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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 A0A087WSG5, Species MOUSE (Mus musculus, Mouse), Gene Mnat1, Length 249 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	53	Low	76.5	Confident	209 Å²	209	96.1 Å²	96.1	100%	1.03	49%	0.489	S	S	*	.				0	-0.2	0	-85.1	-178.5	166.1	0	0	113
2	D	51	Low	77.3	Confident	119 Å²	119	90.9 Å²	90.9	64%	0.636	47%	0.466	S	S	*	.			trans	-116.4	4.9	-162.3	-60.9	-59.6	0	0	0	117.7
3	D	64.1	Low	77.8	Confident	167 Å²	167	94.6 Å²	94.6	89%	0.893	48%	0.477	S	S	*	.			trans	-99.6	0.2	-173.1	-71.4	-35.5	0	0	0	115.5	G5	D3-G5 PolarHBondContact O-N 3Å
4	Q	72.4	Confident	78.3	Confident	74 Å²	74	101.7 Å²	101.7	35%	0.346	50%	0.497	S	S	.	.			trans	-82	101.3	175.9	-95	158.2	43	0	0	111.8	L21 E64	Q4-L21 HydrophobicContact CB-CD1 4.18Å; Q4-E64 PolarHBondContact NE2-O 3.42Å
5	G	81.9	Confident	78.9	Confident	20 Å²	20	107.9 Å²	107.9	21%	0.206	51%	0.513	C	S	.	.	B	Isolated β-bridge	trans	-135.1	162	171.7	0	0	0	0	0	111.3	D3 T11	D3-G5 PolarHBondContact O-N 3Å; G5-T11 VanDerWaalsContact CA-O 3.25Å; G5-T11 WeakPolarHBondContact CA-O 3.44Å
6	C	86.6	Confident	79.2	Confident	1 Å²	1	105 Å²	105	1%	0.007	50%	0.501	C	S	.	.			trans	-71.2	129	174.7	174.5	0	0	0	0	110.2	R8 C9 K10 T11 L21 C31 C34	C6-R8 PolarHBondContact O-N 3.23Å; C6-R8 VanDerWaalsContact O-N 3.16Å; C6-C9 WeakPolarHBondContact CB-SG 3.3Å; C6-K10 WeakPolarHBondContact O-CA 3.42Å; C6-K10 PolarHBondContact O-N 3.21Å; C6-T11 PolarHBondContact N-O 3.33Å; C6-L21 HydrophobicContact CB-CD2 4.32Å; C6-C31 HydrophobicContact CB-CB 3.84Å; C6-C31 PolarHBondContact SG-N 3.13Å; C6-C31 VanDerWaalsContact SG-N 3.4Å; C6-C31 VanDerWaalsContact SG-SG 3.66Å; C6-C34 VanDerWaalsContact SG-SG 3.68Å
7	P	85.3	Confident	79.6	Confident	60 Å²	60	105.1 Å²	105.1	39%	0.39	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-21.5	-178	25.2	-34.4	0	0	0	113.3	T29	P7-T29 WeakPolarHBondContact CD-O 3.45Å; P7-T29 VanDerWaalsContact CG-O 3.26Å; P7-T29 WeakPolarHBondContact CG-O 3.46Å
8	R	84.9	Confident	80	Confident	153 Å²	153	104.4 Å²	104.4	58%	0.577	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-53.9	179.5	-78.3	-67.7	-143.9	176.9	2.6	113.5	C6 L30 C34 P47	C6-R8 PolarHBondContact O-N 3.23Å; C6-R8 VanDerWaalsContact O-N 3.16Å; R8-L30 HydrophobicContact CB-CD2 4.27Å; R8-L30 HydrophobicContact CG-CD2 3.67Å; R8-C34 HydrophobicContact CB-CB 4.24Å; R8-P47 HydrophobicContact CG-CG 4.47Å
9	C	87.5	Confident	80.4	Confident	51 Å²	51	100.1 Å²	100.1	35%	0.345	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-8.5	-176.2	64.2	0	0	0	0	113.5	C6 T11 C31	C6-C9 WeakPolarHBondContact CB-SG 3.3Å; C9-T11 PolarHBondContact O-N 3Å; C9-T11 PolarHBondContact SG-OG1 3.42Å; C9-T11 VanDerWaalsContact SG-OG1 3.41Å; C9-C31 PolarHBondContact SG-SG 3.15Å
10	K	87.3	Confident	80.8	Confident	164 Å²	164	100.8 Å²	100.8	71%	0.713	50%	0.499	S	S	*	.			trans	56.6	15.2	-176.5	-53.7	-177.9	-179.7	-177.2	0	113.8	C6	C6-K10 WeakPolarHBondContact O-CA 3.42Å; C6-K10 PolarHBondContact O-N 3.21Å
11	T	87.2	Confident	81.3	Confident	39 Å²	39	96.8 Å²	96.8	24%	0.239	48%	0.479	C	S	.	.			trans	-73.9	128.3	172.5	-53.2	0	0	0	0	108.4	G5 C6 C9 R15 N16 L19	G5-T11 VanDerWaalsContact CA-O 3.25Å; G5-T11 WeakPolarHBondContact CA-O 3.44Å; C6-T11 PolarHBondContact N-O 3.33Å; C9-T11 PolarHBondContact O-N 3Å; C9-T11 PolarHBondContact SG-OG1 3.42Å; C9-T11 VanDerWaalsContact SG-OG1 3.41Å; T11-R15 HydrophobicContact CG2-CB 4.4Å; T11-N16 HydrophobicContact CG2-CB 4.13Å; T11-L19 HydrophobicContact CG2-CD1 4.39Å; T11-L19 HydrophobicContact CG2-CD2 4.13Å; T11-L19 WeakPolarHBondContact O-CD2 3.44Å
12	T	86.8	Confident	83	Confident	34 Å²	34	88.3 Å²	88.3	21%	0.209	44%	0.437	C	S	.	.	B	Isolated β-bridge	trans	-101.9	162.1	175.3	59.3	0	0	0	0	110.3	Y14 R15 N16	T12-Y14 PolarHBondContact O-N 3.4Å; T12-R15 PolarHBondContact O-N 3.47Å; T12-R15 VanDerWaalsContact O-N 3.12Å; T12-N16 PolarHBondContact O-N 3.07Å
13	K	83.8	Confident	85	Confident	139 Å²	139	82.6 Å²	82.6	60%	0.604	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-26.4	174.1	-161.7	173.7	-177.4	-179.8	0	112.7	N16 P17	K13-N16 CarbonylContact O-C 3.58Å; K13-P17 WeakPolarHBondContact O-CA 3.4Å
14	Y	85	Confident	86.2	Confident	194 Å²	194	74.7 Å²	74.7	76%	0.761	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-43.7	173.6	-176.3	-95.1	0	0	0	112.7	T12	T12-Y14 PolarHBondContact O-N 3.4Å
15	R	86.7	Confident	86.7	Confident	195 Å²	195	73.9 Å²	73.9	74%	0.736	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-32.6	179.9	-69.5	-176.4	-179.9	-178.6	0.1	112.8	T11 T12	T11-R15 HydrophobicContact CG2-CB 4.4Å; T12-R15 PolarHBondContact O-N 3.47Å; T12-R15 VanDerWaalsContact O-N 3.12Å
16	N	83.5	Confident	86.9	Confident	61 Å²	61	73.9 Å²	73.9	33%	0.326	36%	0.361	S	S	.	.			trans	-135.8	99.7	177.6	-176	2.9	0	0	0	110	T11 T12 K13 S18 L19	T11-N16 HydrophobicContact CG2-CB 4.13Å; T12-N16 PolarHBondContact O-N 3.07Å; K13-N16 CarbonylContact O-C 3.58Å; N16-S18 PolarHBondContact O-N 3.26Å; N16-S18 PolarHBondContact OD1-N 3.19Å; N16-S18 PolarHBondContact OD1-OG 2.87Å; N16-L19 HydrophobicContact CB-CB 4.19Å; N16-L19 WeakPolarHBondContact O-CB 3.43Å; N16-L19 PolarHBondContact O-N 2.84Å
17	P	85.8	Confident	86.9	Confident	107 Å²	107	74.3 Å²	74.3	70%	0.695	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-25.9	-179.6	-26.5	35.5	0	0	0	114.3	K13 L19	K13-P17 WeakPolarHBondContact O-CA 3.4Å; P17-L19 VanDerWaalsContact C-N 3.29Å
18	S	87.6	Confident	87	Confident	92 Å²	92	73.5 Å²	73.5	64%	0.643	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	5.1	177.4	64.5	0	0	0	0	113.7	N16 K20	N16-S18 PolarHBondContact O-N 3.26Å; N16-S18 PolarHBondContact OD1-N 3.19Å; N16-S18 PolarHBondContact OD1-OG 2.87Å; S18-K20 PolarHBondContact O-N 3.29Å; S18-K20 VanDerWaalsContact O-N 3.17Å
19	L	87.2	Confident	87.3	Confident	23 Å²	23	67.1 Å²	67.1	12%	0.12	33%	0.334	C	S	.	.			trans	-64.4	115.7	178.6	-171.3	72.2	0	0	0	110.7	T11 N16 P17 L21 C31	T11-L19 HydrophobicContact CG2-CD1 4.39Å; T11-L19 HydrophobicContact CG2-CD2 4.13Å; T11-L19 WeakPolarHBondContact O-CD2 3.44Å; N16-L19 HydrophobicContact CB-CB 4.19Å; N16-L19 WeakPolarHBondContact O-CB 3.43Å; N16-L19 PolarHBondContact O-N 2.84Å; P17-L19 VanDerWaalsContact C-N 3.29Å; L19-L21 HydrophobicContact CD2-CD2 4.33Å; L19-C31 HydrophobicContact CD1-CB 3.54Å; L19-C31 HydrophobicContact CG-CB 4.12Å
20	K	89	Confident	87.4	Confident	114 Å²	114	64.8 Å²	64.8	50%	0.496	32%	0.319	S	S	.	.			trans	-91.6	116.3	169.9	-61.7	-178.7	-169.5	166.7	0	109.4	S18 C31 E32	S18-K20 PolarHBondContact O-N 3.29Å; S18-K20 VanDerWaalsContact O-N 3.17Å; K20-C31 WeakPolarHBondContact O-CA 3.44Å; K20-E32 HydrophobicContact CB-CB 4.47Å; K20-E32 PolarHBondContact O-N 3.02Å
21	L	90.1	Very high	87.6	Confident	16 Å²	16	57 Å²	57	8%	0.084	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	142.8	168.1	-67.2	170.3	0	0	0	109.1	Q4 C6 L19 C31 Q61	Q4-L21 HydrophobicContact CB-CD1 4.18Å; C6-L21 HydrophobicContact CB-CD2 4.32Å; L19-L21 HydrophobicContact CD2-CD2 4.33Å; L21-C31 HydrophobicContact CD2-CB 4.24Å; L21-Q61 HydrophobicContact CB-CB 4.09Å; L21-Q61 WeakPolarHBondContact O-CB 3.36Å; L21-Q61 PolarHBondContact O-N 3.2Å
22	M	90.2	Very high	87.7	Confident	31 Å²	31	58.9 Å²	58.9	15%	0.153	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	138.7	178.1	-65	-173.6	170.5	0	0	109.9	T29 L30 E32 V35 F58 R59	M22-T29 CarbonylContact O-C 3.59Å; M22-T29 VanDerWaalsContact O-CA 3.31Å; M22-T29 WeakPolarHBondContact O-CA 3.26Å; M22-L30 WeakPolarHBondContact CA-O 3.22Å; M22-L30 WeakPolarHBondContact CB-O 3.48Å; M22-L30 PolarHBondContact N-O 3.33Å; M22-L30 PolarHBondContact O-N 2.87Å; M22-E32 HydrophobicContact CE-CB 4.04Å; M22-E32 HydrophobicContact CE-CG 3.84Å; M22-V35 HydrophobicContact CB-CG2 4.3Å; M22-V35 HydrophobicContact SD-CB 4.39Å; M22-V35 HydrophobicContact SD-CG1 4.44Å; M22-V35 HydrophobicContact SD-CG2 4.08Å; M22-F58 HydrophobicContact CB-CB 4.39Å; M22-F58 HydrophobicContact CB-CD1 4.1Å; M22-F58 HydrophobicContact SD-CB 4.14Å; M22-R59 CarbonylContact C-O 3.54Å; M22-R59 WeakPolarHBondContact CA-O 3.11Å; M22-R59 VanDerWaalsContact CB-O 3.29Å; M22-R59 WeakPolarHBondContact CB-O 3.48Å
23	V	91.7	Very high	87.9	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	138.4	175.8	-167.5	0	0	0	0	108.9	T29 R59 Q61 P66 D69	V23-T29 HydrophobicContact CG2-CG2 4.18Å; V23-R59 HydrophobicContact CB-CG 4.45Å; V23-R59 PolarHBondContact N-O 3.45Å; V23-R59 WeakPolarHBondContact O-CG 3.24Å; V23-R59 PolarHBondContact O-N 3.47Å; V23-Q61 HydrophobicContact CG2-CB 3.64Å; V23-Q61 HydrophobicContact CG2-CG 3.68Å; V23-P66 HydrophobicContact CG1-CB 4.29Å; V23-P66 HydrophobicContact CG2-CB 4.43Å; V23-D69 HydrophobicContact CB-CB 4.43Å; V23-D69 HydrophobicContact CG1-CB 4.3Å; V23-D69 HydrophobicContact CG2-CB 3.97Å
24	N	88.8	Confident	88.2	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.281	C	S	.	.			trans	-96.4	-178.8	174.6	61.7	23.3	0	0	0	112.1	C26 G27 H28 C46 L53 F58	N24-C26 PolarHBondContact ND2-SG 3.39Å; N24-C26 PolarHBondContact O-N 2.98Å; N24-C26 PolarHBondContact OD1-N 3.17Å; N24-C26 VanDerWaalsContact OD1-N 3.16Å; N24-C26 PolarHBondContact OD1-SG 2.94Å; N24-G27 PolarHBondContact O-N 2.92Å; N24-G27 PolarHBondContact OD1-N 3.18Å; N24-H28 VanDerWaalsContact CG-O 3.22Å; N24-H28 PolarHBondContact N-O 3.2Å; N24-H28 PolarHBondContact ND2-O 3.5Å; N24-H28 PolarHBondContact OD1-N 3.3Å; N24-H28 PolarHBondContact OD1-O 3.49Å; N24-C46 PolarHBondContact ND2-SG 2.98Å; N24-L53 HydrophobicContact CB-CD1 3.86Å; N24-L53 HydrophobicContact CB-CD2 4.15Å; N24-F58 HydrophobicContact CB-CD1 4.1Å; N24-F58 HydrophobicContact CB-CE1 3.79Å; N24-F58 HydrophobicContact CB-CZ 4.13Å
25	V	84.7	Confident	88.4	Confident	57 Å²	57	45.7 Å²	45.7	35%	0.345	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-23.2	178.9	-69.1	0	0	0	0	114.6	L53 N57	V25-L53 HydrophobicContact CG2-CD2 3.54Å; V25-N57 HydrophobicContact CG1-CB 3.94Å
26	C	85.3	Confident	88.5	Confident	21 Å²	21	39.8 Å²	39.8	14%	0.142	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-10.4	178	47.2	0	0	0	0	113.4	N24 H28 C46 C49	N24-C26 PolarHBondContact ND2-SG 3.39Å; N24-C26 PolarHBondContact O-N 2.98Å; N24-C26 PolarHBondContact OD1-N 3.17Å; N24-C26 VanDerWaalsContact OD1-N 3.16Å; N24-C26 PolarHBondContact OD1-SG 2.94Å; C26-H28 PolarHBondContact SG-ND1 2.93Å; C26-C46 PolarHBondContact SG-SG 3.06Å; C26-C49 PolarHBondContact SG-SG 3.23Å
27	G	85.9	Confident	88.8	Confident	9 Å²	9	42.8 Å²	42.8	9%	0.093	24%	0.244	C	C	.	.	S	Bend	trans	90.6	19.5	-179	0	0	0	0	0	114.4	N24 P66	N24-G27 PolarHBondContact O-N 2.92Å; N24-G27 PolarHBondContact OD1-N 3.18Å; G27-P66 WeakPolarHBondContact O-CB 3.45Å
28	H	88.7	Confident	88.8	Confident	44 Å²	44	38.9 Å²	38.9	20%	0.204	22%	0.217	C	C	.	.			trans	-101	145.9	174.5	-54.8	118.9	0	0	0	110.9	N24 C26 C46 E48 C49	N24-H28 VanDerWaalsContact CG-O 3.22Å; N24-H28 PolarHBondContact N-O 3.2Å; N24-H28 PolarHBondContact ND2-O 3.5Å; N24-H28 PolarHBondContact OD1-N 3.3Å; N24-H28 PolarHBondContact OD1-O 3.49Å; C26-H28 PolarHBondContact SG-ND1 2.93Å; H28-C46 PolarHBondContact ND1-SG 2.99Å; H28-E48 VanDerWaalsContact CD2-CD 3.45Å; H28-E48 IonicContact CD2-OE1 3.2Å; H28-E48 IonicContact CD2-OE2 2.74Å; H28-E48 PolarHBondContact CD2-OE2 3.12Å; H28-E48 IonicContact CG-OE1 2.62Å; H28-E48 IonicContact CG-OE2 3.18Å; H28-E48 IonicContact NE2-OE2 2.99Å; H28-C49 PolarHBondContact CE1-SG 2.66Å
29	T	89.7	Confident	88.8	Confident	19 Å²	19	36.2 Å²	36.2	12%	0.117	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	140.1	-174	53.9	0	0	0	0	112	P7 M22 V23 P66	P7-T29 WeakPolarHBondContact CD-O 3.45Å; P7-T29 VanDerWaalsContact CG-O 3.26Å; P7-T29 WeakPolarHBondContact CG-O 3.46Å; M22-T29 CarbonylContact O-C 3.59Å; M22-T29 VanDerWaalsContact O-CA 3.31Å; M22-T29 WeakPolarHBondContact O-CA 3.26Å; V23-T29 HydrophobicContact CG2-CG2 4.18Å; T29-P66 HydrophobicContact CG2-CB 3.57Å; T29-P66 HydrophobicContact CG2-CG 4.06Å
30	L	90.3	Very high	88.7	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	143.4	175.3	-83.2	148.1	0	0	0	108.5	R8 M22 C34 V35 P47 F58	R8-L30 HydrophobicContact CB-CD2 4.27Å; R8-L30 HydrophobicContact CG-CD2 3.67Å; M22-L30 WeakPolarHBondContact CA-O 3.22Å; M22-L30 WeakPolarHBondContact CB-O 3.48Å; M22-L30 PolarHBondContact N-O 3.33Å; M22-L30 PolarHBondContact O-N 2.87Å; L30-C34 HydrophobicContact CD2-CB 3.97Å; L30-V35 HydrophobicContact CB-CG2 3.76Å; L30-P47 HydrophobicContact CD1-CG 4.23Å; L30-P47 HydrophobicContact CD2-CG 4.25Å; L30-F58 HydrophobicContact CB-CE1 4.18Å; L30-F58 HydrophobicContact CD1-CE1 3.58Å; L30-F58 HydrophobicContact CD1-CZ 3.82Å
31	C	91.3	Very high	88.1	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	154.4	173.1	65.8	0	0	0	0	111.6	C6 C9 L19 K20 L21 S33 C34 V35	C6-C31 HydrophobicContact CB-CB 3.84Å; C6-C31 PolarHBondContact SG-N 3.13Å; C6-C31 VanDerWaalsContact SG-N 3.4Å; C6-C31 VanDerWaalsContact SG-SG 3.66Å; C9-C31 PolarHBondContact SG-SG 3.15Å; L19-C31 HydrophobicContact CD1-CB 3.54Å; L19-C31 HydrophobicContact CG-CB 4.12Å; K20-C31 WeakPolarHBondContact O-CA 3.44Å; L21-C31 HydrophobicContact CD2-CB 4.24Å; C31-S33 VanDerWaalsContact C-N 3.27Å; C31-S33 PolarHBondContact O-N 3.32Å; C31-S33 PolarHBondContact SG-OG 3.22Å; C31-C34 WeakPolarHBondContact O-CA 3.25Å; C31-C34 PolarHBondContact O-N 2.91Å; C31-C34 PolarHBondContact SG-SG 3.41Å; C31-V35 WeakPolarHBondContact O-CG2 3.3Å; C31-V35 PolarHBondContact O-N 3.01Å
32	E	90.6	Very high	87.2	Confident	79 Å²	79	48.6 Å²	48.6	37%	0.369	27%	0.268	S	S	.	.	H	α-helix	trans	-46.2	-47.9	179.2	-176.6	171.3	-160.6	0	0	112.9	K20 M22 C34 V35 D36	K20-E32 HydrophobicContact CB-CB 4.47Å; K20-E32 PolarHBondContact O-N 3.02Å; M22-E32 HydrophobicContact CE-CB 4.04Å; M22-E32 HydrophobicContact CE-CG 3.84Å; E32-C34 PolarHBondContact O-N 3.04Å; E32-V35 WeakPolarHBondContact O-CB 3.46Å; E32-V35 PolarHBondContact O-N 3.39Å; E32-D36 PolarHBondContact O-N 3.23Å
33	S	90	Very high	86.3	Confident	72 Å²	72	50.6 Å²	50.6	50%	0.503	29%	0.29	S	S	.	.	H	α-helix	trans	-63.8	-35.8	178.1	55.8	0	0	0	0	114.1	C31 L37	C31-S33 VanDerWaalsContact C-N 3.27Å; C31-S33 PolarHBondContact O-N 3.32Å; C31-S33 PolarHBondContact SG-OG 3.22Å; S33-L37 WeakPolarHBondContact O-CB 3.5Å; S33-L37 PolarHBondContact O-N 2.81Å; S33-L37 VanDerWaalsContact O-N 3.07Å
34	C	89.4	Confident	85.8	Confident	15 Å²	15	50.7 Å²	50.7	10%	0.101	29%	0.291	C	S	.	.	H	α-helix	trans	-74.6	-31.1	175.7	-77.2	0	0	0	0	112	C6 R8 L30 C31 E32 L38	C6-C34 VanDerWaalsContact SG-SG 3.68Å; R8-C34 HydrophobicContact CB-CB 4.24Å; L30-C34 HydrophobicContact CD2-CB 3.97Å; C31-C34 WeakPolarHBondContact O-CA 3.25Å; C31-C34 PolarHBondContact O-N 2.91Å; C31-C34 PolarHBondContact SG-SG 3.41Å; E32-C34 PolarHBondContact O-N 3.04Å; C34-L38 VanDerWaalsContact O-CB 3.3Å; C34-L38 WeakPolarHBondContact O-CB 3.01Å; C34-L38 PolarHBondContact O-N 2.93Å
35	V	89.9	Confident	85.8	Confident	3 Å²	3	54.8 Å²	54.8	2%	0.018	31%	0.313	C	S	.	.	H	α-helix	trans	-64.1	-47.7	172.1	175.9	0	0	0	0	109.7	M22 L30 C31 E32 L37 L38 F39 F58	M22-V35 HydrophobicContact CB-CG2 4.3Å; M22-V35 HydrophobicContact SD-CB 4.39Å; M22-V35 HydrophobicContact SD-CG1 4.44Å; M22-V35 HydrophobicContact SD-CG2 4.08Å; L30-V35 HydrophobicContact CB-CG2 3.76Å; C31-V35 WeakPolarHBondContact O-CG2 3.3Å; C31-V35 PolarHBondContact O-N 3.01Å; E32-V35 WeakPolarHBondContact O-CB 3.46Å; E32-V35 PolarHBondContact O-N 3.39Å; V35-L37 PolarHBondContact O-N 3.16Å; V35-L38 WeakPolarHBondContact O-CB 3.26Å; V35-L38 PolarHBondContact O-N 3Å; V35-F39 HydrophobicContact CG1-CD2 4.02Å; V35-F39 HydrophobicContact CG1-CE2 3.94Å; V35-F39 VanDerWaalsContact O-CD2 3.22Å; V35-F39 WeakPolarHBondContact O-CD2 3.39Å; V35-F39 PolarHBondContact O-N 2.85Å; V35-F58 HydrophobicContact CG1-CB 4.28Å; V35-F58 HydrophobicContact CG1-CD1 4.15Å; V35-F58 HydrophobicContact CG1-CD2 3.83Å; V35-F58 HydrophobicContact CG1-CE1 4.45Å; V35-F58 HydrophobicContact CG1-CE2 4.18Å; V35-F58 HydrophobicContact CG1-CG 3.81Å; V35-F58 HydrophobicContact CG1-CZ 4.44Å; V35-F58 HydrophobicContact CG2-CD1 3.54Å; V35-F58 HydrophobicContact CG2-CE1 3.63Å; V35-F58 HydrophobicContact CG2-CG 4.07Å; V35-F58 HydrophobicContact CG2-CZ 4.22Å
36	D	89.6	Confident	85.9	Confident	70 Å²	70	52.2 Å²	52.2	37%	0.374	30%	0.297	S	S	.	.	H	α-helix	trans	-60.4	-47.3	177.9	-75.6	-31.3	0	0	0	111.9	E32 L38 F39 V40 K55	E32-D36 PolarHBondContact O-N 3.23Å; D36-L38 VanDerWaalsContact C-N 3.28Å; D36-L38 PolarHBondContact O-N 2.72Å; D36-F39 PolarHBondContact O-N 3.17Å; D36-V40 WeakPolarHBondContact O-CG2 3.48Å; D36-V40 PolarHBondContact O-N 3.19Å; D36-K55 VanDerWaalsContact OD1-CE 3.26Å; D36-K55 WeakPolarHBondContact OD1-CE 3.17Å; D36-K55 IonicContact OD1-NZ 2.66Å; D36-K55 PolarHBondContact OD1-NZ 2.84Å
