A0A087XQ90_POEFO Loading...

DnaJ homolog subfamily C member 8

Suppresses polyglutamine (polyQ) aggregation of ATXN3 in neuronal cells.

AlphaFold DB (A0A3B3VEB1), UniProt , Accession A0A087XQ90, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 250 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	48.9	Very low	52.4	Low	250 Å²	250	109.7 Å²	109.7	100%	1.232	74%	0.737	S	S	*	*				0	110.4	0	-88.1	-177.1	164.3	0	0	108.4
2	A	42.7	Very low	53.2	Low	97 Å²	97	105.2 Å²	105.2	80%	0.802	71%	0.708	S	S	*	*			trans	170.5	101.1	159.7	0	0	0	0	0	104.7
3	A	54.5	Low	54.4	Low	103 Å²	103	102.8 Å²	102.8	85%	0.851	69%	0.688	S	S	*	*				58.3	104	79.6	0	0	0	0	0	111.9
4	A	51.5	Low	55.6	Low	107 Å²	107	99.6 Å²	99.6	88%	0.884	67%	0.668	S	S	*	*			trans	175.1	28.4	149.8	0	0	0	0	0	113.4
5	G	51.9	Low	56.3	Low	77 Å²	77	99.7 Å²	99.7	79%	0.794	66%	0.66	S	S	*	*	S	Bend	trans	-102.4	1	-179.4	0	0	0	0	0	115.4
6	G	52.1	Low	57.7	Low	54 Å²	54	101.4 Å²	101.4	56%	0.557	66%	0.656	S	S	*	*	S	Bend	trans	-108	-17.5	-164.1	0	0	0	0	0	116.6	S10	G6-S10 PolarHBondContact O-OG 3.47Å
7	E	51.1	Low	58.7	Low	152 Å²	152	102.1 Å²	102.1	71%	0.71	65%	0.652	S	S	*	*	H	α-helix	trans	-91	-30.8	-165.8	-70.6	177.7	158.6	0	0	113.9	S10 Q11	E7-S10 PolarHBondContact O-OG 3.16Å; E7-Q11 WeakPolarHBondContact O-CB 3.48Å; E7-Q11 PolarHBondContact O-N 3.11Å; E7-Q11 PolarHBondContact O-OE1 3.11Å
8	S	52.8	Low	59.3	Low	96 Å²	96	102.7 Å²	102.7	67%	0.671	64%	0.643	S	S	*	*	H	α-helix	trans	-74.9	-34.5	-175.3	70.3	0	0	0	0	113.6	S12	S8-S12 PolarHBondContact O-N 3.19Å
9	S	56.1	Low	60.1	Low	78 Å²	78	103.5 Å²	103.5	55%	0.545	64%	0.638	S	S	.	*	H	α-helix	trans	-79.2	-27.5	-179.6	-175.5	0	0	0	0	112.6	S12 V13	S9-S12 PolarHBondContact O-OG 3.23Å; S9-S12 VanDerWaalsContact O-OG 3.11Å; S9-V13 VanDerWaalsContact O-CG2 3.31Å; S9-V13 WeakPolarHBondContact O-CG2 3.22Å
10	S	57.9	Low	61.2	Low	70 Å²	70	103.5 Å²	103.5	49%	0.49	63%	0.634	S	S	.	*	H	α-helix	trans	-76.4	-35.7	174.4	53.4	0	0	0	0	111.5	G6 E7 S14	G6-S10 PolarHBondContact O-OG 3.47Å; E7-S10 PolarHBondContact O-OG 3.16Å; S10-S14 PolarHBondContact O-N 3.04Å; S10-S14 VanDerWaalsContact O-N 3.11Å; S10-S14 PolarHBondContact O-OG 3.24Å
11	Q	56.5	Low	62.1	Low	123 Å²	123	104.4 Å²	104.4	58%	0.575	63%	0.629	S	S	*	*	H	α-helix	trans	-67.5	-38.8	176.3	-85.5	172.9	-30.9	0	0	112.4	E7 V13 S14 D15	E7-Q11 WeakPolarHBondContact O-CB 3.48Å; E7-Q11 PolarHBondContact O-N 3.11Å; E7-Q11 PolarHBondContact O-OE1 3.11Å; Q11-V13 PolarHBondContact O-N 2.79Å; Q11-S14 WeakPolarHBondContact CA-OG 3.45Å; Q11-S14 PolarHBondContact O-N 3.03Å; Q11-S14 PolarHBondContact O-OG 2.91Å; Q11-D15 WeakPolarHBondContact O-CB 3.31Å; Q11-D15 PolarHBondContact O-N 3.5Å
12	S	62.3	Low	62.9	Low	55 Å²	55	98.5 Å²	98.5	39%	0.385	59%	0.594	S	S	.	*	H	α-helix	trans	-67.1	-37.9	178.2	65.9	0	0	0	0	112.9	S8 S9 D15 E16	S8-S12 PolarHBondContact O-N 3.19Å; S9-S12 PolarHBondContact O-OG 3.23Å; S9-S12 VanDerWaalsContact O-OG 3.11Å; S12-D15 PolarHBondContact O-N 3Å; S12-E16 WeakPolarHBondContact O-CG 3.45Å; S12-E16 PolarHBondContact O-N 3.39Å
13	V	69.2	Low	64.4	Low	74 Å²	74	97.4 Å²	97.4	45%	0.448	58%	0.578	S	S	.	*	H	α-helix	trans	-70.7	-37.5	177.2	176.2	0	0	0	0	110.9	S9 Q11 E16 L17	S9-V13 VanDerWaalsContact O-CG2 3.31Å; S9-V13 WeakPolarHBondContact O-CG2 3.22Å; Q11-V13 PolarHBondContact O-N 2.79Å; V13-E16 PolarHBondContact O-N 2.92Å; V13-L17 HydrophobicContact CG1-CD1 4.08Å; V13-L17 WeakPolarHBondContact O-CB 3.32Å; V13-L17 WeakPolarHBondContact O-CG 3.43Å; V13-L17 PolarHBondContact O-N 3.39Å
14	S	70.8	Confident	65	Low	58 Å²	58	98.1 Å²	98.1	41%	0.406	56%	0.563	S	S	.	*	H	α-helix	trans	-66.9	-36.2	173	55.1	0	0	0	0	112.7	S10 Q11 L17 F18	S10-S14 PolarHBondContact O-N 3.04Å; S10-S14 VanDerWaalsContact O-N 3.11Å; S10-S14 PolarHBondContact O-OG 3.24Å; Q11-S14 WeakPolarHBondContact CA-OG 3.45Å; Q11-S14 PolarHBondContact O-N 3.03Å; Q11-S14 PolarHBondContact O-OG 2.91Å; S14-L17 PolarHBondContact O-N 3.3Å; S14-F18 VanDerWaalsContact O-CB 3.28Å; S14-F18 WeakPolarHBondContact O-CB 3.44Å; S14-F18 PolarHBondContact O-N 3.49Å
15	D	66.8	Low	65.6	Low	102 Å²	102	95.3 Å²	95.3	55%	0.545	54%	0.535	S	S	.	.	H	α-helix	trans	-68	-39.9	176.6	-78.2	-16.5	0	0	0	111.5	Q11 S12 F18 Q19	Q11-D15 WeakPolarHBondContact O-CB 3.31Å; Q11-D15 PolarHBondContact O-N 3.5Å; S12-D15 PolarHBondContact O-N 3Å; D15-F18 PolarHBondContact O-N 2.87Å; D15-Q19 WeakPolarHBondContact O-CB 3.28Å; D15-Q19 VanDerWaalsContact O-CG 3.22Å; D15-Q19 WeakPolarHBondContact O-CG 3.22Å; D15-Q19 PolarHBondContact O-N 3.37Å
16	E	78.6	Confident	65.9	Low	127 Å²	127	97.7 Å²	97.7	59%	0.593	52%	0.524	S	S	*	.	H	α-helix	trans	-66.1	-41.7	174.3	-75.8	-177.9	175.1	0	0	112.7	S12 V13 F18 Q19 N20	S12-E16 WeakPolarHBondContact O-CG 3.45Å; S12-E16 PolarHBondContact O-N 3.39Å; V13-E16 PolarHBondContact O-N 2.92Å; E16-F18 VanDerWaalsContact C-N 3.31Å; E16-F18 PolarHBondContact O-N 2.93Å; E16-Q19 PolarHBondContact O-N 3.38Å; E16-N20 WeakPolarHBondContact O-CB 3.33Å; E16-N20 VanDerWaalsContact O-CG 3.24Å; E16-N20 PolarHBondContact O-N 2.96Å; E16-N20 PolarHBondContact O-ND2 2.99Å
17	L	74.6	Confident	66.6	Low	113 Å²	113	100.3 Å²	100.3	59%	0.592	52%	0.521	S	S	*	.	H	α-helix	trans	-64.2	-38.2	174.9	-71.4	170.3	0	0	0	111.7	V13 S14 F21	V13-L17 HydrophobicContact CG1-CD1 4.08Å; V13-L17 WeakPolarHBondContact O-CB 3.32Å; V13-L17 WeakPolarHBondContact O-CG 3.43Å; V13-L17 PolarHBondContact O-N 3.39Å; S14-L17 PolarHBondContact O-N 3.3Å; L17-F21 WeakPolarHBondContact O-CB 3.4Å; L17-F21 PolarHBondContact O-N 3.48Å
18	F	69.6	Low	66.7	Low	112 Å²	112	97 Å²	97	49%	0.491	51%	0.507	S	S	.	.	H	α-helix	trans	-68.7	-40.6	175.3	-173.8	-102.8	0	0	0	112	S14 D15 E16 F21 Y22	S14-F18 VanDerWaalsContact O-CB 3.28Å; S14-F18 WeakPolarHBondContact O-CB 3.44Å; S14-F18 PolarHBondContact O-N 3.49Å; D15-F18 PolarHBondContact O-N 2.87Å; E16-F18 VanDerWaalsContact C-N 3.31Å; E16-F18 PolarHBondContact O-N 2.93Å; F18-F21 PolarHBondContact O-N 3.35Å; F18-Y22 HydrophobicContact CE1-CD2 4.12Å; F18-Y22 HydrophobicContact CZ-CD2 4.07Å; F18-Y22 HydrophobicContact CZ-CE2 4.44Å; F18-Y22 WeakPolarHBondContact O-CB 3.37Å; F18-Y22 PolarHBondContact O-N 2.86Å
19	Q	74.3	Confident	66.7	Low	119 Å²	119	98.2 Å²	98.2	56%	0.556	50%	0.503	S	S	*	.	H	α-helix	trans	-65.8	-37.7	175.2	-71.1	-63.6	-20.6	0	0	112.6	D15 E16 Y22 T23	D15-Q19 WeakPolarHBondContact O-CB 3.28Å; D15-Q19 VanDerWaalsContact O-CG 3.22Å; D15-Q19 WeakPolarHBondContact O-CG 3.22Å; D15-Q19 PolarHBondContact O-N 3.37Å; E16-Q19 PolarHBondContact O-N 3.38Å; Q19-Y22 PolarHBondContact O-N 2.88Å; Q19-T23 PolarHBondContact O-N 3.04Å; Q19-T23 PolarHBondContact O-OG1 3.48Å
20	N	82.4	Confident	66.6	Low	103 Å²	103	102.3 Å²	102.3	55%	0.551	51%	0.511	S	S	*	.	H	α-helix	trans	-66.1	-43.1	173.6	-73.1	-22.2	0	0	0	111.8	E16 Y22 T23 E24	E16-N20 WeakPolarHBondContact O-CB 3.33Å; E16-N20 VanDerWaalsContact O-CG 3.24Å; E16-N20 PolarHBondContact O-N 2.96Å; E16-N20 PolarHBondContact O-ND2 2.99Å; N20-Y22 PolarHBondContact O-N 3.26Å; N20-T23 WeakPolarHBondContact CA-OG1 3.37Å; N20-T23 PolarHBondContact O-N 2.69Å; N20-T23 PolarHBondContact O-OG1 3.41Å; N20-E24 WeakPolarHBondContact O-CB 3.36Å; N20-E24 PolarHBondContact O-N 3.35Å
21	F	79.2	Confident	66.3	Low	123 Å²	123	107.2 Å²	107.2	54%	0.539	52%	0.518	S	S	.	.	H	α-helix	trans	-61.6	-42.6	172.8	176.8	-102	0	0	0	111.7	L17 F18 T23 E24 V25	L17-F21 WeakPolarHBondContact O-CB 3.4Å; L17-F21 PolarHBondContact O-N 3.48Å; F18-F21 PolarHBondContact O-N 3.35Å; F21-T23 VanDerWaalsContact C-N 3.32Å; F21-T23 PolarHBondContact O-N 3.09Å; F21-E24 PolarHBondContact O-N 3.49Å; F21-V25 HydrophobicContact CD1-CG2 4.32Å; F21-V25 HydrophobicContact CD2-CG2 4.41Å; F21-V25 HydrophobicContact CE1-CG2 3.92Å; F21-V25 HydrophobicContact CE2-CG2 4.02Å; F21-V25 HydrophobicContact CZ-CG2 3.76Å; F21-V25 WeakPolarHBondContact O-CG2 3.34Å; F21-V25 PolarHBondContact O-N 3.39Å
22	Y	65.6	Low	65.8	Low	125 Å²	125	106.3 Å²	106.3	49%	0.49	52%	0.517	S	S	.	.	H	α-helix	trans	-67.1	-32.1	179.6	-144.5	-86.3	0	0	0	112.7	F18 Q19 N20 K26	F18-Y22 HydrophobicContact CE1-CD2 4.12Å; F18-Y22 HydrophobicContact CZ-CD2 4.07Å; F18-Y22 HydrophobicContact CZ-CE2 4.44Å; F18-Y22 WeakPolarHBondContact O-CB 3.37Å; F18-Y22 PolarHBondContact O-N 2.86Å; Q19-Y22 PolarHBondContact O-N 2.88Å; N20-Y22 PolarHBondContact O-N 3.26Å; Y22-K26 WeakPolarHBondContact O-CB 3.43Å; Y22-K26 PolarHBondContact O-N 2.93Å; Y22-K26 VanDerWaalsContact O-N 3.09Å
23	T	75.4	Confident	65.4	Low	74 Å²	74	107.1 Å²	107.1	45%	0.454	52%	0.523	S	S	.	.	H	α-helix	trans	-75.9	-35.7	173.2	28.6	0	0	0	0	112.4	Q19 N20 F21 K26 Q27	Q19-T23 PolarHBondContact O-N 3.04Å; Q19-T23 PolarHBondContact O-OG1 3.48Å; N20-T23 WeakPolarHBondContact CA-OG1 3.37Å; N20-T23 PolarHBondContact O-N 2.69Å; N20-T23 PolarHBondContact O-OG1 3.41Å; F21-T23 VanDerWaalsContact C-N 3.32Å; F21-T23 PolarHBondContact O-N 3.09Å; T23-K26 PolarHBondContact O-N 2.95Å; T23-Q27 WeakPolarHBondContact O-CG 3.26Å; T23-Q27 PolarHBondContact O-N 3.2Å
24	E	67.2	Low	65	Low	119 Å²	119	108 Å²	108	56%	0.556	53%	0.528	S	S	*	.	H	α-helix	trans	-65.3	-42.9	173.6	-170.5	167.3	-163.3	0	0	111.8	N20 F21 Q27 I28	N20-E24 WeakPolarHBondContact O-CB 3.36Å; N20-E24 PolarHBondContact O-N 3.35Å; F21-E24 PolarHBondContact O-N 3.49Å; E24-Q27 PolarHBondContact O-N 2.98Å; E24-I28 HydrophobicContact CG-CD1 4.3Å; E24-I28 VanDerWaalsContact O-CG1 3.26Å; E24-I28 WeakPolarHBondContact O-CG1 3.36Å; E24-I28 PolarHBondContact O-N 3.46Å
25	V	64.1	Low	64.8	Low	47 Å²	47	107.8 Å²	107.8	29%	0.285	52%	0.523	S	S	.	.	H	α-helix	trans	-64.6	-44	173.4	172.6	0	0	0	0	111.5	F21 Q27 I28 E29	F21-V25 HydrophobicContact CD1-CG2 4.32Å; F21-V25 HydrophobicContact CD2-CG2 4.41Å; F21-V25 HydrophobicContact CE1-CG2 3.92Å; F21-V25 HydrophobicContact CE2-CG2 4.02Å; F21-V25 HydrophobicContact CZ-CG2 3.76Å; F21-V25 WeakPolarHBondContact O-CG2 3.34Å; F21-V25 PolarHBondContact O-N 3.39Å; V25-Q27 PolarHBondContact O-N 2.82Å; V25-I28 CarbonylContact O-C 3.55Å; V25-I28 WeakPolarHBondContact O-CA 3.18Å; V25-I28 WeakPolarHBondContact O-CB 3.09Å; V25-I28 PolarHBondContact O-N 3.03Å; V25-E29 PolarHBondContact O-N 3.29Å
26	K	58.2	Low	65.7	Low	128 Å²	128	106.2 Å²	106.2	56%	0.557	52%	0.517	S	S	*	.	H	α-helix	trans	-61.1	-31.2	173.2	-99.9	179.3	174.7	173.5	0	113	Y22 T23 K30	Y22-K26 WeakPolarHBondContact O-CB 3.43Å; Y22-K26 PolarHBondContact O-N 2.93Å; Y22-K26 VanDerWaalsContact O-N 3.09Å; T23-K26 PolarHBondContact O-N 2.95Å; K26-K30 WeakPolarHBondContact O-CB 3.44Å; K26-K30 PolarHBondContact O-N 2.98Å
27	Q	65.2	Low	66	Low	108 Å²	108	101.2 Å²	101.2	51%	0.505	50%	0.496	S	S	.	.	H	α-helix	trans	-75.3	-28.3	172.3	-73.8	-176	12.4	0	0	112.6	T23 E24 V25 R31	T23-Q27 WeakPolarHBondContact O-CG 3.26Å; T23-Q27 PolarHBondContact O-N 3.2Å; E24-Q27 PolarHBondContact O-N 2.98Å; V25-Q27 PolarHBondContact O-N 2.82Å; Q27-R31 WeakPolarHBondContact O-CB 3.43Å; Q27-R31 VanDerWaalsContact O-CD 3.26Å; Q27-R31 WeakPolarHBondContact O-CD 3.18Å; Q27-R31 WeakPolarHBondContact O-CG 3.26Å; Q27-R31 PolarHBondContact O-N 2.99Å
28	I	54.3	Low	66.6	Low	82 Å²	82	101.5 Å²	101.5	42%	0.421	49%	0.492	S	S	.	.	H	α-helix	trans	-72.2	-44.7	172.4	-67.3	162.4	0	0	0	110.2	E24 V25 K30 R31 D32	E24-I28 HydrophobicContact CG-CD1 4.3Å; E24-I28 VanDerWaalsContact O-CG1 3.26Å; E24-I28 WeakPolarHBondContact O-CG1 3.36Å; E24-I28 PolarHBondContact O-N 3.46Å; V25-I28 CarbonylContact O-C 3.55Å; V25-I28 WeakPolarHBondContact O-CA 3.18Å; V25-I28 WeakPolarHBondContact O-CB 3.09Å; V25-I28 PolarHBondContact O-N 3.03Å; I28-K30 VanDerWaalsContact C-N 3.35Å; I28-K30 PolarHBondContact O-N 3.3Å; I28-R31 CarbonylContact O-C 3.46Å; I28-R31 WeakPolarHBondContact O-CA 3.35Å; I28-R31 WeakPolarHBondContact O-CB 3.34Å; I28-R31 PolarHBondContact O-N 3.08Å; I28-D32 PolarHBondContact O-N 3.05Å
29	E	51.7	Low	67.6	Low	122 Å²	122	100.6 Å²	100.6	57%	0.57	49%	0.49	S	S	*	.	H	α-helix	trans	-67.6	-31.8	174.8	-72.5	-176.3	148.3	0	0	113.1	V25 R31 D32 S33	V25-E29 PolarHBondContact O-N 3.29Å; E29-R31 VanDerWaalsContact C-N 3.31Å; E29-D32 CarbonylContact O-C 3.48Å; E29-D32 WeakPolarHBondContact O-CB 3.4Å; E29-D32 PolarHBondContact O-N 3.43Å; E29-S33 PolarHBondContact O-N 3.27Å
30	K	55.9	Low	68.3	Low	164 Å²	164	95 Å²	95	71%	0.713	46%	0.463	S	S	*	.	H	α-helix	trans	-76.8	-19.1	172	-149.9	175.5	-170.9	-177.2	0	112.3	K26 I28 S33	K26-K30 WeakPolarHBondContact O-CB 3.44Å; K26-K30 PolarHBondContact O-N 2.98Å; I28-K30 VanDerWaalsContact C-N 3.35Å; I28-K30 PolarHBondContact O-N 3.3Å; K30-S33 WeakPolarHBondContact O-CB 3.4Å; K30-S33 PolarHBondContact O-N 3.22Å; K30-S33 PolarHBondContact O-OG 2.81Å
31	R	51.4	Low	68.8	Low	173 Å²	173	90.3 Å²	90.3	65%	0.653	44%	0.438	S	S	*	.	H	α-helix	trans	-80.8	-28.4	165.8	-75.4	164.6	-174.8	137.6	2.8	111.5	Q27 I28 E29 S33	Q27-R31 WeakPolarHBondContact O-CB 3.43Å; Q27-R31 VanDerWaalsContact O-CD 3.26Å; Q27-R31 WeakPolarHBondContact O-CD 3.18Å; Q27-R31 WeakPolarHBondContact O-CG 3.26Å; Q27-R31 PolarHBondContact O-N 2.99Å; I28-R31 CarbonylContact O-C 3.46Å; I28-R31 WeakPolarHBondContact O-CA 3.35Å; I28-R31 WeakPolarHBondContact O-CB 3.34Å; I28-R31 PolarHBondContact O-N 3.08Å; E29-R31 VanDerWaalsContact C-N 3.31Å; R31-S33 PolarHBondContact O-N 3.44Å
32	D	45.4	Very low	69.4	Low	104 Å²	104	88.1 Å²	88.1	56%	0.556	43%	0.432	S	S	*	.	S	Bend	trans	-70.1	-0.4	164.5	-67.5	-28.6	0	0	0	112.5	I28 E29 V34	I28-D32 PolarHBondContact O-N 3.05Å; E29-D32 CarbonylContact O-C 3.48Å; E29-D32 WeakPolarHBondContact O-CB 3.4Å; E29-D32 PolarHBondContact O-N 3.43Å; D32-V34 PolarHBondContact O-N 2.86Å
33	S	53.3	Low	70.6	Confident	73 Å²	73	83.9 Å²	83.9	51%	0.51	42%	0.415	S	S	.	.			trans	-88	27.4	-173.4	102.3	0	0	0	0	116.6	E29 K30 R31	E29-S33 PolarHBondContact O-N 3.27Å; K30-S33 WeakPolarHBondContact O-CB 3.4Å; K30-S33 PolarHBondContact O-N 3.22Å; K30-S33 PolarHBondContact O-OG 2.81Å; R31-S33 PolarHBondContact O-N 3.44Å
34	V	60.2	Low	71.4	Confident	91 Å²	91	80.4 Å²	80.4	55%	0.552	39%	0.394	S	S	*	.	S	Bend	trans	-127.5	77.7	155.7	-167.4	0	0	0	0	109.1	D32	D32-V34 PolarHBondContact O-N 2.86Å
35	L	66.9	Low	72.7	Confident	55 Å²	55	76.9 Å²	76.9	29%	0.288	38%	0.379	S	S	.	.			trans	71.3	117	172.5	-137.9	62.3	0	0	0	113.8	Q39 Q40 R43	L35-Q39 HydrophobicContact CB-CB 4.37Å; L35-Q39 HydrophobicContact CD1-CB 3.46Å; L35-Q39 VanDerWaalsContact CD1-CB 3.46Å; L35-Q39 HydrophobicContact CD1-CG 4.2Å; L35-Q39 HydrophobicContact CD2-CB 4.23Å; L35-Q39 WeakPolarHBondContact CD2-O 3.25Å; L35-Q39 HydrophobicContact CG-CB 3.34Å; L35-Q39 HydrophobicContact CG-CG 4.5Å; L35-Q40 HydrophobicContact CD2-CB 4.39Å; L35-R43 HydrophobicContact CD2-CB 3.82Å; L35-R43 HydrophobicContact CD2-CG 4.22Å
36	T	85.4	Confident	74	Confident	68 Å²	68	78.5 Å²	78.5	42%	0.417	38%	0.38	S	S	.	.			trans	-60.7	160.5	174.7	68.1	0	0	0	0	110.5	K38 Q39 Q40	T36-K38 PolarHBondContact O-N 3.19Å; T36-K38 VanDerWaalsContact O-N 3.11Å; T36-Q39 PolarHBondContact O-N 3.3Å; T36-Q39 VanDerWaalsContact OG1-CG 3.26Å; T36-Q39 WeakPolarHBondContact OG1-CG 3.26Å; T36-Q39 PolarHBondContact OG1-N 3.47Å; T36-Q39 PolarHBondContact OG1-OE1 3.48Å; T36-Q40 WeakPolarHBondContact O-CB 3.49Å; T36-Q40 PolarHBondContact O-N 2.87Å
37	S	85.6	Confident	75.4	Confident	22 Å²	22	78.5 Å²	78.5	15%	0.154	39%	0.393	C	S	.	.	H	α-helix	trans	-48.6	-43.7	176.9	-61.9	0	0	0	0	112.7	Q40 I41 L81 N87	S37-Q40 PolarHBondContact O-N 3.28Å; S37-I41 VanDerWaalsContact O-CG1 3.26Å; S37-I41 WeakPolarHBondContact O-CG1 3.35Å; S37-I41 PolarHBondContact O-N 3.25Å; S37-L81 WeakPolarHBondContact CB-O 3.35Å; S37-L81 PolarHBondContact OG-O 2.84Å; S37-L81 VanDerWaalsContact OG-O 3.05Å; S37-N87 WeakPolarHBondContact CB-OD1 3.5Å
38	K	87.6	Confident	76.2	Confident	120 Å²	120	75 Å²	75	52%	0.522	39%	0.386	S	S	.	.	H	α-helix	trans	-64.6	-48.5	177.4	-68.1	-174.9	177.9	-178.3	0	111.9	T36 Q40 I41 D42 D89	T36-K38 PolarHBondContact O-N 3.19Å; T36-K38 VanDerWaalsContact O-N 3.11Å; K38-Q40 VanDerWaalsContact C-N 3.26Å; K38-Q40 PolarHBondContact O-N 3.47Å; K38-I41 PolarHBondContact O-N 3.07Å; K38-D42 PolarHBondContact O-N 3.28Å; K38-D89 WeakPolarHBondContact CE-OD2 3.41Å; K38-D89 IonicContact NZ-OD2 3.76Å; K38-D89 PolarHBondContact NZ-OD2 2.93Å
39	Q	90.1	Very high	77.8	Confident	93 Å²	93	72.1 Å²	72.1	44%	0.435	37%	0.373	S	S	.	.	H	α-helix	trans	-64.2	-32.9	179.1	-68.5	170.3	-23.5	0	0	112	L35 T36 D42 R43	L35-Q39 HydrophobicContact CB-CB 4.37Å; L35-Q39 HydrophobicContact CD1-CB 3.46Å; L35-Q39 VanDerWaalsContact CD1-CB 3.46Å; L35-Q39 HydrophobicContact CD1-CG 4.2Å; L35-Q39 HydrophobicContact CD2-CB 4.23Å; L35-Q39 WeakPolarHBondContact CD2-O 3.25Å; L35-Q39 HydrophobicContact CG-CB 3.34Å; L35-Q39 HydrophobicContact CG-CG 4.5Å; T36-Q39 PolarHBondContact O-N 3.3Å; T36-Q39 VanDerWaalsContact OG1-CG 3.26Å; T36-Q39 WeakPolarHBondContact OG1-CG 3.26Å; T36-Q39 PolarHBondContact OG1-N 3.47Å; T36-Q39 PolarHBondContact OG1-OE1 3.48Å; Q39-D42 PolarHBondContact O-N 3.16Å; Q39-R43 WeakPolarHBondContact O-CB 3.35Å; Q39-R43 PolarHBondContact O-N 3.46Å
40	Q	90.1	Very high	79.3	Confident	0 Å²	0	70 Å²	70	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-69.6	-41.9	176.9	-177.9	60.7	23.8	0	0	111.9	L35 T36 S37 K38 R43 L44 L78 V82	L35-Q40 HydrophobicContact CD2-CB 4.39Å; T36-Q40 WeakPolarHBondContact O-CB 3.49Å; T36-Q40 PolarHBondContact O-N 2.87Å; S37-Q40 PolarHBondContact O-N 3.28Å; K38-Q40 VanDerWaalsContact C-N 3.26Å; K38-Q40 PolarHBondContact O-N 3.47Å; Q40-R43 PolarHBondContact O-N 3.03Å; Q40-L44 HydrophobicContact CG-CD1 4.43Å; Q40-L44 WeakPolarHBondContact O-CG 3.26Å; Q40-L44 PolarHBondContact O-N 3.01Å; Q40-L44 VanDerWaalsContact O-N 3.14Å; Q40-L78 HydrophobicContact CG-CD2 4.13Å; Q40-L78 VanDerWaalsContact NE2-CD2 3.33Å; Q40-V82 HydrophobicContact CB-CG1 4.26Å; Q40-V82 HydrophobicContact CG-CG1 3.49Å; Q40-V82 VanDerWaalsContact CG-CG1 3.49Å
