A0A087Y0B0_POEFO Loading...

Vesicle transport protein USE1

AlphaFold DB , UniProt , Accession A0A087Y0B0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 277 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	44.9	Very low	38.3	Very low	215 Å²	215	102.4 Å²	102.4	100%	1.059	62%	0.618	S	S	*	*				0	-34.3	0	-128	176.4	-84.1	0	0	111.7	T3 C4	M1-T3 PolarHBondContact O-N 3.41Å; M1-C4 PolarHBondContact O-N 3.32Å
2	E	36.1	Very low	37.8	Very low	170 Å²	170	108.3 Å²	108.3	79%	0.794	62%	0.623	S	S	*	*	H	α-helix	trans	-66.7	-30.5	177.4	-67.8	-177.4	111.1	0	0	115	C4 F5 V6	E2-C4 VanDerWaalsContact C-N 3.34Å; E2-C4 PolarHBondContact O-N 2.74Å; E2-F5 PolarHBondContact O-N 2.92Å; E2-V6 PolarHBondContact O-N 3.4Å
3	T	37.9	Very low	37.9	Very low	118 Å²	118	106.5 Å²	106.5	72%	0.724	62%	0.615	S	S	*	*	H	α-helix	trans	-68.7	-30.1	178.6	46.9	0	0	0	0	113.5	M1 A7	M1-T3 PolarHBondContact O-N 3.41Å; T3-A7 PolarHBondContact O-N 3.45Å
4	C	34.7	Very low	38.3	Very low	94 Å²	94	107.4 Å²	107.4	64%	0.635	62%	0.615	S	S	*	*	H	α-helix	trans	-73.8	-30.9	173.5	-67	0	0	0	0	112.2	M1 E2 A8	M1-C4 PolarHBondContact O-N 3.32Å; E2-C4 VanDerWaalsContact C-N 3.34Å; E2-C4 PolarHBondContact O-N 2.74Å; C4-A8 WeakPolarHBondContact O-CB 3.12Å; C4-A8 PolarHBondContact O-N 3.16Å
5	F	33.1	Very low	37.9	Very low	164 Å²	164	108.3 Å²	108.3	72%	0.719	61%	0.612	S	S	*	*	H	α-helix	trans	-72.4	-37.5	179.5	-158.8	-95.3	0	0	0	111.8	E2 A8 A9	E2-F5 PolarHBondContact O-N 2.92Å; F5-A8 PolarHBondContact O-N 2.99Å; F5-A9 VanDerWaalsContact O-CB 3.27Å; F5-A9 WeakPolarHBondContact O-CB 3.36Å; F5-A9 PolarHBondContact O-N 3.33Å
6	V	42.5	Very low	37.6	Very low	103 Å²	103	108.4 Å²	108.4	62%	0.624	61%	0.609	S	S	*	*	H	α-helix	trans	-68.9	-37.3	175.4	178.3	0	0	0	0	111.6	E2 A9 A10	E2-V6 PolarHBondContact O-N 3.4Å; V6-A9 PolarHBondContact O-N 3.42Å; V6-A10 VanDerWaalsContact O-CB 3.3Å; V6-A10 WeakPolarHBondContact O-CB 2.95Å; V6-A10 PolarHBondContact O-N 3.24Å
7	A	37.4	Very low	37.6	Very low	68 Å²	68	114 Å²	114	56%	0.562	62%	0.619	S	S	*	*	H	α-helix	trans	-67.6	-39.8	174.5	0	0	0	0	0	112.1	T3 G11	T3-A7 PolarHBondContact O-N 3.45Å; A7-G11 PolarHBondContact O-N 3.49Å
8	A	37.2	Very low	37.6	Very low	60 Å²	60	115.2 Å²	115.2	50%	0.496	62%	0.619	S	S	.	*	H	α-helix	trans	-67.7	-39.7	175.1	0	0	0	0	0	112.1	C4 F5 G11 Y12	C4-A8 WeakPolarHBondContact O-CB 3.12Å; C4-A8 PolarHBondContact O-N 3.16Å; F5-A8 PolarHBondContact O-N 2.99Å; A8-G11 PolarHBondContact O-N 3.46Å; A8-Y12 WeakPolarHBondContact O-CB 3.14Å; A8-Y12 PolarHBondContact O-N 3.31Å
9	A	37.3	Very low	37.4	Very low	45 Å²	45	114.7 Å²	114.7	37%	0.372	62%	0.624	S	S	.	*	H	α-helix	trans	-68.2	-39.4	176	0	0	0	0	0	112.2	F5 V6 Y12 V13	F5-A9 VanDerWaalsContact O-CB 3.27Å; F5-A9 WeakPolarHBondContact O-CB 3.36Å; F5-A9 PolarHBondContact O-N 3.33Å; V6-A9 PolarHBondContact O-N 3.42Å; A9-Y12 PolarHBondContact O-N 3.4Å; A9-V13 WeakPolarHBondContact O-CB 3.22Å; A9-V13 VanDerWaalsContact O-CG2 3.24Å; A9-V13 WeakPolarHBondContact O-CG2 3.42Å; A9-V13 PolarHBondContact O-N 2.78Å
10	A	41.8	Very low	37.3	Very low	50 Å²	50	116.4 Å²	116.4	41%	0.413	63%	0.632	S	S	.	*	H	α-helix	trans	-65.2	-40	172.9	0	0	0	0	0	111.6	V6 V13 I14	V6-A10 VanDerWaalsContact O-CB 3.3Å; V6-A10 WeakPolarHBondContact O-CB 2.95Å; V6-A10 PolarHBondContact O-N 3.24Å; A10-V13 PolarHBondContact O-N 2.8Å; A10-I14 VanDerWaalsContact O-CG1 3.27Å; A10-I14 WeakPolarHBondContact O-CG1 3.49Å; A10-I14 PolarHBondContact O-N 3.15Å
11	G	38.6	Very low	37.6	Very low	39 Å²	39	114.3 Å²	114.3	40%	0.402	63%	0.627	S	S	.	*	H	α-helix	trans	-62.3	-41.9	172.5	0	0	0	0	0	112.6	A7 A8 I14 Q15	A7-G11 PolarHBondContact O-N 3.49Å; A8-G11 PolarHBondContact O-N 3.46Å; G11-I14 PolarHBondContact O-N 3.18Å; G11-Q15 WeakPolarHBondContact O-CB 3.34Å; G11-Q15 PolarHBondContact O-N 2.8Å
12	Y	31.7	Very low	37.6	Very low	173 Å²	173	111.1 Å²	111.1	68%	0.678	61%	0.614	S	S	*	*	H	α-helix	trans	-68.9	-37.3	177.1	-120.3	-99.1	0	0	0	112.6	A8 A9 Q15 L16	A8-Y12 WeakPolarHBondContact O-CB 3.14Å; A8-Y12 PolarHBondContact O-N 3.31Å; A9-Y12 PolarHBondContact O-N 3.4Å; Y12-Q15 PolarHBondContact O-N 3.41Å; Y12-L16 HydrophobicContact CD1-CD1 3.48Å; Y12-L16 VanDerWaalsContact CD1-CD1 3.48Å; Y12-L16 HydrophobicContact CE1-CD1 4.06Å; Y12-L16 HydrophobicContact CG-CD1 4.47Å; Y12-L16 WeakPolarHBondContact O-CB 3.29Å; Y12-L16 VanDerWaalsContact O-CD1 3.28Å; Y12-L16 WeakPolarHBondContact O-CD1 3.28Å; Y12-L16 PolarHBondContact O-N 3.29Å
13	V	39.9	Very low	38.2	Very low	86 Å²	86	111.5 Å²	111.5	52%	0.521	62%	0.618	S	S	.	*	H	α-helix	trans	-69.9	-35.8	176.4	171.5	0	0	0	0	111.5	A9 A10 R17	A9-V13 WeakPolarHBondContact O-CB 3.22Å; A9-V13 VanDerWaalsContact O-CG2 3.24Å; A9-V13 WeakPolarHBondContact O-CG2 3.42Å; A9-V13 PolarHBondContact O-N 2.78Å; A10-V13 PolarHBondContact O-N 2.8Å; V13-R17 WeakPolarHBondContact O-CB 3.49Å; V13-R17 PolarHBondContact O-N 2.92Å
14	I	43.2	Very low	39	Very low	119 Å²	119	107.3 Å²	107.3	61%	0.61	60%	0.595	S	S	*	*	H	α-helix	trans	-66.8	-39.7	171.6	-68	170	0	0	0	110.3	A10 G11 R17 H18	A10-I14 VanDerWaalsContact O-CG1 3.27Å; A10-I14 WeakPolarHBondContact O-CG1 3.49Å; A10-I14 PolarHBondContact O-N 3.15Å; G11-I14 PolarHBondContact O-N 3.18Å; I14-R17 PolarHBondContact O-N 3.4Å; I14-H18 WeakPolarHBondContact O-CB 3.27Å; I14-H18 PolarHBondContact O-N 3.47Å
15	Q	33	Very low	40.4	Very low	121 Å²	121	104.5 Å²	104.5	57%	0.565	58%	0.577	S	S	*	*	H	α-helix	trans	-74.1	-33.4	179.5	-146.8	71.6	-35.5	0	0	113.6	G11 Y12 H18 C19	G11-Q15 WeakPolarHBondContact O-CB 3.34Å; G11-Q15 PolarHBondContact O-N 2.8Å; Y12-Q15 PolarHBondContact O-N 3.41Å; Q15-H18 WeakPolarHBondContact O-CB 3.45Å; Q15-H18 PolarHBondContact O-N 3.36Å; Q15-C19 PolarHBondContact O-N 3.04Å
16	L	32.9	Very low	42	Very low	109 Å²	109	107.7 Å²	107.7	57%	0.571	58%	0.584	S	S	*	*	H	α-helix	trans	-70.3	-37	172	-98.1	106.6	0	0	0	111.9	Y12 H18 C19	Y12-L16 HydrophobicContact CD1-CD1 3.48Å; Y12-L16 VanDerWaalsContact CD1-CD1 3.48Å; Y12-L16 HydrophobicContact CE1-CD1 4.06Å; Y12-L16 HydrophobicContact CG-CD1 4.47Å; Y12-L16 WeakPolarHBondContact O-CB 3.29Å; Y12-L16 VanDerWaalsContact O-CD1 3.28Å; Y12-L16 WeakPolarHBondContact O-CD1 3.28Å; Y12-L16 PolarHBondContact O-N 3.29Å; L16-H18 PolarHBondContact O-N 2.98Å; L16-C19 PolarHBondContact O-N 3.32Å
17	R	36.9	Very low	43.3	Very low	204 Å²	204	105.3 Å²	105.3	77%	0.77	57%	0.568	S	S	*	*	H	α-helix	trans	-68.1	-21.9	172	-157.3	-176.1	-73.3	174.7	-4.2	112.2	V13 I14	V13-R17 WeakPolarHBondContact O-CB 3.49Å; V13-R17 PolarHBondContact O-N 2.92Å; I14-R17 PolarHBondContact O-N 3.4Å
18	H	37.8	Very low	44.7	Very low	136 Å²	136	102.9 Å²	102.9	63%	0.63	54%	0.544	S	S	*	.	H	α-helix	trans	-82.6	-25.7	173.8	-147.5	66.4	0	0	0	113.1	I14 Q15 L16 S21	I14-H18 WeakPolarHBondContact O-CB 3.27Å; I14-H18 PolarHBondContact O-N 3.47Å; Q15-H18 WeakPolarHBondContact O-CB 3.45Å; Q15-H18 PolarHBondContact O-N 3.36Å; L16-H18 PolarHBondContact O-N 2.98Å; H18-S21 WeakPolarHBondContact O-CB 3.37Å; H18-S21 PolarHBondContact O-N 2.87Å; H18-S21 PolarHBondContact O-OG 3.23Å
19	C	34.2	Very low	46.4	Very low	105 Å²	105	103.7 Å²	103.7	71%	0.709	54%	0.54	S	S	*	.	H	α-helix	trans	-81.9	-18.7	-179.1	-104.4	0	0	0	0	114.8	Q15 L16 S21	Q15-C19 PolarHBondContact O-N 3.04Å; L16-C19 PolarHBondContact O-N 3.32Å; C19-S21 PolarHBondContact O-N 2.68Å
20	D	35.8	Very low	48.2	Very low	148 Å²	148	105.3 Å²	105.3	79%	0.791	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	1.6	170.1	-101.2	-33.8	0	0	0	113.2	N22	D20-N22 PolarHBondContact O-N 3.25Å
21	S	42.8	Very low	49.9	Very low	74 Å²	74	102.9 Å²	102.9	52%	0.517	52%	0.522	S	S	.	.			trans	-81.6	59.2	174	-52.4	0	0	0	0	110.7	H18 C19 M23	H18-S21 WeakPolarHBondContact O-CB 3.37Å; H18-S21 PolarHBondContact O-N 2.87Å; H18-S21 PolarHBondContact O-OG 3.23Å; C19-S21 PolarHBondContact O-N 2.68Å; S21-M23 PolarHBondContact O-N 3.3Å
22	N	44.5	Very low	51.6	Low	148 Å²	148	104.5 Å²	104.5	79%	0.791	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	111.4	-179.5	-125.9	-15.7	0	0	0	110	D20	D20-N22 PolarHBondContact O-N 3.25Å
23	M	48.2	Very low	53.7	Low	178 Å²	178	104.4 Å²	104.4	88%	0.877	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	49.6	174.3	-62.5	-179	66.7	0	0	116.8	S21 S25	S21-M23 PolarHBondContact O-N 3.3Å; M23-S25 PolarHBondContact O-N 3.19Å
24	A	55.6	Low	55.4	Low	30 Å²	30	101.4 Å²	101.4	25%	0.248	50%	0.5	C	S	.	.			trans	-60.6	128.8	165.4	0	0	0	0	0	110.6	E28 I29	A24-E28 VanDerWaalsContact CA-OE2 3.29Å; A24-E28 WeakPolarHBondContact CA-OE2 3.41Å; A24-E28 HydrophobicContact CB-CB 4.29Å; A24-E28 HydrophobicContact CB-CG 4.21Å; A24-E28 WeakPolarHBondContact CB-OE2 3.46Å; A24-I29 HydrophobicContact CB-CD1 4.42Å; A24-I29 HydrophobicContact CB-CG1 3.91Å
25	S	64.5	Low	56.8	Low	35 Å²	35	96 Å²	96	25%	0.245	47%	0.473	C	S	.	.			trans	-60.9	151.4	177.4	-176.9	0	0	0	0	110.2	M23 L27 E28 I29 S72	M23-S25 PolarHBondContact O-N 3.19Å; S25-L27 PolarHBondContact O-N 3.26Å; S25-E28 PolarHBondContact N-OE2 3.14Å; S25-E28 WeakPolarHBondContact O-CA 3.42Å; S25-E28 WeakPolarHBondContact O-CB 3.5Å; S25-E28 PolarHBondContact O-N 3.46Å; S25-I29 PolarHBondContact O-N 3.4Å; S25-I29 VanDerWaalsContact O-N 3.08Å; S25-S72 WeakPolarHBondContact CB-OG 3.48Å; S25-S72 PolarHBondContact OG-OG 3.36Å
26	R	66.4	Low	58.6	Low	230 Å²	230	93.4 Å²	93.4	87%	0.868	47%	0.468	S	S	*	.	H	α-helix	trans	-52.2	-31.6	175	-70.7	-177.9	174.1	-128.5	-0.2	112.1	N30	R26-N30 WeakPolarHBondContact O-CB 3.41Å; R26-N30 PolarHBondContact O-N 3.42Å
27	L	69.4	Low	60.4	Low	54 Å²	54	95.1 Å²	95.1	28%	0.283	47%	0.466	S	S	.	.	H	α-helix	trans	-64.9	-42.1	174.8	-164.6	83.4	0	0	0	112.4	S25 N30 F31 A66 L67	S25-L27 PolarHBondContact O-N 3.26Å; L27-N30 PolarHBondContact O-N 3.04Å; L27-F31 WeakPolarHBondContact O-CB 3.45Å; L27-F31 PolarHBondContact O-N 3.28Å; L27-A66 HydrophobicContact CD1-CB 4.29Å; L27-A66 HydrophobicContact CD2-CB 3.91Å; L27-L67 HydrophobicContact CB-CD2 4.14Å; L27-L67 HydrophobicContact CD2-CB 4.09Å; L27-L67 HydrophobicContact CD2-CD2 3.62Å; L27-L67 HydrophobicContact CD2-CG 3.49Å; L27-L67 VanDerWaalsContact CD2-CG 3.49Å; L27-L67 HydrophobicContact CG-CD2 4.04Å; L27-L67 HydrophobicContact CG-CG 4Å
28	E	67.1	Low	61.9	Low	16 Å²	16	85.4 Å²	85.4	8%	0.075	43%	0.43	C	S	.	.	H	α-helix	trans	-71.2	-41.7	-178.8	-174.7	173.8	-165.6	0	0	111.4	A24 S25 N30 F31 I32 L67 P74 Y82	A24-E28 VanDerWaalsContact CA-OE2 3.29Å; A24-E28 WeakPolarHBondContact CA-OE2 3.41Å; A24-E28 HydrophobicContact CB-CB 4.29Å; A24-E28 HydrophobicContact CB-CG 4.21Å; A24-E28 WeakPolarHBondContact CB-OE2 3.46Å; S25-E28 PolarHBondContact N-OE2 3.14Å; S25-E28 WeakPolarHBondContact O-CA 3.42Å; S25-E28 WeakPolarHBondContact O-CB 3.5Å; S25-E28 PolarHBondContact O-N 3.46Å; E28-N30 VanDerWaalsContact C-N 3.29Å; E28-N30 PolarHBondContact O-N 3.36Å; E28-F31 WeakPolarHBondContact O-CB 3.49Å; E28-F31 PolarHBondContact O-N 3.02Å; E28-I32 HydrophobicContact CG-CD1 4.02Å; E28-I32 VanDerWaalsContact O-CG1 3.24Å; E28-I32 WeakPolarHBondContact O-CG1 3.43Å; E28-I32 PolarHBondContact O-N 2.88Å; E28-L67 HydrophobicContact CB-CD2 3.79Å; E28-L67 HydrophobicContact CG-CD2 4.44Å; E28-P74 HydrophobicContact CG-CG 4.43Å; E28-P74 WeakPolarHBondContact OE1-CB 3.31Å; E28-Y82 HydrophobicContact CG-CE2 4.17Å
29	I	73.4	Confident	63.2	Low	78 Å²	78	82.9 Å²	82.9	40%	0.4	42%	0.419	S	S	.	.	H	α-helix	trans	-61.7	-40.4	174.6	-61.2	170.8	0	0	0	110.8	A24 S25 R33	A24-I29 HydrophobicContact CB-CD1 4.42Å; A24-I29 HydrophobicContact CB-CG1 3.91Å; S25-I29 PolarHBondContact O-N 3.4Å; S25-I29 VanDerWaalsContact O-N 3.08Å; I29-R33 WeakPolarHBondContact O-CB 3.18Å; I29-R33 PolarHBondContact O-N 3.49Å; I29-R33 VanDerWaalsContact O-N 3.11Å
30	N	74.9	Confident	64.8	Low	78 Å²	78	81.3 Å²	81.3	42%	0.417	41%	0.406	S	S	.	.	H	α-helix	trans	-65.1	-45	176.1	-163.8	-75.4	0	0	0	111.2	R26 L27 E28 R33 L34 M63	R26-N30 WeakPolarHBondContact O-CB 3.41Å; R26-N30 PolarHBondContact O-N 3.42Å; L27-N30 PolarHBondContact O-N 3.04Å; E28-N30 VanDerWaalsContact C-N 3.29Å; E28-N30 PolarHBondContact O-N 3.36Å; N30-R33 PolarHBondContact O-N 3.31Å; N30-L34 WeakPolarHBondContact O-CB 3.23Å; N30-L34 PolarHBondContact O-N 2.91Å; N30-M63 HydrophobicContact CB-SD 4.3Å; N30-M63 PolarHBondContact OD1-SD 3.32Å
31	F	78	Confident	66.1	Low	0 Å²	0	75.8 Å²	75.8	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-58	-50.5	176.2	177	-89.9	0	0	0	112.1	L27 E28 R33 L34 L35 L60 M63 L64 L67 Y82 V86	L27-F31 WeakPolarHBondContact O-CB 3.45Å; L27-F31 PolarHBondContact O-N 3.28Å; E28-F31 WeakPolarHBondContact O-CB 3.49Å; E28-F31 PolarHBondContact O-N 3.02Å; F31-R33 VanDerWaalsContact C-N 3.34Å; F31-R33 PolarHBondContact O-N 3.45Å; F31-L34 PolarHBondContact O-N 2.87Å; F31-L35 HydrophobicContact CE1-CD2 4.01Å; F31-L35 HydrophobicContact CZ-CD2 4.48Å; F31-L35 WeakPolarHBondContact O-CB 3.17Å; F31-L35 PolarHBondContact O-N 3.02Å; F31-L60 HydrophobicContact CD2-CD2 3.78Å; F31-L60 HydrophobicContact CE2-CB 4.25Å; F31-L60 HydrophobicContact CE2-CD2 3.67Å; F31-L60 WeakPolarHBondContact CE2-O 3.3Å; F31-L60 HydrophobicContact CG-CD2 4.45Å; F31-L60 HydrophobicContact CZ-CD2 4.24Å; F31-M63 HydrophobicContact CD2-CB 3.96Å; F31-L64 HydrophobicContact CE2-CB 3.94Å; F31-L64 HydrophobicContact CE2-CD1 4.24Å; F31-L64 HydrophobicContact CZ-CD1 4.11Å; F31-L67 HydrophobicContact CB-CD1 3.67Å; F31-L67 HydrophobicContact CD1-CD1 4.08Å; F31-L67 HydrophobicContact CD2-CD1 3.94Å; F31-L67 HydrophobicContact CG-CD1 3.6Å; F31-Y82 HydrophobicContact CD1-CD1 4.26Å; F31-Y82 AromaticContact CD1-CD2 3.9Å; F31-Y82 HydrophobicContact CD1-CD2 3.9Å; F31-Y82 HydrophobicContact CD1-CE1 4.45Å; F31-Y82 HydrophobicContact CD1-CE2 4.08Å; F31-Y82 HydrophobicContact CD1-CG 4.01Å; F31-Y82 AromaticContact CE1-CD1 3.55Å; F31-Y82 HydrophobicContact CE1-CD1 3.55Å; F31-Y82 AromaticContact CE1-CD2 3.62Å; F31-Y82 HydrophobicContact CE1-CD2 3.62Å; F31-Y82 HydrophobicContact CE1-CE1 4.14Å; F31-Y82 HydrophobicContact CE1-CE2 4.18Å; F31-Y82 AromaticContact CE1-CG 3.27Å; F31-Y82 HydrophobicContact CE1-CG 3.27Å; F31-Y82 HydrophobicContact CZ-CD1 4.49Å; F31-Y82 HydrophobicContact CZ-CD2 4.47Å; F31-Y82 HydrophobicContact CZ-CG 4.01Å; F31-V86 HydrophobicContact CE2-CG2 4.05Å; F31-V86 HydrophobicContact CZ-CG2 3.8Å