37	L	88.1	Confident	85.9	Confident	124 Å²	124	53.7 Å²	53.7	65%	0.649	31%	0.307	S	S	*	.	H	α-helix	trans	-59.6	-37.9	176.9	-167.4	84.3	0	0	0	112.5	S33 V35 F39 V40	S33-L37 WeakPolarHBondContact O-CB 3.5Å; S33-L37 PolarHBondContact O-N 2.81Å; S33-L37 VanDerWaalsContact O-N 3.07Å; V35-L37 PolarHBondContact O-N 3.16Å; L37-F39 VanDerWaalsContact C-N 3.28Å; L37-F39 PolarHBondContact O-N 3.48Å; L37-V40 PolarHBondContact O-N 3.4Å
38	L	86.8	Confident	85.8	Confident	26 Å²	26	58.2 Å²	58.2	14%	0.136	33%	0.325	C	S	.	.	H	α-helix	trans	-62	-37.5	179.6	-172.7	70.1	0	0	0	111.5	C34 V35 D36 F58	C34-L38 VanDerWaalsContact O-CB 3.3Å; C34-L38 WeakPolarHBondContact O-CB 3.01Å; C34-L38 PolarHBondContact O-N 2.93Å; V35-L38 WeakPolarHBondContact O-CB 3.26Å; V35-L38 PolarHBondContact O-N 3Å; D36-L38 VanDerWaalsContact C-N 3.28Å; D36-L38 PolarHBondContact O-N 2.72Å; L38-F58 HydrophobicContact CD2-CZ 4.34Å
39	F	87.3	Confident	85.7	Confident	36 Å²	36	58.9 Å²	58.9	16%	0.158	34%	0.335	C	S	.	.	H	α-helix	trans	-89.1	-8.1	-177.4	-72.1	-68.3	0	0	0	115.1	V35 D36 L37 R41 G42 L53 K55 F58	V35-F39 HydrophobicContact CG1-CD2 4.02Å; V35-F39 HydrophobicContact CG1-CE2 3.94Å; V35-F39 VanDerWaalsContact O-CD2 3.22Å; V35-F39 WeakPolarHBondContact O-CD2 3.39Å; V35-F39 PolarHBondContact O-N 2.85Å; D36-F39 PolarHBondContact O-N 3.17Å; L37-F39 VanDerWaalsContact C-N 3.28Å; L37-F39 PolarHBondContact O-N 3.48Å; F39-R41 PolarHBondContact O-N 3.39Å; F39-G42 PolarHBondContact O-N 3.25Å; F39-L53 WeakPolarHBondContact CE1-O 3.44Å; F39-L53 HydrophobicContact CZ-CB 4.32Å; F39-K55 HydrophobicContact CD1-CB 4.45Å; F39-K55 HydrophobicContact CD2-CB 3.81Å; F39-K55 HydrophobicContact CD2-CD 4.45Å; F39-K55 HydrophobicContact CD2-CG 4.02Å; F39-K55 HydrophobicContact CE2-CB 3.89Å; F39-K55 HydrophobicContact CE2-CG 4.3Å; F39-K55 HydrophobicContact CG-CB 4.13Å; F39-K55 HydrophobicContact CZ-CB 4.26Å; F39-F58 AromaticContact CE2-CD2 3.74Å; F39-F58 HydrophobicContact CE2-CD2 3.74Å; F39-F58 AromaticContact CE2-CE2 3.41Å; F39-F58 HydrophobicContact CE2-CE2 3.41Å; F39-F58 VanDerWaalsContact CE2-CE2 3.41Å; F39-F58 HydrophobicContact CE2-CZ 4.38Å; F39-F58 HydrophobicContact CZ-CD2 4.16Å; F39-F58 AromaticContact CZ-CE2 3.64Å; F39-F58 HydrophobicContact CZ-CE2 3.64Å
40	V	85.5	Confident	85.4	Confident	121 Å²	121	59.9 Å²	59.9	73%	0.733	35%	0.349	S	S	*	.	H	α-helix	trans	-58	-31.8	170.7	175.2	0	0	0	0	111.5	D36 L37 G42	D36-V40 WeakPolarHBondContact O-CG2 3.48Å; D36-V40 PolarHBondContact O-N 3.19Å; L37-V40 PolarHBondContact O-N 3.4Å; V40-G42 VanDerWaalsContact C-N 3.29Å; V40-G42 PolarHBondContact O-N 3.47Å
41	R	75.8	Confident	85.3	Confident	225 Å²	225	62.4 Å²	62.4	85%	0.849	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	5.6	176.6	-76.7	-173.6	167.7	109.9	-3.9	114.5	F39 A43	F39-R41 PolarHBondContact O-N 3.39Å; R41-A43 VanDerWaalsContact C-N 3.27Å; R41-A43 PolarHBondContact O-N 2.91Å; R41-A43 VanDerWaalsContact O-N 3.13Å
42	G	70.8	Confident	85.1	Confident	66 Å²	66	67.2 Å²	67.2	68%	0.68	40%	0.396	S	S	*	.	S	Bend	trans	83.2	-32.1	172.6	0	0	0	0	0	116	F39 V40	F39-G42 PolarHBondContact O-N 3.25Å; V40-G42 VanDerWaalsContact C-N 3.29Å; V40-G42 PolarHBondContact O-N 3.47Å
43	A	72.3	Confident	85	Confident	74 Å²	74	64 Å²	64	61%	0.612	38%	0.381	S	S	*	.			trans	-131.1	125.6	172.4	0	0	0	0	0	110.5	R41	R41-A43 VanDerWaalsContact C-N 3.27Å; R41-A43 PolarHBondContact O-N 2.91Å; R41-A43 VanDerWaalsContact O-N 3.13Å
44	G	80.9	Confident	84.9	Confident	2 Å²	2	69.2 Å²	69.2	2%	0.021	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	116.8	-179.9	0	0	0	0	0	110.9	L53	G44-L53 WeakPolarHBondContact O-CA 3.45Å; G44-L53 WeakPolarHBondContact O-CB 3.48Å; G44-L53 PolarHBondContact O-N 3.21Å
45	N	88.5	Confident	84.6	Confident	85 Å²	85	74.3 Å²	74.3	46%	0.455	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	148.9	167.1	-66.3	73.9	0	0	0	109.4	G50 T51	N45-G50 PolarHBondContact ND2-O 3.16Å; N45-T51 WeakPolarHBondContact CA-O 3.31Å
46	C	87.7	Confident	84.4	Confident	3 Å²	3	78.8 Å²	78.8	2%	0.02	44%	0.441	C	S	.	.			trans	-57.6	129.4	169.9	-175.6	0	0	0	0	109.6	N24 C26 H28 E48 C49 G50 T51 L53	N24-C46 PolarHBondContact ND2-SG 2.98Å; C26-C46 PolarHBondContact SG-SG 3.06Å; H28-C46 PolarHBondContact ND1-SG 2.99Å; C46-E48 PolarHBondContact O-N 3.2Å; C46-C49 VanDerWaalsContact CB-SG 3.57Å; C46-G50 VanDerWaalsContact O-CA 3.24Å; C46-G50 WeakPolarHBondContact O-CA 3.29Å; C46-G50 PolarHBondContact O-N 3.27Å; C46-T51 PolarHBondContact N-O 2.83Å; C46-L53 HydrophobicContact CB-CD1 3.8Å; C46-L53 HydrophobicContact CB-CG 4.3Å
47	P	84.5	Confident	84.2	Confident	52 Å²	52	78 Å²	78	34%	0.338	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-18.4	-179.6	27.3	-35	0	0	0	114	R8 L30	R8-P47 HydrophobicContact CG-CG 4.47Å; L30-P47 HydrophobicContact CD1-CG 4.23Å; L30-P47 HydrophobicContact CD2-CG 4.25Å
48	E	84.6	Confident	84.2	Confident	104 Å²	104	73.1 Å²	73.1	49%	0.486	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-47.4	-177.7	-68.4	179.2	-131.5	0	0	112.3	H28 C46	H28-E48 VanDerWaalsContact CD2-CD 3.45Å; H28-E48 IonicContact CD2-OE1 3.2Å; H28-E48 IonicContact CD2-OE2 2.74Å; H28-E48 PolarHBondContact CD2-OE2 3.12Å; H28-E48 IonicContact CG-OE1 2.62Å; H28-E48 IonicContact CG-OE2 3.18Å; H28-E48 IonicContact NE2-OE2 2.99Å; C46-E48 PolarHBondContact O-N 3.2Å
49	C	86.3	Confident	84.3	Confident	59 Å²	59	74.5 Å²	74.5	40%	0.399	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.6	1.7	-175.9	65.1	0	0	0	0	115.2	C26 H28 C46 T51	C26-C49 PolarHBondContact SG-SG 3.23Å; H28-C49 PolarHBondContact CE1-SG 2.66Å; C46-C49 VanDerWaalsContact CB-SG 3.57Å; C49-T51 PolarHBondContact O-N 3.18Å; C49-T51 PolarHBondContact SG-OG1 3.2Å
50	G	84.1	Confident	84.5	Confident	40 Å²	40	76.2 Å²	76.2	41%	0.412	43%	0.428	S	S	.	.			trans	70.1	-0.2	176.6	0	0	0	0	0	116	N45 C46	N45-G50 PolarHBondContact ND2-O 3.16Å; C46-G50 VanDerWaalsContact O-CA 3.24Å; C46-G50 WeakPolarHBondContact O-CA 3.29Å; C46-G50 PolarHBondContact O-N 3.27Å
51	T	86.4	Confident	84.6	Confident	54 Å²	54	71.7 Å²	71.7	33%	0.331	40%	0.398	S	S	.	.			trans	-57.4	133.4	179.4	-52.6	0	0	0	0	110.8	N45 C46 C49 L53	N45-T51 WeakPolarHBondContact CA-O 3.31Å; C46-T51 PolarHBondContact N-O 2.83Å; C49-T51 PolarHBondContact O-N 3.18Å; C49-T51 PolarHBondContact SG-OG1 3.2Å; T51-L53 WeakPolarHBondContact O-CG 3.14Å; T51-L53 PolarHBondContact O-N 3.19Å
52	P	88	Confident	85.2	Confident	102 Å²	102	67.4 Å²	67.4	66%	0.662	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.6	124.3	176.3	26.9	-33.9	0	0	0	110.2
53	L	87.9	Confident	85.9	Confident	11 Å²	11	68.8 Å²	68.8	6%	0.058	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	154	-177.4	-59.6	177	0	0	0	111.1	N24 V25 F39 G44 C46 T51 F58	N24-L53 HydrophobicContact CB-CD1 3.86Å; N24-L53 HydrophobicContact CB-CD2 4.15Å; V25-L53 HydrophobicContact CG2-CD2 3.54Å; F39-L53 WeakPolarHBondContact CE1-O 3.44Å; F39-L53 HydrophobicContact CZ-CB 4.32Å; G44-L53 WeakPolarHBondContact O-CA 3.45Å; G44-L53 WeakPolarHBondContact O-CB 3.48Å; G44-L53 PolarHBondContact O-N 3.21Å; C46-L53 HydrophobicContact CB-CD1 3.8Å; C46-L53 HydrophobicContact CB-CG 4.3Å; T51-L53 WeakPolarHBondContact O-CG 3.14Å; T51-L53 PolarHBondContact O-N 3.19Å; L53-F58 HydrophobicContact CB-CE2 4.02Å; L53-F58 HydrophobicContact CB-CZ 4.5Å; L53-F58 HydrophobicContact CD1-CE1 4.43Å; L53-F58 HydrophobicContact CD1-CE2 3.89Å; L53-F58 HydrophobicContact CD1-CZ 3.53Å
54	R	87.8	Confident	86.5	Confident	181 Å²	181	71.2 Å²	71.2	68%	0.683	38%	0.378	S	S	*	.			trans	-115.6	153.7	169.1	-64.7	-179.3	-179.8	-108.7	0.3	109	S56 N57	R54-S56 PolarHBondContact O-N 3.43Å; R54-N57 VanDerWaalsContact O-CB 3.3Å; R54-N57 WeakPolarHBondContact O-CB 3.31Å; R54-N57 PolarHBondContact O-N 3.02Å
55	K	84.8	Confident	86.7	Confident	122 Å²	122	74.8 Å²	74.8	53%	0.53	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-57.9	-35.5	179.2	-169.1	171.6	-176.2	171.1	0	112.2	D36 F39 N57 F58	D36-K55 VanDerWaalsContact OD1-CE 3.26Å; D36-K55 WeakPolarHBondContact OD1-CE 3.17Å; D36-K55 IonicContact OD1-NZ 2.66Å; D36-K55 PolarHBondContact OD1-NZ 2.84Å; F39-K55 HydrophobicContact CD1-CB 4.45Å; F39-K55 HydrophobicContact CD2-CB 3.81Å; F39-K55 HydrophobicContact CD2-CD 4.45Å; F39-K55 HydrophobicContact CD2-CG 4.02Å; F39-K55 HydrophobicContact CE2-CB 3.89Å; F39-K55 HydrophobicContact CE2-CG 4.3Å; F39-K55 HydrophobicContact CG-CB 4.13Å; F39-K55 HydrophobicContact CZ-CB 4.26Å; K55-N57 PolarHBondContact O-N 3.17Å; K55-F58 PolarHBondContact O-N 2.88Å
56	S	85.8	Confident	86.6	Confident	97 Å²	97	72.2 Å²	72.2	68%	0.678	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-64	-17.3	174.4	58.7	0	0	0	0	114.9	R54 F58	R54-S56 PolarHBondContact O-N 3.43Å; S56-F58 VanDerWaalsContact C-N 3.31Å
57	N	85.1	Confident	86.6	Confident	54 Å²	54	75.7 Å²	75.7	29%	0.289	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-88.8	-2.1	-177.2	-63.7	-3.8	0	0	0	112.5	V25 R54 K55	V25-N57 HydrophobicContact CG1-CB 3.94Å; R54-N57 VanDerWaalsContact O-CB 3.3Å; R54-N57 WeakPolarHBondContact O-CB 3.31Å; R54-N57 PolarHBondContact O-N 3.02Å; K55-N57 PolarHBondContact O-N 3.17Å
58	F	88.4	Confident	86.9	Confident	22 Å²	22	75.6 Å²	75.6	10%	0.096	40%	0.404	C	S	.	.			trans	-92	136.6	173	-75	-89.8	0	0	0	110	M22 N24 L30 V35 L38 F39 L53 K55 S56	M22-F58 HydrophobicContact CB-CB 4.39Å; M22-F58 HydrophobicContact CB-CD1 4.1Å; M22-F58 HydrophobicContact SD-CB 4.14Å; N24-F58 HydrophobicContact CB-CD1 4.1Å; N24-F58 HydrophobicContact CB-CE1 3.79Å; N24-F58 HydrophobicContact CB-CZ 4.13Å; L30-F58 HydrophobicContact CB-CE1 4.18Å; L30-F58 HydrophobicContact CD1-CE1 3.58Å; L30-F58 HydrophobicContact CD1-CZ 3.82Å; V35-F58 HydrophobicContact CG1-CB 4.28Å; V35-F58 HydrophobicContact CG1-CD1 4.15Å; V35-F58 HydrophobicContact CG1-CD2 3.83Å; V35-F58 HydrophobicContact CG1-CE1 4.45Å; V35-F58 HydrophobicContact CG1-CE2 4.18Å; V35-F58 HydrophobicContact CG1-CG 3.81Å; V35-F58 HydrophobicContact CG1-CZ 4.44Å; V35-F58 HydrophobicContact CG2-CD1 3.54Å; V35-F58 HydrophobicContact CG2-CE1 3.63Å; V35-F58 HydrophobicContact CG2-CG 4.07Å; V35-F58 HydrophobicContact CG2-CZ 4.22Å; L38-F58 HydrophobicContact CD2-CZ 4.34Å; F39-F58 AromaticContact CE2-CD2 3.74Å; F39-F58 HydrophobicContact CE2-CD2 3.74Å; F39-F58 AromaticContact CE2-CE2 3.41Å; F39-F58 HydrophobicContact CE2-CE2 3.41Å; F39-F58 VanDerWaalsContact CE2-CE2 3.41Å; F39-F58 HydrophobicContact CE2-CZ 4.38Å; F39-F58 HydrophobicContact CZ-CD2 4.16Å; F39-F58 AromaticContact CZ-CE2 3.64Å; F39-F58 HydrophobicContact CZ-CE2 3.64Å; L53-F58 HydrophobicContact CB-CE2 4.02Å; L53-F58 HydrophobicContact CB-CZ 4.5Å; L53-F58 HydrophobicContact CD1-CE1 4.43Å; L53-F58 HydrophobicContact CD1-CE2 3.89Å; L53-F58 HydrophobicContact CD1-CZ 3.53Å; K55-F58 PolarHBondContact O-N 2.88Å; S56-F58 VanDerWaalsContact C-N 3.31Å
59	R	88.9	Confident	87.2	Confident	54 Å²	54	71 Å²	71	20%	0.204	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	153.7	175.2	56.5	173.5	177	-86.5	0.8	109.7	M22 V23 Q61 D69 E73	M22-R59 CarbonylContact C-O 3.54Å; M22-R59 WeakPolarHBondContact CA-O 3.11Å; M22-R59 VanDerWaalsContact CB-O 3.29Å; M22-R59 WeakPolarHBondContact CB-O 3.48Å; V23-R59 HydrophobicContact CB-CG 4.45Å; V23-R59 PolarHBondContact N-O 3.45Å; V23-R59 WeakPolarHBondContact O-CG 3.24Å; V23-R59 PolarHBondContact O-N 3.47Å; R59-Q61 PolarHBondContact O-N 3.21Å; R59-D69 PolarHBondContact NH2-O 2.79Å; R59-E73 VanDerWaalsContact CZ-CB 3.47Å; R59-E73 VanDerWaalsContact NH1-CG 3.34Å; R59-E73 VanDerWaalsContact NH2-CB 3.27Å
60	V	90.5	Very high	87.3	Confident	73 Å²	73	68.9 Å²	68.9	44%	0.442	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	133.3	174	179.6	0	0	0	0	109.1	L62	V60-L62 PolarHBondContact O-N 3Å
61	Q	88.4	Confident	87.7	Confident	26 Å²	26	69.9 Å²	69.9	12%	0.121	36%	0.36	C	S	.	.			trans	-68.2	123	174.6	-174.5	173.1	1.3	0	0	109.3	L21 V23 R59 F63 E64 D69	L21-Q61 HydrophobicContact CB-CB 4.09Å; L21-Q61 WeakPolarHBondContact O-CB 3.36Å; L21-Q61 PolarHBondContact O-N 3.2Å; V23-Q61 HydrophobicContact CG2-CB 3.64Å; V23-Q61 HydrophobicContact CG2-CG 3.68Å; R59-Q61 PolarHBondContact O-N 3.21Å; Q61-F63 VanDerWaalsContact CD-O 3.29Å; Q61-F63 WeakPolarHBondContact CG-O 3.02Å; Q61-F63 PolarHBondContact NE2-O 3.17Å; Q61-E64 PolarHBondContact NE2-O 3.42Å; Q61-D69 VanDerWaalsContact CG-OD2 3.31Å; Q61-D69 WeakPolarHBondContact CG-OD2 3.38Å
62	L	86.7	Confident	88	Confident	135 Å²	135	69.2 Å²	69.2	71%	0.707	36%	0.356	S	S	*	.			trans	-100.7	-31.5	178.3	-65.1	177.5	0	0	0	111.3	V60 D69	V60-L62 PolarHBondContact O-N 3Å; L62-D69 PolarHBondContact N-OD2 2.77Å; L62-D69 VanDerWaalsContact N-OD2 3.1Å
63	F	87.2	Confident	88.1	Confident	94 Å²	94	66.9 Å²	66.9	41%	0.412	34%	0.337	S	S	.	.	S	Bend	trans	-107.8	153.3	-178.1	-61.6	-76.9	0	0	0	111	Q61 D65 V68 D69 V72	Q61-F63 VanDerWaalsContact CD-O 3.29Å; Q61-F63 WeakPolarHBondContact CG-O 3.02Å; Q61-F63 PolarHBondContact NE2-O 3.17Å; F63-D65 VanDerWaalsContact C-N 3.33Å; F63-D65 PolarHBondContact O-N 3.38Å; F63-V68 HydrophobicContact CB-CB 4.34Å; F63-V68 HydrophobicContact CB-CG1 4.25Å; F63-V68 HydrophobicContact CD1-CG1 4.25Å; F63-V68 HydrophobicContact CD2-CG1 3.92Å; F63-V68 HydrophobicContact CE2-CG1 4.35Å; F63-V68 HydrophobicContact CG-CB 4.47Å; F63-V68 HydrophobicContact CG-CG1 3.87Å; F63-D69 WeakPolarHBondContact CD2-OD1 3.42Å; F63-D69 PolarHBondContact N-OD2 2.71Å; F63-D69 VanDerWaalsContact N-OD2 3.09Å; F63-V72 HydrophobicContact CE2-CG2 4.08Å
64	E	84.1	Confident	88.3	Confident	125 Å²	125	67.4 Å²	67.4	58%	0.584	34%	0.339	S	S	*	.	S	Bend	trans	-61.3	-45.3	173.9	-69.9	-174.5	-177.5	0	0	110.5	Q4 Q61 P66	Q4-E64 PolarHBondContact NE2-O 3.42Å; Q61-E64 PolarHBondContact NE2-O 3.42Å; E64-P66 WeakPolarHBondContact O-CD 3.42Å
65	D	86.1	Confident	88.6	Confident	77 Å²	77	61.9 Å²	61.9	41%	0.412	32%	0.318	S	S	.	.	S	Bend	trans	-83.3	118.2	178.6	-167.2	-23.7	0	0	0	111.6	F63 T67 V68 D69	F63-D65 VanDerWaalsContact C-N 3.33Å; F63-D65 PolarHBondContact O-N 3.38Å; D65-T67 PolarHBondContact O-N 3.01Å; D65-T67 VanDerWaalsContact OD1-CB 3.32Å; D65-T67 WeakPolarHBondContact OD1-CB 3.44Å; D65-T67 WeakPolarHBondContact OD1-CG2 3.34Å; D65-T67 PolarHBondContact OD1-N 3.47Å; D65-T67 PolarHBondContact OD1-OG1 3.2Å; D65-T67 PolarHBondContact OD2-OG1 3.02Å; D65-T67 VanDerWaalsContact OD2-OG1 3.08Å; D65-V68 HydrophobicContact CB-CB 4.36Å; D65-V68 HydrophobicContact CB-CG2 3.87Å; D65-V68 WeakPolarHBondContact O-CB 3.35Å; D65-V68 PolarHBondContact O-N 2.75Å; D65-D69 PolarHBondContact O-N 2.96Å
66	P	85.8	Confident	89	Confident	32 Å²	32	62.4 Å²	62.4	21%	0.208	32%	0.321	C	S	.	.	H	α-helix	trans	-70.3	-16.8	178.9	32.2	-37.7	0	0	0	113.6	V23 G27 T29 E64 D69 K70	V23-P66 HydrophobicContact CG1-CB 4.29Å; V23-P66 HydrophobicContact CG2-CB 4.43Å; G27-P66 WeakPolarHBondContact O-CB 3.45Å; T29-P66 HydrophobicContact CG2-CB 3.57Å; T29-P66 HydrophobicContact CG2-CG 4.06Å; E64-P66 WeakPolarHBondContact O-CD 3.42Å; P66-D69 PolarHBondContact O-N 3.29Å; P66-K70 PolarHBondContact O-N 3Å
67	T	87.9	Confident	89.3	Confident	76 Å²	76	62.8 Å²	62.8	47%	0.466	31%	0.31	S	S	.	.	H	α-helix	trans	-68.9	-39.2	172.5	66.9	0	0	0	0	111.1	D65 K70 E71	D65-T67 PolarHBondContact O-N 3.01Å; D65-T67 VanDerWaalsContact OD1-CB 3.32Å; D65-T67 WeakPolarHBondContact OD1-CB 3.44Å; D65-T67 WeakPolarHBondContact OD1-CG2 3.34Å; D65-T67 PolarHBondContact OD1-N 3.47Å; D65-T67 PolarHBondContact OD1-OG1 3.2Å; D65-T67 PolarHBondContact OD2-OG1 3.02Å; D65-T67 VanDerWaalsContact OD2-OG1 3.08Å; T67-K70 WeakPolarHBondContact O-CA 3.29Å; T67-K70 WeakPolarHBondContact O-CB 3.38Å; T67-K70 PolarHBondContact O-N 3.25Å; T67-K70 VanDerWaalsContact O-N 3.13Å; T67-E71 WeakPolarHBondContact O-CB 3.4Å; T67-E71 PolarHBondContact O-N 3.11Å
68	V	91	Very high	89.7	Confident	50 Å²	50	60.3 Å²	60.3	30%	0.303	30%	0.297	S	S	.	.	H	α-helix	trans	-63.5	-44.4	173.7	177	0	0	0	0	110.2	F63 D65 K70 E71 V72	F63-V68 HydrophobicContact CB-CB 4.34Å; F63-V68 HydrophobicContact CB-CG1 4.25Å; F63-V68 HydrophobicContact CD1-CG1 4.25Å; F63-V68 HydrophobicContact CD2-CG1 3.92Å; F63-V68 HydrophobicContact CE2-CG1 4.35Å; F63-V68 HydrophobicContact CG-CB 4.47Å; F63-V68 HydrophobicContact CG-CG1 3.87Å; D65-V68 HydrophobicContact CB-CB 4.36Å; D65-V68 HydrophobicContact CB-CG2 3.87Å; D65-V68 WeakPolarHBondContact O-CB 3.35Å; D65-V68 PolarHBondContact O-N 2.75Å; V68-K70 VanDerWaalsContact C-N 3.26Å; V68-K70 PolarHBondContact O-N 2.98Å; V68-E71 PolarHBondContact O-N 3Å; V68-V72 HydrophobicContact CG1-CG2 4.22Å; V68-V72 WeakPolarHBondContact O-CB 3.04Å; V68-V72 VanDerWaalsContact O-CG2 3.26Å; V68-V72 WeakPolarHBondContact O-CG2 3.47Å; V68-V72 PolarHBondContact O-N 3.22Å