41	I	91.5	Very high	80.7	Confident	5 Å²	5	68.4 Å²	68.4	3%	0.026	36%	0.362	C	S	.	.	H	α-helix	trans	-62.3	-46.4	171.6	-67.7	166.4	0	0	0	110	S37 K38 R43 L44 L45 V82 N87 R93 A94 A97	S37-I41 VanDerWaalsContact O-CG1 3.26Å; S37-I41 WeakPolarHBondContact O-CG1 3.35Å; S37-I41 PolarHBondContact O-N 3.25Å; K38-I41 PolarHBondContact O-N 3.07Å; I41-R43 VanDerWaalsContact C-N 3.35Å; I41-R43 PolarHBondContact O-N 3.03Å; I41-L44 PolarHBondContact O-N 3.02Å; I41-L45 HydrophobicContact CG2-CD1 3.85Å; I41-L45 HydrophobicContact CG2-CG 4.48Å; I41-L45 WeakPolarHBondContact O-CB 3.37Å; I41-L45 WeakPolarHBondContact O-CG 3.48Å; I41-L45 PolarHBondContact O-N 2.85Å; I41-V82 HydrophobicContact CG1-CB 4.31Å; I41-V82 HydrophobicContact CG1-CG1 4.16Å; I41-N87 HydrophobicContact CD1-CB 4.18Å; I41-R93 HydrophobicContact CG2-CB 3.77Å; I41-A94 HydrophobicContact CD1-CB 3.87Å; I41-A97 HydrophobicContact CB-CB 4.37Å; I41-A97 HydrophobicContact CG1-CB 4.02Å; I41-A97 HydrophobicContact CG2-CB 4.3Å
42	D	92.1	Very high	82.2	Confident	77 Å²	77	63.5 Å²	63.5	41%	0.412	35%	0.346	S	S	.	.	H	α-helix	trans	-59.3	-44.5	177.3	-73.6	-18.2	0	0	0	111.8	K38 Q39 L44 L45 R46 R93	K38-D42 PolarHBondContact O-N 3.28Å; Q39-D42 PolarHBondContact O-N 3.16Å; D42-L44 VanDerWaalsContact C-N 3.32Å; D42-L44 PolarHBondContact O-N 2.87Å; D42-L45 CarbonylContact O-C 3.24Å; D42-L45 PolarHBondContact O-N 2.87Å; D42-R46 WeakPolarHBondContact O-CA 3.45Å; D42-R46 WeakPolarHBondContact O-CB 3.49Å; D42-R46 PolarHBondContact O-N 3.05Å; D42-R93 IonicContact OD1-CZ 3.71Å; D42-R93 IonicContact OD1-NH1 2.59Å; D42-R93 IonicContact OD1-NH2 2.71Å; D42-R93 PolarHBondContact OD1-NH2 3.11Å
43	R	91.7	Very high	84.4	Confident	37 Å²	37	60 Å²	60	14%	0.14	33%	0.327	C	S	.	.	H	α-helix	trans	-58.8	-44.3	177.5	-173	-154	78.8	-179.2	14.8	111.9	L35 Q39 Q40 I41 R46 V59 Q61	L35-R43 HydrophobicContact CD2-CB 3.82Å; L35-R43 HydrophobicContact CD2-CG 4.22Å; Q39-R43 WeakPolarHBondContact O-CB 3.35Å; Q39-R43 PolarHBondContact O-N 3.46Å; Q40-R43 PolarHBondContact O-N 3.03Å; I41-R43 VanDerWaalsContact C-N 3.35Å; I41-R43 PolarHBondContact O-N 3.03Å; R43-R46 WeakPolarHBondContact O-CG 3.12Å; R43-R46 PolarHBondContact O-NH1 3.39Å; R43-V59 PolarHBondContact NH2-O 2.83Å; R43-Q61 VanDerWaalsContact NH1-CG 3.28Å
44	L	92.6	Very high	86.2	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-76.1	-25.8	-177.3	-73.2	171.4	0	0	0	113.3	Q40 I41 D42 S49 N53 V59 V82 A97 V100 V101	Q40-L44 HydrophobicContact CG-CD1 4.43Å; Q40-L44 WeakPolarHBondContact O-CG 3.26Å; Q40-L44 PolarHBondContact O-N 3.01Å; Q40-L44 VanDerWaalsContact O-N 3.14Å; I41-L44 PolarHBondContact O-N 3.02Å; D42-L44 VanDerWaalsContact C-N 3.32Å; D42-L44 PolarHBondContact O-N 2.87Å; L44-S49 WeakPolarHBondContact O-CB 3.12Å; L44-S49 PolarHBondContact O-OG 3.27Å; L44-N53 PolarHBondContact O-ND2 3.33Å; L44-V59 HydrophobicContact CD2-CG1 3.94Å; L44-V82 HydrophobicContact CD1-CG1 4.07Å; L44-A97 HydrophobicContact CB-CB 4.17Å; L44-A97 HydrophobicContact CD1-CB 3.9Å; L44-V100 HydrophobicContact CD2-CG1 3.87Å; L44-V101 HydrophobicContact CD1-CG2 3.63Å
45	L	93.3	Very high	87.8	Confident	46 Å²	46	54 Å²	54	24%	0.241	29%	0.286	C	S	.	.	H	α-helix	trans	-112.6	6.8	-176.2	-60.3	-175.7	0	0	0	114.4	I41 D42 R93 K96 A97	I41-L45 HydrophobicContact CG2-CD1 3.85Å; I41-L45 HydrophobicContact CG2-CG 4.48Å; I41-L45 WeakPolarHBondContact O-CB 3.37Å; I41-L45 WeakPolarHBondContact O-CG 3.48Å; I41-L45 PolarHBondContact O-N 2.85Å; D42-L45 CarbonylContact O-C 3.24Å; D42-L45 PolarHBondContact O-N 2.87Å; L45-R93 HydrophobicContact CD1-CB 3.64Å; L45-R93 HydrophobicContact CD1-CG 4.03Å; L45-R93 VanDerWaalsContact CD1-O 3.29Å; L45-R93 WeakPolarHBondContact CD1-O 3.49Å; L45-K96 HydrophobicContact CD1-CB 4.16Å; L45-K96 HydrophobicContact CD2-CB 3.88Å; L45-A97 HydrophobicContact CD1-CB 4.47Å; L45-A97 HydrophobicContact CG-CB 4.35Å
46	R	90.8	Very high	89.1	Confident	80 Å²	80	51.5 Å²	51.5	30%	0.302	27%	0.273	S	S	.	.	S	Bend	trans	-56.2	154.3	176.8	69.4	-176.3	-172.6	-101.9	13.4	111.6	D42 R43 G48 S49	D42-R46 WeakPolarHBondContact O-CA 3.45Å; D42-R46 WeakPolarHBondContact O-CB 3.49Å; D42-R46 PolarHBondContact O-N 3.05Å; R43-R46 WeakPolarHBondContact O-CG 3.12Å; R43-R46 PolarHBondContact O-NH1 3.39Å; R46-G48 PolarHBondContact O-N 3.45Å; R46-S49 WeakPolarHBondContact O-CB 3.42Å; R46-S49 PolarHBondContact O-N 2.66Å; R46-S49 PolarHBondContact O-OG 3.47Å
47	P	89	Confident	89.5	Confident	128 Å²	128	48.5 Å²	48.5	83%	0.831	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	132.5	168.6	-26.1	35.3	0	0	0	111.2	S49	P47-S49 VanDerWaalsContact C-N 3.29Å; P47-S49 PolarHBondContact O-N 3.49Å
48	G	81.7	Confident	89.8	Confident	35 Å²	35	51.1 Å²	51.1	36%	0.361	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	0.4	-174.8	0	0	0	0	0	115.2	R46 S50 Y51 F52	R46-G48 PolarHBondContact O-N 3.45Å; G48-S50 PolarHBondContact O-N 3.45Å; G48-S50 VanDerWaalsContact O-N 3.1Å; G48-Y51 PolarHBondContact O-N 3.45Å; G48-F52 VanDerWaalsContact O-CD2 3.25Å; G48-F52 WeakPolarHBondContact O-CD2 3.42Å; G48-F52 PolarHBondContact O-N 3.45Å
49	S	86.9	Confident	90.1	Very high	21 Å²	21	45.5 Å²	45.5	15%	0.147	24%	0.24	C	C	.	.	H	α-helix	trans	-53	-29.1	173.3	53.1	0	0	0	0	113.3	L44 R46 P47 Y51 F52 N53	L44-S49 WeakPolarHBondContact O-CB 3.12Å; L44-S49 PolarHBondContact O-OG 3.27Å; R46-S49 WeakPolarHBondContact O-CB 3.42Å; R46-S49 PolarHBondContact O-N 2.66Å; R46-S49 PolarHBondContact O-OG 3.47Å; P47-S49 VanDerWaalsContact C-N 3.29Å; P47-S49 PolarHBondContact O-N 3.49Å; S49-Y51 PolarHBondContact O-N 3.31Å; S49-Y51 VanDerWaalsContact O-N 3.13Å; S49-F52 PolarHBondContact O-N 3.08Å; S49-N53 WeakPolarHBondContact O-CB 3.21Å; S49-N53 PolarHBondContact O-N 3.19Å; S49-N53 PolarHBondContact O-ND2 2.73Å; S49-N53 PolarHBondContact O-OD1 2.86Å
50	S	84.7	Confident	90.2	Very high	79 Å²	79	41.1 Å²	41.1	55%	0.552	22%	0.219	S	C	*	.	H	α-helix	trans	-54.3	-31	174.1	57.4	0	0	0	0	113.9	G48 L54	G48-S50 PolarHBondContact O-N 3.45Å; G48-S50 VanDerWaalsContact O-N 3.1Å; S50-L54 VanDerWaalsContact O-CG 3.31Å; S50-L54 WeakPolarHBondContact O-CG 3.33Å
51	Y	84.5	Confident	90.2	Very high	130 Å²	130	44.6 Å²	44.6	51%	0.51	24%	0.235	S	C	.	.	H	α-helix	trans	-88.6	-42.9	177	-68.1	-77.2	0	0	0	111.8	G48 S49 N53 L54 A169	G48-Y51 PolarHBondContact O-N 3.45Å; S49-Y51 PolarHBondContact O-N 3.31Å; S49-Y51 VanDerWaalsContact O-N 3.13Å; Y51-N53 VanDerWaalsContact C-N 3.31Å; Y51-N53 PolarHBondContact O-N 3.46Å; Y51-L54 HydrophobicContact CD1-CD1 4.33Å; Y51-L54 WeakPolarHBondContact O-CB 3.42Å; Y51-L54 WeakPolarHBondContact O-CG 3.31Å; Y51-L54 PolarHBondContact O-N 2.92Å; Y51-A169 HydrophobicContact CD1-CB 3.75Å; Y51-A169 HydrophobicContact CE1-CB 4.23Å
52	F	83.9	Confident	90.3	Very high	70 Å²	70	45.3 Å²	45.3	31%	0.307	24%	0.239	S	C	.	.	H	α-helix	trans	-67.3	-32.7	180	-67.4	-72.9	0	0	0	112.8	G48 S49 L54 M165	G48-F52 VanDerWaalsContact O-CD2 3.25Å; G48-F52 WeakPolarHBondContact O-CD2 3.42Å; G48-F52 PolarHBondContact O-N 3.45Å; S49-F52 PolarHBondContact O-N 3.08Å; F52-L54 PolarHBondContact O-N 3.43Å; F52-M165 HydrophobicContact CD1-SD 4.27Å
53	N	90.8	Very high	90.2	Very high	31 Å²	31	46.2 Å²	46.2	17%	0.166	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-1	-180	-60.9	-13.9	0	0	0	112.8	L44 S49 Y51 N55 V59 V100	L44-N53 PolarHBondContact O-ND2 3.33Å; S49-N53 WeakPolarHBondContact O-CB 3.21Å; S49-N53 PolarHBondContact O-N 3.19Å; S49-N53 PolarHBondContact O-ND2 2.73Å; S49-N53 PolarHBondContact O-OD1 2.86Å; Y51-N53 VanDerWaalsContact C-N 3.31Å; Y51-N53 PolarHBondContact O-N 3.46Å; N53-N55 VanDerWaalsContact C-N 3.27Å; N53-V59 HydrophobicContact CB-CG2 3.89Å; N53-V100 HydrophobicContact CB-CG1 3.96Å
54	L	91.4	Very high	90.1	Very high	33 Å²	33	46.5 Å²	46.5	17%	0.173	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-30.2	173.9	-64.5	174.2	0	0	0	111.9	S50 Y51 F52 P56 F168 A169 E172	S50-L54 VanDerWaalsContact O-CG 3.31Å; S50-L54 WeakPolarHBondContact O-CG 3.33Å; Y51-L54 HydrophobicContact CD1-CD1 4.33Å; Y51-L54 WeakPolarHBondContact O-CB 3.42Å; Y51-L54 WeakPolarHBondContact O-CG 3.31Å; Y51-L54 PolarHBondContact O-N 2.92Å; F52-L54 PolarHBondContact O-N 3.43Å; L54-P56 VanDerWaalsContact O-CD 3.31Å; L54-P56 WeakPolarHBondContact O-CD 3.45Å; L54-F168 HydrophobicContact CB-CB 3.98Å; L54-F168 HydrophobicContact CB-CD1 4.49Å; L54-A169 HydrophobicContact CD1-CB 4.4Å; L54-E172 HydrophobicContact CD1-CB 3.72Å; L54-E172 HydrophobicContact CD1-CG 4.09Å; L54-E172 HydrophobicContact CD2-CB 3.98Å; L54-E172 HydrophobicContact CD2-CG 3.67Å
55	N	93.3	Very high	90	Very high	3 Å²	3	54.9 Å²	54.9	2%	0.016	29%	0.29	C	S	.	.	S	Bend	trans	-88.2	112.1	173.7	-174.5	-13.6	0	0	0	109.8	N53 F57 E58 V59 M165 F168	N53-N55 VanDerWaalsContact C-N 3.27Å; N55-F57 VanDerWaalsContact C-N 3.31Å; N55-F57 PolarHBondContact O-N 3.44Å; N55-F57 WeakPolarHBondContact OD1-CB 3.2Å; N55-F57 PolarHBondContact OD1-N 3.13Å; N55-E58 HydrophobicContact CB-CB 4.15Å; N55-E58 HydrophobicContact CB-CG 3.92Å; N55-E58 WeakPolarHBondContact ND2-CG 3.3Å; N55-E58 PolarHBondContact O-N 2.86Å; N55-V59 PolarHBondContact O-N 3.28Å; N55-M165 HydrophobicContact CB-CE 3.47Å; N55-M165 VanDerWaalsContact CB-CE 3.47Å; N55-M165 HydrophobicContact CB-SD 4.47Å; N55-M165 WeakPolarHBondContact ND2-CE 3.46Å; N55-F168 HydrophobicContact CB-CD2 4Å; N55-F168 HydrophobicContact CB-CE2 3.95Å; N55-F168 HydrophobicContact CB-CG 4.41Å; N55-F168 HydrophobicContact CB-CZ 4.3Å
56	P	93.9	Very high	89.9	Confident	4 Å²	4	53.3 Å²	53.3	3%	0.026	28%	0.284	C	S	.	.	H	α-helix	trans	-68.5	-26.5	-178.4	28.8	-36.3	0	0	0	113.9	L54 V59 L60 L108 A117	L54-P56 VanDerWaalsContact O-CD 3.31Å; L54-P56 WeakPolarHBondContact O-CD 3.45Å; P56-V59 PolarHBondContact O-N 2.88Å; P56-L60 PolarHBondContact O-N 2.97Å; P56-L60 VanDerWaalsContact O-N 3.12Å; P56-L108 HydrophobicContact CB-CD1 3.97Å; P56-L108 HydrophobicContact CB-CD2 4.12Å; P56-L108 HydrophobicContact CB-CG 3.81Å; P56-L108 HydrophobicContact CG-CD1 4.39Å; P56-L108 HydrophobicContact CG-CD2 3.69Å; P56-L108 HydrophobicContact CG-CG 3.97Å; P56-A117 HydrophobicContact CG-CB 4.16Å
57	F	93.5	Very high	90	Very high	4 Å²	4	53.1 Å²	53.1	2%	0.018	29%	0.291	C	S	.	.	H	α-helix	trans	-69.4	-37.7	177.8	-63.9	-86.6	0	0	0	111.4	N55 L60 Q61 I62 L108 K114 A117 V118 I121	N55-F57 VanDerWaalsContact C-N 3.31Å; N55-F57 PolarHBondContact O-N 3.44Å; N55-F57 WeakPolarHBondContact OD1-CB 3.2Å; N55-F57 PolarHBondContact OD1-N 3.13Å; F57-L60 CarbonylContact O-C 3.55Å; F57-L60 PolarHBondContact O-N 3.42Å; F57-Q61 WeakPolarHBondContact O-CA 3.38Å; F57-Q61 PolarHBondContact O-N 3.43Å; F57-I62 HydrophobicContact CB-CG1 4.33Å; F57-I62 HydrophobicContact CD1-CD1 3.86Å; F57-I62 HydrophobicContact CD1-CG1 3.89Å; F57-I62 HydrophobicContact CE1-CD1 4.38Å; F57-I62 PolarHBondContact O-N 3.39Å; F57-L108 HydrophobicContact CD1-CD1 4.19Å; F57-L108 HydrophobicContact CD1-CD2 4.4Å; F57-L108 HydrophobicContact CD2-CD2 4.12Å; F57-L108 HydrophobicContact CE1-CD1 4.21Å; F57-L108 HydrophobicContact CE1-CD2 3.85Å; F57-L108 HydrophobicContact CE2-CD2 3.55Å; F57-L108 HydrophobicContact CG-CD1 4.48Å; F57-L108 HydrophobicContact CZ-CD2 3.39Å; F57-K114 HydrophobicContact CZ-CG 4.3Å; F57-A117 HydrophobicContact CD2-CB 4.45Å; F57-A117 HydrophobicContact CE2-CB 3.79Å; F57-V118 HydrophobicContact CE2-CG2 4.02Å; F57-V118 HydrophobicContact CZ-CG2 3.63Å; F57-I121 HydrophobicContact CD2-CD1 3.5Å; F57-I121 HydrophobicContact CE2-CD1 3.9Å; F57-I121 HydrophobicContact CG-CD1 4.21Å
58	E	92	Very high	90.1	Very high	78 Å²	78	51.3 Å²	51.3	36%	0.364	28%	0.275	S	S	.	.	H	α-helix	trans	-68.2	-38.5	175.1	-67.9	-62.9	156.5	0	0	112.3	N55 L60 Q61 Y161 M165	N55-E58 HydrophobicContact CB-CB 4.15Å; N55-E58 HydrophobicContact CB-CG 3.92Å; N55-E58 WeakPolarHBondContact ND2-CG 3.3Å; N55-E58 PolarHBondContact O-N 2.86Å; E58-L60 VanDerWaalsContact C-N 3.32Å; E58-L60 PolarHBondContact O-N 3Å; E58-Q61 PolarHBondContact O-N 2.89Å; E58-Y161 VanDerWaalsContact CD-CE2 3.47Å; E58-Y161 HydrophobicContact CG-CE2 4.1Å; E58-Y161 WeakPolarHBondContact OE1-CE2 3.34Å; E58-Y161 WeakPolarHBondContact OE2-CE2 3.37Å; E58-M165 HydrophobicContact CG-CE 3.8Å
59	V	93.4	Very high	90.5	Very high	2 Å²	2	57.1 Å²	57.1	1%	0.012	29%	0.293	C	S	.	.	H	α-helix	trans	-61.7	-43.3	174.7	171.4	0	0	0	0	110.7	R43 L44 N53 N55 P56 Q61 V100 V101 S104	R43-V59 PolarHBondContact NH2-O 2.83Å; L44-V59 HydrophobicContact CD2-CG1 3.94Å; N53-V59 HydrophobicContact CB-CG2 3.89Å; N55-V59 PolarHBondContact O-N 3.28Å; P56-V59 PolarHBondContact O-N 2.88Å; V59-Q61 VanDerWaalsContact C-N 3.33Å; V59-V100 HydrophobicContact CG1-CG1 3.87Å; V59-V100 HydrophobicContact CG2-CG1 4.13Å; V59-V101 HydrophobicContact CG1-CG2 4.3Å; V59-S104 VanDerWaalsContact CB-OG 3.32Å; V59-S104 WeakPolarHBondContact CB-OG 3.48Å; V59-S104 VanDerWaalsContact CG1-OG 3.31Å; V59-S104 WeakPolarHBondContact CG1-OG 3.29Å; V59-S104 WeakPolarHBondContact CG2-OG 3.39Å
60	L	92.8	Very high	90.7	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-86.1	-5	-179	-63.3	-178.5	0	0	0	114	P56 F57 E58 I62 L71 L78 V101 L108	P56-L60 PolarHBondContact O-N 2.97Å; P56-L60 VanDerWaalsContact O-N 3.12Å; F57-L60 CarbonylContact O-C 3.55Å; F57-L60 PolarHBondContact O-N 3.42Å; E58-L60 VanDerWaalsContact C-N 3.32Å; E58-L60 PolarHBondContact O-N 3Å; L60-I62 VanDerWaalsContact C-N 3.31Å; L60-I62 HydrophobicContact CB-CD1 4.26Å; L60-I62 HydrophobicContact CB-CG1 3.99Å; L60-I62 HydrophobicContact CB-CG2 4.46Å; L60-I62 HydrophobicContact CD1-CD1 4.47Å; L60-I62 PolarHBondContact O-N 3.36Å; L60-L71 HydrophobicContact CD1-CD1 3.28Å; L60-L78 HydrophobicContact CD2-CD1 4.07Å; L60-V101 HydrophobicContact CD2-CG1 3.82Å; L60-L108 HydrophobicContact CD1-CD1 3.81Å
61	Q	90.9	Very high	91.1	Very high	73 Å²	73	57.4 Å²	57.4	34%	0.341	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	51.7	-175.1	-65.6	177.7	-46	0	0	112	R43 F57 E58 V59	R43-Q61 VanDerWaalsContact NH1-CG 3.28Å; F57-Q61 WeakPolarHBondContact O-CA 3.38Å; F57-Q61 PolarHBondContact O-N 3.43Å; E58-Q61 PolarHBondContact O-N 2.89Å; V59-Q61 VanDerWaalsContact C-N 3.33Å
62	I	92.6	Very high	91.4	Very high	21 Å²	21	55.9 Å²	55.9	11%	0.108	28%	0.279	C	S	.	.			trans	-122.6	153.8	176.5	55.2	169.4	0	0	0	110.5	F57 L60 A66 L71 R74 L108	F57-I62 HydrophobicContact CB-CG1 4.33Å; F57-I62 HydrophobicContact CD1-CD1 3.86Å; F57-I62 HydrophobicContact CD1-CG1 3.89Å; F57-I62 HydrophobicContact CE1-CD1 4.38Å; F57-I62 PolarHBondContact O-N 3.39Å; L60-I62 VanDerWaalsContact C-N 3.31Å; L60-I62 HydrophobicContact CB-CD1 4.26Å; L60-I62 HydrophobicContact CB-CG1 3.99Å; L60-I62 HydrophobicContact CB-CG2 4.46Å; L60-I62 HydrophobicContact CD1-CD1 4.47Å; L60-I62 PolarHBondContact O-N 3.36Å; I62-A66 HydrophobicContact CB-CB 4.13Å; I62-L71 HydrophobicContact CD1-CB 4.37Å; I62-L71 HydrophobicContact CD1-CD1 3.6Å; I62-R74 HydrophobicContact CG2-CB 3.7Å; I62-R74 HydrophobicContact CG2-CG 3.48Å; I62-R74 VanDerWaalsContact CG2-CG 3.48Å; I62-L108 HydrophobicContact CD1-CD1 3.94Å
63	D	91.1	Very high	91.7	Very high	95 Å²	95	60 Å²	60	51%	0.508	30%	0.297	S	S	.	.			trans	-69.3	144.8	173	-163	-78.6	0	0	0	110.3	E65 A66	D63-E65 PolarHBondContact O-N 3.43Å; D63-E65 WeakPolarHBondContact OD1-CB 3.37Å; D63-E65 PolarHBondContact OD1-N 2.83Å; D63-A66 HydrophobicContact CB-CB 4.31Å; D63-A66 WeakPolarHBondContact O-CB 3.48Å; D63-A66 PolarHBondContact O-N 3.2Å
64	P	90.1	Very high	91.7	Very high	43 Å²	43	64.3 Å²	64.3	28%	0.279	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-27.5	171.5	-25.6	35.5	0	0	0	114.1	A66 I121	P64-A66 VanDerWaalsContact C-N 3.35Å; P64-I121 HydrophobicContact CB-CD1 4.05Å; P64-I121 HydrophobicContact CB-CG2 4.42Å; P64-I121 HydrophobicContact CG-CD1 3.78Å; P64-I121 HydrophobicContact CG-CG2 3.96Å
65	E	89.6	Confident	91.8	Very high	176 Å²	176	64.4 Å²	64.4	82%	0.822	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	2.5	176.5	-56.9	-170.6	151.6	0	0	113.1	D63	D63-E65 PolarHBondContact O-N 3.43Å; D63-E65 WeakPolarHBondContact OD1-CB 3.37Å; D63-E65 PolarHBondContact OD1-N 2.83Å
66	A	90.4	Very high	91.6	Very high	14 Å²	14	72.5 Å²	72.5	12%	0.116	34%	0.34	C	S	.	.			trans	-63.5	147.1	-178.6	0	0	0	0	0	112.8	I62 D63 P64 E70	I62-A66 HydrophobicContact CB-CB 4.13Å; D63-A66 HydrophobicContact CB-CB 4.31Å; D63-A66 WeakPolarHBondContact O-CB 3.48Å; D63-A66 PolarHBondContact O-N 3.2Å; P64-A66 VanDerWaalsContact C-N 3.35Å; A66-E70 WeakPolarHBondContact CA-OE2 3.29Å; A66-E70 HydrophobicContact CB-CB 4.32Å; A66-E70 WeakPolarHBondContact CB-OE2 3.44Å
67	T	92.9	Very high	91.3	Very high	75 Å²	75	74.7 Å²	74.7	46%	0.46	36%	0.358	S	S	.	.			trans	-73.9	159.2	179.5	61.5	0	0	0	0	112.1	E69 E70 L71	T67-E69 PolarHBondContact O-N 3.38Å; T67-E70 PolarHBondContact N-OE2 3.06Å; T67-E70 PolarHBondContact O-N 3.36Å; T67-E70 VanDerWaalsContact O-N 3.14Å; T67-E70 WeakPolarHBondContact OG1-CG 3.24Å; T67-E70 PolarHBondContact OG1-N 3.43Å; T67-E70 PolarHBondContact OG1-OE2 3.14Å; T67-E70 VanDerWaalsContact OG1-OE2 3.12Å; T67-L71 PolarHBondContact O-N 2.61Å
68	D	91.5	Very high	91.2	Very high	90 Å²	90	74.9 Å²	74.9	48%	0.481	36%	0.36	S	S	.	.	H	α-helix	trans	-64.3	-23.8	177	-64.9	-22.1	0	0	0	112.6	K72 K114	D68-K72 WeakPolarHBondContact O-CG 3.25Å; D68-K72 PolarHBondContact O-N 3.04Å; D68-K72 VanDerWaalsContact O-N 3.14Å; D68-K114 IonicContact OD1-NZ 3.58Å; D68-K114 PolarHBondContact OD1-NZ 3.26Å
69	E	90.9	Very high	91.1	Very high	158 Å²	158	71.9 Å²	71.9	74%	0.738	35%	0.347	S	S	*	.	H	α-helix	trans	-69.3	-44.8	173.3	-62.8	-172.4	175.6	0	0	111.5	T67 L71 K72 K73	T67-E69 PolarHBondContact O-N 3.38Å; E69-L71 VanDerWaalsContact C-N 3.34Å; E69-K72 PolarHBondContact O-N 2.93Å; E69-K73 WeakPolarHBondContact O-CB 3.12Å; E69-K73 PolarHBondContact O-N 3.14Å