32	I	72.6	Confident	66.9	Low	73 Å²	73	73.3 Å²	73.3	37%	0.374	36%	0.359	S	S	.	.	H	α-helix	trans	-60.3	-43.9	179.5	-65.4	162.3	0	0	0	111	E28 L35 S36 Y82	E28-I32 HydrophobicContact CG-CD1 4.02Å; E28-I32 VanDerWaalsContact O-CG1 3.24Å; E28-I32 WeakPolarHBondContact O-CG1 3.43Å; E28-I32 PolarHBondContact O-N 2.88Å; I32-L35 PolarHBondContact O-N 3.44Å; I32-S36 PolarHBondContact O-N 3.14Å; I32-Y82 VanDerWaalsContact CD1-OH 3.24Å; I32-Y82 WeakPolarHBondContact CD1-OH 3.49Å; I32-Y82 HydrophobicContact CG1-CE1 4.21Å; I32-Y82 VanDerWaalsContact CG1-OH 3.29Å; I32-Y82 WeakPolarHBondContact CG1-OH 3.48Å
33	R	76	Confident	67.5	Low	170 Å²	170	70.9 Å²	70.9	64%	0.642	35%	0.354	S	S	*	.	H	α-helix	trans	-64.3	-42.1	179.3	-172	-176.2	-63.7	154.3	0.5	111.5	I29 N30 F31 L35 R37	I29-R33 WeakPolarHBondContact O-CB 3.18Å; I29-R33 PolarHBondContact O-N 3.49Å; I29-R33 VanDerWaalsContact O-N 3.11Å; N30-R33 PolarHBondContact O-N 3.31Å; F31-R33 VanDerWaalsContact C-N 3.34Å; F31-R33 PolarHBondContact O-N 3.45Å; R33-L35 VanDerWaalsContact C-N 3.34Å; R33-R37 PolarHBondContact O-N 2.91Å
34	L	75.3	Confident	67.6	Low	23 Å²	23	69.5 Å²	69.5	12%	0.12	35%	0.346	C	S	.	.	H	α-helix	trans	-66.4	-39.8	176.7	-174.3	63.8	0	0	0	110.9	N30 F31 R37 C38 Y56 A59 L60 M63	N30-L34 WeakPolarHBondContact O-CB 3.23Å; N30-L34 PolarHBondContact O-N 2.91Å; F31-L34 PolarHBondContact O-N 2.87Å; L34-R37 WeakPolarHBondContact O-CB 3.44Å; L34-R37 PolarHBondContact O-N 3.42Å; L34-C38 PolarHBondContact O-N 2.78Å; L34-C38 PolarHBondContact O-SG 3.43Å; L34-Y56 HydrophobicContact CD1-CD1 3.64Å; L34-Y56 HydrophobicContact CD1-CE1 4.2Å; L34-Y56 HydrophobicContact CD1-CG 4.17Å; L34-A59 HydrophobicContact CD2-CB 3.99Å; L34-L60 HydrophobicContact CB-CD2 3.87Å; L34-L60 HydrophobicContact CD2-CD2 3.85Å; L34-L60 HydrophobicContact CD2-CG 3.77Å; L34-L60 HydrophobicContact CG-CD2 3.85Å; L34-L60 HydrophobicContact CG-CG 3.97Å; L34-M63 HydrophobicContact CB-CE 4.1Å; L34-M63 HydrophobicContact CD2-CE 3.19Å; L34-M63 HydrophobicContact CG-CE 4.24Å
35	L	74.4	Confident	67.3	Low	7 Å²	7	77.9 Å²	77.9	4%	0.037	38%	0.377	C	S	.	.	H	α-helix	trans	-61	-49.2	179.2	-172	66.5	0	0	0	111.3	F31 I32 R33 R37 C38 E39 L60 Y82 K85 V86 L89	F31-L35 HydrophobicContact CE1-CD2 4.01Å; F31-L35 HydrophobicContact CZ-CD2 4.48Å; F31-L35 WeakPolarHBondContact O-CB 3.17Å; F31-L35 PolarHBondContact O-N 3.02Å; I32-L35 PolarHBondContact O-N 3.44Å; R33-L35 VanDerWaalsContact C-N 3.34Å; L35-R37 VanDerWaalsContact C-N 3.27Å; L35-R37 PolarHBondContact O-N 3.39Å; L35-C38 PolarHBondContact O-N 3.05Å; L35-E39 WeakPolarHBondContact O-CG 3.37Å; L35-E39 PolarHBondContact O-N 3.33Å; L35-L60 HydrophobicContact CB-CD2 4.08Å; L35-L60 HydrophobicContact CD1-CD1 3.85Å; L35-L60 HydrophobicContact CD1-CD2 4.35Å; L35-Y82 HydrophobicContact CD2-CD1 4.34Å; L35-K85 HydrophobicContact CD1-CB 4.12Å; L35-K85 HydrophobicContact CD2-CB 4.07Å; L35-K85 HydrophobicContact CD2-CD 3.7Å; L35-V86 HydrophobicContact CD1-CG2 4.4Å; L35-L89 HydrophobicContact CD1-CD1 4.24Å
36	S	70.8	Confident	66.9	Low	65 Å²	65	80 Å²	80	46%	0.455	38%	0.379	S	S	.	.	H	α-helix	trans	-58.9	-38.3	175.7	177.8	0	0	0	0	112.3	I32 C38 E39 T40	I32-S36 PolarHBondContact O-N 3.14Å; S36-C38 VanDerWaalsContact C-N 3.35Å; S36-E39 PolarHBondContact O-N 3.41Å; S36-T40 WeakPolarHBondContact O-CG2 2.83Å; S36-T40 PolarHBondContact O-N 2.81Å; S36-T40 PolarHBondContact O-OG1 3.18Å
37	R	69.8	Low	66	Low	145 Å²	145	72.2 Å²	72.2	55%	0.547	37%	0.37	S	S	.	.	H	α-helix	trans	-68.4	-33.7	175.8	-167.9	174.2	-173.6	178.2	2.4	112.6	R33 L34 L35 T40 M41	R33-R37 PolarHBondContact O-N 2.91Å; L34-R37 WeakPolarHBondContact O-CB 3.44Å; L34-R37 PolarHBondContact O-N 3.42Å; L35-R37 VanDerWaalsContact C-N 3.27Å; L35-R37 PolarHBondContact O-N 3.39Å; R37-T40 PolarHBondContact O-OG1 2.8Å; R37-M41 HydrophobicContact CG-SD 4.36Å; R37-M41 WeakPolarHBondContact O-CB 3.44Å; R37-M41 WeakPolarHBondContact O-CG 3.33Å; R37-M41 PolarHBondContact O-N 2.94Å
38	C	67.6	Low	64.9	Low	0 Å²	0	77.6 Å²	77.6	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-72.8	-35.8	175.1	-60.8	0	0	0	0	111.6	L34 L35 S36 M41 A42 L53 Y56 L60 L89	L34-C38 PolarHBondContact O-N 2.78Å; L34-C38 PolarHBondContact O-SG 3.43Å; L35-C38 PolarHBondContact O-N 3.05Å; S36-C38 VanDerWaalsContact C-N 3.35Å; C38-M41 PolarHBondContact O-N 3.05Å; C38-A42 VanDerWaalsContact O-CB 3.26Å; C38-A42 WeakPolarHBondContact O-CB 3.19Å; C38-A42 PolarHBondContact O-N 3.49Å; C38-L53 HydrophobicContact CB-CD1 3.97Å; C38-Y56 WeakPolarHBondContact SG-CB 3.46Å; C38-L60 HydrophobicContact CB-CD1 4.06Å; C38-L60 VanDerWaalsContact SG-CD1 3.55Å; C38-L89 HydrophobicContact CB-CD2 3.19Å
39	E	66.6	Low	64.1	Low	84 Å²	84	78 Å²	78	39%	0.393	40%	0.4	S	S	.	.	H	α-helix	trans	-63.3	-44.3	174.1	-72.2	174.4	171.7	0	0	111.7	L35 S36 A42 S43 L89	L35-E39 WeakPolarHBondContact O-CG 3.37Å; L35-E39 PolarHBondContact O-N 3.33Å; S36-E39 PolarHBondContact O-N 3.41Å; E39-A42 PolarHBondContact O-N 2.97Å; E39-S43 PolarHBondContact O-N 3.46Å; E39-L89 HydrophobicContact CG-CD1 4.38Å
40	T	67	Low	63.4	Low	72 Å²	72	77.9 Å²	77.9	44%	0.442	40%	0.398	S	S	.	.	H	α-helix	trans	-67	-42	175.7	56.2	0	0	0	0	111.9	S36 R37 A42 S43 E44	S36-T40 WeakPolarHBondContact O-CG2 2.83Å; S36-T40 PolarHBondContact O-N 2.81Å; S36-T40 PolarHBondContact O-OG1 3.18Å; R37-T40 PolarHBondContact O-OG1 2.8Å; T40-A42 VanDerWaalsContact C-N 3.31Å; T40-A42 PolarHBondContact O-N 2.99Å; T40-S43 PolarHBondContact O-N 3.25Å; T40-S43 VanDerWaalsContact O-N 3.08Å; T40-S43 PolarHBondContact O-OG 3.35Å; T40-E44 PolarHBondContact O-N 3.43Å; T40-E44 VanDerWaalsContact O-N 3.1Å
41	M	62.9	Low	62.9	Low	31 Å²	31	81.7 Å²	81.7	15%	0.153	41%	0.407	C	S	.	.	H	α-helix	trans	-65.4	-32	175.4	-74.4	-176.4	64.9	0	0	113.3	R37 C38 S43 A49 R52 L53 Y56	R37-M41 HydrophobicContact CG-SD 4.36Å; R37-M41 WeakPolarHBondContact O-CB 3.44Å; R37-M41 WeakPolarHBondContact O-CG 3.33Å; R37-M41 PolarHBondContact O-N 2.94Å; C38-M41 PolarHBondContact O-N 3.05Å; M41-S43 PolarHBondContact O-N 3.03Å; M41-A49 HydrophobicContact CE-CB 4.09Å; M41-R52 HydrophobicContact CE-CB 3.81Å; M41-L53 HydrophobicContact CB-CD1 4.42Å; M41-Y56 HydrophobicContact CE-CD2 4.11Å; M41-Y56 HydrophobicContact CE-CE2 3.87Å; M41-Y56 HydrophobicContact SD-CD2 3.86Å; M41-Y56 HydrophobicContact SD-CE2 3.62Å
42	A	60.6	Low	62.2	Low	22 Å²	22	87.7 Å²	87.7	18%	0.182	43%	0.429	C	S	.	.	H	α-helix	trans	-69.7	-24.3	173.5	0	0	0	0	0	112.6	C38 E39 T40 L53 L92	C38-A42 VanDerWaalsContact O-CB 3.26Å; C38-A42 WeakPolarHBondContact O-CB 3.19Å; C38-A42 PolarHBondContact O-N 3.49Å; E39-A42 PolarHBondContact O-N 2.97Å; T40-A42 VanDerWaalsContact C-N 3.31Å; T40-A42 PolarHBondContact O-N 2.99Å; A42-L53 HydrophobicContact CB-CD2 4.33Å; A42-L92 HydrophobicContact CB-CD2 3.92Å
43	S	56.6	Low	62	Low	98 Å²	98	84.6 Å²	84.6	69%	0.685	41%	0.413	S	S	*	.	H	α-helix	trans	-87.5	-22.1	178.2	76.5	0	0	0	0	114.1	E39 T40 M41	E39-S43 PolarHBondContact O-N 3.46Å; T40-S43 PolarHBondContact O-N 3.25Å; T40-S43 VanDerWaalsContact O-N 3.08Å; T40-S43 PolarHBondContact O-OG 3.35Å; M41-S43 PolarHBondContact O-N 3.03Å
44	E	50.3	Low	61.7	Low	148 Å²	148	79.9 Å²	79.9	69%	0.692	40%	0.399	S	S	*	.	S	Bend	trans	-91.4	138.3	178.5	-108.9	174.7	176.1	0	0	112	T40 R46	T40-E44 PolarHBondContact O-N 3.43Å; T40-E44 VanDerWaalsContact O-N 3.1Å; E44-R46 PolarHBondContact O-N 3.08Å
45	K	48.2	Very low	61.7	Low	207 Å²	207	86 Å²	86	90%	0.9	42%	0.424	S	S	*	.			trans	-36.5	112	-171.2	-152.2	175.6	-178.7	-169.9	0	114.7	G47	K45-G47 VanDerWaalsContact C-N 3.32Å; K45-G47 PolarHBondContact O-N 3.35Å
46	R	57.4	Low	61.6	Low	80 Å²	80	88.7 Å²	88.7	30%	0.302	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	59.9	-177.2	-65.9	-178.3	171	-142.5	-15.4	115.2	E44 L92 E96	E44-R46 PolarHBondContact O-N 3.08Å; R46-L92 PolarHBondContact NH1-O 3.34Å; R46-L92 PolarHBondContact NH2-O 3.46Å; R46-E96 WeakPolarHBondContact CD-OE1 3.29Å; R46-E96 WeakPolarHBondContact CD-OE2 3.39Å; R46-E96 IonicContact CZ-OE2 3.35Å; R46-E96 IonicContact NE-OE2 3.73Å; R46-E96 IonicContact NH1-OE1 3.57Å; R46-E96 IonicContact NH1-OE2 2.61Å; R46-E96 PolarHBondContact NH1-OE2 3.35Å
47	G	47.4	Very low	61.8	Low	66 Å²	66	86 Å²	86	68%	0.68	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-36.6	173.3	0	0	0	0	0	113.8	K45	K45-G47 VanDerWaalsContact C-N 3.32Å; K45-G47 PolarHBondContact O-N 3.35Å
48	E	45	Very low	62.1	Low	166 Å²	166	81.3 Å²	81.3	78%	0.776	41%	0.408	S	S	*	.	S	Bend	trans	-135.9	-6.6	-171.2	-65.3	-177	178.5	0	0	113.7	W51	E48-W51 PolarHBondContact O-NE1 2.94Å
49	A	51.2	Low	62.5	Low	25 Å²	25	83 Å²	83	21%	0.207	42%	0.421	C	S	.	.			trans	-94.3	-2.9	-173.8	0	0	0	0	0	114.2	M41 R52 L53	M41-A49 HydrophobicContact CE-CB 4.09Å; A49-R52 PolarHBondContact O-N 3.26Å; A49-L53 WeakPolarHBondContact O-CB 3.13Å; A49-L53 PolarHBondContact O-N 3.35Å
50	E	58.6	Low	63	Low	75 Å²	75	79 Å²	79	35%	0.35	40%	0.403	S	S	.	.	H	α-helix	trans	-59.2	-55.6	-173.9	-166.7	175.5	-168.5	0	0	111.4	R52 L53 E54	E50-R52 PolarHBondContact O-N 2.68Å; E50-L53 WeakPolarHBondContact O-CB 3.36Å; E50-L53 PolarHBondContact O-N 3.22Å; E50-L53 VanDerWaalsContact O-N 3.1Å; E50-E54 WeakPolarHBondContact O-CG 3.46Å; E50-E54 PolarHBondContact O-N 3.04Å
51	W	65.6	Low	63.5	Low	159 Å²	159	78.3 Å²	78.3	60%	0.602	40%	0.398	S	S	*	.	H	α-helix	trans	-62.1	-28.4	178.4	73.8	-90	0	0	0	113.8	E48 K55	E48-W51 PolarHBondContact O-NE1 2.94Å; W51-K55 WeakPolarHBondContact O-CG 3.49Å; W51-K55 PolarHBondContact O-N 3.15Å
52	R	63.1	Low	64.2	Low	126 Å²	126	82.2 Å²	82.2	48%	0.475	42%	0.42	S	S	.	.	H	α-helix	trans	-73.7	-44.1	176.6	-66.9	-177.3	173.5	163.4	-0.3	110.2	M41 A49 E50 E54 K55 Y56	M41-R52 HydrophobicContact CE-CB 3.81Å; A49-R52 PolarHBondContact O-N 3.26Å; E50-R52 PolarHBondContact O-N 2.68Å; R52-E54 VanDerWaalsContact C-N 3.31Å; R52-E54 PolarHBondContact O-N 3.43Å; R52-K55 PolarHBondContact O-N 2.95Å; R52-Y56 HydrophobicContact CB-CD2 4.31Å; R52-Y56 HydrophobicContact CB-CE2 4.01Å; R52-Y56 WeakPolarHBondContact O-CD2 3.1Å; R52-Y56 PolarHBondContact O-N 2.86Å
53	L	68.6	Low	64.7	Low	7 Å²	7	82.6 Å²	82.6	4%	0.037	42%	0.418	C	S	.	.	H	α-helix	trans	-61.6	-41.4	176.3	-171.5	63.6	0	0	0	110.5	C38 M41 A42 A49 E50 K55 Y56 V57 L89	C38-L53 HydrophobicContact CB-CD1 3.97Å; M41-L53 HydrophobicContact CB-CD1 4.42Å; A42-L53 HydrophobicContact CB-CD2 4.33Å; A49-L53 WeakPolarHBondContact O-CB 3.13Å; A49-L53 PolarHBondContact O-N 3.35Å; E50-L53 WeakPolarHBondContact O-CB 3.36Å; E50-L53 PolarHBondContact O-N 3.22Å; E50-L53 VanDerWaalsContact O-N 3.1Å; L53-K55 PolarHBondContact O-N 3.41Å; L53-Y56 PolarHBondContact O-N 3.49Å; L53-V57 HydrophobicContact CD1-CG2 4.29Å; L53-V57 HydrophobicContact CG-CG2 4.29Å; L53-V57 WeakPolarHBondContact O-CB 3.29Å; L53-V57 VanDerWaalsContact O-CG2 3.23Å; L53-V57 WeakPolarHBondContact O-CG2 3.19Å; L53-V57 PolarHBondContact O-N 2.68Å; L53-L89 HydrophobicContact CD1-CD2 4.36Å
54	E	69.4	Low	65.5	Low	72 Å²	72	78.5 Å²	78.5	34%	0.336	39%	0.389	S	S	.	.	H	α-helix	trans	-54.7	-49.1	173.3	-61.9	-159.6	143.7	0	0	112.3	E50 R52 V57 A58 L93	E50-E54 WeakPolarHBondContact O-CG 3.46Å; E50-E54 PolarHBondContact O-N 3.04Å; R52-E54 VanDerWaalsContact C-N 3.31Å; R52-E54 PolarHBondContact O-N 3.43Å; E54-V57 PolarHBondContact O-N 2.92Å; E54-A58 WeakPolarHBondContact O-CB 3.3Å; E54-A58 PolarHBondContact O-N 2.98Å; E54-L93 HydrophobicContact CB-CD2 4.14Å; E54-L93 HydrophobicContact CG-CD1 3.57Å; E54-L93 HydrophobicContact CG-CD2 3.73Å; E54-L93 HydrophobicContact CG-CG 4.04Å
55	K	74.9	Confident	66.7	Low	150 Å²	150	74.3 Å²	74.3	65%	0.652	37%	0.373	S	S	*	.	H	α-helix	trans	-67	-37.4	-179.6	-69.4	-66.1	-179	-174.5	0	112.4	W51 R52 L53 A59	W51-K55 WeakPolarHBondContact O-CG 3.49Å; W51-K55 PolarHBondContact O-N 3.15Å; R52-K55 PolarHBondContact O-N 2.95Å; L53-K55 PolarHBondContact O-N 3.41Å; K55-A59 WeakPolarHBondContact O-CB 3.32Å; K55-A59 PolarHBondContact O-N 3.38Å