69	D	89.4	Confident	90	Very high	6 Å²	6	63.2 Å²	63.2	3%	0.032	31%	0.313	C	S	.	.	H	α-helix	trans	-60.6	-36.2	174.2	-96.7	-49.8	0	0	0	112.1	V23 R59 Q61 L62 F63 D65 P66 E73	V23-D69 HydrophobicContact CB-CB 4.43Å; V23-D69 HydrophobicContact CG1-CB 4.3Å; V23-D69 HydrophobicContact CG2-CB 3.97Å; R59-D69 PolarHBondContact NH2-O 2.79Å; Q61-D69 VanDerWaalsContact CG-OD2 3.31Å; Q61-D69 WeakPolarHBondContact CG-OD2 3.38Å; L62-D69 PolarHBondContact N-OD2 2.77Å; L62-D69 VanDerWaalsContact N-OD2 3.1Å; F63-D69 WeakPolarHBondContact CD2-OD1 3.42Å; F63-D69 PolarHBondContact N-OD2 2.71Å; F63-D69 VanDerWaalsContact N-OD2 3.09Å; D65-D69 PolarHBondContact O-N 2.96Å; P66-D69 PolarHBondContact O-N 3.29Å; D69-E73 PolarHBondContact O-N 2.83Å
70	K	89.8	Confident	90.1	Very high	16 Å²	16	67.5 Å²	67.5	7%	0.07	33%	0.333	C	S	.	.	H	α-helix	trans	-66	-49	174.5	-172.5	-171.3	178.9	-174.6	0	111.2	P66 T67 V68 E73 I74 T110 N112	P66-K70 PolarHBondContact O-N 3Å; T67-K70 WeakPolarHBondContact O-CA 3.29Å; T67-K70 WeakPolarHBondContact O-CB 3.38Å; T67-K70 PolarHBondContact O-N 3.25Å; T67-K70 VanDerWaalsContact O-N 3.13Å; V68-K70 VanDerWaalsContact C-N 3.26Å; V68-K70 PolarHBondContact O-N 2.98Å; K70-E73 PolarHBondContact O-N 3.37Å; K70-I74 HydrophobicContact CD-CD1 4.45Å; K70-I74 HydrophobicContact CG-CD1 3.9Å; K70-I74 WeakPolarHBondContact O-CG1 3.47Å; K70-I74 PolarHBondContact O-N 3.45Å; K70-T110 WeakPolarHBondContact CE-O 3.49Å; K70-T110 PolarHBondContact NZ-O 2.95Å; K70-N112 PolarHBondContact NZ-ND2 3.25Å; K70-N112 PolarHBondContact NZ-OD1 2.9Å
71	E	92.3	Very high	90.1	Very high	60 Å²	60	65.3 Å²	65.3	28%	0.28	32%	0.319	S	S	.	.	H	α-helix	trans	-60.8	-48.8	179.7	-173.2	-167.4	142.8	0	0	111.5	T67 V68 E73 I74 R75 V106 T110	T67-E71 WeakPolarHBondContact O-CB 3.4Å; T67-E71 PolarHBondContact O-N 3.11Å; V68-E71 PolarHBondContact O-N 3Å; E71-E73 VanDerWaalsContact C-N 3.26Å; E71-E73 PolarHBondContact O-N 2.98Å; E71-I74 PolarHBondContact O-N 3.47Å; E71-I74 VanDerWaalsContact O-N 3.08Å; E71-R75 WeakPolarHBondContact O-CB 3.34Å; E71-R75 PolarHBondContact O-N 3.34Å; E71-R75 IonicContact OE1-CZ 3.62Å; E71-R75 IonicContact OE1-NH1 2.93Å; E71-R75 PolarHBondContact OE1-NH1 3.45Å; E71-R75 IonicContact OE1-NH2 3.93Å; E71-R75 PolarHBondContact OE1-NH2 3.07Å; E71-V106 HydrophobicContact CG-CG1 3.92Å; E71-T110 HydrophobicContact CB-CG2 4.09Å
72	V	92.4	Very high	90.3	Very high	40 Å²	40	64.7 Å²	64.7	24%	0.242	32%	0.315	C	S	.	.	H	α-helix	trans	-57.8	-40.8	179.6	168.8	0	0	0	0	111.3	F63 V68 K76	F63-V72 HydrophobicContact CE2-CG2 4.08Å; V68-V72 HydrophobicContact CG1-CG2 4.22Å; V68-V72 WeakPolarHBondContact O-CB 3.04Å; V68-V72 VanDerWaalsContact O-CG2 3.26Å; V68-V72 WeakPolarHBondContact O-CG2 3.47Å; V68-V72 PolarHBondContact O-N 3.22Å; V72-K76 HydrophobicContact CG1-CD 4.4Å; V72-K76 WeakPolarHBondContact O-CB 3.49Å; V72-K76 VanDerWaalsContact O-CG 3.3Å; V72-K76 WeakPolarHBondContact O-CG 3.26Å; V72-K76 PolarHBondContact O-N 3.3Å
73	E	90.1	Very high	90.5	Very high	54 Å²	54	59.8 Å²	59.8	25%	0.252	29%	0.29	S	S	.	.	H	α-helix	trans	-67	-43.4	176.5	178.1	69.4	-174.5	0	0	112.3	R59 D69 K70 E71 K76 K77	R59-E73 VanDerWaalsContact CZ-CB 3.47Å; R59-E73 VanDerWaalsContact NH1-CG 3.34Å; R59-E73 VanDerWaalsContact NH2-CB 3.27Å; D69-E73 PolarHBondContact O-N 2.83Å; K70-E73 PolarHBondContact O-N 3.37Å; E71-E73 VanDerWaalsContact C-N 3.26Å; E71-E73 PolarHBondContact O-N 2.98Å; E73-K76 PolarHBondContact O-N 2.94Å; E73-K77 WeakPolarHBondContact O-CG 3.47Å; E73-K77 PolarHBondContact O-N 3.3Å; E73-K77 VanDerWaalsContact O-N 3.14Å; E73-K77 WeakPolarHBondContact OE1-CE 3.33Å; E73-K77 IonicContact OE1-NZ 3.05Å; E73-K77 PolarHBondContact OE1-NZ 3.45Å
74	I	92.3	Very high	90.6	Very high	22 Å²	22	57.9 Å²	57.9	11%	0.113	28%	0.281	C	S	.	.	H	α-helix	trans	-62.9	-47.8	177.4	-71.3	168.1	0	0	0	109.5	K70 E71 K76 K77 V78 V106 L109	K70-I74 HydrophobicContact CD-CD1 4.45Å; K70-I74 HydrophobicContact CG-CD1 3.9Å; K70-I74 WeakPolarHBondContact O-CG1 3.47Å; K70-I74 PolarHBondContact O-N 3.45Å; E71-I74 PolarHBondContact O-N 3.47Å; E71-I74 VanDerWaalsContact O-N 3.08Å; I74-K76 VanDerWaalsContact C-N 3.34Å; I74-K76 PolarHBondContact O-N 3.41Å; I74-K77 WeakPolarHBondContact O-CA 3.46Å; I74-K77 WeakPolarHBondContact O-CB 3.33Å; I74-K77 PolarHBondContact O-N 3.49Å; I74-V78 HydrophobicContact CG2-CG2 4.18Å; I74-V78 WeakPolarHBondContact O-CG2 3.35Å; I74-V78 PolarHBondContact O-N 3.31Å; I74-V106 HydrophobicContact CG2-CG1 4.31Å; I74-V106 HydrophobicContact CG2-CG2 4.49Å; I74-L109 HydrophobicContact CD1-CB 4.09Å; I74-L109 HydrophobicContact CG2-CB 3.55Å; I74-L109 HydrophobicContact CG2-CD1 3.84Å; I74-L109 HydrophobicContact CG2-CG 4.32Å
75	R	94.8	Very high	90.9	Very high	64 Å²	64	55.1 Å²	55.1	24%	0.242	27%	0.266	C	S	.	.	H	α-helix	trans	-57.3	-44.6	177.3	-172.5	174.9	-76.9	116.6	4.4	111.4	E71 K77 V78 L79 E103 V106	E71-R75 WeakPolarHBondContact O-CB 3.34Å; E71-R75 PolarHBondContact O-N 3.34Å; E71-R75 IonicContact OE1-CZ 3.62Å; E71-R75 IonicContact OE1-NH1 2.93Å; E71-R75 PolarHBondContact OE1-NH1 3.45Å; E71-R75 IonicContact OE1-NH2 3.93Å; E71-R75 PolarHBondContact OE1-NH2 3.07Å; R75-K77 VanDerWaalsContact C-N 3.3Å; R75-K77 PolarHBondContact O-N 2.69Å; R75-V78 PolarHBondContact O-N 3.49Å; R75-L79 HydrophobicContact CG-CD1 3.76Å; R75-L79 HydrophobicContact CG-CG 4.14Å; R75-L79 WeakPolarHBondContact O-CB 3.27Å; R75-L79 VanDerWaalsContact O-CG 3.31Å; R75-L79 WeakPolarHBondContact O-CG 3.4Å; R75-L79 PolarHBondContact O-N 2.9Å; R75-E103 IonicContact CZ-OE1 3.55Å; R75-E103 IonicContact CZ-OE2 3.43Å; R75-E103 IonicContact NE-OE1 3.2Å; R75-E103 PolarHBondContact NE-OE1 2.94Å; R75-E103 IonicContact NE-OE2 3.38Å; R75-E103 IonicContact NH2-OE1 3.94Å; R75-E103 PolarHBondContact NH2-OE1 3.06Å; R75-E103 IonicContact NH2-OE2 2.67Å; R75-E103 PolarHBondContact NH2-OE2 2.88Å; R75-V106 HydrophobicContact CB-CG1 4.32Å; R75-V106 HydrophobicContact CB-CG2 4.21Å; R75-V106 HydrophobicContact CG-CG2 4.39Å
76	K	92.9	Very high	91.1	Very high	133 Å²	133	56.7 Å²	56.7	58%	0.578	27%	0.27	S	S	*	.	H	α-helix	trans	-57.9	-39.5	173.9	-77.1	175.6	-178.2	179.6	0	113	V72 E73 I74 K80	V72-K76 HydrophobicContact CG1-CD 4.4Å; V72-K76 WeakPolarHBondContact O-CB 3.49Å; V72-K76 VanDerWaalsContact O-CG 3.3Å; V72-K76 WeakPolarHBondContact O-CG 3.26Å; V72-K76 PolarHBondContact O-N 3.3Å; E73-K76 PolarHBondContact O-N 2.94Å; I74-K76 VanDerWaalsContact C-N 3.34Å; I74-K76 PolarHBondContact O-N 3.41Å; K76-K80 WeakPolarHBondContact O-CB 3.38Å; K76-K80 PolarHBondContact O-N 2.75Å
77	K	91.9	Very high	91.2	Very high	106 Å²	106	62.3 Å²	62.3	46%	0.461	29%	0.294	S	S	.	.	H	α-helix	trans	-71.2	-42	177.6	-72	173.7	-175.8	163.2	0	112.3	E73 I74 R75 K80	E73-K77 WeakPolarHBondContact O-CG 3.47Å; E73-K77 PolarHBondContact O-N 3.3Å; E73-K77 VanDerWaalsContact O-N 3.14Å; E73-K77 WeakPolarHBondContact OE1-CE 3.33Å; E73-K77 IonicContact OE1-NZ 3.05Å; E73-K77 PolarHBondContact OE1-NZ 3.45Å; I74-K77 WeakPolarHBondContact O-CA 3.46Å; I74-K77 WeakPolarHBondContact O-CB 3.33Å; I74-K77 PolarHBondContact O-N 3.49Å; R75-K77 VanDerWaalsContact C-N 3.3Å; R75-K77 PolarHBondContact O-N 2.69Å; K77-K80 WeakPolarHBondContact O-CB 3.44Å; K77-K80 PolarHBondContact O-N 2.65Å
78	V	93.9	Very high	91.3	Very high	1 Å²	1	62 Å²	62	1%	0.006	29%	0.289	C	S	.	.	H	α-helix	trans	-65.5	-50.3	178.6	177.5	0	0	0	0	109.8	I74 R75 K80 I81 Y82 V102 I105 V106 L109 M122	I74-V78 HydrophobicContact CG2-CG2 4.18Å; I74-V78 WeakPolarHBondContact O-CG2 3.35Å; I74-V78 PolarHBondContact O-N 3.31Å; R75-V78 PolarHBondContact O-N 3.49Å; V78-K80 PolarHBondContact O-N 3.08Å; V78-K80 VanDerWaalsContact O-N 3.15Å; V78-I81 CarbonylContact O-C 3.35Å; V78-I81 WeakPolarHBondContact O-CA 3.49Å; V78-I81 PolarHBondContact O-N 3.5Å; V78-Y82 HydrophobicContact CG1-CD2 3.71Å; V78-Y82 HydrophobicContact CG1-CE2 4.31Å; V78-Y82 HydrophobicContact CG1-CG 4.25Å; V78-Y82 PolarHBondContact O-N 2.9Å; V78-V102 HydrophobicContact CG1-CG1 3.92Å; V78-I105 HydrophobicContact CG1-CG2 4.02Å; V78-I105 HydrophobicContact CG2-CG2 3.86Å; V78-V106 HydrophobicContact CB-CG2 4.11Å; V78-V106 HydrophobicContact CG1-CG2 4.29Å; V78-V106 HydrophobicContact CG2-CG2 4Å; V78-L109 HydrophobicContact CG2-CD1 3.88Å; V78-M122 HydrophobicContact CB-CE 4.43Å; V78-M122 HydrophobicContact CG2-CE 3.85Å; V78-M122 HydrophobicContact CG2-SD 4.28Å
79	L	93.4	Very high	91.3	Very high	84 Å²	84	61.5 Å²	61.5	44%	0.44	28%	0.283	S	S	.	.	H	α-helix	trans	-62.6	-23.1	179.1	-69.8	176	0	0	0	113.8	R75 I81 Y82 V102	R75-L79 HydrophobicContact CG-CD1 3.76Å; R75-L79 HydrophobicContact CG-CG 4.14Å; R75-L79 WeakPolarHBondContact O-CB 3.27Å; R75-L79 VanDerWaalsContact O-CG 3.31Å; R75-L79 WeakPolarHBondContact O-CG 3.4Å; R75-L79 PolarHBondContact O-N 2.9Å; L79-I81 PolarHBondContact O-N 2.85Å; L79-Y82 CarbonylContact O-C 3.52Å; L79-V102 HydrophobicContact CD2-CG1 4.21Å
80	K	91.8	Very high	91.5	Very high	144 Å²	144	66.4 Å²	66.4	63%	0.626	32%	0.315	S	S	*	.	H	α-helix	trans	-68.3	-26.4	172.6	-172.1	174.3	-178.6	176.8	0	112.7	K76 K77 V78	K76-K80 WeakPolarHBondContact O-CB 3.38Å; K76-K80 PolarHBondContact O-N 2.75Å; K77-K80 WeakPolarHBondContact O-CB 3.44Å; K77-K80 PolarHBondContact O-N 2.65Å; V78-K80 PolarHBondContact O-N 3.08Å; V78-K80 VanDerWaalsContact O-N 3.15Å
81	I	90.9	Very high	91.8	Very high	26 Å²	26	67.8 Å²	67.8	13%	0.133	33%	0.327	C	S	.	.	H	α-helix	trans	-97	-45.1	177.7	-62.7	164.2	0	0	0	109.7	V78 L79 N83 M122 Y125 Q126 I133	V78-I81 CarbonylContact O-C 3.35Å; V78-I81 WeakPolarHBondContact O-CA 3.49Å; V78-I81 PolarHBondContact O-N 3.5Å; L79-I81 PolarHBondContact O-N 2.85Å; I81-N83 PolarHBondContact O-N 3.29Å; I81-M122 HydrophobicContact CD1-CE 3.6Å; I81-Y125 HydrophobicContact CG2-CD1 3.8Å; I81-Y125 HydrophobicContact CG2-CE1 4.27Å; I81-Q126 HydrophobicContact CG2-CB 4.05Å; I81-Q126 HydrophobicContact CG2-CG 4.43Å; I81-I133 HydrophobicContact CG2-CD1 4.03Å; I81-I133 VanDerWaalsContact O-CD1 3.3Å; I81-I133 WeakPolarHBondContact O-CD1 3.46Å; I81-I133 VanDerWaalsContact O-CG1 3.28Å; I81-I133 WeakPolarHBondContact O-CG1 3.4Å
82	Y	91.8	Very high	91.9	Very high	13 Å²	13	69.5 Å²	69.5	5%	0.051	34%	0.337	C	S	.	.			trans	-90.5	68.8	179.4	-71.5	-102.1	0	0	0	110.2	V78 L79 F98 V102 I105 M122 Y125	V78-Y82 HydrophobicContact CG1-CD2 3.71Å; V78-Y82 HydrophobicContact CG1-CE2 4.31Å; V78-Y82 HydrophobicContact CG1-CG 4.25Å; V78-Y82 PolarHBondContact O-N 2.9Å; L79-Y82 CarbonylContact O-C 3.52Å; Y82-F98 AromaticContact CD1-CE2 3.57Å; Y82-F98 HydrophobicContact CD1-CE2 3.57Å; Y82-F98 AromaticContact CD1-CZ 3.71Å; Y82-F98 HydrophobicContact CD1-CZ 3.71Å; Y82-F98 HydrophobicContact CE1-CE2 4.26Å; Y82-F98 HydrophobicContact CG-CZ 4.31Å; Y82-V102 HydrophobicContact CD1-CG2 3.71Å; Y82-V102 HydrophobicContact CG-CG2 3.88Å; Y82-I105 HydrophobicContact CE1-CD1 3.96Å; Y82-I105 HydrophobicContact CE2-CD1 4.05Å; Y82-I105 WeakPolarHBondContact OH-CD1 3.29Å; Y82-M122 HydrophobicContact CE2-CG 4.09Å; Y82-Y125 HydrophobicContact CD1-CD1 4.37Å; Y82-Y125 AromaticContact CD1-CE1 4Å; Y82-Y125 HydrophobicContact CD1-CE1 4Å; Y82-Y125 HydrophobicContact CD1-CE2 4.17Å; Y82-Y125 AromaticContact CD1-CZ 3.86Å; Y82-Y125 HydrophobicContact CD2-CD1 4.44Å; Y82-Y125 HydrophobicContact CD2-CE1 4.47Å; Y82-Y125 HydrophobicContact CE1-CD1 4.06Å; Y82-Y125 AromaticContact CE1-CD2 3.84Å; Y82-Y125 HydrophobicContact CE1-CD2 3.84Å; Y82-Y125 HydrophobicContact CE1-CE1 4.09Å; Y82-Y125 AromaticContact CE1-CE2 3.85Å; Y82-Y125 HydrophobicContact CE1-CE2 3.85Å; Y82-Y125 AromaticContact CE1-CG 3.93Å; Y82-Y125 HydrophobicContact CE1-CG 3.93Å; Y82-Y125 AromaticContact CE1-CZ 3.97Å; Y82-Y125 HydrophobicContact CE2-CD1 4.13Å; Y82-Y125 HydrophobicContact CE2-CG 4.4Å; Y82-Y125 HydrophobicContact CG-CE1 4.18Å; Y82-Y125 AromaticContact CZ-CD1 3.92Å; Y82-Y125 AromaticContact CZ-CG 3.79Å
83	N	90.9	Very high	92.1	Very high	32 Å²	32	76.6 Å²	76.6	17%	0.171	36%	0.36	C	S	.	.			trans	-107.2	29.7	-173.9	67.9	-15.6	0	0	0	113.6	I81 I133 N136	I81-N83 PolarHBondContact O-N 3.29Å; N83-I133 PolarHBondContact ND2-O 3.19Å; N83-I133 WeakPolarHBondContact OD1-CA 3.39Å; N83-N136 HydrophobicContact CB-CB 4.48Å; N83-N136 WeakPolarHBondContact ND2-CB 3.28Å; N83-N136 PolarHBondContact O-ND2 3.34Å
84	K	90	Very high	92.3	Very high	54 Å²	54	78.4 Å²	78.4	24%	0.235	37%	0.368	C	S	.	.			trans	-75.4	139.4	171.9	-66.2	-175.6	178.2	179.9	0	109.9	D88 F89 F98 Y125 N129	K84-D88 WeakPolarHBondContact CA-OD2 3.03Å; K84-D88 HydrophobicContact CB-CB 4.41Å; K84-F89 HydrophobicContact CB-CE2 3.64Å; K84-F89 HydrophobicContact CB-CZ 3.91Å; K84-F89 HydrophobicContact CD-CE2 4.34Å; K84-F89 HydrophobicContact CD-CZ 3.84Å; K84-F98 HydrophobicContact CB-CE1 4Å; K84-F98 HydrophobicContact CB-CZ 4Å; K84-F98 HydrophobicContact CD-CE2 4.4Å; K84-F98 HydrophobicContact CD-CZ 4.39Å; K84-F98 HydrophobicContact CG-CZ 4.34Å; K84-Y125 WeakPolarHBondContact CD-OH 3.49Å; K84-Y125 WeakPolarHBondContact CE-OH 3.49Å; K84-N129 PolarHBondContact NZ-OD1 3.42Å
85	R	88.6	Confident	92.4	Very high	68 Å²	68	79.8 Å²	79.8	26%	0.257	37%	0.372	S	S	.	.			trans	-100.9	166	177.2	-65.7	-172.3	176.5	-179.8	0	110.7	E87 D88 F89 E143	R85-E87 PolarHBondContact O-N 3.34Å; R85-E87 VanDerWaalsContact O-N 3.16Å; R85-D88 PolarHBondContact N-OD2 3.22Å; R85-D88 WeakPolarHBondContact O-CB 3.4Å; R85-D88 PolarHBondContact O-N 3.13Å; R85-F89 WeakPolarHBondContact O-CD2 3.31Å; R85-E143 IonicContact CZ-OE1 3.46Å; R85-E143 IonicContact CZ-OE2 3.22Å; R85-E143 IonicContact NH1-OE1 2.71Å; R85-E143 PolarHBondContact NH1-OE1 3.01Å; R85-E143 IonicContact NH1-OE2 3.5Å; R85-E143 PolarHBondContact NH1-OE2 3.22Å; R85-E143 IonicContact NH2-OE1 3.9Å; R85-E143 PolarHBondContact NH2-OE1 3.1Å; R85-E143 IonicContact NH2-OE2 3.15Å; R85-E143 PolarHBondContact NH2-OE2 3.09Å
86	E	90.4	Very high	92.4	Very high	110 Å²	110	80.5 Å²	80.5	51%	0.514	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-50.7	-38.5	173.2	-171.2	-178.8	168.8	0	0	112.1	D88 F89 L92 Y95	E86-D88 PolarHBondContact O-N 2.98Å; E86-F89 PolarHBondContact O-N 3.49Å; E86-F89 VanDerWaalsContact O-N 3.1Å; E86-L92 HydrophobicContact CG-CD1 4.46Å; E86-Y95 HydrophobicContact CB-CD1 3.96Å; E86-Y95 HydrophobicContact CB-CD2 4.32Å; E86-Y95 HydrophobicContact CB-CE1 3.92Å; E86-Y95 HydrophobicContact CB-CE2 4.3Å; E86-Y95 HydrophobicContact CB-CG 4.15Å; E86-Y95 HydrophobicContact CG-CD1 3.92Å; E86-Y95 HydrophobicContact CG-CE1 4.27Å; E86-Y95 HydrophobicContact CG-CG 4.22Å
87	E	89.3	Confident	92.5	Very high	150 Å²	150	78.3 Å²	78.3	70%	0.701	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-60.2	-23.5	176.1	-60.4	172.4	-166.7	0	0	114.7	R85 F89	R85-E87 PolarHBondContact O-N 3.34Å; R85-E87 VanDerWaalsContact O-N 3.16Å; E87-F89 VanDerWaalsContact C-N 3.28Å
88	D	88.7	Confident	92.6	Very high	68 Å²	68	74 Å²	74	36%	0.364	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-83.7	-5.4	-179.7	-62.8	-44.7	0	0	0	112.1	K84 R85 E86 N136	K84-D88 WeakPolarHBondContact CA-OD2 3.03Å; K84-D88 HydrophobicContact CB-CB 4.41Å; R85-D88 PolarHBondContact N-OD2 3.22Å; R85-D88 WeakPolarHBondContact O-CB 3.4Å; R85-D88 PolarHBondContact O-N 3.13Å; E86-D88 PolarHBondContact O-N 2.98Å; D88-N136 PolarHBondContact OD2-ND2 3.43Å
89	F	91.9	Very high	92.7	Very high	40 Å²	40	77.1 Å²	77.1	18%	0.175	37%	0.373	C	S	.	.	S	Bend	trans	-110.5	146.1	-178.9	-65.7	-87.4	0	0	0	111.9	K84 R85 E86 E87 S91 E94 Y95 F98	K84-F89 HydrophobicContact CB-CE2 3.64Å; K84-F89 HydrophobicContact CB-CZ 3.91Å; K84-F89 HydrophobicContact CD-CE2 4.34Å; K84-F89 HydrophobicContact CD-CZ 3.84Å; R85-F89 WeakPolarHBondContact O-CD2 3.31Å; E86-F89 PolarHBondContact O-N 3.49Å; E86-F89 VanDerWaalsContact O-N 3.1Å; E87-F89 VanDerWaalsContact C-N 3.28Å; F89-S91 VanDerWaalsContact C-N 3.33Å; F89-E94 HydrophobicContact CD1-CB 4.04Å; F89-Y95 AromaticContact CD2-CD2 3.61Å; F89-Y95 HydrophobicContact CD2-CD2 3.61Å; F89-Y95 HydrophobicContact CD2-CG 4.24Å; F89-Y95 AromaticContact CE2-CD2 3.67Å; F89-Y95 HydrophobicContact CE2-CD2 3.67Å; F89-Y95 HydrophobicContact CE2-CE2 4.43Å; F89-F98 HydrophobicContact CE1-CB 4.04Å; F89-F98 HydrophobicContact CE1-CG 4.19Å; F89-F98 AromaticContact CE2-CD1 3.98Å; F89-F98 HydrophobicContact CE2-CD1 3.98Å; F89-F98 HydrophobicContact CE2-CE1 4.44Å; F89-F98 HydrophobicContact CE2-CG 4.25Å; F89-F98 HydrophobicContact CZ-CB 3.75Å; F89-F98 AromaticContact CZ-CD1 3.67Å; F89-F98 HydrophobicContact CZ-CD1 3.67Å; F89-F98 AromaticContact CZ-CD2 3.91Å; F89-F98 HydrophobicContact CZ-CD2 3.91Å; F89-F98 HydrophobicContact CZ-CE1 4.21Å; F89-F98 HydrophobicContact CZ-CE2 4.41Å; F89-F98 AromaticContact CZ-CG 3.49Å; F89-F98 HydrophobicContact CZ-CG 3.49Å; F89-F98 VanDerWaalsContact CZ-CG 3.49Å