70	E	90.9	Very high	90.9	Very high	98 Å²	98	76.6 Å²	76.6	46%	0.458	37%	0.371	S	S	.	.	H	α-helix	trans	-64	-40.8	175.4	-72.3	170.9	139.2	0	0	111.5	A66 T67 K72 K73 R74	A66-E70 WeakPolarHBondContact CA-OE2 3.29Å; A66-E70 HydrophobicContact CB-CB 4.32Å; A66-E70 WeakPolarHBondContact CB-OE2 3.44Å; T67-E70 PolarHBondContact N-OE2 3.06Å; T67-E70 PolarHBondContact O-N 3.36Å; T67-E70 VanDerWaalsContact O-N 3.14Å; T67-E70 WeakPolarHBondContact OG1-CG 3.24Å; T67-E70 PolarHBondContact OG1-N 3.43Å; T67-E70 PolarHBondContact OG1-OE2 3.14Å; T67-E70 VanDerWaalsContact OG1-OE2 3.12Å; E70-K72 PolarHBondContact O-N 3.24Å; E70-K73 PolarHBondContact O-N 3.39Å; E70-R74 VanDerWaalsContact O-CB 3.3Å; E70-R74 WeakPolarHBondContact O-CB 3.47Å; E70-R74 WeakPolarHBondContact O-CG 3.38Å; E70-R74 PolarHBondContact O-N 3.45Å
71	L	92.9	Very high	90.6	Very high	7 Å²	7	78.5 Å²	78.5	4%	0.037	38%	0.381	C	S	.	.	H	α-helix	trans	-54.2	-51.4	173	173.4	63.4	0	0	0	111.2	L60 I62 T67 E69 R74 F75 Y105 L108	L60-L71 HydrophobicContact CD1-CD1 3.28Å; I62-L71 HydrophobicContact CD1-CB 4.37Å; I62-L71 HydrophobicContact CD1-CD1 3.6Å; T67-L71 PolarHBondContact O-N 2.61Å; E69-L71 VanDerWaalsContact C-N 3.34Å; L71-R74 PolarHBondContact O-N 2.88Å; L71-F75 WeakPolarHBondContact O-CB 3.46Å; L71-F75 PolarHBondContact O-N 3.04Å; L71-Y105 HydrophobicContact CD1-CD2 4.05Å; L71-Y105 HydrophobicContact CD2-CD2 4.46Å; L71-Y105 HydrophobicContact CD2-CE2 4.35Å; L71-Y105 HydrophobicContact CG-CD2 4.01Å; L71-Y105 HydrophobicContact CG-CE2 4Å; L71-L108 HydrophobicContact CD1-CB 4.1Å; L71-L108 HydrophobicContact CD1-CD1 3.69Å; L71-L108 HydrophobicContact CD2-CB 3.85Å
72	K	91	Very high	90.7	Very high	98 Å²	98	75 Å²	75	43%	0.426	37%	0.365	S	S	.	.	H	α-helix	trans	-63.4	-42.5	178.4	-73.3	171.8	-174.9	171.7	0	112.2	D68 E69 E70 R76 Y105	D68-K72 WeakPolarHBondContact O-CG 3.25Å; D68-K72 PolarHBondContact O-N 3.04Å; D68-K72 VanDerWaalsContact O-N 3.14Å; E69-K72 PolarHBondContact O-N 2.93Å; E70-K72 PolarHBondContact O-N 3.24Å; K72-R76 VanDerWaalsContact O-CG 3.31Å; K72-R76 WeakPolarHBondContact O-CG 3.33Å; K72-R76 PolarHBondContact O-N 3.42Å; K72-Y105 HydrophobicContact CG-CE2 4.26Å
73	K	90	Very high	90.6	Very high	158 Å²	158	77.1 Å²	77.1	69%	0.687	37%	0.374	S	S	*	.	H	α-helix	trans	-61.7	-44.8	179.2	-176.3	177.7	179.2	179.8	0	111.2	E69 E70 R76 A77	E69-K73 WeakPolarHBondContact O-CB 3.12Å; E69-K73 PolarHBondContact O-N 3.14Å; E70-K73 PolarHBondContact O-N 3.39Å; K73-R76 PolarHBondContact O-N 3.27Å; K73-A77 PolarHBondContact O-N 3.37Å; K73-A77 VanDerWaalsContact O-N 3.08Å
74	R	91.3	Very high	90.7	Very high	120 Å²	120	73.7 Å²	73.7	45%	0.453	36%	0.357	S	S	.	.	H	α-helix	trans	-70.3	-41.8	-179.1	-71.2	-85	-174.4	-165.3	5.3	112	I62 E70 L71 R76 A77 L78	I62-R74 HydrophobicContact CG2-CB 3.7Å; I62-R74 HydrophobicContact CG2-CG 3.48Å; I62-R74 VanDerWaalsContact CG2-CG 3.48Å; E70-R74 VanDerWaalsContact O-CB 3.3Å; E70-R74 WeakPolarHBondContact O-CB 3.47Å; E70-R74 WeakPolarHBondContact O-CG 3.38Å; E70-R74 PolarHBondContact O-N 3.45Å; L71-R74 PolarHBondContact O-N 2.88Å; R74-R76 PolarHBondContact O-N 3.32Å; R74-A77 PolarHBondContact O-N 3.14Å; R74-L78 WeakPolarHBondContact O-CB 3.37Å; R74-L78 WeakPolarHBondContact O-CG 3.25Å; R74-L78 PolarHBondContact O-N 3.21Å
75	F	92.7	Very high	90.7	Very high	35 Å²	35	77.2 Å²	77.2	15%	0.154	37%	0.373	C	S	.	.	H	α-helix	trans	-56.4	-48.1	172.3	171.5	-108.6	0	0	0	112	L71 A77 L78 S79 V101 D102 Y105	L71-F75 WeakPolarHBondContact O-CB 3.46Å; L71-F75 PolarHBondContact O-N 3.04Å; F75-A77 PolarHBondContact O-N 3.21Å; F75-L78 PolarHBondContact O-N 2.81Å; F75-S79 VanDerWaalsContact CE2-OG 3.28Å; F75-S79 WeakPolarHBondContact CE2-OG 3.36Å; F75-S79 WeakPolarHBondContact CZ-OG 3.35Å; F75-S79 WeakPolarHBondContact O-CB 3.43Å; F75-S79 PolarHBondContact O-N 3.06Å; F75-S79 PolarHBondContact O-OG 2.93Å; F75-V101 HydrophobicContact CD2-CG1 3.77Å; F75-V101 HydrophobicContact CE2-CG1 4.01Å; F75-D102 HydrophobicContact CE2-CB 4.47Å; F75-Y105 HydrophobicContact CB-CD2 3.63Å; F75-Y105 HydrophobicContact CB-CE2 4.07Å; F75-Y105 HydrophobicContact CB-CG 4.11Å; F75-Y105 HydrophobicContact CD1-CD1 4.09Å; F75-Y105 HydrophobicContact CD1-CD2 4.15Å; F75-Y105 HydrophobicContact CD1-CE1 4.19Å; F75-Y105 HydrophobicContact CD1-CE2 4.23Å; F75-Y105 HydrophobicContact CD1-CG 4.08Å; F75-Y105 VanDerWaalsContact CD2-CB 3.44Å; F75-Y105 HydrophobicContact CD2-CD1 4.12Å; F75-Y105 HydrophobicContact CD2-CD2 4.05Å; F75-Y105 AromaticContact CD2-CG 3.61Å; F75-Y105 HydrophobicContact CD2-CG 3.61Å; F75-Y105 HydrophobicContact CE1-CD1 4.08Å; F75-Y105 HydrophobicContact CE1-CE1 4.23Å; F75-Y105 HydrophobicContact CE1-CG 4.44Å; F75-Y105 HydrophobicContact CE2-CD1 4.11Å; F75-Y105 HydrophobicContact CE2-CG 4.02Å; F75-Y105 HydrophobicContact CG-CD1 4.1Å; F75-Y105 AromaticContact CG-CD2 3.66Å; F75-Y105 HydrophobicContact CG-CD2 3.66Å; F75-Y105 HydrophobicContact CG-CE2 4.15Å; F75-Y105 AromaticContact CG-CG 3.63Å; F75-Y105 HydrophobicContact CG-CG 3.63Å; F75-Y105 HydrophobicContact CZ-CD1 4.09Å; F75-Y105 HydrophobicContact CZ-CG 4.41Å
76	R	88.7	Confident	90.4	Very high	174 Å²	174	74.8 Å²	74.8	66%	0.657	36%	0.36	S	S	*	.	H	α-helix	trans	-60.6	-46.2	177.9	-71.7	173.9	-174.2	-178.6	2	112.1	K72 K73 R74 S79 I80	K72-R76 VanDerWaalsContact O-CG 3.31Å; K72-R76 WeakPolarHBondContact O-CG 3.33Å; K72-R76 PolarHBondContact O-N 3.42Å; K73-R76 PolarHBondContact O-N 3.27Å; R74-R76 PolarHBondContact O-N 3.32Å; R76-S79 PolarHBondContact O-N 3.14Å; R76-I80 WeakPolarHBondContact O-CG1 3.43Å; R76-I80 PolarHBondContact O-N 3.46Å
77	A	88.9	Confident	90.3	Very high	49 Å²	49	74.8 Å²	74.8	41%	0.405	36%	0.358	S	S	.	.	H	α-helix	trans	-61.2	-49.1	179.3	0	0	0	0	0	111.8	K73 R74 F75 I80 L81	K73-A77 PolarHBondContact O-N 3.37Å; K73-A77 VanDerWaalsContact O-N 3.08Å; R74-A77 PolarHBondContact O-N 3.14Å; F75-A77 PolarHBondContact O-N 3.21Å; A77-I80 PolarHBondContact O-N 3.12Å; A77-L81 WeakPolarHBondContact O-CG 3.5Å; A77-L81 PolarHBondContact O-N 2.92Å
78	L	91.1	Very high	90.2	Very high	9 Å²	9	78.7 Å²	78.7	5%	0.047	37%	0.371	C	S	.	.	H	α-helix	trans	-65.8	-41.1	179.3	-73.2	179.5	0	0	0	112.2	Q40 L60 R74 F75 I80 L81 V82 V101	Q40-L78 HydrophobicContact CG-CD2 4.13Å; Q40-L78 VanDerWaalsContact NE2-CD2 3.33Å; L60-L78 HydrophobicContact CD2-CD1 4.07Å; R74-L78 WeakPolarHBondContact O-CB 3.37Å; R74-L78 WeakPolarHBondContact O-CG 3.25Å; R74-L78 PolarHBondContact O-N 3.21Å; F75-L78 PolarHBondContact O-N 2.81Å; L78-I80 VanDerWaalsContact C-N 3.3Å; L78-I80 PolarHBondContact O-N 3Å; L78-L81 HydrophobicContact CD2-CD1 4.39Å; L78-L81 WeakPolarHBondContact O-CB 3.28Å; L78-L81 PolarHBondContact O-N 2.93Å; L78-L81 VanDerWaalsContact O-N 3.07Å; L78-V82 WeakPolarHBondContact O-CG2 3.43Å; L78-V82 PolarHBondContact O-N 3.29Å; L78-V101 HydrophobicContact CB-CG1 4.03Å; L78-V101 HydrophobicContact CB-CG2 4.42Å
79	S	89.5	Confident	90.1	Very high	14 Å²	14	80.6 Å²	80.6	10%	0.098	38%	0.382	C	S	.	.	H	α-helix	trans	-56.4	-44.1	177.8	-66.8	0	0	0	0	111.9	F75 R76 L81 V82 H83	F75-S79 VanDerWaalsContact CE2-OG 3.28Å; F75-S79 WeakPolarHBondContact CE2-OG 3.36Å; F75-S79 WeakPolarHBondContact CZ-OG 3.35Å; F75-S79 WeakPolarHBondContact O-CB 3.43Å; F75-S79 PolarHBondContact O-N 3.06Å; F75-S79 PolarHBondContact O-OG 2.93Å; R76-S79 PolarHBondContact O-N 3.14Å; S79-L81 VanDerWaalsContact C-N 3.32Å; S79-L81 PolarHBondContact O-N 2.99Å; S79-V82 PolarHBondContact O-N 3.11Å; S79-H83 WeakPolarHBondContact O-CB 3.06Å; S79-H83 PolarHBondContact O-N 2.89Å
80	I	88.3	Confident	90.1	Very high	102 Å²	102	75.7 Å²	75.7	52%	0.523	36%	0.36	S	S	.	.	H	α-helix	trans	-65.3	-37.6	177.6	-66.8	164.9	0	0	0	111.2	R76 A77 L78 K86	R76-I80 WeakPolarHBondContact O-CG1 3.43Å; R76-I80 PolarHBondContact O-N 3.46Å; A77-I80 PolarHBondContact O-N 3.12Å; L78-I80 VanDerWaalsContact C-N 3.3Å; L78-I80 PolarHBondContact O-N 3Å; I80-K86 HydrophobicContact CG2-CD 4.22Å; I80-K86 WeakPolarHBondContact O-CD 3.42Å
81	L	87.9	Confident	90.2	Very high	40 Å²	40	74 Å²	74	21%	0.209	36%	0.358	C	S	.	.	H	α-helix	trans	-67.9	-38.8	179.4	-69.9	172.7	0	0	0	112.1	S37 A77 L78 S79 N87	S37-L81 WeakPolarHBondContact CB-O 3.35Å; S37-L81 PolarHBondContact OG-O 2.84Å; S37-L81 VanDerWaalsContact OG-O 3.05Å; A77-L81 WeakPolarHBondContact O-CG 3.5Å; A77-L81 PolarHBondContact O-N 2.92Å; L78-L81 HydrophobicContact CD2-CD1 4.39Å; L78-L81 WeakPolarHBondContact O-CB 3.28Å; L78-L81 PolarHBondContact O-N 2.93Å; L78-L81 VanDerWaalsContact O-N 3.07Å; S79-L81 VanDerWaalsContact C-N 3.32Å; S79-L81 PolarHBondContact O-N 2.99Å; L81-N87 PolarHBondContact O-ND2 3.41Å
82	V	92.3	Very high	90.3	Very high	0 Å²	0	80.4 Å²	80.4	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-99.1	3.9	-176.3	-53.4	0	0	0	0	114.2	Q40 I41 L44 L78 S79 A94 A97 F98 V101	Q40-V82 HydrophobicContact CB-CG1 4.26Å; Q40-V82 HydrophobicContact CG-CG1 3.49Å; Q40-V82 VanDerWaalsContact CG-CG1 3.49Å; I41-V82 HydrophobicContact CG1-CB 4.31Å; I41-V82 HydrophobicContact CG1-CG1 4.16Å; L44-V82 HydrophobicContact CD1-CG1 4.07Å; L78-V82 WeakPolarHBondContact O-CG2 3.43Å; L78-V82 PolarHBondContact O-N 3.29Å; S79-V82 PolarHBondContact O-N 3.11Å; V82-A94 CarbonylContact O-C 3.58Å; V82-A94 WeakPolarHBondContact O-CA 3.33Å; V82-A94 WeakPolarHBondContact O-CB 3.41Å; V82-A97 HydrophobicContact CB-CB 4.06Å; V82-A97 HydrophobicContact CG1-CB 4.2Å; V82-F98 HydrophobicContact CG2-CB 3.86Å; V82-F98 HydrophobicContact CG2-CD2 4.1Å; V82-F98 HydrophobicContact CG2-CG 4.5Å; V82-V101 HydrophobicContact CG2-CG2 4.29Å
83	H	90.8	Very high	90.5	Very high	65 Å²	65	79.9 Å²	79.9	30%	0.301	38%	0.383	S	S	.	.			trans	-64.7	137.3	-177.6	-160.9	-88.3	0	0	0	111.9	S79 D85 K86 N87	S79-H83 WeakPolarHBondContact O-CB 3.06Å; S79-H83 PolarHBondContact O-N 2.89Å; H83-D85 IonicContact CE1-OD1 2.65Å; H83-D85 PolarHBondContact CE1-OD1 3.07Å; H83-D85 IonicContact CE1-OD2 2.98Å; H83-D85 PolarHBondContact CE1-OD2 3.13Å; H83-D85 WeakPolarHBondContact ND1-CB 3.45Å; H83-D85 PolarHBondContact ND1-N 3.48Å; H83-D85 VanDerWaalsContact ND1-N 3.13Å; H83-D85 IonicContact ND1-OD1 2.64Å; H83-D85 IonicContact ND1-OD2 3.53Å; H83-D85 PolarHBondContact O-N 3.12Å; H83-K86 PolarHBondContact O-N 3.35Å; H83-N87 PolarHBondContact O-N 3.32Å; H83-N87 PolarHBondContact O-ND2 3.47Å
84	P	92.6	Very high	90.6	Very high	23 Å²	23	72.4 Å²	72.4	15%	0.149	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-59.6	-40.1	179	23.3	-34.6	0	0	0	113.2	K86 N87 Q88 P91 A94	P84-K86 PolarHBondContact O-N 2.94Å; P84-N87 CarbonylContact O-C 3.6Å; P84-N87 VanDerWaalsContact O-C 3.24Å; P84-N87 PolarHBondContact O-N 3.38Å; P84-Q88 PolarHBondContact O-N 3.46Å; P84-P91 HydrophobicContact CB-CB 4.29Å; P84-A94 HydrophobicContact CB-CB 4.37Å
85	D	89.5	Confident	90.8	Very high	116 Å²	116	70.1 Å²	70.1	62%	0.62	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-60	-30.5	179.5	-62.4	10.3	0	0	0	114.2	H83 Q88	H83-D85 IonicContact CE1-OD1 2.65Å; H83-D85 PolarHBondContact CE1-OD1 3.07Å; H83-D85 IonicContact CE1-OD2 2.98Å; H83-D85 PolarHBondContact CE1-OD2 3.13Å; H83-D85 WeakPolarHBondContact ND1-CB 3.45Å; H83-D85 PolarHBondContact ND1-N 3.48Å; H83-D85 VanDerWaalsContact ND1-N 3.13Å; H83-D85 IonicContact ND1-OD1 2.64Å; H83-D85 IonicContact ND1-OD2 3.53Å; H83-D85 PolarHBondContact O-N 3.12Å; D85-Q88 VanDerWaalsContact O-CG 3.25Å; D85-Q88 WeakPolarHBondContact O-CG 3.43Å; D85-Q88 PolarHBondContact O-NE2 3.46Å; D85-Q88 VanDerWaalsContact O-NE2 3.08Å
86	K	84.1	Confident	91	Very high	126 Å²	126	73.7 Å²	73.7	55%	0.548	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-87.5	-18.8	178.7	-159.8	-176.5	179.6	-160.8	0	112	I80 H83 P84	I80-K86 HydrophobicContact CG2-CD 4.22Å; I80-K86 WeakPolarHBondContact O-CD 3.42Å; H83-K86 PolarHBondContact O-N 3.35Å; P84-K86 PolarHBondContact O-N 2.94Å
87	N	89.4	Confident	91.3	Very high	14 Å²	14	65.4 Å²	65.4	8%	0.075	33%	0.329	C	S	.	.			trans	-117.1	55.3	-176.8	-63.5	-74.1	0	0	0	110.2	S37 I41 L81 H83 P84 D89 D90 A94	S37-N87 WeakPolarHBondContact CB-OD1 3.5Å; I41-N87 HydrophobicContact CD1-CB 4.18Å; L81-N87 PolarHBondContact O-ND2 3.41Å; H83-N87 PolarHBondContact O-N 3.32Å; H83-N87 PolarHBondContact O-ND2 3.47Å; P84-N87 CarbonylContact O-C 3.6Å; P84-N87 VanDerWaalsContact O-C 3.24Å; P84-N87 PolarHBondContact O-N 3.38Å; N87-D89 PolarHBondContact O-N 3.3Å; N87-D89 VanDerWaalsContact O-N 3.16Å; N87-D90 CarbonylContact O-C 3.28Å; N87-D90 VanDerWaalsContact O-C 3.28Å; N87-D90 PolarHBondContact O-N 3.23Å; N87-A94 HydrophobicContact CB-CB 3.72Å
88	Q	89.3	Confident	91.6	Very high	157 Å²	157	65.3 Å²	65.3	73%	0.734	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-20.7	-176.4	-59.6	-178.7	6.4	0	0	113.3	P84 D85 D90 P91	P84-Q88 PolarHBondContact O-N 3.46Å; D85-Q88 VanDerWaalsContact O-CG 3.25Å; D85-Q88 WeakPolarHBondContact O-CG 3.43Å; D85-Q88 PolarHBondContact O-NE2 3.46Å; D85-Q88 VanDerWaalsContact O-NE2 3.08Å; Q88-D90 VanDerWaalsContact C-N 3.28Å; Q88-D90 PolarHBondContact O-N 3.14Å; Q88-P91 WeakPolarHBondContact O-CD 3.44Å
89	D	90.5	Very high	91.8	Very high	130 Å²	130	69.8 Å²	69.8	70%	0.695	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-32.1	173.3	-61.1	-18.3	0	0	0	112.5	K38 N87	K38-D89 WeakPolarHBondContact CE-OD2 3.41Å; K38-D89 IonicContact NZ-OD2 3.76Å; K38-D89 PolarHBondContact NZ-OD2 2.93Å; N87-D89 PolarHBondContact O-N 3.3Å; N87-D89 VanDerWaalsContact O-N 3.16Å
90	D	91.5	Very high	92.1	Very high	54 Å²	54	70.5 Å²	70.5	29%	0.289	34%	0.344	S	S	.	.	S	Bend	trans	-149.8	64.7	-173.5	-167.4	-5.4	0	0	0	111.3	N87 Q88 E92 R93 A94	N87-D90 CarbonylContact O-C 3.28Å; N87-D90 VanDerWaalsContact O-C 3.28Å; N87-D90 PolarHBondContact O-N 3.23Å; Q88-D90 VanDerWaalsContact C-N 3.28Å; Q88-D90 PolarHBondContact O-N 3.14Å; D90-E92 VanDerWaalsContact C-N 3.31Å; D90-E92 PolarHBondContact O-N 3.29Å; D90-R93 PolarHBondContact O-N 3.33Å; D90-R93 VanDerWaalsContact OD1-CB 3.25Å; D90-R93 WeakPolarHBondContact OD1-CB 3.31Å; D90-R93 VanDerWaalsContact OD1-CG 3.24Å; D90-R93 WeakPolarHBondContact OD1-CG 3.49Å; D90-R93 PolarHBondContact OD1-N 3.5Å; D90-R93 WeakPolarHBondContact OD2-CB 3.37Å; D90-R93 WeakPolarHBondContact OD2-CD 3.38Å; D90-R93 IonicContact OD2-CZ 3.34Å; D90-R93 IonicContact OD2-NE 3.77Å; D90-R93 IonicContact OD2-NH1 3.31Å; D90-R93 PolarHBondContact OD2-NH1 3.23Å; D90-A94 WeakPolarHBondContact O-CB 3.1Å; D90-A94 PolarHBondContact O-N 2.94Å
91	P	92.5	Very high	92.5	Very high	64 Å²	64	65.7 Å²	65.7	42%	0.416	32%	0.319	S	S	.	.	H	α-helix	trans	-68.3	-30.4	-171.5	26.8	-34.7	0	0	0	112.4	P84 Q88 Q95	P84-P91 HydrophobicContact CB-CB 4.29Å; Q88-P91 WeakPolarHBondContact O-CD 3.44Å; P91-Q95 VanDerWaalsContact O-CB 3.29Å; P91-Q95 WeakPolarHBondContact O-CB 3.41Å; P91-Q95 PolarHBondContact O-N 2.68Å
92	E	94.3	Very high	92.9	Very high	141 Å²	141	65.5 Å²	65.5	66%	0.659	32%	0.319	S	S	*	.	H	α-helix	trans	-67.6	-43.5	178.9	-67.4	-166.7	173.8	0	0	112.3	D90 K96	D90-E92 VanDerWaalsContact C-N 3.31Å; D90-E92 PolarHBondContact O-N 3.29Å; E92-K96 WeakPolarHBondContact O-CG 3.33Å; E92-K96 PolarHBondContact O-N 3.13Å; E92-K96 VanDerWaalsContact O-N 3.13Å
93	R	94.5	Very high	93.1	Very high	87 Å²	87	71.9 Å²	71.9	33%	0.328	35%	0.346	S	S	.	.	H	α-helix	trans	-72.7	-37.8	177.4	-68.6	-172.1	51.2	-132.9	7.9	111	I41 D42 L45 D90 Q95 K96 A97	I41-R93 HydrophobicContact CG2-CB 3.77Å; D42-R93 IonicContact OD1-CZ 3.71Å; D42-R93 IonicContact OD1-NH1 2.59Å; D42-R93 IonicContact OD1-NH2 2.71Å; D42-R93 PolarHBondContact OD1-NH2 3.11Å; L45-R93 HydrophobicContact CD1-CB 3.64Å; L45-R93 HydrophobicContact CD1-CG 4.03Å; L45-R93 VanDerWaalsContact CD1-O 3.29Å; L45-R93 WeakPolarHBondContact CD1-O 3.49Å; D90-R93 PolarHBondContact O-N 3.33Å; D90-R93 VanDerWaalsContact OD1-CB 3.25Å; D90-R93 WeakPolarHBondContact OD1-CB 3.31Å; D90-R93 VanDerWaalsContact OD1-CG 3.24Å; D90-R93 WeakPolarHBondContact OD1-CG 3.49Å; D90-R93 PolarHBondContact OD1-N 3.5Å; D90-R93 WeakPolarHBondContact OD2-CB 3.37Å; D90-R93 WeakPolarHBondContact OD2-CD 3.38Å; D90-R93 IonicContact OD2-CZ 3.34Å; D90-R93 IonicContact OD2-NE 3.77Å; D90-R93 IonicContact OD2-NH1 3.31Å; D90-R93 PolarHBondContact OD2-NH1 3.23Å; R93-Q95 VanDerWaalsContact C-N 3.34Å; R93-Q95 PolarHBondContact O-N 3.35Å; R93-K96 PolarHBondContact O-N 3.5Å; R93-A97 WeakPolarHBondContact O-CB 3.04Å; R93-A97 PolarHBondContact O-N 3.17Å
94	A	93.8	Very high	93.3	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-56.6	-48.2	171.6	0	0	0	0	0	111.6	I41 V82 P84 N87 D90 K96 A97 F98	I41-A94 HydrophobicContact CD1-CB 3.87Å; V82-A94 CarbonylContact O-C 3.58Å; V82-A94 WeakPolarHBondContact O-CA 3.33Å; V82-A94 WeakPolarHBondContact O-CB 3.41Å; P84-A94 HydrophobicContact CB-CB 4.37Å; N87-A94 HydrophobicContact CB-CB 3.72Å; D90-A94 WeakPolarHBondContact O-CB 3.1Å; D90-A94 PolarHBondContact O-N 2.94Å; A94-K96 PolarHBondContact O-N 3.49Å; A94-A97 PolarHBondContact O-N 2.79Å; A94-F98 WeakPolarHBondContact O-CB 3.25Å; A94-F98 PolarHBondContact O-N 2.94Å
95	Q	95.7	Very high	93.4	Very high	73 Å²	73	69.6 Å²	69.6	34%	0.341	33%	0.333	S	S	.	.	H	α-helix	trans	-58.1	-48.1	177	-179.3	58.6	33.7	0	0	112.5	P91 R93 A97 F98 E99	P91-Q95 VanDerWaalsContact O-CB 3.29Å; P91-Q95 WeakPolarHBondContact O-CB 3.41Å; P91-Q95 PolarHBondContact O-N 2.68Å; R93-Q95 VanDerWaalsContact C-N 3.34Å; R93-Q95 PolarHBondContact O-N 3.35Å; Q95-A97 VanDerWaalsContact C-N 3.33Å; Q95-A97 PolarHBondContact O-N 3.35Å; Q95-F98 WeakPolarHBondContact O-CB 3.41Å; Q95-F98 PolarHBondContact O-N 3.45Å; Q95-E99 PolarHBondContact NE2-OE1 3.3Å; Q95-E99 WeakPolarHBondContact O-CG 3.5Å; Q95-E99 PolarHBondContact O-N 2.9Å
96	K	95.6	Very high	93.7	Very high	109 Å²	109	69.9 Å²	69.9	47%	0.474	33%	0.328	S	S	.	.	H	α-helix	trans	-61.4	-41	177	-71	170.3	-176.4	164.7	0	112.1	L45 E92 R93 A94 E99 V100	L45-K96 HydrophobicContact CD1-CB 4.16Å; L45-K96 HydrophobicContact CD2-CB 3.88Å; E92-K96 WeakPolarHBondContact O-CG 3.33Å; E92-K96 PolarHBondContact O-N 3.13Å; E92-K96 VanDerWaalsContact O-N 3.13Å; R93-K96 PolarHBondContact O-N 3.5Å; A94-K96 PolarHBondContact O-N 3.49Å; K96-E99 PolarHBondContact O-N 3.05Å; K96-V100 WeakPolarHBondContact O-CG2 3.34Å; K96-V100 PolarHBondContact O-N 3Å