56	Y	72.9	Confident	67.8	Low	65 Å²	65	66.3 Å²	66.3	26%	0.255	35%	0.345	S	S	.	.	H	α-helix	trans	-71.9	-36.6	176.8	-65.9	-52.7	0	0	0	112.7	L34 C38 M41 R52 L53 A59 L60	L34-Y56 HydrophobicContact CD1-CD1 3.64Å; L34-Y56 HydrophobicContact CD1-CE1 4.2Å; L34-Y56 HydrophobicContact CD1-CG 4.17Å; C38-Y56 WeakPolarHBondContact SG-CB 3.46Å; M41-Y56 HydrophobicContact CE-CD2 4.11Å; M41-Y56 HydrophobicContact CE-CE2 3.87Å; M41-Y56 HydrophobicContact SD-CD2 3.86Å; M41-Y56 HydrophobicContact SD-CE2 3.62Å; R52-Y56 HydrophobicContact CB-CD2 4.31Å; R52-Y56 HydrophobicContact CB-CE2 4.01Å; R52-Y56 WeakPolarHBondContact O-CD2 3.1Å; R52-Y56 PolarHBondContact O-N 2.86Å; L53-Y56 PolarHBondContact O-N 3.49Å; Y56-A59 PolarHBondContact O-N 3.39Å; Y56-L60 WeakPolarHBondContact O-CG 3.38Å; Y56-L60 PolarHBondContact O-N 3.22Å
57	V	74.1	Confident	68.4	Low	7 Å²	7	62.6 Å²	62.6	4%	0.042	33%	0.332	C	S	.	.	H	α-helix	trans	-65.1	-41.2	173.3	171.8	0	0	0	0	110.6	L53 E54 L60 V61 L89 K90	L53-V57 HydrophobicContact CD1-CG2 4.29Å; L53-V57 HydrophobicContact CG-CG2 4.29Å; L53-V57 WeakPolarHBondContact O-CB 3.29Å; L53-V57 VanDerWaalsContact O-CG2 3.23Å; L53-V57 WeakPolarHBondContact O-CG2 3.19Å; L53-V57 PolarHBondContact O-N 2.68Å; E54-V57 PolarHBondContact O-N 2.92Å; V57-L60 WeakPolarHBondContact O-CB 3.34Å; V57-L60 PolarHBondContact O-N 2.93Å; V57-V61 WeakPolarHBondContact O-CG2 3.39Å; V57-V61 PolarHBondContact O-N 3.15Å; V57-L89 HydrophobicContact CG2-CB 3.94Å; V57-L89 HydrophobicContact CG2-CD2 4.12Å; V57-K90 HydrophobicContact CG1-CB 4.26Å
58	A	75.3	Confident	69.3	Low	48 Å²	48	64.8 Å²	64.8	40%	0.397	32%	0.319	S	S	.	.	H	α-helix	trans	-60.5	-45.5	172.5	0	0	0	0	0	112.2	E54 L60 V61 D62	E54-A58 WeakPolarHBondContact O-CB 3.3Å; E54-A58 PolarHBondContact O-N 2.98Å; A58-L60 VanDerWaalsContact C-N 3.31Å; A58-L60 PolarHBondContact O-N 2.84Å; A58-V61 WeakPolarHBondContact O-CB 3.41Å; A58-V61 PolarHBondContact O-N 3.2Å; A58-D62 PolarHBondContact O-N 2.88Å
59	A	77.3	Confident	70.4	Confident	35 Å²	35	65 Å²	65	29%	0.289	32%	0.317	S	S	.	.	H	α-helix	trans	-64.2	-33.4	176.3	0	0	0	0	0	113	L34 K55 Y56 M63	L34-A59 HydrophobicContact CD2-CB 3.99Å; K55-A59 WeakPolarHBondContact O-CB 3.32Å; K55-A59 PolarHBondContact O-N 3.38Å; Y56-A59 PolarHBondContact O-N 3.39Å; A59-M63 WeakPolarHBondContact O-CB 3.41Å; A59-M63 PolarHBondContact O-N 3.32Å
60	L	77.3	Confident	70.6	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-65.1	-42.5	172.4	-78	171.1	0	0	0	111.7	F31 L34 L35 C38 Y56 V57 A58 M63 L64 V86	F31-L60 HydrophobicContact CD2-CD2 3.78Å; F31-L60 HydrophobicContact CE2-CB 4.25Å; F31-L60 HydrophobicContact CE2-CD2 3.67Å; F31-L60 WeakPolarHBondContact CE2-O 3.3Å; F31-L60 HydrophobicContact CG-CD2 4.45Å; F31-L60 HydrophobicContact CZ-CD2 4.24Å; L34-L60 HydrophobicContact CB-CD2 3.87Å; L34-L60 HydrophobicContact CD2-CD2 3.85Å; L34-L60 HydrophobicContact CD2-CG 3.77Å; L34-L60 HydrophobicContact CG-CD2 3.85Å; L34-L60 HydrophobicContact CG-CG 3.97Å; L35-L60 HydrophobicContact CB-CD2 4.08Å; L35-L60 HydrophobicContact CD1-CD1 3.85Å; L35-L60 HydrophobicContact CD1-CD2 4.35Å; C38-L60 HydrophobicContact CB-CD1 4.06Å; C38-L60 VanDerWaalsContact SG-CD1 3.55Å; Y56-L60 WeakPolarHBondContact O-CG 3.38Å; Y56-L60 PolarHBondContact O-N 3.22Å; V57-L60 WeakPolarHBondContact O-CB 3.34Å; V57-L60 PolarHBondContact O-N 2.93Å; A58-L60 VanDerWaalsContact C-N 3.31Å; A58-L60 PolarHBondContact O-N 2.84Å; L60-M63 PolarHBondContact O-N 2.87Å; L60-L64 VanDerWaalsContact O-CB 3.25Å; L60-L64 WeakPolarHBondContact O-CB 3.13Å; L60-L64 PolarHBondContact O-N 3.45Å; L60-V86 HydrophobicContact CB-CG2 4.05Å
61	V	77.8	Confident	70	Confident	58 Å²	58	67.6 Å²	67.6	35%	0.352	34%	0.339	S	S	.	.	H	α-helix	trans	-61.4	-45.8	175.6	173.4	0	0	0	0	110.7	V57 A58 L64 V65 V86	V57-V61 WeakPolarHBondContact O-CG2 3.39Å; V57-V61 PolarHBondContact O-N 3.15Å; A58-V61 WeakPolarHBondContact O-CB 3.41Å; A58-V61 PolarHBondContact O-N 3.2Å; V61-L64 WeakPolarHBondContact O-CB 3.37Å; V61-L64 PolarHBondContact O-N 2.94Å; V61-V65 WeakPolarHBondContact O-CG2 3.49Å; V61-V65 PolarHBondContact O-N 2.91Å; V61-V86 HydrophobicContact CG2-CG1 3.49Å; V61-V86 VanDerWaalsContact CG2-CG1 3.49Å
62	D	75.9	Confident	69.1	Low	113 Å²	113	62.7 Å²	62.7	60%	0.604	33%	0.329	S	S	*	.	H	α-helix	trans	-64.2	-42.6	179.1	-74.5	-20	0	0	0	112.1	A58 L64 V65 A66	A58-D62 PolarHBondContact O-N 2.88Å; D62-L64 VanDerWaalsContact C-N 3.33Å; D62-L64 PolarHBondContact O-N 3.43Å; D62-V65 PolarHBondContact O-N 3.16Å; D62-A66 WeakPolarHBondContact O-CB 3.33Å; D62-A66 PolarHBondContact O-N 3.46Å
63	M	71.7	Confident	68.7	Low	30 Å²	30	64 Å²	64	15%	0.148	34%	0.338	C	S	.	.	H	α-helix	trans	-67.1	-32.9	174.5	-80.5	-168.5	-74.6	0	0	112.7	N30 F31 L34 A59 L60 A66 L67	N30-M63 HydrophobicContact CB-SD 4.3Å; N30-M63 PolarHBondContact OD1-SD 3.32Å; F31-M63 HydrophobicContact CD2-CB 3.96Å; L34-M63 HydrophobicContact CB-CE 4.1Å; L34-M63 HydrophobicContact CD2-CE 3.19Å; L34-M63 HydrophobicContact CG-CE 4.24Å; A59-M63 WeakPolarHBondContact O-CB 3.41Å; A59-M63 PolarHBondContact O-N 3.32Å; L60-M63 PolarHBondContact O-N 2.87Å; M63-A66 PolarHBondContact O-N 3.36Å; M63-L67 WeakPolarHBondContact O-CB 3.4Å; M63-L67 VanDerWaalsContact O-CG 3.3Å; M63-L67 WeakPolarHBondContact O-CG 3.46Å; M63-L67 PolarHBondContact O-N 3.33Å
64	L	73.3	Confident	68.1	Low	12 Å²	12	64.3 Å²	64.3	6%	0.063	34%	0.341	C	S	.	.	H	α-helix	trans	-67.1	-39.7	174.2	-168.4	150.2	0	0	0	111.3	F31 L60 V61 D62 L67 R68 V86	F31-L64 HydrophobicContact CE2-CB 3.94Å; F31-L64 HydrophobicContact CE2-CD1 4.24Å; F31-L64 HydrophobicContact CZ-CD1 4.11Å; L60-L64 VanDerWaalsContact O-CB 3.25Å; L60-L64 WeakPolarHBondContact O-CB 3.13Å; L60-L64 PolarHBondContact O-N 3.45Å; V61-L64 WeakPolarHBondContact O-CB 3.37Å; V61-L64 PolarHBondContact O-N 2.94Å; D62-L64 VanDerWaalsContact C-N 3.33Å; D62-L64 PolarHBondContact O-N 3.43Å; L64-L67 PolarHBondContact O-N 3.46Å; L64-R68 HydrophobicContact CD2-CG 4.42Å; L64-R68 VanDerWaalsContact CD2-NE 3.33Å; L64-R68 WeakPolarHBondContact O-CG 3.35Å; L64-R68 PolarHBondContact O-N 2.9Å; L64-V86 HydrophobicContact CD1-CB 4.33Å; L64-V86 HydrophobicContact CD1-CG2 3.94Å
65	V	76.3	Confident	67.3	Low	60 Å²	60	65.1 Å²	65.1	36%	0.364	35%	0.351	S	S	.	.	H	α-helix	trans	-66	-41.2	172.8	172.9	0	0	0	0	111.1	V61 D62 L67 R68 K69	V61-V65 WeakPolarHBondContact O-CG2 3.49Å; V61-V65 PolarHBondContact O-N 2.91Å; D62-V65 PolarHBondContact O-N 3.16Å; V65-L67 VanDerWaalsContact C-N 3.34Å; V65-R68 PolarHBondContact O-N 2.95Å; V65-K69 HydrophobicContact CG1-CD 4.24Å; V65-K69 WeakPolarHBondContact O-CG 3.34Å; V65-K69 PolarHBondContact O-N 3.23Å; V65-K69 VanDerWaalsContact O-N 3.1Å
66	A	71.8	Confident	66.1	Low	39 Å²	39	64.4 Å²	64.4	32%	0.322	35%	0.35	S	S	.	.	H	α-helix	trans	-64.4	-38.5	174.4	0	0	0	0	0	111.9	L27 D62 M63 K69 S70	L27-A66 HydrophobicContact CD1-CB 4.29Å; L27-A66 HydrophobicContact CD2-CB 3.91Å; D62-A66 WeakPolarHBondContact O-CB 3.33Å; D62-A66 PolarHBondContact O-N 3.46Å; M63-A66 PolarHBondContact O-N 3.36Å; A66-K69 PolarHBondContact O-N 3.1Å; A66-S70 WeakPolarHBondContact O-CB 3.46Å; A66-S70 PolarHBondContact O-N 3.02Å
67	L	69.2	Low	65.2	Low	2 Å²	2	67.2 Å²	67.2	1%	0.01	37%	0.365	C	S	.	.	H	α-helix	trans	-62.8	-42.8	175.2	-84.2	164.9	0	0	0	111	L27 E28 F31 M63 L64 V65 K69 S70 P74	L27-L67 HydrophobicContact CB-CD2 4.14Å; L27-L67 HydrophobicContact CD2-CB 4.09Å; L27-L67 HydrophobicContact CD2-CD2 3.62Å; L27-L67 HydrophobicContact CD2-CG 3.49Å; L27-L67 VanDerWaalsContact CD2-CG 3.49Å; L27-L67 HydrophobicContact CG-CD2 4.04Å; L27-L67 HydrophobicContact CG-CG 4Å; E28-L67 HydrophobicContact CB-CD2 3.79Å; E28-L67 HydrophobicContact CG-CD2 4.44Å; F31-L67 HydrophobicContact CB-CD1 3.67Å; F31-L67 HydrophobicContact CD1-CD1 4.08Å; F31-L67 HydrophobicContact CD2-CD1 3.94Å; F31-L67 HydrophobicContact CG-CD1 3.6Å; M63-L67 WeakPolarHBondContact O-CB 3.4Å; M63-L67 VanDerWaalsContact O-CG 3.3Å; M63-L67 WeakPolarHBondContact O-CG 3.46Å; M63-L67 PolarHBondContact O-N 3.33Å; L64-L67 PolarHBondContact O-N 3.46Å; V65-L67 VanDerWaalsContact C-N 3.34Å; L67-K69 VanDerWaalsContact C-N 3.3Å; L67-K69 PolarHBondContact O-N 3.36Å; L67-S70 PolarHBondContact O-N 3.07Å; L67-S70 PolarHBondContact O-OG 3.36Å; L67-P74 HydrophobicContact CD2-CG 4.27Å
68	R	67.3	Low	64.7	Low	111 Å²	111	69.6 Å²	69.6	42%	0.419	38%	0.377	S	S	.	.	H	α-helix	trans	-63.1	-32.8	175	-75.5	-178.6	-178.6	-173.7	1.6	113.7	L64 V65 K73 L79 T83	L64-R68 HydrophobicContact CD2-CG 4.42Å; L64-R68 VanDerWaalsContact CD2-NE 3.33Å; L64-R68 WeakPolarHBondContact O-CG 3.35Å; L64-R68 PolarHBondContact O-N 2.9Å; V65-R68 PolarHBondContact O-N 2.95Å; R68-K73 VanDerWaalsContact O-CE 3.3Å; R68-K73 WeakPolarHBondContact O-CE 3.36Å; R68-L79 HydrophobicContact CG-CD1 3.65Å; R68-L79 HydrophobicContact CG-CD2 3.85Å; R68-L79 HydrophobicContact CG-CG 4.14Å; R68-T83 PolarHBondContact NH2-OG1 3.4Å
69	K	66.8	Low	64.1	Low	170 Å²	170	68.8 Å²	68.8	74%	0.739	37%	0.366	S	S	*	.	H	α-helix	trans	-86.8	-17.6	179.6	-70.8	178.2	-179.7	179.9	0	113.3	V65 A66 L67	V65-K69 HydrophobicContact CG1-CD 4.24Å; V65-K69 WeakPolarHBondContact O-CG 3.34Å; V65-K69 PolarHBondContact O-N 3.23Å; V65-K69 VanDerWaalsContact O-N 3.1Å; A66-K69 PolarHBondContact O-N 3.1Å; L67-K69 VanDerWaalsContact C-N 3.3Å; L67-K69 PolarHBondContact O-N 3.36Å
70	S	55.3	Low	63.5	Low	16 Å²	16	69.8 Å²	69.8	11%	0.112	37%	0.369	C	S	.	.	S	Bend	trans	-69.3	145.2	-178.7	74.3	0	0	0	0	111.8	A66 L67 S72 K73	A66-S70 WeakPolarHBondContact O-CB 3.46Å; A66-S70 PolarHBondContact O-N 3.02Å; L67-S70 PolarHBondContact O-N 3.07Å; L67-S70 PolarHBondContact O-OG 3.36Å; S70-S72 PolarHBondContact O-N 2.99Å; S70-S72 PolarHBondContact OG-O 3.32Å; S70-K73 WeakPolarHBondContact O-CG 3.48Å
71	P	45.7	Very low	63.1	Low	139 Å²	139	74.1 Å²	74.1	90%	0.903	39%	0.389	S	S	*	.	S	Bend	trans	-72.7	-17	179	29.1	-34.5	0	0	0	113	K73	P71-K73 PolarHBondContact O-N 2.8Å
72	S	46.8	Very low	62.6	Low	56 Å²	56	72.6 Å²	72.6	39%	0.392	38%	0.377	S	S	.	.	S	Bend	trans	-92.7	68.5	170.7	57.4	0	0	0	0	109.4	S25 S70 P74	S25-S72 WeakPolarHBondContact CB-OG 3.48Å; S25-S72 PolarHBondContact OG-OG 3.36Å; S70-S72 PolarHBondContact O-N 2.99Å; S70-S72 PolarHBondContact OG-O 3.32Å; S72-P74 WeakPolarHBondContact O-CD 3.31Å
73	K	54.7	Low	62.5	Low	153 Å²	153	68.5 Å²	68.5	67%	0.665	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-68.3	122.7	179.6	-76.5	178.2	177.5	174.6	0	109.6	R68 S70 P71	R68-K73 VanDerWaalsContact O-CE 3.3Å; R68-K73 WeakPolarHBondContact O-CE 3.36Å; S70-K73 WeakPolarHBondContact O-CG 3.48Å; P71-K73 PolarHBondContact O-N 2.8Å
74	P	56.4	Low	62.5	Low	15 Å²	15	75.5 Å²	75.5	10%	0.097	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-59.8	152.6	163.1	-15.3	29.1	0	0	0	109.3	E28 L67 S72 Q76 I78	E28-P74 HydrophobicContact CG-CG 4.43Å; E28-P74 WeakPolarHBondContact OE1-CB 3.31Å; L67-P74 HydrophobicContact CD2-CG 4.27Å; S72-P74 WeakPolarHBondContact O-CD 3.31Å; P74-Q76 PolarHBondContact O-N 2.8Å; P74-I78 HydrophobicContact CB-CB 4.36Å; P74-I78 HydrophobicContact CB-CG2 4.29Å
75	T	52.3	Low	62.3	Low	88 Å²	88	78.2 Å²	78.2	54%	0.54	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-47.3	137.9	176.9	-49.7	0	0	0	0	110.7	E77 I78 L79	T75-E77 HydrophobicContact CG2-CB 4.47Å; T75-E77 PolarHBondContact O-N 3.4Å; T75-I78 WeakPolarHBondContact O-CB 3.45Å; T75-I78 PolarHBondContact O-N 3.48Å; T75-L79 PolarHBondContact O-N 3.08Å
76	Q	49.2	Very low	62.2	Low	135 Å²	135	75.6 Å²	75.6	63%	0.631	38%	0.376	S	S	*	.	H	α-helix	trans	-53	-29.1	-173.7	-173.9	165.8	-17.9	0	0	113.1	P74 T80	P74-Q76 PolarHBondContact O-N 2.8Å; Q76-T80 VanDerWaalsContact O-CG2 3.31Å; Q76-T80 WeakPolarHBondContact O-CG2 3.44Å; Q76-T80 PolarHBondContact O-N 2.92Å; Q76-T80 VanDerWaalsContact O-N 3.08Å
77	E	55.1	Low	62.2	Low	125 Å²	125	78.1 Å²	78.1	58%	0.584	38%	0.384	S	S	*	.	H	α-helix	trans	-63	-49.2	173.5	-66.8	171.4	-179.5	0	0	112.9	T75 L79 T80 E81	T75-E77 HydrophobicContact CG2-CB 4.47Å; T75-E77 PolarHBondContact O-N 3.4Å; E77-L79 VanDerWaalsContact C-N 3.28Å; E77-L79 PolarHBondContact O-N 3.43Å; E77-T80 PolarHBondContact O-N 2.78Å; E77-T80 VanDerWaalsContact O-N 3.12Å; E77-T80 PolarHBondContact O-OG1 3.48Å; E77-E81 PolarHBondContact O-N 3.49Å
78	I	63.3	Low	62.3	Low	57 Å²	57	84.6 Å²	84.6	29%	0.292	41%	0.413	S	S	.	.	H	α-helix	trans	-63.4	-39.1	179.6	-61.2	173.8	0	0	0	110.1	P74 T75 T80 E81 Y82	P74-I78 HydrophobicContact CB-CB 4.36Å; P74-I78 HydrophobicContact CB-CG2 4.29Å; T75-I78 WeakPolarHBondContact O-CB 3.45Å; T75-I78 PolarHBondContact O-N 3.48Å; I78-T80 VanDerWaalsContact C-N 3.34Å; I78-T80 PolarHBondContact O-N 3.4Å; I78-E81 PolarHBondContact O-N 2.87Å; I78-Y82 HydrophobicContact CG2-CD2 3.87Å; I78-Y82 HydrophobicContact CG2-CE1 4.02Å; I78-Y82 HydrophobicContact CG2-CE2 3.26Å; I78-Y82 HydrophobicContact CG2-CG 4.47Å; I78-Y82 WeakPolarHBondContact CG2-OH 3.42Å; I78-Y82 WeakPolarHBondContact O-CB 3.49Å; I78-Y82 WeakPolarHBondContact O-CD2 3.37Å; I78-Y82 PolarHBondContact O-N 2.81Å
79	L	62.3	Low	62.4	Low	30 Å²	30	79.5 Å²	79.5	16%	0.157	39%	0.394	C	S	.	.	H	α-helix	trans	-64.8	-37.8	176.1	-163.5	116.4	0	0	0	112.3	R68 T75 E77 T83	R68-L79 HydrophobicContact CG-CD1 3.65Å; R68-L79 HydrophobicContact CG-CD2 3.85Å; R68-L79 HydrophobicContact CG-CG 4.14Å; T75-L79 PolarHBondContact O-N 3.08Å; E77-L79 VanDerWaalsContact C-N 3.28Å; E77-L79 PolarHBondContact O-N 3.43Å; L79-T83 WeakPolarHBondContact O-CB 3.47Å; L79-T83 PolarHBondContact O-N 3.28Å; L79-T83 PolarHBondContact O-OG1 3.28Å