90	P	93.4	Very high	92.8	Very high	109 Å²	109	79.6 Å²	79.6	71%	0.708	38%	0.383	S	S	*	.	S	Bend	trans	-76.4	-20.7	177.9	32.3	-36.2	0	0	0	112.9	E94	P90-E94 VanDerWaalsContact CD-OE2 3.24Å; P90-E94 WeakPolarHBondContact CD-OE2 3.49Å; P90-E94 WeakPolarHBondContact CG-OE1 3.44Å; P90-E94 WeakPolarHBondContact CG-OE2 3.32Å
91	S	95.8	Very high	92.8	Very high	45 Å²	45	77.9 Å²	77.9	32%	0.315	38%	0.377	S	S	.	.	S	Bend	trans	-142.1	148.5	-178.9	75.1	0	0	0	0	112.2	F89 R93 E94 Y95	F89-S91 VanDerWaalsContact C-N 3.33Å; S91-R93 PolarHBondContact O-N 2.87Å; S91-E94 PolarHBondContact O-N 3.26Å; S91-E94 WeakPolarHBondContact OG-CG 3.45Å; S91-E94 PolarHBondContact OG-N 2.85Å; S91-E94 PolarHBondContact OG-OE1 3.28Å; S91-E94 VanDerWaalsContact OG-OE1 3.12Å; S91-Y95 PolarHBondContact O-N 2.96Å
92	L	95.1	Very high	93	Very high	96 Å²	96	76.9 Å²	76.9	50%	0.503	37%	0.372	S	S	.	.	H	α-helix	trans	-62.3	-29.4	175.6	-178.2	62.1	0	0	0	112.2	E86 Y95 N96	E86-L92 HydrophobicContact CG-CD1 4.46Å; L92-Y95 HydrophobicContact CD1-CD1 4.2Å; L92-Y95 PolarHBondContact O-N 3.27Å; L92-N96 VanDerWaalsContact O-CG 3.3Å; L92-N96 PolarHBondContact O-N 3.36Å; L92-N96 PolarHBondContact O-ND2 3.08Å
93	R	95.9	Very high	93.2	Very high	190 Å²	190	79.8 Å²	79.8	72%	0.717	39%	0.386	S	S	*	.	H	α-helix	trans	-65.2	-47.7	178	-173.2	174.2	-176.3	173.6	2.8	111.3	S91 Y95 N96 D97	S91-R93 PolarHBondContact O-N 2.87Å; R93-Y95 VanDerWaalsContact C-N 3.28Å; R93-Y95 PolarHBondContact O-N 3.37Å; R93-N96 PolarHBondContact O-N 2.77Å; R93-D97 VanDerWaalsContact O-CG 3.24Å; R93-D97 PolarHBondContact O-N 3.05Å
94	E	94.3	Very high	93.3	Very high	91 Å²	91	83.1 Å²	83.1	43%	0.425	40%	0.401	S	S	.	.	H	α-helix	trans	-62.9	-36	177.2	-74	168	-129.4	0	0	112.2	F89 P90 S91 F98	F89-E94 HydrophobicContact CD1-CB 4.04Å; P90-E94 VanDerWaalsContact CD-OE2 3.24Å; P90-E94 WeakPolarHBondContact CD-OE2 3.49Å; P90-E94 WeakPolarHBondContact CG-OE1 3.44Å; P90-E94 WeakPolarHBondContact CG-OE2 3.32Å; S91-E94 PolarHBondContact O-N 3.26Å; S91-E94 WeakPolarHBondContact OG-CG 3.45Å; S91-E94 PolarHBondContact OG-N 2.85Å; S91-E94 PolarHBondContact OG-OE1 3.28Å; S91-E94 VanDerWaalsContact OG-OE1 3.12Å; E94-F98 VanDerWaalsContact O-CB 3.31Å; E94-F98 WeakPolarHBondContact O-CB 3.26Å; E94-F98 PolarHBondContact O-N 2.72Å
95	Y	94.3	Very high	93.5	Very high	51 Å²	51	81.2 Å²	81.2	20%	0.2	39%	0.393	C	S	.	.	H	α-helix	trans	-64.7	-43.9	173.9	178.2	-118.2	0	0	0	112.1	E86 F89 S91 L92 R93 F98 L99	E86-Y95 HydrophobicContact CB-CD1 3.96Å; E86-Y95 HydrophobicContact CB-CD2 4.32Å; E86-Y95 HydrophobicContact CB-CE1 3.92Å; E86-Y95 HydrophobicContact CB-CE2 4.3Å; E86-Y95 HydrophobicContact CB-CG 4.15Å; E86-Y95 HydrophobicContact CG-CD1 3.92Å; E86-Y95 HydrophobicContact CG-CE1 4.27Å; E86-Y95 HydrophobicContact CG-CG 4.22Å; F89-Y95 AromaticContact CD2-CD2 3.61Å; F89-Y95 HydrophobicContact CD2-CD2 3.61Å; F89-Y95 HydrophobicContact CD2-CG 4.24Å; F89-Y95 AromaticContact CE2-CD2 3.67Å; F89-Y95 HydrophobicContact CE2-CD2 3.67Å; F89-Y95 HydrophobicContact CE2-CE2 4.43Å; S91-Y95 PolarHBondContact O-N 2.96Å; L92-Y95 HydrophobicContact CD1-CD1 4.2Å; L92-Y95 PolarHBondContact O-N 3.27Å; R93-Y95 VanDerWaalsContact C-N 3.28Å; R93-Y95 PolarHBondContact O-N 3.37Å; Y95-F98 WeakPolarHBondContact O-CB 3.5Å; Y95-F98 PolarHBondContact O-N 2.9Å; Y95-L99 HydrophobicContact CD1-CD1 4.2Å; Y95-L99 HydrophobicContact CE1-CD1 3.66Å; Y95-L99 HydrophobicContact CE1-CG 4.33Å; Y95-L99 HydrophobicContact CE2-CD1 4.37Å; Y95-L99 HydrophobicContact CE2-CD2 4.19Å; Y95-L99 HydrophobicContact CE2-CG 4.19Å; Y95-L99 WeakPolarHBondContact O-CG 3.5Å; Y95-L99 PolarHBondContact O-N 3.43Å
96	N	95.1	Very high	93.8	Very high	80 Å²	80	78 Å²	78	43%	0.428	38%	0.381	S	S	.	.	H	α-helix	trans	-66.9	-40.8	177.2	-70.3	-26.7	0	0	0	112.3	L92 R93 F98 L99 E100	L92-N96 VanDerWaalsContact O-CG 3.3Å; L92-N96 PolarHBondContact O-N 3.36Å; L92-N96 PolarHBondContact O-ND2 3.08Å; R93-N96 PolarHBondContact O-N 2.77Å; N96-F98 VanDerWaalsContact C-N 3.27Å; N96-F98 PolarHBondContact O-N 3.23Å; N96-L99 PolarHBondContact O-N 3.46Å; N96-E100 PolarHBondContact O-N 3.48Å
97	D	95.4	Very high	93.9	Very high	86 Å²	86	78.9 Å²	78.9	46%	0.46	38%	0.383	S	S	.	.	H	α-helix	trans	-61.4	-39.5	174.6	-66	-22.5	0	0	0	110.2	R93 E100 E101	R93-D97 VanDerWaalsContact O-CG 3.24Å; R93-D97 PolarHBondContact O-N 3.05Å; D97-E100 PolarHBondContact O-N 2.95Å; D97-E101 WeakPolarHBondContact O-CG 3.15Å; D97-E101 PolarHBondContact O-N 3.14Å
98	F	94.1	Very high	94.1	Very high	16 Å²	16	72.8 Å²	72.8	7%	0.07	36%	0.355	C	S	.	.	H	α-helix	trans	-64	-39.6	173.4	173.8	-101.9	0	0	0	113.3	Y82 K84 F89 E94 Y95 N96 E100 E101 V102 Y125	Y82-F98 AromaticContact CD1-CE2 3.57Å; Y82-F98 HydrophobicContact CD1-CE2 3.57Å; Y82-F98 AromaticContact CD1-CZ 3.71Å; Y82-F98 HydrophobicContact CD1-CZ 3.71Å; Y82-F98 HydrophobicContact CE1-CE2 4.26Å; Y82-F98 HydrophobicContact CG-CZ 4.31Å; K84-F98 HydrophobicContact CB-CE1 4Å; K84-F98 HydrophobicContact CB-CZ 4Å; K84-F98 HydrophobicContact CD-CE2 4.4Å; K84-F98 HydrophobicContact CD-CZ 4.39Å; K84-F98 HydrophobicContact CG-CZ 4.34Å; F89-F98 HydrophobicContact CE1-CB 4.04Å; F89-F98 HydrophobicContact CE1-CG 4.19Å; F89-F98 AromaticContact CE2-CD1 3.98Å; F89-F98 HydrophobicContact CE2-CD1 3.98Å; F89-F98 HydrophobicContact CE2-CE1 4.44Å; F89-F98 HydrophobicContact CE2-CG 4.25Å; F89-F98 HydrophobicContact CZ-CB 3.75Å; F89-F98 AromaticContact CZ-CD1 3.67Å; F89-F98 HydrophobicContact CZ-CD1 3.67Å; F89-F98 AromaticContact CZ-CD2 3.91Å; F89-F98 HydrophobicContact CZ-CD2 3.91Å; F89-F98 HydrophobicContact CZ-CE1 4.21Å; F89-F98 HydrophobicContact CZ-CE2 4.41Å; F89-F98 AromaticContact CZ-CG 3.49Å; F89-F98 HydrophobicContact CZ-CG 3.49Å; F89-F98 VanDerWaalsContact CZ-CG 3.49Å; E94-F98 VanDerWaalsContact O-CB 3.31Å; E94-F98 WeakPolarHBondContact O-CB 3.26Å; E94-F98 PolarHBondContact O-N 2.72Å; Y95-F98 WeakPolarHBondContact O-CB 3.5Å; Y95-F98 PolarHBondContact O-N 2.9Å; N96-F98 VanDerWaalsContact C-N 3.27Å; N96-F98 PolarHBondContact O-N 3.23Å; F98-E100 VanDerWaalsContact C-N 3.35Å; F98-E101 PolarHBondContact O-N 3.33Å; F98-V102 HydrophobicContact CE1-CG2 4.27Å; F98-V102 HydrophobicContact CZ-CG2 4.24Å; F98-V102 WeakPolarHBondContact O-CG2 3.05Å; F98-V102 PolarHBondContact O-N 3.37Å; F98-V102 VanDerWaalsContact O-N 3.09Å; F98-Y125 HydrophobicContact CE2-CE2 4.31Å; F98-Y125 WeakPolarHBondContact CE2-OH 3.38Å
99	L	94.8	Very high	94.2	Very high	67 Å²	67	70.6 Å²	70.6	35%	0.351	34%	0.344	S	S	.	.	H	α-helix	trans	-65.9	-38.5	175.1	-69.9	179.7	0	0	0	111.8	Y95 N96 V102 E103	Y95-L99 HydrophobicContact CD1-CD1 4.2Å; Y95-L99 HydrophobicContact CE1-CD1 3.66Å; Y95-L99 HydrophobicContact CE1-CG 4.33Å; Y95-L99 HydrophobicContact CE2-CD1 4.37Å; Y95-L99 HydrophobicContact CE2-CD2 4.19Å; Y95-L99 HydrophobicContact CE2-CG 4.19Å; Y95-L99 WeakPolarHBondContact O-CG 3.5Å; Y95-L99 PolarHBondContact O-N 3.43Å; N96-L99 PolarHBondContact O-N 3.46Å; L99-V102 WeakPolarHBondContact O-CB 3.43Å; L99-V102 PolarHBondContact O-N 3.03Å; L99-E103 PolarHBondContact O-N 3.44Å
100	E	95.7	Very high	94.1	Very high	135 Å²	135	69.5 Å²	69.5	63%	0.631	34%	0.34	S	S	*	.	H	α-helix	trans	-63.8	-43	174.8	-170.5	64.9	-154.1	0	0	111.3	N96 D97 F98 V102 E103 E104	N96-E100 PolarHBondContact O-N 3.48Å; D97-E100 PolarHBondContact O-N 2.95Å; F98-E100 VanDerWaalsContact C-N 3.35Å; E100-V102 VanDerWaalsContact C-N 3.27Å; E100-V102 PolarHBondContact O-N 3.01Å; E100-E103 PolarHBondContact O-N 2.99Å; E100-E103 VanDerWaalsContact O-N 3.13Å; E100-E104 PolarHBondContact O-N 3.23Å
101	E	93.1	Very high	93.9	Very high	109 Å²	109	68.2 Å²	68.2	51%	0.509	33%	0.327	S	S	.	.	H	α-helix	trans	-58.5	-39.4	173.5	-73.7	-178.8	-176.7	0	0	112.1	D97 F98 E104 I105	D97-E101 WeakPolarHBondContact O-CG 3.15Å; D97-E101 PolarHBondContact O-N 3.14Å; F98-E101 PolarHBondContact O-N 3.33Å; E101-E104 PolarHBondContact O-N 2.98Å; E101-I105 VanDerWaalsContact O-CG1 3.27Å; E101-I105 WeakPolarHBondContact O-CG1 3.4Å; E101-I105 PolarHBondContact O-N 3.44Å
102	V	94.9	Very high	93.4	Very high	4 Å²	4	70.9 Å²	70.9	2%	0.024	34%	0.338	C	S	.	.	H	α-helix	trans	-63.6	-43.2	175.7	168.2	0	0	0	0	110.9	V78 L79 Y82 F98 L99 E100 I105 V106	V78-V102 HydrophobicContact CG1-CG1 3.92Å; L79-V102 HydrophobicContact CD2-CG1 4.21Å; Y82-V102 HydrophobicContact CD1-CG2 3.71Å; Y82-V102 HydrophobicContact CG-CG2 3.88Å; F98-V102 HydrophobicContact CE1-CG2 4.27Å; F98-V102 HydrophobicContact CZ-CG2 4.24Å; F98-V102 WeakPolarHBondContact O-CG2 3.05Å; F98-V102 PolarHBondContact O-N 3.37Å; F98-V102 VanDerWaalsContact O-N 3.09Å; L99-V102 WeakPolarHBondContact O-CB 3.43Å; L99-V102 PolarHBondContact O-N 3.03Å; E100-V102 VanDerWaalsContact C-N 3.27Å; E100-V102 PolarHBondContact O-N 3.01Å; V102-I105 WeakPolarHBondContact O-CB 3.31Å; V102-I105 PolarHBondContact O-N 3.27Å; V102-V106 WeakPolarHBondContact O-CG2 3.3Å; V102-V106 PolarHBondContact O-N 2.8Å
103	E	95.2	Very high	93	Very high	74 Å²	74	70 Å²	70	35%	0.346	34%	0.336	S	S	.	.	H	α-helix	trans	-68.1	-37	177.1	-74	-58.5	147.8	0	0	112.4	R75 L99 E100 I105 V106 F107	R75-E103 IonicContact CZ-OE1 3.55Å; R75-E103 IonicContact CZ-OE2 3.43Å; R75-E103 IonicContact NE-OE1 3.2Å; R75-E103 PolarHBondContact NE-OE1 2.94Å; R75-E103 IonicContact NE-OE2 3.38Å; R75-E103 IonicContact NH2-OE1 3.94Å; R75-E103 PolarHBondContact NH2-OE1 3.06Å; R75-E103 IonicContact NH2-OE2 2.67Å; R75-E103 PolarHBondContact NH2-OE2 2.88Å; L99-E103 PolarHBondContact O-N 3.44Å; E100-E103 PolarHBondContact O-N 2.99Å; E100-E103 VanDerWaalsContact O-N 3.13Å; E103-I105 VanDerWaalsContact C-N 3.31Å; E103-I105 PolarHBondContact O-N 3.15Å; E103-V106 PolarHBondContact O-N 2.9Å; E103-F107 VanDerWaalsContact O-CB 3.28Å; E103-F107 WeakPolarHBondContact O-CB 3.49Å; E103-F107 PolarHBondContact O-N 3.21Å
104	E	94.3	Very high	92.6	Very high	103 Å²	103	64.6 Å²	64.6	48%	0.481	32%	0.322	S	S	.	.	H	α-helix	trans	-59.5	-43.5	172.4	-167.2	-169.9	165.8	0	0	111.1	E100 E101 F107 N108	E100-E104 PolarHBondContact O-N 3.23Å; E101-E104 PolarHBondContact O-N 2.98Å; E104-F107 PolarHBondContact O-N 3.39Å; E104-N108 VanDerWaalsContact O-CB 3.31Å; E104-N108 WeakPolarHBondContact O-CB 3.44Å; E104-N108 PolarHBondContact O-N 3.36Å; E104-N108 PolarHBondContact O-ND2 3.05Å
105	I	93.1	Very high	92.3	Very high	13 Å²	13	62.8 Å²	62.8	7%	0.067	32%	0.315	C	S	.	.	H	α-helix	trans	-61.8	-46.8	175.6	-71.2	166.6	0	0	0	111	V78 Y82 E101 V102 E103 N108 L109 T118 M122	V78-I105 HydrophobicContact CG1-CG2 4.02Å; V78-I105 HydrophobicContact CG2-CG2 3.86Å; Y82-I105 HydrophobicContact CE1-CD1 3.96Å; Y82-I105 HydrophobicContact CE2-CD1 4.05Å; Y82-I105 WeakPolarHBondContact OH-CD1 3.29Å; E101-I105 VanDerWaalsContact O-CG1 3.27Å; E101-I105 WeakPolarHBondContact O-CG1 3.4Å; E101-I105 PolarHBondContact O-N 3.44Å; V102-I105 WeakPolarHBondContact O-CB 3.31Å; V102-I105 PolarHBondContact O-N 3.27Å; E103-I105 VanDerWaalsContact C-N 3.31Å; E103-I105 PolarHBondContact O-N 3.15Å; I105-N108 PolarHBondContact O-N 3.01Å; I105-L109 HydrophobicContact CG2-CD1 3.66Å; I105-L109 WeakPolarHBondContact O-CB 3.5Å; I105-L109 WeakPolarHBondContact O-CD1 3.36Å; I105-L109 WeakPolarHBondContact O-CG 3.35Å; I105-L109 PolarHBondContact O-N 3.16Å; I105-T118 HydrophobicContact CB-CG2 4.14Å; I105-T118 HydrophobicContact CG1-CG2 4.15Å; I105-T118 HydrophobicContact CG2-CG2 3.7Å; I105-M122 HydrophobicContact CG2-CG 4.11Å; I105-M122 HydrophobicContact CG2-SD 3.83Å
106	V	94	Very high	92	Very high	1 Å²	1	68.2 Å²	68.2	1%	0.006	34%	0.342	C	S	.	.	H	α-helix	trans	-62.9	-44	179	171.3	0	0	0	0	110.9	E71 I74 R75 V78 V102 E103 L109 T110	E71-V106 HydrophobicContact CG-CG1 3.92Å; I74-V106 HydrophobicContact CG2-CG1 4.31Å; I74-V106 HydrophobicContact CG2-CG2 4.49Å; R75-V106 HydrophobicContact CB-CG1 4.32Å; R75-V106 HydrophobicContact CB-CG2 4.21Å; R75-V106 HydrophobicContact CG-CG2 4.39Å; V78-V106 HydrophobicContact CB-CG2 4.11Å; V78-V106 HydrophobicContact CG1-CG2 4.29Å; V78-V106 HydrophobicContact CG2-CG2 4Å; V102-V106 WeakPolarHBondContact O-CG2 3.3Å; V102-V106 PolarHBondContact O-N 2.8Å; E103-V106 PolarHBondContact O-N 2.9Å; V106-L109 PolarHBondContact O-N 3.45Å; V106-T110 VanDerWaalsContact O-CB 3.29Å; V106-T110 WeakPolarHBondContact O-CB 3.31Å; V106-T110 PolarHBondContact O-N 2.91Å; V106-T110 PolarHBondContact O-OG1 2.71Å
107	F	93.9	Very high	91.9	Very high	128 Å²	128	68.4 Å²	68.4	56%	0.561	34%	0.343	S	S	*	.	H	α-helix	trans	-62	-47.9	178.3	-177.8	-94.3	0	0	0	111.8	E103 E104 L109 T110 N111	E103-F107 VanDerWaalsContact O-CB 3.28Å; E103-F107 WeakPolarHBondContact O-CB 3.49Å; E103-F107 PolarHBondContact O-N 3.21Å; E104-F107 PolarHBondContact O-N 3.39Å; F107-L109 PolarHBondContact O-N 2.88Å; F107-T110 PolarHBondContact O-N 3.06Å; F107-N111 VanDerWaalsContact CD2-ND2 3.31Å; F107-N111 WeakPolarHBondContact CD2-ND2 3.49Å; F107-N111 WeakPolarHBondContact CE2-ND2 3.48Å; F107-N111 WeakPolarHBondContact CZ-ND2 3.48Å; F107-N111 PolarHBondContact O-N 2.77Å; F107-N111 PolarHBondContact O-ND2 3.18Å
108	N	92.8	Very high	91.7	Very high	22 Å²	22	64.5 Å²	64.5	12%	0.118	32%	0.322	C	S	.	.	H	α-helix	trans	-59.1	-46.6	177.7	-76.3	-29.9	0	0	0	111.7	E104 I105 T110 N112 V113 T118	E104-N108 VanDerWaalsContact O-CB 3.31Å; E104-N108 WeakPolarHBondContact O-CB 3.44Å; E104-N108 PolarHBondContact O-N 3.36Å; E104-N108 PolarHBondContact O-ND2 3.05Å; I105-N108 PolarHBondContact O-N 3.01Å; N108-T110 PolarHBondContact O-N 3.11Å; N108-N112 WeakPolarHBondContact O-CA 3.33Å; N108-N112 PolarHBondContact O-N 2.81Å; N108-V113 CarbonylContact C-O 3.17Å; N108-V113 WeakPolarHBondContact CB-O 3.27Å; N108-V113 PolarHBondContact O-N 3.45Å; N108-T118 HydrophobicContact CB-CG2 4.37Å
109	L	90.7	Very high	91.5	Very high	23 Å²	23	69.1 Å²	69.1	12%	0.12	34%	0.342	C	S	.	.	H	α-helix	trans	-65.9	-35.4	177.1	-76.3	159	0	0	0	113.1	I74 V78 I105 V106 F107 L115 T118 K119 M122	I74-L109 HydrophobicContact CD1-CB 4.09Å; I74-L109 HydrophobicContact CG2-CB 3.55Å; I74-L109 HydrophobicContact CG2-CD1 3.84Å; I74-L109 HydrophobicContact CG2-CG 4.32Å; V78-L109 HydrophobicContact CG2-CD1 3.88Å; I105-L109 HydrophobicContact CG2-CD1 3.66Å; I105-L109 WeakPolarHBondContact O-CB 3.5Å; I105-L109 WeakPolarHBondContact O-CD1 3.36Å; I105-L109 WeakPolarHBondContact O-CG 3.35Å; I105-L109 PolarHBondContact O-N 3.16Å; V106-L109 PolarHBondContact O-N 3.45Å; F107-L109 PolarHBondContact O-N 2.88Å; L109-L115 HydrophobicContact CD2-CD2 4.02Å; L109-T118 HydrophobicContact CD1-CG2 4.14Å; L109-T118 HydrophobicContact CG-CG2 3.98Å; L109-K119 HydrophobicContact CD2-CG 4.47Å; L109-M122 HydrophobicContact CD1-SD 3.71Å
110	T	90.4	Very high	91.5	Very high	17 Å²	17	72.1 Å²	72.1	10%	0.104	35%	0.353	C	S	.	.	H	α-helix	trans	-72.1	-44.1	-178.9	-59.3	0	0	0	0	111	K70 E71 V106 F107 N108 N112	K70-T110 WeakPolarHBondContact CE-O 3.49Å; K70-T110 PolarHBondContact NZ-O 2.95Å; E71-T110 HydrophobicContact CB-CG2 4.09Å; V106-T110 VanDerWaalsContact O-CB 3.29Å; V106-T110 WeakPolarHBondContact O-CB 3.31Å; V106-T110 PolarHBondContact O-N 2.91Å; V106-T110 PolarHBondContact O-OG1 2.71Å; F107-T110 PolarHBondContact O-N 3.06Å; N108-T110 PolarHBondContact O-N 3.11Å; T110-N112 VanDerWaalsContact C-N 3.33Å
111	N	89.5	Confident	91.3	Very high	82 Å²	82	71.3 Å²	71.3	44%	0.439	35%	0.347	S	S	.	.	H	α-helix	trans	-87.4	-0.9	-178.4	-66.2	-46.9	0	0	0	114.1	F107 V113	F107-N111 VanDerWaalsContact CD2-ND2 3.31Å; F107-N111 WeakPolarHBondContact CD2-ND2 3.49Å; F107-N111 WeakPolarHBondContact CE2-ND2 3.48Å; F107-N111 WeakPolarHBondContact CZ-ND2 3.48Å; F107-N111 PolarHBondContact O-N 2.77Å; F107-N111 PolarHBondContact O-ND2 3.18Å; N111-V113 HydrophobicContact CB-CG2 4.01Å; N111-V113 PolarHBondContact O-N 2.74Å
112	N	85.8	Confident	91.2	Very high	100 Å²	100	67.1 Å²	67.1	54%	0.535	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.5	31	-175.2	-44.4	-67.3	0	0	0	113.4	K70 N108 T110 L115	K70-N112 PolarHBondContact NZ-ND2 3.25Å; K70-N112 PolarHBondContact NZ-OD1 2.9Å; N108-N112 WeakPolarHBondContact O-CA 3.33Å; N108-N112 PolarHBondContact O-N 2.81Å; T110-N112 VanDerWaalsContact C-N 3.33Å; N112-L115 HydrophobicContact CB-CD1 3.89Å; N112-L115 HydrophobicContact CB-CG 4.24Å