97	A	94.8	Very high	94.3	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-66.2	-39.8	176.9	0	0	0	0	0	111.8	I41 L44 L45 V82 R93 A94 Q95 V100 V101	I41-A97 HydrophobicContact CB-CB 4.37Å; I41-A97 HydrophobicContact CG1-CB 4.02Å; I41-A97 HydrophobicContact CG2-CB 4.3Å; L44-A97 HydrophobicContact CB-CB 4.17Å; L44-A97 HydrophobicContact CD1-CB 3.9Å; L45-A97 HydrophobicContact CD1-CB 4.47Å; L45-A97 HydrophobicContact CG-CB 4.35Å; V82-A97 HydrophobicContact CB-CB 4.06Å; V82-A97 HydrophobicContact CG1-CB 4.2Å; R93-A97 WeakPolarHBondContact O-CB 3.04Å; R93-A97 PolarHBondContact O-N 3.17Å; A94-A97 PolarHBondContact O-N 2.79Å; Q95-A97 VanDerWaalsContact C-N 3.33Å; Q95-A97 PolarHBondContact O-N 3.35Å; A97-V100 PolarHBondContact O-N 2.79Å; A97-V101 WeakPolarHBondContact O-CG2 3.26Å; A97-V101 PolarHBondContact O-N 3.44Å; A97-V101 VanDerWaalsContact O-N 3.14Å
98	F	95.4	Very high	94.5	Very high	47 Å²	47	65.8 Å²	65.8	21%	0.206	31%	0.312	C	S	.	.	H	α-helix	trans	-60.7	-45.9	174	179.7	-98.8	0	0	0	112	V82 A94 Q95 V100 V101 D102	V82-F98 HydrophobicContact CG2-CB 3.86Å; V82-F98 HydrophobicContact CG2-CD2 4.1Å; V82-F98 HydrophobicContact CG2-CG 4.5Å; A94-F98 WeakPolarHBondContact O-CB 3.25Å; A94-F98 PolarHBondContact O-N 2.94Å; Q95-F98 WeakPolarHBondContact O-CB 3.41Å; Q95-F98 PolarHBondContact O-N 3.45Å; F98-V100 VanDerWaalsContact C-N 3.26Å; F98-V100 PolarHBondContact O-N 2.9Å; F98-V101 PolarHBondContact O-N 3.31Å; F98-V101 VanDerWaalsContact O-N 3.11Å; F98-D102 HydrophobicContact CE1-CB 4.35Å; F98-D102 WeakPolarHBondContact O-CB 3.23Å; F98-D102 PolarHBondContact O-N 2.9Å
99	E	95.9	Very high	94.7	Very high	104 Å²	104	63.1 Å²	63.1	49%	0.486	30%	0.303	S	S	.	.	H	α-helix	trans	-58.2	-37.5	176.5	-74.6	169.7	-165.1	0	0	112.6	Q95 K96 K103	Q95-E99 PolarHBondContact NE2-OE1 3.3Å; Q95-E99 WeakPolarHBondContact O-CG 3.5Å; Q95-E99 PolarHBondContact O-N 2.9Å; K96-E99 PolarHBondContact O-N 3.05Å; E99-K103 WeakPolarHBondContact O-CB 3.27Å; E99-K103 PolarHBondContact O-N 3.32Å
100	V	95.9	Very high	94.9	Very high	29 Å²	29	59.7 Å²	59.7	18%	0.176	28%	0.284	C	S	.	.	H	α-helix	trans	-64.6	-47.1	174.9	173.8	0	0	0	0	110.9	L44 N53 V59 K96 A97 F98 K103 S104	L44-V100 HydrophobicContact CD2-CG1 3.87Å; N53-V100 HydrophobicContact CB-CG1 3.96Å; V59-V100 HydrophobicContact CG1-CG1 3.87Å; V59-V100 HydrophobicContact CG2-CG1 4.13Å; K96-V100 WeakPolarHBondContact O-CG2 3.34Å; K96-V100 PolarHBondContact O-N 3Å; A97-V100 PolarHBondContact O-N 2.79Å; F98-V100 VanDerWaalsContact C-N 3.26Å; F98-V100 PolarHBondContact O-N 2.9Å; V100-K103 PolarHBondContact O-N 3.23Å; V100-S104 PolarHBondContact O-N 2.71Å; V100-S104 PolarHBondContact O-OG 2.93Å
101	V	95.8	Very high	95	Very high	0 Å²	0	62 Å²	62	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-62.5	-45.4	178.7	170.9	0	0	0	0	111.2	L44 V59 L60 F75 L78 V82 A97 F98 S104 Y105	L44-V101 HydrophobicContact CD1-CG2 3.63Å; V59-V101 HydrophobicContact CG1-CG2 4.3Å; L60-V101 HydrophobicContact CD2-CG1 3.82Å; F75-V101 HydrophobicContact CD2-CG1 3.77Å; F75-V101 HydrophobicContact CE2-CG1 4.01Å; L78-V101 HydrophobicContact CB-CG1 4.03Å; L78-V101 HydrophobicContact CB-CG2 4.42Å; V82-V101 HydrophobicContact CG2-CG2 4.29Å; A97-V101 WeakPolarHBondContact O-CG2 3.26Å; A97-V101 PolarHBondContact O-N 3.44Å; A97-V101 VanDerWaalsContact O-N 3.14Å; F98-V101 PolarHBondContact O-N 3.31Å; F98-V101 VanDerWaalsContact O-N 3.11Å; V101-S104 PolarHBondContact O-N 3.27Å; V101-Y105 PolarHBondContact O-N 3.43Å
102	D	96.4	Very high	95.2	Very high	37 Å²	37	64.3 Å²	64.3	20%	0.198	31%	0.308	C	S	.	.	H	α-helix	trans	-64.2	-43.6	178	179	57.8	0	0	0	112.1	F75 F98 S104 Y105 K106	F75-D102 HydrophobicContact CE2-CB 4.47Å; F98-D102 HydrophobicContact CE1-CB 4.35Å; F98-D102 WeakPolarHBondContact O-CB 3.23Å; F98-D102 PolarHBondContact O-N 2.9Å; D102-S104 PolarHBondContact O-N 2.84Å; D102-Y105 PolarHBondContact O-N 3.23Å; D102-K106 WeakPolarHBondContact O-CG 3.48Å; D102-K106 PolarHBondContact O-N 2.89Å; D102-K106 WeakPolarHBondContact OD1-CE 3.09Å; D102-K106 IonicContact OD1-NZ 2.71Å; D102-K106 WeakPolarHBondContact OD2-CE 3.19Å; D102-K106 IonicContact OD2-NZ 3.88Å; D102-K106 PolarHBondContact OD2-NZ 3.47Å
103	K	95.9	Very high	95.1	Very high	133 Å²	133	61.3 Å²	61.3	58%	0.578	29%	0.294	S	S	*	.	H	α-helix	trans	-59	-48.2	174.5	-174.7	178.9	-179.7	-178.2	0	111.1	E99 V100 Y105 K106 L107	E99-K103 WeakPolarHBondContact O-CB 3.27Å; E99-K103 PolarHBondContact O-N 3.32Å; V100-K103 PolarHBondContact O-N 3.23Å; K103-Y105 VanDerWaalsContact C-N 3.33Å; K103-Y105 PolarHBondContact O-N 3.17Å; K103-K106 PolarHBondContact O-N 3.44Å; K103-L107 HydrophobicContact CG-CD1 4.46Å; K103-L107 VanDerWaalsContact O-CG 3.29Å; K103-L107 WeakPolarHBondContact O-CG 3.32Å; K103-L107 PolarHBondContact O-N 2.98Å
104	S	95.6	Very high	95.1	Very high	3 Å²	3	59.4 Å²	59.4	2%	0.021	29%	0.288	C	S	.	.	H	α-helix	trans	-62.4	-39	178.6	-66.3	0	0	0	0	112.7	V59 V100 V101 D102 L107 L108	V59-S104 VanDerWaalsContact CB-OG 3.32Å; V59-S104 WeakPolarHBondContact CB-OG 3.48Å; V59-S104 VanDerWaalsContact CG1-OG 3.31Å; V59-S104 WeakPolarHBondContact CG1-OG 3.29Å; V59-S104 WeakPolarHBondContact CG2-OG 3.39Å; V100-S104 PolarHBondContact O-N 2.71Å; V100-S104 PolarHBondContact O-OG 2.93Å; V101-S104 PolarHBondContact O-N 3.27Å; D102-S104 PolarHBondContact O-N 2.84Å; S104-L107 PolarHBondContact O-N 2.92Å; S104-L108 WeakPolarHBondContact O-CG 3.4Å; S104-L108 PolarHBondContact O-N 3.43Å; S104-L108 VanDerWaalsContact O-N 3.16Å
105	Y	95.9	Very high	95.1	Very high	38 Å²	38	65.9 Å²	65.9	15%	0.149	32%	0.316	C	S	.	.	H	α-helix	trans	-63.8	-44.7	174.6	177	-107.1	0	0	0	112.1	L71 K72 F75 V101 D102 K103 L107 L108 L109	L71-Y105 HydrophobicContact CD1-CD2 4.05Å; L71-Y105 HydrophobicContact CD2-CD2 4.46Å; L71-Y105 HydrophobicContact CD2-CE2 4.35Å; L71-Y105 HydrophobicContact CG-CD2 4.01Å; L71-Y105 HydrophobicContact CG-CE2 4Å; K72-Y105 HydrophobicContact CG-CE2 4.26Å; F75-Y105 HydrophobicContact CB-CD2 3.63Å; F75-Y105 HydrophobicContact CB-CE2 4.07Å; F75-Y105 HydrophobicContact CB-CG 4.11Å; F75-Y105 HydrophobicContact CD1-CD1 4.09Å; F75-Y105 HydrophobicContact CD1-CD2 4.15Å; F75-Y105 HydrophobicContact CD1-CE1 4.19Å; F75-Y105 HydrophobicContact CD1-CE2 4.23Å; F75-Y105 HydrophobicContact CD1-CG 4.08Å; F75-Y105 VanDerWaalsContact CD2-CB 3.44Å; F75-Y105 HydrophobicContact CD2-CD1 4.12Å; F75-Y105 HydrophobicContact CD2-CD2 4.05Å; F75-Y105 AromaticContact CD2-CG 3.61Å; F75-Y105 HydrophobicContact CD2-CG 3.61Å; F75-Y105 HydrophobicContact CE1-CD1 4.08Å; F75-Y105 HydrophobicContact CE1-CE1 4.23Å; F75-Y105 HydrophobicContact CE1-CG 4.44Å; F75-Y105 HydrophobicContact CE2-CD1 4.11Å; F75-Y105 HydrophobicContact CE2-CG 4.02Å; F75-Y105 HydrophobicContact CG-CD1 4.1Å; F75-Y105 AromaticContact CG-CD2 3.66Å; F75-Y105 HydrophobicContact CG-CD2 3.66Å; F75-Y105 HydrophobicContact CG-CE2 4.15Å; F75-Y105 AromaticContact CG-CG 3.63Å; F75-Y105 HydrophobicContact CG-CG 3.63Å; F75-Y105 HydrophobicContact CZ-CD1 4.09Å; F75-Y105 HydrophobicContact CZ-CG 4.41Å; V101-Y105 PolarHBondContact O-N 3.43Å; D102-Y105 PolarHBondContact O-N 3.23Å; K103-Y105 VanDerWaalsContact C-N 3.33Å; K103-Y105 PolarHBondContact O-N 3.17Å; Y105-L107 VanDerWaalsContact C-N 3.34Å; Y105-L107 PolarHBondContact O-N 2.97Å; Y105-L108 PolarHBondContact O-N 2.82Å; Y105-L109 WeakPolarHBondContact O-CB 3.45Å; Y105-L109 PolarHBondContact O-N 3.22Å
106	K	95.9	Very high	95.1	Very high	121 Å²	121	69.5 Å²	69.5	53%	0.526	33%	0.326	S	S	.	.	H	α-helix	trans	-61	-40.1	176.2	-74	170	176.9	166.5	0	112.7	D102 K103 L108 L109 D110	D102-K106 WeakPolarHBondContact O-CG 3.48Å; D102-K106 PolarHBondContact O-N 2.89Å; D102-K106 WeakPolarHBondContact OD1-CE 3.09Å; D102-K106 IonicContact OD1-NZ 2.71Å; D102-K106 WeakPolarHBondContact OD2-CE 3.19Å; D102-K106 IonicContact OD2-NZ 3.88Å; D102-K106 PolarHBondContact OD2-NZ 3.47Å; K103-K106 PolarHBondContact O-N 3.44Å; K106-L108 VanDerWaalsContact C-N 3.31Å; K106-L108 PolarHBondContact O-N 3.3Å; K106-L109 PolarHBondContact O-N 3.38Å; K106-D110 PolarHBondContact O-N 3.01Å
107	L	94.7	Very high	95	Very high	51 Å²	51	64.8 Å²	64.8	27%	0.267	31%	0.307	S	S	.	.	H	α-helix	trans	-61.8	-38.5	175.4	-68.7	174.1	0	0	0	112	K103 S104 Y105 Q113 K114	K103-L107 HydrophobicContact CG-CD1 4.46Å; K103-L107 VanDerWaalsContact O-CG 3.29Å; K103-L107 WeakPolarHBondContact O-CG 3.32Å; K103-L107 PolarHBondContact O-N 2.98Å; S104-L107 PolarHBondContact O-N 2.92Å; Y105-L107 VanDerWaalsContact C-N 3.34Å; Y105-L107 PolarHBondContact O-N 2.97Å; L107-Q113 VanDerWaalsContact O-CB 3.26Å; L107-Q113 WeakPolarHBondContact O-CB 3.47Å; L107-K114 PolarHBondContact O-N 3.43Å
108	L	94.4	Very high	95	Very high	3 Å²	3	67.2 Å²	67.2	2%	0.016	32%	0.322	C	S	.	.	H	α-helix	trans	-82.8	-17.5	179.9	-66.7	178.5	0	0	0	113.7	P56 F57 L60 I62 L71 S104 Y105 K106 K114	P56-L108 HydrophobicContact CB-CD1 3.97Å; P56-L108 HydrophobicContact CB-CD2 4.12Å; P56-L108 HydrophobicContact CB-CG 3.81Å; P56-L108 HydrophobicContact CG-CD1 4.39Å; P56-L108 HydrophobicContact CG-CD2 3.69Å; P56-L108 HydrophobicContact CG-CG 3.97Å; F57-L108 HydrophobicContact CD1-CD1 4.19Å; F57-L108 HydrophobicContact CD1-CD2 4.4Å; F57-L108 HydrophobicContact CD2-CD2 4.12Å; F57-L108 HydrophobicContact CE1-CD1 4.21Å; F57-L108 HydrophobicContact CE1-CD2 3.85Å; F57-L108 HydrophobicContact CE2-CD2 3.55Å; F57-L108 HydrophobicContact CG-CD1 4.48Å; F57-L108 HydrophobicContact CZ-CD2 3.39Å; L60-L108 HydrophobicContact CD1-CD1 3.81Å; I62-L108 HydrophobicContact CD1-CD1 3.94Å; L71-L108 HydrophobicContact CD1-CB 4.1Å; L71-L108 HydrophobicContact CD1-CD1 3.69Å; L71-L108 HydrophobicContact CD2-CB 3.85Å; S104-L108 WeakPolarHBondContact O-CG 3.4Å; S104-L108 PolarHBondContact O-N 3.43Å; S104-L108 VanDerWaalsContact O-N 3.16Å; Y105-L108 PolarHBondContact O-N 2.82Å; K106-L108 VanDerWaalsContact C-N 3.31Å; K106-L108 PolarHBondContact O-N 3.3Å; L108-K114 HydrophobicContact CD2-CB 4.34Å; L108-K114 HydrophobicContact CD2-CG 4.07Å
109	L	93.8	Very high	95	Very high	102 Å²	102	69 Å²	69	53%	0.534	33%	0.334	S	S	.	.	H	α-helix	trans	-73.2	-32.4	174.6	-169.8	66.9	0	0	0	111.9	Y105 K106 P111	Y105-L109 WeakPolarHBondContact O-CB 3.45Å; Y105-L109 PolarHBondContact O-N 3.22Å; K106-L109 PolarHBondContact O-N 3.38Å; L109-P111 WeakPolarHBondContact O-CD 3.46Å
110	D	95.1	Very high	94.9	Very high	57 Å²	57	65 Å²	65	31%	0.305	32%	0.317	S	S	.	.	S	Bend	trans	-76.1	115.6	172.5	-179.6	-14.8	0	0	0	109.8	K106 E112 Q113 K114	K106-D110 PolarHBondContact O-N 3.01Å; D110-E112 PolarHBondContact O-N 3Å; D110-E112 PolarHBondContact OD1-N 3.46Å; D110-Q113 HydrophobicContact CB-CB 4.06Å; D110-Q113 HydrophobicContact CB-CG 4.13Å; D110-Q113 PolarHBondContact O-N 3.13Å; D110-Q113 WeakPolarHBondContact OD2-CG 3.39Å; D110-Q113 PolarHBondContact OD2-NE2 3.39Å; D110-K114 WeakPolarHBondContact O-CB 3.15Å; D110-K114 PolarHBondContact O-N 3.35Å
111	P	94	Very high	94.8	Very high	103 Å²	103	64.8 Å²	64.8	67%	0.669	31%	0.314	S	S	*	.	H	α-helix	trans	-58.5	-34.3	-178	-23.3	33.8	0	0	0	113.6	L109 K115	L109-P111 WeakPolarHBondContact O-CD 3.46Å; P111-K115 VanDerWaalsContact O-CB 3.27Å; P111-K115 WeakPolarHBondContact O-CB 3.35Å; P111-K115 PolarHBondContact O-N 3.29Å
112	E	95.4	Very high	94.8	Very high	113 Å²	113	68.5 Å²	68.5	53%	0.528	33%	0.332	S	S	.	.	H	α-helix	trans	-71	-42.5	-179.1	-170.3	179.1	174.8	0	0	110.6	D110 K115 R116	D110-E112 PolarHBondContact O-N 3Å; D110-E112 PolarHBondContact OD1-N 3.46Å; E112-K115 PolarHBondContact O-N 3.22Å; E112-R116 WeakPolarHBondContact O-CG 3.16Å; E112-R116 PolarHBondContact O-N 3.38Å; E112-R116 IonicContact OE1-CZ 2.67Å; E112-R116 IonicContact OE1-NE 2.78Å; E112-R116 IonicContact OE1-NH2 3.61Å; E112-R116 PolarHBondContact OE1-NH2 3.3Å
113	Q	93.4	Very high	94.7	Very high	78 Å²	78	68.8 Å²	68.8	36%	0.364	34%	0.339	S	S	.	.	H	α-helix	trans	-72	-39.7	178.6	-64.8	-174.2	61.5	0	0	111.8	L107 D110 K115 R116 A117	L107-Q113 VanDerWaalsContact O-CB 3.26Å; L107-Q113 WeakPolarHBondContact O-CB 3.47Å; D110-Q113 HydrophobicContact CB-CB 4.06Å; D110-Q113 HydrophobicContact CB-CG 4.13Å; D110-Q113 PolarHBondContact O-N 3.13Å; D110-Q113 WeakPolarHBondContact OD2-CG 3.39Å; D110-Q113 PolarHBondContact OD2-NE2 3.39Å; Q113-K115 VanDerWaalsContact C-N 3.33Å; Q113-K115 PolarHBondContact O-N 3.4Å; Q113-R116 PolarHBondContact O-N 3.22Å; Q113-A117 PolarHBondContact O-N 2.79Å
114	K	93.6	Very high	94.6	Very high	47 Å²	47	62.5 Å²	62.5	20%	0.204	31%	0.312	C	S	.	.	H	α-helix	trans	-55.2	-49.9	170.2	-175.6	178.9	-174.5	-175.7	0	110.5	F57 D68 L107 L108 D110 R116 A117 V118	F57-K114 HydrophobicContact CZ-CG 4.3Å; D68-K114 IonicContact OD1-NZ 3.58Å; D68-K114 PolarHBondContact OD1-NZ 3.26Å; L107-K114 PolarHBondContact O-N 3.43Å; L108-K114 HydrophobicContact CD2-CB 4.34Å; L108-K114 HydrophobicContact CD2-CG 4.07Å; D110-K114 WeakPolarHBondContact O-CB 3.15Å; D110-K114 PolarHBondContact O-N 3.35Å; K114-R116 PolarHBondContact O-N 3.27Å; K114-A117 PolarHBondContact O-N 3.44Å; K114-V118 WeakPolarHBondContact O-CG2 3.35Å; K114-V118 PolarHBondContact O-N 2.9Å
115	K	94.7	Very high	94.5	Very high	135 Å²	135	66 Å²	66	59%	0.587	33%	0.327	S	S	*	.	H	α-helix	trans	-58.9	-49.2	178.5	-176.2	-179.3	176.4	-177	0	111.7	P111 E112 Q113 A117 V118 D119	P111-K115 VanDerWaalsContact O-CB 3.27Å; P111-K115 WeakPolarHBondContact O-CB 3.35Å; P111-K115 PolarHBondContact O-N 3.29Å; E112-K115 PolarHBondContact O-N 3.22Å; Q113-K115 VanDerWaalsContact C-N 3.33Å; Q113-K115 PolarHBondContact O-N 3.4Å; K115-A117 VanDerWaalsContact C-N 3.27Å; K115-A117 PolarHBondContact O-N 2.72Å; K115-V118 PolarHBondContact O-N 3.15Å; K115-V118 VanDerWaalsContact O-N 3.13Å; K115-D119 PolarHBondContact O-N 2.95Å
116	R	94.1	Very high	94.4	Very high	150 Å²	150	69.2 Å²	69.2	57%	0.566	34%	0.343	S	S	*	.	H	α-helix	trans	-57.2	-41.2	176.9	-71.2	174	-172.6	-170	4.4	111.9	E112 Q113 K114 D119 V120	E112-R116 WeakPolarHBondContact O-CG 3.16Å; E112-R116 PolarHBondContact O-N 3.38Å; E112-R116 IonicContact OE1-CZ 2.67Å; E112-R116 IonicContact OE1-NE 2.78Å; E112-R116 IonicContact OE1-NH2 3.61Å; E112-R116 PolarHBondContact OE1-NH2 3.3Å; Q113-R116 PolarHBondContact O-N 3.22Å; K114-R116 PolarHBondContact O-N 3.27Å; R116-D119 PolarHBondContact O-N 3.45Å; R116-V120 VanDerWaalsContact O-CG2 3.3Å; R116-V120 WeakPolarHBondContact O-CG2 3.34Å; R116-V120 PolarHBondContact O-N 3.47Å; R116-V120 VanDerWaalsContact O-N 3.15Å
117	A	93.9	Very high	94.3	Very high	9 Å²	9	68.3 Å²	68.3	7%	0.074	34%	0.337	C	S	.	.	H	α-helix	trans	-65.6	-42.1	177.5	0	0	0	0	0	111.9	P56 F57 Q113 K114 K115 V120 I121 F168	P56-A117 HydrophobicContact CG-CB 4.16Å; F57-A117 HydrophobicContact CD2-CB 4.45Å; F57-A117 HydrophobicContact CE2-CB 3.79Å; Q113-A117 PolarHBondContact O-N 2.79Å; K114-A117 PolarHBondContact O-N 3.44Å; K115-A117 VanDerWaalsContact C-N 3.27Å; K115-A117 PolarHBondContact O-N 2.72Å; A117-V120 PolarHBondContact O-N 2.85Å; A117-I121 WeakPolarHBondContact O-CG1 3.29Å; A117-I121 PolarHBondContact O-N 3.39Å; A117-F168 HydrophobicContact CB-CE1 4.38Å; A117-F168 HydrophobicContact CB-CZ 4.2Å
118	V	95	Very high	94.1	Very high	51 Å²	51	66.3 Å²	66.3	31%	0.309	33%	0.327	S	S	.	.	H	α-helix	trans	-63	-44	174.3	173.6	0	0	0	0	111.4	F57 K114 K115 V120 I121 Q122	F57-V118 HydrophobicContact CE2-CG2 4.02Å; F57-V118 HydrophobicContact CZ-CG2 3.63Å; K114-V118 WeakPolarHBondContact O-CG2 3.35Å; K114-V118 PolarHBondContact O-N 2.9Å; K115-V118 PolarHBondContact O-N 3.15Å; K115-V118 VanDerWaalsContact O-N 3.13Å; V118-V120 PolarHBondContact O-N 2.59Å; V118-I121 WeakPolarHBondContact O-CB 3.36Å; V118-I121 PolarHBondContact O-N 2.98Å; V118-I121 VanDerWaalsContact O-N 3.07Å; V118-Q122 WeakPolarHBondContact O-CB 3.22Å; V118-Q122 PolarHBondContact O-N 2.99Å
119	D	95.3	Very high	94	Very high	86 Å²	86	70.4 Å²	70.4	46%	0.46	35%	0.346	S	S	.	.	H	α-helix	trans	-58.5	-38.1	178.5	-67	-20.5	0	0	0	111.4	K115 R116 Q122 A123	K115-D119 PolarHBondContact O-N 2.95Å; R116-D119 PolarHBondContact O-N 3.45Å; D119-Q122 PolarHBondContact O-N 3.13Å; D119-A123 WeakPolarHBondContact O-CB 2.95Å; D119-A123 PolarHBondContact O-N 3.44Å
120	V	94.8	Very high	94	Very high	20 Å²	20	70.5 Å²	70.5	12%	0.121	34%	0.343	C	S	.	.	H	α-helix	trans	-66.7	-41	175.8	174.8	0	0	0	0	112	R116 A117 V118 A123 G124 L167 F168 L171	R116-V120 VanDerWaalsContact O-CG2 3.3Å; R116-V120 WeakPolarHBondContact O-CG2 3.34Å; R116-V120 PolarHBondContact O-N 3.47Å; R116-V120 VanDerWaalsContact O-N 3.15Å; A117-V120 PolarHBondContact O-N 2.85Å; V118-V120 PolarHBondContact O-N 2.59Å; V120-A123 PolarHBondContact O-N 3.1Å; V120-G124 PolarHBondContact O-N 3.46Å; V120-L167 HydrophobicContact CG1-CB 3.83Å; V120-F168 HydrophobicContact CB-CE1 4.3Å; V120-F168 HydrophobicContact CB-CE2 4.04Å; V120-F168 HydrophobicContact CB-CZ 3.88Å; V120-F168 HydrophobicContact CG1-CD1 4.25Å; V120-F168 HydrophobicContact CG1-CD2 3.63Å; V120-F168 HydrophobicContact CG1-CE1 4.17Å; V120-F168 HydrophobicContact CG1-CE2 3.53Å; V120-F168 HydrophobicContact CG1-CG 3.99Å; V120-F168 HydrophobicContact CG1-CZ 3.82Å; V120-L171 HydrophobicContact CB-CD1 4.49Å; V120-L171 HydrophobicContact CG1-CD1 4.2Å; V120-L171 HydrophobicContact CG2-CD1 3.39Å