80	T	64.6	Low	62.5	Low	57 Å²	57	76.3 Å²	76.3	35%	0.35	38%	0.38	S	S	.	.	H	α-helix	trans	-69.3	-37	174.1	61.6	0	0	0	0	112.4	Q76 E77 I78 T83 R84	Q76-T80 VanDerWaalsContact O-CG2 3.31Å; Q76-T80 WeakPolarHBondContact O-CG2 3.44Å; Q76-T80 PolarHBondContact O-N 2.92Å; Q76-T80 VanDerWaalsContact O-N 3.08Å; E77-T80 PolarHBondContact O-N 2.78Å; E77-T80 VanDerWaalsContact O-N 3.12Å; E77-T80 PolarHBondContact O-OG1 3.48Å; I78-T80 VanDerWaalsContact C-N 3.34Å; I78-T80 PolarHBondContact O-N 3.4Å; T80-T83 PolarHBondContact O-N 2.78Å; T80-R84 WeakPolarHBondContact O-CG 3.4Å; T80-R84 PolarHBondContact O-N 3.49Å
81	E	69.1	Low	62.9	Low	90 Å²	90	77.4 Å²	77.4	42%	0.421	39%	0.394	S	S	.	.	H	α-helix	trans	-64.6	-45.7	175.1	-166.8	-172.4	151.5	0	0	111.5	E77 I78 T83 R84 K85	E77-E81 PolarHBondContact O-N 3.49Å; I78-E81 PolarHBondContact O-N 2.87Å; E81-T83 VanDerWaalsContact C-N 3.3Å; E81-T83 PolarHBondContact O-N 2.86Å; E81-R84 PolarHBondContact O-N 3.26Å; E81-K85 WeakPolarHBondContact O-CG 3.41Å; E81-K85 PolarHBondContact O-N 2.87Å; E81-K85 WeakPolarHBondContact OE1-CE 3.47Å; E81-K85 IonicContact OE1-NZ 2.71Å; E81-K85 PolarHBondContact OE1-NZ 2.91Å
82	Y	67.9	Low	63.7	Low	26 Å²	26	73.6 Å²	73.6	10%	0.102	37%	0.366	C	S	.	.	H	α-helix	trans	-60.7	-39.1	174.3	-68.2	-19.1	0	0	0	112.7	E28 F31 I32 L35 I78 K85 V86	E28-Y82 HydrophobicContact CG-CE2 4.17Å; F31-Y82 HydrophobicContact CD1-CD1 4.26Å; F31-Y82 AromaticContact CD1-CD2 3.9Å; F31-Y82 HydrophobicContact CD1-CD2 3.9Å; F31-Y82 HydrophobicContact CD1-CE1 4.45Å; F31-Y82 HydrophobicContact CD1-CE2 4.08Å; F31-Y82 HydrophobicContact CD1-CG 4.01Å; F31-Y82 AromaticContact CE1-CD1 3.55Å; F31-Y82 HydrophobicContact CE1-CD1 3.55Å; F31-Y82 AromaticContact CE1-CD2 3.62Å; F31-Y82 HydrophobicContact CE1-CD2 3.62Å; F31-Y82 HydrophobicContact CE1-CE1 4.14Å; F31-Y82 HydrophobicContact CE1-CE2 4.18Å; F31-Y82 AromaticContact CE1-CG 3.27Å; F31-Y82 HydrophobicContact CE1-CG 3.27Å; F31-Y82 HydrophobicContact CZ-CD1 4.49Å; F31-Y82 HydrophobicContact CZ-CD2 4.47Å; F31-Y82 HydrophobicContact CZ-CG 4.01Å; I32-Y82 VanDerWaalsContact CD1-OH 3.24Å; I32-Y82 WeakPolarHBondContact CD1-OH 3.49Å; I32-Y82 HydrophobicContact CG1-CE1 4.21Å; I32-Y82 VanDerWaalsContact CG1-OH 3.29Å; I32-Y82 WeakPolarHBondContact CG1-OH 3.48Å; L35-Y82 HydrophobicContact CD2-CD1 4.34Å; I78-Y82 HydrophobicContact CG2-CD2 3.87Å; I78-Y82 HydrophobicContact CG2-CE1 4.02Å; I78-Y82 HydrophobicContact CG2-CE2 3.26Å; I78-Y82 HydrophobicContact CG2-CG 4.47Å; I78-Y82 WeakPolarHBondContact CG2-OH 3.42Å; I78-Y82 WeakPolarHBondContact O-CB 3.49Å; I78-Y82 WeakPolarHBondContact O-CD2 3.37Å; I78-Y82 PolarHBondContact O-N 2.81Å; Y82-K85 PolarHBondContact O-N 3.3Å; Y82-V86 VanDerWaalsContact O-CG2 3.28Å; Y82-V86 WeakPolarHBondContact O-CG2 3.34Å; Y82-V86 PolarHBondContact O-N 3.16Å
83	T	73.6	Confident	64.5	Low	27 Å²	27	71.7 Å²	71.7	17%	0.166	35%	0.351	C	S	.	.	H	α-helix	trans	-64	-48.3	176.3	-53.5	0	0	0	0	110.7	R68 L79 T80 E81 K85 V86 D87	R68-T83 PolarHBondContact NH2-OG1 3.4Å; L79-T83 WeakPolarHBondContact O-CB 3.47Å; L79-T83 PolarHBondContact O-N 3.28Å; L79-T83 PolarHBondContact O-OG1 3.28Å; T80-T83 PolarHBondContact O-N 2.78Å; E81-T83 VanDerWaalsContact C-N 3.3Å; E81-T83 PolarHBondContact O-N 2.86Å; T83-K85 VanDerWaalsContact C-N 3.32Å; T83-K85 PolarHBondContact O-N 3.39Å; T83-V86 PolarHBondContact O-N 3.28Å; T83-D87 WeakPolarHBondContact O-CB 3.25Å; T83-D87 VanDerWaalsContact O-CG 3.27Å; T83-D87 PolarHBondContact O-N 3.04Å
84	R	72.1	Confident	64.7	Low	178 Å²	178	68.8 Å²	68.8	67%	0.672	34%	0.34	S	S	*	.	H	α-helix	trans	-59.8	-40.4	177	-72.4	177.8	-173.3	140.3	1	112.7	T80 E81 D87 F88	T80-R84 WeakPolarHBondContact O-CG 3.4Å; T80-R84 PolarHBondContact O-N 3.49Å; E81-R84 PolarHBondContact O-N 3.26Å; R84-D87 PolarHBondContact O-N 2.93Å; R84-F88 WeakPolarHBondContact O-CB 3.37Å; R84-F88 PolarHBondContact O-N 3.18Å
85	K	69.4	Low	64.3	Low	68 Å²	68	71.3 Å²	71.3	30%	0.296	36%	0.362	S	S	.	.	H	α-helix	trans	-65.9	-44.2	177.5	-74.8	178.7	171.1	164.2	0	111.3	L35 E81 Y82 T83 D87 F88 L89	L35-K85 HydrophobicContact CD1-CB 4.12Å; L35-K85 HydrophobicContact CD2-CB 4.07Å; L35-K85 HydrophobicContact CD2-CD 3.7Å; E81-K85 WeakPolarHBondContact O-CG 3.41Å; E81-K85 PolarHBondContact O-N 2.87Å; E81-K85 WeakPolarHBondContact OE1-CE 3.47Å; E81-K85 IonicContact OE1-NZ 2.71Å; E81-K85 PolarHBondContact OE1-NZ 2.91Å; Y82-K85 PolarHBondContact O-N 3.3Å; T83-K85 VanDerWaalsContact C-N 3.32Å; T83-K85 PolarHBondContact O-N 3.39Å; K85-D87 PolarHBondContact O-N 3.4Å; K85-F88 PolarHBondContact O-N 3.02Å; K85-L89 WeakPolarHBondContact O-CD1 3.3Å; K85-L89 PolarHBondContact O-N 3.46Å
86	V	73.1	Confident	64.1	Low	5 Å²	5	69.3 Å²	69.3	3%	0.03	35%	0.346	C	S	.	.	H	α-helix	trans	-63.8	-40.6	175.8	172.8	0	0	0	0	111.6	F31 L35 L60 V61 L64 Y82 T83 L89 K90	F31-V86 HydrophobicContact CE2-CG2 4.05Å; F31-V86 HydrophobicContact CZ-CG2 3.8Å; L35-V86 HydrophobicContact CD1-CG2 4.4Å; L60-V86 HydrophobicContact CB-CG2 4.05Å; V61-V86 HydrophobicContact CG2-CG1 3.49Å; V61-V86 VanDerWaalsContact CG2-CG1 3.49Å; L64-V86 HydrophobicContact CD1-CB 4.33Å; L64-V86 HydrophobicContact CD1-CG2 3.94Å; Y82-V86 VanDerWaalsContact O-CG2 3.28Å; Y82-V86 WeakPolarHBondContact O-CG2 3.34Å; Y82-V86 PolarHBondContact O-N 3.16Å; T83-V86 PolarHBondContact O-N 3.28Å; V86-L89 PolarHBondContact O-N 3.06Å; V86-K90 WeakPolarHBondContact O-CB 3.46Å; V86-K90 PolarHBondContact O-N 2.96Å
87	D	71.1	Confident	64.1	Low	92 Å²	92	69.9 Å²	69.9	49%	0.492	35%	0.347	S	S	.	.	H	α-helix	trans	-65.6	-37.5	176.3	-70.3	-28.8	0	0	0	112.2	T83 R84 K85 K90 G91	T83-D87 WeakPolarHBondContact O-CB 3.25Å; T83-D87 VanDerWaalsContact O-CG 3.27Å; T83-D87 PolarHBondContact O-N 3.04Å; R84-D87 PolarHBondContact O-N 2.93Å; K85-D87 PolarHBondContact O-N 3.4Å; D87-K90 PolarHBondContact O-N 3.44Å; D87-G91 PolarHBondContact O-N 2.86Å
88	F	71.1	Confident	63.4	Low	138 Å²	138	69.5 Å²	69.5	61%	0.605	35%	0.348	S	S	*	.	H	α-helix	trans	-62.2	-47.9	173.2	175.7	-101.2	0	0	0	111.6	R84 K85 K90 G91 L92	R84-F88 WeakPolarHBondContact O-CB 3.37Å; R84-F88 PolarHBondContact O-N 3.18Å; K85-F88 PolarHBondContact O-N 3.02Å; F88-K90 VanDerWaalsContact C-N 3.3Å; F88-K90 PolarHBondContact O-N 3.49Å; F88-G91 PolarHBondContact O-N 2.83Å; F88-L92 HydrophobicContact CZ-CD1 4.34Å; F88-L92 WeakPolarHBondContact O-CB 3.44Å; F88-L92 PolarHBondContact O-N 3.08Å
89	L	69.4	Low	62.3	Low	4 Å²	4	70 Å²	70	2%	0.021	35%	0.354	C	S	.	.	H	α-helix	trans	-63.4	-36.9	177	-85.3	92.6	0	0	0	112.3	L35 C38 E39 L53 V57 K85 V86 L93	L35-L89 HydrophobicContact CD1-CD1 4.24Å; C38-L89 HydrophobicContact CB-CD2 3.19Å; E39-L89 HydrophobicContact CG-CD1 4.38Å; L53-L89 HydrophobicContact CD1-CD2 4.36Å; V57-L89 HydrophobicContact CG2-CB 3.94Å; V57-L89 HydrophobicContact CG2-CD2 4.12Å; K85-L89 WeakPolarHBondContact O-CD1 3.3Å; K85-L89 PolarHBondContact O-N 3.46Å; V86-L89 PolarHBondContact O-N 3.06Å; L89-L93 WeakPolarHBondContact O-CB 3.43Å; L89-L93 PolarHBondContact O-N 2.87Å
90	K	70	Confident	61.1	Low	103 Å²	103	72.1 Å²	72.1	45%	0.448	37%	0.371	S	S	.	.	H	α-helix	trans	-67.1	-42.9	174.5	-170.9	-179.7	177.7	-173.9	0	111.8	V57 V86 D87 F88 L92 L93 E94	V57-K90 HydrophobicContact CG1-CB 4.26Å; V86-K90 WeakPolarHBondContact O-CB 3.46Å; V86-K90 PolarHBondContact O-N 2.96Å; D87-K90 PolarHBondContact O-N 3.44Å; F88-K90 VanDerWaalsContact C-N 3.3Å; F88-K90 PolarHBondContact O-N 3.49Å; K90-L92 VanDerWaalsContact C-N 3.32Å; K90-L92 PolarHBondContact O-N 3.32Å; K90-L93 WeakPolarHBondContact O-CB 3.46Å; K90-L93 PolarHBondContact O-N 3Å; K90-E94 HydrophobicContact CG-CG 4.44Å; K90-E94 WeakPolarHBondContact O-CG 3.43Å; K90-E94 PolarHBondContact O-N 3.21Å
91	G	63.1	Low	60	Low	40 Å²	40	74.5 Å²	74.5	41%	0.412	39%	0.388	S	S	.	.	H	α-helix	trans	-64	-37.4	176.1	0	0	0	0	0	112.6	D87 F88 L93 A95	D87-G91 PolarHBondContact O-N 2.86Å; F88-G91 PolarHBondContact O-N 2.83Å; G91-L93 PolarHBondContact O-N 3.23Å; G91-A95 WeakPolarHBondContact O-CB 3.47Å; G91-A95 PolarHBondContact O-N 3.36Å
92	L	63.5	Low	58.5	Low	58 Å²	58	75.3 Å²	75.3	30%	0.304	40%	0.399	S	S	.	.	H	α-helix	trans	-69.1	-21.9	175.9	-159.5	80.7	0	0	0	113.1	A42 R46 F88 K90	A42-L92 HydrophobicContact CB-CD2 3.92Å; R46-L92 PolarHBondContact NH1-O 3.34Å; R46-L92 PolarHBondContact NH2-O 3.46Å; F88-L92 HydrophobicContact CZ-CD1 4.34Å; F88-L92 WeakPolarHBondContact O-CB 3.44Å; F88-L92 PolarHBondContact O-N 3.08Å; K90-L92 VanDerWaalsContact C-N 3.32Å; K90-L92 PolarHBondContact O-N 3.32Å
93	L	64.1	Low	57.3	Low	17 Å²	17	80.4 Å²	80.4	9%	0.089	42%	0.424	C	S	.	.	H	α-helix	trans	-88.4	-44.5	176.7	-175.6	74.6	0	0	0	111.3	E54 L89 K90 G91 A95 E96 K97	E54-L93 HydrophobicContact CB-CD2 4.14Å; E54-L93 HydrophobicContact CG-CD1 3.57Å; E54-L93 HydrophobicContact CG-CD2 3.73Å; E54-L93 HydrophobicContact CG-CG 4.04Å; L89-L93 WeakPolarHBondContact O-CB 3.43Å; L89-L93 PolarHBondContact O-N 2.87Å; K90-L93 WeakPolarHBondContact O-CB 3.46Å; K90-L93 PolarHBondContact O-N 3Å; G91-L93 PolarHBondContact O-N 3.23Å; L93-A95 VanDerWaalsContact C-N 3.35Å; L93-A95 PolarHBondContact O-N 2.66Å; L93-E96 PolarHBondContact O-N 3.02Å; L93-K97 PolarHBondContact O-N 3.19Å
94	E	57.5	Low	56.1	Low	91 Å²	91	85.7 Å²	85.7	43%	0.425	44%	0.444	S	S	.	.	H	α-helix	trans	-64.5	-37	174.8	-70.4	-73.7	171.3	0	0	112.2	K90 E96 K97 L98	K90-E94 HydrophobicContact CG-CG 4.44Å; K90-E94 WeakPolarHBondContact O-CG 3.43Å; K90-E94 PolarHBondContact O-N 3.21Å; E94-E96 PolarHBondContact O-N 3.41Å; E94-K97 PolarHBondContact O-N 2.97Å; E94-L98 PolarHBondContact O-N 3.29Å
95	A	47.9	Very low	54.8	Low	68 Å²	68	80.6 Å²	80.6	56%	0.562	44%	0.44	S	S	*	.	H	α-helix	trans	-64	-21.9	175.1	0	0	0	0	0	113.3	G91 L93	G91-A95 WeakPolarHBondContact O-CB 3.47Å; G91-A95 PolarHBondContact O-N 3.36Å; L93-A95 VanDerWaalsContact C-N 3.35Å; L93-A95 PolarHBondContact O-N 2.66Å
96	E	48.7	Very low	53.5	Low	46 Å²	46	82.1 Å²	82.1	22%	0.215	45%	0.451	C	S	.	.	H	α-helix	trans	-88.5	-35.1	176	-167.6	165.8	-136.1	0	0	111.9	R46 L93 E94 L98 T99	R46-E96 WeakPolarHBondContact CD-OE1 3.29Å; R46-E96 WeakPolarHBondContact CD-OE2 3.39Å; R46-E96 IonicContact CZ-OE2 3.35Å; R46-E96 IonicContact NE-OE2 3.73Å; R46-E96 IonicContact NH1-OE1 3.57Å; R46-E96 IonicContact NH1-OE2 2.61Å; R46-E96 PolarHBondContact NH1-OE2 3.35Å; L93-E96 PolarHBondContact O-N 3.02Å; E94-E96 PolarHBondContact O-N 3.41Å; E96-L98 PolarHBondContact O-N 3.27Å; E96-L98 VanDerWaalsContact O-N 3.16Å; E96-T99 WeakPolarHBondContact CA-OG1 3.43Å; E96-T99 WeakPolarHBondContact O-CB 3.48Å; E96-T99 PolarHBondContact O-N 2.67Å; E96-T99 PolarHBondContact O-OG1 3.46Å
97	K	50	Low	52.3	Low	147 Å²	147	84 Å²	84	64%	0.639	47%	0.468	S	S	*	.	H	α-helix	trans	-62.7	-20.6	174.6	-150.1	177	-174.9	-178.2	0	113.6	L93 E94	L93-K97 PolarHBondContact O-N 3.19Å; E94-K97 PolarHBondContact O-N 2.97Å
98	L	38.8	Very low	51.1	Low	117 Å²	117	85.8 Å²	85.8	61%	0.613	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	6.5	177.1	-76.1	157.3	0	0	0	114	E94 E96 S100	E94-L98 PolarHBondContact O-N 3.29Å; E96-L98 PolarHBondContact O-N 3.27Å; E96-L98 VanDerWaalsContact O-N 3.16Å; L98-S100 PolarHBondContact O-N 2.96Å
99	T	41.8	Very low	50.1	Low	69 Å²	69	85.1 Å²	85.1	42%	0.423	48%	0.476	S	S	.	.			trans	-74.7	64.2	-175.3	-40.5	0	0	0	0	113	E96	E96-T99 WeakPolarHBondContact CA-OG1 3.43Å; E96-T99 WeakPolarHBondContact O-CB 3.48Å; E96-T99 PolarHBondContact O-N 2.67Å; E96-T99 PolarHBondContact O-OG1 3.46Å
100	S	36.5	Very low	49	Very low	73 Å²	73	91.8 Å²	91.8	51%	0.51	51%	0.505	S	S	.	.			trans	-75	129.6	161.2	-177.3	0	0	0	0	108.9	L98 T102 E103	L98-S100 PolarHBondContact O-N 2.96Å; S100-T102 PolarHBondContact O-N 3.37Å; S100-E103 PolarHBondContact O-N 3.12Å
101	P	40.7	Very low	47.8	Very low	107 Å²	107	93.2 Å²	93.2	70%	0.695	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-11.7	-167.6	21.8	-33.4	0	0	0	115.7
102	T	38.1	Very low	46.9	Very low	108 Å²	108	95.3 Å²	95.3	66%	0.663	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-25.8	-177.5	-42.2	0	0	0	0	113.2	S100	S100-T102 PolarHBondContact O-N 3.37Å
103	E	43.4	Very low	45.8	Very low	133 Å²	133	98.2 Å²	98.2	62%	0.621	55%	0.552	S	S	*	*	H	α-helix	trans	-78.7	-25.8	-178	-120.9	175.7	174.1	0	0	113.2	S100 A105 L106 A107	S100-E103 PolarHBondContact O-N 3.12Å; E103-A105 VanDerWaalsContact C-N 3.28Å; E103-A105 PolarHBondContact O-N 3.23Å; E103-L106 PolarHBondContact O-N 2.92Å; E103-A107 PolarHBondContact O-N 3.34Å
104	K	47.8	Very low	44.3	Very low	137 Å²	137	101.1 Å²	101.1	60%	0.596	59%	0.586	S	S	*	*	H	α-helix	trans	-65.9	-27.7	176.3	-80.2	-176.9	174.6	173.6	0	113.2	N108	K104-N108 PolarHBondContact O-N 3.01Å
105	A	44.4	Very low	43.5	Very low	71 Å²	71	108 Å²	108	59%	0.587	61%	0.608	S	S	*	*	H	α-helix	trans	-71.6	-35.1	175.5	0	0	0	0	0	112.1	E103	E103-A105 VanDerWaalsContact C-N 3.28Å; E103-A105 PolarHBondContact O-N 3.23Å
106	L	43	Very low	42.7	Very low	101 Å²	101	111.3 Å²	111.3	53%	0.529	62%	0.622	S	S	.	*	H	α-helix	trans	-75.3	-42.1	175.2	-76.7	173.7	0	0	0	111.6	E103 N108 Q109 F110	E103-L106 PolarHBondContact O-N 2.92Å; L106-N108 VanDerWaalsContact C-N 3.29Å; L106-N108 PolarHBondContact O-N 2.9Å; L106-Q109 WeakPolarHBondContact O-CB 3.28Å; L106-Q109 PolarHBondContact O-N 2.97Å; L106-F110 VanDerWaalsContact O-CD2 3.24Å; L106-F110 WeakPolarHBondContact O-CD2 3.5Å; L106-F110 PolarHBondContact O-N 3Å
