Å; N24-F58 WeakPolarHBondContact ND2-CZ 3.23Å
25	V	86.8	Confident	89.3	Confident	64 Å²	64	45.3 Å²	45.3	39%	0.388	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-24.6	-178.8	-63.3	0	0	0	0	114.3	G27 L53	V25-G27 VanDerWaalsContact C-N 3.34Å; V25-L53 HydrophobicContact CG2-CD2 3.65Å
26	C	87.6	Confident	89.6	Confident	20 Å²	20	39.2 Å²	39.2	14%	0.135	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-11.4	178	63.5	0	0	0	0	113.9	N24 H28 C46 C49	N24-C26 PolarHBondContact O-N 2.95Å; N24-C26 VanDerWaalsContact O-N 3.15Å; C26-H28 VanDerWaalsContact C-N 3.33Å; C26-C46 VanDerWaalsContact SG-SG 3.63Å; C26-C49 WeakPolarHBondContact CB-SG 3.5Å
27	G	86.3	Confident	89.9	Confident	8 Å²	8	42.1 Å²	42.1	8%	0.082	24%	0.241	C	C	.	.			trans	84.3	-3.4	-178	0	0	0	0	0	115.4	N24 V25 P66	N24-G27 PolarHBondContact O-N 3.19Å; V25-G27 VanDerWaalsContact C-N 3.34Å; G27-P66 WeakPolarHBondContact O-CB 3.49Å
28	H	90.2	Very high	90	Very high	55 Å²	55	40 Å²	40	26%	0.255	22%	0.223	S	C	.	.			trans	-84.4	139.4	-179.6	-57.3	148.6	0	0	0	112.2	C26 C46 E48 C49	C26-H28 VanDerWaalsContact C-N 3.33Å; H28-C46 PolarHBondContact ND1-SG 3.26Å; H28-E48 HydrophobicContact CB-CB 4.41Å; H28-E48 WeakPolarHBondContact CB-OE2 3.37Å; H28-E48 IonicContact CD2-OE2 3.16Å; H28-E48 PolarHBondContact CD2-OE2 2.87Å; H28-E48 IonicContact CE1-OE2 2.67Å; H28-E48 IonicContact CG-OE2 2.82Å; H28-E48 WeakPolarHBondContact ND1-CB 3.36Å; H28-E48 IonicContact ND1-OE2 3.44Å; H28-E48 IonicContact NE2-OE2 3.05Å; H28-E48 PolarHBondContact NE2-OE2 3.34Å; H28-C49 VanDerWaalsContact CE1-CB 3.46Å; H28-C49 WeakPolarHBondContact CE1-CB 3.47Å; H28-C49 VanDerWaalsContact CE1-SG 3.51Å; H28-C49 PolarHBondContact ND1-SG 3.17Å
29	T	91	Very high	90.2	Very high	20 Å²	20	35.6 Å²	35.6	12%	0.123	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	142.7	-177.6	52	0	0	0	0	111.9	P7 M22 V23 P66	P7-T29 WeakPolarHBondContact CD-O 3.2Å; P7-T29 VanDerWaalsContact CG-O 3.23Å; P7-T29 WeakPolarHBondContact CG-O 3.26Å; M22-T29 CarbonylContact O-C 3.12Å; M22-T29 WeakPolarHBondContact O-CA 3.25Å; V23-T29 HydrophobicContact CG2-CG2 3.57Å; T29-P66 HydrophobicContact CG2-CB 3.75Å; T29-P66 HydrophobicContact CG2-CG 3.37Å
30	L	91.5	Very high	90.3	Very high	4 Å²	4	39.7 Å²	39.7	2%	0.021	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	144.6	168.2	-71.1	173.9	0	0	0	108.4	P7 R8 M22 V35 L38 F39 P47 F58	P7-L30 HydrophobicContact CG-CD2 3.86Å; R8-L30 HydrophobicContact CB-CD2 4.46Å; M22-L30 WeakPolarHBondContact CA-O 3.34Å; M22-L30 WeakPolarHBondContact CB-O 3.47Å; M22-L30 PolarHBondContact N-O 2.99Å; M22-L30 PolarHBondContact O-N 2.94Å; L30-V35 HydrophobicContact CB-CG2 3.57Å; L30-V35 HydrophobicContact CD1-CG2 4.21Å; L30-L38 HydrophobicContact CD1-CD1 3.98Å; L30-L38 HydrophobicContact CD2-CD1 4.44Å; L30-F39 HydrophobicContact CD1-CE2 3.92Å; L30-P47 HydrophobicContact CD1-CG 4.33Å; L30-P47 HydrophobicContact CD2-CG 3.98Å; L30-F58 HydrophobicContact CD1-CE1 4.04Å; L30-F58 HydrophobicContact CD1-CZ 4.19Å
31	C	92	Very high	90.4	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.014	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	153.9	171.3	69.8	0	0	0	0	111.6	C6 L19 K20 L21 S33 C34 V35	C6-C31 HydrophobicContact CB-CB 3.84Å; C6-C31 PolarHBondContact SG-N 3.1Å; C6-C31 VanDerWaalsContact SG-N 3.4Å; L19-C31 HydrophobicContact CD1-CB 3.45Å; L19-C31 VanDerWaalsContact CD1-CB 3.45Å; L19-C31 HydrophobicContact CG-CB 4.03Å; K20-C31 CarbonylContact O-C 3.48Å; K20-C31 VanDerWaalsContact O-CA 3.3Å; K20-C31 WeakPolarHBondContact O-CA 3.4Å; L21-C31 HydrophobicContact CD2-CB 4.37Å; C31-S33 VanDerWaalsContact C-N 3.27Å; C31-S33 PolarHBondContact O-N 3.17Å; C31-C34 WeakPolarHBondContact O-CA 3.39Å; C31-C34 WeakPolarHBondContact O-CB 3.32Å; C31-C34 PolarHBondContact O-N 3.4Å; C31-C34 VanDerWaalsContact SG-CB 3.58Å; C31-C34 PolarHBondContact SG-N 3.25Å; C31-C34 VanDerWaalsContact SG-N 3.4Å; C31-C34 PolarHBondContact SG-SG 2.94Å; C31-V35 PolarHBondContact O-N 3.33Å
32	E	92	Very high	90.2	Very high	69 Å²	69	47.2 Å²	47.2	32%	0.322	25%	0.253	S	S	.	.	H	α-helix	trans	-45	-49.9	176.7	-176.8	165.8	-158.1	0	0	112.3	K20 M22 C34 V35 D36	K20-E32 HydrophobicContact CB-CB 4.41Å; K20-E32 WeakPolarHBondContact CD-OE2 3.44Å; K20-E32 IonicContact NZ-OE2 2.65Å; K20-E32 PolarHBondContact O-N 3.43Å; M22-E32 HydrophobicContact CE-CB 3.75Å; M22-E32 HydrophobicContact CE-CG 3.56Å; M22-E32 HydrophobicContact SD-CB 4.32Å; E32-C34 VanDerWaalsContact C-N 3.32Å; E32-C34 PolarHBondContact O-N 3Å; E32-V35 PolarHBondContact O-N 3.15Å; E32-D36 PolarHBondContact O-N 3.18Å
33	S	91.3	Very high	90.2	Very high	72 Å²	72	48.6 Å²	48.6	50%	0.503	27%	0.269	S	S	.	.	H	α-helix	trans	-61.7	-36.7	178.1	-42.3	0	0	0	0	113.3	C31 L37	C31-S33 VanDerWaalsContact C-N 3.27Å; C31-S33 PolarHBondContact O-N 3.17Å; S33-L37 WeakPolarHBondContact O-CB 3Å; S33-L37 WeakPolarHBondContact O-CD1 3.34Å; S33-L37 WeakPolarHBondContact O-CG 3.22Å; S33-L37 PolarHBondContact O-N 3.09Å; S33-L37 VanDerWaalsContact O-N 3.14Å
34	C	91.9	Very high	90.2	Very high	7 Å²	7	49.6 Å²	49.6	5%	0.047	28%	0.279	C	S	.	.	H	α-helix	trans	-73.7	-35.4	177.2	-78	0	0	0	0	112.2	C31 E32 L37 L38	C31-C34 WeakPolarHBondContact O-CA 3.39Å; C31-C34 WeakPolarHBondContact O-CB 3.32Å; C31-C34 PolarHBondContact O-N 3.4Å; C31-C34 VanDerWaalsContact SG-CB 3.58Å; C31-C34 PolarHBondContact SG-N 3.25Å; C31-C34 VanDerWaalsContact SG-N 3.4Å; C31-C34 PolarHBondContact SG-SG 2.94Å; E32-C34 VanDerWaalsContact C-N 3.32Å; E32-C34 PolarHBondContact O-N 3Å; C34-L37 PolarHBondContact O-N 3.44Å; C34-L38 WeakPolarHBondContact O-CB 3.43Å; C34-L38 WeakPolarHBondContact O-CG 3.28Å; C34-L38 PolarHBondContact O-N 2.99Å
35	V	91.6	Very high	90.3	Very high	3 Å²	3	54.6 Å²	54.6	2%	0.018	31%	0.305	C	S	.	.	H	α-helix	trans	-62.9	-47.7	173.7	175	0	0	0	0	109.7	M22 L30 C31 E32 L37 L38 F39 K55 F58	M22-V35 HydrophobicContact CB-CG2 4.18Å; M22-V35 HydrophobicContact SD-CB 4.28Å; M22-V35 HydrophobicContact SD-CG1 4.41Å; M22-V35 HydrophobicContact SD-CG2 4.1Å; L30-V35 HydrophobicContact CB-CG2 3.57Å; L30-V35 HydrophobicContact CD1-CG2 4.21Å; C31-V35 PolarHBondContact O-N 3.33Å; E32-V35 PolarHBondContact O-N 3.15Å; V35-L37 VanDerWaalsContact C-N 3.3Å; V35-L37 PolarHBondContact O-N 3.23Å; V35-L38 PolarHBondContact O-N 3.24Å; V35-F39 HydrophobicContact CG1-CD2 4.02Å; V35-F39 WeakPolarHBondContact O-CB 3.3Å; V35-F39 WeakPolarHBondContact O-CD2 3.27Å; V35-F39 PolarHBondContact O-N 3.32Å; V35-K55 HydrophobicContact CG1-CG 4.38Å; V35-F58 HydrophobicContact CG1-CB 4.26Å; V35-F58 HydrophobicContact CG1-CD1 4.25Å; V35-F58 HydrophobicContact CG1-CD2 3.7Å; V35-F58 HydrophobicContact CG1-CE2 4.05Å; V35-F58 HydrophobicContact CG1-CG 3.8Å; V35-F58 HydrophobicContact CG1-CZ 4.48Å; V35-F58 HydrophobicContact CG2-CD1 3.78Å; V35-F58 HydrophobicContact CG2-CE1 3.92Å; V35-F58 HydrophobicContact CG2-CG 4.17Å; V35-F58 HydrophobicContact CG2-CZ 4.41Å
36	D	91.8	Very high	90.5	Very high	68 Å²	68	51.8 Å²	51.8	36%	0.364	29%	0.289	S	S	.	.	H	α-helix	trans	-59.5	-41.3	178.3	-76.4	-33.7	0	0	0	112.6	E32 V40 K55	E32-D36 PolarHBondContact O-N 3.18Å; D36-V40 WeakPolarHBondContact O-CG2 3.22Å; D36-V40 PolarHBondContact O-N 2.8Å; D36-K55 WeakPolarHBondContact OD1-CE 3.38Å; D36-K55 IonicContact OD1-NZ 3.39Å; D36-K55 PolarHBondContact OD1-NZ 3.13Å
37	L	91.3	Very high	90.6	Very high	118 Å²	118	54.4 Å²	54.4	62%	0.618	31%	0.305	S	S	*	.	H	α-helix	trans	-74.7	-34.5	179.5	-70.7	171.2	0	0	0	114.2	S33 C34 V35 V40	S33-L37 WeakPolarHBondContact O-CB 3Å; S33-L37 WeakPolarHBondContact O-CD1 3.34Å; S33-L37 WeakPolarHBondContact O-CG 3.22Å; S33-L37 PolarHBondContact O-N 3.09Å; S33-L37 VanDerWaalsContact O-N 3.14Å; C34-L37 PolarHBondContact O-N 3.44Å; V35-L37 VanDerWaalsContact C-N 3.3Å; V35-L37 PolarHBondContact O-N 3.23Å; L37-V40 WeakPolarHBondContact O-CG2 3.45Å
38	L	88.5	Confident	90.7	Very high	63 Å²	63	58.7 Å²	58.7	33%	0.33	32%	0.323	S	S	.	.	H	α-helix	trans	-80.1	-37.9	179.5	-75	176.8	0	0	0	112.1	R8 L30 C34 V35 P47	R8-L38 VanDerWaalsContact NH1-CG 3.29Å; L30-L38 HydrophobicContact CD1-CD1 3.98Å; L30-L38 HydrophobicContact CD2-CD1 4.44Å; C34-L38 WeakPolarHBondContact O-CB 3.43Å; C34-L38 WeakPolarHBondContact O-CG 3.28Å; C34-L38 PolarHBondContact O-N 2.99Å; V35-L38 PolarHBondContact O-N 3.24Å; L38-P47 HydrophobicContact CD1-CG 4.14Å
39	F	91.1	Very high	90.6	Very high	1 Å²	1	58.8 Å²	58.8	0%	0.004	33%	0.33	C	S	.	.			trans	-106.3	30.9	-171.4	-59	-89.1	0	0	0	112.2	L30 V35 R41 G42 L53 K55 F58	L30-F39 HydrophobicContact CD1-CE2 3.92Å; V35-F39 HydrophobicContact CG1-CD2 4.02Å; V35-F39 WeakPolarHBondContact O-CB 3.3Å; V35-F39 WeakPolarHBondContact O-CD2 3.27Å; V35-F39 PolarHBondContact O-N 3.32Å; F39-R41 PolarHBondContact O-N 3.47Å; F39-G42 WeakPolarHBondContact O-CA 3.38Å; F39-G42 PolarHBondContact O-N 2.94Å; F39-L53 HydrophobicContact CE1-CB 3.77Å; F39-L53 HydrophobicContact CZ-CB 4.09Å; F39-L53 HydrophobicContact CZ-CD1 4.29Å; F39-K55 HydrophobicContact CB-CB 3.92Å; F39-K55 HydrophobicContact CB-CD 4.43Å; F39-K55 HydrophobicContact CB-CG 4.12Å; F39-F58 HydrophobicContact CD1-CE2 4.13Å; F39-F58 AromaticContact CD2-CE2 3.7Å; F39-F58 HydrophobicContact CD2-CE2 3.7Å; F39-F58 AromaticContact CD2-CZ 3.94Å; F39-F58 HydrophobicContact CD2-CZ 3.94Å; F39-F58 AromaticContact CE1-CE2 3.96Å; F39-F58 HydrophobicContact CE1-CE2 3.96Å; F39-F58 HydrophobicContact CE1-CZ 4.19Å; F39-F58 HydrophobicContact CE2-CE1 4.38Å; F39-F58 AromaticContact CE2-CE2 3.54Å; F39-F58 HydrophobicContact CE2-CE2 3.54Å; F39-F58 AromaticContact CE2-CZ 3.32Å; F39-F58 HydrophobicContact CE2-CZ 3.32Å; F39-F58 HydrophobicContact CG-CE2 4.03Å; F39-F58 AromaticContact CZ-CE2 3.69Å; F39-F58 HydrophobicContact CZ-CE2 3.69Å; F39-F58 AromaticContact CZ-CZ 3.48Å; F39-F58 HydrophobicContact CZ-CZ 3.48Å; F39-F58 VanDerWaalsContact CZ-CZ 3.48Å
40	V	89.1	Confident	90.5	Very high	110 Å²	110	59.7 Å²	59.7	67%	0.667	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-39.2	177	-179.7	0	0	0	0	111.5	D36 L37 G42	D36-V40 WeakPolarHBondContact O-CG2 3.22Å; D36-V40 PolarHBondContact O-N 2.8Å; L37-V40 WeakPolarHBondContact O-CG2 3.45Å; V40-G42 PolarHBondContact O-N 3.46Å
41	R	89.9	Confident	90.4	Very high	245 Å²	245	62 Å²	62	93%	0.925	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	7	176.1	-65.3	-173.3	177.8	125.5	-1.8	113.8	F39 A43	F39-R41 PolarHBondContact O-N 3.47Å; R41-A43 PolarHBondContact O-N 3.4Å
42	G	88.3	Confident	90.4	Very high	35 Å²	35	66.9 Å²	66.9	36%	0.361	39%	0.389	S	S	.	.	S	Bend	trans	84.4	-26.8	178.9	0	0	0	0	0	115.1	F39 V40 K55	F39-G42 WeakPolarHBondContact O-CA 3.38Å; F39-G42 PolarHBondContact O-N 2.94Å; V40-G42 PolarHBondContact O-N 3.46Å; G42-K55 WeakPolarHBondContact O-CB 3.47Å; G42-K55 PolarHBondContact O-N 2.84Å
43	A	90	Very high	90.4	Very high	57 Å²	57	63.8 Å²	63.8	47%	0.471	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	154.1	173.4	0	0	0	0	0	110.9	R41 L53 R54	R41-A43 PolarHBondContact O-N 3.4Å; A43-L53 WeakPolarHBondContact CA-O 3.4Å; A43-R54 HydrophobicContact CB-CG 4.42Å
44	G	91.1	Very high	90.4	Very high	20 Å²	20	68.2 Å²	68.2	21%	0.206	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.5	-178.7	-178.9	0	0	0	0	0	110.8	L53	G44-L53 PolarHBondContact N-O 2.88Å; G44-L53 PolarHBondContact O-N 3.12Å
45	N	92.7	Very high	90.3	Very high	105 Å²	105	71.9 Å²	71.9	56%	0.561	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98	144.2	177.8	-63.1	87.5	0	0	0	110.4	G50 T51	N45-G50 PolarHBondContact ND2-O 3.38Å; N45-T51 WeakPolarHBondContact CA-O 3.39Å
46	C	91.5	Very high	90.2	Very high	5 Å²	5	76.5 Å²	76.5	3%	0.034	43%	0.428	C	S	.	.			trans	-58.5	130.1	169.9	-176.5	0	0	0	0	109.5	C26 H28 E48 C49 G50 T51 L53	C26-C46 VanDerWaalsContact SG-SG 3.63Å; H28-C46 PolarHBondContact ND1-SG 3.26Å; C46-E48 PolarHBondContact O-N 3.45Å; C46-C49 VanDerWaalsContact CB-SG 3.57Å; C46-G50 WeakPolarHBondContact O-CA 3.38Å; C46-G50 PolarHBondContact O-N 2.79Å; C46-T51 PolarHBondContact N-O 3.43Å; C46-L53 HydrophobicContact CB-CD1 3.63Å; C46-L53 HydrophobicContact CB-CG 4.1Å
47	P	89.3	Confident	90.1	Very high	75 Å²	75	77 Å²	77	49%	0.487	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-19.5	179.9	26.2	-33.8	0	0	0	113.7	L30 L38	L30-P47 HydrophobicContact CD1-CG 4.33Å; L30-P47 HydrophobicContact CD2-CG 3.98Å; L38-P47 HydrophobicContact CD1-CG 4.14Å
48	E	88.2	Confident	90.1	Very high	98 Å²	98	72.6 Å²	72.6	46%	0.458	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-47.4	-177.8	-70.4	-175.7	-172.9	0	0	113.4	P7 H28 C46	P7-E48 WeakPolarHBondContact CB-OE1 3.33Å; P7-E48 WeakPolarHBondContact CG-OE1 3.44Å; H28-E48 HydrophobicContact CB-CB 4.41Å; H28-E48 WeakPolarHBondContact CB-OE2 3.37Å; H28-E48 IonicContact CD2-OE2 3.16Å; H28-E48 PolarHBondContact CD2-OE2 2.87Å; H28-E48 IonicContact CE1-OE2 2.67Å; H28-E48 IonicContact CG-OE2 2.82Å; H28-E48 WeakPolarHBondContact ND1-CB 3.36Å; H28-E48 IonicContact ND1-OE2 3.44Å; H28-E48 IonicContact NE2-OE2 3.05Å; H28-E48 PolarHBondContact NE2-OE2 3.34Å; C46-E48 PolarHBondContact O-N 3.45Å
49	C	89.6	Confident	90.1	Very high	58 Å²	58	72 Å²	72	39%	0.392	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	-2.6	-179.6	55.5	0	0	0	0	115.2	C26 H28 C46 T51	C26-C49 WeakPolarHBondContact CB-SG 3.5Å; H28-C49 VanDerWaalsContact CE1-CB 3.46Å; H28-C49 WeakPolarHBondContact CE1-CB 3.47Å; H28-C49 VanDerWaalsContact CE1-SG 3.51Å; H28-C49 PolarHBondContact ND1-SG 3.17Å; C46-C49 VanDerWaalsContact CB-SG 3.57Å; C49-T51 PolarHBondContact O-N 2.87Å; C49-T51 PolarHBondContact SG-OG1 3.32Å
50	G	88.2	Confident	90.1	Very high	39 Å²	39	75.4 Å²	75.4	40%	0.402	42%	0.42	S	S	.	.			trans	70	-1.2	-176.6	0	0	0	0	0	115.5	N45 C46	N45-G50 PolarHBondContact ND2-O 3.38Å; C46-G50 WeakPolarHBondContact O-CA 3.38Å; C46-G50 PolarHBondContact O-N 2.79Å
51	T	89.5	Confident	90	Very high	51 Å²	51	71.3 Å²	71.3	31%	0.313	39%	0.394	S	S	.	.			trans	-56.9	132.2	179.1	-62	0	0	0	0	110.1	N45 C46 C49 L53	N45-T51 WeakPolarHBondContact CA-O 3.39Å; C46-T51 PolarHBondContact N-O 3.43Å; C49-T51 PolarHBondContact O-N 2.87Å; C49-T51 PolarHBondContact SG-OG1 3.32Å; T51-L53 HydrophobicContact CG2-CD2 3.99Å; T51-L53 WeakPolarHBondContact O-CG 3.5Å; T51-L53 PolarHBondContact O-N 3.41Å
52	P	91.4	Very high	89.9	Confident	105 Å²	105	65.8 Å²	65.8	68%	0.682	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.5	117.7	175.8	27.3	-33.6	0	0	0	110.2
53	L	91.7	Very high	89.9	Confident	4 Å²	4	68.5 Å²	68.5	2%	0.021	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	142.6	-178.6	-58.6	-178.2	0	0	0	110.7	N24 V25 F39 A43 G44 C46 T51 F58	N24-L53 HydrophobicContact CB-CD1 3.84Å; N24-L53 HydrophobicContact CB-CD2 4.04Å; N24-L53 HydrophobicContact CB-CG 4.47Å; V25-L53 HydrophobicContact CG2-CD2 3.65Å; F39-L53 HydrophobicContact CE1-CB 3.77Å; F39-L53 HydrophobicContact CZ-CB 4.09Å; F39-L53 HydrophobicContact CZ-CD1 4.29Å; A43-L53 WeakPolarHBondContact CA-O 3.4Å; G44-L53 PolarHBondContact N-O 2.88Å; G44-L53 PolarHBondContact O-N 3.12Å; C46-L53 HydrophobicContact CB-CD1 3.63Å; C46-L53 HydrophobicContact CB-CG 4.1Å; T51-L53 HydrophobicContact CG2-CD2 3.99Å; T51-L53 WeakPolarHBondContact O-CG 3.5Å; T51-L53 PolarHBondContact O-N 3.41Å; L53-F58 HydrophobicContact CB-CE2 4.1Å; L53-F58 HydrophobicContact CB-CZ 4.17Å; L53-F58 HydrophobicContact CD1-CE1 4.18Å; L53-F58 HydrophobicContact CD1-CE2 4.33Å; L53-F58 HydrophobicContact CD1-CZ 3.58Å
54	R	91.9	Very high	89.7	Confident	166 Å²	166	73.1 Å²	73.1	63%	0.626	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.6	143.3	170.4	-66.2	-176.3	178.8	-135.7	0.3	110	N24 A43 S56 N57 F58	N24-R54 PolarHBondContact ND2-O 3.16Å; A43-R54 HydrophobicContact CB-CG 4.42Å; R54-S56 VanDerWaalsContact C-N 3.26Å; R54-S56 PolarHBondContact O-N 3.38Å; R54-N57 PolarHBondContact O-N 3.43Å; R54-N57 VanDerWaalsContact O-N 3.09Å; R54-F58 WeakPolarHBondContact O-CD2 3.5Å
55	K	89.3	Confident	89.5	Confident	83 Å²	83	75.6 Å²	75.6	36%	0.361	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-56.3	-40.6	177.8	-168.3	178.5	178.1	177.6	0	112	V35 D36 F39 G42 N57 F58	V35-K55 HydrophobicContact CG1-CG 4.38Å; D36-K55 WeakPolarHBondContact OD1-CE 3.38Å; D36-K55 IonicContact OD1-NZ 3.39Å; D36-K55 PolarHBondContact OD1-NZ 3.13Å; F39-K55 HydrophobicContact CB-CB 3.92Å; F39-K55 HydrophobicContact CB-CD 4.43Å; F39-K55 HydrophobicContact CB-CG 4.12Å; G42-K55 WeakPolarHBondContact O-CB 3.47Å; G42-K55 PolarHBondContact O-N 2.84Å; K55-N57 PolarHBondContact O-N 3.08Å; K55-F58 PolarHBondContact O-N 3.3Å
56	S	89	Confident	89.2	Confident	100 Å²	100	72 Å²	72	70%	0.699	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-63.6	-20	179.4	60	0	0	0	0	114.8	R54	R54-S56 VanDerWaalsContact C-N 3.26Å; R54-S56 PolarHBondContact O-N 3.38Å
57	N	90.1	Very high	89.1	Confident	80 Å²	80	75.6 Å²	75.6	43%	0.428	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-95.6	-2.5	-174.5	-64.3	-0.2	0	0	0	112.5	N24 R54 K55	N24-N57 PolarHBondContact OD1-O 3.08Å; R54-N57 PolarHBondContact O-N 3.43Å; R54-N57 VanDerWaalsContact O-N 3.09Å; K55-N57 PolarHBondContact O-N 3.08Å
58	F	91.3	Very high	89.1	Confident	24 Å²	24	74.3 Å²	74.3	11%	0.105	40%	0.399	C	S	.	.			trans	-73.2	135.4	170	-76.4	-87	0	0	0	109.7	M22 N24 L30 V35 F39 L53 R54 K55	M22-F58 HydrophobicContact CB-CB 4.34Å; M22-F58 HydrophobicContact CB-CD1 4.19Å; M22-F58 HydrophobicContact SD-CB 4.24Å; N24-F58 HydrophobicContact CB-CD1 3.87Å; N24-F58 HydrophobicContact CB-CE1 3.77Å; N24-F58 HydrophobicContact CB-CG 4.36Å; N24-F58 HydrophobicContact CB-CZ 4.18Å; N24-F58 WeakPolarHBondContact ND2-CD2 3.3Å; N24-F58 WeakPolarHBondContact ND2-CE2 3.43Å; N24-F58 WeakPolarHBondContact ND2-CG 3.29Å; N24-F58 WeakPolarHBondContact ND2-CZ 3.23Å; L30-F58 HydrophobicContact CD1-CE1 4.04Å; L30-F58 HydrophobicContact CD1-CZ 4.19Å; V35-F58 HydrophobicContact CG1-CB 4.26Å; V35-F58 HydrophobicContact CG1-CD1 4.25Å; V35-F58 HydrophobicContact CG1-CD2 3.7Å; V35-F58 HydrophobicContact CG1-CE2 4.05Å; V35-F58 HydrophobicContact CG1-CG 3.8Å; V35-F58 HydrophobicContact CG1-CZ 4.48Å; V35-F58 HydrophobicContact CG2-CD1 3.78Å; V35-F58 HydrophobicContact CG2-CE1 3.92Å; V35-F58 HydrophobicContact CG2-CG 4.17Å; V35-F58 HydrophobicContact CG2-CZ 4.41Å; F39-F58 HydrophobicContact CD1-CE2 4.13Å; F39-F58 AromaticContact CD2-CE2 3.7Å; F39-F58 HydrophobicContact CD2-CE2 3.7Å; F39-F58 AromaticContact CD2-CZ 3.94Å; F39-F58 HydrophobicContact CD2-CZ 3.94Å; F39-F58 AromaticContact CE1-CE2 3.96Å; F39-F58 HydrophobicContact CE1-CE2 3.96Å; F39-F58 HydrophobicContact CE1-CZ 4.19Å; F39-F58 HydrophobicContact CE2-CE1 4.38Å; F39-F58 AromaticContact CE2-CE2 3.54Å; F39-F58 HydrophobicContact CE2-CE2 3.54Å; F39-F58 AromaticContact CE2-CZ 3.32Å; F39-F58 HydrophobicContact CE2-CZ 3.32Å; F39-F58 HydrophobicContact CG-CE2 4.03Å; F39-F58 AromaticContact CZ-CE2 3.69Å; F39-F58 HydrophobicContact CZ-CE2 3.69Å; F39-F58 AromaticContact CZ-CZ 3.48Å; F39-F58 HydrophobicContact CZ-CZ 3.48Å; F39-F58 VanDerWaalsContact CZ-CZ 3.48Å; L53-F58 HydrophobicContact CB-CE2 4.1Å; L53-F58 HydrophobicContact CB-CZ 4.17Å; L53-F58 HydrophobicContact CD1-CE1 4.18Å; L53-F58 HydrophobicContact CD1-CE2 4.33Å; L53-F58 HydrophobicContact CD1-CZ 3.58Å; R54-F58 WeakPolarHBondContact O-CD2 3.5Å; K55-F58 PolarHBondContact O-N 3.3Å
59	R	88.2	Confident	89.2	Confident	51 Å²	51	69.8 Å²	69.8	19%	0.192	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	154.6	178.2	58.7	-178.3	-179.7	-77.4	1.4	109.5	M22 V23 Q61 D69 E73	M22-R59 CarbonylContact C-O 3.59Å; M22-R59 WeakPolarHBondContact CA-O 3.46Å; M22-R59 WeakPolarHBondContact CB-O 3.47Å; V23-R59 PolarHBondContact N-O 3.21Å; V23-R59 WeakPolarHBondContact O-CG 3.3Å; V23-R59 PolarHBondContact O-N 3.21Å; R59-Q61 PolarHBondContact O-N 3.26Å; R59-D69 PolarHBondContact NH2-O 3.28Å; R59-E73 VanDerWaalsContact NH2-CG 3.27Å