121	I	94.1	Very high	93.8	Very high	23 Å²	23	71.4 Å²	71.4	12%	0.118	35%	0.347	C	S	.	.	H	α-helix	trans	-65.5	-44.2	177.4	-63.2	170	0	0	0	110.2	F57 P64 A117 V118 G124 K125 T164 F168	F57-I121 HydrophobicContact CD2-CD1 3.5Å; F57-I121 HydrophobicContact CE2-CD1 3.9Å; F57-I121 HydrophobicContact CG-CD1 4.21Å; P64-I121 HydrophobicContact CB-CD1 4.05Å; P64-I121 HydrophobicContact CB-CG2 4.42Å; P64-I121 HydrophobicContact CG-CD1 3.78Å; P64-I121 HydrophobicContact CG-CG2 3.96Å; A117-I121 WeakPolarHBondContact O-CG1 3.29Å; A117-I121 PolarHBondContact O-N 3.39Å; V118-I121 WeakPolarHBondContact O-CB 3.36Å; V118-I121 PolarHBondContact O-N 2.98Å; V118-I121 VanDerWaalsContact O-N 3.07Å; I121-G124 WeakPolarHBondContact O-CA 3.06Å; I121-G124 PolarHBondContact O-N 3.46Å; I121-G124 VanDerWaalsContact O-N 3.14Å; I121-K125 PolarHBondContact O-N 2.94Å; I121-T164 HydrophobicContact CB-CG2 4.25Å; I121-T164 HydrophobicContact CG1-CG2 3.73Å; I121-T164 HydrophobicContact CG2-CG2 4.47Å; I121-F168 HydrophobicContact CG1-CE2 3.88Å; I121-F168 HydrophobicContact CG1-CZ 4.25Å
122	Q	94.3	Very high	93.6	Very high	79 Å²	79	67.2 Å²	67.2	37%	0.369	32%	0.319	S	S	.	.	H	α-helix	trans	-62.9	-43.8	177.5	-176.7	56.2	32.4	0	0	111.5	V118 D119 G124 K125 E126	V118-Q122 WeakPolarHBondContact O-CB 3.22Å; V118-Q122 PolarHBondContact O-N 2.99Å; D119-Q122 PolarHBondContact O-N 3.13Å; Q122-G124 VanDerWaalsContact C-N 3.27Å; Q122-G124 PolarHBondContact O-N 2.95Å; Q122-K125 WeakPolarHBondContact O-CB 3.26Å; Q122-K125 PolarHBondContact O-N 3.34Å; Q122-K125 VanDerWaalsContact O-N 3.14Å; Q122-E126 WeakPolarHBondContact CG-OE1 3.41Å; Q122-E126 PolarHBondContact NE2-OE1 2.65Å; Q122-E126 WeakPolarHBondContact O-CG 3.47Å; Q122-E126 PolarHBondContact O-N 3.41Å
123	A	94.9	Very high	93.3	Very high	43 Å²	43	69.3 Å²	69.3	36%	0.355	33%	0.327	S	S	.	.	H	α-helix	trans	-60.4	-36.7	173.3	0	0	0	0	0	112.5	D119 V120 Y127 L167	D119-A123 WeakPolarHBondContact O-CB 2.95Å; D119-A123 PolarHBondContact O-N 3.44Å; V120-A123 PolarHBondContact O-N 3.1Å; A123-Y127 WeakPolarHBondContact O-CB 3.34Å; A123-Y127 PolarHBondContact O-N 3.33Å; A123-L167 HydrophobicContact CB-CD1 4.2Å
124	G	93.4	Very high	93.1	Very high	0 Å²	0	71.2 Å²	71.2	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-62.2	-45	173.4	0	0	0	0	0	112.4	V120 I121 Q122 V128	V120-G124 PolarHBondContact O-N 3.46Å; I121-G124 WeakPolarHBondContact O-CA 3.06Å; I121-G124 PolarHBondContact O-N 3.46Å; I121-G124 VanDerWaalsContact O-N 3.14Å; Q122-G124 VanDerWaalsContact C-N 3.27Å; Q122-G124 PolarHBondContact O-N 2.95Å; G124-V128 WeakPolarHBondContact O-CG2 3.38Å; G124-V128 PolarHBondContact O-N 3.46Å
125	K	93	Very high	92.8	Very high	78 Å²	78	73 Å²	73	34%	0.339	34%	0.343	S	S	.	.	H	α-helix	trans	-62.7	-50.7	176.6	-174.7	179	171.3	-178.4	0	112	I121 Q122 Y127 V128 E129 F156 V160	I121-K125 PolarHBondContact O-N 2.94Å; Q122-K125 WeakPolarHBondContact O-CB 3.26Å; Q122-K125 PolarHBondContact O-N 3.34Å; Q122-K125 VanDerWaalsContact O-N 3.14Å; K125-Y127 VanDerWaalsContact C-N 3.29Å; K125-Y127 PolarHBondContact O-N 3.27Å; K125-V128 PolarHBondContact O-N 3.16Å; K125-V128 VanDerWaalsContact O-N 3.13Å; K125-E129 WeakPolarHBondContact CE-OE1 3.39Å; K125-E129 WeakPolarHBondContact O-CG 3.44Å; K125-E129 PolarHBondContact O-N 2.64Å; K125-F156 HydrophobicContact CG-CZ 4.3Å; K125-V160 HydrophobicContact CB-CG1 4.05Å; K125-V160 HydrophobicContact CB-CG2 4.5Å; K125-V160 HydrophobicContact CG-CG2 4.39Å
126	E	94.4	Very high	92.4	Very high	104 Å²	104	69.5 Å²	69.5	49%	0.486	33%	0.328	S	S	.	.	H	α-helix	trans	-59.7	-38.8	179.1	-72.3	171.7	-170.2	0	0	112.5	Q122 E129 H130	Q122-E126 WeakPolarHBondContact CG-OE1 3.41Å; Q122-E126 PolarHBondContact NE2-OE1 2.65Å; Q122-E126 WeakPolarHBondContact O-CG 3.47Å; Q122-E126 PolarHBondContact O-N 3.41Å; E126-E129 PolarHBondContact O-N 2.94Å; E126-H130 VanDerWaalsContact O-CB 3.28Å; E126-H130 WeakPolarHBondContact O-CB 3.26Å; E126-H130 PolarHBondContact O-N 3.48Å
127	Y	93.4	Very high	92.2	Very high	103 Å²	103	70.2 Å²	70.2	40%	0.404	34%	0.335	S	S	.	.	H	α-helix	trans	-60.9	-45.7	175.7	178.8	-89.8	0	0	0	111.9	A123 K125 H130 M131 Q163	A123-Y127 WeakPolarHBondContact O-CB 3.34Å; A123-Y127 PolarHBondContact O-N 3.33Å; K125-Y127 VanDerWaalsContact C-N 3.29Å; K125-Y127 PolarHBondContact O-N 3.27Å; Y127-H130 PolarHBondContact O-N 3.28Å; Y127-M131 HydrophobicContact CD1-CG 4.05Å; Y127-M131 HydrophobicContact CE1-CE 4.19Å; Y127-M131 HydrophobicContact CE1-CG 3.65Å; Y127-M131 HydrophobicContact CE1-SD 4.11Å; Y127-M131 WeakPolarHBondContact O-CB 3.29Å; Y127-M131 WeakPolarHBondContact O-CG 3.38Å; Y127-M131 PolarHBondContact O-N 2.9Å; Y127-Q163 HydrophobicContact CD1-CG 3.54Å; Y127-Q163 HydrophobicContact CE1-CG 4.23Å; Y127-Q163 HydrophobicContact CG-CG 4.09Å
128	V	91.8	Very high	91.8	Very high	9 Å²	9	74.1 Å²	74.1	6%	0.055	35%	0.352	C	S	.	.	H	α-helix	trans	-67.2	-44.9	179.3	175.6	0	0	0	0	110.5	G124 K125 H130 M131 V132 F156 A159 V160 Q163	G124-V128 WeakPolarHBondContact O-CG2 3.38Å; G124-V128 PolarHBondContact O-N 3.46Å; K125-V128 PolarHBondContact O-N 3.16Å; K125-V128 VanDerWaalsContact O-N 3.13Å; V128-H130 VanDerWaalsContact C-N 3.31Å; V128-H130 PolarHBondContact O-N 2.87Å; V128-M131 WeakPolarHBondContact O-CB 3.17Å; V128-M131 PolarHBondContact O-N 3.47Å; V128-V132 HydrophobicContact CG1-CG2 4.34Å; V128-V132 WeakPolarHBondContact O-CG2 3.38Å; V128-V132 PolarHBondContact O-N 2.99Å; V128-F156 HydrophobicContact CB-CE2 4.38Å; V128-F156 HydrophobicContact CG1-CD2 3.88Å; V128-F156 HydrophobicContact CG1-CE2 3.7Å; V128-A159 HydrophobicContact CG1-CB 3.8Å; V128-A159 HydrophobicContact CG2-CB 4.34Å; V128-V160 HydrophobicContact CB-CG2 3.95Å; V128-V160 HydrophobicContact CG1-CG2 4.06Å; V128-V160 HydrophobicContact CG2-CG2 4.15Å; V128-Q163 HydrophobicContact CG2-CB 3.82Å; V128-Q163 HydrophobicContact CG2-CG 4.24Å
129	E	91.9	Very high	91.4	Very high	89 Å²	89	73.5 Å²	73.5	42%	0.416	35%	0.347	S	S	.	.	H	α-helix	trans	-57.2	-44.5	174.8	-71.1	178.9	-176.7	0	0	111.9	K125 E126 V132 K133 F156	K125-E129 WeakPolarHBondContact CE-OE1 3.39Å; K125-E129 WeakPolarHBondContact O-CG 3.44Å; K125-E129 PolarHBondContact O-N 2.64Å; E126-E129 PolarHBondContact O-N 2.94Å; E129-V132 PolarHBondContact O-N 3.13Å; E129-K133 VanDerWaalsContact O-CB 3.32Å; E129-K133 WeakPolarHBondContact O-CB 3.5Å; E129-K133 PolarHBondContact O-N 3.2Å; E129-F156 HydrophobicContact CG-CE2 3.83Å; E129-F156 HydrophobicContact CG-CZ 3.62Å
130	H	92.8	Very high	90.8	Very high	103 Å²	103	76.5 Å²	76.5	48%	0.477	36%	0.356	S	S	.	.	H	α-helix	trans	-63.4	-44.3	176.6	179.1	-100.9	0	0	0	111.7	E126 Y127 V128 K133 Q134	E126-H130 VanDerWaalsContact O-CB 3.28Å; E126-H130 WeakPolarHBondContact O-CB 3.26Å; E126-H130 PolarHBondContact O-N 3.48Å; Y127-H130 PolarHBondContact O-N 3.28Å; V128-H130 VanDerWaalsContact C-N 3.31Å; V128-H130 PolarHBondContact O-N 2.87Å; H130-K133 PolarHBondContact O-N 3.22Å; H130-Q134 PolarHBondContact CE1-NE2 3.07Å; H130-Q134 PolarHBondContact NE2-NE2 2.91Å; H130-Q134 VanDerWaalsContact NE2-NE2 3.15Å; H130-Q134 VanDerWaalsContact O-CG 3.29Å; H130-Q134 WeakPolarHBondContact O-CG 3.31Å; H130-Q134 PolarHBondContact O-N 3.14Å
131	M	91.8	Very high	90.5	Very high	77 Å²	77	83.6 Å²	83.6	38%	0.379	39%	0.385	S	S	.	.	H	α-helix	trans	-57.8	-48.8	174.9	-82.5	-105	-68.3	0	0	112.2	Y127 V128 K133 Q134 K135	Y127-M131 HydrophobicContact CD1-CG 4.05Å; Y127-M131 HydrophobicContact CE1-CE 4.19Å; Y127-M131 HydrophobicContact CE1-CG 3.65Å; Y127-M131 HydrophobicContact CE1-SD 4.11Å; Y127-M131 WeakPolarHBondContact O-CB 3.29Å; Y127-M131 WeakPolarHBondContact O-CG 3.38Å; Y127-M131 PolarHBondContact O-N 2.9Å; V128-M131 WeakPolarHBondContact O-CB 3.17Å; V128-M131 PolarHBondContact O-N 3.47Å; M131-K133 PolarHBondContact O-N 3.49Å; M131-Q134 PolarHBondContact O-N 2.98Å; M131-K135 PolarHBondContact O-N 3.14Å
132	V	89.3	Confident	90	Very high	15 Å²	15	86.5 Å²	86.5	9%	0.091	40%	0.401	C	S	.	.	H	α-helix	trans	-62.1	-44.9	178.6	173.8	0	0	0	0	110.6	V128 E129 Q134 K135 K136 E150	V128-V132 HydrophobicContact CG1-CG2 4.34Å; V128-V132 WeakPolarHBondContact O-CG2 3.38Å; V128-V132 PolarHBondContact O-N 2.99Å; E129-V132 PolarHBondContact O-N 3.13Å; V132-Q134 VanDerWaalsContact C-N 3.31Å; V132-Q134 PolarHBondContact O-N 3.48Å; V132-K135 PolarHBondContact O-N 3.34Å; V132-K136 HydrophobicContact CG1-CD 4.4Å; V132-K136 WeakPolarHBondContact O-CG 3.49Å; V132-K136 PolarHBondContact O-N 3.37Å; V132-E150 HydrophobicContact CG2-CB 3.47Å; V132-E150 VanDerWaalsContact CG2-CB 3.47Å; V132-E150 HydrophobicContact CG2-CG 3.91Å
133	K	89.8	Confident	89.2	Confident	157 Å²	157	86.2 Å²	86.2	68%	0.683	42%	0.419	S	S	*	.	H	α-helix	trans	-59.5	-40.4	176.1	-173.2	177	-177.1	175.7	0	112.2	E129 H130 M131 K137	E129-K133 VanDerWaalsContact O-CB 3.32Å; E129-K133 WeakPolarHBondContact O-CB 3.5Å; E129-K133 PolarHBondContact O-N 3.2Å; H130-K133 PolarHBondContact O-N 3.22Å; M131-K133 PolarHBondContact O-N 3.49Å; K133-K137 WeakPolarHBondContact O-CB 3.46Å; K133-K137 PolarHBondContact O-N 3.14Å; K133-K137 VanDerWaalsContact O-N 3.08Å
134	Q	89.1	Confident	88.6	Confident	117 Å²	117	90.4 Å²	90.4	55%	0.547	43%	0.429	S	S	.	.	H	α-helix	trans	-66.9	-44.6	175.5	-69.3	-135.8	-8	0	0	112.1	H130 M131 V132 K136 K137 Q138	H130-Q134 PolarHBondContact CE1-NE2 3.07Å; H130-Q134 PolarHBondContact NE2-NE2 2.91Å; H130-Q134 VanDerWaalsContact NE2-NE2 3.15Å; H130-Q134 VanDerWaalsContact O-CG 3.29Å; H130-Q134 WeakPolarHBondContact O-CG 3.31Å; H130-Q134 PolarHBondContact O-N 3.14Å; M131-Q134 PolarHBondContact O-N 2.98Å; V132-Q134 VanDerWaalsContact C-N 3.31Å; V132-Q134 PolarHBondContact O-N 3.48Å; Q134-K136 PolarHBondContact O-N 3.42Å; Q134-K137 PolarHBondContact O-N 3.32Å; Q134-Q138 PolarHBondContact O-N 3.02Å
135	K	87.2	Confident	87.5	Confident	84 Å²	84	95.5 Å²	95.5	37%	0.365	46%	0.462	S	S	.	.	H	α-helix	trans	-57	-48.2	175.1	-76.4	-176.6	176.4	-176.5	0	111.6	M131 V132 K137 Q138 L139 V148 E150	M131-K135 PolarHBondContact O-N 3.14Å; V132-K135 PolarHBondContact O-N 3.34Å; K135-K137 VanDerWaalsContact C-N 3.33Å; K135-K137 PolarHBondContact O-N 3.13Å; K135-Q138 PolarHBondContact O-N 3.33Å; K135-Q138 VanDerWaalsContact O-N 3.16Å; K135-L139 WeakPolarHBondContact O-CG 3.31Å; K135-L139 PolarHBondContact O-N 3.42Å; K135-V148 HydrophobicContact CB-CG1 4.26Å; K135-V148 HydrophobicContact CD-CG1 3.91Å; K135-E150 IonicContact NZ-OE1 3.49Å; K135-E150 PolarHBondContact NZ-OE1 2.92Å; K135-E150 IonicContact NZ-OE2 3.35Å
136	K	86.7	Confident	86.2	Confident	63 Å²	63	96.2 Å²	96.2	27%	0.274	47%	0.467	S	S	.	.	H	α-helix	trans	-58.3	-43.1	176	-72.6	-173.2	174.6	-168.9	0	112.7	V132 Q134 Q138 L139 K140 V148 D151	V132-K136 HydrophobicContact CG1-CD 4.4Å; V132-K136 WeakPolarHBondContact O-CG 3.49Å; V132-K136 PolarHBondContact O-N 3.37Å; Q134-K136 PolarHBondContact O-N 3.42Å; K136-Q138 VanDerWaalsContact C-N 3.33Å; K136-Q138 PolarHBondContact O-N 3.24Å; K136-L139 PolarHBondContact O-N 3.03Å; K136-K140 WeakPolarHBondContact O-CB 3.33Å; K136-K140 PolarHBondContact O-N 3.05Å; K136-V148 HydrophobicContact CD-CG2 4.26Å; K136-V148 HydrophobicContact CG-CG2 3.39Å; K136-D151 WeakPolarHBondContact CE-OD1 3.41Å; K136-D151 WeakPolarHBondContact CE-OD2 3.32Å; K136-D151 IonicContact NZ-OD1 2.7Å; K136-D151 PolarHBondContact NZ-OD1 3.39Å; K136-D151 IonicContact NZ-OD2 3.45Å; K136-D151 PolarHBondContact NZ-OD2 3.46Å
137	K	88.5	Confident	84.9	Confident	164 Å²	164	97.8 Å²	97.8	71%	0.713	48%	0.478	S	S	*	.	H	α-helix	trans	-63.5	-39.2	177.4	-172.2	178.6	179.5	-177.8	0	111.8	K133 Q134 K135 K141	K133-K137 WeakPolarHBondContact O-CB 3.46Å; K133-K137 PolarHBondContact O-N 3.14Å; K133-K137 VanDerWaalsContact O-N 3.08Å; Q134-K137 PolarHBondContact O-N 3.32Å; K135-K137 VanDerWaalsContact C-N 3.33Å; K135-K137 PolarHBondContact O-N 3.13Å; K137-K141 PolarHBondContact O-N 3.26Å; K137-K141 VanDerWaalsContact O-N 3.12Å
138	Q	86	Confident	83.7	Confident	91 Å²	91	93.6 Å²	93.6	43%	0.425	46%	0.464	S	S	.	.	H	α-helix	trans	-68.5	-46.6	177.1	-173.7	57.1	48.1	0	0	111.5	Q134 K135 K136 K140 K141 D142	Q134-Q138 PolarHBondContact O-N 3.02Å; K135-Q138 PolarHBondContact O-N 3.33Å; K135-Q138 VanDerWaalsContact O-N 3.16Å; K136-Q138 VanDerWaalsContact C-N 3.33Å; K136-Q138 PolarHBondContact O-N 3.24Å; Q138-K140 VanDerWaalsContact C-N 3.27Å; Q138-K140 PolarHBondContact O-N 2.93Å; Q138-K141 WeakPolarHBondContact O-CA 3.46Å; Q138-K141 WeakPolarHBondContact O-CB 3.38Å; Q138-K141 PolarHBondContact O-N 3.37Å; Q138-D142 PolarHBondContact NE2-OD1 2.99Å; Q138-D142 PolarHBondContact NE2-OD2 3.21Å; Q138-D142 VanDerWaalsContact O-CG 3.31Å; Q138-D142 PolarHBondContact O-N 2.88Å
139	L	86	Confident	82.5	Confident	39 Å²	39	99.9 Å²	99.9	20%	0.204	49%	0.492	C	S	.	.	H	α-helix	trans	-58.4	-39.8	175.5	-70.1	168.8	0	0	0	112.2	K135 K136 K141 D142 G143 K144 V148	K135-L139 WeakPolarHBondContact O-CG 3.31Å; K135-L139 PolarHBondContact O-N 3.42Å; K136-L139 PolarHBondContact O-N 3.03Å; L139-K141 VanDerWaalsContact C-N 3.34Å; L139-K141 PolarHBondContact O-N 3.43Å; L139-D142 CarbonylContact O-C 3.35Å; L139-D142 PolarHBondContact O-N 3.46Å; L139-G143 PolarHBondContact O-N 2.88Å; L139-G143 VanDerWaalsContact O-N 3.13Å; L139-K144 HydrophobicContact CB-CB 4.47Å; L139-K144 HydrophobicContact CD2-CB 3.9Å; L139-K144 HydrophobicContact CD2-CD 4.04Å; L139-K144 PolarHBondContact O-N 3.19Å; L139-V148 HydrophobicContact CD1-CG2 3.94Å
140	K	84.6	Confident	81.3	Confident	149 Å²	149	97.2 Å²	97.2	65%	0.648	48%	0.48	S	S	*	.	H	α-helix	trans	-60.7	-41	172.7	-172.3	-179.6	-176.5	176.3	0	112.4	K136 Q138 D142 G143 Q146	K136-K140 WeakPolarHBondContact O-CB 3.33Å; K136-K140 PolarHBondContact O-N 3.05Å; Q138-K140 VanDerWaalsContact C-N 3.27Å; Q138-K140 PolarHBondContact O-N 2.93Å; K140-D142 VanDerWaalsContact C-N 3.32Å; K140-G143 PolarHBondContact O-N 2.93Å; K140-Q146 HydrophobicContact CB-CG 4.33Å
141	K	88.3	Confident	80.2	Confident	168 Å²	168	95.4 Å²	95.4	73%	0.73	47%	0.474	S	S	*	.	H	α-helix	trans	-67.6	-35.4	177.4	-173	-177.1	175.7	-173.3	0	111.6	K137 Q138 L139 G143	K137-K141 PolarHBondContact O-N 3.26Å; K137-K141 VanDerWaalsContact O-N 3.12Å; Q138-K141 WeakPolarHBondContact O-CA 3.46Å; Q138-K141 WeakPolarHBondContact O-CB 3.38Å; Q138-K141 PolarHBondContact O-N 3.37Å; L139-K141 VanDerWaalsContact C-N 3.34Å; L139-K141 PolarHBondContact O-N 3.43Å; K141-G143 VanDerWaalsContact C-N 3.27Å; K141-G143 PolarHBondContact O-N 2.9Å
142	D	83.6	Confident	79.7	Confident	85 Å²	85	95.5 Å²	95.5	46%	0.455	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	2.5	-178.9	-60.7	-22.9	0	0	0	113.2	Q138 L139 K140 K144	Q138-D142 PolarHBondContact NE2-OD1 2.99Å; Q138-D142 PolarHBondContact NE2-OD2 3.21Å; Q138-D142 VanDerWaalsContact O-CG 3.31Å; Q138-D142 PolarHBondContact O-N 2.88Å; L139-D142 CarbonylContact O-C 3.35Å; L139-D142 PolarHBondContact O-N 3.46Å; K140-D142 VanDerWaalsContact C-N 3.32Å; D142-K144 HydrophobicContact CB-CG 4.42Å; D142-K144 PolarHBondContact O-N 3.22Å
143	G	76.8	Confident	79.4	Confident	73 Å²	73	98.5 Å²	98.5	75%	0.753	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.2	15.3	179.9	0	0	0	0	0	114.6	L139 K140 K141	L139-G143 PolarHBondContact O-N 2.88Å; L139-G143 VanDerWaalsContact O-N 3.13Å; K140-G143 PolarHBondContact O-N 2.93Å; K141-G143 VanDerWaalsContact C-N 3.27Å; K141-G143 PolarHBondContact O-N 2.9Å
144	K	81.1	Confident	79.2	Confident	130 Å²	130	95 Å²	95	57%	0.565	49%	0.485	S	S	*	.			trans	-88.4	155.4	178.4	-68.5	-179.5	-177.3	176.7	0	110.8	L139 D142 Q146	L139-K144 HydrophobicContact CB-CB 4.47Å; L139-K144 HydrophobicContact CD2-CB 3.9Å; L139-K144 HydrophobicContact CD2-CD 4.04Å; L139-K144 PolarHBondContact O-N 3.19Å; D142-K144 HydrophobicContact CB-CG 4.42Å; D142-K144 PolarHBondContact O-N 3.22Å; K144-Q146 PolarHBondContact O-N 2.92Å
145	P	71.4	Confident	79	Confident	107 Å²	107	92.3 Å²	92.3	70%	0.695	47%	0.473	S	S	*	.			trans	-54.8	138.4	171.5	21	-30.5	0	0	0	110.3	D147	P145-D147 PolarHBondContact O-N 3.36Å
146	Q	65.8	Low	79	Confident	94 Å²	94	90.8 Å²	90.8	44%	0.439	47%	0.466	S	S	.	.			trans	-77.7	5.7	-177.4	-77.2	176.8	20.8	0	0	113.6	K140 K144 V148	K140-Q146 HydrophobicContact CB-CG 4.33Å; K144-Q146 PolarHBondContact O-N 2.92Å; Q146-V148 VanDerWaalsContact O-CG2 3.26Å; Q146-V148 WeakPolarHBondContact O-CG2 3.33Å; Q146-V148 PolarHBondContact O-N 3.23Å
147	D	66.2	Low	79	Confident	136 Å²	136	94.2 Å²	94.2	73%	0.727	48%	0.477	S	S	*	.			trans	-68.4	114.9	179.1	-159.3	29.1	0	0	0	108.4	P145	P145-D147 PolarHBondContact O-N 3.36Å
148	V	68.6	Low	79	Confident	16 Å²	16	90.8 Å²	90.8	10%	0.097	46%	0.464	C	S	.	.			trans	-113.1	144.4	179	-151	0	0	0	0	108.1	K135 K136 L139 Q146 E150 D151	K135-V148 HydrophobicContact CB-CG1 4.26Å; K135-V148 HydrophobicContact CD-CG1 3.91Å; K136-V148 HydrophobicContact CD-CG2 4.26Å; K136-V148 HydrophobicContact CG-CG2 3.39Å; L139-V148 HydrophobicContact CD1-CG2 3.94Å; Q146-V148 VanDerWaalsContact O-CG2 3.26Å; Q146-V148 WeakPolarHBondContact O-CG2 3.33Å; Q146-V148 PolarHBondContact O-N 3.23Å; V148-E150 WeakPolarHBondContact CG1-OE2 3.45Å; V148-E150 PolarHBondContact O-N 3.37Å; V148-D151 PolarHBondContact N-OD2 2.93Å; V148-D151 VanDerWaalsContact O-CB 3.26Å; V148-D151 WeakPolarHBondContact O-CB 3.45Å; V148-D151 PolarHBondContact O-N 3.08Å
149	E	67.4	Low	79.2	Confident	140 Å²	140	87.7 Å²	87.7	65%	0.654	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-55.1	-27.3	179.7	-168.6	176.9	-177.7	0	0	113	D151 M155	E149-D151 VanDerWaalsContact C-N 3.29Å; E149-D151 PolarHBondContact O-N 3.49Å; E149-M155 HydrophobicContact CG-CE 3.84Å; E149-M155 VanDerWaalsContact O-CB 3.23Å; E149-M155 WeakPolarHBondContact O-CB 3.41Å; E149-M155 VanDerWaalsContact OE1-CE 3.27Å; E149-M155 WeakPolarHBondContact OE1-CE 3.48Å
150	E	65.8	Low	79.4	Confident	34 Å²	34	86.9 Å²	86.9	16%	0.159	45%	0.45	C	S	.	.	G	3₁₀ helix	trans	-81.1	4.8	174.5	-57.8	94.3	158.4	0	0	115.2	V132 K135 V148 D152	V132-E150 HydrophobicContact CG2-CB 3.47Å; V132-E150 VanDerWaalsContact CG2-CB 3.47Å; V132-E150 HydrophobicContact CG2-CG 3.91Å; K135-E150 IonicContact NZ-OE1 3.49Å; K135-E150 PolarHBondContact NZ-OE1 2.92Å; K135-E150 IonicContact NZ-OE2 3.35Å; V148-E150 WeakPolarHBondContact CG1-OE2 3.45Å; V148-E150 PolarHBondContact O-N 3.37Å; E150-D152 VanDerWaalsContact C-N 3.31Å