113	V	86.7	Confident	91.1	Very high	77 Å²	77	72.1 Å²	72.1	47%	0.467	35%	0.35	S	S	.	.	S	Bend	trans	-91.2	131.5	174.1	-178.4	0	0	0	0	107.9	N108 N111 L115	N108-V113 CarbonylContact C-O 3.17Å; N108-V113 WeakPolarHBondContact CB-O 3.27Å; N108-V113 PolarHBondContact O-N 3.45Å; N111-V113 HydrophobicContact CB-CG2 4.01Å; N111-V113 PolarHBondContact O-N 2.74Å; V113-L115 PolarHBondContact O-N 2.99Å; V113-L115 VanDerWaalsContact O-N 3.11Å
114	D	86.9	Confident	91.1	Very high	77 Å²	77	72.3 Å²	72.3	41%	0.412	35%	0.353	S	S	.	.	S	Bend	trans	53.1	33.9	174.5	-157.3	21.3	0	0	0	116.2	E116 N117 T118	D114-E116 PolarHBondContact O-N 3.05Å; D114-N117 PolarHBondContact O-N 3.43Å; D114-N117 WeakPolarHBondContact OD1-CB 3.3Å; D114-N117 PolarHBondContact OD1-ND2 3.27Å; D114-N117 WeakPolarHBondContact OD2-CB 3.28Å; D114-N117 PolarHBondContact OD2-ND2 3.4Å; D114-T118 PolarHBondContact O-N 2.85Å; D114-T118 PolarHBondContact O-OG1 3.03Å
115	L	87.3	Confident	91	Very high	53 Å²	53	68.8 Å²	68.8	28%	0.277	34%	0.336	S	S	.	.	H	α-helix	trans	-52	-37	-173.4	-72.7	178.2	0	0	0	114.5	L109 N112 V113 K119	L109-L115 HydrophobicContact CD2-CD2 4.02Å; N112-L115 HydrophobicContact CB-CD1 3.89Å; N112-L115 HydrophobicContact CB-CG 4.24Å; V113-L115 PolarHBondContact O-N 2.99Å; V113-L115 VanDerWaalsContact O-N 3.11Å; L115-K119 VanDerWaalsContact O-CB 3.29Å; L115-K119 WeakPolarHBondContact O-CB 3.43Å; L115-K119 WeakPolarHBondContact O-CD 3.44Å; L115-K119 WeakPolarHBondContact O-CG 3.47Å; L115-K119 PolarHBondContact O-N 3.33Å
116	E	89.2	Confident	90.9	Very high	166 Å²	166	72.7 Å²	72.7	78%	0.776	35%	0.354	S	S	*	.	H	α-helix	trans	-71.3	-46.8	-175	-157.4	119.3	-149.9	0	0	111.2	D114 K120	D114-E116 PolarHBondContact O-N 3.05Å; E116-K120 VanDerWaalsContact O-CB 3.31Å; E116-K120 WeakPolarHBondContact O-CB 3.28Å; E116-K120 PolarHBondContact O-N 2.87Å
117	N	91.7	Very high	90.9	Very high	84 Å²	84	80.2 Å²	80.2	45%	0.449	39%	0.386	S	S	.	.	H	α-helix	trans	-69.4	-41.8	177.4	-69	-35.2	0	0	0	111.1	D114 K119 K120 K121	D114-N117 PolarHBondContact O-N 3.43Å; D114-N117 WeakPolarHBondContact OD1-CB 3.3Å; D114-N117 PolarHBondContact OD1-ND2 3.27Å; D114-N117 WeakPolarHBondContact OD2-CB 3.28Å; D114-N117 PolarHBondContact OD2-ND2 3.4Å; N117-K119 PolarHBondContact O-N 3.09Å; N117-K120 PolarHBondContact O-N 3.2Å; N117-K121 WeakPolarHBondContact O-CB 3.31Å; N117-K121 WeakPolarHBondContact O-CG 3.38Å; N117-K121 PolarHBondContact O-N 3.44Å
118	T	91.3	Very high	90.8	Very high	4 Å²	4	81.2 Å²	81.2	3%	0.025	39%	0.393	C	S	.	.	H	α-helix	trans	-60.4	-46.4	177.2	-49.6	0	0	0	0	111.2	I105 N108 L109 D114 K120 K121 M122	I105-T118 HydrophobicContact CB-CG2 4.14Å; I105-T118 HydrophobicContact CG1-CG2 4.15Å; I105-T118 HydrophobicContact CG2-CG2 3.7Å; N108-T118 HydrophobicContact CB-CG2 4.37Å; L109-T118 HydrophobicContact CD1-CG2 4.14Å; L109-T118 HydrophobicContact CG-CG2 3.98Å; D114-T118 PolarHBondContact O-N 2.85Å; D114-T118 PolarHBondContact O-OG1 3.03Å; T118-K120 VanDerWaalsContact C-N 3.35Å; T118-K120 PolarHBondContact O-N 3.14Å; T118-K121 PolarHBondContact O-N 3.13Å; T118-M122 WeakPolarHBondContact O-CG 3.23Å; T118-M122 PolarHBondContact O-N 3.01Å
119	K	90.6	Very high	90.7	Very high	112 Å²	112	81.5 Å²	81.5	49%	0.487	39%	0.394	S	S	.	.	H	α-helix	trans	-62.1	-42.6	175.9	-75.2	173.3	-174.3	176.7	0	112	L109 L115 N117 M122 E123	L109-K119 HydrophobicContact CD2-CG 4.47Å; L115-K119 VanDerWaalsContact O-CB 3.29Å; L115-K119 WeakPolarHBondContact O-CB 3.43Å; L115-K119 WeakPolarHBondContact O-CD 3.44Å; L115-K119 WeakPolarHBondContact O-CG 3.47Å; L115-K119 PolarHBondContact O-N 3.33Å; N117-K119 PolarHBondContact O-N 3.09Å; K119-M122 PolarHBondContact O-N 3.41Å; K119-E123 WeakPolarHBondContact O-CG 3.37Å; K119-E123 PolarHBondContact O-N 3.11Å
120	K	93.5	Very high	90.8	Very high	131 Å²	131	86.8 Å²	86.8	57%	0.57	42%	0.416	S	S	*	.	H	α-helix	trans	-63.4	-42.4	177.9	-169.8	173.9	-178.2	179.7	0	111.9	E116 N117 T118 E123 I124	E116-K120 VanDerWaalsContact O-CB 3.31Å; E116-K120 WeakPolarHBondContact O-CB 3.28Å; E116-K120 PolarHBondContact O-N 2.87Å; N117-K120 PolarHBondContact O-N 3.2Å; T118-K120 VanDerWaalsContact C-N 3.35Å; T118-K120 PolarHBondContact O-N 3.14Å; K120-E123 PolarHBondContact O-N 3.06Å; K120-I124 HydrophobicContact CG-CD1 4.1Å; K120-I124 WeakPolarHBondContact O-CD1 3.35Å; K120-I124 VanDerWaalsContact O-CG1 3.26Å; K120-I124 WeakPolarHBondContact O-CG1 3.31Å; K120-I124 PolarHBondContact O-N 3.4Å
121	K	91.9	Very high	90.8	Very high	117 Å²	117	92.1 Å²	92.1	51%	0.509	44%	0.444	S	S	.	.	H	α-helix	trans	-58	-47.3	172.7	-74.9	-179.6	-179.6	-177.1	0	110.9	N117 T118 E123 I124 Y125	N117-K121 WeakPolarHBondContact O-CB 3.31Å; N117-K121 WeakPolarHBondContact O-CG 3.38Å; N117-K121 PolarHBondContact O-N 3.44Å; T118-K121 PolarHBondContact O-N 3.13Å; K121-E123 PolarHBondContact O-N 3.36Å; K121-I124 PolarHBondContact O-N 2.91Å; K121-Y125 WeakPolarHBondContact O-CB 3.34Å; K121-Y125 PolarHBondContact O-N 3.37Å
122	M	92.4	Very high	90.8	Very high	22 Å²	22	90.9 Å²	90.9	11%	0.108	44%	0.44	C	S	.	.	H	α-helix	trans	-61.6	-41.3	177.1	-68.7	-177	68.9	0	0	112.8	V78 I81 Y82 I105 L109 T118 K119 Y125 Q126	V78-M122 HydrophobicContact CB-CE 4.43Å; V78-M122 HydrophobicContact CG2-CE 3.85Å; V78-M122 HydrophobicContact CG2-SD 4.28Å; I81-M122 HydrophobicContact CD1-CE 3.6Å; Y82-M122 HydrophobicContact CE2-CG 4.09Å; I105-M122 HydrophobicContact CG2-CG 4.11Å; I105-M122 HydrophobicContact CG2-SD 3.83Å; L109-M122 HydrophobicContact CD1-SD 3.71Å; T118-M122 WeakPolarHBondContact O-CG 3.23Å; T118-M122 PolarHBondContact O-N 3.01Å; K119-M122 PolarHBondContact O-N 3.41Å; M122-Y125 PolarHBondContact O-N 3.05Å; M122-Q126 VanDerWaalsContact O-CB 3.27Å; M122-Q126 WeakPolarHBondContact O-CB 3.41Å; M122-Q126 PolarHBondContact O-N 3.24Å
123	E	93	Very high	91	Very high	108 Å²	108	87.2 Å²	87.2	51%	0.505	42%	0.42	S	S	.	.	H	α-helix	trans	-66.3	-40.6	178	-77	-178	-170.5	0	0	112.7	K119 K120 K121 Q126 K127	K119-E123 WeakPolarHBondContact O-CG 3.37Å; K119-E123 PolarHBondContact O-N 3.11Å; K120-E123 PolarHBondContact O-N 3.06Å; K121-E123 PolarHBondContact O-N 3.36Å; E123-Q126 PolarHBondContact O-N 3.46Å; E123-K127 WeakPolarHBondContact O-CG 3.42Å; E123-K127 PolarHBondContact O-N 2.92Å
124	I	93.3	Very high	91.3	Very high	79 Å²	79	89 Å²	89	41%	0.405	42%	0.423	S	S	.	.	H	α-helix	trans	-63	-50.9	175.2	-67.4	164	0	0	0	109.3	K120 K121 Q126 K127 E128	K120-I124 HydrophobicContact CG-CD1 4.1Å; K120-I124 WeakPolarHBondContact O-CD1 3.35Å; K120-I124 VanDerWaalsContact O-CG1 3.26Å; K120-I124 WeakPolarHBondContact O-CG1 3.31Å; K120-I124 PolarHBondContact O-N 3.4Å; K121-I124 PolarHBondContact O-N 2.91Å; I124-Q126 VanDerWaalsContact C-N 3.29Å; I124-Q126 PolarHBondContact O-N 2.99Å; I124-K127 PolarHBondContact O-N 2.92Å; I124-K127 VanDerWaalsContact O-N 3.07Å; I124-E128 HydrophobicContact CG2-CG 4.32Å; I124-E128 WeakPolarHBondContact CG2-OE1 3.46Å; I124-E128 WeakPolarHBondContact O-CG 3.37Å; I124-E128 PolarHBondContact O-N 3.26Å
125	Y	92.3	Very high	91.5	Very high	29 Å²	29	91.8 Å²	91.8	11%	0.114	43%	0.431	C	S	.	.	H	α-helix	trans	-56.6	-44.1	178.3	-176.5	-86.3	0	0	0	111.9	I81 Y82 K84 F98 K121 M122 K127 E128 N129 I133	I81-Y125 HydrophobicContact CG2-CD1 3.8Å; I81-Y125 HydrophobicContact CG2-CE1 4.27Å; Y82-Y125 HydrophobicContact CD1-CD1 4.37Å; Y82-Y125 AromaticContact CD1-CE1 4Å; Y82-Y125 HydrophobicContact CD1-CE1 4Å; Y82-Y125 HydrophobicContact CD1-CE2 4.17Å; Y82-Y125 AromaticContact CD1-CZ 3.86Å; Y82-Y125 HydrophobicContact CD2-CD1 4.44Å; Y82-Y125 HydrophobicContact CD2-CE1 4.47Å; Y82-Y125 HydrophobicContact CE1-CD1 4.06Å; Y82-Y125 AromaticContact CE1-CD2 3.84Å; Y82-Y125 HydrophobicContact CE1-CD2 3.84Å; Y82-Y125 HydrophobicContact CE1-CE1 4.09Å; Y82-Y125 AromaticContact CE1-CE2 3.85Å; Y82-Y125 HydrophobicContact CE1-CE2 3.85Å; Y82-Y125 AromaticContact CE1-CG 3.93Å; Y82-Y125 HydrophobicContact CE1-CG 3.93Å; Y82-Y125 AromaticContact CE1-CZ 3.97Å; Y82-Y125 HydrophobicContact CE2-CD1 4.13Å; Y82-Y125 HydrophobicContact CE2-CG 4.4Å; Y82-Y125 HydrophobicContact CG-CE1 4.18Å; Y82-Y125 AromaticContact CZ-CD1 3.92Å; Y82-Y125 AromaticContact CZ-CG 3.79Å; K84-Y125 WeakPolarHBondContact CD-OH 3.49Å; K84-Y125 WeakPolarHBondContact CE-OH 3.49Å; F98-Y125 HydrophobicContact CE2-CE2 4.31Å; F98-Y125 WeakPolarHBondContact CE2-OH 3.38Å; K121-Y125 WeakPolarHBondContact O-CB 3.34Å; K121-Y125 PolarHBondContact O-N 3.37Å; M122-Y125 PolarHBondContact O-N 3.05Å; Y125-K127 VanDerWaalsContact C-N 3.33Å; Y125-K127 PolarHBondContact O-N 3.49Å; Y125-E128 PolarHBondContact O-N 3.23Å; Y125-N129 HydrophobicContact CD1-CB 4.48Å; Y125-N129 WeakPolarHBondContact CD2-ND2 3.42Å; Y125-N129 HydrophobicContact CE1-CB 4.16Å; Y125-N129 WeakPolarHBondContact CE2-ND2 3.21Å; Y125-N129 WeakPolarHBondContact O-CB 3.45Å; Y125-N129 PolarHBondContact O-N 3.34Å; Y125-N129 PolarHBondContact O-ND2 3.05Å; Y125-I133 HydrophobicContact CD1-CD1 4.45Å; Y125-I133 HydrophobicContact CE1-CD1 4.28Å
126	Q	92.1	Very high	91.7	Very high	94 Å²	94	89.6 Å²	89.6	44%	0.439	42%	0.42	S	S	.	.	H	α-helix	trans	-63.1	-37.7	178.5	-173.3	179.7	28.3	0	0	112.5	I81 M122 E123 I124 K130	I81-Q126 HydrophobicContact CG2-CB 4.05Å; I81-Q126 HydrophobicContact CG2-CG 4.43Å; M122-Q126 VanDerWaalsContact O-CB 3.27Å; M122-Q126 WeakPolarHBondContact O-CB 3.41Å; M122-Q126 PolarHBondContact O-N 3.24Å; E123-Q126 PolarHBondContact O-N 3.46Å; I124-Q126 VanDerWaalsContact C-N 3.29Å; I124-Q126 PolarHBondContact O-N 2.99Å; Q126-K130 WeakPolarHBondContact O-CA 3.47Å; Q126-K130 WeakPolarHBondContact O-CB 3.36Å; Q126-K130 PolarHBondContact O-N 3.46Å
127	K	93.1	Very high	91.8	Very high	159 Å²	159	87.2 Å²	87.2	69%	0.691	41%	0.407	S	S	*	.	H	α-helix	trans	-70.6	-43.9	177.1	-76.1	175.4	-176.8	172.8	0	111.7	E123 I124 Y125	E123-K127 WeakPolarHBondContact O-CG 3.42Å; E123-K127 PolarHBondContact O-N 2.92Å; I124-K127 PolarHBondContact O-N 2.92Å; I124-K127 VanDerWaalsContact O-N 3.07Å; Y125-K127 VanDerWaalsContact C-N 3.33Å; Y125-K127 PolarHBondContact O-N 3.49Å
128	E	92.6	Very high	91.8	Very high	150 Å²	150	87.9 Å²	87.9	70%	0.701	41%	0.41	S	S	*	.	H	α-helix	trans	-71.6	-37.1	-177.5	-69.8	176.7	173.2	0	0	112.6	I124 Y125	I124-E128 HydrophobicContact CG2-CG 4.32Å; I124-E128 WeakPolarHBondContact CG2-OE1 3.46Å; I124-E128 WeakPolarHBondContact O-CG 3.37Å; I124-E128 PolarHBondContact O-N 3.26Å; Y125-E128 PolarHBondContact O-N 3.23Å
129	N	90.7	Very high	91.8	Very high	27 Å²	27	91 Å²	91	14%	0.144	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	16.6	-175	-62.5	-88.1	0	0	0	113.3	K84 Y125 D131 V132 I133	K84-N129 PolarHBondContact NZ-OD1 3.42Å; Y125-N129 HydrophobicContact CD1-CB 4.48Å; Y125-N129 WeakPolarHBondContact CD2-ND2 3.42Å; Y125-N129 HydrophobicContact CE1-CB 4.16Å; Y125-N129 WeakPolarHBondContact CE2-ND2 3.21Å; Y125-N129 WeakPolarHBondContact O-CB 3.45Å; Y125-N129 PolarHBondContact O-N 3.34Å; Y125-N129 PolarHBondContact O-ND2 3.05Å; N129-D131 VanDerWaalsContact C-N 3.29Å; N129-D131 PolarHBondContact O-N 3.25Å; N129-D131 VanDerWaalsContact O-N 3.16Å; N129-V132 PolarHBondContact O-N 2.62Å; N129-V132 VanDerWaalsContact O-N 3.11Å; N129-I133 HydrophobicContact CB-CD1 4.12Å; N129-I133 HydrophobicContact CB-CG1 4.23Å; N129-I133 VanDerWaalsContact O-CG1 3.23Å; N129-I133 WeakPolarHBondContact O-CG1 3.47Å; N129-I133 PolarHBondContact O-N 3.37Å
130	K	92	Very high	91.8	Very high	134 Å²	134	89.5 Å²	89.5	58%	0.583	42%	0.42	S	S	*	.	H	α-helix	trans	-51.2	-44.8	-172.4	-172.2	-180	175.1	-172	0	113.6	Q126 I133 Q134	Q126-K130 WeakPolarHBondContact O-CA 3.47Å; Q126-K130 WeakPolarHBondContact O-CB 3.36Å; Q126-K130 PolarHBondContact O-N 3.46Å; K130-I133 PolarHBondContact O-N 2.97Å; K130-Q134 WeakPolarHBondContact O-CB 3.33Å; K130-Q134 PolarHBondContact O-N 2.96Å
131	D	90.1	Very high	91.8	Very high	130 Å²	130	85.8 Å²	85.8	70%	0.695	41%	0.409	S	S	*	.	H	α-helix	trans	-71	-40.1	-177.7	-62	-29.8	0	0	0	112.1	N129 Q134 K135	N129-D131 VanDerWaalsContact C-N 3.29Å; N129-D131 PolarHBondContact O-N 3.25Å; N129-D131 VanDerWaalsContact O-N 3.16Å; D131-Q134 PolarHBondContact O-N 3.43Å; D131-K135 WeakPolarHBondContact O-CB 3.42Å; D131-K135 PolarHBondContact O-N 3Å
132	V	89.9	Confident	91.9	Very high	56 Å²	56	88 Å²	88	34%	0.339	41%	0.414	S	S	.	.	H	α-helix	trans	-62.8	-45.9	175.3	-179.9	0	0	0	0	109.9	N129 Q134 K135 N136	N129-V132 PolarHBondContact O-N 2.62Å; N129-V132 VanDerWaalsContact O-N 3.11Å; V132-Q134 VanDerWaalsContact C-N 3.32Å; V132-Q134 PolarHBondContact O-N 3.3Å; V132-K135 PolarHBondContact O-N 3.33Å; V132-N136 WeakPolarHBondContact O-CB 3.31Å; V132-N136 PolarHBondContact O-N 2.95Å
133	I	90.9	Very high	91.9	Very high	23 Å²	23	90.9 Å²	90.9	12%	0.118	43%	0.427	C	S	.	.	H	α-helix	trans	-59.4	-45.6	178.2	-65.5	168.3	0	0	0	110.4	I81 N83 Y125 N129 K130 N136 K137	I81-I133 HydrophobicContact CG2-CD1 4.03Å; I81-I133 VanDerWaalsContact O-CD1 3.3Å; I81-I133 WeakPolarHBondContact O-CD1 3.46Å; I81-I133 VanDerWaalsContact O-CG1 3.28Å; I81-I133 WeakPolarHBondContact O-CG1 3.4Å; N83-I133 PolarHBondContact ND2-O 3.19Å; N83-I133 WeakPolarHBondContact OD1-CA 3.39Å; Y125-I133 HydrophobicContact CD1-CD1 4.45Å; Y125-I133 HydrophobicContact CE1-CD1 4.28Å; N129-I133 HydrophobicContact CB-CD1 4.12Å; N129-I133 HydrophobicContact CB-CG1 4.23Å; N129-I133 VanDerWaalsContact O-CG1 3.23Å; N129-I133 WeakPolarHBondContact O-CG1 3.47Å; N129-I133 PolarHBondContact O-N 3.37Å; K130-I133 PolarHBondContact O-N 2.97Å; I133-N136 PolarHBondContact O-N 2.87Å; I133-K137 VanDerWaalsContact O-CB 3.31Å; I133-K137 WeakPolarHBondContact O-CB 3.4Å; I133-K137 PolarHBondContact O-N 3.01Å
134	Q	92	Very high	91.8	Very high	115 Å²	115	90.5 Å²	90.5	54%	0.537	43%	0.425	S	S	.	.	H	α-helix	trans	-65.7	-41.5	179.8	-174.3	166.8	-8.9	0	0	112.1	K130 D131 V132 K137 L138	K130-Q134 WeakPolarHBondContact O-CB 3.33Å; K130-Q134 PolarHBondContact O-N 2.96Å; D131-Q134 PolarHBondContact O-N 3.43Å; V132-Q134 VanDerWaalsContact C-N 3.32Å; V132-Q134 PolarHBondContact O-N 3.3Å; Q134-K137 PolarHBondContact O-N 3.23Å; Q134-L138 WeakPolarHBondContact O-CG 3.5Å; Q134-L138 PolarHBondContact O-N 3.04Å
135	K	91.7	Very high	91.9	Very high	134 Å²	134	91.7 Å²	91.7	58%	0.583	43%	0.429	S	S	*	.	H	α-helix	trans	-61.4	-47.3	175.5	-175.3	-177.2	179	-173.7	0	111.7	D131 V132 K137 L138 K139	D131-K135 WeakPolarHBondContact O-CB 3.42Å; D131-K135 PolarHBondContact O-N 3Å; V132-K135 PolarHBondContact O-N 3.33Å; K135-K137 VanDerWaalsContact C-N 3.31Å; K135-K137 PolarHBondContact O-N 2.94Å; K135-L138 PolarHBondContact O-N 3.39Å; K135-K139 PolarHBondContact O-N 3.22Å
136	N	91	Very high	91.9	Very high	8 Å²	8	96.5 Å²	96.5	4%	0.043	45%	0.452	C	S	.	.	H	α-helix	trans	-68.6	-32.7	-179.7	-74.7	0.8	0	0	0	111.9	N83 D88 V132 I133 K139 L140	N83-N136 HydrophobicContact CB-CB 4.48Å; N83-N136 WeakPolarHBondContact ND2-CB 3.28Å; N83-N136 PolarHBondContact O-ND2 3.34Å; D88-N136 PolarHBondContact OD2-ND2 3.43Å; V132-N136 WeakPolarHBondContact O-CB 3.31Å; V132-N136 PolarHBondContact O-N 2.95Å; I133-N136 PolarHBondContact O-N 2.87Å; N136-K139 PolarHBondContact O-N 2.96Å; N136-L140 PolarHBondContact O-N 2.94Å
137	K	91.6	Very high	92	Very high	116 Å²	116	97.2 Å²	97.2	50%	0.504	46%	0.459	S	S	.	.	H	α-helix	trans	-63.2	-43.7	171.8	-171.9	-177.1	176.4	-163.4	0	112	I133 Q134 K135 L140 T141	I133-K137 VanDerWaalsContact O-CB 3.31Å; I133-K137 WeakPolarHBondContact O-CB 3.4Å; I133-K137 PolarHBondContact O-N 3.01Å; Q134-K137 PolarHBondContact O-N 3.23Å; K135-K137 VanDerWaalsContact C-N 3.31Å; K135-K137 PolarHBondContact O-N 2.94Å; K137-L140 PolarHBondContact O-N 3.32Å; K137-T141 PolarHBondContact O-N 3.37Å; K137-T141 PolarHBondContact O-OG1 3.43Å; K137-T141 VanDerWaalsContact O-OG1 3.14Å
138	L	92.3	Very high	92	Very high	97 Å²	97	96 Å²	96	51%	0.508	46%	0.455	S	S	.	.	H	α-helix	trans	-64.4	-39.9	176.8	-71	171.7	0	0	0	112.1	Q134 K135 T141 R142	Q134-L138 WeakPolarHBondContact O-CG 3.5Å; Q134-L138 PolarHBondContact O-N 3.04Å; K135-L138 PolarHBondContact O-N 3.39Å; L138-T141 PolarHBondContact O-N 3.3Å; L138-R142 WeakPolarHBondContact O-CG 3.36Å; L138-R142 PolarHBondContact O-N 2.67Å; L138-R142 VanDerWaalsContact O-N 3.11Å