60	V	91.4	Very high	89.2	Confident	72 Å²	72	68.2 Å²	68.2	44%	0.436	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	133.9	173.4	-178.6	0	0	0	0	108.8	L62	V60-L62 PolarHBondContact O-N 3.4Å
61	Q	88.3	Confident	89.4	Confident	25 Å²	25	68.9 Å²	68.9	12%	0.117	36%	0.358	C	S	.	.			trans	-65.1	123.7	174	-171.1	-177.8	-14.3	0	0	109.3	L21 V23 R59 F63 E64 D69	L21-Q61 HydrophobicContact CB-CB 4.17Å; L21-Q61 VanDerWaalsContact CB-OE1 3.26Å; L21-Q61 WeakPolarHBondContact O-CB 3.24Å; L21-Q61 PolarHBondContact O-N 3.38Å; V23-Q61 HydrophobicContact CG2-CB 3.89Å; V23-Q61 HydrophobicContact CG2-CG 3.83Å; R59-Q61 PolarHBondContact O-N 3.26Å; Q61-F63 WeakPolarHBondContact CG-O 3.28Å; Q61-F63 PolarHBondContact NE2-O 3.41Å; Q61-E64 PolarHBondContact NE2-O 3.23Å; Q61-D69 VanDerWaalsContact CG-OD2 3.23Å; Q61-D69 WeakPolarHBondContact CG-OD2 3.43Å
62	L	87.5	Confident	89.6	Confident	128 Å²	128	68.1 Å²	68.1	67%	0.67	35%	0.353	S	S	*	.			trans	-97.4	-31.2	-178.7	-63.5	179.8	0	0	0	112	V60 D69	V60-L62 PolarHBondContact O-N 3.4Å; L62-D69 PolarHBondContact N-OD1 3.33Å; L62-D69 PolarHBondContact N-OD2 3Å; L62-D69 VanDerWaalsContact N-OD2 3.08Å
63	F	88.1	Confident	89.5	Confident	93 Å²	93	65.4 Å²	65.4	41%	0.408	33%	0.331	S	S	.	.	S	Bend	trans	-106.4	157.8	-177.1	-61.5	-80.6	0	0	0	111	Q61 D65 V68 D69 V72	Q61-F63 WeakPolarHBondContact CG-O 3.28Å; Q61-F63 PolarHBondContact NE2-O 3.41Å; F63-D65 VanDerWaalsContact C-N 3.31Å; F63-V68 HydrophobicContact CB-CB 4.17Å; F63-V68 HydrophobicContact CB-CG1 4.09Å; F63-V68 HydrophobicContact CD1-CG1 3.98Å; F63-V68 HydrophobicContact CD2-CG1 3.87Å; F63-V68 HydrophobicContact CE1-CG1 4.4Å; F63-V68 HydrophobicContact CE2-CG1 4.31Å; F63-V68 HydrophobicContact CG-CB 4.31Å; F63-V68 HydrophobicContact CG-CG1 3.69Å; F63-D69 PolarHBondContact N-OD2 2.98Å; F63-V72 HydrophobicContact CE2-CB 4.42Å; F63-V72 HydrophobicContact CE2-CG2 3.82Å; F63-V72 HydrophobicContact CZ-CG2 4.22Å
64	E	85.8	Confident	89.6	Confident	153 Å²	153	66.2 Å²	66.2	72%	0.715	34%	0.335	S	S	*	.	S	Bend	trans	-63	-42.1	174.4	-70.1	-177	-177.7	0	0	111	Q4 Q61 P66	Q4-E64 VanDerWaalsContact NE2-C 3.31Å; Q4-E64 PolarHBondContact NE2-O 3.35Å; Q4-E64 PolarHBondContact OE1-O 3.25Å; Q4-E64 VanDerWaalsContact OE1-O 3.14Å; Q61-E64 PolarHBondContact NE2-O 3.23Å; E64-P66 WeakPolarHBondContact O-CD 3.3Å
65	D	86.5	Confident	89.7	Confident	73 Å²	73	61.5 Å²	61.5	39%	0.39	32%	0.317	S	S	.	.	S	Bend	trans	-88.4	120.5	177.8	-167.7	-22	0	0	0	111.5	F63 T67 V68 D69	F63-D65 VanDerWaalsContact C-N 3.31Å; D65-T67 PolarHBondContact O-N 2.95Å; D65-T67 WeakPolarHBondContact OD1-CB 3.33Å; D65-T67 WeakPolarHBondContact OD1-CG2 3.3Å; D65-T67 PolarHBondContact OD1-N 3.09Å; D65-T67 PolarHBondContact OD1-OG1 2.93Å; D65-T67 PolarHBondContact OD2-OG1 3.37Å; D65-V68 HydrophobicContact CB-CB 4.36Å; D65-V68 HydrophobicContact CB-CG2 3.87Å; D65-V68 PolarHBondContact O-N 3.15Å; D65-D69 PolarHBondContact O-N 2.94Å
66	P	87	Confident	89.9	Confident	30 Å²	30	62 Å²	62	20%	0.195	32%	0.32	C	S	.	.	H	α-helix	trans	-61.3	-24.3	174.9	-22.3	35	0	0	0	114.1	V23 G27 T29 E64 D69 K70	V23-P66 HydrophobicContact CG2-CB 4.32Å; G27-P66 WeakPolarHBondContact O-CB 3.49Å; T29-P66 HydrophobicContact CG2-CB 3.75Å; T29-P66 HydrophobicContact CG2-CG 3.37Å; E64-P66 WeakPolarHBondContact O-CD 3.3Å; P66-D69 PolarHBondContact O-N 2.92Å; P66-K70 PolarHBondContact O-N 3.32Å
67	T	87.9	Confident	90	Very high	80 Å²	80	62.4 Å²	62.4	49%	0.491	31%	0.309	S	S	.	.	H	α-helix	trans	-69.3	-37.4	177	68.3	0	0	0	0	111.3	D65 K70 E71	D65-T67 PolarHBondContact O-N 2.95Å; D65-T67 WeakPolarHBondContact OD1-CB 3.33Å; D65-T67 WeakPolarHBondContact OD1-CG2 3.3Å; D65-T67 PolarHBondContact OD1-N 3.09Å; D65-T67 PolarHBondContact OD1-OG1 2.93Å; D65-T67 PolarHBondContact OD2-OG1 3.37Å; T67-K70 WeakPolarHBondContact O-CA 3.47Å; T67-K70 WeakPolarHBondContact O-CB 3.16Å; T67-K70 PolarHBondContact O-N 2.88Å; T67-K70 VanDerWaalsContact O-N 3.11Å; T67-E71 PolarHBondContact O-N 2.77Å
68	V	91	Very high	90.2	Very high	47 Å²	47	58.6 Å²	58.6	29%	0.285	29%	0.288	S	S	.	.	H	α-helix	trans	-65	-42.2	173.5	177.4	0	0	0	0	110.3	F63 D65 K70 E71 V72	F63-V68 HydrophobicContact CB-CB 4.17Å; F63-V68 HydrophobicContact CB-CG1 4.09Å; F63-V68 HydrophobicContact CD1-CG1 3.98Å; F63-V68 HydrophobicContact CD2-CG1 3.87Å; F63-V68 HydrophobicContact CE1-CG1 4.4Å; F63-V68 HydrophobicContact CE2-CG1 4.31Å; F63-V68 HydrophobicContact CG-CB 4.31Å; F63-V68 HydrophobicContact CG-CG1 3.69Å; D65-V68 HydrophobicContact CB-CB 4.36Å; D65-V68 HydrophobicContact CB-CG2 3.87Å; D65-V68 PolarHBondContact O-N 3.15Å; V68-K70 PolarHBondContact O-N 3.43Å; V68-E71 PolarHBondContact O-N 3.16Å; V68-V72 HydrophobicContact CG1-CG2 4.26Å; V68-V72 WeakPolarHBondContact O-CB 3.29Å; V68-V72 VanDerWaalsContact O-CG2 3.29Å; V68-V72 WeakPolarHBondContact O-CG2 3.28Å; V68-V72 PolarHBondContact O-N 3.43Å
69	D	89.6	Confident	90.3	Very high	3 Å²	3	61.6 Å²	61.6	2%	0.016	31%	0.305	C	S	.	.	H	α-helix	trans	-61.1	-31.2	172.8	-96.3	-71.3	0	0	0	112.9	V23 R59 Q61 L62 F63 D65 P66	V23-D69 HydrophobicContact CG1-CB 4.29Å; R59-D69 PolarHBondContact NH2-O 3.28Å; Q61-D69 VanDerWaalsContact CG-OD2 3.23Å; Q61-D69 WeakPolarHBondContact CG-OD2 3.43Å; L62-D69 PolarHBondContact N-OD1 3.33Å; L62-D69 PolarHBondContact N-OD2 3Å; L62-D69 VanDerWaalsContact N-OD2 3.08Å; F63-D69 PolarHBondContact N-OD2 2.98Å; D65-D69 PolarHBondContact O-N 2.94Å; P66-D69 PolarHBondContact O-N 2.92Å
70	K	89.3	Confident	90.4	Very high	26 Å²	26	66.6 Å²	66.6	11%	0.113	33%	0.328	C	S	.	.	H	α-helix	trans	-71.9	-48.7	173.8	-173.5	-169.1	175.9	-167.3	0	110.7	P66 T67 V68 E73 I74 T110	P66-K70 PolarHBondContact O-N 3.32Å; T67-K70 WeakPolarHBondContact O-CA 3.47Å; T67-K70 WeakPolarHBondContact O-CB 3.16Å; T67-K70 PolarHBondContact O-N 2.88Å; T67-K70 VanDerWaalsContact O-N 3.11Å; V68-K70 PolarHBondContact O-N 3.43Å; K70-E73 PolarHBondContact O-N 3.14Å; K70-I74 HydrophobicContact CD-CD1 4.49Å; K70-I74 HydrophobicContact CG-CD1 3.98Å; K70-I74 WeakPolarHBondContact O-CG1 3.4Å; K70-I74 PolarHBondContact O-N 2.98Å; K70-T110 PolarHBondContact NZ-O 3.3Å
71	E	93.1	Very high	90.3	Very high	53 Å²	53	64.4 Å²	64.4	25%	0.248	31%	0.314	C	S	.	.	H	α-helix	trans	-57.8	-49.5	178.8	-173.2	-166	140.7	0	0	111.4	T67 V68 E73 I74 R75 V106 T110	T67-E71 PolarHBondContact O-N 2.77Å; V68-E71 PolarHBondContact O-N 3.16Å; E71-E73 VanDerWaalsContact C-N 3.27Å; E71-E73 PolarHBondContact O-N 2.96Å; E71-I74 CarbonylContact O-C 3.51Å; E71-I74 PolarHBondContact O-N 2.94Å; E71-I74 VanDerWaalsContact O-N 3.07Å; E71-R75 WeakPolarHBondContact O-CB 3.39Å; E71-R75 PolarHBondContact O-N 3.21Å; E71-R75 IonicContact OE1-CZ 3.72Å; E71-R75 IonicContact OE1-NH1 2.87Å; E71-R75 PolarHBondContact OE1-NH1 2.89Å; E71-R75 IonicContact OE1-NH2 3.7Å; E71-R75 PolarHBondContact OE1-NH2 3.39Å; E71-V106 HydrophobicContact CG-CG1 4Å; E71-T110 HydrophobicContact CB-CG2 3.93Å; E71-T110 HydrophobicContact CG-CG2 4.31Å
72	V	92.6	Very high	90.4	Very high	34 Å²	34	63.5 Å²	63.5	21%	0.206	31%	0.309	C	S	.	.	H	α-helix	trans	-58	-39.6	-179.3	167.7	0	0	0	0	111.8	F63 V68 K76	F63-V72 HydrophobicContact CE2-CB 4.42Å; F63-V72 HydrophobicContact CE2-CG2 3.82Å; F63-V72 HydrophobicContact CZ-CG2 4.22Å; V68-V72 HydrophobicContact CG1-CG2 4.26Å; V68-V72 WeakPolarHBondContact O-CB 3.29Å; V68-V72 VanDerWaalsContact O-CG2 3.29Å; V68-V72 WeakPolarHBondContact O-CG2 3.28Å; V68-V72 PolarHBondContact O-N 3.43Å; V72-K76 HydrophobicContact CG1-CD 4.31Å; V72-K76 WeakPolarHBondContact O-CB 3.27Å; V72-K76 VanDerWaalsContact O-CG 3.28Å; V72-K76 WeakPolarHBondContact O-CG 3.24Å; V72-K76 PolarHBondContact O-N 3.22Å
73	E	90.4	Very high	90.5	Very high	48 Å²	48	58.8 Å²	58.8	22%	0.224	29%	0.285	C	S	.	.	H	α-helix	trans	-72.3	-36.7	176.7	-76.7	-53.4	127	0	0	113.5	R59 K70 E71 K76 K77	R59-E73 VanDerWaalsContact NH2-CG 3.27Å; K70-E73 PolarHBondContact O-N 3.14Å; E71-E73 VanDerWaalsContact C-N 3.27Å; E71-E73 PolarHBondContact O-N 2.96Å; E73-K76 WeakPolarHBondContact OE1-CD 3.38Å; E73-K76 IonicContact OE1-NZ 3.59Å; E73-K76 PolarHBondContact OE1-NZ 3.31Å; E73-K77 WeakPolarHBondContact O-CG 3.22Å; E73-K77 PolarHBondContact O-N 2.84Å; E73-K77 VanDerWaalsContact O-N 3.1Å
74	I	92.5	Very high	90.6	Very high	22 Å²	22	56.9 Å²	56.9	11%	0.113	28%	0.276	C	S	.	.	H	α-helix	trans	-63.4	-49	173.4	-71.5	170.6	0	0	0	109.1	K70 E71 K76 K77 V78 V106 L109	K70-I74 HydrophobicContact CD-CD1 4.49Å; K70-I74 HydrophobicContact CG-CD1 3.98Å; K70-I74 WeakPolarHBondContact O-CG1 3.4Å; K70-I74 PolarHBondContact O-N 2.98Å; E71-I74 CarbonylContact O-C 3.51Å; E71-I74 PolarHBondContact O-N 2.94Å; E71-I74 VanDerWaalsContact O-N 3.07Å; I74-K76 PolarHBondContact O-N 3.1Å; I74-K77 WeakPolarHBondContact O-CA 3.47Å; I74-K77 WeakPolarHBondContact O-CB 3.33Å; I74-K77 PolarHBondContact O-N 3.5Å; I74-V78 HydrophobicContact CG2-CG2 4.19Å; I74-V78 WeakPolarHBondContact O-CG2 3.26Å; I74-V78 PolarHBondContact O-N 3.25Å; I74-V106 HydrophobicContact CG2-CG1 4.41Å; I74-L109 HydrophobicContact CD1-CB 4.23Å; I74-L109 HydrophobicContact CG2-CB 3.54Å; I74-L109 HydrophobicContact CG2-CD1 3.79Å; I74-L109 HydrophobicContact CG2-CG 4.35Å
75	R	95	Very high	90.6	Very high	67 Å²	67	53.8 Å²	53.8	25%	0.253	26%	0.258	S	S	.	.	H	α-helix	trans	-56.4	-46.4	176.2	-173	173.8	-75.7	121.1	1	111.6	E71 K77 V78 L79 E103 V106	E71-R75 WeakPolarHBondContact O-CB 3.39Å; E71-R75 PolarHBondContact O-N 3.21Å; E71-R75 IonicContact OE1-CZ 3.72Å; E71-R75 IonicContact OE1-NH1 2.87Å; E71-R75 PolarHBondContact OE1-NH1 2.89Å; E71-R75 IonicContact OE1-NH2 3.7Å; E71-R75 PolarHBondContact OE1-NH2 3.39Å; R75-K77 VanDerWaalsContact C-N 3.28Å; R75-K77 PolarHBondContact O-N 3.5Å; R75-V78 PolarHBondContact O-N 3.03Å; R75-L79 HydrophobicContact CG-CD1 3.79Å; R75-L79 HydrophobicContact CG-CG 4.14Å; R75-L79 WeakPolarHBondContact O-CB 3.26Å; R75-L79 VanDerWaalsContact O-CG 3.28Å; R75-L79 WeakPolarHBondContact O-CG 3.23Å; R75-L79 PolarHBondContact O-N 3.46Å; R75-E103 IonicContact CZ-OE2 3.23Å; R75-E103 IonicContact NE-OE2 3Å; R75-E103 IonicContact NH2-OE1 2.81Å; R75-E103 PolarHBondContact NH2-OE1 3.49Å; R75-E103 IonicContact NH2-OE2 3.01Å; R75-E103 PolarHBondContact NH2-OE2 3Å; R75-V106 HydrophobicContact CB-CG1 4.2Å; R75-V106 HydrophobicContact CB-CG2 4.15Å; R75-V106 HydrophobicContact CG-CG2 4.29Å
76	K	92.8	Very high	90.7	Very high	94 Å²	94	55.7 Å²	55.7	41%	0.409	27%	0.265	S	S	.	.	H	α-helix	trans	-57.2	-37.4	173.9	-77.9	169.1	-179.7	164.6	0	113.3	V72 E73 I74 K80	V72-K76 HydrophobicContact CG1-CD 4.31Å; V72-K76 WeakPolarHBondContact O-CB 3.27Å; V72-K76 VanDerWaalsContact O-CG 3.28Å; V72-K76 WeakPolarHBondContact O-CG 3.24Å; V72-K76 PolarHBondContact O-N 3.22Å; E73-K76 WeakPolarHBondContact OE1-CD 3.38Å; E73-K76 IonicContact OE1-NZ 3.59Å; E73-K76 PolarHBondContact OE1-NZ 3.31Å; I74-K76 PolarHBondContact O-N 3.1Å; K76-K80 VanDerWaalsContact O-CG 3.3Å; K76-K80 WeakPolarHBondContact O-CG 3.44Å; K76-K80 PolarHBondContact O-N 2.95Å
77	K	91.8	Very high	90.7	Very high	107 Å²	107	60.2 Å²	60.2	47%	0.465	28%	0.283	S	S	.	.	H	α-helix	trans	-73.8	-42.4	177.3	-72.2	171	-175.9	173.2	0	111.8	E73 I74 R75 K80	E73-K77 WeakPolarHBondContact O-CG 3.22Å; E73-K77 PolarHBondContact O-N 2.84Å; E73-K77 VanDerWaalsContact O-N 3.1Å; I74-K77 WeakPolarHBondContact O-CA 3.47Å; I74-K77 WeakPolarHBondContact O-CB 3.33Å; I74-K77 PolarHBondContact O-N 3.5Å; R75-K77 VanDerWaalsContact C-N 3.28Å; R75-K77 PolarHBondContact O-N 3.5Å; K77-K80 PolarHBondContact O-N 2.97Å
78	V	93.6	Very high	90.7	Very high	1 Å²	1	59.9 Å²	59.9	1%	0.006	28%	0.278	C	S	.	.	H	α-helix	trans	-63	-48.6	177.5	176.5	0	0	0	0	109.7	I74 R75 K80 I81 Y82 V102 I105 V106 L109 M122	I74-V78 HydrophobicContact CG2-CG2 4.19Å; I74-V78 WeakPolarHBondContact O-CG2 3.26Å; I74-V78 PolarHBondContact O-N 3.25Å; R75-V78 PolarHBondContact O-N 3.03Å; V78-K80 PolarHBondContact O-N 3.05Å; V78-I81 CarbonylContact O-C 3.42Å; V78-I81 WeakPolarHBondContact O-CA 3.24Å; V78-I81 WeakPolarHBondContact O-CB 3.15Å; V78-I81 PolarHBondContact O-N 2.87Å; V78-Y82 HydrophobicContact CG1-CD2 3.72Å; V78-Y82 HydrophobicContact CG1-CE2 4.36Å; V78-Y82 HydrophobicContact CG1-CG 4.23Å; V78-Y82 PolarHBondContact O-N 3.43Å; V78-V102 HydrophobicContact CG1-CG1 3.92Å; V78-I105 HydrophobicContact CG1-CG2 4.02Å; V78-I105 HydrophobicContact CG2-CG2 3.92Å; V78-V106 HydrophobicContact CB-CG2 4.06Å; V78-V106 HydrophobicContact CG1-CG2 4.19Å; V78-V106 HydrophobicContact CG2-CG2 4.01Å; V78-L109 HydrophobicContact CG2-CD1 3.83Å; V78-M122 HydrophobicContact CG2-CE 3.93Å; V78-M122 HydrophobicContact CG2-SD 4.45Å
79	L	93.1	Very high	90.7	Very high	86 Å²	86	59.4 Å²	59.4	45%	0.45	27%	0.273	S	S	.	.	H	α-helix	trans	-63.1	-23.3	179	-69.7	175.5	0	0	0	114.1	R75 I81 Y82 N83 V102	R75-L79 HydrophobicContact CG-CD1 3.79Å; R75-L79 HydrophobicContact CG-CG 4.14Å; R75-L79 WeakPolarHBondContact O-CB 3.26Å; R75-L79 VanDerWaalsContact O-CG 3.28Å; R75-L79 WeakPolarHBondContact O-CG 3.23Å; R75-L79 PolarHBondContact O-N 3.46Å; L79-I81 PolarHBondContact O-N 3.05Å; L79-Y82 CarbonylContact O-C 3.52Å; L79-N83 WeakPolarHBondContact O-CB 3.26Å; L79-V102 HydrophobicContact CD2-CG1 4.27Å
80	K	90.2	Very high	90.8	Very high	156 Å²	156	64.8 Å²	64.8	68%	0.678	31%	0.307	S	S	*	.	H	α-helix	trans	-67.8	-26.2	171	-77.2	172.1	-173.9	-177.5	0	112.8	K76 K77 V78	K76-K80 VanDerWaalsContact O-CG 3.3Å; K76-K80 WeakPolarHBondContact O-CG 3.44Å; K76-K80 PolarHBondContact O-N 2.95Å; K77-K80 PolarHBondContact O-N 2.97Å; V78-K80 PolarHBondContact O-N 3.05Å
81	I	89.5	Confident	91	Very high	27 Å²	27	65.8 Å²	65.8	14%	0.138	32%	0.318	C	S	.	.	H	α-helix	trans	-96.3	-44.6	178.3	-62	165.3	0	0	0	109.5	V78 L79 N83 M122 Y125 Q126 I133	V78-I81 CarbonylContact O-C 3.42Å; V78-I81 WeakPolarHBondContact O-CA 3.24Å; V78-I81 WeakPolarHBondContact O-CB 3.15Å; V78-I81 PolarHBondContact O-N 2.87Å; L79-I81 PolarHBondContact O-N 3.05Å; I81-N83 PolarHBondContact O-N 2.81Å; I81-M122 HydrophobicContact CD1-CE 3.58Å; I81-Y125 HydrophobicContact CG2-CD1 3.95Å; I81-Y125 HydrophobicContact CG2-CE1 4.42Å; I81-Q126 HydrophobicContact CG2-CB 3.93Å; I81-Q126 HydrophobicContact CG2-CG 4.29Å; I81-I133 HydrophobicContact CG2-CD1 4.22Å; I81-I133 WeakPolarHBondContact O-CD1 3.44Å; I81-I133 VanDerWaalsContact O-CG1 3.25Å; I81-I133 WeakPolarHBondContact O-CG1 3.49Å
82	Y	90.9	Very high	91.1	Very high	5 Å²	5	67.9 Å²	67.9	2%	0.02	33%	0.33	C	S	.	.			trans	-93.3	68.5	178.5	-71.3	-101.8	0	0	0	109.7	V78 L79 F98 V102 I105 M122 Y125	V78-Y82 HydrophobicContact CG1-CD2 3.72Å; V78-Y82 HydrophobicContact CG1-CE2 4.36Å; V78-Y82 HydrophobicContact CG1-CG 4.23Å; V78-Y82 PolarHBondContact O-N 3.43Å; L79-Y82 CarbonylContact O-C 3.52Å; Y82-F98 AromaticContact CD1-CE2 3.58Å; Y82-F98 HydrophobicContact CD1-CE2 3.58Å; Y82-F98 AromaticContact CD1-CZ 3.92Å; Y82-F98 HydrophobicContact CD1-CZ 3.92Å; Y82-F98 HydrophobicContact CE1-CE2 4.38Å; Y82-F98 HydrophobicContact CG-CE2 4.49Å; Y82-F98 HydrophobicContact CG-CZ 4.43Å; Y82-V102 HydrophobicContact CD1-CG2 3.7Å; Y82-V102 HydrophobicContact CG-CG2 3.9Å; Y82-I105 HydrophobicContact CE1-CD1 3.86Å; Y82-I105 HydrophobicContact CE2-CD1 3.96Å; Y82-I105 VanDerWaalsContact CZ-CD1 3.43Å; Y82-I105 VanDerWaalsContact OH-CD1 3.26Å; Y82-I105 WeakPolarHBondContact OH-CD1 3.49Å; Y82-M122 HydrophobicContact CE2-CG 4.01Å; Y82-Y125 HydrophobicContact CD1-CD1 4.13Å; Y82-Y125 AromaticContact CD1-CE1 3.8Å; Y82-Y125 HydrophobicContact CD1-CE1 3.8Å; Y82-Y125 HydrophobicContact CD1-CE2 4.19Å; Y82-Y125 HydrophobicContact CD1-CG 4.48Å; Y82-Y125 AromaticContact CD1-CZ 3.83Å; Y82-Y125 HydrophobicContact CD2-CD1 4.27Å; Y82-Y125 HydrophobicContact CD2-CE1 4.34Å; Y82-Y125 AromaticContact CE1-CD1 3.79Å; Y82-Y125 HydrophobicContact CE1-CD1 3.79Å; Y82-Y125 AromaticContact CE1-CD2 3.79Å; Y82-Y125 HydrophobicContact CE1-CD2 3.79Å; Y82-Y125 AromaticContact CE1-CE1 3.89Å; Y82-Y125 HydrophobicContact CE1-CE1 3.89Å; Y82-Y125 AromaticContact CE1-CE2 3.88Å; Y82-Y125 HydrophobicContact CE1-CE2 3.88Å; Y82-Y125 AromaticContact CE1-CG 3.75Å; Y82-Y125 HydrophobicContact CE1-CG 3.75Å; Y82-Y125 AromaticContact CE1-CZ 3.94Å; Y82-Y125 AromaticContact CE2-CD1 3.94Å; Y82-Y125 HydrophobicContact CE2-CD1 3.94Å; Y82-Y125 HydrophobicContact CE2-CE1 4.43Å; Y82-Y125 HydrophobicContact CE2-CG 4.33Å; Y82-Y125 HydrophobicContact CG-CD1 4.35Å; Y82-Y125 HydrophobicContact CG-CE1 4.02Å; Y82-Y125 AromaticContact CZ-CD1 3.68Å; Y82-Y125 AromaticContact CZ-CG 3.65Å; Y82-Y125 WeakPolarHBondContact OH-CB 3.32Å
83	N	89.7	Confident	91.2	Very high	30 Å²	30	75.3 Å²	75.3	16%	0.16	36%	0.355	C	S	.	.			trans	-106.7	27	-175.5	69.9	-13.4	0	0	0	113.6	L79 I81 I133 N136	L79-N83 WeakPolarHBondContact O-CB 3.26Å; I81-N83 PolarHBondContact O-N 2.81Å; N83-I133 PolarHBondContact ND2-O 3.06Å; N83-I133 WeakPolarHBondContact OD1-CA 3.24Å; N83-I133 WeakPolarHBondContact OD1-CG1 3.49Å; N83-N136 WeakPolarHBondContact ND2-CB 3.46Å; N83-N136 PolarHBondContact O-ND2 3.08Å
84	K	89.5	Confident	91.3	Very high	52 Å²	52	77.3 Å²	77.3	23%	0.226	36%	0.364	C	S	.	.			trans	-72	142.7	171.6	-68.9	-176.7	177.7	174.3	0	109.8	D88 F89 F98 Y125 N129 V132	K84-D88 WeakPolarHBondContact CA-OD2 3.38Å; K84-D88 HydrophobicContact CB-CB 4.32Å; K84-F89 HydrophobicContact CB-CE2 3.62Å; K84-F89 HydrophobicContact CB-CZ 3.9Å; K84-F89 HydrophobicContact CD-CE1 4.44Å; K84-F89 HydrophobicContact CD-CE2 4.2Å; K84-F89 HydrophobicContact CD-CZ 3.7Å; K84-F89 HydrophobicContact CG-CZ 4.46Å; K84-F98 HydrophobicContact CB-CE1 4.12Å; K84-F98 HydrophobicContact CB-CE2 4.45Å; K84-F98 HydrophobicContact CB-CZ 3.91Å; K84-F98 HydrophobicContact CD-CE2 4.32Å; K84-F98 HydrophobicContact CG-CZ 4.44Å; K84-Y125 VanDerWaalsContact CD-OH 3.26Å; K84-Y125 WeakPolarHBondContact CD-OH 3.38Å; K84-Y125 WeakPolarHBondContact CE-OH 3.43Å; K84-N129 VanDerWaalsContact CE-OD1 3.24Å; K84-N129 WeakPolarHBondContact CE-OD1 3.31Å; K84-N129 PolarHBondContact NZ-OD1 2.99Å; K84-V132 HydrophobicContact CG-CG1 4.48Å
85	R	86.4	Confident	91.4	Very high	89 Å²	89	78.7 Å²	78.7	34%	0.336	37%	0.368	S	S	.	.			trans	-102.6	164.7	177.2	-68	177.1	61.3	159.6	-7.1	109.8	E87 D88 F89 E143	R85-E87 IonicContact CZ-OE1 3.57Å; R85-E87 IonicContact NE-OE1 2.83Å; R85-E87 IonicContact NH2-OE1 3.41Å; R85-E87 PolarHBondContact NH2-OE1 2.9Å; R85-E87 PolarHBondContact O-N 3.33Å; R85-D88 PolarHBondContact N-OD2 3.47Å; R85-D88 WeakPolarHBondContact O-CB 3.34Å; R85-D88 PolarHBondContact O-N 3.01Å; R85-F89 WeakPolarHBondContact O-CD2 3.29Å; R85-E143 IonicContact NH1-OE1 3.71Å; R85-E143 PolarHBondContact NH1-OE1 3.18Å; R85-E143 IonicContact NH1-OE2 3.04Å; R85-E143 PolarHBondContact NH1-OE2 2.95Å
86	E	88.6	Confident	91.4	Very high	112 Å²	112	79.2 Å²	79.2	52%	0.523	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-51.3	-38.6	173.7	-172.4	-179.3	173.4	0	0	112.1	D88 F89 Y95	E86-D88 PolarHBondContact O-N 3.37Å; E86-D88 VanDerWaalsContact O-N 3.17Å; E86-F89 PolarHBondContact O-N 3.2Å; E86-F89 VanDerWaalsContact O-N 3.11Å; E86-Y95 HydrophobicContact CB-CD1 3.94Å; E86-Y95 HydrophobicContact CB-CD2 4.34Å; E86-Y95 HydrophobicContact CB-CE1 3.89Å; E86-Y95 HydrophobicContact CB-CE2 4.32Å; E86-Y95 HydrophobicContact CB-CG 4.16Å; E86-Y95 HydrophobicContact CG-CD1 3.83Å; E86-Y95 HydrophobicContact CG-CE1 4.16Å; E86-Y95 HydrophobicContact CG-CG 4.18Å