151	D	69.8	Low	79.6	Confident	65 Å²	65	83.5 Å²	83.5	35%	0.348	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-78.1	-19.9	168.7	-74.1	-29.6	0	0	0	112.4	K136 V148 E149 P153	K136-D151 WeakPolarHBondContact CE-OD1 3.41Å; K136-D151 WeakPolarHBondContact CE-OD2 3.32Å; K136-D151 IonicContact NZ-OD1 2.7Å; K136-D151 PolarHBondContact NZ-OD1 3.39Å; K136-D151 IonicContact NZ-OD2 3.45Å; K136-D151 PolarHBondContact NZ-OD2 3.46Å; V148-D151 PolarHBondContact N-OD2 2.93Å; V148-D151 VanDerWaalsContact O-CB 3.26Å; V148-D151 WeakPolarHBondContact O-CB 3.45Å; V148-D151 PolarHBondContact O-N 3.08Å; E149-D151 VanDerWaalsContact C-N 3.29Å; E149-D151 PolarHBondContact O-N 3.49Å; D151-P153 WeakPolarHBondContact O-CD 3.32Å
152	D	81.4	Confident	79.6	Confident	78 Å²	78	82 Å²	82	42%	0.417	43%	0.427	S	S	.	.	S	Bend	trans	-68.5	124.5	165.2	179.8	-85.6	0	0	0	110	E150 D154 M155 F156	E150-D152 VanDerWaalsContact C-N 3.31Å; D152-D154 PolarHBondContact O-N 3.47Å; D152-D154 WeakPolarHBondContact OD1-CA 3.48Å; D152-D154 VanDerWaalsContact OD1-CB 3.25Å; D152-D154 WeakPolarHBondContact OD1-CB 3.4Å; D152-D154 PolarHBondContact OD1-N 2.98Å; D152-M155 HydrophobicContact CB-CB 4.12Å; D152-M155 HydrophobicContact CB-CG 4Å; D152-M155 PolarHBondContact O-N 3.21Å; D152-M155 VanDerWaalsContact O-N 3.17Å; D152-M155 PolarHBondContact OD1-N 3.45Å; D152-F156 PolarHBondContact O-N 2.9Å
153	P	83.4	Confident	80	Confident	79 Å²	79	79.2 Å²	79.2	51%	0.513	41%	0.412	S	S	.	.	H	α-helix	trans	-59.2	-30.5	-177.2	-27.1	35.4	0	0	0	114.5	D151 R157	D151-P153 WeakPolarHBondContact O-CD 3.32Å; P153-R157 WeakPolarHBondContact O-CG 3.46Å; P153-R157 PolarHBondContact O-N 2.98Å; P153-R157 VanDerWaalsContact O-N 3.13Å; P153-R157 PolarHBondContact O-NH1 3.47Å
154	D	84.6	Confident	80.8	Confident	84 Å²	84	76 Å²	76	45%	0.449	38%	0.378	S	S	.	.	H	α-helix	trans	-73.5	-41.9	177.6	-79.8	-68.5	0	0	0	111.3	D152 F156 R157 Q158	D152-D154 PolarHBondContact O-N 3.47Å; D152-D154 WeakPolarHBondContact OD1-CA 3.48Å; D152-D154 VanDerWaalsContact OD1-CB 3.25Å; D152-D154 WeakPolarHBondContact OD1-CB 3.4Å; D152-D154 PolarHBondContact OD1-N 2.98Å; D154-F156 VanDerWaalsContact C-N 3.34Å; D154-F156 PolarHBondContact O-N 3.46Å; D154-R157 PolarHBondContact O-N 3.31Å; D154-R157 IonicContact OD1-CZ 2.87Å; D154-R157 IonicContact OD1-NE 3.54Å; D154-R157 IonicContact OD1-NH2 2.66Å; D154-R157 PolarHBondContact OD1-NH2 3.45Å; D154-R157 IonicContact OD2-NH2 3.53Å; D154-R157 PolarHBondContact OD2-NH2 3.13Å; D154-R157 VanDerWaalsContact OD2-NH2 3.14Å; D154-Q158 WeakPolarHBondContact O-CG 3.33Å; D154-Q158 PolarHBondContact O-N 3.25Å
155	M	85.8	Confident	81.2	Confident	60 Å²	60	70.9 Å²	70.9	30%	0.296	36%	0.356	S	S	.	.	H	α-helix	trans	-64.9	-39.4	176.3	-66.6	-58.5	-75.4	0	0	111.9	E149 D152 Q158 A159	E149-M155 HydrophobicContact CG-CE 3.84Å; E149-M155 VanDerWaalsContact O-CB 3.23Å; E149-M155 WeakPolarHBondContact O-CB 3.41Å; E149-M155 VanDerWaalsContact OE1-CE 3.27Å; E149-M155 WeakPolarHBondContact OE1-CE 3.48Å; D152-M155 HydrophobicContact CB-CB 4.12Å; D152-M155 HydrophobicContact CB-CG 4Å; D152-M155 PolarHBondContact O-N 3.21Å; D152-M155 VanDerWaalsContact O-N 3.17Å; D152-M155 PolarHBondContact OD1-N 3.45Å; M155-Q158 PolarHBondContact O-N 2.99Å; M155-A159 WeakPolarHBondContact O-CB 3.41Å; M155-A159 PolarHBondContact O-N 2.95Å
156	F	87.6	Confident	82.1	Confident	51 Å²	51	70.9 Å²	70.9	22%	0.224	35%	0.345	C	S	.	.	H	α-helix	trans	-60.5	-49	172.4	-177.8	-99.1	0	0	0	111.7	K125 V128 E129 D152 D154 Q158 A159 V160	K125-F156 HydrophobicContact CG-CZ 4.3Å; V128-F156 HydrophobicContact CB-CE2 4.38Å; V128-F156 HydrophobicContact CG1-CD2 3.88Å; V128-F156 HydrophobicContact CG1-CE2 3.7Å; E129-F156 HydrophobicContact CG-CE2 3.83Å; E129-F156 HydrophobicContact CG-CZ 3.62Å; D152-F156 PolarHBondContact O-N 2.9Å; D154-F156 VanDerWaalsContact C-N 3.34Å; D154-F156 PolarHBondContact O-N 3.46Å; F156-Q158 VanDerWaalsContact C-N 3.3Å; F156-Q158 PolarHBondContact O-N 2.93Å; F156-A159 PolarHBondContact O-N 2.92Å; F156-A159 VanDerWaalsContact O-N 3.15Å; F156-V160 HydrophobicContact CD1-CG2 4.05Å; F156-V160 HydrophobicContact CE1-CG2 3.64Å; F156-V160 HydrophobicContact CE2-CG2 4.14Å; F156-V160 HydrophobicContact CG-CG2 4.47Å; F156-V160 HydrophobicContact CZ-CG2 3.68Å; F156-V160 WeakPolarHBondContact O-CG2 3.27Å; F156-V160 PolarHBondContact O-N 2.91Å
157	R	87	Confident	83.4	Confident	136 Å²	136	68 Å²	68	51%	0.513	33%	0.333	S	S	.	.	H	α-helix	trans	-56.3	-44.5	176.1	-77.8	-172.4	-66.6	-90.8	13.9	111.8	P153 D154 V160 Y161	P153-R157 WeakPolarHBondContact O-CG 3.46Å; P153-R157 PolarHBondContact O-N 2.98Å; P153-R157 VanDerWaalsContact O-N 3.13Å; P153-R157 PolarHBondContact O-NH1 3.47Å; D154-R157 PolarHBondContact O-N 3.31Å; D154-R157 IonicContact OD1-CZ 2.87Å; D154-R157 IonicContact OD1-NE 3.54Å; D154-R157 IonicContact OD1-NH2 2.66Å; D154-R157 PolarHBondContact OD1-NH2 3.45Å; D154-R157 IonicContact OD2-NH2 3.53Å; D154-R157 PolarHBondContact OD2-NH2 3.13Å; D154-R157 VanDerWaalsContact OD2-NH2 3.14Å; R157-V160 PolarHBondContact O-N 3.16Å; R157-Y161 WeakPolarHBondContact O-CB 3.36Å; R157-Y161 PolarHBondContact O-N 3.12Å
158	Q	87.8	Confident	84.7	Confident	91 Å²	91	62.6 Å²	62.6	43%	0.425	30%	0.303	S	S	.	.	H	α-helix	trans	-65	-39.8	177.6	-71.4	178.9	34.1	0	0	112.7	D154 M155 F156 Y161 K162	D154-Q158 WeakPolarHBondContact O-CG 3.33Å; D154-Q158 PolarHBondContact O-N 3.25Å; M155-Q158 PolarHBondContact O-N 2.99Å; F156-Q158 VanDerWaalsContact C-N 3.3Å; F156-Q158 PolarHBondContact O-N 2.93Å; Q158-Y161 PolarHBondContact O-N 3.21Å; Q158-K162 WeakPolarHBondContact O-CB 3.3Å; Q158-K162 VanDerWaalsContact O-CG 3.29Å; Q158-K162 WeakPolarHBondContact O-CG 3.4Å; Q158-K162 PolarHBondContact O-N 2.96Å
159	A	89.3	Confident	85.7	Confident	27 Å²	27	62.6 Å²	62.6	22%	0.223	30%	0.304	C	S	.	.	H	α-helix	trans	-64.7	-46	176.7	0	0	0	0	0	111.3	V128 M155 F156 Y161 K162 Q163	V128-A159 HydrophobicContact CG1-CB 3.8Å; V128-A159 HydrophobicContact CG2-CB 4.34Å; M155-A159 WeakPolarHBondContact O-CB 3.41Å; M155-A159 PolarHBondContact O-N 2.95Å; F156-A159 PolarHBondContact O-N 2.92Å; F156-A159 VanDerWaalsContact O-N 3.15Å; A159-Y161 VanDerWaalsContact C-N 3.34Å; A159-Y161 PolarHBondContact O-N 3Å; A159-K162 PolarHBondContact O-N 3.47Å; A159-Q163 WeakPolarHBondContact O-CB 3.42Å; A159-Q163 PolarHBondContact O-N 3.33Å
160	V	90.7	Very high	86.9	Confident	21 Å²	21	59.4 Å²	59.4	13%	0.127	29%	0.29	C	S	.	.	H	α-helix	trans	-59.9	-45.1	175.1	174.3	0	0	0	0	110.7	K125 V128 F156 R157 Q163 T164	K125-V160 HydrophobicContact CB-CG1 4.05Å; K125-V160 HydrophobicContact CB-CG2 4.5Å; K125-V160 HydrophobicContact CG-CG2 4.39Å; V128-V160 HydrophobicContact CB-CG2 3.95Å; V128-V160 HydrophobicContact CG1-CG2 4.06Å; V128-V160 HydrophobicContact CG2-CG2 4.15Å; F156-V160 HydrophobicContact CD1-CG2 4.05Å; F156-V160 HydrophobicContact CE1-CG2 3.64Å; F156-V160 HydrophobicContact CE2-CG2 4.14Å; F156-V160 HydrophobicContact CG-CG2 4.47Å; F156-V160 HydrophobicContact CZ-CG2 3.68Å; F156-V160 WeakPolarHBondContact O-CG2 3.27Å; F156-V160 PolarHBondContact O-N 2.91Å; R157-V160 PolarHBondContact O-N 3.16Å; V160-Q163 PolarHBondContact O-N 3.45Å; V160-T164 WeakPolarHBondContact O-CB 3.33Å; V160-T164 PolarHBondContact O-N 2.76Å; V160-T164 PolarHBondContact O-OG1 2.85Å
161	Y	88.6	Confident	88	Confident	78 Å²	78	62 Å²	62	31%	0.306	30%	0.304	S	S	.	.	H	α-helix	trans	-57.6	-52.2	176	175	-96.6	0	0	0	111.9	E58 R157 Q158 A159 Q163 T164 M165	E58-Y161 VanDerWaalsContact CD-CE2 3.47Å; E58-Y161 HydrophobicContact CG-CE2 4.1Å; E58-Y161 WeakPolarHBondContact OE1-CE2 3.34Å; E58-Y161 WeakPolarHBondContact OE2-CE2 3.37Å; R157-Y161 WeakPolarHBondContact O-CB 3.36Å; R157-Y161 PolarHBondContact O-N 3.12Å; Q158-Y161 PolarHBondContact O-N 3.21Å; A159-Y161 VanDerWaalsContact C-N 3.34Å; A159-Y161 PolarHBondContact O-N 3Å; Y161-Q163 VanDerWaalsContact C-N 3.34Å; Y161-Q163 PolarHBondContact O-N 3.43Å; Y161-T164 PolarHBondContact O-N 2.94Å; Y161-M165 HydrophobicContact CD1-CG 4.39Å; Y161-M165 HydrophobicContact CE1-CG 3.98Å; Y161-M165 HydrophobicContact CE2-CE 4.27Å; Y161-M165 HydrophobicContact CE2-CG 4.13Å; Y161-M165 HydrophobicContact CE2-SD 4.32Å; Y161-M165 WeakPolarHBondContact O-CG 3.35Å; Y161-M165 PolarHBondContact O-N 3.23Å
162	K	89.8	Confident	89	Confident	136 Å²	136	60.7 Å²	60.7	59%	0.591	30%	0.296	S	S	*	.	H	α-helix	trans	-58.8	-45.1	179.4	-74.4	171	-176.2	170.5	0	111.6	Q158 A159 K166	Q158-K162 WeakPolarHBondContact O-CB 3.3Å; Q158-K162 VanDerWaalsContact O-CG 3.29Å; Q158-K162 WeakPolarHBondContact O-CG 3.4Å; Q158-K162 PolarHBondContact O-N 2.96Å; A159-K162 PolarHBondContact O-N 3.47Å; K162-K166 PolarHBondContact O-N 2.95Å; K162-K166 VanDerWaalsContact O-N 3.13Å
163	Q	91.9	Very high	89.5	Confident	28 Å²	28	60.6 Å²	60.6	13%	0.131	30%	0.295	C	S	.	.	H	α-helix	trans	-66.7	-42.7	179.7	-176.1	62.3	18.1	0	0	111.8	Y127 V128 A159 V160 Y161 K166 L167	Y127-Q163 HydrophobicContact CD1-CG 3.54Å; Y127-Q163 HydrophobicContact CE1-CG 4.23Å; Y127-Q163 HydrophobicContact CG-CG 4.09Å; V128-Q163 HydrophobicContact CG2-CB 3.82Å; V128-Q163 HydrophobicContact CG2-CG 4.24Å; A159-Q163 WeakPolarHBondContact O-CB 3.42Å; A159-Q163 PolarHBondContact O-N 3.33Å; V160-Q163 PolarHBondContact O-N 3.45Å; Y161-Q163 VanDerWaalsContact C-N 3.34Å; Y161-Q163 PolarHBondContact O-N 3.43Å; Q163-K166 WeakPolarHBondContact O-CB 3.27Å; Q163-K166 PolarHBondContact O-N 3.44Å; Q163-L167 WeakPolarHBondContact O-CG 3.49Å; Q163-L167 PolarHBondContact O-N 2.83Å
164	T	92.1	Very high	89.9	Confident	6 Å²	6	62.3 Å²	62.3	4%	0.037	29%	0.294	C	S	.	.	H	α-helix	trans	-61	-47.8	177.8	-62	0	0	0	0	111.1	I121 V160 Y161 K166 L167 F168	I121-T164 HydrophobicContact CB-CG2 4.25Å; I121-T164 HydrophobicContact CG1-CG2 3.73Å; I121-T164 HydrophobicContact CG2-CG2 4.47Å; V160-T164 WeakPolarHBondContact O-CB 3.33Å; V160-T164 PolarHBondContact O-N 2.76Å; V160-T164 PolarHBondContact O-OG1 2.85Å; Y161-T164 PolarHBondContact O-N 2.94Å; T164-K166 VanDerWaalsContact C-N 3.27Å; T164-K166 PolarHBondContact O-N 3.3Å; T164-L167 PolarHBondContact O-N 3.15Å; T164-L167 VanDerWaalsContact O-N 3.14Å; T164-F168 HydrophobicContact CG2-CD2 3.85Å; T164-F168 HydrophobicContact CG2-CE2 3.7Å; T164-F168 WeakPolarHBondContact O-CD2 3.33Å; T164-F168 PolarHBondContact O-N 2.71Å
165	M	89.7	Confident	90.2	Very high	21 Å²	21	63 Å²	63	10%	0.103	29%	0.29	C	S	.	.	H	α-helix	trans	-56.5	-41.9	175	-71	-58.4	99.8	0	0	112.1	F52 N55 E58 Y161 F168 A169	F52-M165 HydrophobicContact CD1-SD 4.27Å; N55-M165 HydrophobicContact CB-CE 3.47Å; N55-M165 VanDerWaalsContact CB-CE 3.47Å; N55-M165 HydrophobicContact CB-SD 4.47Å; N55-M165 WeakPolarHBondContact ND2-CE 3.46Å; E58-M165 HydrophobicContact CG-CE 3.8Å; Y161-M165 HydrophobicContact CD1-CG 4.39Å; Y161-M165 HydrophobicContact CE1-CG 3.98Å; Y161-M165 HydrophobicContact CE2-CE 4.27Å; Y161-M165 HydrophobicContact CE2-CG 4.13Å; Y161-M165 HydrophobicContact CE2-SD 4.32Å; Y161-M165 WeakPolarHBondContact O-CG 3.35Å; Y161-M165 PolarHBondContact O-N 3.23Å; M165-F168 PolarHBondContact O-N 2.7Å; M165-A169 WeakPolarHBondContact O-CB 3.45Å; M165-A169 PolarHBondContact O-N 3.35Å
166	K	91.1	Very high	90.4	Very high	107 Å²	107	65.8 Å²	65.8	47%	0.465	30%	0.301	S	S	.	.	H	α-helix	trans	-61.8	-44.7	176.6	-179.6	178.8	172.2	-179	0	111.8	K162 Q163 T164 A169 E170	K162-K166 PolarHBondContact O-N 2.95Å; K162-K166 VanDerWaalsContact O-N 3.13Å; Q163-K166 WeakPolarHBondContact O-CB 3.27Å; Q163-K166 PolarHBondContact O-N 3.44Å; T164-K166 VanDerWaalsContact C-N 3.27Å; T164-K166 PolarHBondContact O-N 3.3Å; K166-A169 PolarHBondContact O-N 3Å; K166-E170 WeakPolarHBondContact CE-OE1 3.28Å; K166-E170 WeakPolarHBondContact O-CG 3.36Å; K166-E170 PolarHBondContact O-N 3.4Å
167	L	92.7	Very high	90.6	Very high	35 Å²	35	69.1 Å²	69.1	18%	0.183	32%	0.317	C	S	.	.	H	α-helix	trans	-62.5	-44.5	178.3	-68.8	176.5	0	0	0	112.3	V120 A123 Q163 T164 A169 E170 L171	V120-L167 HydrophobicContact CG1-CB 3.83Å; A123-L167 HydrophobicContact CB-CD1 4.2Å; Q163-L167 WeakPolarHBondContact O-CG 3.49Å; Q163-L167 PolarHBondContact O-N 2.83Å; T164-L167 PolarHBondContact O-N 3.15Å; T164-L167 VanDerWaalsContact O-N 3.14Å; L167-A169 VanDerWaalsContact C-N 3.32Å; L167-A169 PolarHBondContact O-N 3.34Å; L167-E170 PolarHBondContact O-N 2.91Å; L167-L171 WeakPolarHBondContact O-CG 3.44Å; L167-L171 PolarHBondContact O-N 3.49Å
168	F	93.3	Very high	91	Very high	21 Å²	21	70.8 Å²	70.8	9%	0.092	32%	0.323	C	S	.	.	H	α-helix	trans	-59	-43.4	174.3	-84.9	-77.3	0	0	0	111.8	L54 N55 A117 V120 I121 T164 M165 L171 E172	L54-F168 HydrophobicContact CB-CB 3.98Å; L54-F168 HydrophobicContact CB-CD1 4.49Å; N55-F168 HydrophobicContact CB-CD2 4Å; N55-F168 HydrophobicContact CB-CE2 3.95Å; N55-F168 HydrophobicContact CB-CG 4.41Å; N55-F168 HydrophobicContact CB-CZ 4.3Å; A117-F168 HydrophobicContact CB-CE1 4.38Å; A117-F168 HydrophobicContact CB-CZ 4.2Å; V120-F168 HydrophobicContact CB-CE1 4.3Å; V120-F168 HydrophobicContact CB-CE2 4.04Å; V120-F168 HydrophobicContact CB-CZ 3.88Å; V120-F168 HydrophobicContact CG1-CD1 4.25Å; V120-F168 HydrophobicContact CG1-CD2 3.63Å; V120-F168 HydrophobicContact CG1-CE1 4.17Å; V120-F168 HydrophobicContact CG1-CE2 3.53Å; V120-F168 HydrophobicContact CG1-CG 3.99Å; V120-F168 HydrophobicContact CG1-CZ 3.82Å; I121-F168 HydrophobicContact CG1-CE2 3.88Å; I121-F168 HydrophobicContact CG1-CZ 4.25Å; T164-F168 HydrophobicContact CG2-CD2 3.85Å; T164-F168 HydrophobicContact CG2-CE2 3.7Å; T164-F168 WeakPolarHBondContact O-CD2 3.33Å; T164-F168 PolarHBondContact O-N 2.71Å; M165-F168 PolarHBondContact O-N 2.7Å; F168-L171 PolarHBondContact O-N 2.97Å; F168-E172 WeakPolarHBondContact O-CB 3.26Å; F168-E172 PolarHBondContact O-N 2.95Å
169	A	90.9	Very high	91.2	Very high	16 Å²	16	70.5 Å²	70.5	13%	0.132	32%	0.322	C	S	.	.	H	α-helix	trans	-62.8	-44.2	177.1	0	0	0	0	0	112.5	Y51 L54 M165 K166 L167 L171 E172 I173	Y51-A169 HydrophobicContact CD1-CB 3.75Å; Y51-A169 HydrophobicContact CE1-CB 4.23Å; L54-A169 HydrophobicContact CD1-CB 4.4Å; M165-A169 WeakPolarHBondContact O-CB 3.45Å; M165-A169 PolarHBondContact O-N 3.35Å; K166-A169 PolarHBondContact O-N 3Å; L167-A169 VanDerWaalsContact C-N 3.32Å; L167-A169 PolarHBondContact O-N 3.34Å; A169-L171 PolarHBondContact O-N 3.31Å; A169-E172 PolarHBondContact O-N 3.46Å; A169-I173 VanDerWaalsContact O-CG1 3.26Å; A169-I173 WeakPolarHBondContact O-CG1 3.4Å; A169-I173 PolarHBondContact O-N 2.92Å
170	E	90.6	Very high	91.4	Very high	74 Å²	74	72 Å²	72	35%	0.346	34%	0.335	S	S	.	.	H	α-helix	trans	-62.9	-40.5	177.2	-73.9	177.9	-169.7	0	0	112.3	K166 L167 I173 K174	K166-E170 WeakPolarHBondContact CE-OE1 3.28Å; K166-E170 WeakPolarHBondContact O-CG 3.36Å; K166-E170 PolarHBondContact O-N 3.4Å; L167-E170 PolarHBondContact O-N 2.91Å; E170-I173 PolarHBondContact O-N 3.06Å; E170-K174 WeakPolarHBondContact O-CB 3.29Å; E170-K174 WeakPolarHBondContact O-CG 3.39Å; E170-K174 PolarHBondContact O-N 3.15Å
171	L	90.9	Very high	91.6	Very high	89 Å²	89	77.4 Å²	77.4	47%	0.466	36%	0.356	S	S	.	.	H	α-helix	trans	-65.9	-40.6	176.5	-71.8	174	0	0	0	112	V120 L167 F168 A169 K174 R175	V120-L171 HydrophobicContact CB-CD1 4.49Å; V120-L171 HydrophobicContact CG1-CD1 4.2Å; V120-L171 HydrophobicContact CG2-CD1 3.39Å; L167-L171 WeakPolarHBondContact O-CG 3.44Å; L167-L171 PolarHBondContact O-N 3.49Å; F168-L171 PolarHBondContact O-N 2.97Å; A169-L171 PolarHBondContact O-N 3.31Å; L171-K174 PolarHBondContact O-N 3.03Å; L171-R175 WeakPolarHBondContact O-CB 3.42Å; L171-R175 PolarHBondContact O-N 2.78Å
172	E	90.6	Very high	92	Very high	37 Å²	37	79.6 Å²	79.6	17%	0.173	37%	0.369	C	S	.	.	H	α-helix	trans	-65.3	-42.4	176.1	-176.8	67.9	-165.3	0	0	111.6	L54 F168 A169 R175 K176	L54-E172 HydrophobicContact CD1-CB 3.72Å; L54-E172 HydrophobicContact CD1-CG 4.09Å; L54-E172 HydrophobicContact CD2-CB 3.98Å; L54-E172 HydrophobicContact CD2-CG 3.67Å; F168-E172 WeakPolarHBondContact O-CB 3.26Å; F168-E172 PolarHBondContact O-N 2.95Å; A169-E172 PolarHBondContact O-N 3.46Å; E172-R175 PolarHBondContact O-N 3.17Å; E172-R175 IonicContact OE1-CZ 3.66Å; E172-R175 VanDerWaalsContact OE1-CZ 3.31Å; E172-R175 IonicContact OE1-NH1 3.76Å; E172-R175 PolarHBondContact OE1-NH1 2.89Å; E172-R175 IonicContact OE1-NH2 3.14Å; E172-R175 PolarHBondContact OE1-NH2 3.27Å; E172-R175 IonicContact OE2-CZ 3.44Å; E172-R175 IonicContact OE2-NH1 3.54Å; E172-R175 PolarHBondContact OE2-NH1 3.28Å; E172-R175 IonicContact OE2-NH2 2.61Å; E172-K176 WeakPolarHBondContact O-CG 3.47Å; E172-K176 PolarHBondContact O-N 3.43Å; E172-K176 VanDerWaalsContact OE1-CE 3.27Å; E172-K176 WeakPolarHBondContact OE1-CE 2.97Å
173	I	90.7	Very high	92.1	Very high	76 Å²	76	78.5 Å²	78.5	39%	0.39	37%	0.368	S	S	.	.	H	α-helix	trans	-59.8	-50.7	174.7	-69.6	164.7	0	0	0	109.8	A169 E170 R175 K176 E177	A169-I173 VanDerWaalsContact O-CG1 3.26Å; A169-I173 WeakPolarHBondContact O-CG1 3.4Å; A169-I173 PolarHBondContact O-N 2.92Å; E170-I173 PolarHBondContact O-N 3.06Å; I173-R175 VanDerWaalsContact C-N 3.26Å; I173-R175 PolarHBondContact O-N 3Å; I173-K176 PolarHBondContact O-N 2.9Å; I173-K176 VanDerWaalsContact O-N 3.17Å; I173-E177 HydrophobicContact CG2-CG 4.36Å; I173-E177 WeakPolarHBondContact O-CG 3.27Å; I173-E177 PolarHBondContact O-N 3.12Å
174	K	91.9	Very high	92.3	Very high	114 Å²	114	83.1 Å²	83.1	50%	0.496	39%	0.389	S	S	.	.	H	α-helix	trans	-60	-34.6	177.6	-76.6	175.3	179.8	169.7	0	112.8	E170 L171 R178	E170-K174 WeakPolarHBondContact O-CB 3.29Å; E170-K174 WeakPolarHBondContact O-CG 3.39Å; E170-K174 PolarHBondContact O-N 3.15Å; L171-K174 PolarHBondContact O-N 3.03Å; K174-R178 WeakPolarHBondContact O-CB 3.34Å; K174-R178 PolarHBondContact O-N 2.67Å; K174-R178 VanDerWaalsContact O-N 3.12Å