139	K	91.3	Very high	92.1	Very high	71 Å²	71	95.2 Å²	95.2	31%	0.309	45%	0.452	S	S	.	.	H	α-helix	trans	-58.6	-50.5	173	-73.9	-176.8	172.4	-173.5	0	111.3	K135 N136 T141 R142 E143	K135-K139 PolarHBondContact O-N 3.22Å; N136-K139 PolarHBondContact O-N 2.96Å; K139-T141 VanDerWaalsContact C-N 3.32Å; K139-T141 PolarHBondContact O-N 3.46Å; K139-R142 PolarHBondContact O-N 2.87Å; K139-E143 WeakPolarHBondContact O-CG 3.39Å; K139-E143 PolarHBondContact O-N 2.88Å
140	L	90.6	Very high	92.3	Very high	79 Å²	79	96.5 Å²	96.5	41%	0.414	47%	0.466	S	S	.	.	H	α-helix	trans	-59.5	-41.5	179.7	-175.5	70.4	0	0	0	112.3	N136 K137 E143 Q144	N136-L140 PolarHBondContact O-N 2.94Å; K137-L140 PolarHBondContact O-N 3.32Å; L140-E143 PolarHBondContact O-N 3Å; L140-Q144 WeakPolarHBondContact O-CB 3.44Å; L140-Q144 VanDerWaalsContact O-CG 3.28Å; L140-Q144 WeakPolarHBondContact O-CG 3.24Å; L140-Q144 PolarHBondContact O-N 3.02Å
141	T	92.8	Very high	92.5	Very high	54 Å²	54	93.7 Å²	93.7	33%	0.331	46%	0.457	S	S	.	.	H	α-helix	trans	-63.5	-42.3	177.4	-60.9	0	0	0	0	111.9	K137 L138 K139 Q144 E145	K137-T141 PolarHBondContact O-N 3.37Å; K137-T141 PolarHBondContact O-OG1 3.43Å; K137-T141 VanDerWaalsContact O-OG1 3.14Å; L138-T141 PolarHBondContact O-N 3.3Å; K139-T141 VanDerWaalsContact C-N 3.32Å; K139-T141 PolarHBondContact O-N 3.46Å; T141-Q144 PolarHBondContact O-N 2.96Å; T141-E145 WeakPolarHBondContact O-CG 3.38Å; T141-E145 PolarHBondContact O-N 3.33Å
142	R	93.9	Very high	92.7	Very high	163 Å²	163	91.1 Å²	91.1	62%	0.615	44%	0.441	S	S	*	.	H	α-helix	trans	-63.6	-45	176.5	-71.3	176.4	-178.6	-176.5	-1.4	112.4	L138 K139 Q144 E145 E146	L138-R142 WeakPolarHBondContact O-CG 3.36Å; L138-R142 PolarHBondContact O-N 2.67Å; L138-R142 VanDerWaalsContact O-N 3.11Å; K139-R142 PolarHBondContact O-N 2.87Å; R142-Q144 VanDerWaalsContact C-N 3.26Å; R142-Q144 PolarHBondContact O-N 3.14Å; R142-E145 PolarHBondContact O-N 3.47Å; R142-E146 WeakPolarHBondContact O-CB 3.45Å; R142-E146 WeakPolarHBondContact O-CG 3.49Å; R142-E146 PolarHBondContact O-N 2.85Å
143	E	91.9	Very high	93	Very high	82 Å²	82	92 Å²	92	38%	0.383	45%	0.446	S	S	.	.	H	α-helix	trans	-62.9	-34.4	177.3	-70.6	169.3	-169.2	0	0	112.1	R85 K139 L140 L147	R85-E143 IonicContact CZ-OE1 3.46Å; R85-E143 IonicContact CZ-OE2 3.22Å; R85-E143 IonicContact NH1-OE1 2.71Å; R85-E143 PolarHBondContact NH1-OE1 3.01Å; R85-E143 IonicContact NH1-OE2 3.5Å; R85-E143 PolarHBondContact NH1-OE2 3.22Å; R85-E143 IonicContact NH2-OE1 3.9Å; R85-E143 PolarHBondContact NH2-OE1 3.1Å; R85-E143 IonicContact NH2-OE2 3.15Å; R85-E143 PolarHBondContact NH2-OE2 3.09Å; K139-E143 WeakPolarHBondContact O-CG 3.39Å; K139-E143 PolarHBondContact O-N 2.88Å; L140-E143 PolarHBondContact O-N 3Å; E143-L147 WeakPolarHBondContact O-CB 3.38Å; E143-L147 PolarHBondContact O-N 3.19Å
144	Q	92.1	Very high	93.1	Very high	100 Å²	100	96.8 Å²	96.8	47%	0.467	47%	0.468	S	S	.	.	H	α-helix	trans	-67	-45.7	173.4	-76.2	173.8	-17.9	0	0	111.8	L140 T141 R142 L147 E148	L140-Q144 WeakPolarHBondContact O-CB 3.44Å; L140-Q144 VanDerWaalsContact O-CG 3.28Å; L140-Q144 WeakPolarHBondContact O-CG 3.24Å; L140-Q144 PolarHBondContact O-N 3.02Å; T141-Q144 PolarHBondContact O-N 2.96Å; R142-Q144 VanDerWaalsContact C-N 3.26Å; R142-Q144 PolarHBondContact O-N 3.14Å; Q144-L147 PolarHBondContact O-N 2.95Å; Q144-E148 WeakPolarHBondContact O-CG 3.34Å; Q144-E148 PolarHBondContact O-N 3.37Å
145	E	93.9	Very high	93.2	Very high	105 Å²	105	97.6 Å²	97.6	49%	0.491	47%	0.466	S	S	.	.	H	α-helix	trans	-59.6	-47.4	175.7	-72.4	169.4	177	0	0	111.2	T141 R142 L147 E148 E149	T141-E145 WeakPolarHBondContact O-CG 3.38Å; T141-E145 PolarHBondContact O-N 3.33Å; R142-E145 PolarHBondContact O-N 3.47Å; E145-L147 VanDerWaalsContact C-N 3.33Å; E145-L147 PolarHBondContact O-N 2.89Å; E145-E148 PolarHBondContact O-N 3.05Å; E145-E149 WeakPolarHBondContact O-CG 3.41Å; E145-E149 PolarHBondContact O-N 2.88Å
146	E	94.3	Very high	93.3	Very high	129 Å²	129	95.3 Å²	95.3	60%	0.603	46%	0.457	S	S	*	.	H	α-helix	trans	-60.3	-40.5	177.2	-73	173.7	-168.8	0	0	112.4	R142 A150	R142-E146 WeakPolarHBondContact O-CB 3.45Å; R142-E146 WeakPolarHBondContact O-CG 3.49Å; R142-E146 PolarHBondContact O-N 2.85Å; E146-A150 WeakPolarHBondContact O-CB 3.32Å; E146-A150 PolarHBondContact O-N 2.99Å
147	L	93.6	Very high	93.4	Very high	110 Å²	110	99.8 Å²	99.8	58%	0.576	48%	0.478	S	S	*	.	H	α-helix	trans	-67.5	-41.7	176.7	-176.9	64.7	0	0	0	111.8	E143 Q144 E145 A150 L151	E143-L147 WeakPolarHBondContact O-CB 3.38Å; E143-L147 PolarHBondContact O-N 3.19Å; Q144-L147 PolarHBondContact O-N 2.95Å; E145-L147 VanDerWaalsContact C-N 3.33Å; E145-L147 PolarHBondContact O-N 2.89Å; L147-A150 PolarHBondContact O-N 3.19Å; L147-L151 HydrophobicContact CG-CD1 4.35Å; L147-L151 VanDerWaalsContact O-CG 3.3Å; L147-L151 WeakPolarHBondContact O-CG 3.39Å; L147-L151 PolarHBondContact O-N 3.48Å
148	E	93.5	Very high	93.5	Very high	133 Å²	133	99.6 Å²	99.6	62%	0.621	48%	0.479	S	S	*	.	H	α-helix	trans	-63.1	-41.7	176.7	-76	179.5	-173.7	0	0	111.8	Q144 E145 L151 E152	Q144-E148 WeakPolarHBondContact O-CG 3.34Å; Q144-E148 PolarHBondContact O-N 3.37Å; E145-E148 PolarHBondContact O-N 3.05Å; E148-L151 PolarHBondContact O-N 3.4Å; E148-E152 PolarHBondContact O-N 3.28Å
149	E	94.9	Very high	93.6	Very high	134 Å²	134	100.6 Å²	100.6	63%	0.626	48%	0.481	S	S	*	.	H	α-helix	trans	-61.8	-45.9	174	-73.6	-178.5	-178.5	0	0	111.7	E145 L151 E152 V153	E145-E149 WeakPolarHBondContact O-CG 3.41Å; E145-E149 PolarHBondContact O-N 2.88Å; E149-L151 VanDerWaalsContact C-N 3.34Å; E149-L151 PolarHBondContact O-N 3.02Å; E149-E152 PolarHBondContact O-N 2.9Å; E149-V153 WeakPolarHBondContact O-CG2 3.3Å; E149-V153 PolarHBondContact O-N 2.99Å
150	A	94.4	Very high	93.7	Very high	54 Å²	54	103.4 Å²	103.4	45%	0.446	50%	0.495	S	S	.	.	H	α-helix	trans	-60.4	-43.1	177.6	0	0	0	0	0	112.1	E146 L147 E152 V153 E154	E146-A150 WeakPolarHBondContact O-CB 3.32Å; E146-A150 PolarHBondContact O-N 2.99Å; L147-A150 PolarHBondContact O-N 3.19Å; A150-E152 VanDerWaalsContact C-N 3.32Å; A150-E152 PolarHBondContact O-N 3.36Å; A150-V153 PolarHBondContact O-N 3.46Å; A150-E154 PolarHBondContact O-N 3.43Å
151	L	95	Very high	93.8	Very high	75 Å²	75	107.1 Å²	107.1	39%	0.393	50%	0.504	S	S	.	.	H	α-helix	trans	-65.8	-33.6	176.5	-70.6	172.7	0	0	0	112.5	L147 E148 E149 R155	L147-L151 HydrophobicContact CG-CD1 4.35Å; L147-L151 VanDerWaalsContact O-CG 3.3Å; L147-L151 WeakPolarHBondContact O-CG 3.39Å; L147-L151 PolarHBondContact O-N 3.48Å; E148-L151 PolarHBondContact O-N 3.4Å; E149-L151 VanDerWaalsContact C-N 3.34Å; E149-L151 PolarHBondContact O-N 3.02Å; L151-R155 WeakPolarHBondContact O-CG 3.44Å; L151-R155 PolarHBondContact O-N 3.01Å; L151-R155 PolarHBondContact O-NH1 3.32Å
152	E	94.7	Very high	93.8	Very high	76 Å²	76	112.5 Å²	112.5	36%	0.355	52%	0.518	S	S	.	.	H	α-helix	trans	-69.1	-42.1	175.3	-179.2	58.1	-150.7	0	0	111.5	E148 E149 A150 E154 R155 Q156	E148-E152 PolarHBondContact O-N 3.28Å; E149-E152 PolarHBondContact O-N 2.9Å; A150-E152 VanDerWaalsContact C-N 3.32Å; A150-E152 PolarHBondContact O-N 3.36Å; E152-E154 VanDerWaalsContact C-N 3.35Å; E152-E154 PolarHBondContact O-N 3.01Å; E152-R155 PolarHBondContact O-N 3.27Å; E152-R155 IonicContact OE2-CZ 2.71Å; E152-R155 IonicContact OE2-NE 2.77Å; E152-R155 PolarHBondContact OE2-NE 3.32Å; E152-R155 IonicContact OE2-NH2 3.73Å; E152-R155 PolarHBondContact OE2-NH2 2.71Å; E152-Q156 VanDerWaalsContact O-CG 3.32Å; E152-Q156 WeakPolarHBondContact O-CG 3.12Å; E152-Q156 PolarHBondContact O-N 3.1Å; E152-Q156 PolarHBondContact OE1-NE2 2.91Å
153	V	95.9	Very high	93.9	Very high	73 Å²	73	108.6 Å²	108.6	44%	0.442	51%	0.509	S	S	.	.	H	α-helix	trans	-60.1	-46.1	174	173.9	0	0	0	0	110.7	E149 A150 R155 Q156 E157	E149-V153 WeakPolarHBondContact O-CG2 3.3Å; E149-V153 PolarHBondContact O-N 2.99Å; A150-V153 PolarHBondContact O-N 3.46Å; V153-R155 VanDerWaalsContact C-N 3.33Å; V153-R155 PolarHBondContact O-N 3.43Å; V153-Q156 PolarHBondContact O-N 3.19Å; V153-E157 HydrophobicContact CG1-CG 4.36Å; V153-E157 WeakPolarHBondContact O-CG 3.45Å; V153-E157 PolarHBondContact O-N 3.17Å
154	E	93.3	Very high	93.9	Very high	125 Å²	125	110.2 Å²	110.2	58%	0.584	52%	0.515	S	S	*	.	H	α-helix	trans	-60.5	-42.2	177.6	-171.8	-179.1	-177.9	0	0	111.9	A150 E152 E157 H158	A150-E154 PolarHBondContact O-N 3.43Å; E152-E154 VanDerWaalsContact C-N 3.35Å; E152-E154 PolarHBondContact O-N 3.01Å; E154-E157 PolarHBondContact O-N 3.37Å; E154-H158 VanDerWaalsContact O-CB 3.32Å; E154-H158 WeakPolarHBondContact O-CB 3.38Å; E154-H158 PolarHBondContact O-N 3.37Å
155	R	94.5	Very high	93.9	Very high	132 Å²	132	109.2 Å²	109.2	50%	0.498	51%	0.512	S	S	.	.	H	α-helix	trans	-60.3	-45.9	174.5	-78.8	-169.9	-62.7	-88.9	10.8	111.9	L151 E152 V153 H158 E159	L151-R155 WeakPolarHBondContact O-CG 3.44Å; L151-R155 PolarHBondContact O-N 3.01Å; L151-R155 PolarHBondContact O-NH1 3.32Å; E152-R155 PolarHBondContact O-N 3.27Å; E152-R155 IonicContact OE2-CZ 2.71Å; E152-R155 IonicContact OE2-NE 2.77Å; E152-R155 PolarHBondContact OE2-NE 3.32Å; E152-R155 IonicContact OE2-NH2 3.73Å; E152-R155 PolarHBondContact OE2-NH2 2.71Å; V153-R155 VanDerWaalsContact C-N 3.33Å; V153-R155 PolarHBondContact O-N 3.43Å; R155-H158 PolarHBondContact O-N 3.39Å; R155-E159 WeakPolarHBondContact O-CB 3.32Å; R155-E159 PolarHBondContact O-N 3.29Å
156	Q	93.9	Very high	93.9	Very high	85 Å²	85	108.9 Å²	108.9	40%	0.397	51%	0.51	S	S	.	.	H	α-helix	trans	-65.1	-43.8	-179.8	-72.1	176.9	13.2	0	0	111.8	E152 V153 H158 E159 Q160	E152-Q156 VanDerWaalsContact O-CG 3.32Å; E152-Q156 WeakPolarHBondContact O-CG 3.12Å; E152-Q156 PolarHBondContact O-N 3.1Å; E152-Q156 PolarHBondContact OE1-NE2 2.91Å; V153-Q156 PolarHBondContact O-N 3.19Å; Q156-H158 VanDerWaalsContact C-N 3.32Å; Q156-H158 PolarHBondContact O-N 2.9Å; Q156-E159 PolarHBondContact O-N 3.16Å; Q156-Q160 WeakPolarHBondContact O-CB 3.19Å; Q156-Q160 VanDerWaalsContact O-CG 3.24Å; Q156-Q160 WeakPolarHBondContact O-CG 3.24Å; Q156-Q160 PolarHBondContact O-N 3.12Å
157	E	92.8	Very high	93.9	Very high	102 Å²	102	109.5 Å²	109.5	48%	0.477	51%	0.511	S	S	.	.	H	α-helix	trans	-61.7	-42.3	176	-72.8	-175.4	168.9	0	0	111.5	V153 E154 Q160 R161	V153-E157 HydrophobicContact CG1-CG 4.36Å; V153-E157 WeakPolarHBondContact O-CG 3.45Å; V153-E157 PolarHBondContact O-N 3.17Å; E154-E157 PolarHBondContact O-N 3.37Å; E157-Q160 PolarHBondContact O-N 3.43Å; E157-R161 WeakPolarHBondContact O-CB 3.47Å; E157-R161 PolarHBondContact O-N 3.43Å
158	H	92.9	Very high	93.7	Very high	113 Å²	113	107.3 Å²	107.3	52%	0.523	50%	0.498	S	S	.	.	H	α-helix	trans	-64.8	-43.2	176.5	-178.8	-100.1	0	0	0	111.9	E154 R155 Q156 R161 R162	E154-H158 VanDerWaalsContact O-CB 3.32Å; E154-H158 WeakPolarHBondContact O-CB 3.38Å; E154-H158 PolarHBondContact O-N 3.37Å; R155-H158 PolarHBondContact O-N 3.39Å; Q156-H158 VanDerWaalsContact C-N 3.32Å; Q156-H158 PolarHBondContact O-N 2.9Å; H158-R161 PolarHBondContact O-N 3.28Å; H158-R162 VanDerWaalsContact CE1-CD 3.46Å; H158-R162 WeakPolarHBondContact CE1-CD 3.46Å; H158-R162 WeakPolarHBondContact O-CG 3.47Å; H158-R162 PolarHBondContact O-N 2.99Å
159	E	95.1	Very high	93.5	Very high	117 Å²	117	106 Å²	106	55%	0.547	49%	0.491	S	S	.	.	H	α-helix	trans	-64	-45.4	175.9	-174.1	173.3	-172.9	0	0	111.9	R155 Q156 R161 R162 L163	R155-E159 WeakPolarHBondContact O-CB 3.32Å; R155-E159 PolarHBondContact O-N 3.29Å; Q156-E159 PolarHBondContact O-N 3.16Å; E159-R161 VanDerWaalsContact C-N 3.31Å; E159-R161 PolarHBondContact O-N 2.98Å; E159-R162 PolarHBondContact O-N 3.44Å; E159-L163 HydrophobicContact CG-CD1 4.21Å; E159-L163 WeakPolarHBondContact O-CG 3.38Å; E159-L163 PolarHBondContact O-N 3.29Å
160	Q	93	Very high	93.5	Very high	130 Å²	130	104.6 Å²	104.6	61%	0.607	49%	0.485	S	S	*	.	H	α-helix	trans	-59.8	-42	175.6	-74.2	178	13.6	0	0	111.7	Q156 E157 L163 F164	Q156-Q160 WeakPolarHBondContact O-CB 3.19Å; Q156-Q160 VanDerWaalsContact O-CG 3.24Å; Q156-Q160 WeakPolarHBondContact O-CG 3.24Å; Q156-Q160 PolarHBondContact O-N 3.12Å; E157-Q160 PolarHBondContact O-N 3.43Å; Q160-L163 PolarHBondContact O-N 2.86Å; Q160-F164 VanDerWaalsContact O-CB 3.29Å; Q160-F164 WeakPolarHBondContact O-CB 3.45Å; Q160-F164 PolarHBondContact O-N 3.4Å
161	R	92.8	Very high	93.3	Very high	157 Å²	157	107.7 Å²	107.7	59%	0.592	49%	0.493	S	S	*	.	H	α-helix	trans	-61.1	-45.4	175.3	-173.8	-179	-64.3	-150.9	2.4	111.3	E157 H158 E159 F164 I165	E157-R161 WeakPolarHBondContact O-CB 3.47Å; E157-R161 PolarHBondContact O-N 3.43Å; H158-R161 PolarHBondContact O-N 3.28Å; E159-R161 VanDerWaalsContact C-N 3.31Å; E159-R161 PolarHBondContact O-N 2.98Å; R161-F164 PolarHBondContact O-N 2.9Å; R161-I165 HydrophobicContact CG-CD1 4.07Å; R161-I165 WeakPolarHBondContact O-CG1 3.44Å; R161-I165 PolarHBondContact O-N 3.18Å
162	R	93.4	Very high	92.9	Very high	168 Å²	168	106.7 Å²	106.7	63%	0.634	49%	0.487	S	S	*	.	H	α-helix	trans	-60.8	-46.9	176.8	-74.4	-178.4	65.1	-161.3	0.2	112	H158 E159 F164 I165 Q166	H158-R162 VanDerWaalsContact CE1-CD 3.46Å; H158-R162 WeakPolarHBondContact CE1-CD 3.46Å; H158-R162 WeakPolarHBondContact O-CG 3.47Å; H158-R162 PolarHBondContact O-N 2.99Å; E159-R162 PolarHBondContact O-N 3.44Å; R162-F164 VanDerWaalsContact C-N 3.3Å; R162-F164 PolarHBondContact O-N 3.41Å; R162-I165 PolarHBondContact O-N 3.45Å; R162-Q166 WeakPolarHBondContact O-CB 3.29Å; R162-Q166 PolarHBondContact O-N 2.98Å
163	L	95.4	Very high	92.7	Very high	80 Å²	80	107.8 Å²	107.8	42%	0.419	49%	0.492	S	S	.	.	H	α-helix	trans	-64.2	-36.1	177.6	-70.3	174	0	0	0	112.1	E159 Q160 K167	E159-L163 HydrophobicContact CG-CD1 4.21Å; E159-L163 WeakPolarHBondContact O-CG 3.38Å; E159-L163 PolarHBondContact O-N 3.29Å; Q160-L163 PolarHBondContact O-N 2.86Å; L163-K167 WeakPolarHBondContact O-CB 3.32Å; L163-K167 WeakPolarHBondContact O-CG 3.42Å; L163-K167 PolarHBondContact O-N 3.48Å
164	F	93	Very high	92.6	Very high	116 Å²	116	106.4 Å²	106.4	51%	0.509	49%	0.488	S	S	.	.	H	α-helix	trans	-64.7	-49.2	176.7	-176.3	-91.9	0	0	0	111.4	Q160 R161 R162 Q166 K167 E168	Q160-F164 VanDerWaalsContact O-CB 3.29Å; Q160-F164 WeakPolarHBondContact O-CB 3.45Å; Q160-F164 PolarHBondContact O-N 3.4Å; R161-F164 PolarHBondContact O-N 2.9Å; R162-F164 VanDerWaalsContact C-N 3.3Å; R162-F164 PolarHBondContact O-N 3.41Å; F164-Q166 VanDerWaalsContact C-N 3.33Å; F164-Q166 PolarHBondContact O-N 3.4Å; F164-K167 PolarHBondContact O-N 3.29Å; F164-E168 WeakPolarHBondContact CE1-OE2 3.33Å; F164-E168 WeakPolarHBondContact O-CB 3.27Å; F164-E168 PolarHBondContact O-N 3.4Å
165	I	91.1	Very high	92.4	Very high	79 Å²	79	103.6 Å²	103.6	41%	0.405	48%	0.477	S	S	.	.	H	α-helix	trans	-58.9	-46.2	176.9	-66.9	165.6	0	0	0	110.2	R161 R162 K167 E168 E169	R161-I165 HydrophobicContact CG-CD1 4.07Å; R161-I165 WeakPolarHBondContact O-CG1 3.44Å; R161-I165 PolarHBondContact O-N 3.18Å; R162-I165 PolarHBondContact O-N 3.45Å; I165-K167 PolarHBondContact O-N 2.93Å; I165-E168 PolarHBondContact O-N 3.47Å; I165-E169 HydrophobicContact CG2-CG 4.43Å; I165-E169 WeakPolarHBondContact O-CG 3.42Å; I165-E169 PolarHBondContact O-N 2.92Å
166	Q	94.7	Very high	92.1	Very high	98 Å²	98	102.7 Å²	102.7	46%	0.458	48%	0.476	S	S	.	.	H	α-helix	trans	-60.6	-45.5	178.8	-175	-179.9	-5.2	0	0	112.2	R162 F164 E168 E169 E170	R162-Q166 WeakPolarHBondContact O-CB 3.29Å; R162-Q166 PolarHBondContact O-N 2.98Å; F164-Q166 VanDerWaalsContact C-N 3.33Å; F164-Q166 PolarHBondContact O-N 3.4Å; Q166-E168 VanDerWaalsContact C-N 3.3Å; Q166-E168 PolarHBondContact O-N 3.38Å; Q166-E169 PolarHBondContact O-N 2.91Å; Q166-E170 PolarHBondContact NE2-OE1 2.97Å; Q166-E170 VanDerWaalsContact NE2-OE1 3.14Å; Q166-E170 WeakPolarHBondContact O-CB 3.42Å; Q166-E170 WeakPolarHBondContact O-CG 3.32Å; Q166-E170 PolarHBondContact O-N 3.48Å
167	K	94.3	Very high	91.9	Very high	143 Å²	143	106.3 Å²	106.3	62%	0.622	49%	0.486	S	S	*	.	H	α-helix	trans	-63.6	-37.2	176.7	-77.3	179.2	-179.3	178.6	0	112.2	L163 F164 I165 L171	L163-K167 WeakPolarHBondContact O-CB 3.32Å; L163-K167 WeakPolarHBondContact O-CG 3.42Å; L163-K167 PolarHBondContact O-N 3.48Å; F164-K167 PolarHBondContact O-N 3.29Å; I165-K167 PolarHBondContact O-N 2.93Å; K167-L171 VanDerWaalsContact O-CB 3.31Å; K167-L171 WeakPolarHBondContact O-CB 3.34Å; K167-L171 PolarHBondContact O-N 2.87Å
168	E	88.4	Confident	91.9	Very high	64 Å²	64	108.3 Å²	108.3	30%	0.299	49%	0.493	S	S	.	.	H	α-helix	trans	-65.8	-46.7	176.7	-175.3	165.7	-154.7	0	0	111	F164 I165 Q166 E170 L171 Q172	F164-E168 WeakPolarHBondContact CE1-OE2 3.33Å; F164-E168 WeakPolarHBondContact O-CB 3.27Å; F164-E168 PolarHBondContact O-N 3.4Å; I165-E168 PolarHBondContact O-N 3.47Å; Q166-E168 VanDerWaalsContact C-N 3.3Å; Q166-E168 PolarHBondContact O-N 3.38Å; E168-E170 PolarHBondContact O-N 3.36Å; E168-L171 PolarHBondContact O-N 3.39Å; E168-Q172 WeakPolarHBondContact O-CB 3.31Å; E168-Q172 VanDerWaalsContact O-CG 3.25Å; E168-Q172 WeakPolarHBondContact O-CG 3.46Å; E168-Q172 PolarHBondContact O-N 2.86Å