87	E	88.1	Confident	91.5	Very high	125 Å²	125	78.8 Å²	78.8	58%	0.584	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-59.3	-22.5	175.4	-63.7	160.6	-137.9	0	0	114.4	R85 F89 K139	R85-E87 IonicContact CZ-OE1 3.57Å; R85-E87 IonicContact NE-OE1 2.83Å; R85-E87 IonicContact NH2-OE1 3.41Å; R85-E87 PolarHBondContact NH2-OE1 2.9Å; R85-E87 PolarHBondContact O-N 3.33Å; E87-F89 VanDerWaalsContact C-N 3.27Å; E87-K139 IonicContact OE2-NZ 2.92Å; E87-K139 PolarHBondContact OE2-NZ 3.44Å
88	D	87.1	Confident	91.5	Very high	73 Å²	73	74.5 Å²	74.5	39%	0.39	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-82.9	-5.3	-179.7	-63.5	-45	0	0	0	112.3	K84 R85 E86 N136	K84-D88 WeakPolarHBondContact CA-OD2 3.38Å; K84-D88 HydrophobicContact CB-CB 4.32Å; R85-D88 PolarHBondContact N-OD2 3.47Å; R85-D88 WeakPolarHBondContact O-CB 3.34Å; R85-D88 PolarHBondContact O-N 3.01Å; E86-D88 PolarHBondContact O-N 3.37Å; E86-D88 VanDerWaalsContact O-N 3.17Å; D88-N136 PolarHBondContact OD2-ND2 2.92Å
89	F	91.1	Very high	91.6	Very high	38 Å²	38	77.9 Å²	77.9	17%	0.167	38%	0.377	C	S	.	.	S	Bend	trans	-112.5	141.8	-177.4	-64.5	-89.6	0	0	0	112.2	K84 R85 E86 E87 S91 E94 Y95 F98	K84-F89 HydrophobicContact CB-CE2 3.62Å; K84-F89 HydrophobicContact CB-CZ 3.9Å; K84-F89 HydrophobicContact CD-CE1 4.44Å; K84-F89 HydrophobicContact CD-CE2 4.2Å; K84-F89 HydrophobicContact CD-CZ 3.7Å; K84-F89 HydrophobicContact CG-CZ 4.46Å; R85-F89 WeakPolarHBondContact O-CD2 3.29Å; E86-F89 PolarHBondContact O-N 3.2Å; E86-F89 VanDerWaalsContact O-N 3.11Å; E87-F89 VanDerWaalsContact C-N 3.27Å; F89-S91 VanDerWaalsContact C-N 3.27Å; F89-S91 PolarHBondContact O-N 3.43Å; F89-E94 HydrophobicContact CB-CB 4.46Å; F89-E94 HydrophobicContact CD1-CB 4Å; F89-Y95 AromaticContact CD2-CD2 3.65Å; F89-Y95 HydrophobicContact CD2-CD2 3.65Å; F89-Y95 HydrophobicContact CD2-CG 4.26Å; F89-Y95 AromaticContact CE2-CD2 3.71Å; F89-Y95 HydrophobicContact CE2-CD2 3.71Å; F89-Y95 HydrophobicContact CE2-CE2 4.47Å; F89-F98 HydrophobicContact CE1-CB 3.87Å; F89-F98 HydrophobicContact CE1-CD2 4.41Å; F89-F98 HydrophobicContact CE1-CG 4.13Å; F89-F98 HydrophobicContact CE2-CB 4.43Å; F89-F98 HydrophobicContact CE2-CD1 4.01Å; F89-F98 HydrophobicContact CE2-CE1 4.46Å; F89-F98 HydrophobicContact CE2-CG 4.16Å; F89-F98 HydrophobicContact CZ-CB 3.63Å; F89-F98 AromaticContact CZ-CD1 3.74Å; F89-F98 HydrophobicContact CZ-CD1 3.74Å; F89-F98 AromaticContact CZ-CD2 3.76Å; F89-F98 HydrophobicContact CZ-CD2 3.76Å; F89-F98 HydrophobicContact CZ-CE1 4.32Å; F89-F98 HydrophobicContact CZ-CE2 4.31Å; F89-F98 AromaticContact CZ-CG 3.43Å; F89-F98 HydrophobicContact CZ-CG 3.43Å; F89-F98 VanDerWaalsContact CZ-CG 3.43Å
90	P	91.9	Very high	91.7	Very high	115 Å²	115	80.3 Å²	80.3	75%	0.747	39%	0.386	S	S	*	.	S	Bend	trans	-65	-27.7	176.3	-20.9	31.6	0	0	0	114.4	E94	P90-E94 WeakPolarHBondContact CD-OE2 3.34Å
91	S	94.3	Very high	91.8	Very high	47 Å²	47	76.8 Å²	76.8	33%	0.329	37%	0.372	S	S	.	.	S	Bend	trans	-142.6	149.3	-175.2	71.9	0	0	0	0	111.4	F89 R93 E94 Y95	F89-S91 VanDerWaalsContact C-N 3.27Å; F89-S91 PolarHBondContact O-N 3.43Å; S91-R93 PolarHBondContact O-N 2.71Å; S91-E94 PolarHBondContact O-N 2.91Å; S91-E94 WeakPolarHBondContact OG-CG 3.32Å; S91-E94 PolarHBondContact OG-N 3.47Å; S91-E94 PolarHBondContact OG-OE1 3.48Å; S91-Y95 PolarHBondContact O-N 2.77Å
92	L	93.8	Very high	92.1	Very high	98 Å²	98	76 Å²	76	51%	0.513	37%	0.369	S	S	.	.	H	α-helix	trans	-59.5	-30.1	175.1	-178	62.2	0	0	0	112	Y95 N96	L92-Y95 HydrophobicContact CD1-CD1 4.18Å; L92-Y95 PolarHBondContact O-N 3.09Å; L92-N96 VanDerWaalsContact O-CG 3.24Å; L92-N96 PolarHBondContact O-N 3.27Å; L92-N96 PolarHBondContact O-ND2 3.44Å
93	R	94.8	Very high	92.3	Very high	190 Å²	190	79.2 Å²	79.2	72%	0.717	38%	0.384	S	S	*	.	H	α-helix	trans	-64.3	-48	177.8	-175.9	174.4	-179.1	176.7	2.2	111.8	S91 Y95 N96 D97	S91-R93 PolarHBondContact O-N 2.71Å; R93-Y95 VanDerWaalsContact C-N 3.27Å; R93-Y95 PolarHBondContact O-N 3.11Å; R93-N96 PolarHBondContact O-N 3.44Å; R93-N96 VanDerWaalsContact O-N 3.16Å; R93-D97 VanDerWaalsContact O-CG 3.31Å; R93-D97 PolarHBondContact O-N 3.11Å
94	E	93.3	Very high	92.5	Very high	90 Å²	90	82.9 Å²	82.9	42%	0.421	40%	0.4	S	S	.	.	H	α-helix	trans	-63.9	-35	177.9	-72.5	169.7	-127.9	0	0	112	F89 P90 S91 F98	F89-E94 HydrophobicContact CB-CB 4.46Å; F89-E94 HydrophobicContact CD1-CB 4Å; P90-E94 WeakPolarHBondContact CD-OE2 3.34Å; S91-E94 PolarHBondContact O-N 2.91Å; S91-E94 WeakPolarHBondContact OG-CG 3.32Å; S91-E94 PolarHBondContact OG-N 3.47Å; S91-E94 PolarHBondContact OG-OE1 3.48Å; E94-F98 WeakPolarHBondContact O-CB 3.49Å; E94-F98 PolarHBondContact O-N 2.98Å
95	Y	94	Very high	92.7	Very high	50 Å²	50	80.5 Å²	80.5	20%	0.196	39%	0.39	C	S	.	.	H	α-helix	trans	-64.3	-44	172.7	178.3	-120.7	0	0	0	111.8	E86 F89 S91 L92 R93 F98 L99	E86-Y95 HydrophobicContact CB-CD1 3.94Å; E86-Y95 HydrophobicContact CB-CD2 4.34Å; E86-Y95 HydrophobicContact CB-CE1 3.89Å; E86-Y95 HydrophobicContact CB-CE2 4.32Å; E86-Y95 HydrophobicContact CB-CG 4.16Å; E86-Y95 HydrophobicContact CG-CD1 3.83Å; E86-Y95 HydrophobicContact CG-CE1 4.16Å; E86-Y95 HydrophobicContact CG-CG 4.18Å; F89-Y95 AromaticContact CD2-CD2 3.65Å; F89-Y95 HydrophobicContact CD2-CD2 3.65Å; F89-Y95 HydrophobicContact CD2-CG 4.26Å; F89-Y95 AromaticContact CE2-CD2 3.71Å; F89-Y95 HydrophobicContact CE2-CD2 3.71Å; F89-Y95 HydrophobicContact CE2-CE2 4.47Å; S91-Y95 PolarHBondContact O-N 2.77Å; L92-Y95 HydrophobicContact CD1-CD1 4.18Å; L92-Y95 PolarHBondContact O-N 3.09Å; R93-Y95 VanDerWaalsContact C-N 3.27Å; R93-Y95 PolarHBondContact O-N 3.11Å; Y95-F98 HydrophobicContact CD2-CD1 4.35Å; Y95-F98 HydrophobicContact CE2-CD1 4.44Å; Y95-F98 WeakPolarHBondContact O-CB 3.08Å; Y95-F98 PolarHBondContact O-N 2.94Å; Y95-L99 HydrophobicContact CD1-CD1 4.15Å; Y95-L99 HydrophobicContact CD2-CG 4.46Å; Y95-L99 HydrophobicContact CE1-CD1 3.64Å; Y95-L99 HydrophobicContact CE1-CG 4.25Å; Y95-L99 HydrophobicContact CE2-CD1 4.35Å; Y95-L99 HydrophobicContact CE2-CD2 4.02Å; Y95-L99 HydrophobicContact CE2-CG 4.08Å; Y95-L99 WeakPolarHBondContact O-CG 3.49Å; Y95-L99 PolarHBondContact O-N 2.75Å
96	N	94.8	Very high	93	Very high	79 Å²	79	76.3 Å²	76.3	42%	0.422	37%	0.374	S	S	.	.	H	α-helix	trans	-64.8	-42	176.6	-70.1	-21.2	0	0	0	112.1	L92 R93 F98 L99 E100	L92-N96 VanDerWaalsContact O-CG 3.24Å; L92-N96 PolarHBondContact O-N 3.27Å; L92-N96 PolarHBondContact O-ND2 3.44Å; R93-N96 PolarHBondContact O-N 3.44Å; R93-N96 VanDerWaalsContact O-N 3.16Å; N96-F98 VanDerWaalsContact C-N 3.28Å; N96-F98 PolarHBondContact O-N 3.23Å; N96-L99 WeakPolarHBondContact O-CB 3.46Å; N96-L99 PolarHBondContact O-N 3.24Å; N96-L99 VanDerWaalsContact O-N 3.15Å; N96-E100 PolarHBondContact O-N 3Å
97	D	94.5	Very high	93.3	Very high	84 Å²	84	76.5 Å²	76.5	45%	0.449	37%	0.373	S	S	.	.	H	α-helix	trans	-61.3	-40.3	175.2	-66.8	-22.2	0	0	0	110.4	R93 E100 E101	R93-D97 VanDerWaalsContact O-CG 3.31Å; R93-D97 PolarHBondContact O-N 3.11Å; D97-E100 WeakPolarHBondContact O-CB 3.39Å; D97-E100 PolarHBondContact O-N 3.17Å; D97-E101 WeakPolarHBondContact O-CG 3.2Å; D97-E101 PolarHBondContact O-N 2.97Å
98	F	93.4	Very high	93.5	Very high	17 Å²	17	71.7 Å²	71.7	8%	0.075	35%	0.351	C	S	.	.	H	α-helix	trans	-62	-42.4	172.6	169.3	-98.7	0	0	0	112.8	Y82 K84 F89 E94 Y95 N96 E100 E101 V102 Y125	Y82-F98 AromaticContact CD1-CE2 3.58Å; Y82-F98 HydrophobicContact CD1-CE2 3.58Å; Y82-F98 AromaticContact CD1-CZ 3.92Å; Y82-F98 HydrophobicContact CD1-CZ 3.92Å; Y82-F98 HydrophobicContact CE1-CE2 4.38Å; Y82-F98 HydrophobicContact CG-CE2 4.49Å; Y82-F98 HydrophobicContact CG-CZ 4.43Å; K84-F98 HydrophobicContact CB-CE1 4.12Å; K84-F98 HydrophobicContact CB-CE2 4.45Å; K84-F98 HydrophobicContact CB-CZ 3.91Å; K84-F98 HydrophobicContact CD-CE2 4.32Å; K84-F98 HydrophobicContact CG-CZ 4.44Å; F89-F98 HydrophobicContact CE1-CB 3.87Å; F89-F98 HydrophobicContact CE1-CD2 4.41Å; F89-F98 HydrophobicContact CE1-CG 4.13Å; F89-F98 HydrophobicContact CE2-CB 4.43Å; F89-F98 HydrophobicContact CE2-CD1 4.01Å; F89-F98 HydrophobicContact CE2-CE1 4.46Å; F89-F98 HydrophobicContact CE2-CG 4.16Å; F89-F98 HydrophobicContact CZ-CB 3.63Å; F89-F98 AromaticContact CZ-CD1 3.74Å; F89-F98 HydrophobicContact CZ-CD1 3.74Å; F89-F98 AromaticContact CZ-CD2 3.76Å; F89-F98 HydrophobicContact CZ-CD2 3.76Å; F89-F98 HydrophobicContact CZ-CE1 4.32Å; F89-F98 HydrophobicContact CZ-CE2 4.31Å; F89-F98 AromaticContact CZ-CG 3.43Å; F89-F98 HydrophobicContact CZ-CG 3.43Å; F89-F98 VanDerWaalsContact CZ-CG 3.43Å; E94-F98 WeakPolarHBondContact O-CB 3.49Å; E94-F98 PolarHBondContact O-N 2.98Å; Y95-F98 HydrophobicContact CD2-CD1 4.35Å; Y95-F98 HydrophobicContact CE2-CD1 4.44Å; Y95-F98 WeakPolarHBondContact O-CB 3.08Å; Y95-F98 PolarHBondContact O-N 2.94Å; N96-F98 VanDerWaalsContact C-N 3.28Å; N96-F98 PolarHBondContact O-N 3.23Å; F98-E100 VanDerWaalsContact C-N 3.33Å; F98-E101 PolarHBondContact O-N 2.95Å; F98-V102 HydrophobicContact CD1-CG2 4.5Å; F98-V102 HydrophobicContact CE1-CG2 4.09Å; F98-V102 HydrophobicContact CE2-CG2 4.32Å; F98-V102 HydrophobicContact CZ-CG2 3.99Å; F98-V102 WeakPolarHBondContact O-CG2 3.42Å; F98-V102 PolarHBondContact O-N 2.94Å; F98-Y125 HydrophobicContact CE2-CE2 4.36Å; F98-Y125 WeakPolarHBondContact CE2-OH 3.16Å
99	L	94.8	Very high	93.7	Very high	72 Å²	72	69.5 Å²	69.5	38%	0.377	34%	0.34	S	S	.	.	H	α-helix	trans	-63.2	-40.4	176.1	-69.7	-180	0	0	0	111.8	Y95 N96 V102 E103	Y95-L99 HydrophobicContact CD1-CD1 4.15Å; Y95-L99 HydrophobicContact CD2-CG 4.46Å; Y95-L99 HydrophobicContact CE1-CD1 3.64Å; Y95-L99 HydrophobicContact CE1-CG 4.25Å; Y95-L99 HydrophobicContact CE2-CD1 4.35Å; Y95-L99 HydrophobicContact CE2-CD2 4.02Å; Y95-L99 HydrophobicContact CE2-CG 4.08Å; Y95-L99 WeakPolarHBondContact O-CG 3.49Å; Y95-L99 PolarHBondContact O-N 2.75Å; N96-L99 WeakPolarHBondContact O-CB 3.46Å; N96-L99 PolarHBondContact O-N 3.24Å; N96-L99 VanDerWaalsContact O-N 3.15Å; L99-V102 WeakPolarHBondContact O-CB 3.42Å; L99-V102 PolarHBondContact O-N 3.44Å; L99-E103 PolarHBondContact O-N 2.86Å
100	E	94.9	Very high	93.7	Very high	137 Å²	137	68.4 Å²	68.4	64%	0.64	34%	0.336	S	S	*	.	H	α-helix	trans	-62	-43.7	175.2	-165.9	66.1	-151.8	0	0	111	N96 D97 F98 V102 E103 E104	N96-E100 PolarHBondContact O-N 3Å; D97-E100 WeakPolarHBondContact O-CB 3.39Å; D97-E100 PolarHBondContact O-N 3.17Å; F98-E100 VanDerWaalsContact C-N 3.33Å; E100-V102 VanDerWaalsContact C-N 3.32Å; E100-V102 PolarHBondContact O-N 3.07Å; E100-E103 PolarHBondContact O-N 3.46Å; E100-E103 VanDerWaalsContact O-N 3.14Å; E100-E104 PolarHBondContact O-N 3.32Å
101	E	93.4	Very high	93.6	Very high	83 Å²	83	66.9 Å²	66.9	39%	0.388	32%	0.322	S	S	.	.	H	α-helix	trans	-61.1	-38.6	174.3	-74.1	-167.9	-135.7	0	0	112.8	D97 F98 E103 I105 K121	D97-E101 WeakPolarHBondContact O-CG 3.2Å; D97-E101 PolarHBondContact O-N 2.97Å; F98-E101 PolarHBondContact O-N 2.95Å; E101-E103 VanDerWaalsContact C-N 3.33Å; E101-I105 WeakPolarHBondContact O-CD1 3.4Å; E101-I105 VanDerWaalsContact O-CG1 3.23Å; E101-I105 WeakPolarHBondContact O-CG1 3.39Å; E101-I105 PolarHBondContact O-N 3.45Å; E101-I105 VanDerWaalsContact O-N 3.1Å; E101-K121 WeakPolarHBondContact OE2-CE 3.36Å; E101-K121 IonicContact OE2-NZ 2.77Å; E101-K121 PolarHBondContact OE2-NZ 2.85Å
102	V	94.6	Very high	93.2	Very high	10 Å²	10	69.4 Å²	69.4	6%	0.061	33%	0.331	C	S	.	.	H	α-helix	trans	-63.4	-42.2	174.5	172.1	0	0	0	0	110.5	V78 L79 Y82 F98 L99 E100 I105 V106	V78-V102 HydrophobicContact CG1-CG1 3.92Å; L79-V102 HydrophobicContact CD2-CG1 4.27Å; Y82-V102 HydrophobicContact CD1-CG2 3.7Å; Y82-V102 HydrophobicContact CG-CG2 3.9Å; F98-V102 HydrophobicContact CD1-CG2 4.5Å; F98-V102 HydrophobicContact CE1-CG2 4.09Å; F98-V102 HydrophobicContact CE2-CG2 4.32Å; F98-V102 HydrophobicContact CZ-CG2 3.99Å; F98-V102 WeakPolarHBondContact O-CG2 3.42Å; F98-V102 PolarHBondContact O-N 2.94Å; L99-V102 WeakPolarHBondContact O-CB 3.42Å; L99-V102 PolarHBondContact O-N 3.44Å; E100-V102 VanDerWaalsContact C-N 3.32Å; E100-V102 PolarHBondContact O-N 3.07Å; V102-I105 PolarHBondContact O-N 3.25Å; V102-V106 HydrophobicContact CG1-CG2 4.42Å; V102-V106 WeakPolarHBondContact O-CG2 3.06Å; V102-V106 PolarHBondContact O-N 3.07Å
103	E	94.7	Very high	93	Very high	73 Å²	73	68 Å²	68	34%	0.341	33%	0.327	S	S	.	.	H	α-helix	trans	-67.4	-40.9	179.6	-168.3	56.3	-148.5	0	0	111.7	R75 L99 E100 E101 I105 V106 F107	R75-E103 IonicContact CZ-OE2 3.23Å; R75-E103 IonicContact NE-OE2 3Å; R75-E103 IonicContact NH2-OE1 2.81Å; R75-E103 PolarHBondContact NH2-OE1 3.49Å; R75-E103 IonicContact NH2-OE2 3.01Å; R75-E103 PolarHBondContact NH2-OE2 3Å; L99-E103 PolarHBondContact O-N 2.86Å; E100-E103 PolarHBondContact O-N 3.46Å; E100-E103 VanDerWaalsContact O-N 3.14Å; E101-E103 VanDerWaalsContact C-N 3.33Å; E103-I105 VanDerWaalsContact C-N 3.3Å; E103-I105 PolarHBondContact O-N 2.82Å; E103-V106 PolarHBondContact O-N 3.25Å; E103-F107 VanDerWaalsContact O-CB 3.3Å; E103-F107 WeakPolarHBondContact O-CB 3.02Å; E103-F107 PolarHBondContact O-N 2.87Å
104	E	94	Very high	92.7	Very high	106 Å²	106	63 Å²	63	50%	0.495	31%	0.314	S	S	.	.	H	α-helix	trans	-57.3	-44.2	173	-171.5	-175.5	-167.4	0	0	111.4	E100 F107 N108	E100-E104 PolarHBondContact O-N 3.32Å; E104-F107 PolarHBondContact O-N 3.11Å; E104-N108 VanDerWaalsContact O-CB 3.28Å; E104-N108 WeakPolarHBondContact O-CB 3.46Å; E104-N108 PolarHBondContact O-N 2.87Å; E104-N108 PolarHBondContact O-ND2 2.92Å
105	I	93.6	Very high	92.4	Very high	3 Å²	3	61.1 Å²	61.1	2%	0.015	31%	0.307	C	S	.	.	H	α-helix	trans	-63.3	-45.4	176.5	-69.4	166.1	0	0	0	111.1	V78 Y82 E101 V102 E103 N108 L109 T118 K121 M122	V78-I105 HydrophobicContact CG1-CG2 4.02Å; V78-I105 HydrophobicContact CG2-CG2 3.92Å; Y82-I105 HydrophobicContact CE1-CD1 3.86Å; Y82-I105 HydrophobicContact CE2-CD1 3.96Å; Y82-I105 VanDerWaalsContact CZ-CD1 3.43Å; Y82-I105 VanDerWaalsContact OH-CD1 3.26Å; Y82-I105 WeakPolarHBondContact OH-CD1 3.49Å; E101-I105 WeakPolarHBondContact O-CD1 3.4Å; E101-I105 VanDerWaalsContact O-CG1 3.23Å; E101-I105 WeakPolarHBondContact O-CG1 3.39Å; E101-I105 PolarHBondContact O-N 3.45Å; E101-I105 VanDerWaalsContact O-N 3.1Å; V102-I105 PolarHBondContact O-N 3.25Å; E103-I105 VanDerWaalsContact C-N 3.3Å; E103-I105 PolarHBondContact O-N 2.82Å; I105-N108 PolarHBondContact O-N 2.67Å; I105-L109 HydrophobicContact CG2-CD1 4.07Å; I105-L109 WeakPolarHBondContact O-CB 3.3Å; I105-L109 VanDerWaalsContact O-CG 3.28Å; I105-L109 WeakPolarHBondContact O-CG 3.33Å; I105-L109 PolarHBondContact O-N 2.77Å; I105-T118 HydrophobicContact CB-CG2 4.21Å; I105-T118 HydrophobicContact CG1-CG2 4.22Å; I105-T118 HydrophobicContact CG2-CG2 3.76Å; I105-K121 HydrophobicContact CD1-CD 4.49Å; I105-M122 HydrophobicContact CG2-CG 4Å; I105-M122 HydrophobicContact CG2-SD 3.72Å
106	V	93.9	Very high	92.2	Very high	0 Å²	0	64 Å²	64	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-63.1	-44.2	178.9	170.6	0	0	0	0	110.6	E71 I74 R75 V78 V102 E103 L109 T110	E71-V106 HydrophobicContact CG-CG1 4Å; I74-V106 HydrophobicContact CG2-CG1 4.41Å; R75-V106 HydrophobicContact CB-CG1 4.2Å; R75-V106 HydrophobicContact CB-CG2 4.15Å; R75-V106 HydrophobicContact CG-CG2 4.29Å; V78-V106 HydrophobicContact CB-CG2 4.06Å; V78-V106 HydrophobicContact CG1-CG2 4.19Å; V78-V106 HydrophobicContact CG2-CG2 4.01Å; V102-V106 HydrophobicContact CG1-CG2 4.42Å; V102-V106 WeakPolarHBondContact O-CG2 3.06Å; V102-V106 PolarHBondContact O-N 3.07Å; E103-V106 PolarHBondContact O-N 3.25Å; V106-L109 PolarHBondContact O-N 3.3Å; V106-T110 VanDerWaalsContact O-CB 3.24Å; V106-T110 WeakPolarHBondContact O-CB 3.42Å; V106-T110 PolarHBondContact O-N 3.25Å; V106-T110 PolarHBondContact O-OG1 3.18Å
107	F	93.6	Very high	92.1	Very high	117 Å²	117	64.4 Å²	64.4	51%	0.513	33%	0.328	S	S	.	.	H	α-helix	trans	-60.7	-49.5	177	-178.5	-92.3	0	0	0	111.6	E103 E104 L109 T110 N111	E103-F107 VanDerWaalsContact O-CB 3.3Å; E103-F107 WeakPolarHBondContact O-CB 3.02Å; E103-F107 PolarHBondContact O-N 2.87Å; E104-F107 PolarHBondContact O-N 3.11Å; F107-L109 PolarHBondContact O-N 2.81Å; F107-T110 PolarHBondContact O-N 3.22Å; F107-N111 WeakPolarHBondContact CD2-ND2 3.33Å; F107-N111 WeakPolarHBondContact CE2-ND2 3.5Å; F107-N111 WeakPolarHBondContact CZ-ND2 3.44Å; F107-N111 WeakPolarHBondContact O-CB 3.2Å; F107-N111 PolarHBondContact O-N 3.44Å; F107-N111 PolarHBondContact O-ND2 3.05Å
108	N	93.2	Very high	92	Very high	23 Å²	23	60.8 Å²	60.8	12%	0.123	31%	0.309	C	S	.	.	H	α-helix	trans	-58.7	-46.7	178.9	-76.7	-12.6	0	0	0	111.8	E104 I105 T110 N112 V113 T118	E104-N108 VanDerWaalsContact O-CB 3.28Å; E104-N108 WeakPolarHBondContact O-CB 3.46Å; E104-N108 PolarHBondContact O-N 2.87Å; E104-N108 PolarHBondContact O-ND2 2.92Å; I105-N108 PolarHBondContact O-N 2.67Å; N108-T110 PolarHBondContact O-N 3.18Å; N108-N112 CarbonylContact O-C 3.51Å; N108-N112 WeakPolarHBondContact O-CA 3.2Å; N108-N112 PolarHBondContact O-N 2.86Å; N108-V113 CarbonylContact C-O 3.53Å; N108-V113 VanDerWaalsContact CB-O 3.3Å; N108-V113 WeakPolarHBondContact CB-O 3.35Å; N108-V113 PolarHBondContact O-N 2.88Å; N108-T118 HydrophobicContact CB-CG2 4.2Å; N108-T118 WeakPolarHBondContact CB-OG1 3.45Å; N108-T118 PolarHBondContact ND2-OG1 3.32Å
109	L	91	Very high	91.8	Very high	27 Å²	27	64.8 Å²	64.8	14%	0.141	33%	0.326	C	S	.	.	H	α-helix	trans	-67.7	-34.6	177.6	-69.9	179.2	0	0	0	113.2	I74 V78 I105 V106 F107 L115 T118 M122	I74-L109 HydrophobicContact CD1-CB 4.23Å; I74-L109 HydrophobicContact CG2-CB 3.54Å; I74-L109 HydrophobicContact CG2-CD1 3.79Å; I74-L109 HydrophobicContact CG2-CG 4.35Å; V78-L109 HydrophobicContact CG2-CD1 3.83Å; I105-L109 HydrophobicContact CG2-CD1 4.07Å; I105-L109 WeakPolarHBondContact O-CB 3.3Å; I105-L109 VanDerWaalsContact O-CG 3.28Å; I105-L109 WeakPolarHBondContact O-CG 3.33Å; I105-L109 PolarHBondContact O-N 2.77Å; V106-L109 PolarHBondContact O-N 3.3Å; F107-L109 PolarHBondContact O-N 2.81Å; L109-L115 HydrophobicContact CD2-CD2 3.77Å; L109-T118 HydrophobicContact CD2-CG2 4.05Å; L109-T118 HydrophobicContact CG-CG2 3.95Å; L109-M122 HydrophobicContact CD1-SD 3.73Å
110	T	90.6	Very high	91.8	Very high	15 Å²	15	67 Å²	67	9%	0.092	33%	0.333	C	S	.	.	H	α-helix	trans	-73	-45.2	-178.2	-60.5	0	0	0	0	111	K70 E71 V106 F107 N108 N112	K70-T110 PolarHBondContact NZ-O 3.3Å; E71-T110 HydrophobicContact CB-CG2 3.93Å; E71-T110 HydrophobicContact CG-CG2 4.31Å; V106-T110 VanDerWaalsContact O-CB 3.24Å; V106-T110 WeakPolarHBondContact O-CB 3.42Å; V106-T110 PolarHBondContact O-N 3.25Å; V106-T110 PolarHBondContact O-OG1 3.18Å; F107-T110 PolarHBondContact O-N 3.22Å; N108-T110 PolarHBondContact O-N 3.18Å; T110-N112 VanDerWaalsContact C-N 3.33Å
111	N	90.3	Very high	91.6	Very high	83 Å²	83	64.3 Å²	64.3	44%	0.444	32%	0.319	S	S	.	.	H	α-helix	trans	-88	-0.6	-178.7	-65.7	-44.8	0	0	0	113.8	F107 V113	F107-N111 WeakPolarHBondContact CD2-ND2 3.33Å; F107-N111 WeakPolarHBondContact CE2-ND2 3.5Å; F107-N111 WeakPolarHBondContact CZ-ND2 3.44Å; F107-N111 WeakPolarHBondContact O-CB 3.2Å; F107-N111 PolarHBondContact O-N 3.44Å; F107-N111 PolarHBondContact O-ND2 3.05Å; N111-V113 VanDerWaalsContact C-N 3.25Å; N111-V113 HydrophobicContact CB-CG2 3.97Å; N111-V113 PolarHBondContact O-N 2.92Å
112	N	86.6	Confident	91.6	Very high	100 Å²	100	61.4 Å²	61.4	54%	0.535	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.8	34.4	-174.6	-44.5	-69.9	0	0	0	113.3	N108 T110 L115	N108-N112 CarbonylContact O-C 3.51Å; N108-N112 WeakPolarHBondContact O-CA 3.2Å; N108-N112 PolarHBondContact O-N 2.86Å; T110-N112 VanDerWaalsContact C-N 3.33Å; N112-L115 HydrophobicContact CB-CD1 4.04Å; N112-L115 HydrophobicContact CB-CG 4.31Å