175	R	92	Very high	92.5	Very high	98 Å²	98	87 Å²	87	37%	0.37	41%	0.406	S	S	.	.	H	α-helix	trans	-65.6	-49.8	175.5	-162.6	-168.3	81.5	-132.2	-16.8	110.6	L171 E172 I173 E177 R178 E179	L171-R175 WeakPolarHBondContact O-CB 3.42Å; L171-R175 PolarHBondContact O-N 2.78Å; E172-R175 PolarHBondContact O-N 3.17Å; E172-R175 IonicContact OE1-CZ 3.66Å; E172-R175 VanDerWaalsContact OE1-CZ 3.31Å; E172-R175 IonicContact OE1-NH1 3.76Å; E172-R175 PolarHBondContact OE1-NH1 2.89Å; E172-R175 IonicContact OE1-NH2 3.14Å; E172-R175 PolarHBondContact OE1-NH2 3.27Å; E172-R175 IonicContact OE2-CZ 3.44Å; E172-R175 IonicContact OE2-NH1 3.54Å; E172-R175 PolarHBondContact OE2-NH1 3.28Å; E172-R175 IonicContact OE2-NH2 2.61Å; I173-R175 VanDerWaalsContact C-N 3.26Å; I173-R175 PolarHBondContact O-N 3Å; R175-E177 VanDerWaalsContact C-N 3.34Å; R175-E177 PolarHBondContact O-N 2.93Å; R175-R178 WeakPolarHBondContact O-CB 3.39Å; R175-R178 PolarHBondContact O-N 3.18Å; R175-E179 WeakPolarHBondContact CD-OE1 3.43Å; R175-E179 WeakPolarHBondContact CG-OE1 3.47Å; R175-E179 IonicContact CZ-OE1 3.4Å; R175-E179 IonicContact NE-OE1 3.96Å; R175-E179 PolarHBondContact NE-OE1 3.46Å; R175-E179 WeakPolarHBondContact O-CG 3.35Å; R175-E179 PolarHBondContact O-N 3.44Å
176	K	89.9	Confident	92.7	Very high	120 Å²	120	93.2 Å²	93.2	52%	0.522	43%	0.429	S	S	.	.	H	α-helix	trans	-61.5	-40.9	178.5	-71.8	-178	-176.3	-179.4	0	112.4	E172 I173 R178 E179 A180	E172-K176 WeakPolarHBondContact O-CG 3.47Å; E172-K176 PolarHBondContact O-N 3.43Å; E172-K176 VanDerWaalsContact OE1-CE 3.27Å; E172-K176 WeakPolarHBondContact OE1-CE 2.97Å; I173-K176 PolarHBondContact O-N 2.9Å; I173-K176 VanDerWaalsContact O-N 3.17Å; K176-R178 VanDerWaalsContact C-N 3.33Å; K176-R178 PolarHBondContact O-N 3.48Å; K176-E179 PolarHBondContact O-N 3.43Å; K176-A180 VanDerWaalsContact O-CB 3.27Å; K176-A180 WeakPolarHBondContact O-CB 3.45Å; K176-A180 PolarHBondContact O-N 2.86Å
177	E	92	Very high	93	Very high	120 Å²	120	93.5 Å²	93.5	56%	0.561	43%	0.43	S	S	*	.	H	α-helix	trans	-61.2	-42.3	175.2	-73.9	174.5	169.3	0	0	111.8	I173 R175 A180 K181	I173-E177 HydrophobicContact CG2-CG 4.36Å; I173-E177 WeakPolarHBondContact O-CG 3.27Å; I173-E177 PolarHBondContact O-N 3.12Å; R175-E177 VanDerWaalsContact C-N 3.34Å; R175-E177 PolarHBondContact O-N 2.93Å; E177-A180 PolarHBondContact O-N 2.93Å; E177-K181 WeakPolarHBondContact O-CB 3.38Å; E177-K181 PolarHBondContact O-N 3.46Å
178	R	94.1	Very high	93.2	Very high	171 Å²	171	97.9 Å²	97.9	65%	0.645	44%	0.444	S	S	*	.	H	α-helix	trans	-64.7	-47.8	176.8	-169.7	-172.3	-52.2	148.2	6.8	111.8	K174 R175 K176 A180 K181 E182	K174-R178 WeakPolarHBondContact O-CB 3.34Å; K174-R178 PolarHBondContact O-N 2.67Å; K174-R178 VanDerWaalsContact O-N 3.12Å; R175-R178 WeakPolarHBondContact O-CB 3.39Å; R175-R178 PolarHBondContact O-N 3.18Å; K176-R178 VanDerWaalsContact C-N 3.33Å; K176-R178 PolarHBondContact O-N 3.48Å; R178-A180 VanDerWaalsContact C-N 3.32Å; R178-A180 PolarHBondContact O-N 2.96Å; R178-K181 PolarHBondContact O-N 2.91Å; R178-E182 WeakPolarHBondContact O-CB 3.43Å; R178-E182 PolarHBondContact O-N 3.43Å
179	E	92.1	Very high	93.3	Very high	86 Å²	86	99.4 Å²	99.4	40%	0.402	46%	0.461	S	S	.	.	H	α-helix	trans	-59.7	-42.9	176.4	-71.8	166.7	-173	0	0	111.2	R175 K176 E182 M183	R175-E179 WeakPolarHBondContact CD-OE1 3.43Å; R175-E179 WeakPolarHBondContact CG-OE1 3.47Å; R175-E179 IonicContact CZ-OE1 3.4Å; R175-E179 IonicContact NE-OE1 3.96Å; R175-E179 PolarHBondContact NE-OE1 3.46Å; R175-E179 WeakPolarHBondContact O-CG 3.35Å; R175-E179 PolarHBondContact O-N 3.44Å; K176-E179 PolarHBondContact O-N 3.43Å; E179-E182 PolarHBondContact O-N 2.91Å; E179-M183 WeakPolarHBondContact O-CB 3.27Å; E179-M183 VanDerWaalsContact O-CG 3.27Å; E179-M183 WeakPolarHBondContact O-CG 3.42Å; E179-M183 PolarHBondContact O-N 3.27Å
180	A	94.8	Very high	93.6	Very high	59 Å²	59	104.4 Å²	104.4	49%	0.488	48%	0.476	S	S	.	.	H	α-helix	trans	-64.2	-43.1	177.5	0	0	0	0	0	111.5	K176 E177 R178 M183 H184	K176-A180 VanDerWaalsContact O-CB 3.27Å; K176-A180 WeakPolarHBondContact O-CB 3.45Å; K176-A180 PolarHBondContact O-N 2.86Å; E177-A180 PolarHBondContact O-N 2.93Å; R178-A180 VanDerWaalsContact C-N 3.32Å; R178-A180 PolarHBondContact O-N 2.96Å; A180-M183 PolarHBondContact O-N 3.31Å; A180-H184 WeakPolarHBondContact O-CB 3.4Å; A180-H184 PolarHBondContact O-N 2.94Å
181	K	94.9	Very high	93.8	Very high	134 Å²	134	105.9 Å²	105.9	58%	0.583	48%	0.483	S	S	*	.	H	α-helix	trans	-62	-47.2	176.5	-175.7	179.7	175.3	-176.4	0	111.6	E177 R178 M183 H184 E185	E177-K181 WeakPolarHBondContact O-CB 3.38Å; E177-K181 PolarHBondContact O-N 3.46Å; R178-K181 PolarHBondContact O-N 2.91Å; K181-M183 PolarHBondContact O-N 2.84Å; K181-H184 PolarHBondContact O-N 3.41Å; K181-E185 WeakPolarHBondContact CE-OE1 3.32Å; K181-E185 WeakPolarHBondContact O-CG 3.35Å; K181-E185 PolarHBondContact O-N 2.95Å
182	E	95.2	Very high	94	Very high	124 Å²	124	107.5 Å²	107.5	58%	0.579	49%	0.488	S	S	*	.	H	α-helix	trans	-61.6	-43.9	177.7	-174.8	-177.6	167.1	0	0	111.5	R178 E179 H184 E185 R186	R178-E182 WeakPolarHBondContact O-CB 3.43Å; R178-E182 PolarHBondContact O-N 3.43Å; E179-E182 PolarHBondContact O-N 2.91Å; E182-H184 VanDerWaalsContact C-N 3.31Å; E182-H184 PolarHBondContact O-N 3.43Å; E182-E185 PolarHBondContact O-N 3.49Å; E182-R186 VanDerWaalsContact O-CB 3.32Å; E182-R186 WeakPolarHBondContact O-CB 3.44Å; E182-R186 PolarHBondContact O-N 3.43Å
183	M	93.8	Very high	94.3	Very high	113 Å²	113	112.3 Å²	112.3	56%	0.557	51%	0.51	S	S	*	.	H	α-helix	trans	-60.8	-40.4	175	-77.6	-64.6	-66.7	0	0	112.1	E179 A180 K181 K187	E179-M183 WeakPolarHBondContact O-CB 3.27Å; E179-M183 VanDerWaalsContact O-CG 3.27Å; E179-M183 WeakPolarHBondContact O-CG 3.42Å; E179-M183 PolarHBondContact O-N 3.27Å; A180-M183 PolarHBondContact O-N 3.31Å; K181-M183 PolarHBondContact O-N 2.84Å; M183-K187 WeakPolarHBondContact O-CB 3.05Å; M183-K187 PolarHBondContact O-N 3.04Å
184	H	95	Very high	94.6	Very high	125 Å²	125	113.5 Å²	113.5	58%	0.579	52%	0.517	S	S	*	.	H	α-helix	trans	-69.1	-39.1	178.1	-138.3	-62.7	0	0	0	112.2	A180 K181 E182 K187 R188	A180-H184 WeakPolarHBondContact O-CB 3.4Å; A180-H184 PolarHBondContact O-N 2.94Å; K181-H184 PolarHBondContact O-N 3.41Å; E182-H184 VanDerWaalsContact C-N 3.31Å; E182-H184 PolarHBondContact O-N 3.43Å; H184-K187 PolarHBondContact O-N 3.2Å; H184-R188 WeakPolarHBondContact O-CG 3.43Å; H184-R188 PolarHBondContact O-N 3.42Å
185	E	95.5	Very high	94.8	Very high	86 Å²	86	114.5 Å²	114.5	40%	0.402	52%	0.523	S	S	.	.	H	α-helix	trans	-64.1	-46.5	173.2	-77.3	172.4	-176	0	0	111.4	K181 E182 K187 R188 A189	K181-E185 WeakPolarHBondContact CE-OE1 3.32Å; K181-E185 WeakPolarHBondContact O-CG 3.35Å; K181-E185 PolarHBondContact O-N 2.95Å; E182-E185 PolarHBondContact O-N 3.49Å; E185-K187 VanDerWaalsContact C-N 3.26Å; E185-K187 PolarHBondContact O-N 2.88Å; E185-R188 PolarHBondContact O-N 3.02Å; E185-A189 WeakPolarHBondContact O-CB 3.45Å; E185-A189 PolarHBondContact O-N 3.42Å
186	R	95.6	Very high	95	Very high	153 Å²	153	112.6 Å²	112.6	58%	0.577	53%	0.529	S	S	*	.	H	α-helix	trans	-62.8	-32.3	176	-173.6	176.3	179.7	-174.9	1.8	112.9	E182 R190	E182-R186 VanDerWaalsContact O-CB 3.32Å; E182-R186 WeakPolarHBondContact O-CB 3.44Å; E182-R186 PolarHBondContact O-N 3.43Å; R186-R190 WeakPolarHBondContact O-CG 3.46Å; R186-R190 PolarHBondContact O-N 3.33Å; R186-R190 PolarHBondContact O-NE 2.88Å
187	K	96.1	Very high	95.3	Very high	113 Å²	113	109.8 Å²	109.8	49%	0.491	53%	0.528	S	S	.	.	H	α-helix	trans	-68.6	-49.6	174.1	-173.1	179.2	175.9	-173	0	110.8	M183 H184 E185 A189 R190 E191	M183-K187 WeakPolarHBondContact O-CB 3.05Å; M183-K187 PolarHBondContact O-N 3.04Å; H184-K187 PolarHBondContact O-N 3.2Å; E185-K187 VanDerWaalsContact C-N 3.26Å; E185-K187 PolarHBondContact O-N 2.88Å; K187-A189 PolarHBondContact O-N 3.3Å; K187-R190 PolarHBondContact O-N 3.01Å; K187-E191 WeakPolarHBondContact CE-OE1 3.49Å; K187-E191 WeakPolarHBondContact O-CG 3.11Å; K187-E191 PolarHBondContact O-N 2.87Å
188	R	96.6	Very high	95.5	Very high	126 Å²	126	109.5 Å²	109.5	48%	0.475	53%	0.526	S	S	.	.	H	α-helix	trans	-58.5	-46.1	176.8	-73.3	-171.4	-65.4	162	-0.1	112.2	H184 E185 R190 E191 E192	H184-R188 WeakPolarHBondContact O-CG 3.43Å; H184-R188 PolarHBondContact O-N 3.42Å; E185-R188 PolarHBondContact O-N 3.02Å; R188-R190 VanDerWaalsContact C-N 3.29Å; R188-R190 PolarHBondContact O-N 3.21Å; R188-E191 PolarHBondContact O-N 3.23Å; R188-E191 VanDerWaalsContact O-N 3.13Å; R188-E192 WeakPolarHBondContact O-CG 3.47Å; R188-E192 PolarHBondContact O-N 3.13Å
189	A	96.9	Very high	95.6	Very high	53 Å²	53	107.9 Å²	107.9	44%	0.438	52%	0.524	S	S	.	.	H	α-helix	trans	-59.1	-39.2	178.2	0	0	0	0	0	112.5	E185 K187 E193	E185-A189 WeakPolarHBondContact O-CB 3.45Å; E185-A189 PolarHBondContact O-N 3.42Å; K187-A189 PolarHBondContact O-N 3.3Å; A189-E193 WeakPolarHBondContact O-CB 3.38Å; A189-E193 PolarHBondContact O-N 2.9Å
190	R	95.3	Very high	95.8	Very high	122 Å²	122	105.3 Å²	105.3	46%	0.46	52%	0.517	S	S	.	.	H	α-helix	trans	-68.6	-39.8	175.2	-79.3	-171.2	-79.9	-175.5	-3.1	112.6	R186 K187 R188 E193 I194	R186-R190 WeakPolarHBondContact O-CG 3.46Å; R186-R190 PolarHBondContact O-N 3.33Å; R186-R190 PolarHBondContact O-NE 2.88Å; K187-R190 PolarHBondContact O-N 3.01Å; R188-R190 VanDerWaalsContact C-N 3.29Å; R188-R190 PolarHBondContact O-N 3.21Å; R190-E193 PolarHBondContact O-N 3.31Å; R190-I194 WeakPolarHBondContact O-CD1 3.22Å; R190-I194 VanDerWaalsContact O-CG1 3.24Å; R190-I194 WeakPolarHBondContact O-CG1 3.48Å; R190-I194 PolarHBondContact O-N 3.45Å
191	E	95.2	Very high	95.9	Very high	104 Å²	104	108.4 Å²	108.4	49%	0.486	52%	0.52	S	S	.	.	H	α-helix	trans	-63.6	-44.1	175.6	-72.1	170.9	178.2	0	0	111.1	K187 R188 I194 E195	K187-E191 WeakPolarHBondContact CE-OE1 3.49Å; K187-E191 WeakPolarHBondContact O-CG 3.11Å; K187-E191 PolarHBondContact O-N 2.87Å; R188-E191 PolarHBondContact O-N 3.23Å; R188-E191 VanDerWaalsContact O-N 3.13Å; E191-I194 PolarHBondContact O-N 3.46Å; E191-E195 WeakPolarHBondContact O-CB 3.24Å; E191-E195 PolarHBondContact O-N 2.94Å
192	E	96.5	Very high	96	Very high	124 Å²	124	109.4 Å²	109.4	58%	0.579	52%	0.52	S	S	*	.	H	α-helix	trans	-63	-40	175.1	-72.3	173.4	-170.1	0	0	112.2	R188 E195 A196	R188-E192 WeakPolarHBondContact O-CG 3.47Å; R188-E192 PolarHBondContact O-N 3.13Å; E192-E195 PolarHBondContact O-N 2.84Å; E192-A196 VanDerWaalsContact O-CB 3.22Å; E192-A196 WeakPolarHBondContact O-CB 3.4Å; E192-A196 PolarHBondContact O-N 3.43Å
193	E	96.1	Very high	95.9	Very high	137 Å²	137	109.5 Å²	109.5	64%	0.64	52%	0.52	S	S	*	.	H	α-helix	trans	-63.2	-44.3	175.4	-175.5	-178	-179.1	0	0	111.6	A189 R190 A196 A197	A189-E193 WeakPolarHBondContact O-CB 3.38Å; A189-E193 PolarHBondContact O-N 2.9Å; R190-E193 PolarHBondContact O-N 3.31Å; E193-A196 PolarHBondContact O-N 2.86Å; E193-A197 WeakPolarHBondContact O-CB 3.47Å; E193-A197 PolarHBondContact O-N 3.23Å
194	I	96.5	Very high	96	Very high	102 Å²	102	113.1 Å²	113.1	52%	0.523	53%	0.528	S	S	.	.	H	α-helix	trans	-62.9	-47.2	176.4	-69	164.5	0	0	0	110.1	R190 E191 A196 A197 E198	R190-I194 WeakPolarHBondContact O-CD1 3.22Å; R190-I194 VanDerWaalsContact O-CG1 3.24Å; R190-I194 WeakPolarHBondContact O-CG1 3.48Å; R190-I194 PolarHBondContact O-N 3.45Å; E191-I194 PolarHBondContact O-N 3.46Å; I194-A196 VanDerWaalsContact C-N 3.35Å; I194-A196 PolarHBondContact O-N 3.33Å; I194-A197 PolarHBondContact O-N 2.89Å; I194-E198 WeakPolarHBondContact O-CG 3.12Å; I194-E198 PolarHBondContact O-N 3.43Å
195	E	96.1	Very high	95.9	Very high	134 Å²	134	112 Å²	112	63%	0.626	52%	0.523	S	S	*	.	H	α-helix	trans	-62.7	-41.9	178.7	-173.4	179.7	-177.6	0	0	111.6	E191 E192 A197 E198 K199	E191-E195 WeakPolarHBondContact O-CB 3.24Å; E191-E195 PolarHBondContact O-N 2.94Å; E192-E195 PolarHBondContact O-N 2.84Å; E195-A197 VanDerWaalsContact C-N 3.35Å; E195-A197 PolarHBondContact O-N 3.15Å; E195-E198 PolarHBondContact O-N 2.88Å; E195-K199 VanDerWaalsContact O-CB 3.3Å; E195-K199 WeakPolarHBondContact O-CB 3.33Å; E195-K199 PolarHBondContact O-N 2.84Å
196	A	96.6	Very high	95.8	Very high	59 Å²	59	114.9 Å²	114.9	49%	0.488	53%	0.53	S	S	.	.	H	α-helix	trans	-63.5	-41	175.7	0	0	0	0	0	111.6	E192 E193 I194 K199 A200	E192-A196 VanDerWaalsContact O-CB 3.22Å; E192-A196 WeakPolarHBondContact O-CB 3.4Å; E192-A196 PolarHBondContact O-N 3.43Å; E193-A196 PolarHBondContact O-N 2.86Å; I194-A196 VanDerWaalsContact C-N 3.35Å; I194-A196 PolarHBondContact O-N 3.33Å; A196-K199 PolarHBondContact O-N 3.35Å; A196-A200 VanDerWaalsContact O-CB 3.25Å; A196-A200 WeakPolarHBondContact O-CB 3.3Å; A196-A200 PolarHBondContact O-N 3.35Å
197	A	96.3	Very high	95.6	Very high	61 Å²	61	111.2 Å²	111.2	50%	0.504	52%	0.52	S	S	.	.	H	α-helix	trans	-64.9	-43.2	175.5	0	0	0	0	0	111.8	E193 I194 E195 A200 K201	E193-A197 WeakPolarHBondContact O-CB 3.47Å; E193-A197 PolarHBondContact O-N 3.23Å; I194-A197 PolarHBondContact O-N 2.89Å; E195-A197 VanDerWaalsContact C-N 3.35Å; E195-A197 PolarHBondContact O-N 3.15Å; A197-A200 PolarHBondContact O-N 2.88Å; A197-K201 WeakPolarHBondContact O-CB 3.26Å; A197-K201 PolarHBondContact O-N 3.34Å
198	E	96.7	Very high	95.5	Very high	113 Å²	113	111.9 Å²	111.9	53%	0.528	52%	0.522	S	S	.	.	H	α-helix	trans	-63.2	-43	174.7	-75.8	-166.6	166.5	0	0	111.9	I194 E195 K201 R202	I194-E198 WeakPolarHBondContact O-CG 3.12Å; I194-E198 PolarHBondContact O-N 3.43Å; E195-E198 PolarHBondContact O-N 2.88Å; E198-K201 PolarHBondContact O-N 3.46Å; E198-R202 WeakPolarHBondContact O-CB 3.32Å; E198-R202 PolarHBondContact O-N 3.43Å
199	K	95.9	Very high	95.2	Very high	138 Å²	138	110.3 Å²	110.3	60%	0.6	52%	0.524	S	S	*	.	H	α-helix	trans	-64.7	-45.3	177.1	-173.8	-179.7	177.6	-176.1	0	111.3	E195 A196 K201 R202 E203	E195-K199 VanDerWaalsContact O-CB 3.3Å; E195-K199 WeakPolarHBondContact O-CB 3.33Å; E195-K199 PolarHBondContact O-N 2.84Å; A196-K199 PolarHBondContact O-N 3.35Å; K199-K201 VanDerWaalsContact C-N 3.3Å; K199-K201 PolarHBondContact O-N 2.85Å; K199-R202 PolarHBondContact O-N 3.09Å; K199-E203 WeakPolarHBondContact O-CB 3.41Å; K199-E203 PolarHBondContact O-N 3.39Å
200	A	96.3	Very high	94.8	Very high	31 Å²	31	111.7 Å²	111.7	26%	0.256	52%	0.52	S	S	.	.	H	α-helix	trans	-63	-38.2	176.2	0	0	0	0	0	111.5	A196 A197 E203 R204	A196-A200 VanDerWaalsContact O-CB 3.25Å; A196-A200 WeakPolarHBondContact O-CB 3.3Å; A196-A200 PolarHBondContact O-N 3.35Å; A197-A200 PolarHBondContact O-N 2.88Å; A200-E203 PolarHBondContact O-N 3.47Å; A200-R204 WeakPolarHBondContact O-CB 3.42Å; A200-R204 VanDerWaalsContact O-CG 3.26Å; A200-R204 WeakPolarHBondContact O-CG 3.31Å; A200-R204 PolarHBondContact O-N 3.5Å
201	K	96.9	Very high	94.4	Very high	125 Å²	125	111 Å²	111	54%	0.543	52%	0.522	S	S	.	.	H	α-helix	trans	-62.5	-48.4	173.1	-175.6	-178.2	174.5	-171.9	0	111.1	A197 E198 K199 E203 R204 E205	A197-K201 WeakPolarHBondContact O-CB 3.26Å; A197-K201 PolarHBondContact O-N 3.34Å; E198-K201 PolarHBondContact O-N 3.46Å; K199-K201 VanDerWaalsContact C-N 3.3Å; K199-K201 PolarHBondContact O-N 2.85Å; K201-E203 VanDerWaalsContact C-N 3.3Å; K201-E203 PolarHBondContact O-N 2.86Å; K201-R204 PolarHBondContact O-N 3.16Å; K201-E205 WeakPolarHBondContact CE-OE1 3.47Å; K201-E205 WeakPolarHBondContact O-CG 2.93Å; K201-E205 PolarHBondContact O-N 3.24Å
202	R	95.9	Very high	93.9	Very high	155 Å²	155	112 Å²	112	59%	0.585	53%	0.527	S	S	*	.	H	α-helix	trans	-60	-40.2	177.6	-168.5	-175.6	-60.9	132.6	5.4	112	E198 K199 W206	E198-R202 WeakPolarHBondContact O-CB 3.32Å; E198-R202 PolarHBondContact O-N 3.43Å; K199-R202 PolarHBondContact O-N 3.09Å; R202-W206 VanDerWaalsContact O-CB 3.31Å; R202-W206 WeakPolarHBondContact O-CB 3.25Å; R202-W206 PolarHBondContact O-N 2.92Å
203	E	94.8	Very high	93.4	Very high	126 Å²	126	109.4 Å²	109.4	59%	0.589	52%	0.522	S	S	*	.	H	α-helix	trans	-68.4	-42.6	177.2	-174.3	168.7	-156.7	0	0	111.9	K199 A200 K201 W206 Q207	K199-E203 WeakPolarHBondContact O-CB 3.41Å; K199-E203 PolarHBondContact O-N 3.39Å; A200-E203 PolarHBondContact O-N 3.47Å; K201-E203 VanDerWaalsContact C-N 3.3Å; K201-E203 PolarHBondContact O-N 2.86Å; E203-W206 PolarHBondContact O-N 3.44Å; E203-Q207 VanDerWaalsContact O-CB 3.31Å; E203-Q207 WeakPolarHBondContact O-CB 3.3Å; E203-Q207 PolarHBondContact O-N 3.06Å
204	R	94.8	Very high	92.7	Very high	188 Å²	188	110.1 Å²	110.1	71%	0.709	52%	0.519	S	S	*	.	H	α-helix	trans	-61	-44.6	173.6	-73.8	174.1	-165.6	158.7	5	112	A200 K201 Q207 K208	A200-R204 WeakPolarHBondContact O-CB 3.42Å; A200-R204 VanDerWaalsContact O-CG 3.26Å; A200-R204 WeakPolarHBondContact O-CG 3.31Å; A200-R204 PolarHBondContact O-N 3.5Å; K201-R204 PolarHBondContact O-N 3.16Å; R204-Q207 PolarHBondContact O-N 2.89Å; R204-K208 WeakPolarHBondContact O-CB 3.31Å; R204-K208 PolarHBondContact O-N 3.44Å
205	E	94	Very high	91.6	Very high	101 Å²	101	110.1 Å²	110.1	47%	0.472	52%	0.52	S	S	.	.	H	α-helix	trans	-63.3	-43.6	176.4	-74.4	174.9	-179	0	0	111.3	K201 K208 N209	K201-E205 WeakPolarHBondContact CE-OE1 3.47Å; K201-E205 WeakPolarHBondContact O-CG 2.93Å; K201-E205 PolarHBondContact O-N 3.24Å; E205-K208 PolarHBondContact O-N 3.3Å; E205-N209 WeakPolarHBondContact O-CB 3.42Å; E205-N209 PolarHBondContact O-N 2.96Å; E205-N209 PolarHBondContact O-ND2 3.26Å; E205-N209 PolarHBondContact O-OD1 2.93Å