107	A	47.3	Very low	42.6	Very low	45 Å²	45	114.5 Å²	114.5	37%	0.372	65%	0.647	S	S	.	*	H	α-helix	trans	-62	-33.7	-180	0	0	0	0	0	113.5	E103 Q109 F110 L111	E103-A107 PolarHBondContact O-N 3.34Å; A107-Q109 PolarHBondContact O-N 3.3Å; A107-F110 PolarHBondContact O-N 3.2Å; A107-L111 PolarHBondContact O-N 3.44Å
108	N	45.7	Very low	41.8	Very low	128 Å²	128	114 Å²	114	68%	0.684	66%	0.656	S	S	*	*	H	α-helix	trans	-67.2	-22.1	174.4	-82.3	-14.5	0	0	0	113.5	K104 L106	K104-N108 PolarHBondContact O-N 3.01Å; L106-N108 VanDerWaalsContact C-N 3.29Å; L106-N108 PolarHBondContact O-N 2.9Å
109	Q	50.8	Low	41.5	Very low	125 Å²	125	116.1 Å²	116.1	58%	0.584	67%	0.666	S	S	*	*	H	α-helix	trans	-82.8	-24.6	175.2	-150.6	179.6	103.6	0	0	112.1	L106 A107	L106-Q109 WeakPolarHBondContact O-CB 3.28Å; L106-Q109 PolarHBondContact O-N 2.97Å; A107-Q109 PolarHBondContact O-N 3.3Å
110	F	46	Very low	41.4	Very low	143 Å²	143	117.2 Å²	117.2	63%	0.627	68%	0.683	S	S	*	*	H	α-helix	trans	-89.9	-10.2	179.3	-76	-73.8	0	0	0	115	L106 A107	L106-F110 VanDerWaalsContact O-CD2 3.24Å; L106-F110 WeakPolarHBondContact O-CD2 3.5Å; L106-F110 PolarHBondContact O-N 3Å; A107-F110 PolarHBondContact O-N 3.2Å
111	L	45.3	Very low	41.6	Very low	134 Å²	134	121.4 Å²	121.4	70%	0.702	70%	0.699	S	S	*	*			trans	-97.4	25.8	-177.2	-75.2	169.7	0	0	0	114.8	A107 P113	A107-L111 PolarHBondContact O-N 3.44Å; L111-P113 WeakPolarHBondContact O-CD 3.44Å
112	A	42.7	Very low	41	Very low	83 Å²	83	125.6 Å²	125.6	69%	0.686	71%	0.709	S	S	*	*			trans	-67.2	115.8	160.2	0	0	0	0	0	109	G114	A112-G114 PolarHBondContact O-N 3.14Å; A112-G114 VanDerWaalsContact O-N 3.1Å
113	P	42.2	Very low	40.9	Very low	120 Å²	120	132 Å²	132	78%	0.779	72%	0.721	S	S	*	*			trans	-73.4	109.7	179.6	-15.6	32.2	0	0	0	110.1	L111 R115	L111-P113 WeakPolarHBondContact O-CD 3.44Å; P113-R115 PolarHBondContact O-N 3.15Å
114	G	32	Very low	40.6	Very low	78 Å²	78	131.3 Å²	131.3	80%	0.804	72%	0.72	S	S	*	*			trans	-61.6	118.5	155.1	0	0	0	0	0	108.9	A112	A112-G114 PolarHBondContact O-N 3.14Å; A112-G114 VanDerWaalsContact O-N 3.1Å
115	R	39.8	Very low	40.1	Very low	235 Å²	235	129.6 Å²	129.6	89%	0.887	72%	0.723	S	S	*	*			trans	-66.2	137.1	169.7	-74.2	175.4	140.9	95.3	-4.1	109.3	P113	P113-R115 PolarHBondContact O-N 3.15Å
116	T	30.9	Very low	39.8	Very low	137 Å²	137	130.7 Å²	130.7	84%	0.84	73%	0.731	S	S	*	*				-160.5	153.3	106.8	41.2	0	0	0	0	112.3
117	P	47.7	Very low	39.6	Very low	114 Å²	114	131.8 Å²	131.8	74%	0.74	74%	0.743	S	S	*	*			trans	-108.5	129.3	-169.6	34.8	-19.9	0	0	0	111.8
118	T	33.3	Very low	39.4	Very low	136 Å²	136	136.9 Å²	136.9	83%	0.834	76%	0.756	S	S	*	*			trans	-157.5	98.1	156.6	-27.6	0	0	0	0	111
119	I	32.5	Very low	39.2	Very low	161 Å²	161	136.5 Å²	136.5	83%	0.826	76%	0.759	S	S	*	*				163.2	124.2	116.1	-78.8	-165.9	0	0	0	106.8
120	A	40.3	Very low	38.9	Very low	93 Å²	93	135.7 Å²	135.7	77%	0.769	76%	0.762	S	S	*	*			trans	-72.3	153.8	-178.2	0	0	0	0	0	110.9
121	N	39.7	Very low	38.7	Very low	160 Å²	160	136.5 Å²	136.5	86%	0.856	77%	0.768	S	S	*	*			trans	94.2	73.6	162.1	-147.7	44.5	0	0	0	116.5
122	E	28.7	Very low	38.6	Very low	195 Å²	195	136.8 Å²	136.8	91%	0.911	77%	0.769	S	S	*	*			trans	-160.2	152.5	130.3	-115.9	-179.1	173.3	0	0	112.3	M124	E122-M124 PolarHBondContact O-N 3.39Å
123	R	34.8	Very low	38.6	Very low	243 Å²	243	138.4 Å²	138.4	92%	0.917	76%	0.762	S	S	*	*			trans	-74.9	115.5	-159.7	-155.4	174.6	-169.5	126.4	-3.9	111.4
124	M	39	Very low	38.6	Very low	118 Å²	118	136.7 Å²	136.7	58%	0.581	75%	0.753	S	S	*	*			trans	-22.7	128.4	161.1	-175.6	98.4	171.5	0	0	116.5	E122 K128	E122-M124 PolarHBondContact O-N 3.39Å; M124-K128 HydrophobicContact CE-CB 3.52Å; M124-K128 HydrophobicContact CE-CD 3.65Å; M124-K128 HydrophobicContact CE-CG 3.62Å; M124-K128 HydrophobicContact SD-CD 3.94Å; M124-K128 HydrophobicContact SD-CG 4.31Å
125	P	35.6	Very low	39.1	Very low	102 Å²	102	141.2 Å²	141.2	66%	0.662	75%	0.75	S	S	*	*			trans	-118.2	120.5	144.9	30.4	-16.5	0	0	0	111.8	T127	P125-T127 VanDerWaalsContact C-N 3.33Å; P125-T127 PolarHBondContact O-N 3.49Å; P125-T127 PolarHBondContact O-OG1 2.79Å
126	A	38.6	Very low	39.2	Very low	93 Å²	93	133.3 Å²	133.3	77%	0.769	74%	0.735	S	S	*	*	S	Bend	trans	45.8	22.5	142.8	0	0	0	0	0	122
127	T	38.7	Very low	40.1	Very low	125 Å²	125	134.3 Å²	134.3	77%	0.767	72%	0.723	S	S	*	*			trans	-107.3	5.1	-179.6	-36.1	0	0	0	0	114	P125	P125-T127 VanDerWaalsContact C-N 3.33Å; P125-T127 PolarHBondContact O-N 3.49Å; P125-T127 PolarHBondContact O-OG1 2.79Å
128	K	42.4	Very low	40	Very low	151 Å²	151	133 Å²	133	66%	0.657	72%	0.716	S	S	*	*	S	Bend	trans	-103.8	0.3	-172.8	-71.3	-171	173.6	166.7	0	117.2	M124	M124-K128 HydrophobicContact CE-CB 3.52Å; M124-K128 HydrophobicContact CE-CD 3.65Å; M124-K128 HydrophobicContact CE-CG 3.62Å; M124-K128 HydrophobicContact SD-CD 3.94Å; M124-K128 HydrophobicContact SD-CG 4.31Å
129	T	43.2	Very low	40.7	Very low	120 Å²	120	131.1 Å²	131.1	74%	0.736	71%	0.705	S	S	*	*	S	Bend	trans	-99.8	-11	-177	49.4	0	0	0	0	114.8
130	V	43.7	Very low	41.8	Very low	109 Å²	109	125.1 Å²	125.1	66%	0.661	68%	0.682	S	S	*	*	S	Bend	trans	-92.2	-9.6	179.4	-178	0	0	0	0	112.9
131	H	41.9	Very low	42.3	Very low	159 Å²	159	127.6 Å²	127.6	74%	0.736	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	-9.8	-173.4	-119	51	0	0	0	115.6
132	I	44.1	Very low	42.8	Very low	141 Å²	141	126.2 Å²	126.2	72%	0.723	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-26.9	175.8	-70.1	169.8	0	0	0	111.3
133	Q	41.9	Very low	44.1	Very low	117 Å²	117	125.2 Å²	125.2	55%	0.547	66%	0.656	S	S	.	*	H	α-helix	trans	-78.5	-23.9	-178.4	-159.3	177.5	24.1	0	0	113.5	R137	Q133-R137 VanDerWaalsContact NE2-NH2 3.15Å; Q133-R137 WeakPolarHBondContact O-CG 3.43Å
134	S	42	Very low	45	Very low	83 Å²	83	118.7 Å²	118.7	58%	0.58	64%	0.639	S	S	*	*	H	α-helix	trans	-76.9	-31.7	-179.9	-107	0	0	0	0	113.9	A136	S134-A136 PolarHBondContact O-N 3.07Å
135	K	42.5	Very low	45.9	Very low	174 Å²	174	121.2 Å²	121.2	76%	0.757	65%	0.65	S	S	*	*	H	α-helix	trans	-73.7	-23.6	179.6	-86.8	-170.8	173.4	-172.8	0	114.2	T139	K135-T139 PolarHBondContact O-OG1 3Å; K135-T139 VanDerWaalsContact O-OG1 3.13Å
136	A	42.5	Very low	46.5	Very low	68 Å²	68	123.2 Å²	123.2	56%	0.562	65%	0.654	S	S	*	*	H	α-helix	trans	-87.9	-20.8	177.1	0	0	0	0	0	113.4	S134 T139 G140	S134-A136 PolarHBondContact O-N 3.07Å; A136-T139 PolarHBondContact O-OG1 2.89Å; A136-G140 PolarHBondContact O-N 2.9Å
137	R	48.5	Very low	47.5	Very low	158 Å²	158	124 Å²	124	60%	0.596	64%	0.644	S	S	*	*	H	α-helix	trans	-82.3	-36.4	-179.7	-74.5	-177.2	-174.1	-124.1	5.7	113	Q133 G140 E141	Q133-R137 VanDerWaalsContact NE2-NH2 3.15Å; Q133-R137 WeakPolarHBondContact O-CG 3.43Å; R137-G140 PolarHBondContact O-N 3.24Å; R137-E141 PolarHBondContact O-N 3.01Å
138	C	47.3	Very low	48.2	Very low	88 Å²	88	121 Å²	121	60%	0.595	64%	0.639	S	S	*	*	H	α-helix	trans	-69.5	-33.6	178.7	-165.2	0	0	0	0	112.6	M142	C138-M142 PolarHBondContact O-N 2.96Å
139	T	47.8	Very low	48.5	Very low	96 Å²	96	118.7 Å²	118.7	59%	0.589	64%	0.637	S	S	*	*	H	α-helix	trans	-76.6	-26	173.9	39.4	0	0	0	0	113.4	K135 A136 R143	K135-T139 PolarHBondContact O-OG1 3Å; K135-T139 VanDerWaalsContact O-OG1 3.13Å; A136-T139 PolarHBondContact O-OG1 2.89Å; T139-R143 WeakPolarHBondContact O-CB 3.47Å; T139-R143 PolarHBondContact O-N 3.26Å
140	G	53.8	Low	48.4	Very low	35 Å²	35	124.4 Å²	124.4	36%	0.361	65%	0.645	S	S	.	*	H	α-helix	trans	-70	-47.9	174.8	0	0	0	0	0	112.6	A136 R137 M142 R143 D144	A136-G140 PolarHBondContact O-N 2.9Å; R137-G140 PolarHBondContact O-N 3.24Å; G140-M142 PolarHBondContact O-N 3.02Å; G140-R143 PolarHBondContact O-N 3.42Å; G140-R143 VanDerWaalsContact O-N 3.17Å; G140-D144 PolarHBondContact O-N 3.32Å
141	E	51.7	Low	48.7	Very low	144 Å²	144	125.6 Å²	125.6	67%	0.673	65%	0.653	S	S	*	*	H	α-helix	trans	-66.8	-36.9	180	-69.1	-177.2	172.5	0	0	112.1	R137 R143 D144 E145	R137-E141 PolarHBondContact O-N 3.01Å; E141-R143 VanDerWaalsContact C-N 3.3Å; E141-R143 PolarHBondContact O-N 2.83Å; E141-D144 PolarHBondContact O-N 3.24Å; E141-E145 PolarHBondContact O-N 3.36Å
142	M	50.1	Low	48.4	Very low	132 Å²	132	123.5 Å²	123.5	65%	0.65	66%	0.656	S	S	*	*	H	α-helix	trans	-67.7	-29.8	174.2	-157.4	175.5	-161.6	0	0	112.7	C138 G140 L146	C138-M142 PolarHBondContact O-N 2.96Å; G140-M142 PolarHBondContact O-N 3.02Å; M142-L146 WeakPolarHBondContact O-CB 3.46Å; M142-L146 WeakPolarHBondContact O-CD1 3.28Å; M142-L146 WeakPolarHBondContact O-CG 3.34Å; M142-L146 PolarHBondContact O-N 3.19Å
143	R	56.3	Low	48.1	Very low	174 Å²	174	120.2 Å²	120.2	66%	0.657	66%	0.658	S	S	*	*	H	α-helix	trans	-77.4	-35.7	176.3	-162.1	-175.1	-176.5	-135.7	1.2	111.9	T139 G140 E141 L146 L147	T139-R143 WeakPolarHBondContact O-CB 3.47Å; T139-R143 PolarHBondContact O-N 3.26Å; G140-R143 PolarHBondContact O-N 3.42Å; G140-R143 VanDerWaalsContact O-N 3.17Å; E141-R143 VanDerWaalsContact C-N 3.3Å; E141-R143 PolarHBondContact O-N 2.83Å; R143-L146 PolarHBondContact O-N 3.39Å; R143-L147 HydrophobicContact CG-CD1 3.88Å; R143-L147 HydrophobicContact CG-CG 4.46Å; R143-L147 VanDerWaalsContact O-CB 3.3Å; R143-L147 WeakPolarHBondContact O-CB 3.49Å; R143-L147 WeakPolarHBondContact O-CG 3.39Å; R143-L147 PolarHBondContact O-N 2.87Å
144	D	53	Low	47.7	Very low	105 Å²	105	124.5 Å²	124.5	56%	0.561	67%	0.674	S	S	*	*	H	α-helix	trans	-70.6	-32.6	174.9	-91.8	-1.4	0	0	0	112.5	G140 E141 G148	G140-D144 PolarHBondContact O-N 3.32Å; E141-D144 PolarHBondContact O-N 3.24Å; D144-G148 PolarHBondContact O-N 2.94Å; D144-G148 VanDerWaalsContact O-N 3.1Å
145	E	58.8	Low	47.2	Very low	172 Å²	172	124.8 Å²	124.8	80%	0.804	68%	0.681	S	S	*	*	H	α-helix	trans	-70.4	-37.7	170.6	-74.8	-159.2	157.8	0	0	112.6	E141	E141-E145 PolarHBondContact O-N 3.36Å
146	L	48.6	Very low	47	Very low	143 Å²	143	124.5 Å²	124.5	75%	0.749	69%	0.688	S	S	*	*	H	α-helix	trans	-74	-25.7	175.7	-77	166.6	0	0	0	113.6	M142 R143	M142-L146 WeakPolarHBondContact O-CB 3.46Å; M142-L146 WeakPolarHBondContact O-CD1 3.28Å; M142-L146 WeakPolarHBondContact O-CG 3.34Å; M142-L146 PolarHBondContact O-N 3.19Å; R143-L146 PolarHBondContact O-N 3.39Å
147	L	58.7	Low	46.7	Very low	109 Å²	109	124.1 Å²	124.1	57%	0.571	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	3.1	179	-66.9	174.4	0	0	0	114	R143 T149	R143-L147 HydrophobicContact CG-CD1 3.88Å; R143-L147 HydrophobicContact CG-CG 4.46Å; R143-L147 VanDerWaalsContact O-CB 3.3Å; R143-L147 WeakPolarHBondContact O-CB 3.49Å; R143-L147 WeakPolarHBondContact O-CG 3.39Å; R143-L147 PolarHBondContact O-N 2.87Å; L147-T149 PolarHBondContact O-N 3.42Å
148	G	53.8	Low	46.2	Very low	63 Å²	63	123.4 Å²	123.4	65%	0.649	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	59.6	46.9	163.2	0	0	0	0	0	115.3	D144 R150	D144-G148 PolarHBondContact O-N 2.94Å; D144-G148 VanDerWaalsContact O-N 3.1Å; G148-R150 PolarHBondContact O-N 3.18Å
149	T	48.5	Very low	45.9	Very low	102 Å²	102	125.7 Å²	125.7	63%	0.626	71%	0.705	S	S	*	*			trans	-91.8	79.2	172.1	-56.7	0	0	0	0	110.4	L147 T151	L147-T149 PolarHBondContact O-N 3.42Å; T149-T151 HydrophobicContact CG2-CG2 4.23Å
150	R	41.2	Very low	45.7	Very low	240 Å²	240	132.3 Å²	132.3	91%	0.906	72%	0.719	S	S	*	*			trans	-88.1	104.2	159	-135	-177.8	-154.8	163.5	7.1	107	G148 S152	G148-R150 PolarHBondContact O-N 3.18Å; R150-S152 PolarHBondContact O-N 3.47Å
151	T	49.4	Very low	45.2	Very low	134 Å²	134	137.9 Å²	137.9	82%	0.822	74%	0.74	S	S	*	*			trans	-63.8	103.4	171.2	44.7	0	0	0	0	109.1	T149	T149-T151 HydrophobicContact CG2-CG2 4.23Å
152	S	36.3	Very low	44.4	Very low	115 Å²	115	141.9 Å²	141.9	80%	0.804	75%	0.749	S	S	*	*			trans	-126.2	104	157.4	-169.1	0	0	0	0	107.3	R150 K154	R150-S152 PolarHBondContact O-N 3.47Å; S152-K154 PolarHBondContact O-N 2.88Å
153	G	37.9	Very low	44.1	Very low	73 Å²	73	146.6 Å²	146.6	75%	0.753	76%	0.76	S	S	*	*			trans	-64.1	131	176.6	0	0	0	0	0	111.4
154	K	33.7	Very low	43	Very low	207 Å²	207	145.4 Å²	145.4	90%	0.9	77%	0.771	S	S	*	*			trans	-176.2	131.4	132.4	-125.5	174.9	174	178.4	0	110.1	S152	S152-K154 PolarHBondContact O-N 2.88Å
155	A	31.6	Very low	42.4	Very low	88 Å²	88	147.9 Å²	147.9	73%	0.727	78%	0.784	S	S	*	*			trans	56.3	110.4	147.6	0	0	0	0	0	119.4
156	D	38.2	Very low	42	Very low	169 Å²	169	144.6 Å²	144.6	90%	0.904	78%	0.778	S	S	*	*				46.1	131.5	112.9	-149.7	19.3	0	0	0	120
157	G	34.6	Very low	41.8	Very low	60 Å²	60	146.3 Å²	146.3	62%	0.619	79%	0.787	S	S	*	*			trans	105.8	103.9	151.9	0	0	0	0	0	118.3
158	D	39	Very low	40.6	Very low	142 Å²	142	146.2 Å²	146.2	76%	0.759	79%	0.787	S	S	*	*				67.7	154.8	124.4	-156.5	21.5	0	0	0	121.6
159	L	41.6	Very low	40.3	Very low	137 Å²	137	152.1 Å²	152.1	72%	0.717	80%	0.797	S	S	*	*			trans	104.7	82.6	155.8	-52.2	177.1	0	0	0	119.5
160	R	43.7	Very low	40.2	Very low	234 Å²	234	158 Å²	158	88%	0.883	81%	0.808	S	S	*	*				14	124.2	116	-71.9	172.2	161.3	168.7	-4.3	117.9
161	N	42.3	Very low	40.2	Very low	152 Å²	152	153.3 Å²	153.3	81%	0.813	80%	0.796	S	S	*	*			trans	-160.4	96.4	135.4	-150.7	21.7	0	0	0	110
162	R	35.6	Very low	40.1	Very low	228 Å²	228	150.5 Å²	150.5	86%	0.86	78%	0.782	S	S	*	*				78	105.5	84	-162.2	177.1	-175.1	165.4	1.2	115.4
163	R	44.4	Very low	40.8	Very low	232 Å²	232	147.9 Å²	147.9	88%	0.875	77%	0.768	S	S	*	*			trans	5.6	135.3	144.7	-96.1	178.2	178.5	-174.8	-0	118.5