113	V	89.1	Confident	91.5	Very high	70 Å²	70	67 Å²	67	42%	0.424	33%	0.331	S	S	.	.	S	Bend	trans	-88.5	129	173.2	-178.4	0	0	0	0	108.2	N108 N111 L115	N108-V113 CarbonylContact C-O 3.53Å; N108-V113 VanDerWaalsContact CB-O 3.3Å; N108-V113 WeakPolarHBondContact CB-O 3.35Å; N108-V113 PolarHBondContact O-N 2.88Å; N111-V113 VanDerWaalsContact C-N 3.25Å; N111-V113 HydrophobicContact CB-CG2 3.97Å; N111-V113 PolarHBondContact O-N 2.92Å; V113-L115 VanDerWaalsContact C-N 3.35Å; V113-L115 PolarHBondContact O-N 3.14Å
114	D	88.3	Confident	91.4	Very high	83 Å²	83	68 Å²	68	44%	0.444	34%	0.338	S	S	.	.	S	Bend	trans	43	52.5	176	-160	3.7	0	0	0	115.5	D116 N117 T118	D114-D116 VanDerWaalsContact C-N 3.3Å; D114-D116 PolarHBondContact O-N 2.78Å; D114-N117 VanDerWaalsContact CG-ND2 3.25Å; D114-N117 VanDerWaalsContact OD1-CB 3.28Å; D114-N117 WeakPolarHBondContact OD1-CB 3.43Å; D114-N117 VanDerWaalsContact OD1-CG 3.26Å; D114-N117 PolarHBondContact OD1-N 3.26Å; D114-N117 PolarHBondContact OD1-ND2 3.02Å; D114-N117 WeakPolarHBondContact OD2-CB 3.49Å; D114-N117 PolarHBondContact OD2-ND2 3.27Å; D114-T118 VanDerWaalsContact O-CB 3.3Å; D114-T118 WeakPolarHBondContact O-CB 3.25Å; D114-T118 PolarHBondContact O-N 3.05Å; D114-T118 PolarHBondContact O-OG1 2.96Å
115	L	87.3	Confident	91.3	Very high	52 Å²	52	64.3 Å²	64.3	27%	0.272	32%	0.32	S	S	.	.	H	α-helix	trans	-60.1	-37	-175.4	-71.7	179.6	0	0	0	113.2	L109 N112 V113 K119	L109-L115 HydrophobicContact CD2-CD2 3.77Å; N112-L115 HydrophobicContact CB-CD1 4.04Å; N112-L115 HydrophobicContact CB-CG 4.31Å; V113-L115 VanDerWaalsContact C-N 3.35Å; V113-L115 PolarHBondContact O-N 3.14Å; L115-K119 VanDerWaalsContact O-CB 3.29Å; L115-K119 WeakPolarHBondContact O-CB 3.35Å; L115-K119 WeakPolarHBondContact O-CD 3.45Å; L115-K119 WeakPolarHBondContact O-CG 3.49Å; L115-K119 PolarHBondContact O-N 2.63Å
116	D	90.6	Very high	91.2	Very high	111 Å²	111	68.8 Å²	68.8	59%	0.594	34%	0.34	S	S	*	.	H	α-helix	trans	-73.3	-43.7	-174.3	-68.6	-32.3	0	0	0	111.7	D114 K120	D114-D116 VanDerWaalsContact C-N 3.3Å; D114-D116 PolarHBondContact O-N 2.78Å; D116-K120 WeakPolarHBondContact O-CB 3.28Å; D116-K120 VanDerWaalsContact O-CG 3.24Å; D116-K120 WeakPolarHBondContact O-CG 3.28Å; D116-K120 PolarHBondContact O-N 3.49Å
117	N	92.1	Very high	91.1	Very high	87 Å²	87	77.2 Å²	77.2	47%	0.465	38%	0.377	S	S	.	.	H	α-helix	trans	-69.9	-40.3	176	-65	-30.3	0	0	0	111.1	D114 K119 K120 K121	D114-N117 VanDerWaalsContact CG-ND2 3.25Å; D114-N117 VanDerWaalsContact OD1-CB 3.28Å; D114-N117 WeakPolarHBondContact OD1-CB 3.43Å; D114-N117 VanDerWaalsContact OD1-CG 3.26Å; D114-N117 PolarHBondContact OD1-N 3.26Å; D114-N117 PolarHBondContact OD1-ND2 3.02Å; D114-N117 WeakPolarHBondContact OD2-CB 3.49Å; D114-N117 PolarHBondContact OD2-ND2 3.27Å; N117-K119 PolarHBondContact O-N 3.39Å; N117-K120 PolarHBondContact O-N 3.05Å; N117-K121 WeakPolarHBondContact O-CB 3.23Å; N117-K121 PolarHBondContact O-N 2.77Å
118	T	91	Very high	91	Very high	7 Å²	7	78.6 Å²	78.6	4%	0.043	39%	0.385	C	S	.	.	H	α-helix	trans	-60.6	-46	177.1	-57.2	0	0	0	0	111.1	I105 N108 L109 D114 K120 K121 M122	I105-T118 HydrophobicContact CB-CG2 4.21Å; I105-T118 HydrophobicContact CG1-CG2 4.22Å; I105-T118 HydrophobicContact CG2-CG2 3.76Å; N108-T118 HydrophobicContact CB-CG2 4.2Å; N108-T118 WeakPolarHBondContact CB-OG1 3.45Å; N108-T118 PolarHBondContact ND2-OG1 3.32Å; L109-T118 HydrophobicContact CD2-CG2 4.05Å; L109-T118 HydrophobicContact CG-CG2 3.95Å; D114-T118 VanDerWaalsContact O-CB 3.3Å; D114-T118 WeakPolarHBondContact O-CB 3.25Å; D114-T118 PolarHBondContact O-N 3.05Å; D114-T118 PolarHBondContact O-OG1 2.96Å; T118-K120 PolarHBondContact O-N 3.12Å; T118-K121 PolarHBondContact O-N 2.89Å; T118-M122 VanDerWaalsContact O-CG 3.3Å; T118-M122 WeakPolarHBondContact O-CG 3.36Å; T118-M122 PolarHBondContact O-N 2.88Å
119	K	91.1	Very high	90.8	Very high	102 Å²	102	78.5 Å²	78.5	44%	0.443	39%	0.385	S	S	.	.	H	α-helix	trans	-62.5	-43.1	175.4	-75.8	171.8	-174	171.6	0	112.4	L115 N117 K121 M122 E123	L115-K119 VanDerWaalsContact O-CB 3.29Å; L115-K119 WeakPolarHBondContact O-CB 3.35Å; L115-K119 WeakPolarHBondContact O-CD 3.45Å; L115-K119 WeakPolarHBondContact O-CG 3.49Å; L115-K119 PolarHBondContact O-N 2.63Å; N117-K119 PolarHBondContact O-N 3.39Å; K119-K121 PolarHBondContact O-N 3.18Å; K119-M122 WeakPolarHBondContact O-CB 3.46Å; K119-M122 PolarHBondContact O-N 3.2Å; K119-E123 WeakPolarHBondContact O-CG 3.45Å; K119-E123 PolarHBondContact O-N 3.15Å
120	K	93.2	Very high	90.7	Very high	119 Å²	119	83 Å²	83	52%	0.517	40%	0.403	S	S	.	.	H	α-helix	trans	-60.6	-44.4	175.2	-74	171	-173.5	171.9	0	111.8	D116 N117 T118 M122 E123 I124	D116-K120 WeakPolarHBondContact O-CB 3.28Å; D116-K120 VanDerWaalsContact O-CG 3.24Å; D116-K120 WeakPolarHBondContact O-CG 3.28Å; D116-K120 PolarHBondContact O-N 3.49Å; N117-K120 PolarHBondContact O-N 3.05Å; T118-K120 PolarHBondContact O-N 3.12Å; K120-M122 VanDerWaalsContact C-N 3.31Å; K120-M122 PolarHBondContact O-N 3.3Å; K120-E123 PolarHBondContact O-N 3.23Å; K120-I124 VanDerWaalsContact O-CG1 3.3Å; K120-I124 WeakPolarHBondContact O-CG1 3.23Å; K120-I124 PolarHBondContact O-N 2.68Å
121	K	92.3	Very high	90.6	Very high	80 Å²	80	88.3 Å²	88.3	35%	0.348	43%	0.431	S	S	.	.	H	α-helix	trans	-57.6	-45.7	175.6	-171.4	-179.9	179	-172.7	0	110.3	E101 I105 N117 T118 K119 Y125	E101-K121 WeakPolarHBondContact OE2-CE 3.36Å; E101-K121 IonicContact OE2-NZ 2.77Å; E101-K121 PolarHBondContact OE2-NZ 2.85Å; I105-K121 HydrophobicContact CD1-CD 4.49Å; N117-K121 WeakPolarHBondContact O-CB 3.23Å; N117-K121 PolarHBondContact O-N 2.77Å; T118-K121 PolarHBondContact O-N 2.89Å; K119-K121 PolarHBondContact O-N 3.18Å; K121-Y125 VanDerWaalsContact O-CB 3.29Å; K121-Y125 WeakPolarHBondContact O-CB 3.19Å; K121-Y125 PolarHBondContact O-N 2.99Å
122	M	92.1	Very high	90.4	Very high	21 Å²	21	87 Å²	87	10%	0.103	43%	0.426	C	S	.	.	H	α-helix	trans	-63.4	-41.7	175.6	-66.8	-178.6	69.3	0	0	113.5	V78 I81 Y82 I105 L109 T118 K119 K120 Y125 Q126	V78-M122 HydrophobicContact CG2-CE 3.93Å; V78-M122 HydrophobicContact CG2-SD 4.45Å; I81-M122 HydrophobicContact CD1-CE 3.58Å; Y82-M122 HydrophobicContact CE2-CG 4.01Å; I105-M122 HydrophobicContact CG2-CG 4Å; I105-M122 HydrophobicContact CG2-SD 3.72Å; L109-M122 HydrophobicContact CD1-SD 3.73Å; T118-M122 VanDerWaalsContact O-CG 3.3Å; T118-M122 WeakPolarHBondContact O-CG 3.36Å; T118-M122 PolarHBondContact O-N 2.88Å; K119-M122 WeakPolarHBondContact O-CB 3.46Å; K119-M122 PolarHBondContact O-N 3.2Å; K120-M122 VanDerWaalsContact C-N 3.31Å; K120-M122 PolarHBondContact O-N 3.3Å; M122-Y125 PolarHBondContact O-N 3.28Å; M122-Q126 VanDerWaalsContact O-CB 3.24Å; M122-Q126 WeakPolarHBondContact O-CB 3.48Å; M122-Q126 PolarHBondContact O-N 3.44Å
123	E	92.8	Very high	90.5	Very high	127 Å²	127	83.2 Å²	83.2	59%	0.593	41%	0.405	S	S	*	.	H	α-helix	trans	-65.6	-43	178.9	-76.2	176.6	-177.5	0	0	112.1	K119 K120 Q126 K127	K119-E123 WeakPolarHBondContact O-CG 3.45Å; K119-E123 PolarHBondContact O-N 3.15Å; K120-E123 PolarHBondContact O-N 3.23Å; E123-Q126 PolarHBondContact O-N 2.89Å; E123-K127 WeakPolarHBondContact O-CB 3.15Å; E123-K127 PolarHBondContact O-N 2.86Å
124	I	93.3	Very high	90.5	Very high	94 Å²	94	85.2 Å²	85.2	48%	0.482	41%	0.41	S	S	.	.	H	α-helix	trans	-62	-51.4	174.9	-66.9	165.6	0	0	0	109.5	K120 Q126 K127 E128	K120-I124 VanDerWaalsContact O-CG1 3.3Å; K120-I124 WeakPolarHBondContact O-CG1 3.23Å; K120-I124 PolarHBondContact O-N 2.68Å; I124-Q126 VanDerWaalsContact C-N 3.3Å; I124-Q126 PolarHBondContact O-N 3.11Å; I124-K127 WeakPolarHBondContact O-CB 2.98Å; I124-K127 PolarHBondContact O-N 2.91Å; I124-K127 VanDerWaalsContact O-N 3.07Å; I124-E128 HydrophobicContact CG2-CG 4.38Å; I124-E128 WeakPolarHBondContact CG2-OE1 3.44Å; I124-E128 WeakPolarHBondContact O-CG 3.46Å; I124-E128 PolarHBondContact O-N 3.18Å
125	Y	91.3	Very high	90.5	Very high	30 Å²	30	88.8 Å²	88.8	12%	0.118	42%	0.422	C	S	.	.	H	α-helix	trans	-57.7	-43.4	178.8	-177.6	-87.5	0	0	0	112.1	I81 Y82 K84 F98 K121 M122 K127 E128 N129 I133	I81-Y125 HydrophobicContact CG2-CD1 3.95Å; I81-Y125 HydrophobicContact CG2-CE1 4.42Å; Y82-Y125 HydrophobicContact CD1-CD1 4.13Å; Y82-Y125 AromaticContact CD1-CE1 3.8Å; Y82-Y125 HydrophobicContact CD1-CE1 3.8Å; Y82-Y125 HydrophobicContact CD1-CE2 4.19Å; Y82-Y125 HydrophobicContact CD1-CG 4.48Å; Y82-Y125 AromaticContact CD1-CZ 3.83Å; Y82-Y125 HydrophobicContact CD2-CD1 4.27Å; Y82-Y125 HydrophobicContact CD2-CE1 4.34Å; Y82-Y125 AromaticContact CE1-CD1 3.79Å; Y82-Y125 HydrophobicContact CE1-CD1 3.79Å; Y82-Y125 AromaticContact CE1-CD2 3.79Å; Y82-Y125 HydrophobicContact CE1-CD2 3.79Å; Y82-Y125 AromaticContact CE1-CE1 3.89Å; Y82-Y125 HydrophobicContact CE1-CE1 3.89Å; Y82-Y125 AromaticContact CE1-CE2 3.88Å; Y82-Y125 HydrophobicContact CE1-CE2 3.88Å; Y82-Y125 AromaticContact CE1-CG 3.75Å; Y82-Y125 HydrophobicContact CE1-CG 3.75Å; Y82-Y125 AromaticContact CE1-CZ 3.94Å; Y82-Y125 AromaticContact CE2-CD1 3.94Å; Y82-Y125 HydrophobicContact CE2-CD1 3.94Å; Y82-Y125 HydrophobicContact CE2-CE1 4.43Å; Y82-Y125 HydrophobicContact CE2-CG 4.33Å; Y82-Y125 HydrophobicContact CG-CD1 4.35Å; Y82-Y125 HydrophobicContact CG-CE1 4.02Å; Y82-Y125 AromaticContact CZ-CD1 3.68Å; Y82-Y125 AromaticContact CZ-CG 3.65Å; Y82-Y125 WeakPolarHBondContact OH-CB 3.32Å; K84-Y125 VanDerWaalsContact CD-OH 3.26Å; K84-Y125 WeakPolarHBondContact CD-OH 3.38Å; K84-Y125 WeakPolarHBondContact CE-OH 3.43Å; F98-Y125 HydrophobicContact CE2-CE2 4.36Å; F98-Y125 WeakPolarHBondContact CE2-OH 3.16Å; K121-Y125 VanDerWaalsContact O-CB 3.29Å; K121-Y125 WeakPolarHBondContact O-CB 3.19Å; K121-Y125 PolarHBondContact O-N 2.99Å; M122-Y125 PolarHBondContact O-N 3.28Å; Y125-K127 VanDerWaalsContact C-N 3.32Å; Y125-K127 PolarHBondContact O-N 2.77Å; Y125-E128 PolarHBondContact O-N 3.39Å; Y125-N129 VanDerWaalsContact CD2-ND2 3.26Å; Y125-N129 WeakPolarHBondContact CD2-ND2 3.43Å; Y125-N129 HydrophobicContact CE1-CB 4.15Å; Y125-N129 WeakPolarHBondContact CE2-ND2 3.45Å; Y125-N129 WeakPolarHBondContact O-CB 3.45Å; Y125-N129 PolarHBondContact O-N 3.35Å; Y125-N129 PolarHBondContact O-ND2 3.27Å; Y125-I133 HydrophobicContact CE1-CD1 4.42Å
126	Q	90.8	Very high	90.5	Very high	97 Å²	97	87.1 Å²	87.1	45%	0.453	41%	0.413	S	S	.	.	H	α-helix	trans	-63.8	-37.6	177.7	-173.7	179	26.2	0	0	112.2	I81 M122 E123 I124 K130 I133	I81-Q126 HydrophobicContact CG2-CB 3.93Å; I81-Q126 HydrophobicContact CG2-CG 4.29Å; M122-Q126 VanDerWaalsContact O-CB 3.24Å; M122-Q126 WeakPolarHBondContact O-CB 3.48Å; M122-Q126 PolarHBondContact O-N 3.44Å; E123-Q126 PolarHBondContact O-N 2.89Å; I124-Q126 VanDerWaalsContact C-N 3.3Å; I124-Q126 PolarHBondContact O-N 3.11Å; Q126-K130 WeakPolarHBondContact O-CA 3.3Å; Q126-K130 WeakPolarHBondContact O-CB 3.46Å; Q126-K130 PolarHBondContact O-N 3.1Å; Q126-I133 HydrophobicContact CG-CD1 4.5Å
127	K	91.9	Very high	90.4	Very high	176 Å²	176	88.4 Å²	88.4	77%	0.765	41%	0.413	S	S	*	.	H	α-helix	trans	-69.7	-43	178.3	-176.1	179.6	176.2	-174.3	0	111.6	E123 I124 Y125	E123-K127 WeakPolarHBondContact O-CB 3.15Å; E123-K127 PolarHBondContact O-N 2.86Å; I124-K127 WeakPolarHBondContact O-CB 2.98Å; I124-K127 PolarHBondContact O-N 2.91Å; I124-K127 VanDerWaalsContact O-N 3.07Å; Y125-K127 VanDerWaalsContact C-N 3.32Å; Y125-K127 PolarHBondContact O-N 2.77Å
128	E	91.3	Very high	90.2	Very high	146 Å²	146	90.3 Å²	90.3	68%	0.682	42%	0.423	S	S	*	.	H	α-helix	trans	-73	-39.3	-178.7	-69.7	176.3	172.1	0	0	112.4	I124 Y125	I124-E128 HydrophobicContact CG2-CG 4.38Å; I124-E128 WeakPolarHBondContact CG2-OE1 3.44Å; I124-E128 WeakPolarHBondContact O-CG 3.46Å; I124-E128 PolarHBondContact O-N 3.18Å; Y125-E128 PolarHBondContact O-N 3.39Å
129	N	89.4	Confident	90.1	Very high	22 Å²	22	93.7 Å²	93.7	12%	0.118	44%	0.437	C	S	.	.	S	Bend	trans	-98.6	13.2	-175.8	-61.4	-84.6	0	0	0	113.3	K84 Y125 D131 V132 I133	K84-N129 VanDerWaalsContact CE-OD1 3.24Å; K84-N129 WeakPolarHBondContact CE-OD1 3.31Å; K84-N129 PolarHBondContact NZ-OD1 2.99Å; Y125-N129 VanDerWaalsContact CD2-ND2 3.26Å; Y125-N129 WeakPolarHBondContact CD2-ND2 3.43Å; Y125-N129 HydrophobicContact CE1-CB 4.15Å; Y125-N129 WeakPolarHBondContact CE2-ND2 3.45Å; Y125-N129 WeakPolarHBondContact O-CB 3.45Å; Y125-N129 PolarHBondContact O-N 3.35Å; Y125-N129 PolarHBondContact O-ND2 3.27Å; N129-D131 VanDerWaalsContact C-N 3.29Å; N129-D131 PolarHBondContact O-N 2.82Å; N129-D131 VanDerWaalsContact O-N 3.15Å; N129-V132 PolarHBondContact O-N 3.22Å; N129-V132 VanDerWaalsContact O-N 3.11Å; N129-I133 HydrophobicContact CB-CD1 3.99Å; N129-I133 HydrophobicContact CB-CG1 4.14Å; N129-I133 WeakPolarHBondContact O-CG1 3.34Å; N129-I133 PolarHBondContact O-N 2.85Å
130	K	88.9	Confident	89.8	Confident	120 Å²	120	93.1 Å²	93.1	52%	0.522	44%	0.438	S	S	.	.	H	α-helix	trans	-50.3	-45.7	-172.3	-172.2	-178.3	175.3	-172.3	0	113.5	Q126 I133 Q134	Q126-K130 WeakPolarHBondContact O-CA 3.3Å; Q126-K130 WeakPolarHBondContact O-CB 3.46Å; Q126-K130 PolarHBondContact O-N 3.1Å; K130-I133 PolarHBondContact O-N 3.38Å; K130-Q134 WeakPolarHBondContact O-CG 3.43Å; K130-Q134 PolarHBondContact O-N 3.33Å
131	D	88.3	Confident	89.5	Confident	127 Å²	127	89.9 Å²	89.9	68%	0.679	43%	0.428	S	S	*	.	H	α-helix	trans	-71	-41	-177.4	-61.5	-34.1	0	0	0	111.9	N129 I133 Q134 K135	N129-D131 VanDerWaalsContact C-N 3.29Å; N129-D131 PolarHBondContact O-N 2.82Å; N129-D131 VanDerWaalsContact O-N 3.15Å; D131-I133 VanDerWaalsContact C-N 3.33Å; D131-I133 PolarHBondContact O-N 2.93Å; D131-Q134 PolarHBondContact O-N 2.88Å; D131-K135 WeakPolarHBondContact O-CB 3.09Å; D131-K135 PolarHBondContact O-N 3.05Å
132	V	87.5	Confident	89.3	Confident	57 Å²	57	93.7 Å²	93.7	35%	0.345	44%	0.44	S	S	.	.	H	α-helix	trans	-61.7	-44.7	174.6	179.7	0	0	0	0	110.1	K84 N129 Q134 K135 N136	K84-V132 HydrophobicContact CG-CG1 4.48Å; N129-V132 PolarHBondContact O-N 3.22Å; N129-V132 VanDerWaalsContact O-N 3.11Å; V132-Q134 VanDerWaalsContact C-N 3.34Å; V132-Q134 PolarHBondContact O-N 3.32Å; V132-K135 PolarHBondContact O-N 2.86Å; V132-N136 WeakPolarHBondContact O-CB 3.36Å; V132-N136 PolarHBondContact O-N 2.9Å
133	I	87.2	Confident	89.1	Confident	20 Å²	20	96.2 Å²	96.2	10%	0.103	45%	0.452	C	S	.	.	H	α-helix	trans	-60.5	-45.6	178.8	-65.4	165.5	0	0	0	110.7	I81 N83 Y125 Q126 N129 K130 D131 K137	I81-I133 HydrophobicContact CG2-CD1 4.22Å; I81-I133 WeakPolarHBondContact O-CD1 3.44Å; I81-I133 VanDerWaalsContact O-CG1 3.25Å; I81-I133 WeakPolarHBondContact O-CG1 3.49Å; N83-I133 PolarHBondContact ND2-O 3.06Å; N83-I133 WeakPolarHBondContact OD1-CA 3.24Å; N83-I133 WeakPolarHBondContact OD1-CG1 3.49Å; Y125-I133 HydrophobicContact CE1-CD1 4.42Å; Q126-I133 HydrophobicContact CG-CD1 4.5Å; N129-I133 HydrophobicContact CB-CD1 3.99Å; N129-I133 HydrophobicContact CB-CG1 4.14Å; N129-I133 WeakPolarHBondContact O-CG1 3.34Å; N129-I133 PolarHBondContact O-N 2.85Å; K130-I133 PolarHBondContact O-N 3.38Å; D131-I133 VanDerWaalsContact C-N 3.33Å; D131-I133 PolarHBondContact O-N 2.93Å; I133-K137 VanDerWaalsContact O-CB 3.31Å; I133-K137 WeakPolarHBondContact O-CB 3.49Å; I133-K137 PolarHBondContact O-N 2.76Å
134	Q	89.1	Confident	88.8	Confident	111 Å²	111	95 Å²	95	52%	0.519	45%	0.446	S	S	.	.	H	α-helix	trans	-64.9	-42.6	178.5	-73.4	-177.7	9	0	0	112.3	K130 D131 V132 K137 L138	K130-Q134 WeakPolarHBondContact O-CG 3.43Å; K130-Q134 PolarHBondContact O-N 3.33Å; D131-Q134 PolarHBondContact O-N 2.88Å; V132-Q134 VanDerWaalsContact C-N 3.34Å; V132-Q134 PolarHBondContact O-N 3.32Å; Q134-K137 PolarHBondContact O-N 3.36Å; Q134-L138 PolarHBondContact O-N 3.43Å
135	K	89	Confident	88.6	Confident	159 Å²	159	96.2 Å²	96.2	69%	0.691	45%	0.45	S	S	*	.	H	α-helix	trans	-62	-47.2	177	-173.5	-177.6	177.4	-171.5	0	111.7	D131 V132 K137 L138 K139	D131-K135 WeakPolarHBondContact O-CB 3.09Å; D131-K135 PolarHBondContact O-N 3.05Å; V132-K135 PolarHBondContact O-N 2.86Å; K135-K137 VanDerWaalsContact C-N 3.32Å; K135-K137 PolarHBondContact O-N 3.06Å; K135-L138 PolarHBondContact O-N 3.15Å; K135-K139 PolarHBondContact O-N 2.75Å
136	N	87.8	Confident	88.6	Confident	16 Å²	16	99.3 Å²	99.3	9%	0.086	47%	0.466	C	S	.	.	H	α-helix	trans	-66.6	-35.4	179.3	-74.8	2.8	0	0	0	111.7	N83 D88 V132 K139 L140	N83-N136 WeakPolarHBondContact ND2-CB 3.46Å; N83-N136 PolarHBondContact O-ND2 3.08Å; D88-N136 PolarHBondContact OD2-ND2 2.92Å; V132-N136 WeakPolarHBondContact O-CB 3.36Å; V132-N136 PolarHBondContact O-N 2.9Å; N136-K139 PolarHBondContact O-N 2.83Å; N136-L140 WeakPolarHBondContact O-CB 3.16Å; N136-L140 PolarHBondContact O-N 2.96Å
137	K	88.2	Confident	88.6	Confident	139 Å²	139	99.8 Å²	99.8	60%	0.604	47%	0.471	S	S	*	.	H	α-helix	trans	-62.7	-43.7	172.6	-173.8	-179.3	177.9	-172.5	0	111.8	I133 Q134 K135 L140 T141	I133-K137 VanDerWaalsContact O-CB 3.31Å; I133-K137 WeakPolarHBondContact O-CB 3.49Å; I133-K137 PolarHBondContact O-N 2.76Å; Q134-K137 PolarHBondContact O-N 3.36Å; K135-K137 VanDerWaalsContact C-N 3.32Å; K135-K137 PolarHBondContact O-N 3.06Å; K137-L140 PolarHBondContact O-N 3.32Å; K137-T141 PolarHBondContact O-N 2.84Å; K137-T141 PolarHBondContact O-OG1 3.23Å
138	L	88.9	Confident	88.4	Confident	127 Å²	127	97.9 Å²	97.9	67%	0.665	46%	0.464	S	S	*	.	H	α-helix	trans	-66.3	-39.8	178.2	-172.6	64.6	0	0	0	111.8	Q134 K135 T141 R142	Q134-L138 PolarHBondContact O-N 3.43Å; K135-L138 PolarHBondContact O-N 3.15Å; L138-T141 PolarHBondContact O-N 3.3Å; L138-R142 PolarHBondContact O-N 2.77Å
139	K	87.5	Confident	88.4	Confident	78 Å²	78	97.4 Å²	97.4	34%	0.339	46%	0.462	S	S	.	.	H	α-helix	trans	-59.2	-47.2	173.6	-171.3	-178.4	177.6	-173.1	0	110.8	E87 K135 N136 T141 R142 E143	E87-K139 IonicContact OE2-NZ 2.92Å; E87-K139 PolarHBondContact OE2-NZ 3.44Å; K135-K139 PolarHBondContact O-N 2.75Å; N136-K139 PolarHBondContact O-N 2.83Å; K139-T141 PolarHBondContact O-N 3.06Å; K139-R142 PolarHBondContact O-N 3.11Å; K139-E143 VanDerWaalsContact CE-OE1 3.28Å; K139-E143 WeakPolarHBondContact CE-OE1 3.46Å; K139-E143 WeakPolarHBondContact O-CG 3.44Å; K139-E143 PolarHBondContact O-N 3.32Å
140	L	85.5	Confident	88.5	Confident	89 Å²	89	99 Å²	99	47%	0.466	48%	0.479	S	S	.	.	H	α-helix	trans	-62	-43.9	177.9	-177	66.8	0	0	0	112.4	N136 K137 R142 E143 Q144	N136-L140 WeakPolarHBondContact O-CB 3.16Å; N136-L140 PolarHBondContact O-N 2.96Å; K137-L140 PolarHBondContact O-N 3.32Å; L140-R142 VanDerWaalsContact C-N 3.31Å; L140-R142 PolarHBondContact O-N 3.26Å; L140-E143 PolarHBondContact O-N 3.07Å; L140-Q144 WeakPolarHBondContact O-CB 3.41Å; L140-Q144 VanDerWaalsContact O-CG 3.27Å; L140-Q144 WeakPolarHBondContact O-CG 3.15Å; L140-Q144 PolarHBondContact O-N 3.25Å
141	T	87.1	Confident	88.6	Confident	51 Å²	51	97.9 Å²	97.9	31%	0.313	48%	0.478	S	S	.	.	H	α-helix	trans	-61.2	-42.1	177.4	-63.6	0	0	0	0	111.3	K137 L138 K139 Q144 E145	K137-T141 PolarHBondContact O-N 2.84Å; K137-T141 PolarHBondContact O-OG1 3.23Å; L138-T141 PolarHBondContact O-N 3.3Å; K139-T141 PolarHBondContact O-N 3.06Å; T141-Q144 PolarHBondContact O-N 3.14Å; T141-E145 WeakPolarHBondContact O-CG 3.46Å; T141-E145 PolarHBondContact O-N 3.4Å
142	R	87.6	Confident	88.7	Confident	160 Å²	160	94.8 Å²	94.8	60%	0.604	46%	0.459	S	S	*	.	H	α-helix	trans	-63.7	-46.7	176	-178.6	-179.8	169.6	172.5	0.9	112.4	L138 K139 L140 Q144 E145 E146	L138-R142 PolarHBondContact O-N 2.77Å; K139-R142 PolarHBondContact O-N 3.11Å; L140-R142 VanDerWaalsContact C-N 3.31Å; L140-R142 PolarHBondContact O-N 3.26Å; R142-Q144 VanDerWaalsContact C-N 3.25Å; R142-Q144 PolarHBondContact O-N 2.91Å; R142-E145 PolarHBondContact O-N 3.32Å; R142-E146 HydrophobicContact CG-CG 4.49Å; R142-E146 WeakPolarHBondContact CG-OE1 3.37Å; R142-E146 IonicContact CZ-OE1 2.72Å; R142-E146 IonicContact NE-OE1 3.31Å; R142-E146 PolarHBondContact NE-OE1 2.87Å; R142-E146 IonicContact NH2-OE1 3.67Å; R142-E146 PolarHBondContact NH2-OE1 2.9Å; R142-E146 WeakPolarHBondContact O-CB 3.44Å; R142-E146 WeakPolarHBondContact O-CG 3.34Å; R142-E146 PolarHBondContact O-N 2.96Å