206	W	93.3	Very high	90.8	Very high	148 Å²	148	106.2 Å²	106.2	56%	0.561	52%	0.515	S	S	*	.	H	α-helix	trans	-60.9	-46.3	174.8	179.5	87.6	0	0	0	112	R202 E203 N209 F210	R202-W206 VanDerWaalsContact O-CB 3.31Å; R202-W206 WeakPolarHBondContact O-CB 3.25Å; R202-W206 PolarHBondContact O-N 2.92Å; E203-W206 PolarHBondContact O-N 3.44Å; W206-N209 PolarHBondContact O-N 3.45Å; W206-F210 HydrophobicContact CH2-CB 4.45Å; W206-F210 AromaticContact CH2-CD2 3.87Å; W206-F210 HydrophobicContact CH2-CD2 3.87Å; W206-F210 HydrophobicContact CH2-CE2 4.23Å; W206-F210 HydrophobicContact CH2-CG 4.14Å; W206-F210 AromaticContact CZ2-CD2 3.83Å; W206-F210 HydrophobicContact CZ2-CD2 3.83Å; W206-F210 HydrophobicContact CZ2-CE2 4.35Å; W206-F210 HydrophobicContact CZ2-CG 4.39Å; W206-F210 HydrophobicContact CZ3-CB 4.45Å; W206-F210 HydrophobicContact CZ3-CG 4.47Å; W206-F210 VanDerWaalsContact O-CB 3.3Å; W206-F210 WeakPolarHBondContact O-CB 3.37Å; W206-F210 PolarHBondContact O-N 2.94Å
207	Q	90.9	Very high	90	Very high	76 Å²	76	108.5 Å²	108.5	36%	0.355	51%	0.511	S	S	.	.	H	α-helix	trans	-62.2	-45	179.8	-174.6	67.6	12	0	0	111	E203 R204 F210 E211	E203-Q207 VanDerWaalsContact O-CB 3.31Å; E203-Q207 WeakPolarHBondContact O-CB 3.3Å; E203-Q207 PolarHBondContact O-N 3.06Å; R204-Q207 PolarHBondContact O-N 2.89Å; Q207-F210 WeakPolarHBondContact O-CB 3.42Å; Q207-F210 PolarHBondContact O-N 2.82Å; Q207-E211 PolarHBondContact NE2-OE1 2.97Å; Q207-E211 WeakPolarHBondContact O-CB 3.48Å; Q207-E211 WeakPolarHBondContact O-CG 3.47Å; Q207-E211 PolarHBondContact O-N 3.4Å
208	K	93.7	Very high	89.1	Confident	126 Å²	126	107.9 Å²	107.9	55%	0.548	50%	0.501	S	S	.	.	H	α-helix	trans	-58.4	-50.2	175.1	-176.6	179.2	172.9	-176.5	0	111	R204 E205 F210 E211 E212	R204-K208 WeakPolarHBondContact O-CB 3.31Å; R204-K208 PolarHBondContact O-N 3.44Å; E205-K208 PolarHBondContact O-N 3.3Å; K208-F210 VanDerWaalsContact C-N 3.29Å; K208-F210 PolarHBondContact O-N 3.32Å; K208-E211 PolarHBondContact O-N 2.82Å; K208-E212 WeakPolarHBondContact CE-OE1 3.37Å; K208-E212 IonicContact NZ-OE1 3.04Å; K208-E212 WeakPolarHBondContact O-CB 3.47Å; K208-E212 WeakPolarHBondContact O-CG 3.33Å; K208-E212 PolarHBondContact O-N 3.14Å
209	N	90.2	Very high	88	Confident	94 Å²	94	106.4 Å²	106.4	50%	0.503	50%	0.497	S	S	.	.	H	α-helix	trans	-61.7	-36.7	177.9	-68.8	-7.9	0	0	0	112.3	E205 W206 S213	E205-N209 WeakPolarHBondContact O-CB 3.42Å; E205-N209 PolarHBondContact O-N 2.96Å; E205-N209 PolarHBondContact O-ND2 3.26Å; E205-N209 PolarHBondContact O-OD1 2.93Å; W206-N209 PolarHBondContact O-N 3.45Å; N209-S213 WeakPolarHBondContact O-CB 3.47Å; N209-S213 PolarHBondContact O-N 2.91Å; N209-S213 PolarHBondContact O-OG 3.23Å
210	F	89.6	Confident	87.3	Confident	82 Å²	82	103.6 Å²	103.6	36%	0.36	50%	0.495	S	S	.	.	H	α-helix	trans	-66.6	-43.8	176.5	-177.9	-91.3	0	0	0	111.6	W206 Q207 K208 S213 R214 R217	W206-F210 HydrophobicContact CH2-CB 4.45Å; W206-F210 AromaticContact CH2-CD2 3.87Å; W206-F210 HydrophobicContact CH2-CD2 3.87Å; W206-F210 HydrophobicContact CH2-CE2 4.23Å; W206-F210 HydrophobicContact CH2-CG 4.14Å; W206-F210 AromaticContact CZ2-CD2 3.83Å; W206-F210 HydrophobicContact CZ2-CD2 3.83Å; W206-F210 HydrophobicContact CZ2-CE2 4.35Å; W206-F210 HydrophobicContact CZ2-CG 4.39Å; W206-F210 HydrophobicContact CZ3-CB 4.45Å; W206-F210 HydrophobicContact CZ3-CG 4.47Å; W206-F210 VanDerWaalsContact O-CB 3.3Å; W206-F210 WeakPolarHBondContact O-CB 3.37Å; W206-F210 PolarHBondContact O-N 2.94Å; Q207-F210 WeakPolarHBondContact O-CB 3.42Å; Q207-F210 PolarHBondContact O-N 2.82Å; K208-F210 VanDerWaalsContact C-N 3.29Å; K208-F210 PolarHBondContact O-N 3.32Å; F210-S213 CarbonylContact O-C 3.59Å; F210-S213 PolarHBondContact O-N 3.38Å; F210-R214 PolarHBondContact O-N 2.87Å; F210-R217 VanDerWaalsContact CD1-NH2 3.29Å; F210-R217 VanDerWaalsContact CE2-NH2 3.33Å; F210-R217 VanDerWaalsContact CZ-NH2 3.25Å; F210-R217 PolarHBondContact O-NH2 3.5Å
211	E	86.1	Confident	86.2	Confident	108 Å²	108	108.9 Å²	108.9	51%	0.505	51%	0.508	S	S	.	.	H	α-helix	trans	-68.9	-41.8	177.7	-75.5	178	-169.6	0	0	112.3	Q207 K208 S213 R214	Q207-E211 PolarHBondContact NE2-OE1 2.97Å; Q207-E211 WeakPolarHBondContact O-CB 3.48Å; Q207-E211 WeakPolarHBondContact O-CG 3.47Å; Q207-E211 PolarHBondContact O-N 3.4Å; K208-E211 PolarHBondContact O-N 2.82Å; E211-S213 VanDerWaalsContact C-N 3.27Å; E211-S213 PolarHBondContact O-N 3.06Å; E211-R214 WeakPolarHBondContact O-CA 3.22Å; E211-R214 WeakPolarHBondContact O-CB 3.44Å; E211-R214 PolarHBondContact O-N 3.34Å
212	E	84.7	Confident	85.2	Confident	125 Å²	125	109.8 Å²	109.8	58%	0.584	51%	0.508	S	S	*	.	H	α-helix	trans	-62.5	-36.6	173.6	-72.4	175	178.7	0	0	111.6	K208 R214	K208-E212 WeakPolarHBondContact CE-OE1 3.37Å; K208-E212 IonicContact NZ-OE1 3.04Å; K208-E212 WeakPolarHBondContact O-CB 3.47Å; K208-E212 WeakPolarHBondContact O-CG 3.33Å; K208-E212 PolarHBondContact O-N 3.14Å; E212-R214 PolarHBondContact O-N 3.23Å
213	S	86.4	Confident	84	Confident	69 Å²	69	106.2 Å²	106.2	48%	0.483	50%	0.503	S	S	.	.	H	α-helix	trans	-76.3	0	172.3	-59.2	0	0	0	0	113.5	N209 F210 E211 R217	N209-S213 WeakPolarHBondContact O-CB 3.47Å; N209-S213 PolarHBondContact O-N 2.91Å; N209-S213 PolarHBondContact O-OG 3.23Å; F210-S213 CarbonylContact O-C 3.59Å; F210-S213 PolarHBondContact O-N 3.38Å; E211-S213 VanDerWaalsContact C-N 3.27Å; E211-S213 PolarHBondContact O-N 3.06Å; S213-R217 WeakPolarHBondContact O-CB 2.94Å; S213-R217 WeakPolarHBondContact O-CG 3.36Å; S213-R217 PolarHBondContact O-N 3.42Å; S213-R217 PolarHBondContact O-NE 2.88Å; S213-R217 VanDerWaalsContact O-NE 3.08Å
214	R	81.4	Confident	83	Confident	151 Å²	151	106.7 Å²	106.7	57%	0.57	50%	0.504	S	S	*	.	H	α-helix	trans	-70.8	-46.3	-177.5	-167.9	179.2	87.4	156	3.7	111.6	F210 E211 E212 G216 R217 V218	F210-R214 PolarHBondContact O-N 2.87Å; E211-R214 WeakPolarHBondContact O-CA 3.22Å; E211-R214 WeakPolarHBondContact O-CB 3.44Å; E211-R214 PolarHBondContact O-N 3.34Å; E212-R214 PolarHBondContact O-N 3.23Å; R214-G216 PolarHBondContact O-N 3.19Å; R214-R217 PolarHBondContact O-N 2.9Å; R214-R217 VanDerWaalsContact O-N 3.13Å; R214-V218 HydrophobicContact CG-CG2 4.17Å; R214-V218 WeakPolarHBondContact O-CB 3.29Å; R214-V218 VanDerWaalsContact O-CG2 3.29Å; R214-V218 WeakPolarHBondContact O-CG2 3.43Å; R214-V218 PolarHBondContact O-N 3.14Å
215	D	73.7	Confident	82	Confident	103 Å²	103	103.2 Å²	103.2	55%	0.551	50%	0.496	S	S	*	.	H	α-helix	trans	-64.8	-43.5	-176.6	-74.2	-11.8	0	0	0	111.1	R217 V218 D219	D215-R217 VanDerWaalsContact C-N 3.3Å; D215-R217 PolarHBondContact O-N 3.49Å; D215-V218 PolarHBondContact O-N 3.29Å; D215-D219 WeakPolarHBondContact O-CB 3.5Å; D215-D219 PolarHBondContact O-N 2.9Å
216	G	78.1	Confident	80.7	Confident	51 Å²	51	103.7 Å²	103.7	53%	0.526	51%	0.506	S	S	.	.	H	α-helix	trans	-60.8	-36	172.7	0	0	0	0	0	113.6	R214 S220	R214-G216 PolarHBondContact O-N 3.19Å; G216-S220 VanDerWaalsContact O-CB 3.29Å; G216-S220 WeakPolarHBondContact O-CB 3.39Å; G216-S220 PolarHBondContact O-N 3.23Å
217	R	81.5	Confident	79	Confident	108 Å²	108	104.6 Å²	104.6	41%	0.408	51%	0.514	S	S	.	.	H	α-helix	trans	-71.3	-42.1	175	-76.2	-177.4	-65.7	165.7	-1.9	112.4	F210 S213 R214 D215 S220 W221	F210-R217 VanDerWaalsContact CD1-NH2 3.29Å; F210-R217 VanDerWaalsContact CE2-NH2 3.33Å; F210-R217 VanDerWaalsContact CZ-NH2 3.25Å; F210-R217 PolarHBondContact O-NH2 3.5Å; S213-R217 WeakPolarHBondContact O-CB 2.94Å; S213-R217 WeakPolarHBondContact O-CG 3.36Å; S213-R217 PolarHBondContact O-N 3.42Å; S213-R217 PolarHBondContact O-NE 2.88Å; S213-R217 VanDerWaalsContact O-NE 3.08Å; R214-R217 PolarHBondContact O-N 2.9Å; R214-R217 VanDerWaalsContact O-N 3.13Å; D215-R217 VanDerWaalsContact C-N 3.3Å; D215-R217 PolarHBondContact O-N 3.49Å; R217-S220 PolarHBondContact O-N 3.32Å; R217-W221 WeakPolarHBondContact O-CB 3.29Å; R217-W221 PolarHBondContact O-N 2.73Å
218	V	76.4	Confident	77.3	Confident	48 Å²	48	104 Å²	104	29%	0.291	53%	0.528	S	S	.	.	H	α-helix	trans	-64.8	-42.5	177.5	171.4	0	0	0	0	110.2	R214 D215 W221 R222	R214-V218 HydrophobicContact CG-CG2 4.17Å; R214-V218 WeakPolarHBondContact O-CB 3.29Å; R214-V218 VanDerWaalsContact O-CG2 3.29Å; R214-V218 WeakPolarHBondContact O-CG2 3.43Å; R214-V218 PolarHBondContact O-N 3.14Å; D215-V218 PolarHBondContact O-N 3.29Å; V218-W221 PolarHBondContact O-N 2.81Å; V218-R222 HydrophobicContact CG1-CG 4.45Å; V218-R222 VanDerWaalsContact CG1-CZ 3.44Å; V218-R222 WeakPolarHBondContact O-CG 3.32Å; V218-R222 PolarHBondContact O-N 2.98Å
219	D	73.8	Confident	75.4	Confident	81 Å²	81	107.7 Å²	107.7	43%	0.433	54%	0.544	S	S	.	.	H	α-helix	trans	-69.8	-38.9	177.9	-72.1	-18.5	0	0	0	112.1	D215 W221 R222 T223	D215-D219 WeakPolarHBondContact O-CB 3.5Å; D215-D219 PolarHBondContact O-N 2.9Å; D219-W221 VanDerWaalsContact C-N 3.28Å; D219-W221 PolarHBondContact O-N 3.23Å; D219-R222 PolarHBondContact O-N 3.08Å; D219-R222 IonicContact OD1-NH1 3.12Å; D219-R222 PolarHBondContact OD1-NH1 2.84Å; D219-R222 VanDerWaalsContact OD1-NH1 3.12Å; D219-T223 WeakPolarHBondContact O-CB 3.46Å; D219-T223 PolarHBondContact O-N 3.12Å; D219-T223 PolarHBondContact O-OG1 2.9Å
220	S	80.4	Confident	73.4	Confident	80 Å²	80	108.2 Å²	108.2	56%	0.559	56%	0.555	S	S	*	*	H	α-helix	trans	-60.5	-38	169.5	-178.2	0	0	0	0	112	G216 R217 F224	G216-S220 VanDerWaalsContact O-CB 3.29Å; G216-S220 WeakPolarHBondContact O-CB 3.39Å; G216-S220 PolarHBondContact O-N 3.23Å; R217-S220 PolarHBondContact O-N 3.32Å; S220-F224 WeakPolarHBondContact O-CB 3.4Å; S220-F224 PolarHBondContact O-N 3.43Å
221	W	73.9	Confident	71.4	Confident	142 Å²	142	114 Å²	114	54%	0.538	58%	0.58	S	S	.	*	H	α-helix	trans	-71.8	-42.5	178.2	-179.7	93.5	0	0	0	112.2	R217 V218 D219 T223 F224 Q225	R217-W221 WeakPolarHBondContact O-CB 3.29Å; R217-W221 PolarHBondContact O-N 2.73Å; V218-W221 PolarHBondContact O-N 2.81Å; D219-W221 VanDerWaalsContact C-N 3.28Å; D219-W221 PolarHBondContact O-N 3.23Å; W221-T223 VanDerWaalsContact C-N 3.29Å; W221-T223 PolarHBondContact O-N 2.67Å; W221-F224 WeakPolarHBondContact O-CB 3.35Å; W221-F224 PolarHBondContact O-N 3.13Å; W221-Q225 HydrophobicContact CH2-CG 4.08Å; W221-Q225 HydrophobicContact CZ2-CG 4.08Å; W221-Q225 HydrophobicContact CZ3-CG 4.4Å; W221-Q225 PolarHBondContact O-N 3.47Å
222	R	75.9	Confident	69.2	Low	143 Å²	143	117.8 Å²	117.8	54%	0.54	60%	0.598	S	S	.	*	H	α-helix	trans	-59.6	-43	173.3	-74.7	175.2	178.9	145.6	-3.5	110.6	V218 D219 Q225 T226	V218-R222 HydrophobicContact CG1-CG 4.45Å; V218-R222 VanDerWaalsContact CG1-CZ 3.44Å; V218-R222 WeakPolarHBondContact O-CG 3.32Å; V218-R222 PolarHBondContact O-N 2.98Å; D219-R222 PolarHBondContact O-N 3.08Å; D219-R222 IonicContact OD1-NH1 3.12Å; D219-R222 PolarHBondContact OD1-NH1 2.84Å; D219-R222 VanDerWaalsContact OD1-NH1 3.12Å; R222-Q225 PolarHBondContact O-N 2.92Å; R222-T226 WeakPolarHBondContact O-CG2 3.38Å; R222-T226 PolarHBondContact O-N 3.4Å; R222-T226 PolarHBondContact O-OG1 2.82Å
223	T	70.8	Confident	67.8	Low	80 Å²	80	121.4 Å²	121.4	49%	0.491	61%	0.612	S	S	.	*	H	α-helix	trans	-65.6	-37.6	176.8	-50.7	0	0	0	0	111.7	D219 W221 T226 K227	D219-T223 WeakPolarHBondContact O-CB 3.46Å; D219-T223 PolarHBondContact O-N 3.12Å; D219-T223 PolarHBondContact O-OG1 2.9Å; W221-T223 VanDerWaalsContact C-N 3.29Å; W221-T223 PolarHBondContact O-N 2.67Å; T223-T226 WeakPolarHBondContact CA-OG1 3.41Å; T223-T226 PolarHBondContact O-OG1 2.91Å; T223-T226 VanDerWaalsContact O-OG1 3.06Å; T223-K227 VanDerWaalsContact O-CB 3.24Å; T223-K227 WeakPolarHBondContact O-CB 3.24Å; T223-K227 PolarHBondContact O-N 3.19Å
224	F	74.1	Confident	65.9	Low	137 Å²	137	127.6 Å²	127.6	60%	0.601	63%	0.63	S	S	*	*	H	α-helix	trans	-65	-41	173.4	176.7	-101.1	0	0	0	112.2	S220 W221 K227 G228	S220-F224 WeakPolarHBondContact O-CB 3.4Å; S220-F224 PolarHBondContact O-N 3.43Å; W221-F224 WeakPolarHBondContact O-CB 3.35Å; W221-F224 PolarHBondContact O-N 3.13Å; F224-K227 PolarHBondContact O-N 3.21Å; F224-G228 PolarHBondContact O-N 3.41Å; F224-G228 VanDerWaalsContact O-N 3.1Å
225	Q	72.5	Confident	64.1	Low	115 Å²	115	128 Å²	128	54%	0.537	64%	0.643	S	S	.	*	H	α-helix	trans	-65.7	-42.5	175.7	-107.8	-162.8	-21.3	0	0	112.8	W221 R222 K227 G228	W221-Q225 HydrophobicContact CH2-CG 4.08Å; W221-Q225 HydrophobicContact CZ2-CG 4.08Å; W221-Q225 HydrophobicContact CZ3-CG 4.4Å; W221-Q225 PolarHBondContact O-N 3.47Å; R222-Q225 PolarHBondContact O-N 2.92Å; Q225-K227 VanDerWaalsContact C-N 3.35Å; Q225-G228 PolarHBondContact O-N 2.95Å
226	T	67.5	Low	63	Low	111 Å²	111	134.1 Å²	134.1	68%	0.681	66%	0.659	S	S	*	*	H	α-helix	trans	-70.5	-31.6	178.6	55.6	0	0	0	0	112.2	R222 T223 G228	R222-T226 WeakPolarHBondContact O-CG2 3.38Å; R222-T226 PolarHBondContact O-N 3.4Å; R222-T226 PolarHBondContact O-OG1 2.82Å; T223-T226 WeakPolarHBondContact CA-OG1 3.41Å; T223-T226 PolarHBondContact O-OG1 2.91Å; T223-T226 VanDerWaalsContact O-OG1 3.06Å; T226-G228 VanDerWaalsContact C-N 3.32Å
227	K	56.9	Low	61.9	Low	167 Å²	167	135.6 Å²	135.6	73%	0.726	66%	0.66	S	S	*	*	H	α-helix	trans	-78.7	-12.4	174.7	-144	172	-168.4	176.4	0	113.7	T223 F224 Q225 K229	T223-K227 VanDerWaalsContact O-CB 3.24Å; T223-K227 WeakPolarHBondContact O-CB 3.24Å; T223-K227 PolarHBondContact O-N 3.19Å; F224-K227 PolarHBondContact O-N 3.21Å; Q225-K227 VanDerWaalsContact C-N 3.35Å; K227-K229 PolarHBondContact O-N 3.05Å
228	G	55.2	Low	60.6	Low	63 Å²	63	139.4 Å²	139.4	65%	0.649	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-0.8	177.4	0	0	0	0	0	115.9	F224 Q225 T226	F224-G228 PolarHBondContact O-N 3.41Å; F224-G228 VanDerWaalsContact O-N 3.1Å; Q225-G228 PolarHBondContact O-N 2.95Å; T226-G228 VanDerWaalsContact C-N 3.32Å
229	K	54	Low	59.5	Low	203 Å²	203	145.3 Å²	145.3	88%	0.883	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	13.7	175.3	-69.4	-166	178.7	-178.5	0	114.8	K227	K227-K229 PolarHBondContact O-N 3.05Å
230	S	47.9	Very low	58.7	Low	106 Å²	106	150.6 Å²	150.6	74%	0.741	73%	0.729	S	S	*	*	S	Bend	trans	-139.9	125.4	167.9	-172.5	0	0	0	0	111.1
231	K	48.3	Very low	57.6	Low	202 Å²	202	152.1 Å²	152.1	88%	0.878	74%	0.737	S	S	*	*			trans	-55.2	142.8	-176.6	-79.5	173.6	171.8	170.2	0	112.5
232	E	39.6	Very low	56.5	Low	188 Å²	188	151.4 Å²	151.4	88%	0.879	75%	0.75	S	S	*	*				-176	142.2	109.5	-155.3	157.4	147.1	0	0	112.6	K234	E232-K234 PolarHBondContact O-N 3.06Å
233	K	55.1	Low	55.5	Low	202 Å²	202	154.1 Å²	154.1	88%	0.878	77%	0.766	S	S	*	*			trans	-65.9	115	177.4	-75.6	175.4	174.1	175	0	111
234	K	46.2	Very low	54.7	Low	199 Å²	199	156.6 Å²	156.6	87%	0.865	78%	0.78	S	S	*	*			trans	-141	140.4	152.2	-83.5	-171.3	179	166.9	0	111.4	E232	E232-K234 PolarHBondContact O-N 3.06Å
235	N	44.8	Very low	53.5	Low	159 Å²	159	159.7 Å²	159.7	85%	0.85	79%	0.794	S	S	*	*			trans	-42.4	124.1	-167	-70.7	-21.3	0	0	0	115.3	S237	N235-S237 VanDerWaalsContact C-N 3.32Å; N235-S237 PolarHBondContact O-N 3.18Å
236	R	50.8	Low	52.3	Low	232 Å²	232	162.5 Å²	162.5	88%	0.875	81%	0.809	S	S	*	*			trans	-74.5	82.2	164.5	-83.1	-179.5	170.6	167.6	-3.7	110
237	S	54	Low	51.4	Low	81 Å²	81	166 Å²	166	57%	0.566	82%	0.817	S	S	*	*			trans	-95.8	163.3	138.2	55.3	0	0	0	0	106.9	N235	N235-S237 VanDerWaalsContact C-N 3.32Å; N235-S237 PolarHBondContact O-N 3.18Å
238	F	54	Low	51.1	Low	189 Å²	189	166.9 Å²	166.9	83%	0.829	82%	0.824	S	S	*	*			trans	87.3	50.8	-177.8	-54	-87.4	0	0	0	117.2
239	L	53.5	Low	50.5	Low	172 Å²	172	175.6 Å²	175.6	90%	0.901	84%	0.838	S	S	*	*			trans	-119.3	73.8	136.5	-81.8	155	0	0	0	107
240	K	58.3	Low	50.2	Low	192 Å²	192	178.6 Å²	178.6	84%	0.835	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-98.4	125	162.3	-84.8	-179.5	176.5	177.4	0	106.7
241	P	55.8	Low	50.3	Low	112 Å²	112	182.2 Å²	182.2	73%	0.727	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-54.9	147.5	172.3	0.8	1.8	0	0	0	109.4	K243	P241-K243 PolarHBondContact O-N 2.94Å; P241-K243 VanDerWaalsContact O-N 3.14Å
242	P	51.8	Low	50.4	Low	126 Å²	126	181.2 Å²	181.2	82%	0.818	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-56.2	124.5	178.8	22.1	-29.5	0	0	0	108.5	V244	P242-V244 PolarHBondContact O-N 3.27Å; P242-V244 VanDerWaalsContact O-N 3.14Å
243	K	55	Low	51	Low	201 Å²	201	180.8 Å²	180.8	87%	0.874	86%	0.858	S	S	*	*	P	Polyproline II helix	trans	-57	121.9	175.7	-89.7	178	171.6	-178	0	107.7	P241 K245	P241-K243 PolarHBondContact O-N 2.94Å; P241-K243 VanDerWaalsContact O-N 3.14Å; K243-K245 PolarHBondContact O-N 3.01Å
244	V	53.3	Low	50.7	Low	131 Å²	131	179.5 Å²	179.5	79%	0.794	86%	0.857	S	S	*	*			trans	-54.2	109.8	166.4	179.9	0	0	0	0	106.4	P242 M246	P242-V244 PolarHBondContact O-N 3.27Å; P242-V244 VanDerWaalsContact O-N 3.14Å; V244-M246 PolarHBondContact O-N 3.49Å
245	K	48.8	Very low	51	Low	202 Å²	202	178.3 Å²	178.3	88%	0.878	86%	0.857	S	S	*	*			trans	-67.9	104.1	166.5	-81.2	-177.6	174.9	-179.2	0	105.5	K243 E247	K243-K245 PolarHBondContact O-N 3.01Å; K245-E247 PolarHBondContact O-N 3.1Å; K245-E247 VanDerWaalsContact O-N 3.09Å
246	M	47.4	Very low	51.4	Low	175 Å²	175	179.6 Å²	179.6	86%	0.862	86%	0.857	S	S	*	*			trans	-62.3	109.1	161.4	-85.7	176.9	159	0	0	106.4	V244 Q248	V244-M246 PolarHBondContact O-N 3.49Å; M246-Q248 PolarHBondContact O-N 3.36Å; M246-Q248 VanDerWaalsContact O-N 3.16Å
247	E	48.6	Very low	51.5	Low	183 Å²	183	175.9 Å²	175.9	86%	0.855	86%	0.856	S	S	*	*			trans	-56	114.4	168.3	-164	174.8	-172.4	0	0	107.2	K245 R249	K245-E247 PolarHBondContact O-N 3.1Å; K245-E247 VanDerWaalsContact O-N 3.09Å; E247-R249 PolarHBondContact O-N 3.22Å; E247-R249 VanDerWaalsContact O-N 3.15Å
248	Q	50.7	Low	51.3	Low	187 Å²	187	183.2 Å²	183.2	87%	0.874	88%	0.878	S	S	*	*			trans	-67.5	111.5	172.5	-75.7	-174.6	-25.5	0	0	106.8	M246 E250	M246-Q248 PolarHBondContact O-N 3.36Å; M246-Q248 VanDerWaalsContact O-N 3.16Å; Q248-E250 PolarHBondContact O-N 3.3Å
249	R	41.9	Very low	51.1	Low	245 Å²	245	182.7 Å²	182.7	93%	0.925	88%	0.882	S	S	*	*			trans	-71.5	112	162	-83.9	-176.4	169.5	-164.8	-3.5	107.2	E247	E247-R249 PolarHBondContact O-N 3.22Å; E247-R249 VanDerWaalsContact O-N 3.15Å
250	E	47.9	Very low	50.9	Low	266 Å²	266	183.6 Å²	183.6	100%	1.243	88%	0.88	S	S	*	*			trans	-63.8	0	157.3	-74.2	-175.2	144.9	0	0	110.8	Q248	Q248-E250 PolarHBondContact O-N 3.3Å

Retrieved 250 of 250 residues in 140.1 ms (Link to these results)

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