164	V	32.5	Very low	41.7	Very low	148 Å²	148	147.7 Å²	147.7	90%	0.897	76%	0.759	S	S	*	*				-157.9	146.8	122.5	172.4	0	0	0	0	110.5
165	L	39.4	Very low	42.7	Very low	157 Å²	157	144.6 Å²	144.6	82%	0.822	75%	0.748	S	S	*	*			trans	-79.7	-178.4	-175	-102	137	0	0	0	113.8
166	P	52.3	Low	43.8	Very low	104 Å²	104	145.3 Å²	145.3	68%	0.675	74%	0.738	S	S	*	*			trans	-94.6	146.5	-146.6	38.1	-35.5	0	0	0	114.9
167	L	42.9	Very low	44.8	Very low	179 Å²	179	142.1 Å²	142.1	94%	0.937	72%	0.721	S	S	*	*			trans	175.5	113.4	142.7	-130.7	80.5	0	0	0	107.8
168	D	33.3	Very low	46.4	Very low	107 Å²	107	142 Å²	142	57%	0.572	72%	0.715	S	S	*	*				174.6	93.3	129.8	-165.2	13.6	0	0	0	110.5	R170	D168-R170 VanDerWaalsContact C-N 3.34Å; D168-R170 PolarHBondContact O-N 3.42Å
169	E	47.8	Very low	47.4	Very low	187 Å²	187	138.8 Å²	138.8	87%	0.874	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	0.6	-176.1	-88.9	-160.1	115	0	0	114.8
170	R	47.1	Very low	48.3	Very low	225 Å²	225	137.4 Å²	137.4	85%	0.849	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	-25.8	-175	-87	-163	170.1	-171.9	-1	116.2	D168	D168-R170 VanDerWaalsContact C-N 3.34Å; D168-R170 PolarHBondContact O-N 3.42Å
171	Q	41.3	Very low	49.4	Very low	141 Å²	141	132.9 Å²	132.9	66%	0.659	68%	0.682	S	S	*	*	H	α-helix	trans	-85.9	-31.5	-177.8	-139.7	162.9	-6.1	0	0	112.3	A173	Q171-A173 VanDerWaalsContact C-N 3.34Å; Q171-A173 PolarHBondContact O-N 3.38Å
172	S	47.7	Very low	50.4	Low	76 Å²	76	131.5 Å²	131.5	53%	0.531	67%	0.67	S	S	.	*	H	α-helix	trans	-70	-26.2	177.1	-176.9	0	0	0	0	113.7	L176	S172-L176 WeakPolarHBondContact O-CB 3.49Å; S172-L176 PolarHBondContact O-N 2.86Å
173	A	50.9	Low	51.4	Low	60 Å²	60	126.5 Å²	126.5	50%	0.496	66%	0.656	S	S	.	*	H	α-helix	trans	-71.5	-36.3	-178.6	0	0	0	0	0	112.4	Q171 D177	Q171-A173 VanDerWaalsContact C-N 3.34Å; Q171-A173 PolarHBondContact O-N 3.38Å; A173-D177 VanDerWaalsContact O-CB 3.3Å; A173-D177 WeakPolarHBondContact O-CB 3.38Å; A173-D177 PolarHBondContact O-N 2.86Å
174	A	55.8	Low	52.2	Low	68 Å²	68	121.3 Å²	121.3	56%	0.562	64%	0.642	S	S	*	*	H	α-helix	trans	-75.1	-36.9	179.5	0	0	0	0	0	112.7	A178	A174-A178 PolarHBondContact O-N 3.26Å; A174-A178 VanDerWaalsContact O-N 3.13Å
175	E	54.2	Low	53.7	Low	143 Å²	143	118.4 Å²	118.4	67%	0.668	62%	0.621	S	S	*	*	H	α-helix	trans	-71.3	-35.8	172.8	-72.1	-174.3	164.9	0	0	111.9	V179	E175-V179 VanDerWaalsContact O-CG2 3.28Å; E175-V179 WeakPolarHBondContact O-CG2 3.48Å; E175-V179 PolarHBondContact O-N 2.92Å
176	L	55.5	Low	54.9	Low	102 Å²	102	115.1 Å²	115.1	53%	0.534	60%	0.604	S	S	.	*	H	α-helix	trans	-67.5	-38	174.7	-173	65.9	0	0	0	112	S172 V179 L180	S172-L176 WeakPolarHBondContact O-CB 3.49Å; S172-L176 PolarHBondContact O-N 2.86Å; L176-V179 PolarHBondContact O-N 3.4Å; L176-L180 HydrophobicContact CG-CD1 4.3Å; L176-L180 WeakPolarHBondContact O-CB 3.44Å; L176-L180 PolarHBondContact O-N 2.82Å
177	D	59.9	Low	55.1	Low	102 Å²	102	116.8 Å²	116.8	55%	0.545	60%	0.603	S	S	.	*	H	α-helix	trans	-67.2	-41.7	176.4	-165.6	49.2	0	0	0	111.8	A173 V179 L180 Q181	A173-D177 VanDerWaalsContact O-CB 3.3Å; A173-D177 WeakPolarHBondContact O-CB 3.38Å; A173-D177 PolarHBondContact O-N 2.86Å; D177-V179 VanDerWaalsContact C-N 3.34Å; D177-V179 PolarHBondContact O-N 3.21Å; D177-L180 PolarHBondContact O-N 3.27Å; D177-Q181 WeakPolarHBondContact O-CB 3.41Å; D177-Q181 PolarHBondContact O-N 2.91Å
178	A	66.7	Low	56.4	Low	58 Å²	58	113.8 Å²	113.8	48%	0.479	58%	0.584	S	S	.	*	H	α-helix	trans	-62.9	-38.2	174	0	0	0	0	0	112.6	A174 H182	A174-A178 PolarHBondContact O-N 3.26Å; A174-A178 VanDerWaalsContact O-N 3.13Å; A178-H182 WeakPolarHBondContact O-CB 3.28Å; A178-H182 PolarHBondContact O-N 3.35Å
179	V	61.3	Low	58.1	Low	74 Å²	74	115.2 Å²	115.2	45%	0.448	59%	0.585	S	S	.	*	H	α-helix	trans	-70	-38.5	174.3	169.9	0	0	0	0	111.3	E175 L176 D177 H182 H183	E175-V179 VanDerWaalsContact O-CG2 3.28Å; E175-V179 WeakPolarHBondContact O-CG2 3.48Å; E175-V179 PolarHBondContact O-N 2.92Å; L176-V179 PolarHBondContact O-N 3.4Å; D177-V179 VanDerWaalsContact C-N 3.34Å; D177-V179 PolarHBondContact O-N 3.21Å; V179-H182 WeakPolarHBondContact O-CB 3.34Å; V179-H182 PolarHBondContact O-N 3.05Å; V179-H183 PolarHBondContact O-CD2 2.96Å; V179-H183 VanDerWaalsContact O-CD2 3.26Å; V179-H183 PolarHBondContact O-N 3.48Å
180	L	60.5	Low	58.8	Low	108 Å²	108	111.5 Å²	111.5	57%	0.565	57%	0.571	S	S	*	*	H	α-helix	trans	-62.8	-43.5	174.8	-119.7	102.4	0	0	0	111.8	L176 D177 H182 H183 H184	L176-L180 HydrophobicContact CG-CD1 4.3Å; L176-L180 WeakPolarHBondContact O-CB 3.44Å; L176-L180 PolarHBondContact O-N 2.82Å; D177-L180 PolarHBondContact O-N 3.27Å; L180-H182 VanDerWaalsContact C-N 3.29Å; L180-H182 PolarHBondContact O-N 2.99Å; L180-H183 PolarHBondContact O-N 3.34Å; L180-H184 PolarHBondContact O-N 3.31Å
181	Q	66.2	Low	60	Low	139 Å²	139	103.6 Å²	103.6	65%	0.65	55%	0.553	S	S	*	*	H	α-helix	trans	-66.7	-34.1	177.9	-152.8	170.5	12.5	0	0	111.2	D177 H184 N185	D177-Q181 WeakPolarHBondContact O-CB 3.41Å; D177-Q181 PolarHBondContact O-N 2.91Å; Q181-H184 PolarHBondContact O-N 3.49Å; Q181-N185 WeakPolarHBondContact O-CB 3Å; Q181-N185 PolarHBondContact O-N 3.45Å; Q181-N185 VanDerWaalsContact O-N 3.12Å
182	H	63.8	Low	61.7	Low	123 Å²	123	101.9 Å²	101.9	57%	0.569	55%	0.545	S	S	*	.	H	α-helix	trans	-65.8	-44.2	171.7	-170.3	40.2	0	0	0	112.2	A178 V179 L180 H184 N185 L186	A178-H182 WeakPolarHBondContact O-CB 3.28Å; A178-H182 PolarHBondContact O-N 3.35Å; V179-H182 WeakPolarHBondContact O-CB 3.34Å; V179-H182 PolarHBondContact O-N 3.05Å; L180-H182 VanDerWaalsContact C-N 3.29Å; L180-H182 PolarHBondContact O-N 2.99Å; H182-H184 VanDerWaalsContact C-N 3.34Å; H182-H184 PolarHBondContact O-N 3.43Å; H182-N185 PolarHBondContact O-N 2.96Å; H182-L186 WeakPolarHBondContact O-CB 3.45Å; H182-L186 PolarHBondContact O-N 2.71Å
183	H	56.9	Low	62.8	Low	123 Å²	123	103.5 Å²	103.5	57%	0.569	55%	0.548	S	S	*	.	H	α-helix	trans	-62.3	-38.6	174.6	-87.3	-74.1	0	0	0	112.7	V179 L180 L186 Q187	V179-H183 PolarHBondContact O-CD2 2.96Å; V179-H183 VanDerWaalsContact O-CD2 3.26Å; V179-H183 PolarHBondContact O-N 3.48Å; L180-H183 PolarHBondContact O-N 3.34Å; H183-L186 PolarHBondContact O-N 2.94Å; H183-Q187 WeakPolarHBondContact O-CB 3.41Å; H183-Q187 PolarHBondContact O-N 2.97Å
184	H	60.2	Low	63.5	Low	124 Å²	124	106.2 Å²	106.2	57%	0.574	55%	0.552	S	S	*	*	H	α-helix	trans	-67.1	-42.8	178.7	-160.9	53	0	0	0	112.2	L180 Q181 H182 L186 Q187 E188	L180-H184 PolarHBondContact O-N 3.31Å; Q181-H184 PolarHBondContact O-N 3.49Å; H182-H184 VanDerWaalsContact C-N 3.34Å; H182-H184 PolarHBondContact O-N 3.43Å; H184-L186 VanDerWaalsContact C-N 3.32Å; H184-L186 PolarHBondContact O-N 3Å; H184-Q187 WeakPolarHBondContact O-CB 3.24Å; H184-Q187 PolarHBondContact O-N 2.99Å; H184-Q187 VanDerWaalsContact O-N 3.12Å; H184-E188 WeakPolarHBondContact O-CB 3.29Å; H184-E188 PolarHBondContact O-N 3.39Å
185	N	64	Low	64.7	Low	87 Å²	87	106.9 Å²	106.9	47%	0.465	55%	0.546	S	S	.	.	H	α-helix	trans	-68.6	-31.9	177.9	-155.8	-19.4	0	0	0	112.1	Q181 H182 K189	Q181-N185 WeakPolarHBondContact O-CB 3Å; Q181-N185 PolarHBondContact O-N 3.45Å; Q181-N185 VanDerWaalsContact O-N 3.12Å; H182-N185 PolarHBondContact O-N 2.96Å; N185-K189 WeakPolarHBondContact O-CB 3.43Å; N185-K189 PolarHBondContact O-N 3.45Å
186	L	65.3	Low	66	Low	88 Å²	88	103.2 Å²	103.2	46%	0.461	53%	0.53	S	S	.	.	H	α-helix	trans	-65.6	-41.2	168.6	-102	136.6	0	0	0	112	H182 H183 H184 L190	H182-L186 WeakPolarHBondContact O-CB 3.45Å; H182-L186 PolarHBondContact O-N 2.71Å; H183-L186 PolarHBondContact O-N 2.94Å; H184-L186 VanDerWaalsContact C-N 3.32Å; H184-L186 PolarHBondContact O-N 3Å; L186-L190 VanDerWaalsContact O-CB 3.3Å; L186-L190 WeakPolarHBondContact O-CB 3.47Å; L186-L190 PolarHBondContact O-N 3.36Å
187	Q	55.3	Low	66.8	Low	138 Å²	138	101.7 Å²	101.7	65%	0.645	52%	0.522	S	S	*	.	H	α-helix	trans	-69.7	-37.3	179.7	-160.6	175.7	4.8	0	0	112.1	H183 H184 L190 A191	H183-Q187 WeakPolarHBondContact O-CB 3.41Å; H183-Q187 PolarHBondContact O-N 2.97Å; H184-Q187 WeakPolarHBondContact O-CB 3.24Å; H184-Q187 PolarHBondContact O-N 2.99Å; H184-Q187 VanDerWaalsContact O-N 3.12Å; Q187-L190 PolarHBondContact O-N 3.49Å; Q187-A191 WeakPolarHBondContact O-CB 3.24Å; Q187-A191 PolarHBondContact O-N 3.4Å
188	E	71.1	Confident	67.5	Low	117 Å²	117	99.6 Å²	99.6	55%	0.547	52%	0.52	S	S	.	.	H	α-helix	trans	-66.2	-45.4	174.1	-168.6	171	-167.6	0	0	111.4	H184 L190 A191 E192	H184-E188 WeakPolarHBondContact O-CB 3.29Å; H184-E188 PolarHBondContact O-N 3.39Å; E188-L190 VanDerWaalsContact C-N 3.32Å; E188-L190 PolarHBondContact O-N 2.94Å; E188-A191 PolarHBondContact O-N 2.85Å; E188-E192 PolarHBondContact O-N 2.9Å
189	K	69.3	Low	68.1	Low	136 Å²	136	103 Å²	103	59%	0.591	52%	0.52	S	S	*	.	H	α-helix	trans	-60.1	-39.7	172.1	-84.7	178.8	176.6	164.9	0	113.1	N185 A191 E192 D193	N185-K189 WeakPolarHBondContact O-CB 3.43Å; N185-K189 PolarHBondContact O-N 3.45Å; K189-A191 VanDerWaalsContact C-N 3.33Å; K189-E192 WeakPolarHBondContact O-CB 3.46Å; K189-E192 PolarHBondContact O-N 3.29Å; K189-D193 PolarHBondContact O-N 3.28Å
190	L	61.8	Low	68.8	Low	110 Å²	110	104.6 Å²	104.6	58%	0.576	53%	0.526	S	S	*	.	H	α-helix	trans	-68.7	-35.9	179.6	-154.5	140.1	0	0	0	111.2	L186 Q187 E188 M194	L186-L190 VanDerWaalsContact O-CB 3.3Å; L186-L190 WeakPolarHBondContact O-CB 3.47Å; L186-L190 PolarHBondContact O-N 3.36Å; Q187-L190 PolarHBondContact O-N 3.49Å; E188-L190 VanDerWaalsContact C-N 3.32Å; E188-L190 PolarHBondContact O-N 2.94Å; L190-M194 HydrophobicContact CD2-CG 4.25Å; L190-M194 WeakPolarHBondContact O-CB 3.34Å; L190-M194 WeakPolarHBondContact O-CG 3.3Å; L190-M194 PolarHBondContact O-N 3.49Å
191	A	72.5	Confident	69.6	Low	58 Å²	58	104.3 Å²	104.3	48%	0.479	53%	0.525	S	S	.	.	H	α-helix	trans	-66.6	-41.2	172.1	0	0	0	0	0	112.1	Q187 E188 K189 M194 L195	Q187-A191 WeakPolarHBondContact O-CB 3.24Å; Q187-A191 PolarHBondContact O-N 3.4Å; E188-A191 PolarHBondContact O-N 2.85Å; K189-A191 VanDerWaalsContact C-N 3.33Å; A191-M194 PolarHBondContact O-N 2.95Å; A191-L195 WeakPolarHBondContact O-CB 3.48Å; A191-L195 PolarHBondContact O-N 3.1Å
192	E	77	Confident	70.2	Confident	105 Å²	105	104.3 Å²	104.3	49%	0.491	52%	0.522	S	S	.	.	H	α-helix	trans	-61.2	-44.3	175.6	-160.5	78.8	-138.3	0	0	111.4	E188 K189 L195 N196	E188-E192 PolarHBondContact O-N 2.9Å; K189-E192 WeakPolarHBondContact O-CB 3.46Å; K189-E192 PolarHBondContact O-N 3.29Å; E192-L195 PolarHBondContact O-N 3.25Å; E192-N196 PolarHBondContact O-N 2.89Å
193	D	70.5	Confident	70.8	Confident	111 Å²	111	103.2 Å²	103.2	59%	0.594	52%	0.521	S	S	*	.	H	α-helix	trans	-66.7	-40.9	177.7	-78.8	-16.6	0	0	0	112.2	K189 L195 N196 L197	K189-D193 PolarHBondContact O-N 3.28Å; D193-L195 VanDerWaalsContact C-N 3.27Å; D193-L195 PolarHBondContact O-N 3.39Å; D193-N196 PolarHBondContact O-N 3.13Å; D193-L197 WeakPolarHBondContact O-CB 3.41Å; D193-L197 PolarHBondContact O-N 2.94Å
194	M	66.2	Low	71.5	Confident	117 Å²	117	102.5 Å²	102.5	58%	0.576	52%	0.521	S	S	*	.	H	α-helix	trans	-60.5	-39.3	173.6	-68.3	-117.1	87	0	0	111.4	L190 A191 A198	L190-M194 HydrophobicContact CD2-CG 4.25Å; L190-M194 WeakPolarHBondContact O-CB 3.34Å; L190-M194 WeakPolarHBondContact O-CG 3.3Å; L190-M194 PolarHBondContact O-N 3.49Å; A191-M194 PolarHBondContact O-N 2.95Å; M194-A198 WeakPolarHBondContact O-CB 3.42Å; M194-A198 PolarHBondContact O-N 3.27Å
195	L	80.1	Confident	72	Confident	82 Å²	82	100.3 Å²	100.3	43%	0.429	52%	0.516	S	S	.	.	H	α-helix	trans	-73.7	-39.3	-177.5	-149.3	163.2	0	0	0	111	A191 E192 D193 A198 R199	A191-L195 WeakPolarHBondContact O-CB 3.48Å; A191-L195 PolarHBondContact O-N 3.1Å; E192-L195 PolarHBondContact O-N 3.25Å; D193-L195 VanDerWaalsContact C-N 3.27Å; D193-L195 PolarHBondContact O-N 3.39Å; L195-A198 PolarHBondContact O-N 3.26Å; L195-R199 HydrophobicContact CD2-CG 4.2Å; L195-R199 VanDerWaalsContact CD2-NE 3.33Å; L195-R199 WeakPolarHBondContact O-CG 3.41Å; L195-R199 PolarHBondContact O-N 3.17Å
196	N	81.3	Confident	72.7	Confident	65 Å²	65	100.4 Å²	100.4	35%	0.348	52%	0.517	S	S	.	.	H	α-helix	trans	-66	-40.3	172.3	-78.6	-25.1	0	0	0	112.5	E192 D193 R199 N200	E192-N196 PolarHBondContact O-N 2.89Å; D193-N196 PolarHBondContact O-N 3.13Å; N196-R199 PolarHBondContact O-N 2.74Å; N196-R199 PolarHBondContact OD1-NH1 3.07Å; N196-N200 WeakPolarHBondContact O-CB 3.19Å; N196-N200 VanDerWaalsContact O-CG 3.26Å; N196-N200 PolarHBondContact O-N 3.17Å; N196-N200 PolarHBondContact O-ND2 3.37Å
197	L	73.9	Confident	73.1	Confident	70 Å²	70	98.6 Å²	98.6	37%	0.366	51%	0.514	S	S	.	.	H	α-helix	trans	-61.8	-45.2	172.8	179.6	61.5	0	0	0	111.4	D193 R199 N200 L201	D193-L197 WeakPolarHBondContact O-CB 3.41Å; D193-L197 PolarHBondContact O-N 2.94Å; L197-R199 PolarHBondContact O-N 3.16Å; L197-N200 PolarHBondContact O-N 3.48Å; L197-L201 VanDerWaalsContact O-CB 3.29Å; L197-L201 WeakPolarHBondContact O-CB 3.34Å; L197-L201 PolarHBondContact O-N 3.32Å
198	A	73.4	Confident	73.8	Confident	59 Å²	59	93.9 Å²	93.9	49%	0.488	50%	0.499	S	S	.	.	H	α-helix	trans	-62.3	-41.3	177.8	0	0	0	0	0	112.3	M194 L195 K202	M194-A198 WeakPolarHBondContact O-CB 3.42Å; M194-A198 PolarHBondContact O-N 3.27Å; L195-A198 PolarHBondContact O-N 3.26Å; A198-K202 VanDerWaalsContact O-CB 3.27Å; A198-K202 WeakPolarHBondContact O-CB 3.4Å; A198-K202 PolarHBondContact O-N 2.92Å