143	E	87.5	Confident	89	Confident	74 Å²	74	95.3 Å²	95.3	35%	0.346	46%	0.463	S	S	.	.	H	α-helix	trans	-60.6	-36.6	176.6	-71.9	172.7	175.6	0	0	111.4	R85 K139 L140 L147	R85-E143 IonicContact NH1-OE1 3.71Å; R85-E143 PolarHBondContact NH1-OE1 3.18Å; R85-E143 IonicContact NH1-OE2 3.04Å; R85-E143 PolarHBondContact NH1-OE2 2.95Å; K139-E143 VanDerWaalsContact CE-OE1 3.28Å; K139-E143 WeakPolarHBondContact CE-OE1 3.46Å; K139-E143 WeakPolarHBondContact O-CG 3.44Å; K139-E143 PolarHBondContact O-N 3.32Å; L140-E143 PolarHBondContact O-N 3.07Å; E143-L147 WeakPolarHBondContact O-CB 3.42Å; E143-L147 PolarHBondContact O-N 2.78Å; E143-L147 VanDerWaalsContact O-N 3.08Å
144	Q	86.6	Confident	89.2	Confident	101 Å²	101	99.7 Å²	99.7	47%	0.472	48%	0.483	S	S	.	.	H	α-helix	trans	-67.5	-45.2	174.7	-75.6	176.4	-19.3	0	0	112.5	L140 T141 R142 L147 E148	L140-Q144 WeakPolarHBondContact O-CB 3.41Å; L140-Q144 VanDerWaalsContact O-CG 3.27Å; L140-Q144 WeakPolarHBondContact O-CG 3.15Å; L140-Q144 PolarHBondContact O-N 3.25Å; T141-Q144 PolarHBondContact O-N 3.14Å; R142-Q144 VanDerWaalsContact C-N 3.25Å; R142-Q144 PolarHBondContact O-N 2.91Å; Q144-L147 PolarHBondContact O-N 3.27Å; Q144-E148 WeakPolarHBondContact O-CG 3.3Å; Q144-E148 PolarHBondContact O-N 3Å
145	E	89.6	Confident	89.3	Confident	121 Å²	121	101.4 Å²	101.4	57%	0.565	48%	0.484	S	S	*	.	H	α-helix	trans	-61.5	-44.3	176.5	-74.4	172	178.9	0	0	111.5	T141 R142 L147 E148 E149	T141-E145 WeakPolarHBondContact O-CG 3.46Å; T141-E145 PolarHBondContact O-N 3.4Å; R142-E145 PolarHBondContact O-N 3.32Å; E145-L147 VanDerWaalsContact C-N 3.31Å; E145-L147 PolarHBondContact O-N 2.96Å; E145-E148 PolarHBondContact O-N 3.42Å; E145-E149 WeakPolarHBondContact O-CB 3.47Å; E145-E149 PolarHBondContact O-N 3.04Å
146	E	91.1	Very high	89.5	Confident	95 Å²	95	98.1 Å²	98.1	44%	0.444	47%	0.471	S	S	.	.	H	α-helix	trans	-61.2	-38.9	175.8	-71.9	172.9	-174.5	0	0	111.6	R142 A150	R142-E146 HydrophobicContact CG-CG 4.49Å; R142-E146 WeakPolarHBondContact CG-OE1 3.37Å; R142-E146 IonicContact CZ-OE1 2.72Å; R142-E146 IonicContact NE-OE1 3.31Å; R142-E146 PolarHBondContact NE-OE1 2.87Å; R142-E146 IonicContact NH2-OE1 3.67Å; R142-E146 PolarHBondContact NH2-OE1 2.9Å; R142-E146 WeakPolarHBondContact O-CB 3.44Å; R142-E146 WeakPolarHBondContact O-CG 3.34Å; R142-E146 PolarHBondContact O-N 2.96Å; E146-A150 PolarHBondContact O-N 3.47Å; E146-A150 VanDerWaalsContact O-N 3.11Å
147	L	90	Very high	89.7	Confident	107 Å²	107	101.3 Å²	101.3	56%	0.56	49%	0.486	S	S	*	.	H	α-helix	trans	-68.7	-43.3	175.8	-178.6	64.1	0	0	0	112.4	E143 Q144 E145 E149 A150 L151	E143-L147 WeakPolarHBondContact O-CB 3.42Å; E143-L147 PolarHBondContact O-N 2.78Å; E143-L147 VanDerWaalsContact O-N 3.08Å; Q144-L147 PolarHBondContact O-N 3.27Å; E145-L147 VanDerWaalsContact C-N 3.31Å; E145-L147 PolarHBondContact O-N 2.96Å; L147-E149 VanDerWaalsContact C-N 3.33Å; L147-A150 PolarHBondContact O-N 3.23Å; L147-L151 HydrophobicContact CG-CD1 4.36Å; L147-L151 WeakPolarHBondContact O-CG 3.27Å; L147-L151 PolarHBondContact O-N 2.86Å
148	E	87.9	Confident	89.9	Confident	135 Å²	135	99.6 Å²	99.6	63%	0.631	48%	0.483	S	S	*	.	H	α-helix	trans	-62.4	-40.9	176.9	-75.8	-178	-176.3	0	0	111.6	Q144 E145 L151 E152	Q144-E148 WeakPolarHBondContact O-CG 3.3Å; Q144-E148 PolarHBondContact O-N 3Å; E145-E148 PolarHBondContact O-N 3.42Å; E148-L151 PolarHBondContact O-N 2.81Å; E148-E152 WeakPolarHBondContact O-CB 3.08Å; E148-E152 PolarHBondContact O-N 3.35Å
149	E	91.4	Very high	90.1	Very high	137 Å²	137	98.9 Å²	98.9	64%	0.64	48%	0.477	S	S	*	.	H	α-helix	trans	-61.6	-44.4	174.4	-174	176.4	-174	0	0	111.5	E145 L147 L151 E152 V153	E145-E149 WeakPolarHBondContact O-CB 3.47Å; E145-E149 PolarHBondContact O-N 3.04Å; L147-E149 VanDerWaalsContact C-N 3.33Å; E149-L151 PolarHBondContact O-N 3.34Å; E149-E152 PolarHBondContact O-N 3.5Å; E149-V153 WeakPolarHBondContact O-CG2 3.38Å; E149-V153 PolarHBondContact O-N 3.4Å
150	A	91.5	Very high	90.3	Very high	56 Å²	56	101.4 Å²	101.4	46%	0.463	49%	0.49	S	S	.	.	H	α-helix	trans	-61.8	-42.7	177.2	0	0	0	0	0	112.5	E146 L147 V153 E154	E146-A150 PolarHBondContact O-N 3.47Å; E146-A150 VanDerWaalsContact O-N 3.11Å; L147-A150 PolarHBondContact O-N 3.23Å; A150-V153 PolarHBondContact O-N 3.01Å; A150-E154 PolarHBondContact O-N 2.95Å
151	L	91.3	Very high	90.6	Very high	96 Å²	96	103 Å²	103	50%	0.503	49%	0.489	S	S	.	.	H	α-helix	trans	-66	-37.4	176.8	-71.7	173.7	0	0	0	112.3	L147 E148 E149 E154 R155	L147-L151 HydrophobicContact CG-CD1 4.36Å; L147-L151 WeakPolarHBondContact O-CG 3.27Å; L147-L151 PolarHBondContact O-N 2.86Å; E148-L151 PolarHBondContact O-N 2.81Å; E149-L151 PolarHBondContact O-N 3.34Å; L151-E154 PolarHBondContact O-N 3.41Å; L151-R155 WeakPolarHBondContact O-CB 3.44Å; L151-R155 PolarHBondContact O-N 3.47Å
152	E	90.7	Very high	90.8	Very high	62 Å²	62	108.6 Å²	108.6	29%	0.29	51%	0.505	S	S	.	.	H	α-helix	trans	-64.8	-45.9	176.1	-179.3	59.8	-139.2	0	0	111.3	E148 E149 E154 R155 Q156	E148-E152 WeakPolarHBondContact O-CB 3.08Å; E148-E152 PolarHBondContact O-N 3.35Å; E149-E152 PolarHBondContact O-N 3.5Å; E152-E154 PolarHBondContact O-N 2.97Å; E152-R155 VanDerWaalsContact CD-CZ 3.47Å; E152-R155 PolarHBondContact O-N 2.96Å; E152-R155 IonicContact OE1-CZ 2.64Å; E152-R155 VanDerWaalsContact OE1-CZ 3.31Å; E152-R155 IonicContact OE1-NE 2.92Å; E152-R155 IonicContact OE1-NH1 3.92Å; E152-R155 IonicContact OE1-NH2 3.91Å; E152-R155 PolarHBondContact OE1-NH2 2.91Å; E152-R155 IonicContact OE2-CZ 2.71Å; E152-R155 IonicContact OE2-NE 3.77Å; E152-R155 IonicContact OE2-NH1 3.96Å; E152-R155 PolarHBondContact OE2-NH1 2.96Å; E152-R155 IonicContact OE2-NH2 2.69Å; E152-R155 PolarHBondContact OE2-NH2 3.33Å; E152-Q156 WeakPolarHBondContact O-CG 3.35Å; E152-Q156 PolarHBondContact O-N 3.4Å; E152-Q156 PolarHBondContact OE1-NE2 2.82Å
153	V	93.4	Very high	91.2	Very high	68 Å²	68	104.9 Å²	104.9	41%	0.412	50%	0.497	S	S	.	.	H	α-helix	trans	-60	-45.7	175.1	171.6	0	0	0	0	110.8	E149 A150 R155 Q156 E157	E149-V153 WeakPolarHBondContact O-CG2 3.38Å; E149-V153 PolarHBondContact O-N 3.4Å; A150-V153 PolarHBondContact O-N 3.01Å; V153-R155 VanDerWaalsContact C-N 3.32Å; V153-R155 PolarHBondContact O-N 3.17Å; V153-Q156 PolarHBondContact O-N 3.42Å; V153-E157 HydrophobicContact CG1-CG 4.44Å; V153-E157 WeakPolarHBondContact O-CG 3.42Å; V153-E157 PolarHBondContact O-N 3.31Å
154	E	91.1	Very high	91.5	Very high	112 Å²	112	107.3 Å²	107.3	52%	0.523	51%	0.506	S	S	.	.	H	α-helix	trans	-60.1	-42.4	177.1	-175	177.3	-162.7	0	0	111.9	A150 L151 E152 Q156 E157 N158	A150-E154 PolarHBondContact O-N 2.95Å; L151-E154 PolarHBondContact O-N 3.41Å; E152-E154 PolarHBondContact O-N 2.97Å; E154-Q156 PolarHBondContact O-N 2.88Å; E154-E157 PolarHBondContact O-N 2.72Å; E154-N158 WeakPolarHBondContact O-CB 3.28Å; E154-N158 PolarHBondContact O-N 2.93Å
155	R	91.6	Very high	91.8	Very high	146 Å²	146	105.3 Å²	105.3	55%	0.551	50%	0.498	S	S	*	.	H	α-helix	trans	-61.3	-46	176.8	-168.9	-177.8	77.4	-138.9	3.1	111.5	L151 E152 V153 N158 E159	L151-R155 WeakPolarHBondContact O-CB 3.44Å; L151-R155 PolarHBondContact O-N 3.47Å; E152-R155 VanDerWaalsContact CD-CZ 3.47Å; E152-R155 PolarHBondContact O-N 2.96Å; E152-R155 IonicContact OE1-CZ 2.64Å; E152-R155 VanDerWaalsContact OE1-CZ 3.31Å; E152-R155 IonicContact OE1-NE 2.92Å; E152-R155 IonicContact OE1-NH1 3.92Å; E152-R155 IonicContact OE1-NH2 3.91Å; E152-R155 PolarHBondContact OE1-NH2 2.91Å; E152-R155 IonicContact OE2-CZ 2.71Å; E152-R155 IonicContact OE2-NE 3.77Å; E152-R155 IonicContact OE2-NH1 3.96Å; E152-R155 PolarHBondContact OE2-NH1 2.96Å; E152-R155 IonicContact OE2-NH2 2.69Å; E152-R155 PolarHBondContact OE2-NH2 3.33Å; V153-R155 VanDerWaalsContact C-N 3.32Å; V153-R155 PolarHBondContact O-N 3.17Å; R155-N158 PolarHBondContact O-N 3.16Å; R155-E159 WeakPolarHBondContact O-CB 3.4Å; R155-E159 PolarHBondContact O-N 2.91Å
156	Q	93.1	Very high	92	Very high	90 Å²	90	103.2 Å²	103.2	42%	0.421	49%	0.488	S	S	.	.	H	α-helix	trans	-64.2	-44.5	179.2	-70.6	177.7	15.8	0	0	111.9	E152 V153 E154 N158 E159 Q160	E152-Q156 WeakPolarHBondContact O-CG 3.35Å; E152-Q156 PolarHBondContact O-N 3.4Å; E152-Q156 PolarHBondContact OE1-NE2 2.82Å; V153-Q156 PolarHBondContact O-N 3.42Å; E154-Q156 PolarHBondContact O-N 2.88Å; Q156-N158 VanDerWaalsContact C-N 3.31Å; Q156-N158 PolarHBondContact O-N 3.14Å; Q156-E159 PolarHBondContact O-N 3.2Å; Q156-Q160 WeakPolarHBondContact O-CB 3.48Å; Q156-Q160 VanDerWaalsContact O-CG 3.31Å; Q156-Q160 WeakPolarHBondContact O-CG 3.08Å; Q156-Q160 PolarHBondContact O-N 3.47Å
157	E	92.7	Very high	92.1	Very high	83 Å²	83	105.2 Å²	105.2	39%	0.388	50%	0.495	S	S	.	.	H	α-helix	trans	-59	-43.4	175.3	-74.7	-171.4	168.3	0	0	111.5	V153 E154 R161 K228	V153-E157 HydrophobicContact CG1-CG 4.44Å; V153-E157 WeakPolarHBondContact O-CG 3.42Å; V153-E157 PolarHBondContact O-N 3.31Å; E154-E157 PolarHBondContact O-N 2.72Å; E157-R161 VanDerWaalsContact O-CB 3.29Å; E157-R161 WeakPolarHBondContact O-CB 3.26Å; E157-R161 PolarHBondContact O-N 3.08Å; E157-K228 IonicContact OE1-NZ 2.78Å; E157-K228 IonicContact OE2-NZ 3.43Å; E157-K228 PolarHBondContact OE2-NZ 3.46Å
158	N	91.1	Very high	92.1	Very high	103 Å²	103	104 Å²	104	55%	0.551	49%	0.487	S	S	*	.	H	α-helix	trans	-68.1	-40.2	-180	-168.9	42.3	0	0	0	112.1	E154 R155 Q156 R161 R162	E154-N158 WeakPolarHBondContact O-CB 3.28Å; E154-N158 PolarHBondContact O-N 2.93Å; R155-N158 PolarHBondContact O-N 3.16Å; Q156-N158 VanDerWaalsContact C-N 3.31Å; Q156-N158 PolarHBondContact O-N 3.14Å; N158-R161 PolarHBondContact O-N 3.22Å; N158-R162 WeakPolarHBondContact O-CB 3.41Å; N158-R162 PolarHBondContact O-N 3.42Å
159	E	93.1	Very high	92.3	Very high	113 Å²	113	102.5 Å²	102.5	53%	0.528	48%	0.48	S	S	.	.	H	α-helix	trans	-64.6	-46.5	175.1	-174.5	172.1	-161.6	0	0	111.7	R155 Q156 R161 R162 L163	R155-E159 WeakPolarHBondContact O-CB 3.4Å; R155-E159 PolarHBondContact O-N 2.91Å; Q156-E159 PolarHBondContact O-N 3.2Å; E159-R161 VanDerWaalsContact C-N 3.31Å; E159-R161 PolarHBondContact O-N 3.27Å; E159-R162 WeakPolarHBondContact O-CB 3.4Å; E159-R162 PolarHBondContact O-N 2.96Å; E159-L163 HydrophobicContact CG-CD1 4.29Å; E159-L163 WeakPolarHBondContact O-CG 3.27Å; E159-L163 PolarHBondContact O-N 2.99Å
160	Q	92.9	Very high	92.4	Very high	131 Å²	131	101.5 Å²	101.5	61%	0.612	48%	0.475	S	S	*	.	H	α-helix	trans	-59.4	-42.6	175.2	-73.4	-179.2	9.9	0	0	111.7	Q156 R162 L163 F164	Q156-Q160 WeakPolarHBondContact O-CB 3.48Å; Q156-Q160 VanDerWaalsContact O-CG 3.31Å; Q156-Q160 WeakPolarHBondContact O-CG 3.08Å; Q156-Q160 PolarHBondContact O-N 3.47Å; Q160-R162 PolarHBondContact O-N 3.22Å; Q160-L163 PolarHBondContact O-N 3.38Å; Q160-F164 WeakPolarHBondContact O-CB 3.03Å; Q160-F164 PolarHBondContact O-N 2.99Å
161	R	91.2	Very high	92.5	Very high	121 Å²	121	104.6 Å²	104.6	46%	0.457	48%	0.483	S	S	.	.	H	α-helix	trans	-60.4	-45.2	175.4	-177.5	-175.5	-67.1	-172.8	-0	111.4	E157 N158 E159 F164 I165	E157-R161 VanDerWaalsContact O-CB 3.29Å; E157-R161 WeakPolarHBondContact O-CB 3.26Å; E157-R161 PolarHBondContact O-N 3.08Å; N158-R161 PolarHBondContact O-N 3.22Å; E159-R161 VanDerWaalsContact C-N 3.31Å; E159-R161 PolarHBondContact O-N 3.27Å; R161-F164 PolarHBondContact O-N 2.95Å; R161-I165 HydrophobicContact CG-CD1 4.03Å; R161-I165 VanDerWaalsContact O-CG1 3.32Å; R161-I165 WeakPolarHBondContact O-CG1 3.45Å; R161-I165 PolarHBondContact O-N 2.84Å
162	R	92.3	Very high	92.4	Very high	169 Å²	169	103.9 Å²	103.9	64%	0.638	48%	0.477	S	S	*	.	H	α-helix	trans	-61.1	-46.1	177.1	-177.2	-176.4	175.6	-162.9	0.7	111.4	N158 E159 Q160 F164 I165 Q166	N158-R162 WeakPolarHBondContact O-CB 3.41Å; N158-R162 PolarHBondContact O-N 3.42Å; E159-R162 WeakPolarHBondContact O-CB 3.4Å; E159-R162 PolarHBondContact O-N 2.96Å; Q160-R162 PolarHBondContact O-N 3.22Å; R162-F164 VanDerWaalsContact C-N 3.34Å; R162-F164 PolarHBondContact O-N 3.45Å; R162-I165 PolarHBondContact O-N 2.97Å; R162-Q166 WeakPolarHBondContact O-CG 3.44Å; R162-Q166 PolarHBondContact O-N 3.46Å
163	L	94.8	Very high	92.4	Very high	83 Å²	83	106 Å²	106	44%	0.435	49%	0.487	S	S	.	.	H	α-helix	trans	-63.4	-39.5	177.6	-70.9	172.9	0	0	0	112.1	E159 Q160 Q166 K167	E159-L163 HydrophobicContact CG-CD1 4.29Å; E159-L163 WeakPolarHBondContact O-CG 3.27Å; E159-L163 PolarHBondContact O-N 2.99Å; Q160-L163 PolarHBondContact O-N 3.38Å; L163-Q166 PolarHBondContact O-N 3.49Å; L163-K167 WeakPolarHBondContact O-CG 3.41Å; L163-K167 PolarHBondContact O-N 3.39Å
164	F	93.7	Very high	92.4	Very high	124 Å²	124	106.7 Å²	106.7	54%	0.544	49%	0.488	S	S	.	.	H	α-helix	trans	-63.1	-48	176.4	-175.5	-95.2	0	0	0	111.5	Q160 R161 R162 Q166 K167 E168	Q160-F164 WeakPolarHBondContact O-CB 3.03Å; Q160-F164 PolarHBondContact O-N 2.99Å; R161-F164 PolarHBondContact O-N 2.95Å; R162-F164 VanDerWaalsContact C-N 3.34Å; R162-F164 PolarHBondContact O-N 3.45Å; F164-Q166 VanDerWaalsContact C-N 3.35Å; F164-Q166 PolarHBondContact O-N 3.35Å; F164-K167 PolarHBondContact O-N 2.91Å; F164-E168 HydrophobicContact CD1-CG 4.2Å; F164-E168 HydrophobicContact CE1-CG 3.78Å; F164-E168 VanDerWaalsContact CE1-OE2 3.23Å; F164-E168 WeakPolarHBondContact CE1-OE2 3.21Å; F164-E168 HydrophobicContact CZ-CG 4.05Å; F164-E168 PolarHBondContact O-N 2.95Å
165	I	92.9	Very high	92.4	Very high	60 Å²	60	105.1 Å²	105.1	31%	0.308	48%	0.483	S	S	.	.	H	α-helix	trans	-59.6	-45.4	177.2	-68.1	166.4	0	0	0	110.8	R161 R162 K167 E168 E169	R161-I165 HydrophobicContact CG-CD1 4.03Å; R161-I165 VanDerWaalsContact O-CG1 3.32Å; R161-I165 WeakPolarHBondContact O-CG1 3.45Å; R161-I165 PolarHBondContact O-N 2.84Å; R162-I165 PolarHBondContact O-N 2.97Å; I165-K167 VanDerWaalsContact C-N 3.34Å; I165-K167 PolarHBondContact O-N 3.29Å; I165-E168 PolarHBondContact O-N 3.18Å; I165-E169 HydrophobicContact CG2-CG 4.44Å; I165-E169 WeakPolarHBondContact O-CG 3.33Å; I165-E169 PolarHBondContact O-N 3.09Å
166	Q	93.6	Very high	92.3	Very high	76 Å²	76	105.1 Å²	105.1	36%	0.355	49%	0.487	S	S	.	.	H	α-helix	trans	-61.4	-40.9	177.3	-75.3	-178.5	-3	0	0	112.5	R162 L163 F164 E169 Q170	R162-Q166 WeakPolarHBondContact O-CG 3.44Å; R162-Q166 PolarHBondContact O-N 3.46Å; L163-Q166 PolarHBondContact O-N 3.49Å; F164-Q166 VanDerWaalsContact C-N 3.35Å; F164-Q166 PolarHBondContact O-N 3.35Å; Q166-E169 PolarHBondContact O-N 2.85Å; Q166-Q170 WeakPolarHBondContact O-CB 3.47Å; Q166-Q170 VanDerWaalsContact O-CG 3.27Å; Q166-Q170 WeakPolarHBondContact O-CG 3.44Å; Q166-Q170 PolarHBondContact O-N 3.38Å
167	K	94.5	Very high	92.2	Very high	137 Å²	137	109.2 Å²	109.2	60%	0.596	50%	0.498	S	S	*	.	H	α-helix	trans	-64.2	-43.2	175.4	-76.4	179.1	-178.8	179.6	0	111.7	L163 F164 I165 Q170 L171	L163-K167 WeakPolarHBondContact O-CG 3.41Å; L163-K167 PolarHBondContact O-N 3.39Å; F164-K167 PolarHBondContact O-N 2.91Å; I165-K167 VanDerWaalsContact C-N 3.34Å; I165-K167 PolarHBondContact O-N 3.29Å; K167-Q170 PolarHBondContact O-N 3.2Å; K167-L171 WeakPolarHBondContact O-CB 3.41Å; K167-L171 VanDerWaalsContact O-CG 3.31Å; K167-L171 WeakPolarHBondContact O-CG 3.36Å; K167-L171 PolarHBondContact O-N 3.34Å
168	E	90.2	Very high	92.2	Very high	82 Å²	82	112.2 Å²	112.2	38%	0.383	51%	0.51	S	S	.	.	H	α-helix	trans	-61	-46.2	175.7	-73.6	-164.1	118.7	0	0	111.6	F164 I165 Q170 L171 Q172	F164-E168 HydrophobicContact CD1-CG 4.2Å; F164-E168 HydrophobicContact CE1-CG 3.78Å; F164-E168 VanDerWaalsContact CE1-OE2 3.23Å; F164-E168 WeakPolarHBondContact CE1-OE2 3.21Å; F164-E168 HydrophobicContact CZ-CG 4.05Å; F164-E168 PolarHBondContact O-N 2.95Å; I165-E168 PolarHBondContact O-N 3.18Å; E168-Q170 PolarHBondContact O-N 3.19Å; E168-L171 PolarHBondContact O-N 3.36Å; E168-Q172 WeakPolarHBondContact O-CB 3.45Å; E168-Q172 WeakPolarHBondContact O-CG 2.97Å; E168-Q172 PolarHBondContact O-N 3.43Å
169	E	91.4	Very high	92	Very high	103 Å²	103	108.8 Å²	108.8	48%	0.481	49%	0.492	S	S	.	.	H	α-helix	trans	-61.5	-42.6	176.9	-73.8	177.8	176.9	0	0	112	I165 Q166 Q172 Q173	I165-E169 HydrophobicContact CG2-CG 4.44Å; I165-E169 WeakPolarHBondContact O-CG 3.33Å; I165-E169 PolarHBondContact O-N 3.09Å; Q166-E169 PolarHBondContact O-N 2.85Å; E169-Q172 PolarHBondContact O-N 3.25Å; E169-Q173 WeakPolarHBondContact O-CG 3.45Å; E169-Q173 PolarHBondContact O-N 3.22Å
170	Q	94	Very high	91.8	Very high	117 Å²	117	110.2 Å²	110.2	55%	0.547	50%	0.496	S	S	.	.	H	α-helix	trans	-63	-45.1	175.7	-76.9	179.3	-0.4	0	0	112	Q166 K167 E168 Q172 Q173 I174	Q166-Q170 WeakPolarHBondContact O-CB 3.47Å; Q166-Q170 VanDerWaalsContact O-CG 3.27Å; Q166-Q170 WeakPolarHBondContact O-CG 3.44Å; Q166-Q170 PolarHBondContact O-N 3.38Å; K167-Q170 PolarHBondContact O-N 3.2Å; E168-Q170 PolarHBondContact O-N 3.19Å; Q170-Q172 VanDerWaalsContact C-N 3.33Å; Q170-Q172 PolarHBondContact O-N 2.98Å; Q170-Q173 PolarHBondContact O-N 2.85Å; Q170-I174 VanDerWaalsContact O-CG1 3.32Å; Q170-I174 WeakPolarHBondContact O-CG1 3.48Å; Q170-I174 PolarHBondContact O-N 2.93Å
171	L	92.5	Very high	91.7	Very high	120 Å²	120	108.9 Å²	108.9	63%	0.628	49%	0.49	S	S	*	.	H	α-helix	trans	-62.1	-41.6	176.5	-73.3	173.7	0	0	0	111.4	K167 E168 I174 L175	K167-L171 WeakPolarHBondContact O-CB 3.41Å; K167-L171 VanDerWaalsContact O-CG 3.31Å; K167-L171 WeakPolarHBondContact O-CG 3.36Å; K167-L171 PolarHBondContact O-N 3.34Å; E168-L171 PolarHBondContact O-N 3.36Å; L171-I174 PolarHBondContact O-N 2.92Å; L171-L175 WeakPolarHBondContact O-CB 3.49Å; L171-L175 PolarHBondContact O-N 3.31Å
172	Q	88.7	Confident	91.6	Very high	81 Å²	81	105.1 Å²	105.1	38%	0.379	49%	0.485	S	S	.	.	H	α-helix	trans	-62.6	-41.5	174.4	-74.4	179.7	3.5	0	0	112.1	E168 E169 Q170 L175 K176	E168-Q172 WeakPolarHBondContact O-CB 3.45Å; E168-Q172 WeakPolarHBondContact O-CG 2.97Å; E168-Q172 PolarHBondContact O-N 3.43Å; E169-Q172 PolarHBondContact O-N 3.25Å; Q170-Q172 VanDerWaalsContact C-N 3.33Å; Q170-Q172 PolarHBondContact O-N 2.98Å; Q172-L175 PolarHBondContact O-N 3.14Å; Q172-K176 WeakPolarHBondContact O-CB 3.44Å; Q172-K176 VanDerWaalsContact O-CG 3.29Å; Q172-K176 WeakPolarHBondContact O-CG 3.43Å; Q172-K176 PolarHBondContact O-N 3.19Å
173	Q	91.3	Very high	91.4	Very high	106 Å²	106	98.4 Å²	98.4	50%	0.495	46%	0.46	S	S	.	.	H	α-helix	trans	-64	-43.1	175.2	-74	-177.7	21.2	0	0	112.1	E169 Q170 K176 R177	E169-Q173 WeakPolarHBondContact O-CG 3.45Å; E169-Q173 PolarHBondContact O-N 3.22Å; Q170-Q173 PolarHBondContact O-N 2.85Å; Q173-K176 PolarHBondContact O-N 3.01Å; Q173-R177 WeakPolarHBondContact O-CG 3.41Å; Q173-R177 PolarHBondContact O-N 2.91Å
174	I	94	Very high	91.1	Very high	84 Å²	84	98.2 Å²	98.2	43%	0.431	46%	0.459	S	S	.	.	H	α-helix	trans	-62.3	-44.6	176.6	-69.3	166.6	0	0	0	110.3	Q170 L171 R177 K178	Q170-I174 VanDerWaalsContact O-CG1 3.32Å; Q170-I174 WeakPolarHBondContact O-CG1 3.48Å; Q170-I174 PolarHBondContact O-N 2.93Å; L171-I174 PolarHBondContact O-N 2.92Å; I174-R177 PolarHBondContact O-N 2.69Å; I174-K178 HydrophobicContact CG2-CD 4.34Å; I174-K178 WeakPolarHBondContact O-CG 3.39Å; I174-K178 PolarHBondContact O-N 3.41Å
175	L	90.6	Very high	90.9	Very high	78 Å²	78	95.9 Å²	95.9	41%	0.408	45%	0.452	S	S	.	.	H	α-helix	trans	-62.9	-45.1	178.1	-171.1	69.6	0	0	0	111.5	L171 Q172 R177 K178 N179 L212	L171-L175 WeakPolarHBondContact O-CB 3.49Å; L171-L175 PolarHBondContact O-N 3.31Å; Q172-L175 PolarHBondContact O-N 3.14Å; L175-R177 VanDerWaalsContact C-N 3.32Å; L175-R177 PolarHBondContact O-N 2.74Å; L175-K178 PolarHBondContact O-N 2.83Å; L175-N179 WeakPolarHBondContact O-CB 3.37Å; L175-N179 PolarHBondContact O-N 2.64Å; L175-L212 HydrophobicContact CD2-CD1 3.78Å