169	E	90.4	Very high	91.7	Very high	104 Å²	104	104 Å²	104	49%	0.486	48%	0.475	S	S	.	.	H	α-helix	trans	-59.2	-44.6	174	-72.5	178.7	176.5	0	0	112.1	I165 Q166 L171 Q172 Q173	I165-E169 HydrophobicContact CG2-CG 4.43Å; I165-E169 WeakPolarHBondContact O-CG 3.42Å; I165-E169 PolarHBondContact O-N 2.92Å; Q166-E169 PolarHBondContact O-N 2.91Å; E169-L171 PolarHBondContact O-N 2.88Å; E169-Q172 PolarHBondContact O-N 2.89Å; E169-Q173 WeakPolarHBondContact O-CB 3.25Å; E169-Q173 VanDerWaalsContact O-CG 3.31Å; E169-Q173 WeakPolarHBondContact O-CG 3.44Å; E169-Q173 PolarHBondContact O-N 3.5Å
170	E	93.8	Very high	91.4	Very high	105 Å²	105	105 Å²	105	49%	0.491	48%	0.477	S	S	.	.	H	α-helix	trans	-61.5	-44	176.4	-76.3	174.1	-169.4	0	0	111.7	Q166 E168 Q173 A174	Q166-E170 PolarHBondContact NE2-OE1 2.97Å; Q166-E170 VanDerWaalsContact NE2-OE1 3.14Å; Q166-E170 WeakPolarHBondContact O-CB 3.42Å; Q166-E170 WeakPolarHBondContact O-CG 3.32Å; Q166-E170 PolarHBondContact O-N 3.48Å; E168-E170 PolarHBondContact O-N 3.36Å; E170-Q173 PolarHBondContact O-N 3.27Å; E170-A174 WeakPolarHBondContact O-CB 3.31Å; E170-A174 PolarHBondContact O-N 2.92Å
171	L	90.8	Very high	91.3	Very high	119 Å²	119	104.5 Å²	104.5	62%	0.623	47%	0.474	S	S	*	.	H	α-helix	trans	-64.3	-43.3	176.9	-175.7	65.9	0	0	0	111.2	K167 E168 E169 A174 L175	K167-L171 VanDerWaalsContact O-CB 3.31Å; K167-L171 WeakPolarHBondContact O-CB 3.34Å; K167-L171 PolarHBondContact O-N 2.87Å; E168-L171 PolarHBondContact O-N 3.39Å; E169-L171 PolarHBondContact O-N 2.88Å; L171-A174 PolarHBondContact O-N 3.19Å; L171-L175 VanDerWaalsContact O-CB 3.28Å; L171-L175 WeakPolarHBondContact O-CB 3.28Å; L171-L175 PolarHBondContact O-N 3.34Å
172	Q	87.3	Confident	91.1	Very high	55 Å²	55	99 Å²	99	26%	0.257	46%	0.463	S	S	.	.	H	α-helix	trans	-60.7	-45.8	175.9	-74.5	-176.8	9.5	0	0	111.4	E168 E169 L175 K176 L212	E168-Q172 WeakPolarHBondContact O-CB 3.31Å; E168-Q172 VanDerWaalsContact O-CG 3.25Å; E168-Q172 WeakPolarHBondContact O-CG 3.46Å; E168-Q172 PolarHBondContact O-N 2.86Å; E169-Q172 PolarHBondContact O-N 2.89Å; Q172-L175 PolarHBondContact O-N 3.32Å; Q172-K176 WeakPolarHBondContact O-CB 3.43Å; Q172-K176 WeakPolarHBondContact O-CG 3.49Å; Q172-K176 PolarHBondContact O-N 3.24Å; Q172-L212 HydrophobicContact CG-CD1 3.88Å; Q172-L212 HydrophobicContact CG-CD2 3.59Å; Q172-L212 HydrophobicContact CG-CG 4.29Å
173	Q	90.8	Very high	90.9	Very high	99 Å²	99	92.3 Å²	92.3	46%	0.463	44%	0.438	S	S	.	.	H	α-helix	trans	-63.7	-44.2	176.6	-73.1	-176.7	26.3	0	0	111.9	E169 E170 L175 K176 R177	E169-Q173 WeakPolarHBondContact O-CB 3.25Å; E169-Q173 VanDerWaalsContact O-CG 3.31Å; E169-Q173 WeakPolarHBondContact O-CG 3.44Å; E169-Q173 PolarHBondContact O-N 3.5Å; E170-Q173 PolarHBondContact O-N 3.27Å; Q173-L175 VanDerWaalsContact C-N 3.33Å; Q173-L175 PolarHBondContact O-N 2.93Å; Q173-K176 PolarHBondContact O-N 3.46Å; Q173-R177 VanDerWaalsContact O-CG 3.27Å; Q173-R177 WeakPolarHBondContact O-CG 2.77Å; Q173-R177 PolarHBondContact O-N 2.88Å
174	A	92.7	Very high	90.5	Very high	43 Å²	43	93 Å²	93	36%	0.355	44%	0.442	S	S	.	.	H	α-helix	trans	-62.5	-41	178	0	0	0	0	0	111.7	E170 L171 R177 K178	E170-A174 WeakPolarHBondContact O-CB 3.31Å; E170-A174 PolarHBondContact O-N 2.92Å; L171-A174 PolarHBondContact O-N 3.19Å; A174-R177 PolarHBondContact O-N 3.06Å; A174-K178 WeakPolarHBondContact O-CG 2.78Å; A174-K178 PolarHBondContact O-N 3Å
175	L	89.7	Confident	90.4	Very high	66 Å²	66	92 Å²	92	35%	0.346	44%	0.442	S	S	.	.	H	α-helix	trans	-66.8	-43.7	177.5	-170	59.2	0	0	0	111.8	L171 Q172 Q173 R177 K178 N179 L208	L171-L175 VanDerWaalsContact O-CB 3.28Å; L171-L175 WeakPolarHBondContact O-CB 3.28Å; L171-L175 PolarHBondContact O-N 3.34Å; Q172-L175 PolarHBondContact O-N 3.32Å; Q173-L175 VanDerWaalsContact C-N 3.33Å; Q173-L175 PolarHBondContact O-N 2.93Å; L175-R177 VanDerWaalsContact C-N 3.32Å; L175-R177 PolarHBondContact O-N 3.38Å; L175-K178 PolarHBondContact O-N 2.94Å; L175-N179 WeakPolarHBondContact O-CB 3.33Å; L175-N179 PolarHBondContact O-N 3.5Å; L175-L208 HydrophobicContact CD1-CD2 4.13Å; L175-L208 HydrophobicContact CD2-CD2 3.25Å; L175-L208 HydrophobicContact CG-CD2 3.59Å
176	K	88.1	Confident	90.2	Very high	114 Å²	114	90.8 Å²	90.8	50%	0.496	43%	0.434	S	S	.	.	H	α-helix	trans	-59.4	-41.2	172.7	-75.7	-177	176.5	-171.4	0	111.8	Q172 Q173 K180 E209	Q172-K176 WeakPolarHBondContact O-CB 3.43Å; Q172-K176 WeakPolarHBondContact O-CG 3.49Å; Q172-K176 PolarHBondContact O-N 3.24Å; Q173-K176 PolarHBondContact O-N 3.46Å; K176-K180 WeakPolarHBondContact O-CB 3.38Å; K176-K180 PolarHBondContact O-N 2.98Å; K176-E209 IonicContact NZ-OE1 3.58Å
177	R	90.6	Very high	89.8	Confident	160 Å²	160	89.2 Å²	89.2	60%	0.604	43%	0.429	S	S	*	.	H	α-helix	trans	-64.5	-45.8	175.7	-71.7	173.7	-167	-176.4	8	112.1	Q173 A174 L175 K180 Q181	Q173-R177 VanDerWaalsContact O-CG 3.27Å; Q173-R177 WeakPolarHBondContact O-CG 2.77Å; Q173-R177 PolarHBondContact O-N 2.88Å; A174-R177 PolarHBondContact O-N 3.06Å; L175-R177 VanDerWaalsContact C-N 3.32Å; L175-R177 PolarHBondContact O-N 3.38Å; R177-K180 PolarHBondContact O-N 3.21Å; R177-Q181 WeakPolarHBondContact O-CG 3.44Å; R177-Q181 PolarHBondContact O-N 3.49Å
178	K	91.6	Very high	89.6	Confident	144 Å²	144	90.4 Å²	90.4	63%	0.626	44%	0.437	S	S	*	.	H	α-helix	trans	-62.3	-44	177.3	-76.3	-175.8	178.2	-175.1	0	112.2	A174 L175 K180 Q181 A182	A174-K178 WeakPolarHBondContact O-CG 2.78Å; A174-K178 PolarHBondContact O-N 3Å; L175-K178 PolarHBondContact O-N 2.94Å; K178-K180 VanDerWaalsContact C-N 3.35Å; K178-K180 PolarHBondContact O-N 3.44Å; K178-Q181 PolarHBondContact O-N 3.29Å; K178-A182 WeakPolarHBondContact O-CB 3.5Å; K178-A182 PolarHBondContact O-N 3.49Å
179	N	88.3	Confident	89.6	Confident	24 Å²	24	92.2 Å²	92.2	13%	0.128	46%	0.456	C	S	.	.	H	α-helix	trans	-62.9	-42.7	177.7	-167.9	29.2	0	0	0	111.4	L175 Q181 A182 F183 S205 L208	L175-N179 WeakPolarHBondContact O-CB 3.33Å; L175-N179 PolarHBondContact O-N 3.5Å; N179-Q181 PolarHBondContact O-N 3.12Å; N179-A182 PolarHBondContact O-N 3.06Å; N179-F183 PolarHBondContact O-N 3.43Å; N179-S205 PolarHBondContact ND2-OG 2.95Å; N179-L208 HydrophobicContact CB-CD1 4.17Å; N179-L208 WeakPolarHBondContact ND2-CD1 3.44Å
180	K	88.8	Confident	89.2	Confident	138 Å²	138	88.9 Å²	88.9	60%	0.6	45%	0.445	S	S	*	.	H	α-helix	trans	-61.7	-42.7	174.5	-175.4	178.6	179.7	-179.1	0	112.4	K176 R177 K178 F183 L184	K176-K180 WeakPolarHBondContact O-CB 3.38Å; K176-K180 PolarHBondContact O-N 2.98Å; R177-K180 PolarHBondContact O-N 3.21Å; K178-K180 VanDerWaalsContact C-N 3.35Å; K178-K180 PolarHBondContact O-N 3.44Å; K180-F183 PolarHBondContact O-N 2.93Å; K180-L184 WeakPolarHBondContact O-CG 3.47Å; K180-L184 PolarHBondContact O-N 2.94Å; K180-L184 VanDerWaalsContact O-N 3.12Å
181	Q	91.1	Very high	88.6	Confident	118 Å²	118	92.2 Å²	92.2	55%	0.551	47%	0.466	S	S	*	.	H	α-helix	trans	-63.4	-49.6	176.9	-77.2	174.7	-23.1	0	0	111.3	R177 K178 N179 F183 L184 D185	R177-Q181 WeakPolarHBondContact O-CG 3.44Å; R177-Q181 PolarHBondContact O-N 3.49Å; K178-Q181 PolarHBondContact O-N 3.29Å; N179-Q181 PolarHBondContact O-N 3.12Å; Q181-F183 PolarHBondContact O-N 3.46Å; Q181-L184 WeakPolarHBondContact O-CA 3.38Å; Q181-L184 WeakPolarHBondContact O-CB 3.46Å; Q181-L184 PolarHBondContact O-N 3.36Å; Q181-D185 PolarHBondContact O-N 3.35Å
182	A	89.1	Confident	88.2	Confident	42 Å²	42	91.2 Å²	91.2	35%	0.347	46%	0.46	S	S	.	.	H	α-helix	trans	-57.3	-36.5	177.9	0	0	0	0	0	112.6	K178 N179 D185 E186	K178-A182 WeakPolarHBondContact O-CB 3.5Å; K178-A182 PolarHBondContact O-N 3.49Å; N179-A182 PolarHBondContact O-N 3.06Å; A182-D185 PolarHBondContact O-N 2.92Å; A182-E186 WeakPolarHBondContact O-CB 3.48Å; A182-E186 WeakPolarHBondContact O-CG 3.42Å; A182-E186 PolarHBondContact O-N 3.3Å
183	F	88.4	Confident	88.2	Confident	27 Å²	27	92.3 Å²	92.3	12%	0.118	47%	0.472	C	S	.	.	H	α-helix	trans	-67.5	-39.5	174.2	179.5	-116.6	0	0	0	113.4	N179 K180 Q181 E186 L187 L197 L198 H201	N179-F183 PolarHBondContact O-N 3.43Å; K180-F183 PolarHBondContact O-N 2.93Å; Q181-F183 PolarHBondContact O-N 3.46Å; F183-E186 PolarHBondContact O-N 2.94Å; F183-L187 HydrophobicContact CD1-CD1 4.08Å; F183-L187 HydrophobicContact CE1-CD1 3.56Å; F183-L187 HydrophobicContact CE1-CG 4.31Å; F183-L187 HydrophobicContact CE2-CD1 4.28Å; F183-L187 HydrophobicContact CE2-CD2 4.35Å; F183-L187 HydrophobicContact CE2-CG 4.15Å; F183-L187 HydrophobicContact CZ-CD1 3.67Å; F183-L187 HydrophobicContact CZ-CD2 4.21Å; F183-L187 HydrophobicContact CZ-CG 4.02Å; F183-L187 WeakPolarHBondContact O-CG 3.26Å; F183-L187 PolarHBondContact O-N 3.22Å; F183-L197 HydrophobicContact CE2-CB 4.32Å; F183-L198 HydrophobicContact CZ-CD1 3.87Å; F183-L198 HydrophobicContact CZ-CG 4.4Å; F183-H201 VanDerWaalsContact CB-CD2 3.41Å; F183-H201 WeakPolarHBondContact CB-CD2 3.4Å; F183-H201 HydrophobicContact CD2-CB 3.49Å; F183-H201 VanDerWaalsContact CD2-CB 3.49Å; F183-H201 AromaticContact CD2-CD2 3.77Å; F183-H201 AromaticContact CD2-CG 3.63Å; F183-H201 HydrophobicContact CE2-CB 3.62Å; F183-H201 HydrophobicContact CG-CB 4.1Å; F183-H201 AromaticContact CG-CD2 3.51Å; F183-H201 AromaticContact CG-CG 3.68Å; F183-H201 HydrophobicContact CZ-CB 4.33Å
184	L	88.8	Confident	87.8	Confident	94 Å²	94	92.1 Å²	92.1	49%	0.492	48%	0.478	S	S	.	.	H	α-helix	trans	-64.3	-42.7	174.8	-68.7	171.7	0	0	0	111.1	K180 Q181 L187 E188	K180-L184 WeakPolarHBondContact O-CG 3.47Å; K180-L184 PolarHBondContact O-N 2.94Å; K180-L184 VanDerWaalsContact O-N 3.12Å; Q181-L184 WeakPolarHBondContact O-CA 3.38Å; Q181-L184 WeakPolarHBondContact O-CB 3.46Å; Q181-L184 PolarHBondContact O-N 3.36Å; L184-L187 WeakPolarHBondContact O-CB 3.49Å; L184-L187 PolarHBondContact O-N 3.49Å; L184-E188 PolarHBondContact O-N 3.15Å
185	D	90.4	Very high	87.6	Confident	96 Å²	96	93.9 Å²	93.9	51%	0.513	49%	0.493	S	S	.	.	H	α-helix	trans	-64.2	-42.7	177.4	-59.6	-22.8	0	0	0	111.2	Q181 A182 L187 E188 S189	Q181-D185 PolarHBondContact O-N 3.35Å; A182-D185 PolarHBondContact O-N 2.92Å; D185-L187 VanDerWaalsContact C-N 3.32Å; D185-L187 PolarHBondContact O-N 3.14Å; D185-E188 PolarHBondContact O-N 2.93Å; D185-E188 VanDerWaalsContact O-N 3.16Å; D185-S189 PolarHBondContact O-N 3.16Å; D185-S189 PolarHBondContact O-OG 3.01Å
186	E	87.5	Confident	87.4	Confident	53 Å²	53	95.7 Å²	95.7	25%	0.248	50%	0.502	C	S	.	.	H	α-helix	trans	-61	-38.5	174.1	-82.8	177.7	177.5	0	0	111.9	A182 F183 E188 S190 R204	A182-E186 WeakPolarHBondContact O-CB 3.48Å; A182-E186 WeakPolarHBondContact O-CG 3.42Å; A182-E186 PolarHBondContact O-N 3.3Å; F183-E186 PolarHBondContact O-N 2.94Å; E186-E188 VanDerWaalsContact C-N 3.33Å; E186-S190 VanDerWaalsContact O-CB 3.26Å; E186-S190 WeakPolarHBondContact O-CB 3.34Å; E186-S190 PolarHBondContact O-N 3.43Å; E186-S190 VanDerWaalsContact O-N 3.14Å; E186-S190 PolarHBondContact O-OG 3.41Å; E186-R204 IonicContact OE1-CZ 3.64Å; E186-R204 IonicContact OE1-NH1 2.82Å; E186-R204 PolarHBondContact OE1-NH1 3.33Å; E186-R204 IonicContact OE1-NH2 3.49Å; E186-R204 PolarHBondContact OE1-NH2 3.33Å; E186-R204 IonicContact OE2-NH1 3.37Å; E186-R204 PolarHBondContact OE2-NH1 3.19Å
187	L	85.9	Confident	87.2	Confident	65 Å²	65	90.6 Å²	90.6	34%	0.34	48%	0.48	S	S	.	.	H	α-helix	trans	-68.1	-31.6	174.8	-74.6	174.9	0	0	0	112.9	F183 L184 D185 L197	F183-L187 HydrophobicContact CD1-CD1 4.08Å; F183-L187 HydrophobicContact CE1-CD1 3.56Å; F183-L187 HydrophobicContact CE1-CG 4.31Å; F183-L187 HydrophobicContact CE2-CD1 4.28Å; F183-L187 HydrophobicContact CE2-CD2 4.35Å; F183-L187 HydrophobicContact CE2-CG 4.15Å; F183-L187 HydrophobicContact CZ-CD1 3.67Å; F183-L187 HydrophobicContact CZ-CD2 4.21Å; F183-L187 HydrophobicContact CZ-CG 4.02Å; F183-L187 WeakPolarHBondContact O-CG 3.26Å; F183-L187 PolarHBondContact O-N 3.22Å; L184-L187 WeakPolarHBondContact O-CB 3.49Å; L184-L187 PolarHBondContact O-N 3.49Å; D185-L187 VanDerWaalsContact C-N 3.32Å; D185-L187 PolarHBondContact O-N 3.14Å; L187-L197 HydrophobicContact CD2-CB 4.43Å; L187-L197 HydrophobicContact CD2-CD1 3.91Å
188	E	89.3	Confident	87	Confident	169 Å²	169	86.5 Å²	86.5	79%	0.79	47%	0.47	S	S	*	.	H	α-helix	trans	-77.8	-39	179	-175.7	173.2	-175.1	0	0	112	L184 D185 E186	L184-E188 PolarHBondContact O-N 3.15Å; D185-E188 PolarHBondContact O-N 2.93Å; D185-E188 VanDerWaalsContact O-N 3.16Å; E186-E188 VanDerWaalsContact C-N 3.33Å
189	S	88.4	Confident	86.8	Confident	101 Å²	101	81.8 Å²	81.8	71%	0.706	46%	0.458	S	S	*	.	H	α-helix	trans	-97.6	-9.7	-171.4	73.5	0	0	0	0	115.7	D185	D185-S189 PolarHBondContact O-N 3.16Å; D185-S189 PolarHBondContact O-OG 3.01Å
190	S	82.4	Confident	86.7	Confident	35 Å²	35	85 Å²	85	25%	0.245	47%	0.472	C	S	.	.			trans	-117.7	140	-174.1	77.4	0	0	0	0	113.9	E186 L192 L197	E186-S190 VanDerWaalsContact O-CB 3.26Å; E186-S190 WeakPolarHBondContact O-CB 3.34Å; E186-S190 PolarHBondContact O-N 3.43Å; E186-S190 VanDerWaalsContact O-N 3.14Å; E186-S190 PolarHBondContact O-OG 3.41Å; S190-L192 VanDerWaalsContact C-N 3.3Å; S190-L192 PolarHBondContact O-N 3.24Å; S190-L197 WeakPolarHBondContact OG-CD1 3.41Å
191	D	81.5	Confident	86.7	Confident	174 Å²	174	80.3 Å²	80.3	93%	0.93	45%	0.452	S	S	*	.			trans	-93.5	21.2	178.3	-61.9	-47.7	0	0	0	112.9
192	L	82.3	Confident	86.6	Confident	98 Å²	98	80.8 Å²	80.8	51%	0.513	45%	0.452	S	S	.	.	S	Bend	trans	-74.5	153.4	179.8	-73	174.4	0	0	0	111.5	S190 V194 L197	S190-L192 VanDerWaalsContact C-N 3.3Å; S190-L192 PolarHBondContact O-N 3.24Å; L192-V194 PolarHBondContact O-N 2.95Å; L192-L197 HydrophobicContact CB-CD1 4.16Å; L192-L197 HydrophobicContact CB-CD2 4.3Å; L192-L197 HydrophobicContact CB-CG 4.11Å; L192-L197 HydrophobicContact CD1-CD2 4.06Å
193	P	86.2	Confident	86.5	Confident	78 Å²	78	83.2 Å²	83.2	51%	0.506	46%	0.46	S	S	.	.			trans	-56.1	124.2	173.8	-24.1	33	0	0	0	111.5	A195 L196 L197	P193-A195 PolarHBondContact O-N 3.02Å; P193-L196 HydrophobicContact CB-CD1 4.26Å; P193-L196 HydrophobicContact CB-CG 4.47Å; P193-L196 HydrophobicContact CG-CD1 4.1Å; P193-L196 WeakPolarHBondContact O-CB 3.46Å; P193-L196 PolarHBondContact O-N 2.62Å; P193-L197 PolarHBondContact O-N 3.49Å
194	V	83.9	Confident	86.3	Confident	96 Å²	96	86.7 Å²	86.7	58%	0.582	47%	0.472	S	S	*	.	H	α-helix	trans	-51	-35.9	-176.5	178.6	0	0	0	0	112.8	L192 L196 L197 L198	L192-V194 PolarHBondContact O-N 2.95Å; V194-L196 VanDerWaalsContact C-N 3.32Å; V194-L196 PolarHBondContact O-N 2.82Å; V194-L197 PolarHBondContact O-N 3.04Å; V194-L198 HydrophobicContact CG1-CD1 4.2Å; V194-L198 PolarHBondContact O-N 3.42Å
195	A	87.6	Confident	86.1	Confident	80 Å²	80	83.7 Å²	83.7	66%	0.661	46%	0.459	S	S	*	.	H	α-helix	trans	-62.7	-34.7	178.6	0	0	0	0	0	113.5	P193 A199	P193-A195 PolarHBondContact O-N 3.02Å; A195-A199 PolarHBondContact O-N 3.49Å
196	L	85.6	Confident	85.8	Confident	104 Å²	104	82.4 Å²	82.4	55%	0.545	46%	0.455	S	S	.	.	H	α-helix	trans	-75.6	-41	179.1	-69.9	172.9	0	0	0	111.5	P193 V194 L198 A199 Q200	P193-L196 HydrophobicContact CB-CD1 4.26Å; P193-L196 HydrophobicContact CB-CG 4.47Å; P193-L196 HydrophobicContact CG-CD1 4.1Å; P193-L196 WeakPolarHBondContact O-CB 3.46Å; P193-L196 PolarHBondContact O-N 2.62Å; V194-L196 VanDerWaalsContact C-N 3.32Å; V194-L196 PolarHBondContact O-N 2.82Å; L196-L198 VanDerWaalsContact C-N 3.34Å; L196-L198 PolarHBondContact O-N 3.38Å; L196-A199 PolarHBondContact O-N 3.39Å; L196-Q200 WeakPolarHBondContact O-CG 3.48Å; L196-Q200 PolarHBondContact O-N 3.31Å
197	L	82.9	Confident	85.6	Confident	6 Å²	6	85.2 Å²	85.2	3%	0.031	47%	0.468	C	S	.	.	H	α-helix	trans	-63.3	-40.6	175.8	-67.7	173	0	0	0	111.5	F183 L187 S190 L192 P193 V194 A199 Q200 H201	F183-L197 HydrophobicContact CE2-CB 4.32Å; L187-L197 HydrophobicContact CD2-CB 4.43Å; L187-L197 HydrophobicContact CD2-CD1 3.91Å; S190-L197 WeakPolarHBondContact OG-CD1 3.41Å; L192-L197 HydrophobicContact CB-CD1 4.16Å; L192-L197 HydrophobicContact CB-CD2 4.3Å; L192-L197 HydrophobicContact CB-CG 4.11Å; L192-L197 HydrophobicContact CD1-CD2 4.06Å; P193-L197 PolarHBondContact O-N 3.49Å; V194-L197 PolarHBondContact O-N 3.04Å; L197-A199 VanDerWaalsContact C-N 3.32Å; L197-A199 PolarHBondContact O-N 3.05Å; L197-Q200 PolarHBondContact O-N 3Å; L197-H201 PolarHBondContact O-N 2.86Å