199	R	78.8	Confident	73.7	Confident	129 Å²	129	94.4 Å²	94.4	49%	0.487	50%	0.501	S	S	.	.	H	α-helix	trans	-63.6	-45.1	174.5	-76.1	178.4	-176.1	137.4	-1.3	111.8	L195 N196 L197 K202 N203	L195-R199 HydrophobicContact CD2-CG 4.2Å; L195-R199 VanDerWaalsContact CD2-NE 3.33Å; L195-R199 WeakPolarHBondContact O-CG 3.41Å; L195-R199 PolarHBondContact O-N 3.17Å; N196-R199 PolarHBondContact O-N 2.74Å; N196-R199 PolarHBondContact OD1-NH1 3.07Å; L197-R199 PolarHBondContact O-N 3.16Å; R199-K202 PolarHBondContact O-N 3.25Å; R199-N203 WeakPolarHBondContact O-CB 3.37Å; R199-N203 VanDerWaalsContact O-CG 3.29Å; R199-N203 PolarHBondContact O-N 2.92Å
200	N	77.8	Confident	74	Confident	107 Å²	107	93.2 Å²	93.2	57%	0.572	50%	0.501	S	S	*	.	H	α-helix	trans	-64.9	-42.9	178.7	-74.6	-27.3	0	0	0	111.8	N196 L197 K202 N203 N204	N196-N200 WeakPolarHBondContact O-CB 3.19Å; N196-N200 VanDerWaalsContact O-CG 3.26Å; N196-N200 PolarHBondContact O-N 3.17Å; N196-N200 PolarHBondContact O-ND2 3.37Å; L197-N200 PolarHBondContact O-N 3.48Å; N200-K202 PolarHBondContact O-N 2.93Å; N200-N203 PolarHBondContact O-N 3.19Å; N200-N204 VanDerWaalsContact O-CB 3.3Å; N200-N204 WeakPolarHBondContact O-CB 3.49Å; N200-N204 PolarHBondContact O-N 3.37Å
201	L	76.3	Confident	74.5	Confident	103 Å²	103	92.3 Å²	92.3	54%	0.539	50%	0.496	S	S	.	.	H	α-helix	trans	-64.1	-40.7	176.2	-171.9	143.8	0	0	0	111.5	L197 T205	L197-L201 VanDerWaalsContact O-CB 3.29Å; L197-L201 WeakPolarHBondContact O-CB 3.34Å; L197-L201 PolarHBondContact O-N 3.32Å; L201-T205 VanDerWaalsContact O-CB 3.26Å; L201-T205 WeakPolarHBondContact O-CB 3.5Å; L201-T205 PolarHBondContact O-N 3.29Å; L201-T205 PolarHBondContact O-OG1 2.99Å
202	K	79.4	Confident	74.4	Confident	138 Å²	138	95 Å²	95	60%	0.6	50%	0.501	S	S	*	.	H	α-helix	trans	-61.5	-47	174.3	-177	-179.9	178.8	-180	0	111.5	A198 R199 N200 T205 L206	A198-K202 VanDerWaalsContact O-CB 3.27Å; A198-K202 WeakPolarHBondContact O-CB 3.4Å; A198-K202 PolarHBondContact O-N 2.92Å; R199-K202 PolarHBondContact O-N 3.25Å; N200-K202 PolarHBondContact O-N 2.93Å; K202-T205 PolarHBondContact O-N 3.05Å; K202-L206 HydrophobicContact CG-CD1 4.29Å; K202-L206 WeakPolarHBondContact O-CG 2.96Å; K202-L206 PolarHBondContact O-N 3.31Å
203	N	76.4	Confident	74.3	Confident	101 Å²	101	96.5 Å²	96.5	54%	0.54	51%	0.506	S	S	.	.	H	α-helix	trans	-65.7	-42.3	179.3	-71.2	-13.1	0	0	0	112.1	R199 N200 L206 A207	R199-N203 WeakPolarHBondContact O-CB 3.37Å; R199-N203 VanDerWaalsContact O-CG 3.29Å; R199-N203 PolarHBondContact O-N 2.92Å; N200-N203 PolarHBondContact O-N 3.19Å; N203-L206 PolarHBondContact O-N 3.19Å; N203-A207 WeakPolarHBondContact O-CB 3.39Å; N203-A207 PolarHBondContact O-N 2.99Å
204	N	70.8	Confident	74.4	Confident	107 Å²	107	96.9 Å²	96.9	57%	0.572	50%	0.504	S	S	*	.	H	α-helix	trans	-63.5	-42.9	175.9	-170.9	-50.1	0	0	0	111.3	N200 L206 A207 A208	N200-N204 VanDerWaalsContact O-CB 3.3Å; N200-N204 WeakPolarHBondContact O-CB 3.49Å; N200-N204 PolarHBondContact O-N 3.37Å; N204-L206 PolarHBondContact O-N 3.11Å; N204-A207 PolarHBondContact O-N 3.25Å; N204-A208 WeakPolarHBondContact O-CB 3.23Å; N204-A208 PolarHBondContact O-N 3.26Å
205	T	70.2	Confident	74.6	Confident	78 Å²	78	95.3 Å²	95.3	48%	0.479	50%	0.498	S	S	.	.	H	α-helix	trans	-64.1	-42.1	177.9	-58.7	0	0	0	0	112.2	L201 K202 A208 Q209	L201-T205 VanDerWaalsContact O-CB 3.26Å; L201-T205 WeakPolarHBondContact O-CB 3.5Å; L201-T205 PolarHBondContact O-N 3.29Å; L201-T205 PolarHBondContact O-OG1 2.99Å; K202-T205 PolarHBondContact O-N 3.05Å; T205-A208 PolarHBondContact O-N 3.35Å; T205-Q209 PolarHBondContact O-N 3.17Å
206	L	79	Confident	74	Confident	90 Å²	90	96.4 Å²	96.4	47%	0.471	51%	0.505	S	S	.	.	H	α-helix	trans	-65.9	-39.3	175.7	-71.9	173.2	0	0	0	112	K202 N203 N204 Q209 N210	K202-L206 HydrophobicContact CG-CD1 4.29Å; K202-L206 WeakPolarHBondContact O-CG 2.96Å; K202-L206 PolarHBondContact O-N 3.31Å; N203-L206 PolarHBondContact O-N 3.19Å; N204-L206 PolarHBondContact O-N 3.11Å; L206-Q209 PolarHBondContact O-N 2.91Å; L206-N210 PolarHBondContact O-N 3.23Å; L206-N210 VanDerWaalsContact O-N 3.14Å
207	A	73	Confident	73.5	Confident	50 Å²	50	99 Å²	99	41%	0.413	52%	0.515	S	S	.	.	H	α-helix	trans	-62.9	-45.9	173.9	0	0	0	0	0	111.2	N203 N204 Q209 N210 I211	N203-A207 WeakPolarHBondContact O-CB 3.39Å; N203-A207 PolarHBondContact O-N 2.99Å; N204-A207 PolarHBondContact O-N 3.25Å; A207-Q209 VanDerWaalsContact C-N 3.32Å; A207-Q209 PolarHBondContact O-N 3.07Å; A207-N210 PolarHBondContact O-N 3.43Å; A207-I211 VanDerWaalsContact O-CG1 3.28Å; A207-I211 WeakPolarHBondContact O-CG1 3.17Å; A207-I211 PolarHBondContact O-N 3.46Å
208	A	71.6	Confident	73.2	Confident	38 Å²	38	98.8 Å²	98.8	31%	0.314	52%	0.516	S	S	.	.	H	α-helix	trans	-59.2	-40.7	175.3	0	0	0	0	0	112	N204 T205 N210 I211 I212	N204-A208 WeakPolarHBondContact O-CB 3.23Å; N204-A208 PolarHBondContact O-N 3.26Å; T205-A208 PolarHBondContact O-N 3.35Å; A208-N210 PolarHBondContact O-N 3.21Å; A208-I211 PolarHBondContact O-N 2.84Å; A208-I212 WeakPolarHBondContact O-CB 3.39Å; A208-I212 WeakPolarHBondContact O-CD1 3.45Å; A208-I212 WeakPolarHBondContact O-CG1 3.41Å; A208-I212 PolarHBondContact O-N 3.39Å
209	Q	68.3	Low	72.8	Confident	129 Å²	129	101.7 Å²	101.7	60%	0.603	52%	0.523	S	S	*	.	H	α-helix	trans	-62.1	-41	176.8	-172.3	-176.3	1.5	0	0	112.5	T205 L206 A207 K213	T205-Q209 PolarHBondContact O-N 3.17Å; L206-Q209 PolarHBondContact O-N 2.91Å; A207-Q209 VanDerWaalsContact C-N 3.32Å; A207-Q209 PolarHBondContact O-N 3.07Å; Q209-K213 PolarHBondContact O-N 3.05Å; Q209-K213 VanDerWaalsContact O-N 3.15Å
210	N	74.8	Confident	72.4	Confident	111 Å²	111	98.7 Å²	98.7	59%	0.594	52%	0.522	S	S	*	.	H	α-helix	trans	-70.4	-37.8	179.1	-156.9	21.6	0	0	0	111.6	L206 A207 A208 K213 Q214	L206-N210 PolarHBondContact O-N 3.23Å; L206-N210 VanDerWaalsContact O-N 3.14Å; A207-N210 PolarHBondContact O-N 3.43Å; A208-N210 PolarHBondContact O-N 3.21Å; N210-K213 WeakPolarHBondContact O-CB 3.39Å; N210-K213 PolarHBondContact O-N 3.29Å; N210-Q214 PolarHBondContact O-N 2.92Å
211	I	73.8	Confident	72	Confident	91 Å²	91	100.2 Å²	100.2	47%	0.467	53%	0.526	S	S	.	.	H	α-helix	trans	-63.6	-46.2	174.1	-65.8	164.7	0	0	0	110.5	A207 A208 K213 Q214 D215	A207-I211 VanDerWaalsContact O-CG1 3.28Å; A207-I211 WeakPolarHBondContact O-CG1 3.17Å; A207-I211 PolarHBondContact O-N 3.46Å; A208-I211 PolarHBondContact O-N 2.84Å; I211-K213 PolarHBondContact O-N 2.87Å; I211-Q214 CarbonylContact O-C 3.59Å; I211-Q214 WeakPolarHBondContact O-CB 3.42Å; I211-Q214 PolarHBondContact O-N 3.33Å; I211-Q214 VanDerWaalsContact O-N 3.07Å; I211-D215 WeakPolarHBondContact O-CB 3.36Å; I211-D215 VanDerWaalsContact O-CG 3.32Å; I211-D215 PolarHBondContact O-N 2.71Å
212	I	68.9	Low	71.3	Confident	114 Å²	114	98.7 Å²	98.7	59%	0.585	52%	0.523	S	S	*	.	H	α-helix	trans	-57.4	-39.2	176.3	-69.6	161.8	0	0	0	111.3	A208 D215 N216	A208-I212 WeakPolarHBondContact O-CB 3.39Å; A208-I212 WeakPolarHBondContact O-CD1 3.45Å; A208-I212 WeakPolarHBondContact O-CG1 3.41Å; A208-I212 PolarHBondContact O-N 3.39Å; I212-D215 PolarHBondContact O-N 3.36Å; I212-N216 WeakPolarHBondContact O-CB 3.33Å; I212-N216 PolarHBondContact O-N 3.5Å
213	K	74.9	Confident	70.2	Confident	137 Å²	137	98.1 Å²	98.1	60%	0.596	53%	0.525	S	S	*	.	H	α-helix	trans	-67.2	-41.2	177.6	-166.7	177.6	-179.1	-178.3	0	111.8	Q209 N210 I211 Q217	Q209-K213 PolarHBondContact O-N 3.05Å; Q209-K213 VanDerWaalsContact O-N 3.15Å; N210-K213 WeakPolarHBondContact O-CB 3.39Å; N210-K213 PolarHBondContact O-N 3.29Å; I211-K213 PolarHBondContact O-N 2.87Å; K213-Q217 WeakPolarHBondContact O-CG 3.39Å; K213-Q217 PolarHBondContact O-N 3.18Å
214	Q	74.4	Confident	70.1	Confident	119 Å²	119	102.4 Å²	102.4	56%	0.556	53%	0.533	S	S	*	.	H	α-helix	trans	-67.5	-39.9	175.7	-175	177.3	-22.9	0	0	112	N210 I211 N216 Q217 T218	N210-Q214 PolarHBondContact O-N 2.92Å; I211-Q214 CarbonylContact O-C 3.59Å; I211-Q214 WeakPolarHBondContact O-CB 3.42Å; I211-Q214 PolarHBondContact O-N 3.33Å; I211-Q214 VanDerWaalsContact O-N 3.07Å; Q214-N216 VanDerWaalsContact C-N 3.34Å; Q214-N216 PolarHBondContact O-N 3.35Å; Q214-Q217 PolarHBondContact O-N 2.94Å; Q214-T218 WeakPolarHBondContact O-CB 3.27Å; Q214-T218 PolarHBondContact O-N 3.38Å; Q214-T218 PolarHBondContact O-OG1 2.94Å
215	D	68.6	Low	69.7	Low	83 Å²	83	103.5 Å²	103.5	44%	0.444	54%	0.535	S	S	.	.	H	α-helix	trans	-65.6	-38.1	177.4	-73.4	-10.8	0	0	0	111.2	I211 I212 Q217 T218 L219	I211-D215 WeakPolarHBondContact O-CB 3.36Å; I211-D215 VanDerWaalsContact O-CG 3.32Å; I211-D215 PolarHBondContact O-N 2.71Å; I212-D215 PolarHBondContact O-N 3.36Å; D215-Q217 VanDerWaalsContact C-N 3.35Å; D215-Q217 PolarHBondContact O-N 2.93Å; D215-T218 PolarHBondContact O-N 2.61Å; D215-L219 VanDerWaalsContact O-CB 3.28Å; D215-L219 WeakPolarHBondContact O-CB 3.29Å; D215-L219 PolarHBondContact O-N 3.37Å
216	N	69.1	Low	69.4	Low	106 Å²	106	102.3 Å²	102.3	57%	0.567	53%	0.533	S	S	*	.	H	α-helix	trans	-65.3	-37.8	175.5	-164.3	-90.1	0	0	0	112.6	I212 Q214 S220	I212-N216 WeakPolarHBondContact O-CB 3.33Å; I212-N216 PolarHBondContact O-N 3.5Å; Q214-N216 VanDerWaalsContact C-N 3.34Å; Q214-N216 PolarHBondContact O-N 3.35Å; N216-S220 PolarHBondContact O-N 3.45Å; N216-S220 PolarHBondContact O-OG 3.22Å
217	Q	69.6	Low	69	Low	119 Å²	119	102.4 Å²	102.4	56%	0.556	53%	0.534	S	S	*	.	H	α-helix	trans	-66.9	-42.2	172.8	-71.7	-179.7	-18.9	0	0	111.7	K213 Q214 D215 S220 Q221	K213-Q217 WeakPolarHBondContact O-CG 3.39Å; K213-Q217 PolarHBondContact O-N 3.18Å; Q214-Q217 PolarHBondContact O-N 2.94Å; D215-Q217 VanDerWaalsContact C-N 3.35Å; D215-Q217 PolarHBondContact O-N 2.93Å; Q217-S220 PolarHBondContact O-N 3.31Å; Q217-Q221 WeakPolarHBondContact O-CG 3.47Å; Q217-Q221 PolarHBondContact O-N 2.64Å
218	T	68.1	Low	69.1	Low	66 Å²	66	105 Å²	105	41%	0.405	54%	0.54	S	S	.	.	H	α-helix	trans	-68.8	-37.3	179	-54.6	0	0	0	0	111.7	Q214 D215 Q221 S222	Q214-T218 WeakPolarHBondContact O-CB 3.27Å; Q214-T218 PolarHBondContact O-N 3.38Å; Q214-T218 PolarHBondContact O-OG1 2.94Å; D215-T218 PolarHBondContact O-N 2.61Å; T218-Q221 PolarHBondContact O-N 2.84Å; T218-S222 VanDerWaalsContact O-CB 3.31Å; T218-S222 WeakPolarHBondContact O-CB 3.32Å; T218-S222 PolarHBondContact O-N 3.42Å; T218-S222 PolarHBondContact O-OG 3.3Å
219	L	64.8	Low	69.2	Low	119 Å²	119	107 Å²	107	62%	0.623	55%	0.546	S	S	*	.	H	α-helix	trans	-60	-45.2	170.6	-99.2	152.2	0	0	0	111.4	D215 Q221 S222 M223	D215-L219 VanDerWaalsContact O-CB 3.28Å; D215-L219 WeakPolarHBondContact O-CB 3.29Å; D215-L219 PolarHBondContact O-N 3.37Å; L219-Q221 VanDerWaalsContact C-N 3.34Å; L219-Q221 PolarHBondContact O-N 3.05Å; L219-S222 PolarHBondContact O-N 3.24Å; L219-M223 WeakPolarHBondContact O-CB 3.26Å; L219-M223 PolarHBondContact O-N 2.99Å
220	S	69.6	Low	69.3	Low	67 Å²	67	106.7 Å²	106.7	47%	0.469	54%	0.543	S	S	.	.	H	α-helix	trans	-63.9	-39.4	178.6	-61.1	0	0	0	0	112.3	N216 Q217 R224	N216-S220 PolarHBondContact O-N 3.45Å; N216-S220 PolarHBondContact O-OG 3.22Å; Q217-S220 PolarHBondContact O-N 3.31Å; S220-R224 PolarHBondContact O-N 3.05Å; S220-R224 VanDerWaalsContact O-N 3.16Å
221	Q	71.1	Confident	69.1	Low	138 Å²	138	107.8 Å²	107.8	65%	0.645	54%	0.544	S	S	*	.	H	α-helix	trans	-69.2	-41.8	174.9	-71.1	-177.5	-0.5	0	0	112	Q217 T218 L219 M223 R224 Q225	Q217-Q221 WeakPolarHBondContact O-CG 3.47Å; Q217-Q221 PolarHBondContact O-N 2.64Å; T218-Q221 PolarHBondContact O-N 2.84Å; L219-Q221 VanDerWaalsContact C-N 3.34Å; L219-Q221 PolarHBondContact O-N 3.05Å; Q221-M223 VanDerWaalsContact C-N 3.33Å; Q221-M223 PolarHBondContact O-N 3.37Å; Q221-R224 PolarHBondContact O-N 3Å; Q221-Q225 PolarHBondContact O-N 3.36Å
222	S	61.3	Low	68.9	Low	71 Å²	71	109.8 Å²	109.8	50%	0.497	55%	0.55	S	S	.	.	H	α-helix	trans	-64.2	-38.3	177.8	-60	0	0	0	0	111.8	T218 L219 Q225 A226	T218-S222 VanDerWaalsContact O-CB 3.31Å; T218-S222 WeakPolarHBondContact O-CB 3.32Å; T218-S222 PolarHBondContact O-N 3.42Å; T218-S222 PolarHBondContact O-OG 3.3Å; L219-S222 PolarHBondContact O-N 3.24Å; S222-Q225 PolarHBondContact O-N 3.01Å; S222-A226 WeakPolarHBondContact O-CB 3.5Å; S222-A226 PolarHBondContact O-N 3.48Å
223	M	56.6	Low	68.7	Low	127 Å²	127	108.9 Å²	108.9	63%	0.626	55%	0.546	S	S	*	.	H	α-helix	trans	-66.4	-45.3	176.2	-169.9	151.8	-178	0	0	111.6	L219 Q221 Q225 A226 D227	L219-M223 WeakPolarHBondContact O-CB 3.26Å; L219-M223 PolarHBondContact O-N 2.99Å; Q221-M223 VanDerWaalsContact C-N 3.33Å; Q221-M223 PolarHBondContact O-N 3.37Å; M223-Q225 VanDerWaalsContact C-N 3.29Å; M223-Q225 PolarHBondContact O-N 3.48Å; M223-A226 WeakPolarHBondContact O-CB 3.45Å; M223-A226 PolarHBondContact O-N 2.78Å; M223-A226 VanDerWaalsContact O-N 3.15Å; M223-D227 PolarHBondContact O-N 3.35Å
224	R	73.1	Confident	68.3	Low	191 Å²	191	108.9 Å²	108.9	72%	0.721	55%	0.546	S	S	*	.	H	α-helix	trans	-59.1	-39.5	173.7	-83	-177.2	171.3	175.8	-1.6	112.9	S220 Q221 D227 L228	S220-R224 PolarHBondContact O-N 3.05Å; S220-R224 VanDerWaalsContact O-N 3.16Å; Q221-R224 PolarHBondContact O-N 3Å; R224-D227 PolarHBondContact O-N 2.96Å; R224-L228 WeakPolarHBondContact O-CG 3.33Å; R224-L228 PolarHBondContact O-N 3.29Å