176	K	90	Very high	90.7	Very high	146 Å²	146	95.4 Å²	95.4	64%	0.635	45%	0.449	S	S	*	.	H	α-helix	trans	-59.5	-41.2	175.1	-75.8	177	178.1	-177.6	0	111.9	Q172 Q173 K180	Q172-K176 WeakPolarHBondContact O-CB 3.44Å; Q172-K176 VanDerWaalsContact O-CG 3.29Å; Q172-K176 WeakPolarHBondContact O-CG 3.43Å; Q172-K176 PolarHBondContact O-N 3.19Å; Q173-K176 PolarHBondContact O-N 3.01Å; K176-K180 WeakPolarHBondContact O-CB 3.35Å; K176-K180 PolarHBondContact O-N 3.37Å
177	R	90.9	Very high	90.4	Very high	177 Å²	177	94.6 Å²	94.6	67%	0.668	45%	0.447	S	S	*	.	H	α-helix	trans	-65	-45.6	175.6	-74.1	177.3	-174.5	-175.5	3.7	112.1	Q173 I174 L175 K180 Q181	Q173-R177 WeakPolarHBondContact O-CG 3.41Å; Q173-R177 PolarHBondContact O-N 2.91Å; I174-R177 PolarHBondContact O-N 2.69Å; L175-R177 VanDerWaalsContact C-N 3.32Å; L175-R177 PolarHBondContact O-N 2.74Å; R177-K180 PolarHBondContact O-N 3.03Å; R177-Q181 PolarHBondContact O-N 3.07Å
178	K	91.8	Very high	90.1	Very high	145 Å²	145	96.1 Å²	96.1	63%	0.63	46%	0.456	S	S	*	.	H	α-helix	trans	-62.1	-42.6	176.7	-74.9	-175.1	176.6	-173.9	0	112.1	I174 L175 Q181 A182	I174-K178 HydrophobicContact CG2-CD 4.34Å; I174-K178 WeakPolarHBondContact O-CG 3.39Å; I174-K178 PolarHBondContact O-N 3.41Å; L175-K178 PolarHBondContact O-N 2.83Å; K178-Q181 PolarHBondContact O-N 3.08Å; K178-A182 WeakPolarHBondContact O-CB 3.45Å; K178-A182 PolarHBondContact O-N 3.32Å
179	N	88	Confident	90.1	Very high	32 Å²	32	96.9 Å²	96.9	17%	0.171	47%	0.471	C	S	.	.	H	α-helix	trans	-63.5	-44.4	176.6	-167.3	11.2	0	0	0	111.3	L175 Q181 A182 F183	L175-N179 WeakPolarHBondContact O-CB 3.37Å; L175-N179 PolarHBondContact O-N 2.64Å; N179-Q181 VanDerWaalsContact C-N 3.35Å; N179-Q181 PolarHBondContact O-N 2.94Å; N179-A182 PolarHBondContact O-N 3.34Å; N179-F183 PolarHBondContact O-N 3.27Å
180	K	89.6	Confident	89.7	Confident	143 Å²	143	93.4 Å²	93.4	62%	0.622	46%	0.458	S	S	*	.	H	α-helix	trans	-59.7	-43.2	174.3	-173.1	-177.8	179.2	-175	0	112.3	K176 R177 F183 L184	K176-K180 WeakPolarHBondContact O-CB 3.35Å; K176-K180 PolarHBondContact O-N 3.37Å; R177-K180 PolarHBondContact O-N 3.03Å; K180-F183 PolarHBondContact O-N 3.11Å; K180-L184 WeakPolarHBondContact O-CG 3.35Å; K180-L184 PolarHBondContact O-N 2.9Å; K180-L184 VanDerWaalsContact O-N 3.11Å
181	Q	91	Very high	89.3	Confident	102 Å²	102	96.2 Å²	96.2	48%	0.477	48%	0.477	S	S	.	.	H	α-helix	trans	-64.3	-48	178.4	-172.4	63.2	39.4	0	0	111.3	R177 K178 N179 F183 L184 D185	R177-Q181 PolarHBondContact O-N 3.07Å; K178-Q181 PolarHBondContact O-N 3.08Å; N179-Q181 VanDerWaalsContact C-N 3.35Å; N179-Q181 PolarHBondContact O-N 2.94Å; Q181-F183 PolarHBondContact O-N 3.22Å; Q181-L184 WeakPolarHBondContact O-CB 3.35Å; Q181-L184 PolarHBondContact O-N 2.85Å; Q181-D185 PolarHBondContact NE2-OD1 3.2Å; Q181-D185 VanDerWaalsContact O-CG 3.27Å; Q181-D185 PolarHBondContact O-N 2.92Å
182	A	88.9	Confident	89	Confident	43 Å²	43	94.7 Å²	94.7	36%	0.355	47%	0.469	S	S	.	.	H	α-helix	trans	-58.2	-37.3	177.9	0	0	0	0	0	112.3	K178 N179 E186	K178-A182 WeakPolarHBondContact O-CB 3.45Å; K178-A182 PolarHBondContact O-N 3.32Å; N179-A182 PolarHBondContact O-N 3.34Å; A182-E186 WeakPolarHBondContact O-CB 3.44Å; A182-E186 PolarHBondContact O-N 3.06Å
183	F	87.3	Confident	88.9	Confident	28 Å²	28	95 Å²	95	12%	0.123	48%	0.477	C	S	.	.	H	α-helix	trans	-66	-38.9	174.1	-179.3	-114.4	0	0	0	113.1	N179 K180 Q181 E186 L187 L197 L198 H201	N179-F183 PolarHBondContact O-N 3.27Å; K180-F183 PolarHBondContact O-N 3.11Å; Q181-F183 PolarHBondContact O-N 3.22Å; F183-E186 PolarHBondContact O-N 3.42Å; F183-L187 HydrophobicContact CD1-CD1 3.99Å; F183-L187 HydrophobicContact CE1-CD1 3.49Å; F183-L187 VanDerWaalsContact CE1-CD1 3.49Å; F183-L187 HydrophobicContact CE1-CG 4.27Å; F183-L187 HydrophobicContact CE2-CD1 4.42Å; F183-L187 HydrophobicContact CE2-CG 4.34Å; F183-L187 HydrophobicContact CZ-CD1 3.73Å; F183-L187 HydrophobicContact CZ-CD2 4.3Å; F183-L187 HydrophobicContact CZ-CG 4.06Å; F183-L187 WeakPolarHBondContact O-CG 3.4Å; F183-L187 PolarHBondContact O-N 3.26Å; F183-L197 HydrophobicContact CE2-CB 4.42Å; F183-L198 HydrophobicContact CE1-CD2 4.19Å; F183-L198 HydrophobicContact CZ-CD2 3.6Å; F183-L198 HydrophobicContact CZ-CG 4.2Å; F183-H201 HydrophobicContact CD2-CB 3.49Å; F183-H201 VanDerWaalsContact CD2-CB 3.49Å; F183-H201 AromaticContact CD2-CD2 3.45Å; F183-H201 VanDerWaalsContact CD2-CD2 3.45Å; F183-H201 WeakPolarHBondContact CD2-CD2 3.39Å; F183-H201 AromaticContact CD2-CG 3.46Å; F183-H201 VanDerWaalsContact CD2-CG 3.46Å; F183-H201 HydrophobicContact CE2-CB 3.5Å; F183-H201 AromaticContact CE2-CG 3.83Å; F183-H201 HydrophobicContact CG-CB 4.36Å; F183-H201 AromaticContact CG-CD2 3.54Å; F183-H201 AromaticContact CG-CG 3.85Å; F183-H201 AromaticContact CG-NE2 3.97Å; F183-H201 HydrophobicContact CZ-CB 4.39Å
184	L	88.1	Confident	88.6	Confident	78 Å²	78	94.2 Å²	94.2	41%	0.408	48%	0.48	S	S	.	.	H	α-helix	trans	-67	-43.4	175.4	-69.1	172.6	0	0	0	111.6	K180 Q181 E186 L187 E188	K180-L184 WeakPolarHBondContact O-CG 3.35Å; K180-L184 PolarHBondContact O-N 2.9Å; K180-L184 VanDerWaalsContact O-N 3.11Å; Q181-L184 WeakPolarHBondContact O-CB 3.35Å; Q181-L184 PolarHBondContact O-N 2.85Å; L184-E186 VanDerWaalsContact C-N 3.27Å; L184-E186 PolarHBondContact O-N 3.24Å; L184-L187 HydrophobicContact CD2-CD1 4.46Å; L184-L187 WeakPolarHBondContact O-CB 3.32Å; L184-L187 PolarHBondContact O-N 3.44Å; L184-E188 PolarHBondContact O-N 3.37Å
185	D	90.5	Very high	88.3	Confident	75 Å²	75	93.9 Å²	93.9	40%	0.401	49%	0.489	S	S	.	.	H	α-helix	trans	-62.9	-36.3	177.8	-59.2	-15.7	0	0	0	111	Q181 E188 S189	Q181-D185 PolarHBondContact NE2-OD1 3.2Å; Q181-D185 VanDerWaalsContact O-CG 3.27Å; Q181-D185 PolarHBondContact O-N 2.92Å; D185-E188 PolarHBondContact O-N 3Å; D185-S189 WeakPolarHBondContact O-CB 3.29Å; D185-S189 PolarHBondContact O-N 3.13Å; D185-S189 PolarHBondContact O-OG 2.65Å
186	E	88.4	Confident	88.2	Confident	50 Å²	50	94.7 Å²	94.7	23%	0.234	49%	0.493	C	S	.	.	H	α-helix	trans	-69.1	-37.9	175.1	-169.2	167.4	-167	0	0	112	A182 F183 L184 E188 S190 L197 R204	A182-E186 WeakPolarHBondContact O-CB 3.44Å; A182-E186 PolarHBondContact O-N 3.06Å; F183-E186 PolarHBondContact O-N 3.42Å; L184-E186 VanDerWaalsContact C-N 3.27Å; L184-E186 PolarHBondContact O-N 3.24Å; E186-E188 VanDerWaalsContact C-N 3.33Å; E186-S190 VanDerWaalsContact O-CB 3.29Å; E186-S190 WeakPolarHBondContact O-CB 3.31Å; E186-S190 PolarHBondContact O-N 2.99Å; E186-S190 VanDerWaalsContact O-N 3.11Å; E186-S190 PolarHBondContact O-OG 3.01Å; E186-L197 HydrophobicContact CG-CD2 4.01Å; E186-R204 IonicContact OE2-NH1 3.52Å
187	L	87.2	Confident	87.9	Confident	59 Å²	59	87.9 Å²	87.9	31%	0.309	46%	0.464	S	S	.	.	H	α-helix	trans	-65.5	-33.9	172.1	-76.9	169.4	0	0	0	113	F183 L184 V194 L197	F183-L187 HydrophobicContact CD1-CD1 3.99Å; F183-L187 HydrophobicContact CE1-CD1 3.49Å; F183-L187 VanDerWaalsContact CE1-CD1 3.49Å; F183-L187 HydrophobicContact CE1-CG 4.27Å; F183-L187 HydrophobicContact CE2-CD1 4.42Å; F183-L187 HydrophobicContact CE2-CG 4.34Å; F183-L187 HydrophobicContact CZ-CD1 3.73Å; F183-L187 HydrophobicContact CZ-CD2 4.3Å; F183-L187 HydrophobicContact CZ-CG 4.06Å; F183-L187 WeakPolarHBondContact O-CG 3.4Å; F183-L187 PolarHBondContact O-N 3.26Å; L184-L187 HydrophobicContact CD2-CD1 4.46Å; L184-L187 WeakPolarHBondContact O-CB 3.32Å; L184-L187 PolarHBondContact O-N 3.44Å; L187-V194 HydrophobicContact CD2-CG1 4.3Å; L187-L197 HydrophobicContact CD2-CB 4.33Å; L187-L197 HydrophobicContact CD2-CD1 3.73Å
188	E	88.6	Confident	87.7	Confident	169 Å²	169	83 Å²	83	79%	0.79	45%	0.451	S	S	*	.	H	α-helix	trans	-77.6	-38.9	-179.8	-176	176.5	-174.7	0	0	112.2	L184 D185 E186	L184-E188 PolarHBondContact O-N 3.37Å; D185-E188 PolarHBondContact O-N 3Å; E186-E188 VanDerWaalsContact C-N 3.33Å
189	S	89	Confident	87.4	Confident	99 Å²	99	78.5 Å²	78.5	69%	0.692	44%	0.44	S	S	*	.	H	α-helix	trans	-90.4	-18.9	-173.2	58.6	0	0	0	0	115	D185	D185-S189 WeakPolarHBondContact O-CB 3.29Å; D185-S189 PolarHBondContact O-N 3.13Å; D185-S189 PolarHBondContact O-OG 2.65Å
190	S	84.1	Confident	87.3	Confident	30 Å²	30	81 Å²	81	21%	0.21	45%	0.451	C	S	.	.			trans	-105.2	135.9	-176.8	72.6	0	0	0	0	112.9	E186 L192 L197	E186-S190 VanDerWaalsContact O-CB 3.29Å; E186-S190 WeakPolarHBondContact O-CB 3.31Å; E186-S190 PolarHBondContact O-N 2.99Å; E186-S190 VanDerWaalsContact O-N 3.11Å; E186-S190 PolarHBondContact O-OG 3.01Å; S190-L192 PolarHBondContact O-N 3.46Å; S190-L197 VanDerWaalsContact OG-CD1 3.26Å; S190-L197 WeakPolarHBondContact OG-CD1 3.47Å
191	D	85.3	Confident	87.2	Confident	176 Å²	176	76.1 Å²	76.1	94%	0.941	43%	0.43	S	S	*	.			trans	-82.4	12	173.9	-64.1	-44.9	0	0	0	112.8
192	L	85.5	Confident	86.9	Confident	88 Å²	88	77.9 Å²	77.9	46%	0.461	44%	0.437	S	S	.	.	S	Bend	trans	-72.5	148.4	-177.1	-70.7	175.1	0	0	0	111.1	S190 V194 L196 L197	S190-L192 PolarHBondContact O-N 3.46Å; L192-V194 PolarHBondContact O-N 2.95Å; L192-L196 HydrophobicContact CD1-CD2 4.48Å; L192-L197 HydrophobicContact CB-CD1 4.24Å; L192-L197 HydrophobicContact CB-CD2 4.22Å; L192-L197 HydrophobicContact CB-CG 4.08Å; L192-L197 HydrophobicContact CD1-CD2 4.06Å
193	P	86.8	Confident	86.7	Confident	87 Å²	87	80.4 Å²	80.4	57%	0.565	44%	0.444	S	S	*	.			trans	-56.3	129.1	174	-23.2	32.6	0	0	0	111.2	A195 L196 L197	P193-A195 PolarHBondContact O-N 3.3Å; P193-L196 PolarHBondContact O-N 3.31Å; P193-L197 PolarHBondContact O-N 3.11Å
194	V	84.9	Confident	86.5	Confident	90 Å²	90	83.5 Å²	83.5	55%	0.545	46%	0.455	S	S	.	.	H	α-helix	trans	-49.6	-35.9	-177.7	179.1	0	0	0	0	112.8	L187 L192 L196 L197 L198	L187-V194 HydrophobicContact CD2-CG1 4.3Å; L192-V194 PolarHBondContact O-N 2.95Å; V194-L196 VanDerWaalsContact C-N 3.31Å; V194-L196 PolarHBondContact O-N 2.91Å; V194-L197 PolarHBondContact O-N 3.47Å; V194-L198 HydrophobicContact CG1-CD1 3.86Å; V194-L198 HydrophobicContact CG1-CG 4.3Å; V194-L198 WeakPolarHBondContact O-CB 3.45Å; V194-L198 VanDerWaalsContact O-CG 3.3Å; V194-L198 WeakPolarHBondContact O-CG 3.39Å; V194-L198 PolarHBondContact O-N 2.93Å
195	A	88.3	Confident	86.2	Confident	76 Å²	76	81 Å²	81	63%	0.628	44%	0.444	S	S	*	.	H	α-helix	trans	-60.9	-36.3	178.4	0	0	0	0	0	113.5	P193 A199	P193-A195 PolarHBondContact O-N 3.3Å; A195-A199 PolarHBondContact O-N 2.95Å
196	L	87.5	Confident	85.7	Confident	95 Å²	95	80.7 Å²	80.7	50%	0.497	45%	0.445	S	S	.	.	H	α-helix	trans	-75.8	-42	-179	-167.7	147.3	0	0	0	111.1	L192 P193 V194 L198 A199 Q200	L192-L196 HydrophobicContact CD1-CD2 4.48Å; P193-L196 PolarHBondContact O-N 3.31Å; V194-L196 VanDerWaalsContact C-N 3.31Å; V194-L196 PolarHBondContact O-N 2.91Å; L196-L198 VanDerWaalsContact C-N 3.33Å; L196-L198 PolarHBondContact O-N 2.98Å; L196-A199 WeakPolarHBondContact O-CB 3.4Å; L196-A199 PolarHBondContact O-N 2.95Å; L196-Q200 PolarHBondContact O-N 2.99Å
197	L	84.2	Confident	85.2	Confident	4 Å²	4	83.8 Å²	83.8	2%	0.021	46%	0.459	C	S	.	.	H	α-helix	trans	-61.2	-41.5	174.3	-66.3	171.3	0	0	0	111.7	F183 E186 L187 S190 L192 P193 V194 A199 Q200 H201	F183-L197 HydrophobicContact CE2-CB 4.42Å; E186-L197 HydrophobicContact CG-CD2 4.01Å; L187-L197 HydrophobicContact CD2-CB 4.33Å; L187-L197 HydrophobicContact CD2-CD1 3.73Å; S190-L197 VanDerWaalsContact OG-CD1 3.26Å; S190-L197 WeakPolarHBondContact OG-CD1 3.47Å; L192-L197 HydrophobicContact CB-CD1 4.24Å; L192-L197 HydrophobicContact CB-CD2 4.22Å; L192-L197 HydrophobicContact CB-CG 4.08Å; L192-L197 HydrophobicContact CD1-CD2 4.06Å; P193-L197 PolarHBondContact O-N 3.11Å; V194-L197 PolarHBondContact O-N 3.47Å; L197-A199 VanDerWaalsContact C-N 3.34Å; L197-A199 PolarHBondContact O-N 2.72Å; L197-Q200 PolarHBondContact O-N 3.28Å; L197-H201 WeakPolarHBondContact O-CB 3.23Å; L197-H201 PolarHBondContact O-N 2.74Å
198	L	86.5	Confident	84.5	Confident	75 Å²	75	83.5 Å²	83.5	39%	0.393	46%	0.458	S	S	.	.	H	α-helix	trans	-62	-39.6	174.8	-77.1	167.7	0	0	0	112.4	F183 V194 L196 K202	F183-L198 HydrophobicContact CE1-CD2 4.19Å; F183-L198 HydrophobicContact CZ-CD2 3.6Å; F183-L198 HydrophobicContact CZ-CG 4.2Å; V194-L198 HydrophobicContact CG1-CD1 3.86Å; V194-L198 HydrophobicContact CG1-CG 4.3Å; V194-L198 WeakPolarHBondContact O-CB 3.45Å; V194-L198 VanDerWaalsContact O-CG 3.3Å; V194-L198 WeakPolarHBondContact O-CG 3.39Å; V194-L198 PolarHBondContact O-N 2.93Å; L196-L198 VanDerWaalsContact C-N 3.33Å; L196-L198 PolarHBondContact O-N 2.98Å; L198-K202 WeakPolarHBondContact O-CG 3.41Å; L198-K202 PolarHBondContact O-N 3.34Å; L198-K202 VanDerWaalsContact O-N 3.09Å
199	A	86.5	Confident	83.8	Confident	49 Å²	49	81.4 Å²	81.4	41%	0.405	45%	0.448	S	S	.	.	H	α-helix	trans	-64.5	-49.1	176.2	0	0	0	0	0	110.9	A195 L196 L197 H201 K202 D203	A195-A199 PolarHBondContact O-N 2.95Å; L196-A199 WeakPolarHBondContact O-CB 3.4Å; L196-A199 PolarHBondContact O-N 2.95Å; L197-A199 VanDerWaalsContact C-N 3.34Å; L197-A199 PolarHBondContact O-N 2.72Å; A199-H201 VanDerWaalsContact C-N 3.32Å; A199-H201 PolarHBondContact O-N 3.42Å; A199-K202 WeakPolarHBondContact O-CB 3.37Å; A199-K202 PolarHBondContact O-N 2.97Å; A199-K202 VanDerWaalsContact O-N 3.14Å; A199-D203 PolarHBondContact O-N 3.5Å
200	Q	85.8	Confident	82.9	Confident	84 Å²	84	83.3 Å²	83.3	39%	0.393	45%	0.448	S	S	.	.	H	α-helix	trans	-61.4	-38.2	178.9	-169	177.7	2	0	0	112.7	L196 L197 D203 R204	L196-Q200 PolarHBondContact O-N 2.99Å; L197-Q200 PolarHBondContact O-N 3.28Å; Q200-D203 PolarHBondContact O-N 3.26Å; Q200-R204 WeakPolarHBondContact O-CB 3.27Å; Q200-R204 PolarHBondContact O-N 2.97Å
201	H	86.8	Confident	82	Confident	41 Å²	41	88.6 Å²	88.6	19%	0.19	47%	0.469	C	S	.	.	H	α-helix	trans	-68.7	-35.7	176	178.4	-92.8	0	0	0	113	F183 L197 A199 R204 S205	F183-H201 HydrophobicContact CD2-CB 3.49Å; F183-H201 VanDerWaalsContact CD2-CB 3.49Å; F183-H201 AromaticContact CD2-CD2 3.45Å; F183-H201 VanDerWaalsContact CD2-CD2 3.45Å; F183-H201 WeakPolarHBondContact CD2-CD2 3.39Å; F183-H201 AromaticContact CD2-CG 3.46Å; F183-H201 VanDerWaalsContact CD2-CG 3.46Å; F183-H201 HydrophobicContact CE2-CB 3.5Å; F183-H201 AromaticContact CE2-CG 3.83Å; F183-H201 HydrophobicContact CG-CB 4.36Å; F183-H201 AromaticContact CG-CD2 3.54Å; F183-H201 AromaticContact CG-CG 3.85Å; F183-H201 AromaticContact CG-NE2 3.97Å; F183-H201 HydrophobicContact CZ-CB 4.39Å; L197-H201 WeakPolarHBondContact O-CB 3.23Å; L197-H201 PolarHBondContact O-N 2.74Å; A199-H201 VanDerWaalsContact C-N 3.32Å; A199-H201 PolarHBondContact O-N 3.42Å; H201-R204 PolarHBondContact O-N 3.41Å; H201-S205 PolarHBondContact CE1-OG 2.89Å; H201-S205 VanDerWaalsContact CE1-OG 3.29Å; H201-S205 VanDerWaalsContact O-CB 3.3Å; H201-S205 WeakPolarHBondContact O-CB 3.34Å; H201-S205 PolarHBondContact O-N 3.25Å; H201-S205 PolarHBondContact O-OG 2.92Å
202	K	85.7	Confident	80.9	Confident	140 Å²	140	84.7 Å²	84.7	61%	0.609	45%	0.447	S	S	*	.	H	α-helix	trans	-63.1	-43.8	173	-76.3	177.8	-176.3	-176.2	0	111.1	L198 A199 S205 T206	L198-K202 WeakPolarHBondContact O-CG 3.41Å; L198-K202 PolarHBondContact O-N 3.34Å; L198-K202 VanDerWaalsContact O-N 3.09Å; A199-K202 WeakPolarHBondContact O-CB 3.37Å; A199-K202 PolarHBondContact O-N 2.97Å; A199-K202 VanDerWaalsContact O-N 3.14Å; K202-S205 PolarHBondContact O-N 3.44Å; K202-T206 WeakPolarHBondContact O-CG2 3.31Å; K202-T206 PolarHBondContact O-N 2.64Å; K202-T206 PolarHBondContact O-OG1 2.69Å
203	D	84.3	Confident	79.3	Confident	95 Å²	95	87.8 Å²	87.8	51%	0.508	46%	0.46	S	S	.	.	H	α-helix	trans	-65.5	-40.2	177.5	-63.7	-25.9	0	0	0	111.5	A199 Q200 T206 Q207	A199-D203 PolarHBondContact O-N 3.5Å; Q200-D203 PolarHBondContact O-N 3.26Å; D203-T206 WeakPolarHBondContact CA-OG1 3.41Å; D203-T206 PolarHBondContact O-OG1 2.92Å; D203-Q207 WeakPolarHBondContact O-CB 3.4Å; D203-Q207 VanDerWaalsContact O-CG 3.23Å; D203-Q207 WeakPolarHBondContact O-CG 3.4Å; D203-Q207 PolarHBondContact O-N 2.79Å
204	R	83.7	Confident	77.3	Confident	94 Å²	94	91.6 Å²	91.6	36%	0.355	47%	0.467	S	S	.	.	H	α-helix	trans	-66.4	-41.7	175.6	-167.5	-178.5	-66.7	168.8	5.8	112.3	E186 Q200 H201 Q207 L208	E186-R204 IonicContact OE2-NH1 3.52Å; Q200-R204 WeakPolarHBondContact O-CB 3.27Å; Q200-R204 PolarHBondContact O-N 2.97Å; H201-R204 PolarHBondContact O-N 3.41Å; R204-Q207 PolarHBondContact O-N 2.93Å; R204-L208 HydrophobicContact CG-CD1 4.32Å; R204-L208 WeakPolarHBondContact O-CG 3.41Å; R204-L208 PolarHBondContact O-N 3.41Å
205	S	80.8	Confident	75.5	Confident	26 Å²	26	93 Å²	93	18%	0.182	48%	0.479	C	S	.	.	H	α-helix	trans	-65.3	-44.1	178.7	-66.5	0	0	0	0	111.9	H201 K202 L208 E209	H201-S205 PolarHBondContact CE1-OG 2.89Å; H201-S205 VanDerWaalsContact CE1-OG 3.29Å; H201-S205 VanDerWaalsContact O-CB 3.3Å; H201-S205 WeakPolarHBondContact O-CB 3.34Å; H201-S205 PolarHBondContact O-N 3.25Å; H201-S205 PolarHBondContact O-OG 2.92Å; K202-S205 PolarHBondContact O-N 3.44Å; S205-L208 PolarHBondContact O-N 3.34Å; S205-E209 WeakPolarHBondContact O-CG 3.47Å; S205-E209 PolarHBondContact O-N 3.49Å
206	T	79.5	Confident	73.5	Confident	67 Å²	67	97.2 Å²	97.2	41%	0.411	48%	0.483	S	S	.	.	H	α-helix	trans	-64.3	-40.7	176.2	48.4	0	0	0	0	112.1	K202 D203 L208 E209 M210	K202-T206 WeakPolarHBondContact O-CG2 3.31Å; K202-T206 PolarHBondContact O-N 2.64Å; K202-T206 PolarHBondContact O-OG1 2.69Å; D203-T206 WeakPolarHBondContact CA-OG1 3.41Å; D203-T206 PolarHBondContact O-OG1 2.92Å; T206-L208 PolarHBondContact O-N 2.9Å; T206-E209 PolarHBondContact O-N 2.71Å; T206-M210 WeakPolarHBondContact O-CG 3.48Å; T206-M210 PolarHBondContact O-N 3.01Å
207	Q	77.9	Confident	71.6	Confident	115 Å²	115	97.9 Å²	97.9	54%	0.537	49%	0.493	S	S	.	.	H	α-helix	trans	-63.4	-39.2	174.3	-73.2	173.8	29.7	0	0	113	D203 R204 M210 Q211	D203-Q207 WeakPolarHBondContact O-CB 3.4Å; D203-Q207 VanDerWaalsContact O-CG 3.23Å; D203-Q207 WeakPolarHBondContact O-CG 3.4Å; D203-Q207 PolarHBondContact O-N 2.79Å; R204-Q207 PolarHBondContact O-N 2.93Å; Q207-M210 PolarHBondContact O-N 3.35Å; Q207-Q211 WeakPolarHBondContact O-CG 3.46Å; Q207-Q211 PolarHBondContact O-N 3.4Å
208	L	73.8	Confident	69.9	Low	53 Å²	53	104.4 Å²	104.4	28%	0.277	53%	0.532	S	S	.	.	H	α-helix	trans	-66.3	-41.4	175.4	-78.1	166	0	0	0	111.7	R204 S205 T206 Q211 L212	R204-L208 HydrophobicContact CG-CD1 4.32Å; R204-L208 WeakPolarHBondContact O-CG 3.41Å; R204-L208 PolarHBondContact O-N 3.41Å; S205-L208 PolarHBondContact O-N 3.34Å; T206-L208 PolarHBondContact O-N 2.9Å; L208-Q211 PolarHBondContact O-N 2.91Å; L208-L212 WeakPolarHBondContact O-CD1 3.32Å; L208-L212 PolarHBondContact O-N 3.17Å
209	E	73	Confident	68.1	Low	126 Å²	126	107.2 Å²	107.2	59%	0.589	54%	0.541	S	S	*	.	H	α-helix	trans	-60.5	-44.2	174.4	-73.8	175.8	175.2	0	0	111.3	S205 T206 Q211 L212 E213	S205-E209 WeakPolarHBondContact O-CG 3.47Å; S205-E209 PolarHBondContact O-N 3.49Å; T206-E209 PolarHBondContact O-N 2.71Å; E209-Q211 VanDerWaalsContact C-N 3.34Å; E209-Q211 PolarHBondContact O-N 3.35Å; E209-L212 PolarHBondContact O-N 2.93Å; E209-E213 PolarHBondContact O-N 3.49Å
210	M	70.5	Confident	66.4	Low	139 Å²	139	108.6 Å²	108.6	69%	0.685	55%	0.546	S	S	*	.	H	α-helix	trans	-63.6	-33.7	175.2	-70.2	177.8	70.3	0	0	113.5	T206 Q207	T206-M210 WeakPolarHBondContact O-CG 3.48Å; T206-M210 PolarHBondContact O-N 3.01Å; Q207-M210 PolarHBondContact O-N 3.35Å