198	L	86.6	Confident	85.4	Confident	75 Å²	75	84.1 Å²	84.1	39%	0.393	46%	0.462	S	S	.	.	H	α-helix	trans	-62.5	-39.1	175.3	-120.5	92	0	0	0	112.5	F183 V194 L196 K202	F183-L198 HydrophobicContact CZ-CD1 3.87Å; F183-L198 HydrophobicContact CZ-CG 4.4Å; V194-L198 HydrophobicContact CG1-CD1 4.2Å; V194-L198 PolarHBondContact O-N 3.42Å; L196-L198 VanDerWaalsContact C-N 3.34Å; L196-L198 PolarHBondContact O-N 3.38Å; L198-K202 WeakPolarHBondContact O-CG 3.44Å; L198-K202 PolarHBondContact O-N 3.38Å
199	A	87.8	Confident	84.9	Confident	45 Å²	45	80.5 Å²	80.5	37%	0.372	45%	0.445	S	S	.	.	H	α-helix	trans	-65	-47.9	177.6	0	0	0	0	0	110.8	A195 L196 L197 H201 K202 D203	A195-A199 PolarHBondContact O-N 3.49Å; L196-A199 PolarHBondContact O-N 3.39Å; L197-A199 VanDerWaalsContact C-N 3.32Å; L197-A199 PolarHBondContact O-N 3.05Å; A199-H201 VanDerWaalsContact C-N 3.34Å; A199-H201 PolarHBondContact O-N 3.24Å; A199-K202 WeakPolarHBondContact O-CB 3.48Å; A199-K202 PolarHBondContact O-N 3.44Å; A199-D203 PolarHBondContact O-N 3.31Å
200	Q	86.9	Confident	84.3	Confident	92 Å²	92	82 Å²	82	43%	0.43	44%	0.443	S	S	.	.	H	α-helix	trans	-61	-40.2	177.5	-70.7	-178.6	-2.6	0	0	112.8	L196 L197 D203 R204	L196-Q200 WeakPolarHBondContact O-CG 3.48Å; L196-Q200 PolarHBondContact O-N 3.31Å; L197-Q200 PolarHBondContact O-N 3Å; Q200-D203 PolarHBondContact O-N 3.12Å; Q200-R204 WeakPolarHBondContact O-CG 3.45Å; Q200-R204 PolarHBondContact O-N 3.19Å
201	H	87.8	Confident	83.6	Confident	38 Å²	38	87.3 Å²	87.3	18%	0.176	46%	0.463	C	S	.	.	H	α-helix	trans	-68.7	-36.2	177.1	179.2	-96.3	0	0	0	112.9	F183 L197 A199 R204 S205	F183-H201 VanDerWaalsContact CB-CD2 3.41Å; F183-H201 WeakPolarHBondContact CB-CD2 3.4Å; F183-H201 HydrophobicContact CD2-CB 3.49Å; F183-H201 VanDerWaalsContact CD2-CB 3.49Å; F183-H201 AromaticContact CD2-CD2 3.77Å; F183-H201 AromaticContact CD2-CG 3.63Å; F183-H201 HydrophobicContact CE2-CB 3.62Å; F183-H201 HydrophobicContact CG-CB 4.1Å; F183-H201 AromaticContact CG-CD2 3.51Å; F183-H201 AromaticContact CG-CG 3.68Å; F183-H201 HydrophobicContact CZ-CB 4.33Å; L197-H201 PolarHBondContact O-N 2.86Å; A199-H201 VanDerWaalsContact C-N 3.34Å; A199-H201 PolarHBondContact O-N 3.24Å; H201-R204 PolarHBondContact O-N 3.47Å; H201-S205 PolarHBondContact CE1-OG 3.38Å; H201-S205 WeakPolarHBondContact O-CB 3.43Å; H201-S205 PolarHBondContact O-N 2.98Å; H201-S205 PolarHBondContact O-OG 3.46Å
202	K	88.3	Confident	82.8	Confident	128 Å²	128	81.4 Å²	81.4	56%	0.557	43%	0.432	S	S	*	.	H	α-helix	trans	-62.2	-44.4	172.4	-78	177.3	179.5	-178	0	110.9	L198 A199 S205 T206	L198-K202 WeakPolarHBondContact O-CG 3.44Å; L198-K202 PolarHBondContact O-N 3.38Å; A199-K202 WeakPolarHBondContact O-CB 3.48Å; A199-K202 PolarHBondContact O-N 3.44Å; K202-S205 PolarHBondContact O-N 2.79Å; K202-T206 WeakPolarHBondContact O-CG2 3.41Å; K202-T206 PolarHBondContact O-N 3.38Å; K202-T206 PolarHBondContact O-OG1 3.29Å; K202-T206 VanDerWaalsContact O-OG1 3.12Å
203	D	87.3	Confident	81.7	Confident	94 Å²	94	84.4 Å²	84.4	50%	0.503	44%	0.443	S	S	.	.	H	α-helix	trans	-64.8	-40.9	177.4	-65.9	-24.4	0	0	0	112.3	A199 Q200 T206 Q207	A199-D203 PolarHBondContact O-N 3.31Å; Q200-D203 PolarHBondContact O-N 3.12Å; D203-T206 PolarHBondContact O-OG1 2.99Å; D203-Q207 WeakPolarHBondContact O-CB 3.34Å; D203-Q207 WeakPolarHBondContact O-CG 3.32Å; D203-Q207 PolarHBondContact O-N 3.2Å; D203-Q207 VanDerWaalsContact O-N 3.08Å
204	R	85.3	Confident	80.1	Confident	100 Å²	100	88.7 Å²	88.7	38%	0.377	45%	0.454	S	S	.	.	H	α-helix	trans	-63.9	-40.7	174.3	-74	178.3	-175.4	169.4	3.8	111.9	E186 Q200 H201 L208	E186-R204 IonicContact OE1-CZ 3.64Å; E186-R204 IonicContact OE1-NH1 2.82Å; E186-R204 PolarHBondContact OE1-NH1 3.33Å; E186-R204 IonicContact OE1-NH2 3.49Å; E186-R204 PolarHBondContact OE1-NH2 3.33Å; E186-R204 IonicContact OE2-NH1 3.37Å; E186-R204 PolarHBondContact OE2-NH1 3.19Å; Q200-R204 WeakPolarHBondContact O-CG 3.45Å; Q200-R204 PolarHBondContact O-N 3.19Å; H201-R204 PolarHBondContact O-N 3.47Å; R204-L208 WeakPolarHBondContact O-CB 3.43Å; R204-L208 WeakPolarHBondContact O-CD1 3.27Å; R204-L208 WeakPolarHBondContact O-CG 3.3Å; R204-L208 PolarHBondContact O-N 3.06Å
205	S	84.4	Confident	78.4	Confident	31 Å²	31	90 Å²	90	22%	0.217	46%	0.464	C	S	.	.	H	α-helix	trans	-68	-42.2	-179.2	-59.4	0	0	0	0	112.3	N179 H201 K202 L208 E209	N179-S205 PolarHBondContact ND2-OG 2.95Å; H201-S205 PolarHBondContact CE1-OG 3.38Å; H201-S205 WeakPolarHBondContact O-CB 3.43Å; H201-S205 PolarHBondContact O-N 2.98Å; H201-S205 PolarHBondContact O-OG 3.46Å; K202-S205 PolarHBondContact O-N 2.79Å; S205-L208 WeakPolarHBondContact O-CB 3.41Å; S205-L208 PolarHBondContact O-N 3.37Å; S205-E209 WeakPolarHBondContact O-CG 3.23Å; S205-E209 PolarHBondContact O-N 3.08Å
206	T	84.3	Confident	76.6	Confident	69 Å²	69	95.7 Å²	95.7	42%	0.423	47%	0.468	S	S	.	.	H	α-helix	trans	-67.5	-38.9	176.3	51.9	0	0	0	0	111.9	K202 D203 L208 E209 M210	K202-T206 WeakPolarHBondContact O-CG2 3.41Å; K202-T206 PolarHBondContact O-N 3.38Å; K202-T206 PolarHBondContact O-OG1 3.29Å; K202-T206 VanDerWaalsContact O-OG1 3.12Å; D203-T206 PolarHBondContact O-OG1 2.99Å; T206-L208 VanDerWaalsContact C-N 3.32Å; T206-L208 PolarHBondContact O-N 2.94Å; T206-E209 PolarHBondContact O-N 3.35Å; T206-M210 WeakPolarHBondContact O-CB 3.43Å; T206-M210 VanDerWaalsContact O-CG 3.3Å; T206-M210 WeakPolarHBondContact O-CG 3.36Å; T206-M210 PolarHBondContact O-N 3.01Å
207	Q	83.8	Confident	74.4	Confident	112 Å²	112	96.1 Å²	96.1	52%	0.523	48%	0.48	S	S	.	.	H	α-helix	trans	-62.7	-38	173.6	-74	173.8	20.4	0	0	112.6	D203 Q211	D203-Q207 WeakPolarHBondContact O-CB 3.34Å; D203-Q207 WeakPolarHBondContact O-CG 3.32Å; D203-Q207 PolarHBondContact O-N 3.2Å; D203-Q207 VanDerWaalsContact O-N 3.08Å; Q207-Q211 VanDerWaalsContact O-CG 3.27Å; Q207-Q211 WeakPolarHBondContact O-CG 3.49Å; Q207-Q211 PolarHBondContact O-N 3.42Å; Q207-Q211 VanDerWaalsContact O-N 3.12Å
208	L	80.6	Confident	72.6	Confident	42 Å²	42	103.5 Å²	103.5	22%	0.22	52%	0.516	C	S	.	.	H	α-helix	trans	-64.6	-44.9	175.6	-88.4	157.7	0	0	0	111.9	L175 N179 R204 S205 T206 Q211 L212	L175-L208 HydrophobicContact CD1-CD2 4.13Å; L175-L208 HydrophobicContact CD2-CD2 3.25Å; L175-L208 HydrophobicContact CG-CD2 3.59Å; N179-L208 HydrophobicContact CB-CD1 4.17Å; N179-L208 WeakPolarHBondContact ND2-CD1 3.44Å; R204-L208 WeakPolarHBondContact O-CB 3.43Å; R204-L208 WeakPolarHBondContact O-CD1 3.27Å; R204-L208 WeakPolarHBondContact O-CG 3.3Å; R204-L208 PolarHBondContact O-N 3.06Å; S205-L208 WeakPolarHBondContact O-CB 3.41Å; S205-L208 PolarHBondContact O-N 3.37Å; T206-L208 VanDerWaalsContact C-N 3.32Å; T206-L208 PolarHBondContact O-N 2.94Å; L208-Q211 PolarHBondContact O-N 3.04Å; L208-L212 WeakPolarHBondContact O-CD1 3.42Å; L208-L212 VanDerWaalsContact O-CG 3.32Å; L208-L212 WeakPolarHBondContact O-CG 3.21Å; L208-L212 PolarHBondContact O-N 2.99Å
209	E	78.2	Confident	70.3	Confident	92 Å²	92	108.7 Å²	108.7	43%	0.43	54%	0.536	S	S	.	.	H	α-helix	trans	-65.9	-43.3	177.4	-71.1	178.2	162.5	0	0	111.8	K176 S205 T206 Q211 L212 E213	K176-E209 IonicContact NZ-OE1 3.58Å; S205-E209 WeakPolarHBondContact O-CG 3.23Å; S205-E209 PolarHBondContact O-N 3.08Å; T206-E209 PolarHBondContact O-N 3.35Å; E209-Q211 VanDerWaalsContact C-N 3.28Å; E209-Q211 PolarHBondContact O-N 3.05Å; E209-L212 PolarHBondContact O-N 3.45Å; E209-L212 VanDerWaalsContact O-N 3.09Å; E209-E213 PolarHBondContact O-N 2.94Å
210	M	75.9	Confident	68.2	Low	134 Å²	134	112.1 Å²	112.1	66%	0.66	55%	0.554	S	S	*	*	H	α-helix	trans	-63.7	-28.9	176.2	-73.3	179.8	67.8	0	0	114	T206	T206-M210 WeakPolarHBondContact O-CB 3.43Å; T206-M210 VanDerWaalsContact O-CG 3.3Å; T206-M210 WeakPolarHBondContact O-CG 3.36Å; T206-M210 PolarHBondContact O-N 3.01Å
211	Q	69.2	Low	66.2	Low	145 Å²	145	113.8 Å²	113.8	68%	0.678	57%	0.57	S	S	*	*	H	α-helix	trans	-76.6	-24.9	175.5	-75.6	178.2	37.4	0	0	112.9	Q207 L208 E209	Q207-Q211 VanDerWaalsContact O-CG 3.27Å; Q207-Q211 WeakPolarHBondContact O-CG 3.49Å; Q207-Q211 PolarHBondContact O-N 3.42Å; Q207-Q211 VanDerWaalsContact O-N 3.12Å; L208-Q211 PolarHBondContact O-N 3.04Å; E209-Q211 VanDerWaalsContact C-N 3.28Å; E209-Q211 PolarHBondContact O-N 3.05Å
212	L	64.6	Low	64.1	Low	51 Å²	51	118 Å²	118	27%	0.267	60%	0.599	S	S	.	*	H	α-helix	trans	-85.4	-32.7	179.5	-71.8	162.9	0	0	0	112.3	Q172 L208 E209 K214	Q172-L212 HydrophobicContact CG-CD1 3.88Å; Q172-L212 HydrophobicContact CG-CD2 3.59Å; Q172-L212 HydrophobicContact CG-CG 4.29Å; L208-L212 WeakPolarHBondContact O-CD1 3.42Å; L208-L212 VanDerWaalsContact O-CG 3.32Å; L208-L212 WeakPolarHBondContact O-CG 3.21Å; L208-L212 PolarHBondContact O-N 2.99Å; E209-L212 PolarHBondContact O-N 3.45Å; E209-L212 VanDerWaalsContact O-N 3.09Å; L212-K214 VanDerWaalsContact C-N 3.27Å; L212-K214 PolarHBondContact O-N 3.32Å
213	E	59.2	Low	61.8	Low	160 Å²	160	118.9 Å²	118.9	75%	0.748	60%	0.603	S	S	*	*	S	Bend	trans	-77.1	-6.4	178.3	-74.3	-174.3	161	0	0	114.5	E209 P215	E209-E213 PolarHBondContact O-N 2.94Å; E213-P215 VanDerWaalsContact O-CD 3.23Å; E213-P215 WeakPolarHBondContact O-CD 3.33Å; E213-P215 VanDerWaalsContact O-N 3.15Å
214	K	52.1	Low	60.3	Low	169 Å²	169	120.1 Å²	120.1	74%	0.735	62%	0.619	S	S	*	*	S	Bend	trans	-67.6	114.8	178.4	-126.4	178.8	-173.6	177.3	0	109.1	L212 R216	L212-K214 VanDerWaalsContact C-N 3.27Å; L212-K214 PolarHBondContact O-N 3.32Å; K214-R216 PolarHBondContact O-N 3.3Å
215	P	47.1	Very low	58.9	Low	122 Å²	122	119.6 Å²	119.6	79%	0.792	63%	0.627	S	S	*	*			trans	-63.5	115.9	179.3	13.2	-11.1	0	0	0	108.1	E213 S217	E213-P215 VanDerWaalsContact O-CD 3.23Å; E213-P215 WeakPolarHBondContact O-CD 3.33Å; E213-P215 VanDerWaalsContact O-N 3.15Å; P215-S217 PolarHBondContact O-N 3.09Å
216	R	50.4	Low	57	Low	200 Å²	200	121.4 Å²	121.4	76%	0.755	65%	0.65	S	S	*	*			trans	-68	116.2	168.7	-70.7	-177.2	-176.8	-166.5	2.3	106.4	K214 M218	K214-R216 PolarHBondContact O-N 3.3Å; R216-M218 PolarHBondContact O-N 3.12Å
217	S	40.1	Very low	55.2	Low	114 Å²	114	123.8 Å²	123.8	80%	0.797	66%	0.659	S	S	*	*			trans	-59.6	102.5	173.9	68.2	0	0	0	0	108.5	P215 K219	P215-S217 PolarHBondContact O-N 3.09Å; S217-K219 PolarHBondContact O-N 3.18Å
218	M	44.2	Very low	52.9	Low	161 Å²	161	127.9 Å²	127.9	79%	0.793	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-67.1	124.4	166.9	-69.6	-172.8	-77.3	0	0	106.6	R216	R216-M218 PolarHBondContact O-N 3.12Å
219	K	39.4	Very low	50.8	Low	184 Å²	184	133.2 Å²	133.2	80%	0.8	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-59.9	136.3	173.8	-68	-179.5	-179.9	179.2	0	107.6	S217 V221	S217-K219 PolarHBondContact O-N 3.18Å; K219-V221 PolarHBondContact O-N 3.44Å
220	P	42.2	Very low	48.6	Very low	117 Å²	117	134.8 Å²	134.8	76%	0.76	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-60.1	126.5	179.5	24.4	-32.2	0	0	0	109	T222	P220-T222 PolarHBondContact O-N 2.9Å
221	V	45.9	Very low	46.8	Very low	126 Å²	126	134.9 Å²	134.9	76%	0.764	72%	0.719	S	S	*	*			trans	-74.6	106.7	172.9	-158	0	0	0	0	106.3	K219 F223	K219-V221 PolarHBondContact O-N 3.44Å; V221-F223 PolarHBondContact O-N 3.03Å
222	T	42.7	Very low	44.9	Very low	127 Å²	127	137.1 Å²	137.1	78%	0.779	73%	0.727	S	S	*	*			trans	-78.5	107.6	175.7	48.9	0	0	0	0	108.9	P220	P220-T222 PolarHBondContact O-N 2.9Å
223	F	41.8	Very low	43.7	Very low	147 Å²	147	142.9 Å²	142.9	65%	0.645	75%	0.753	S	S	*	*			trans	-72.5	139.8	169.2	-170.4	-132	0	0	0	110	V221 T225 G226	V221-F223 PolarHBondContact O-N 3.03Å; F223-T225 WeakPolarHBondContact CD1-OG1 3.49Å; F223-T225 HydrophobicContact CE1-CG2 4.21Å; F223-T225 WeakPolarHBondContact CE1-OG1 3.5Å; F223-T225 PolarHBondContact O-N 3.26Å; F223-G226 PolarHBondContact O-N 3.4Å
224	S	54.6	Low	42.5	Very low	120 Å²	120	137.9 Å²	137.9	84%	0.839	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	5	-173.7	59.5	0	0	0	0	115.1
225	T	55.8	Low	41.8	Very low	89 Å²	89	135.7 Å²	135.7	55%	0.546	75%	0.746	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108	14.1	174.7	49.7	0	0	0	0	114.2	F223 I227	F223-T225 WeakPolarHBondContact CD1-OG1 3.49Å; F223-T225 HydrophobicContact CE1-CG2 4.21Å; F223-T225 WeakPolarHBondContact CE1-OG1 3.5Å; F223-T225 PolarHBondContact O-N 3.26Å; T225-I227 VanDerWaalsContact C-N 3.32Å; T225-I227 PolarHBondContact O-N 3.05Å
226	G	44.8	Very low	41.5	Very low	68 Å²	68	134.9 Å²	134.9	70%	0.701	75%	0.75	S	S	*	*			trans	75.6	9.9	162.2	0	0	0	0	0	116.6	F223 K228	F223-G226 PolarHBondContact O-N 3.4Å; G226-K228 PolarHBondContact O-N 3.43Å
227	I	46.9	Very low	40.8	Very low	119 Å²	119	132.7 Å²	132.7	61%	0.61	75%	0.752	S	S	*	*			trans	-88.5	108.3	172.5	-57.3	172.4	0	0	0	109	T225 M229	T225-I227 VanDerWaalsContact C-N 3.32Å; T225-I227 PolarHBondContact O-N 3.05Å; I227-M229 HydrophobicContact CG2-CG 4.17Å; I227-M229 HydrophobicContact CG2-SD 4.3Å; I227-M229 PolarHBondContact O-N 3.49Å
228	K	34.5	Very low	40.4	Very low	198 Å²	198	135.3 Å²	135.3	86%	0.861	75%	0.751	S	S	*	*			trans	-82.6	97.5	172.5	-76.7	179	177.7	174.7	0	109.7	G226	G226-K228 PolarHBondContact O-N 3.43Å
229	M	37.4	Very low	39.7	Very low	154 Å²	154	135.5 Å²	135.5	76%	0.759	76%	0.755	S	S	*	*			trans	-83.8	110.6	165.5	-65.7	-66.9	-86	0	0	108.8	I227 L231	I227-M229 HydrophobicContact CG2-CG 4.17Å; I227-M229 HydrophobicContact CG2-SD 4.3Å; I227-M229 PolarHBondContact O-N 3.49Å; M229-L231 PolarHBondContact O-N 3.04Å
230	V	32.7	Very low	39.5	Very low	125 Å²	125	133.2 Å²	133.2	76%	0.758	76%	0.756	S	S	*	*			trans	-82.7	92.2	170.6	-175.6	0	0	0	0	107.4	F232	V230-F232 HydrophobicContact CG1-CD2 4.28Å; V230-F232 PolarHBondContact O-N 3.25Å
231	L	36.8	Very low	39	Very low	136 Å²	136	131.2 Å²	131.2	71%	0.712	75%	0.749	S	S	*	*			trans	-81.9	97.7	167.6	-97.6	140.5	0	0	0	108.5	M229 E233	M229-L231 PolarHBondContact O-N 3.04Å; L231-E233 HydrophobicContact CD2-CG 4.3Å
232	F	29.9	Very low	38.4	Very low	193 Å²	193	133.5 Å²	133.5	85%	0.846	75%	0.749	S	S	*	*			trans	-99.7	91.1	166.2	-129.6	-87.8	0	0	0	107.5	V230	V230-F232 HydrophobicContact CG1-CD2 4.28Å; V230-F232 PolarHBondContact O-N 3.25Å
233	E	38.2	Very low	37.9	Very low	172 Å²	172	136 Å²	136	80%	0.804	76%	0.757	S	S	*	*			trans	-105.4	94.7	167.2	-77.6	-174.5	159.5	0	0	108.5	L231	L231-E233 HydrophobicContact CD2-CG 4.3Å
234	G	34	Very low	37.6	Very low	54 Å²	54	136.3 Å²	136.3	56%	0.557	76%	0.764	S	S	*	*			trans	-95.1	163.4	160.8	0	0	0	0	0	110.3	A236	G234-A236 PolarHBondContact O-N 3Å
235	P	38.1	Very low	36.4	Very low	123 Å²	123	134.1 Å²	134.1	80%	0.799	76%	0.76	S	S	*	*			trans	-66.8	134	-168.8	29.9	-33.4	0	0	0	110.2	I237	P235-I237 PolarHBondContact O-N 3.38Å
236	A	40.2	Very low	35.6	Very low	105 Å²	105	135.8 Å²	135.8	87%	0.868	78%	0.776	S	S	*	*			trans	-58.7	106.9	178.5	0	0	0	0	0	111.2	G234	G234-A236 PolarHBondContact O-N 3Å
237	I	36.1	Very low	35.3	Very low	154 Å²	154	137.9 Å²	137.9	79%	0.79	78%	0.78	S	S	*	*			trans	-135.4	111.5	156.1	-51.2	177.7	0	0	0	106.9	P235	P235-I237 PolarHBondContact O-N 3.38Å
238	H	32.1	Very low	34.8	Very low	170 Å²	170	143.9 Å²	143.9	79%	0.787	80%	0.795	S	S	*	*			trans	1.1	123.3	167.7	-88.6	-95.9	0	0	0	118.3
239	L	28.8	Very low	35	Very low	165 Å²	165	146.1 Å²	146.1	86%	0.864	82%	0.815	S	S	*	*				-152.8	107.7	126.8	-135.5	88.8	0	0	0	111.2
240	V	35.1	Very low	34.9	Very low	136 Å²	136	145.8 Å²	145.8	82%	0.824	82%	0.818	S	S	*	*			trans	-79.9	116.9	155	172.2	0	0	0	0	106.2
241	A	33	Very low	35	Very low	75 Å²	75	146.8 Å²	146.8	62%	0.62	82%	0.821	S	S	*	*			trans	-170.3	113.4	153	0	0	0	0	0	112.2
242	F	32.2	Very low	34.9	Very low	173 Å²	173	147.4 Å²	147.4	76%	0.759	83%	0.827	S	S	*	*			trans	41.4	118.9	130.7	-99.5	-101.4	0	0	0	120.2	L244	F242-L244 HydrophobicContact CE1-CD1 4.5Å
243	L	33.6	Very low	35.2	Very low	181 Å²	181	144.8 Å²	144.8	95%	0.948	83%	0.826	S	S	*	*				-148.8	89.1	122.8	-82.8	-174.9	0	0	0	110
244	L	33.9	Very low	35	Very low	153 Å²	153	143.1 Å²	143.1	80%	0.801	83%	0.827	S	S	*	*			trans	-78	133.1	143.7	-79.7	165.4	0	0	0	107.2	F242	F242-L244 HydrophobicContact CE1-CD1 4.5Å
245	G	30.6	Very low	35.1	Very low	73 Å²	73	149 Å²	149	75%	0.753	85%	0.845	S	S	*	*			trans	158.3	78.1	167.6	0	0	0	0	0	116.4
246	S	39.6	Very low	34.9	Very low	125 Å²	125	150.9 Å²	150.9	87%	0.874	85%	0.849	S	S	*	*			trans	13.6	133.9	136.6	-43.3	0	0	0	0	121.3
247	S	37	Very low	34.5	Very low	112 Å²	112	154.4 Å²	154.4	78%	0.783	85%	0.847	S	S	*	*				-173.7	111.6	126.2	-140	0	0	0	0	108.6
248	W	37	Very low	34.4	Very low	244 Å²	244	154.4 Å²	154.4	92%	0.924	85%	0.852	S	S	*	*				18.6	97.8	90.5	-78.2	64.4	0	0	0	114.6
249	L	39.4	Very low	34.6	Very low	246 Å²	246	153 Å²	153	100%	1.288	86%	0.858	S	S	*	*				-146.2	0	115.5	-120.7	112.3	0	0	0	109

Retrieved 249 of 249 residues in 319.5 ms (Link to these results)

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