211	Q	65.7	Low	64.7	Low	140 Å²	140	111.2 Å²	111.2	65%	0.654	57%	0.567	S	S	*	*	H	α-helix	trans	-75.4	-29.4	176.1	-73.9	-177.7	34	0	0	113.2	Q207 L208 E209	Q207-Q211 WeakPolarHBondContact O-CG 3.46Å; Q207-Q211 PolarHBondContact O-N 3.4Å; L208-Q211 PolarHBondContact O-N 2.91Å; E209-Q211 VanDerWaalsContact C-N 3.34Å; E209-Q211 PolarHBondContact O-N 3.35Å
212	L	60.7	Low	62.9	Low	94 Å²	94	112.8 Å²	112.8	49%	0.492	58%	0.58	S	S	.	*	H	α-helix	trans	-76.3	-26.9	172.8	-92.4	135.5	0	0	0	112.1	L175 L208 E209 K214	L175-L212 HydrophobicContact CD2-CD1 3.78Å; L208-L212 WeakPolarHBondContact O-CD1 3.32Å; L208-L212 PolarHBondContact O-N 3.17Å; E209-L212 PolarHBondContact O-N 2.93Å; L212-K214 PolarHBondContact O-N 3Å
213	E	52	Low	60.9	Low	154 Å²	154	113.2 Å²	113.2	72%	0.72	58%	0.582	S	S	*	*			trans	-74.7	41.7	164.5	-73.5	-165.5	143.4	0	0	112.9	E209	E209-E213 PolarHBondContact O-N 3.49Å
214	K	45.6	Very low	59.6	Low	166 Å²	166	114.5 Å²	114.5	72%	0.722	60%	0.599	S	S	*	*	S	Bend	trans	-55.8	135.7	150.6	-81	-177.2	179.5	-179.6	0	107	L212 K216	L212-K214 PolarHBondContact O-N 3Å; K214-K216 PolarHBondContact O-N 3Å
215	P	46.3	Very low	58.6	Low	121 Å²	121	114.5 Å²	114.5	79%	0.786	61%	0.609	S	S	*	*			trans	-54.2	108	-170.2	19.7	-30.9	0	0	0	108.2	P217	P215-P217 WeakPolarHBondContact O-CD 3.32Å; P215-P217 VanDerWaalsContact O-N 3.08Å
216	K	46.7	Very low	57.2	Low	164 Å²	164	115.2 Å²	115.2	71%	0.713	62%	0.621	S	S	*	*			trans	-52.7	121.1	166.9	-72.2	173.4	179.7	169	0	103.8	K214 V218	K214-K216 PolarHBondContact O-N 3Å; K216-V218 PolarHBondContact O-N 2.96Å
217	P	47.8	Very low	56	Low	109 Å²	109	117.7 Å²	117.7	71%	0.708	63%	0.63	S	S	*	*			trans	-52	121.9	167	22	-29.9	0	0	0	104.9	P215 K219	P215-P217 WeakPolarHBondContact O-CD 3.32Å; P215-P217 VanDerWaalsContact O-N 3.08Å; P217-K219 VanDerWaalsContact C-N 3.28Å; P217-K219 PolarHBondContact O-N 2.93Å
218	V	48.1	Very low	54.8	Low	140 Å²	140	115.4 Å²	115.4	85%	0.848	62%	0.618	S	S	*	*			trans	-51.6	102.4	178.6	178.3	0	0	0	0	104.9	K216 P220	K216-V218 PolarHBondContact O-N 2.96Å; V218-P220 WeakPolarHBondContact O-CD 3.34Å; V218-P220 VanDerWaalsContact O-N 3.14Å
219	K	49.3	Very low	53.4	Low	135 Å²	135	120.9 Å²	120.9	59%	0.587	65%	0.645	S	S	*	*			trans	-64.4	121	-175.9	-67	-178	-178.4	179.5	0	104.4	P217 V221	P217-K219 VanDerWaalsContact C-N 3.28Å; P217-K219 PolarHBondContact O-N 2.93Å; K219-V221 PolarHBondContact O-N 3.24Å
220	P	49.8	Very low	52.4	Low	78 Å²	78	118.5 Å²	118.5	51%	0.506	65%	0.654	S	S	.	*			trans	-56.2	120.2	176.9	20.5	-29.2	0	0	0	106.8	V218 T222	V218-P220 WeakPolarHBondContact O-CD 3.34Å; V218-P220 VanDerWaalsContact O-N 3.14Å; P220-T222 PolarHBondContact O-N 3.4Å
221	V	51	Low	51.4	Low	138 Å²	138	117.7 Å²	117.7	84%	0.836	65%	0.648	S	S	*	*			trans	-56.2	104.2	173.2	-103.2	0	0	0	0	106.5	K219 F223	K219-V221 PolarHBondContact O-N 3.24Å; V221-F223 PolarHBondContact O-N 3.2Å; V221-F223 VanDerWaalsContact O-N 3.13Å
222	T	49.2	Very low	50.4	Low	75 Å²	75	120.1 Å²	120.1	46%	0.46	66%	0.66	S	S	.	*			trans	-69.3	108.6	172.9	46	0	0	0	0	106.6	P220	P220-T222 PolarHBondContact O-N 3.4Å
223	F	44	Very low	49.9	Very low	148 Å²	148	120.9 Å²	120.9	65%	0.649	66%	0.663	S	S	*	*			trans	-60.2	153	168.5	-174.4	-114.3	0	0	0	109.4	V221 T225 G226	V221-F223 PolarHBondContact O-N 3.2Å; V221-F223 VanDerWaalsContact O-N 3.13Å; F223-T225 VanDerWaalsContact CD1-OG1 3.26Å; F223-T225 WeakPolarHBondContact CD1-OG1 3.32Å; F223-T225 WeakPolarHBondContact CE1-OG1 3.46Å; F223-T225 PolarHBondContact O-N 2.88Å; F223-G226 PolarHBondContact O-N 3.43Å
224	S	57	Low	49.8	Very low	122 Å²	122	119.2 Å²	119.2	85%	0.853	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.6	-11.6	-177.2	-175.6	0	0	0	0	114.6
225	T	62.2	Low	49.9	Very low	95 Å²	95	116.3 Å²	116.3	58%	0.583	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.1	10.2	-179.7	-38.9	0	0	0	0	113.2	F223 I227	F223-T225 VanDerWaalsContact CD1-OG1 3.26Å; F223-T225 WeakPolarHBondContact CD1-OG1 3.32Å; F223-T225 WeakPolarHBondContact CE1-OG1 3.46Å; F223-T225 PolarHBondContact O-N 2.88Å; T225-I227 PolarHBondContact O-N 2.99Å; T225-I227 VanDerWaalsContact O-N 3.11Å
226	G	51.5	Low	50	Low	41 Å²	41	114.3 Å²	114.3	42%	0.423	65%	0.654	S	S	.	*			trans	75.3	-2.6	169.8	0	0	0	0	0	116.5	F223 K228	F223-G226 PolarHBondContact O-N 3.43Å; G226-K228 PolarHBondContact O-N 3.49Å
227	I	54.4	Low	50.1	Low	118 Å²	118	112.1 Å²	112.1	61%	0.605	66%	0.656	S	S	*	*			trans	-74.4	112.2	178.1	-57.9	163.6	0	0	0	109.5	T225 M229	T225-I227 PolarHBondContact O-N 2.99Å; T225-I227 VanDerWaalsContact O-N 3.11Å; I227-M229 PolarHBondContact O-N 3.48Å
228	K	53.3	Low	50.3	Low	67 Å²	67	113 Å²	113	29%	0.291	65%	0.654	S	S	.	*			trans	-76.5	108.7	178	-64	176.9	-177.9	173.1	0	109.5	E157 G226 G230 Q231	E157-K228 IonicContact OE1-NZ 2.78Å; E157-K228 IonicContact OE2-NZ 3.43Å; E157-K228 PolarHBondContact OE2-NZ 3.46Å; G226-K228 PolarHBondContact O-N 3.49Å; K228-G230 PolarHBondContact O-N 2.91Å; K228-Q231 HydrophobicContact CB-CG 4.14Å; K228-Q231 PolarHBondContact O-N 3.42Å
229	M	42.9	Very low	50.8	Low	169 Å²	169	114.2 Å²	114.2	83%	0.833	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.3	112.2	171.3	-155.5	87.7	176.6	0	0	108.9	I227	I227-M229 PolarHBondContact O-N 3.48Å
230	G	53.3	Low	51	Low	76 Å²	76	117.5 Å²	117.5	78%	0.784	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	111.3	-2.1	179.3	0	0	0	0	0	116.1	K228 H232	K228-G230 PolarHBondContact O-N 2.91Å; G230-H232 PolarHBondContact O-N 2.93Å
231	Q	48.6	Very low	51.5	Low	121 Å²	121	120 Å²	120	57%	0.565	67%	0.672	S	S	*	*			trans	-65.8	118.7	157.1	-82.8	178.3	-37.6	0	0	107.4	K228 I233	K228-Q231 HydrophobicContact CB-CG 4.14Å; K228-Q231 PolarHBondContact O-N 3.42Å; Q231-I233 PolarHBondContact O-N 3.45Å
232	H	45.3	Very low	52.2	Low	192 Å²	192	122.8 Å²	122.8	89%	0.889	68%	0.676	S	S	*	*			trans	-56.3	88	154.4	-104.9	-92	0	0	0	105.9	G230 S234	G230-H232 PolarHBondContact O-N 2.93Å; H232-S234 PolarHBondContact O-N 2.97Å; H232-S234 VanDerWaalsContact O-N 3.07Å
233	I	49.7	Very low	52.9	Low	109 Å²	109	126.3 Å²	126.3	56%	0.559	69%	0.688	S	S	*	*			trans	-53.7	119.7	156.1	-60.1	163.7	0	0	0	102.3	Q231 L235	Q231-I233 PolarHBondContact O-N 3.45Å; I233-L235 HydrophobicContact CB-CD1 3.74Å; I233-L235 HydrophobicContact CB-CG 4.19Å; I233-L235 HydrophobicContact CG2-CD1 3.95Å; I233-L235 HydrophobicContact CG2-CG 3.81Å; I233-L235 PolarHBondContact O-N 3.04Å
234	S	49.6	Very low	54.4	Low	120 Å²	120	123.9 Å²	123.9	84%	0.839	70%	0.695	S	S	*	*			trans	-67.5	76.4	167	-156.6	0	0	0	0	105.3	H232 A236	H232-S234 PolarHBondContact O-N 2.97Å; H232-S234 VanDerWaalsContact O-N 3.07Å; S234-A236 PolarHBondContact O-N 3.25Å
235	L	48	Very low	55.3	Low	105 Å²	105	126.1 Å²	126.1	55%	0.55	70%	0.696	S	S	.	*			trans	-65.2	98.2	169	-77.3	116.5	0	0	0	103.5	I233 I238	I233-L235 HydrophobicContact CB-CD1 3.74Å; I233-L235 HydrophobicContact CB-CG 4.19Å; I233-L235 HydrophobicContact CG2-CD1 3.95Å; I233-L235 HydrophobicContact CG2-CG 3.81Å; I233-L235 PolarHBondContact O-N 3.04Å; L235-I238 HydrophobicContact CD2-CD1 3.33Å; L235-I238 HydrophobicContact CD2-CG1 3.79Å
236	A	48.9	Very low	56.3	Low	79 Å²	79	130.1 Å²	130.1	65%	0.653	70%	0.702	S	S	*	*			trans	-42.8	132.7	153	0	0	0	0	0	106.2	S234 I238	S234-A236 PolarHBondContact O-N 3.25Å; A236-I238 PolarHBondContact O-N 3.4Å
237	P	48.3	Very low	57.9	Low	117 Å²	117	135.8 Å²	135.8	76%	0.76	72%	0.717	S	S	*	*			trans	-48	112.1	-168.7	-26	31.6	0	0	0	109.3	H239	P237-H239 PolarHBondContact O-N 3.01Å
238	I	52.8	Low	59.5	Low	129 Å²	129	138.2 Å²	138.2	66%	0.662	72%	0.72	S	S	*	*			trans	-58.3	115.4	168.4	-63.4	173.6	0	0	0	103.1	L235 A236 K240	L235-I238 HydrophobicContact CD2-CD1 3.33Å; L235-I238 HydrophobicContact CD2-CG1 3.79Å; A236-I238 PolarHBondContact O-N 3.4Å; I238-K240 PolarHBondContact O-N 3.26Å
239	H	57.1	Low	61.1	Low	165 Å²	165	142 Å²	142	76%	0.764	74%	0.739	S	S	*	*			trans	-47.5	118.3	174.1	-66.4	88.5	0	0	0	106.1	P237 L241	P237-H239 PolarHBondContact O-N 3.01Å; H239-L241 PolarHBondContact O-N 2.91Å
240	K	54.2	Low	63.1	Low	204 Å²	204	138 Å²	138	89%	0.887	73%	0.726	S	S	*	*			trans	-62.9	85.6	173.6	-72.1	-176.5	178.7	-178.5	0	106.4	I238 E242	I238-K240 PolarHBondContact O-N 3.26Å; K240-E242 PolarHBondContact O-N 2.91Å
241	L	60.3	Low	64.6	Low	129 Å²	129	141.4 Å²	141.4	68%	0.675	73%	0.725	S	S	*	*			trans	-66.8	111.9	155.2	-72	165.7	0	0	0	103.3	H239 E243	H239-L241 PolarHBondContact O-N 2.91Å; L241-E243 HydrophobicContact CB-CG 3.77Å; L241-E243 PolarHBondContact O-N 3.06Å
242	E	65.2	Low	66.2	Low	197 Å²	197	144 Å²	144	92%	0.921	74%	0.737	S	S	*	*			trans	-64.5	74.5	164.6	-77.2	-178.9	151.5	0	0	107.2	K240 A244	K240-E242 PolarHBondContact O-N 2.91Å; E242-A244 PolarHBondContact O-N 3.48Å
243	E	64.3	Low	68	Low	150 Å²	150	140.9 Å²	140.9	70%	0.701	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-79	120.2	173.6	-68.3	-176.8	173.7	0	0	107.1	L241 L245	L241-E243 HydrophobicContact CB-CG 3.77Å; L241-E243 PolarHBondContact O-N 3.06Å; E243-L245 PolarHBondContact O-N 2.97Å
244	A	75.6	Confident	69.6	Low	97 Å²	97	142.1 Å²	142.1	80%	0.802	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-51.1	128.2	169.2	0	0	0	0	0	108.3	E242 Y246	E242-A244 PolarHBondContact O-N 3.48Å; A244-Y246 PolarHBondContact O-N 3.33Å
245	L	76.8	Confident	71.2	Confident	168 Å²	168	139.5 Å²	139.5	88%	0.88	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-51	128.6	-179.6	-150.5	86.6	0	0	0	108.8	E243 E247	E243-L245 PolarHBondContact O-N 2.97Å; L245-E247 PolarHBondContact O-N 3.47Å
246	Y	82.6	Confident	73.1	Confident	180 Å²	180	139.9 Å²	139.9	71%	0.706	70%	0.703	S	S	*	*			trans	-56.9	114.1	178.8	176.1	-99.5	0	0	0	109.7	A244 Y248	A244-Y246 PolarHBondContact O-N 3.33Å; Y246-Y248 HydrophobicContact CE1-CD2 4.25Å; Y246-Y248 PolarHBondContact O-N 2.96Å
247	E	85.5	Confident	75	Confident	159 Å²	159	137 Å²	137	74%	0.743	68%	0.681	S	S	*	*			trans	-82.8	111.6	172.7	-169.4	171.7	-168.3	0	0	107.8	L245 Q249	L245-E247 PolarHBondContact O-N 3.47Å; E247-Q249 PolarHBondContact O-N 3.37Å; E247-Q249 VanDerWaalsContact O-N 3.09Å
248	Y	87.1	Confident	77	Confident	170 Å²	170	133.5 Å²	133.5	67%	0.667	66%	0.659	S	S	*	*			trans	-62.1	115.9	-179.5	175.7	-96	0	0	0	110.2	Y246 P250	Y246-Y248 HydrophobicContact CE1-CD2 4.25Å; Y246-Y248 PolarHBondContact O-N 2.96Å; Y248-P250 HydrophobicContact CE1-CB 3.9Å
249	Q	86.6	Confident	78.7	Confident	147 Å²	147	135 Å²	135	69%	0.687	66%	0.662	S	S	*	*			trans	-102.6	119	167.9	-65.1	-176.2	-2.4	0	0	107.8	E247 L251	E247-Q249 PolarHBondContact O-N 3.37Å; E247-Q249 VanDerWaalsContact O-N 3.09Å; Q249-L251 PolarHBondContact O-N 2.9Å
250	P	85.7	Confident	80.3	Confident	85 Å²	85	128.1 Å²	128.1	55%	0.552	63%	0.632	S	S	*	*			trans	-59.7	140.4	175.6	25.1	-32.5	0	0	0	109.7	Y248 Q252	Y248-P250 HydrophobicContact CE1-CB 3.9Å; P250-Q252 PolarHBondContact O-N 3.32Å; P250-Q252 VanDerWaalsContact O-N 3.09Å
251	L	85.2	Confident	82.1	Confident	146 Å²	146	119.4 Å²	119.4	76%	0.764	60%	0.596	S	S	*	*			trans	-60.4	115.6	178.4	-171.2	75.3	0	0	0	109.3	Q249 I253	Q249-L251 PolarHBondContact O-N 2.9Å; L251-I253 HydrophobicContact CD2-CD1 3.95Å; L251-I253 HydrophobicContact CD2-CG1 3.74Å; L251-I253 HydrophobicContact CG-CG1 3.99Å; L251-I253 PolarHBondContact O-N 2.93Å
252	Q	82.4	Confident	83.6	Confident	177 Å²	177	118.3 Å²	118.3	83%	0.827	59%	0.587	S	S	*	*			trans	-82.5	106.4	172.7	-65.3	-176.7	2.3	0	0	108.2	P250	P250-Q252 PolarHBondContact O-N 3.32Å; P250-Q252 VanDerWaalsContact O-N 3.09Å
253	I	82.6	Confident	84.8	Confident	125 Å²	125	111.8 Å²	111.8	64%	0.641	56%	0.559	S	S	*	*			trans	-97.9	113	176.2	-55.4	176	0	0	0	108	L251 T255	L251-I253 HydrophobicContact CD2-CD1 3.95Å; L251-I253 HydrophobicContact CD2-CG1 3.74Å; L251-I253 HydrophobicContact CG-CG1 3.99Å; L251-I253 PolarHBondContact O-N 2.93Å; I253-T255 HydrophobicContact CG2-CG2 4.22Å; I253-T255 PolarHBondContact O-N 2.9Å
254	E	82.1	Confident	86	Confident	135 Å²	135	111.8 Å²	111.8	63%	0.631	56%	0.559	S	S	*	*			trans	-80.4	104.3	170.9	-66.9	-177.2	169.3	0	0	109.5	Y256	E254-Y256 VanDerWaalsContact C-N 3.32Å; E254-Y256 HydrophobicContact CB-CD2 4.16Å; E254-Y256 HydrophobicContact CB-CE2 3.69Å; E254-Y256 WeakPolarHBondContact O-CD2 3.3Å; E254-Y256 PolarHBondContact OE2-OH 2.92Å
255	T	84	Confident	86.8	Confident	65 Å²	65	111.6 Å²	111.6	40%	0.399	54%	0.542	S	S	.	.			trans	-82.9	-6.9	178.8	52.2	0	0	0	0	113.3	I253 G257 S302 G303	I253-T255 HydrophobicContact CG2-CG2 4.22Å; I253-T255 PolarHBondContact O-N 2.9Å; T255-G257 VanDerWaalsContact C-N 3.27Å; T255-G257 PolarHBondContact O-N 3.02Å; T255-S302 CarbonylContact O-C 3.54Å; T255-S302 WeakPolarHBondContact O-CA 3.29Å; T255-G303 PolarHBondContact O-N 3.23Å
256	Y	86.9	Confident	87.5	Confident	114 Å²	114	103.6 Å²	103.6	45%	0.447	50%	0.501	S	S	.	.	S	Bend	trans	46.4	48.8	-177.4	-63.7	-85.6	0	0	0	112.9	E254 G303 L304 F305 W306	E254-Y256 VanDerWaalsContact C-N 3.32Å; E254-Y256 HydrophobicContact CB-CD2 4.16Å; E254-Y256 HydrophobicContact CB-CE2 3.69Å; E254-Y256 WeakPolarHBondContact O-CD2 3.3Å; E254-Y256 PolarHBondContact OE2-OH 2.92Å; Y256-G303 CarbonylContact O-C 3.29Å; Y256-G303 VanDerWaalsContact O-C 3.29Å; Y256-G303 PolarHBondContact O-N 2.9Å; Y256-L304 PolarHBondContact O-N 3.47Å; Y256-L304 VanDerWaalsContact O-N 3.12Å; Y256-F305 WeakPolarHBondContact O-CA 3.29Å; Y256-F305 WeakPolarHBondContact O-CB 3.37Å; Y256-F305 PolarHBondContact O-N 3.38Å; Y256-W306 AromaticContact CD2-CD1 3.9Å; Y256-W306 HydrophobicContact CG-CB 4.26Å; Y256-W306 AromaticContact CG-CD1 3.81Å; Y256-W306 HydrophobicContact CG-CG 4.46Å
257	G	89.2	Confident	87.8	Confident	19 Å²	19	96.9 Å²	96.9	20%	0.196	49%	0.486	C	S	.	.	S	Bend	trans	-163.4	173.6	-171.1	0	0	0	0	0	113.3	T255 F301	T255-G257 VanDerWaalsContact C-N 3.27Å; T255-G257 PolarHBondContact O-N 3.02Å; G257-F301 VanDerWaalsContact CA-O 3.22Å; G257-F301 WeakPolarHBondContact CA-O 3.4Å
258	P	90.4	Very high	88.1	Confident	43 Å²	43	100.3 Å²	100.3	28%	0.279	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-63.8	149.3	173.8	26.5	-30.7	0	0	0	110.6	V260 F301 L304 F305	P258-V260 PolarHBondContact O-N 3.48Å; P258-F301 HydrophobicContact CB-CD2 4.31Å; P258-F301 HydrophobicContact CG-CB 3.94Å; P258-F301 HydrophobicContact CG-CD1 4.11Å; P258-F301 HydrophobicContact CG-CD2 3.78Å; P258-F301 HydrophobicContact CG-CE2 4.27Å; P258-F301 HydrophobicContact CG-CG 3.7Å; P258-L304 HydrophobicContact CG-CD1 4.17Å; P258-F305 HydrophobicContact CB-CE2 4.34Å; P258-F305 HydrophobicContact CB-CZ 4.43Å; P258-F305 HydrophobicContact CG-CZ 4.42Å
259	H	88.9	Confident	88.3	Confident	159 Å²	159	96.7 Å²	96.7	74%	0.736	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-66.1	131.8	177.4	-168.8	69.4	0	0	0	110.4
260	V	90.5	Very high	88.6	Confident	22 Å²	22	90.7 Å²	90.7	13%	0.133	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-75	131.6	178.3	180	0	0	0	0	108.5	P258 L297 Q298 F301	P258-V260 PolarHBondContact O-N 3.48Å; V260-L297 HydrophobicContact CG1-CB 3.9Å; V260-Q298 HydrophobicContact CB-CG 4.31Å; V260-Q298 HydrophobicContact CG1-CG 4.08Å; V260-Q298 HydrophobicContact CG2-CB 4.39Å; V260-Q298 HydrophobicContact CG2-CG 3.91Å; V260-F301 HydrophobicContact CB-CD2 4.43Å; V260-F301 HydrophobicContact CG2-CB 4.04Å; V260-F301 HydrophobicContact CG2-CD2 3.78Å; V260-F301 HydrophobicContact CG2-CG 4.28Å
261	P	92.2	Very high	88.9	Confident	20 Å²	20	90.8 Å²	90.8	13%	0.13	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-63.8	143.5	176.9	-18.8	30.1	0	0	0	112	M265 L266 L269 Y271 H294	P261-M265 HydrophobicContact CB-CB 4.4Å; P261-L266 HydrophobicContact CB-CD2 4.16Å; P261-L269 HydrophobicContact CB-CD1 3.62Å; P261-L269 HydrophobicContact CG-CD1 3.71Å; P261-Y271 HydrophobicContact CG-CE2 3.83Å; P261-H294 PolarHBondContact O-CD2 3.3Å
262	E	92	Very high	89.2	Confident	106 Å²	106	86 Å²	86	50%	0.495	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-56.8	152.8	176.4	-68.3	-62.9	163.7	0	0	112.8	E264 M265 L266	E262-E264 PolarHBondContact O-N 3.44Å; E262-E264 VanDerWaalsContact O-N 3.12Å; E262-M265 HydrophobicContact CB-CG 4.43Å; E262-M265 WeakPolarHBondContact O-CB 3.42Å; E262-M265 PolarHBondContact O-N 2.87Å; E262-L266 PolarHBondContact O-N 3.38Å
263	L	89.8	Confident	89.7	Confident	60 Å²	60	83.4 Å²	83.4	31%	0.314	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-36.7	-172.3	-145.5	77.4	0	0	0	112.6	M265 L266 H294	L263-M265 VanDerWaalsContact C-N 3.33Å; L263-L266 HydrophobicContact CD1-CD1 4.28Å; L263-H294 HydrophobicContact CD1-CB 3.28Å
264	E	90.2	Very high	90	Very high	150 Å²	150	86.2 Å²	86.2	70%	0.701	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-22.3	179.2	-55	82.2	-170.4	0	0	113.4	E262	E262-E264 PolarHBondContact O-N 3.44Å; E262-E264 VanDerWaalsContact O-N 3.12Å
265	M	91.7	Very high	90.4	Very high	94 Å²	94	82 Å²	82	46%	0.463	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-21	-177.8	-65.2	-174.2	64.3	0	0	112.8	P261 E262 L263 G267 R268 L269	P261-M265 HydrophobicContact CB-CB 4.4Å; E262-M265 HydrophobicContact CB-CG 4.43Å; E262-M265 WeakPolarHBondContact O-CB 3.42Å; E262-M265 PolarHBondContact O-N 2.87Å; L263-M265 VanDerWaalsContact C-N 3.33Å; M265-G267 VanDerWaalsContact C-N 3.26Å; M265-G267 PolarHBondContact O-N 2.96Å; M265-R268 PolarHBondContact O-N 2.89Å; M265-L269 HydrophobicContact CB-CD1 4.28Å; M265-L269 HydrophobicContact CE-CD1 4.45Å; M265-L269 PolarHBondContact O-N 3.33Å
266	L	91.8	Very high	90.7	Very high	0 Å²	0	87.4 Å²	87.4	0%	0	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-39.8	-176.5	-64.4	-177.8	0	0	0	113.4	P261 E262 L263 G270 Y271 L272 C293 H294 L297	P261-L266 HydrophobicContact CB-CD2 4.16Å; E262-L266 PolarHBondContact O-N 3.38Å; L263-L266 HydrophobicContact CD1-CD1 4.28Å; L266-G270 PolarHBondContact O-N 3.07Å; L266-Y271 HydrophobicContact CD2-CD2 3.93Å; L266-Y271 HydrophobicContact CD2-CG 4.3Å; L266-Y271 PolarHBondContact O-N 3Å; L266-L272 HydrophobicContact CB-CD1 4.4Å; L266-L272 HydrophobicContact CB-CD2 4.2Å; L266-L272 HydrophobicContact CB-CG 4.09Å; L266-C293 HydrophobicContact CD1-CB 4.35Å; L266-H294 HydrophobicContact CD1-CB 3.79Å; L266-L297 HydrophobicContact CD2-CD1 3.4Å
267	G	88.6	Confident	90.8	Very high	39 Å²	39	85.6 Å²	85.6	40%	0.402	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-42.3	176.1	0	0	0	0	0	112.8	M265 G270	M265-G267 VanDerWaalsContact C-N 3.26Å; M265-G267 PolarHBondContact O-N 2.96Å; G267-G270 PolarHBondContact O-N 3.14Å
268	R	91.4	Very high	90.9	Very high	230 Å²	230	86 Å²	86	87%	0.868	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-35.9	-179	-63.5	-174.2	-172.5	-175.6	3.5	112.7	M265 G270	M265-R268 PolarHBondContact O-N 2.89Å; R268-G270 PolarHBondContact O-N 3.42Å
269	L	92.5	Very high	91	Very high	95 Å²	95	85.2 Å²	85.2	50%	0.497	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-2.3	177.1	-64.5	176	0	0	0	112.8	P261 M265 Y271	P261-L269 HydrophobicContact CB-CD1 3.62Å; P261-L269 HydrophobicContact CG-CD1 3.71Å; M265-L269 HydrophobicContact CB-CD1 4.28Å; M265-L269 HydrophobicContact CE-CD1 4.45Å; M265-L269 PolarHBondContact O-N 3.33Å; L269-Y271 VanDerWaalsContact C-N 3.35Å; L269-Y271 HydrophobicContact CB-CD2 3.59Å; L269-Y271 HydrophobicContact CB-CE2 3.6Å; L269-Y271 HydrophobicContact CD1-CD2 4.34Å; L269-Y271 HydrophobicContact CD1-CE2 3.83Å; L269-Y271 HydrophobicContact CG-CE2 4.37Å; L269-Y271 PolarHBondContact O-N 3.42Å
270	G	92.3	Very high	91.2	Very high	20 Å²	20	82.4 Å²	82.4	21%	0.206	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.9	6.5	175.9	0	0	0	0	0	115.2	L266 G267 R268 L272 N273	L266-G270 PolarHBondContact O-N 3.07Å; G267-G270 PolarHBondContact O-N 3.14Å; R268-G270 PolarHBondContact O-N 3.42Å; G270-L272 PolarHBondContact O-N 3.09Å; G270-N273 VanDerWaalsContact O-CB 3.32Å; G270-N273 WeakPolarHBondContact O-CB 3.23Å; G270-N273 VanDerWaalsContact O-CG 3.25Å; G270-N273 PolarHBondContact O-N 3.34Å; G270-N273 VanDerWaalsContact O-N 3.15Å; G270-N273 PolarHBondContact O-ND2 2.93Å
271	Y	92.5	Very high	91.4	Very high	87 Å²	87	88.2 Å²	88.2	34%	0.341	45%	0.452	S	S	.	.	G	3₁₀ helix	trans	-62.9	-26.6	178.2	-71.1	-74.2	0	0	0	112.9	P261 L266 L269 N273 V275 L297	P261-Y271 HydrophobicContact CG-CE2 3.83Å; L266-Y271 HydrophobicContact CD2-CD2 3.93Å; L266-Y271 HydrophobicContact CD2-CG 4.3Å; L266-Y271 PolarHBondContact O-N 3Å; L269-Y271 VanDerWaalsContact C-N 3.35Å; L269-Y271 HydrophobicContact CB-CD2 3.59Å; L269-Y271 HydrophobicContact CB-CE2 3.6Å; L269-Y271 HydrophobicContact CD1-CD2 4.34Å; L269-Y271 HydrophobicContact CD1-CE2 3.83Å; L269-Y271 HydrophobicContact CG-CE2 4.37Å; L269-Y271 PolarHBondContact O-N 3.42Å; Y271-N273 VanDerWaalsContact C-N 3.34Å; Y271-V275 WeakPolarHBondContact O-CG2 3.46Å; Y271-L297 HydrophobicContact CD1-CD1 3.84Å; Y271-L297 HydrophobicContact CD1-CD2 3.79Å; Y271-L297 HydrophobicContact CD1-CG 4.41Å; Y271-L297 HydrophobicContact CD2-CD1 4.24Å; Y271-L297 HydrophobicContact CE1-CD1 4.19Å; Y271-L297 HydrophobicContact CE1-CD2 3.73Å; Y271-L297 HydrophobicContact CG-CD1 3.87Å
272	L	91.8	Very high	91.4	Very high	47 Å²	47	89.5 Å²	89.5	25%	0.246	46%	0.458	C	S	.	.	G	3₁₀ helix	trans	-82.3	-7.3	179.1	-57.4	-178.4	0	0	0	114	L266 G270 H274 V275 C293	L266-L272 HydrophobicContact CB-CD1 4.4Å; L266-L272 HydrophobicContact CB-CD2 4.2Å; L266-L272 HydrophobicContact CB-CG 4.09Å; G270-L272 PolarHBondContact O-N 3.09Å; L272-H274 PolarHBondContact O-N 3.39Å; L272-V275 PolarHBondContact O-N 3.29Å; L272-C293 HydrophobicContact CD2-CB 3.65Å
273	N	91.4	Very high	91.5	Very high	122 Å²	122	89.2 Å²	89.2	65%	0.652	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-62.7	-27.7	-173.5	-70.7	-13.9	0	0	0	113.7	G270 Y271	G270-N273 VanDerWaalsContact O-CB 3.32Å; G270-N273 WeakPolarHBondContact O-CB 3.23Å; G270-N273 VanDerWaalsContact O-CG 3.25Å; G270-N273 PolarHBondContact O-N 3.34Å; G270-N273 VanDerWaalsContact O-N 3.15Å; G270-N273 PolarHBondContact O-ND2 2.93Å; Y271-N273 VanDerWaalsContact C-N 3.34Å
274	H	89.8	Confident	91.6	Very high	183 Å²	183	90.8 Å²	90.8	85%	0.847	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-113.6	10.9	-178.4	-58.5	-62.5	0	0	0	113	L272	L272-H274 PolarHBondContact O-N 3.39Å
275	V	89.6	Confident	91.7	Very high	48 Å²	48	87 Å²	87	29%	0.291	48%	0.482	S	S	.	.	S	Bend	trans	-97.5	134.8	179.7	-177.2	0	0	0	0	109	Y271 L272 A277 C293	Y271-V275 WeakPolarHBondContact O-CG2 3.46Å; L272-V275 PolarHBondContact O-N 3.29Å; V275-A277 PolarHBondContact O-N 2.93Å; V275-C293 HydrophobicContact CG2-CB 4.05Å
276	R	90.8	Very high	91.7	Very high	177 Å²	177	85.4 Å²	85.4	67%	0.668	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-54.9	129.3	175	176.6	-170.4	155	-175.9	-9.3	110.2	D282 S289	R276-D282 IonicContact NH2-OD2 3.96Å; R276-D282 PolarHBondContact NH2-OD2 2.95Å; R276-S289 VanDerWaalsContact O-CB 3.27Å; R276-S289 WeakPolarHBondContact O-CB 3.45Å
277	A	89.9	Confident	91.7	Very high	76 Å²	76	89.6 Å²	89.6	63%	0.628	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-64.7	141.4	172.9	0	0	0	0	0	111.9	V275	V275-A277 PolarHBondContact O-N 2.93Å
278	A	90.5	Very high	91.8	Very high	27 Å²	27	90 Å²	90	22%	0.223	50%	0.5	C	S	.	.	P	Polyproline II helix	trans	-66.1	135	176.1	0	0	0	0	0	110.8	D282 L283 Y287	A278-D282 HydrophobicContact CB-CB 4.34Å; A278-L283 HydrophobicContact CB-CD2 4.15Å; A278-L283 HydrophobicContact CB-CG 4.2Å; A278-Y287 HydrophobicContact CB-CD1 4.02Å; A278-Y287 HydrophobicContact CB-CE1 4.17Å
279	S	92.8	Very high	91.8	Very high	28 Å²	28	80.4 Å²	80.4	20%	0.196	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-79.2	163.6	173.1	71.3	0	0	0	0	111.3	Q281 D282 L283	S279-Q281 PolarHBondContact O-N 2.98Å; S279-D282 VanDerWaalsContact CB-OD2 3.3Å; S279-D282 WeakPolarHBondContact CB-OD2 3.48Å; S279-D282 PolarHBondContact N-OD2 3.34Å; S279-D282 WeakPolarHBondContact O-CB 3.39Å; S279-D282 PolarHBondContact O-N 3.28Å; S279-D282 PolarHBondContact OG-N 3.42Å; S279-D282 PolarHBondContact OG-OD1 3.29Å; S279-D282 PolarHBondContact OG-OD2 3.41Å; S279-L283 PolarHBondContact O-N 2.91Å
280	P	93.7	Very high	91.9	Very high	100 Å²	100	76.9 Å²	76.9	65%	0.649	45%	0.452	S	S	*	.	H	α-helix	trans	-57.2	-34.7	175.2	-25.7	35.5	0	0	0	113.7	A284	P280-A284 PolarHBondContact O-N 3.46Å; P280-A284 VanDerWaalsContact O-N 3.11Å
281	Q	93.8	Very high	91.8	Very high	144 Å²	144	79.9 Å²	79.9	67%	0.673	46%	0.463	S	S	*	.	H	α-helix	trans	-66.6	-40.8	174.5	-68.8	81.2	5.3	0	0	111.7	S279 L283 A284 G285	S279-Q281 PolarHBondContact O-N 2.98Å; Q281-L283 VanDerWaalsContact C-N 3.34Å; Q281-A284 PolarHBondContact O-N 2.91Å; Q281-G285 PolarHBondContact O-N 3.18Å
282	D	93.3	Very high	91.8	Very high	47 Å²	47	77.5 Å²	77.5	25%	0.251	46%	0.461	S	S	.	.	H	α-helix	trans	-64.2	-42.6	178.2	-56.8	-40.6	0	0	0	110.7	R276 A278 S279 A284 G285 G286 Y287	R276-D282 IonicContact NH2-OD2 3.96Å; R276-D282 PolarHBondContact NH2-OD2 2.95Å; A278-D282 HydrophobicContact CB-CB 4.34Å; S279-D282 VanDerWaalsContact CB-OD2 3.3Å; S279-D282 WeakPolarHBondContact CB-OD2 3.48Å; S279-D282 PolarHBondContact N-OD2 3.34Å; S279-D282 WeakPolarHBondContact O-CB 3.39Å; S279-D282 PolarHBondContact O-N 3.28Å; S279-D282 PolarHBondContact OG-N 3.42Å; S279-D282 PolarHBondContact OG-OD1 3.29Å; S279-D282 PolarHBondContact OG-OD2 3.41Å; D282-A284 VanDerWaalsContact C-N 3.34Å; D282-A284 PolarHBondContact O-N 3.45Å; D282-G285 CarbonylContact O-C 3.59Å; D282-G285 WeakPolarHBondContact O-CA 3.41Å; D282-G285 PolarHBondContact O-N 3.37Å; D282-G286 PolarHBondContact O-N 2.95Å; D282-Y287 HydrophobicContact CB-CD1 3.59Å; D282-Y287 HydrophobicContact CB-CE1 4.46Å; D282-Y287 HydrophobicContact CB-CG 4.17Å; D282-Y287 WeakPolarHBondContact O-CB 3.49Å; D282-Y287 PolarHBondContact O-N 3.03Å
283	L	92.9	Very high	91.9	Very high	100 Å²	100	75.8 Å²	75.8	52%	0.524	45%	0.453	S	S	.	.	H	α-helix	trans	-62.4	-38.7	176.6	-69.7	171.2	0	0	0	112.3	A278 S279 Q281 G285 G286 T288	A278-L283 HydrophobicContact CB-CD2 4.15Å; A278-L283 HydrophobicContact CB-CG 4.2Å; S279-L283 PolarHBondContact O-N 2.91Å; Q281-L283 VanDerWaalsContact C-N 3.34Å; L283-G285 PolarHBondContact O-N 2.89Å; L283-G286 PolarHBondContact O-N 3.19Å; L283-T288 HydrophobicContact CD2-CG2 4.24Å
284	A	91.7	Very high	92	Very high	93 Å²	93	71.4 Å²	71.4	77%	0.769	43%	0.429	S	S	*	.	H	α-helix	trans	-63.6	-27.6	174.9	0	0	0	0	0	112.5	P280 Q281 D282 G286	P280-A284 PolarHBondContact O-N 3.46Å; P280-A284 VanDerWaalsContact O-N 3.11Å; Q281-A284 PolarHBondContact O-N 2.91Å; D282-A284 VanDerWaalsContact C-N 3.34Å; D282-A284 PolarHBondContact O-N 3.45Å; A284-G286 VanDerWaalsContact C-N 3.33Å
285	G	92.9	Very high	92.1	Very high	71 Å²	71	70.2 Å²	70.2	73%	0.732	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	1.5	171.3	0	0	0	0	0	114.7	Q281 D282 L283 Y287	Q281-G285 PolarHBondContact O-N 3.18Å; D282-G285 CarbonylContact O-C 3.59Å; D282-G285 WeakPolarHBondContact O-CA 3.41Å; D282-G285 PolarHBondContact O-N 3.37Å; L283-G285 PolarHBondContact O-N 2.89Å; G285-Y287 VanDerWaalsContact C-N 3.34Å
286	G	91.2	Very high	92.2	Very high	59 Å²	59	70.8 Å²	70.8	61%	0.608	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.2	8.4	-176.9	0	0	0	0	0	114.8	D282 L283 A284	D282-G286 PolarHBondContact O-N 2.95Å; L283-G286 PolarHBondContact O-N 3.19Å; A284-G286 VanDerWaalsContact C-N 3.33Å
287	Y	91.4	Very high	92.3	Very high	88 Å²	88	63.3 Å²	63.3	35%	0.345	40%	0.399	S	S	.	.			trans	-80.7	133.9	177.1	172.9	-85.6	0	0	0	111.5	A278 D282 G285 A292	A278-Y287 HydrophobicContact CB-CD1 4.02Å; A278-Y287 HydrophobicContact CB-CE1 4.17Å; D282-Y287 HydrophobicContact CB-CD1 3.59Å; D282-Y287 HydrophobicContact CB-CE1 4.46Å; D282-Y287 HydrophobicContact CB-CG 4.17Å; D282-Y287 WeakPolarHBondContact O-CB 3.49Å; D282-Y287 PolarHBondContact O-N 3.03Å; G285-Y287 VanDerWaalsContact C-N 3.34Å; Y287-A292 HydrophobicContact CE2-CB 4.02Å; Y287-A292 WeakPolarHBondContact OH-CB 3.45Å
288	T	91.7	Very high	92.4	Very high	48 Å²	48	64 Å²	64	29%	0.294	39%	0.39	S	S	.	.			trans	-126.6	146.3	170.9	56	0	0	0	0	110	L283 S290 L291	L283-T288 HydrophobicContact CD2-CG2 4.24Å; T288-S290 PolarHBondContact O-N 3.33Å; T288-S290 PolarHBondContact OG1-OG 3Å; T288-S290 VanDerWaalsContact OG1-OG 3.11Å; T288-L291 WeakPolarHBondContact O-CB 3.43Å; T288-L291 PolarHBondContact O-N 3.47Å; T288-L291 VanDerWaalsContact O-N 3.09Å
289	S	92	Very high	92.4	Very high	28 Å²	28	68.5 Å²	68.5	20%	0.196	41%	0.41	C	S	.	.	H	α-helix	trans	-62.1	-28.4	177.5	45.9	0	0	0	0	112.7	R276 C293	R276-S289 VanDerWaalsContact O-CB 3.27Å; R276-S289 WeakPolarHBondContact O-CB 3.45Å; S289-C293 WeakPolarHBondContact O-CB 3.32Å; S289-C293 PolarHBondContact O-N 3.43Å; S289-C293 VanDerWaalsContact O-N 3.08Å
290	S	93	Very high	92.3	Very high	22 Å²	22	69.9 Å²	69.9	15%	0.154	42%	0.423	C	S	.	.	H	α-helix	trans	-63.1	-38.1	172.6	52.5	0	0	0	0	112.8	T288 C293 H294	T288-S290 PolarHBondContact O-N 3.33Å; T288-S290 PolarHBondContact OG1-OG 3Å; T288-S290 VanDerWaalsContact OG1-OG 3.11Å; S290-C293 PolarHBondContact O-N 2.88Å; S290-H294 VanDerWaalsContact O-CB 3.27Å; S290-H294 WeakPolarHBondContact O-CB 3.38Å; S290-H294 PolarHBondContact O-N 3.38Å
291	L	91.8	Very high	92.2	Very high	82 Å²	82	66.9 Å²	66.9	43%	0.429	40%	0.4	S	S	.	.	H	α-helix	trans	-63.6	-45.2	178.8	-168.9	118.3	0	0	0	111.8	T288 R295	T288-L291 WeakPolarHBondContact O-CB 3.43Å; T288-L291 PolarHBondContact O-N 3.47Å; T288-L291 VanDerWaalsContact O-N 3.09Å; L291-R295 WeakPolarHBondContact O-CG 3.41Å; L291-R295 PolarHBondContact O-N 3.05Å; L291-R295 VanDerWaalsContact O-N 3.13Å
292	A	91.1	Very high	92	Very high	37 Å²	37	63 Å²	63	31%	0.306	39%	0.389	S	S	.	.	H	α-helix	trans	-65	-43.8	176.5	0	0	0	0	0	111.8	Y287 A296	Y287-A292 HydrophobicContact CE2-CB 4.02Å; Y287-A292 WeakPolarHBondContact OH-CB 3.45Å; A292-A296 PolarHBondContact O-N 3.5Å; A292-A296 VanDerWaalsContact O-N 3.08Å
293	C	93.9	Very high	91.8	Very high	12 Å²	12	62.5 Å²	62.5	8%	0.081	39%	0.394	C	S	.	.	H	α-helix	trans	-61.8	-45.3	177.5	-174.6	0	0	0	0	112	L266 L272 V275 S289 S290 A296 L297	L266-C293 HydrophobicContact CD1-CB 4.35Å; L272-C293 HydrophobicContact CD2-CB 3.65Å; V275-C293 HydrophobicContact CG2-CB 4.05Å; S289-C293 WeakPolarHBondContact O-CB 3.32Å; S289-C293 PolarHBondContact O-N 3.43Å; S289-C293 VanDerWaalsContact O-N 3.08Å; S290-C293 PolarHBondContact O-N 2.88Å; C293-A296 PolarHBondContact O-N 3.01Å; C293-L297 WeakPolarHBondContact O-CG 3.3Å; C293-L297 PolarHBondContact O-N 3Å
294	H	94	Very high	91.7	Very high	30 Å²	30	62.8 Å²	62.8	14%	0.139	40%	0.396	C	S	.	.	H	α-helix	trans	-62.1	-45.8	179.2	-171.7	-98.2	0	0	0	112.7	P261 L263 L266 S290 A296 L297 Q298	P261-H294 PolarHBondContact O-CD2 3.3Å; L263-H294 HydrophobicContact CD1-CB 3.28Å; L266-H294 HydrophobicContact CD1-CB 3.79Å; S290-H294 VanDerWaalsContact O-CB 3.27Å; S290-H294 WeakPolarHBondContact O-CB 3.38Å; S290-H294 PolarHBondContact O-N 3.38Å; H294-A296 VanDerWaalsContact C-N 3.31Å; H294-A296 PolarHBondContact O-N 3.45Å; H294-L297 PolarHBondContact O-N 3.11Å; H294-L297 VanDerWaalsContact O-N 3.17Å; H294-Q298 VanDerWaalsContact CE1-CD 3.44Å; H294-Q298 PolarHBondContact CE1-NE2 3.29Å; H294-Q298 WeakPolarHBondContact O-CG 3.45Å; H294-Q298 PolarHBondContact O-N 2.91Å
295	R	91.9	Very high	91.6	Very high	158 Å²	158	64.9 Å²	64.9	60%	0.596	39%	0.388	S	S	*	.	H	α-helix	trans	-59.2	-44.2	175.1	-74.1	-173.7	67	-159.4	-2.4	111.5	L291 L297 Q298 D299	L291-R295 WeakPolarHBondContact O-CG 3.41Å; L291-R295 PolarHBondContact O-N 3.05Å; L291-R295 VanDerWaalsContact O-N 3.13Å; R295-L297 VanDerWaalsContact C-N 3.3Å; R295-L297 PolarHBondContact O-N 3.25Å; R295-Q298 PolarHBondContact O-N 3.25Å; R295-D299 PolarHBondContact O-N 2.64Å
296	A	92.2	Very high	91.3	Very high	60 Å²	60	68.5 Å²	68.5	50%	0.496	38%	0.38	S	S	.	.	H	α-helix	trans	-62.4	-37.2	176.9	0	0	0	0	0	112.4	A292 C293 H294 A300	A292-A296 PolarHBondContact O-N 3.5Å; A292-A296 VanDerWaalsContact O-N 3.08Å; C293-A296 PolarHBondContact O-N 3.01Å; H294-A296 VanDerWaalsContact C-N 3.31Å; H294-A296 PolarHBondContact O-N 3.45Å; A296-A300 WeakPolarHBondContact O-CB 3.47Å; A296-A300 PolarHBondContact O-N 3.19Å
297	L	92.7	Very high	90.8	Very high	19 Å²	19	73.8 Å²	73.8	10%	0.099	39%	0.389	C	S	.	.	H	α-helix	trans	-70.5	-38.8	175	-69.8	171.9	0	0	0	112.6	V260 L266 Y271 C293 H294 R295 A300 F301	V260-L297 HydrophobicContact CG1-CB 3.9Å; L266-L297 HydrophobicContact CD2-CD1 3.4Å; Y271-L297 HydrophobicContact CD1-CD1 3.84Å; Y271-L297 HydrophobicContact CD1-CD2 3.79Å; Y271-L297 HydrophobicContact CD1-CG 4.41Å; Y271-L297 HydrophobicContact CD2-CD1 4.24Å; Y271-L297 HydrophobicContact CE1-CD1 4.19Å; Y271-L297 HydrophobicContact CE1-CD2 3.73Å; Y271-L297 HydrophobicContact CG-CD1 3.87Å; C293-L297 WeakPolarHBondContact O-CG 3.3Å; C293-L297 PolarHBondContact O-N 3Å; H294-L297 PolarHBondContact O-N 3.11Å; H294-L297 VanDerWaalsContact O-N 3.17Å; R295-L297 VanDerWaalsContact C-N 3.3Å; R295-L297 PolarHBondContact O-N 3.25Å; L297-A300 PolarHBondContact O-N 3.42Å; L297-F301 HydrophobicContact CD2-CE1 4.27Å; L297-F301 HydrophobicContact CD2-CZ 4.18Å; L297-F301 VanDerWaalsContact O-CB 3.25Å; L297-F301 WeakPolarHBondContact O-CB 3.41Å; L297-F301 WeakPolarHBondContact O-CG 3.47Å; L297-F301 PolarHBondContact O-N 3.11Å
298	Q	92	Very high	90.3	Very high	91 Å²	91	74 Å²	74	43%	0.425	40%	0.401	S	S	.	.	H	α-helix	trans	-58.6	-47.9	173.2	-73.7	178.6	-41.2	0	0	111.5	V260 H294 R295 S302	V260-Q298 HydrophobicContact CB-CG 4.31Å; V260-Q298 HydrophobicContact CG1-CG 4.08Å; V260-Q298 HydrophobicContact CG2-CB 4.39Å; V260-Q298 HydrophobicContact CG2-CG 3.91Å; H294-Q298 VanDerWaalsContact CE1-CD 3.44Å; H294-Q298 PolarHBondContact CE1-NE2 3.29Å; H294-Q298 WeakPolarHBondContact O-CG 3.45Å; H294-Q298 PolarHBondContact O-N 2.91Å; R295-Q298 PolarHBondContact O-N 3.25Å; Q298-S302 VanDerWaalsContact O-CB 3.26Å; Q298-S302 WeakPolarHBondContact O-CB 3.4Å; Q298-S302 PolarHBondContact O-N 3.04Å
299	D	90.7	Very high	89.5	Confident	122 Å²	122	80.8 Å²	80.8	65%	0.652	45%	0.45	S	S	*	.	H	α-helix	trans	-65.1	-41.7	177.4	-69.1	-14	0	0	0	111.4	R295	R295-D299 PolarHBondContact O-N 2.64Å
300	A	90.6	Very high	89.4	Confident	56 Å²	56	83.5 Å²	83.5	46%	0.463	46%	0.463	S	S	.	.	H	α-helix	trans	-71.4	-32.3	-178.5	0	0	0	0	0	113.7	A296 L297 L304	A296-A300 WeakPolarHBondContact O-CB 3.47Å; A296-A300 PolarHBondContact O-N 3.19Å; L297-A300 PolarHBondContact O-N 3.42Å; A300-L304 WeakPolarHBondContact O-CD1 3.26Å; A300-L304 WeakPolarHBondContact O-CG 3.46Å
301	F	91.9	Very high	89.2	Confident	38 Å²	38	86.7 Å²	86.7	17%	0.167	48%	0.479	C	S	.	.	H	α-helix	trans	-87.3	-23.5	-179.2	-71.9	3	0	0	0	112.1	G257 P258 V260 L297 G303 L304	G257-F301 VanDerWaalsContact CA-O 3.22Å; G257-F301 WeakPolarHBondContact CA-O 3.4Å; P258-F301 HydrophobicContact CB-CD2 4.31Å; P258-F301 HydrophobicContact CG-CB 3.94Å; P258-F301 HydrophobicContact CG-CD1 4.11Å; P258-F301 HydrophobicContact CG-CD2 3.78Å; P258-F301 HydrophobicContact CG-CE2 4.27Å; P258-F301 HydrophobicContact CG-CG 3.7Å; V260-F301 HydrophobicContact CB-CD2 4.43Å; V260-F301 HydrophobicContact CG2-CB 4.04Å; V260-F301 HydrophobicContact CG2-CD2 3.78Å; V260-F301 HydrophobicContact CG2-CG 4.28Å; L297-F301 HydrophobicContact CD2-CE1 4.27Å; L297-F301 HydrophobicContact CD2-CZ 4.18Å; L297-F301 VanDerWaalsContact O-CB 3.25Å; L297-F301 WeakPolarHBondContact O-CB 3.41Å; L297-F301 WeakPolarHBondContact O-CG 3.47Å; L297-F301 PolarHBondContact O-N 3.11Å; F301-G303 PolarHBondContact O-N 3.39Å; F301-L304 HydrophobicContact CD1-CD1 4.34Å
302	S	90.1	Very high	89.1	Confident	62 Å²	62	86.9 Å²	86.9	43%	0.434	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	132.7	176.2	-167.4	0	0	0	0	111.7	T255 Q298 L304	T255-S302 CarbonylContact O-C 3.54Å; T255-S302 WeakPolarHBondContact O-CA 3.29Å; Q298-S302 VanDerWaalsContact O-CB 3.26Å; Q298-S302 WeakPolarHBondContact O-CB 3.4Å; Q298-S302 PolarHBondContact O-N 3.04Å; S302-L304 VanDerWaalsContact C-N 3.33Å; S302-L304 PolarHBondContact O-N 2.72Å
303	G	89	Confident	89	Confident	36 Å²	36	89.9 Å²	89.9	37%	0.371	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.2	-1.5	172.8	0	0	0	0	0	116.2	T255 Y256 F301 F305 W306	T255-G303 PolarHBondContact O-N 3.23Å; Y256-G303 CarbonylContact O-C 3.29Å; Y256-G303 VanDerWaalsContact O-C 3.29Å; Y256-G303 PolarHBondContact O-N 2.9Å; F301-G303 PolarHBondContact O-N 3.39Å; G303-F305 VanDerWaalsContact C-N 3.27Å; G303-F305 PolarHBondContact O-N 3Å; G303-W306 VanDerWaalsContact O-CB 3.31Å; G303-W306 WeakPolarHBondContact O-CB 3.36Å; G303-W306 PolarHBondContact O-N 3.4Å; G303-W306 VanDerWaalsContact O-N 3.1Å
304	L	88.9	Confident	88.7	Confident	107 Å²	107	94.8 Å²	94.8	56%	0.56	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-30.6	-176.4	-71.4	179.7	0	0	0	114.5	Y256 P258 A300 F301 S302	Y256-L304 PolarHBondContact O-N 3.47Å; Y256-L304 VanDerWaalsContact O-N 3.12Å; P258-L304 HydrophobicContact CG-CD1 4.17Å; A300-L304 WeakPolarHBondContact O-CD1 3.26Å; A300-L304 WeakPolarHBondContact O-CG 3.46Å; F301-L304 HydrophobicContact CD1-CD1 4.34Å; S302-L304 VanDerWaalsContact C-N 3.33Å; S302-L304 PolarHBondContact O-N 2.72Å
305	F	89.8	Confident	88.3	Confident	136 Å²	136	99.1 Å²	99.1	60%	0.596	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	7.4	178.3	-53.2	-36.5	0	0	0	112.5	Y256 P258 G303 Q307	Y256-F305 WeakPolarHBondContact O-CA 3.29Å; Y256-F305 WeakPolarHBondContact O-CB 3.37Å; Y256-F305 PolarHBondContact O-N 3.38Å; P258-F305 HydrophobicContact CB-CE2 4.34Å; P258-F305 HydrophobicContact CB-CZ 4.43Å; P258-F305 HydrophobicContact CG-CZ 4.42Å; G303-F305 VanDerWaalsContact C-N 3.27Å; G303-F305 PolarHBondContact O-N 3Å; F305-Q307 PolarHBondContact O-N 2.81Å; F305-Q307 VanDerWaalsContact O-N 3.11Å
306	W	87.4	Confident	88.1	Confident	148 Å²	148	94.9 Å²	94.9	56%	0.561	54%	0.539	S	S	*	.			trans	-67.6	115	178.9	-173.9	79.9	0	0	0	109.3	Y256 G303 P308	Y256-W306 AromaticContact CD2-CD1 3.9Å; Y256-W306 HydrophobicContact CG-CB 4.26Å; Y256-W306 AromaticContact CG-CD1 3.81Å; Y256-W306 HydrophobicContact CG-CG 4.46Å; G303-W306 VanDerWaalsContact O-CB 3.31Å; G303-W306 WeakPolarHBondContact O-CB 3.36Å; G303-W306 PolarHBondContact O-N 3.4Å; G303-W306 VanDerWaalsContact O-N 3.1Å; W306-P308 HydrophobicContact CH2-CB 3.67Å; W306-P308 HydrophobicContact CH2-CG 4.41Å; W306-P308 HydrophobicContact CZ2-CB 4.37Å; W306-P308 HydrophobicContact CZ3-CB 3.81Å; W306-P308 HydrophobicContact CZ3-CG 4.03Å
307	Q	80.4	Confident	87.7	Confident	170 Å²	170	97.5 Å²	97.5	79%	0.794	54%	0.543	S	S	*	.			trans	-102.9	122.7	171.8	-68.9	-174.9	-14.6	0	0	108	F305 S309	F305-Q307 PolarHBondContact O-N 2.81Å; F305-Q307 VanDerWaalsContact O-N 3.11Å; Q307-S309 PolarHBondContact O-N 2.98Å
308	P	81	Confident	87.3	Confident	93 Å²	93	104.1 Å²	104.1	60%	0.604	58%	0.58	S	S	*	*			trans	-62.8	125.4	169.7	22.3	-27.2	0	0	0	108.8	W306	W306-P308 HydrophobicContact CH2-CB 3.67Å; W306-P308 HydrophobicContact CH2-CG 4.41Å; W306-P308 HydrophobicContact CZ2-CB 4.37Å; W306-P308 HydrophobicContact CZ3-CB 3.81Å; W306-P308 HydrophobicContact CZ3-CG 4.03Å
309	S	76.1	Confident	86.9	Confident	190 Å²	190	105.3 Å²	105.3	100%	1.329	59%	0.594	S	S	*	*			trans	-62.2	0	170.2	55.4	0	0	0	0	112.2	Q307	Q307-S309 PolarHBondContact O-N 2.98Å

Retrieved 309 of 309 residues in 503.4 ms (Link to these results)

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