225	Q	63.3	Low	67.9	Low	129 Å²	129	107 Å²	107	60%	0.603	54%	0.542	S	S	*	.	H	α-helix	trans	-73.7	-31.4	178.6	-167.3	155.2	-2.3	0	0	112.1	Q221 S222 M223 N229	Q221-Q225 PolarHBondContact O-N 3.36Å; S222-Q225 PolarHBondContact O-N 3.01Å; M223-Q225 VanDerWaalsContact C-N 3.29Å; M223-Q225 PolarHBondContact O-N 3.48Å; Q225-N229 WeakPolarHBondContact O-CB 3.18Å; Q225-N229 VanDerWaalsContact O-CG 3.25Å; Q225-N229 PolarHBondContact O-N 3.02Å; Q225-N229 PolarHBondContact O-ND2 2.92Å
226	A	64.3	Low	67.2	Low	54 Å²	54	109 Å²	109	45%	0.446	55%	0.549	S	S	.	.	H	α-helix	trans	-63.9	-44.2	170.1	0	0	0	0	0	111.6	S222 M223 L228 N229 F230	S222-A226 WeakPolarHBondContact O-CB 3.5Å; S222-A226 PolarHBondContact O-N 3.48Å; M223-A226 WeakPolarHBondContact O-CB 3.45Å; M223-A226 PolarHBondContact O-N 2.78Å; M223-A226 VanDerWaalsContact O-N 3.15Å; A226-L228 PolarHBondContact O-N 3.21Å; A226-N229 PolarHBondContact O-N 3.31Å; A226-F230 WeakPolarHBondContact O-CB 3.38Å; A226-F230 PolarHBondContact O-N 2.98Å
227	D	68.8	Low	66.5	Low	91 Å²	91	107.4 Å²	107.4	49%	0.487	55%	0.546	S	S	.	.	H	α-helix	trans	-60.6	-45.5	176.1	-67.9	-32.1	0	0	0	111.7	M223 R224 N229 F230 E231	M223-D227 PolarHBondContact O-N 3.35Å; R224-D227 PolarHBondContact O-N 2.96Å; D227-N229 VanDerWaalsContact C-N 3.33Å; D227-N229 PolarHBondContact O-N 2.95Å; D227-F230 WeakPolarHBondContact O-CB 3.16Å; D227-F230 PolarHBondContact O-N 3.39Å; D227-E231 PolarHBondContact O-N 3.39Å
228	L	76.4	Confident	65.7	Low	104 Å²	104	106.8 Å²	106.8	55%	0.545	54%	0.543	S	S	.	.	H	α-helix	trans	-64.1	-36.8	176.4	-70.7	173.7	0	0	0	112.7	R224 A226 K232	R224-L228 WeakPolarHBondContact O-CG 3.33Å; R224-L228 PolarHBondContact O-N 3.29Å; A226-L228 PolarHBondContact O-N 3.21Å; L228-K232 VanDerWaalsContact O-CG 3.32Å; L228-K232 WeakPolarHBondContact O-CG 3.49Å; L228-K232 PolarHBondContact O-N 3.05Å; L228-K232 VanDerWaalsContact O-N 3.16Å
229	N	73.7	Confident	65.3	Low	82 Å²	82	111.6 Å²	111.6	44%	0.439	55%	0.554	S	S	.	*	H	α-helix	trans	-70.5	-35.8	174.9	-76.6	-42.3	0	0	0	111.5	Q225 A226 D227 K232 L233	Q225-N229 WeakPolarHBondContact O-CB 3.18Å; Q225-N229 VanDerWaalsContact O-CG 3.25Å; Q225-N229 PolarHBondContact O-N 3.02Å; Q225-N229 PolarHBondContact O-ND2 2.92Å; A226-N229 PolarHBondContact O-N 3.31Å; D227-N229 VanDerWaalsContact C-N 3.33Å; D227-N229 PolarHBondContact O-N 2.95Å; N229-K232 PolarHBondContact O-N 2.95Å; N229-L233 WeakPolarHBondContact O-CB 3.24Å; N229-L233 VanDerWaalsContact O-CG 3.3Å; N229-L233 WeakPolarHBondContact O-CG 3.37Å; N229-L233 PolarHBondContact O-N 3.43Å
230	F	70.3	Confident	64.9	Low	122 Å²	122	111.3 Å²	111.3	54%	0.535	55%	0.553	S	S	.	*	H	α-helix	trans	-65.8	-44.1	176.1	-169	-92.4	0	0	0	111.5	A226 D227 K232 L233 K234	A226-F230 WeakPolarHBondContact O-CB 3.38Å; A226-F230 PolarHBondContact O-N 2.98Å; D227-F230 WeakPolarHBondContact O-CB 3.16Å; D227-F230 PolarHBondContact O-N 3.39Å; F230-K232 VanDerWaalsContact C-N 3.33Å; F230-K232 PolarHBondContact O-N 2.89Å; F230-L233 PolarHBondContact O-N 2.94Å; F230-K234 WeakPolarHBondContact O-CB 3.26Å; F230-K234 PolarHBondContact O-N 3.23Å
231	E	71.1	Confident	64.2	Low	133 Å²	133	113 Å²	113	62%	0.621	55%	0.553	S	S	*	*	H	α-helix	trans	-61.2	-41.5	174.2	-77.2	-143.5	130.9	0	0	112.4	D227 K234 T235	D227-E231 PolarHBondContact O-N 3.39Å; E231-K234 PolarHBondContact O-N 3.1Å; E231-T235 PolarHBondContact O-N 3.47Å; E231-T235 PolarHBondContact O-OG1 3.08Å
232	K	68.9	Low	63.3	Low	134 Å²	134	112.3 Å²	112.3	58%	0.583	55%	0.55	S	S	*	.	H	α-helix	trans	-64.3	-44.3	175.6	-75.3	179.3	-179.4	-178.5	0	112.1	L228 N229 F230 K234 T235 E236	L228-K232 VanDerWaalsContact O-CG 3.32Å; L228-K232 WeakPolarHBondContact O-CG 3.49Å; L228-K232 PolarHBondContact O-N 3.05Å; L228-K232 VanDerWaalsContact O-N 3.16Å; N229-K232 PolarHBondContact O-N 2.95Å; F230-K232 VanDerWaalsContact C-N 3.33Å; F230-K232 PolarHBondContact O-N 2.89Å; K232-K234 VanDerWaalsContact C-N 3.29Å; K232-K234 PolarHBondContact O-N 3.25Å; K232-T235 WeakPolarHBondContact CA-OG1 3.47Å; K232-T235 PolarHBondContact O-N 3Å; K232-T235 PolarHBondContact O-OG1 2.67Å; K232-E236 VanDerWaalsContact O-CB 3.29Å; K232-E236 WeakPolarHBondContact O-CB 3.47Å; K232-E236 WeakPolarHBondContact O-CG 3.39Å; K232-E236 PolarHBondContact O-N 2.92Å
233	L	64.6	Low	62.9	Low	95 Å²	95	115 Å²	115	50%	0.497	55%	0.554	S	S	.	*	H	α-helix	trans	-63	-37	175.4	-75.6	168	0	0	0	111.7	N229 F230 S237	N229-L233 WeakPolarHBondContact O-CB 3.24Å; N229-L233 VanDerWaalsContact O-CG 3.3Å; N229-L233 WeakPolarHBondContact O-CG 3.37Å; N229-L233 PolarHBondContact O-N 3.43Å; F230-L233 PolarHBondContact O-N 2.94Å; L233-S237 WeakPolarHBondContact O-CB 3.37Å; L233-S237 PolarHBondContact O-N 2.94Å
234	K	67.1	Low	62.7	Low	137 Å²	137	113.1 Å²	113.1	60%	0.596	55%	0.55	S	S	*	*	H	α-helix	trans	-66.1	-44.7	176	-170.8	178.3	-179.4	-179.7	0	111.9	F230 E231 K232 S237 E238	F230-K234 WeakPolarHBondContact O-CB 3.26Å; F230-K234 PolarHBondContact O-N 3.23Å; E231-K234 PolarHBondContact O-N 3.1Å; K232-K234 VanDerWaalsContact C-N 3.29Å; K232-K234 PolarHBondContact O-N 3.25Å; K234-S237 PolarHBondContact O-N 3.37Å; K234-E238 WeakPolarHBondContact O-CB 3.28Å; K234-E238 PolarHBondContact O-N 3.34Å
235	T	65	Low	61.7	Low	79 Å²	79	110.1 Å²	110.1	49%	0.485	54%	0.542	S	S	.	.	H	α-helix	trans	-69.2	-38	176.9	20.7	0	0	0	0	112.5	E231 K232 R239	E231-T235 PolarHBondContact O-N 3.47Å; E231-T235 PolarHBondContact O-OG1 3.08Å; K232-T235 WeakPolarHBondContact CA-OG1 3.47Å; K232-T235 PolarHBondContact O-N 3Å; K232-T235 PolarHBondContact O-OG1 2.67Å; T235-R239 WeakPolarHBondContact O-CB 3.49Å; T235-R239 WeakPolarHBondContact O-CG 3.32Å; T235-R239 PolarHBondContact O-N 3.21Å
236	E	54.7	Low	61.4	Low	125 Å²	125	112.2 Å²	112.2	58%	0.584	55%	0.549	S	S	*	.	H	α-helix	trans	-64.7	-43.3	172.7	-69.7	-102	155	0	0	111	K232 R239 L240	K232-E236 VanDerWaalsContact O-CB 3.29Å; K232-E236 WeakPolarHBondContact O-CB 3.47Å; K232-E236 WeakPolarHBondContact O-CG 3.39Å; K232-E236 PolarHBondContact O-N 2.92Å; E236-R239 PolarHBondContact O-N 3.37Å; E236-L240 WeakPolarHBondContact O-CD1 3.35Å; E236-L240 PolarHBondContact O-N 3.31Å
237	S	53.9	Low	61	Low	73 Å²	73	112.1 Å²	112.1	51%	0.51	55%	0.545	S	S	.	.	H	α-helix	trans	-62.9	-43.9	176.4	-173.9	0	0	0	0	112.1	L233 K234 R239 L240 E241	L233-S237 WeakPolarHBondContact O-CB 3.37Å; L233-S237 PolarHBondContact O-N 2.94Å; K234-S237 PolarHBondContact O-N 3.37Å; S237-R239 VanDerWaalsContact C-N 3.33Å; S237-R239 PolarHBondContact O-N 3.32Å; S237-L240 PolarHBondContact O-N 3.33Å; S237-E241 PolarHBondContact O-N 3.43Å
238	E	53.5	Low	60.7	Low	105 Å²	105	111.2 Å²	111.2	49%	0.491	54%	0.543	S	S	.	.	H	α-helix	trans	-66.8	-35.3	178.6	-170.9	167.3	-164.9	0	0	111.8	K234 Q242	K234-E238 WeakPolarHBondContact O-CB 3.28Å; K234-E238 PolarHBondContact O-N 3.34Å; E238-Q242 WeakPolarHBondContact O-CG 3.42Å; E238-Q242 PolarHBondContact O-N 3.41Å; E238-Q242 VanDerWaalsContact O-N 3.15Å
239	R	59.4	Low	60.5	Low	167 Å²	167	111.7 Å²	111.7	63%	0.63	55%	0.546	S	S	*	.	H	α-helix	trans	-65.5	-43.8	170.6	-76.7	174.7	70.7	128.5	-0.3	112	T235 E236 S237 E241 Q242 H243	T235-R239 WeakPolarHBondContact O-CB 3.49Å; T235-R239 WeakPolarHBondContact O-CG 3.32Å; T235-R239 PolarHBondContact O-N 3.21Å; E236-R239 PolarHBondContact O-N 3.37Å; S237-R239 VanDerWaalsContact C-N 3.33Å; S237-R239 PolarHBondContact O-N 3.32Å; R239-E241 PolarHBondContact O-N 3.06Å; R239-Q242 PolarHBondContact O-N 3.45Å; R239-H243 PolarHBondContact O-CD2 2.88Å; R239-H243 PolarHBondContact O-N 2.89Å
240	L	56.3	Low	60.6	Low	114 Å²	114	115.5 Å²	115.5	60%	0.597	55%	0.554	S	S	*	*	H	α-helix	trans	-63.8	-38.7	177.6	-97.6	80.8	0	0	0	112.5	E236 S237 H243 T244	E236-L240 WeakPolarHBondContact O-CD1 3.35Å; E236-L240 PolarHBondContact O-N 3.31Å; S237-L240 PolarHBondContact O-N 3.33Å; L240-H243 PolarHBondContact O-N 2.86Å; L240-T244 WeakPolarHBondContact O-CB 3.27Å; L240-T244 PolarHBondContact O-N 3.45Å; L240-T244 PolarHBondContact O-OG1 3.35Å
241	E	54.1	Low	60.9	Low	103 Å²	103	113.5 Å²	113.5	48%	0.481	55%	0.549	S	S	.	.	H	α-helix	trans	-68.4	-39.5	179.1	-160	-173.1	153	0	0	111.9	S237 R239 T244 K245	S237-E241 PolarHBondContact O-N 3.43Å; R239-E241 PolarHBondContact O-N 3.06Å; E241-T244 PolarHBondContact O-N 2.99Å; E241-K245 PolarHBondContact O-N 3.02Å; E241-K245 VanDerWaalsContact O-N 3.08Å; E241-K245 IonicContact OE1-NZ 2.68Å; E241-K245 PolarHBondContact OE1-NZ 3.39Å
242	Q	52.4	Low	61.3	Low	122 Å²	122	112.4 Å²	112.4	57%	0.57	55%	0.547	S	S	*	.	H	α-helix	trans	-67.7	-38.4	175.5	-75.7	178.6	0.2	0	0	112.7	E238 R239 K246	E238-Q242 WeakPolarHBondContact O-CG 3.42Å; E238-Q242 PolarHBondContact O-N 3.41Å; E238-Q242 VanDerWaalsContact O-N 3.15Å; R239-Q242 PolarHBondContact O-N 3.45Å; Q242-K246 PolarHBondContact O-N 2.95Å
243	H	52.6	Low	62.1	Low	128 Å²	128	113.7 Å²	113.7	59%	0.593	55%	0.548	S	S	*	.	H	α-helix	trans	-66.6	-37.7	173.6	-83.9	-72.9	0	0	0	111.7	R239 L240 S247	R239-H243 PolarHBondContact O-CD2 2.88Å; R239-H243 PolarHBondContact O-N 2.89Å; L240-H243 PolarHBondContact O-N 2.86Å; H243-S247 WeakPolarHBondContact O-CA 3.34Å; H243-S247 WeakPolarHBondContact O-CB 3.47Å; H243-S247 PolarHBondContact O-N 3.24Å
244	T	52.8	Low	63.1	Low	88 Å²	88	113 Å²	113	54%	0.54	55%	0.545	S	S	.	.	H	α-helix	trans	-68.2	-42.9	179.2	-54.1	0	0	0	0	111.8	L240 E241 V248	L240-T244 WeakPolarHBondContact O-CB 3.27Å; L240-T244 PolarHBondContact O-N 3.45Å; L240-T244 PolarHBondContact O-OG1 3.35Å; E241-T244 PolarHBondContact O-N 2.99Å; T244-V248 HydrophobicContact CG2-CG2 4.44Å; T244-V248 WeakPolarHBondContact O-CB 3.44Å; T244-V248 WeakPolarHBondContact O-CG2 3.24Å; T244-V248 PolarHBondContact O-N 3.1Å
245	K	53	Low	63.9	Low	127 Å²	127	112.1 Å²	112.1	55%	0.552	54%	0.544	S	S	*	.	H	α-helix	trans	-70.6	-40.2	-179	-75.7	172.8	174.1	165.8	0	114.1	E241 N249	E241-K245 PolarHBondContact O-N 3.02Å; E241-K245 VanDerWaalsContact O-N 3.08Å; E241-K245 IonicContact OE1-NZ 2.68Å; E241-K245 PolarHBondContact OE1-NZ 3.39Å; K245-N249 PolarHBondContact O-ND2 3.29Å
246	K	56.6	Low	64.9	Low	174 Å²	174	113.9 Å²	113.9	76%	0.757	55%	0.55	S	S	*	.	H	α-helix	trans	-77.7	-38.4	175.9	-82.5	-173	176.9	177.1	0	112.6	Q242 N249 W250	Q242-K246 PolarHBondContact O-N 2.95Å; K246-N249 PolarHBondContact O-N 3.47Å; K246-W250 WeakPolarHBondContact O-CB 3.45Å; K246-W250 PolarHBondContact O-N 2.92Å
247	S	55.9	Low	66.5	Low	51 Å²	51	111.7 Å²	111.7	36%	0.357	54%	0.541	S	S	.	.	H	α-helix	trans	-66	-38	179.1	-170.2	0	0	0	0	111.5	H243 W250 L251	H243-S247 WeakPolarHBondContact O-CA 3.34Å; H243-S247 WeakPolarHBondContact O-CB 3.47Å; H243-S247 PolarHBondContact O-N 3.24Å; S247-W250 PolarHBondContact O-N 3.25Å; S247-L251 WeakPolarHBondContact O-CB 3.49Å; S247-L251 WeakPolarHBondContact O-CG 3.44Å; S247-L251 PolarHBondContact O-N 3.47Å
248	V	62.1	Low	68.2	Low	73 Å²	73	113.2 Å²	113.2	44%	0.442	54%	0.543	S	S	.	.	H	α-helix	trans	-63.1	-46.5	175.9	169	0	0	0	0	111.8	T244 W250 L251 L252	T244-V248 HydrophobicContact CG2-CG2 4.44Å; T244-V248 WeakPolarHBondContact O-CB 3.44Å; T244-V248 WeakPolarHBondContact O-CG2 3.24Å; T244-V248 PolarHBondContact O-N 3.1Å; V248-W250 PolarHBondContact O-N 3.43Å; V248-L251 PolarHBondContact O-N 3.02Å; V248-L252 HydrophobicContact CG1-CD1 3.94Å; V248-L252 HydrophobicContact CG1-CG 4.33Å; V248-L252 WeakPolarHBondContact O-CB 3.49Å; V248-L252 WeakPolarHBondContact O-CG 3.3Å; V248-L252 PolarHBondContact O-N 2.83Å
249	N	73.1	Confident	69.8	Low	114 Å²	114	112 Å²	112	61%	0.61	54%	0.543	S	S	*	.	H	α-helix	trans	-64	-40.1	178	-74.7	-58.1	0	0	0	112.5	K245 K246 W253	K245-N249 PolarHBondContact O-ND2 3.29Å; K246-N249 PolarHBondContact O-N 3.47Å; N249-W253 PolarHBondContact O-N 3.34Å; N249-W253 VanDerWaalsContact O-N 3.14Å
250	W	74.8	Confident	71.1	Confident	161 Å²	161	107 Å²	107	61%	0.61	53%	0.534	S	S	*	.	H	α-helix	trans	-70.4	-40.1	177.9	-171.3	75.5	0	0	0	112.6	K246 S247 V248 W253 L254	K246-W250 WeakPolarHBondContact O-CB 3.45Å; K246-W250 PolarHBondContact O-N 2.92Å; S247-W250 PolarHBondContact O-N 3.25Å; V248-W250 PolarHBondContact O-N 3.43Å; W250-W253 PolarHBondContact O-N 3.49Å; W250-L254 HydrophobicContact CH2-CD1 4.02Å; W250-L254 HydrophobicContact CZ2-CD1 4.31Å; W250-L254 HydrophobicContact CZ3-CD1 4.32Å; W250-L254 WeakPolarHBondContact O-CB 3.14Å; W250-L254 PolarHBondContact O-N 3.01Å
251	L	77.5	Confident	72.8	Confident	80 Å²	80	108 Å²	108	42%	0.419	53%	0.533	S	S	.	.	H	α-helix	trans	-66.3	-38.6	174.5	-75	172.7	0	0	0	112	S247 V248 W253 L254 M255	S247-L251 WeakPolarHBondContact O-CB 3.49Å; S247-L251 WeakPolarHBondContact O-CG 3.44Å; S247-L251 PolarHBondContact O-N 3.47Å; V248-L251 PolarHBondContact O-N 3.02Å; L251-W253 VanDerWaalsContact C-N 3.33Å; L251-W253 PolarHBondContact O-N 3Å; L251-L254 PolarHBondContact O-N 3.12Å; L251-M255 WeakPolarHBondContact O-CB 3.43Å; L251-M255 VanDerWaalsContact O-CG 3.23Å; L251-M255 WeakPolarHBondContact O-CG 3.47Å; L251-M255 PolarHBondContact O-N 2.9Å
252	L	79.1	Confident	74.3	Confident	111 Å²	111	107 Å²	107	58%	0.581	53%	0.534	S	S	*	.	H	α-helix	trans	-62.1	-41.5	174	-74.3	173.6	0	0	0	111.5	V248 M255 L256	V248-L252 HydrophobicContact CG1-CD1 3.94Å; V248-L252 HydrophobicContact CG1-CG 4.33Å; V248-L252 WeakPolarHBondContact O-CB 3.49Å; V248-L252 WeakPolarHBondContact O-CG 3.3Å; V248-L252 PolarHBondContact O-N 2.83Å; L252-M255 PolarHBondContact O-N 2.93Å; L252-L256 PolarHBondContact O-N 2.9Å
253	W	85.2	Confident	76.1	Confident	161 Å²	161	107 Å²	107	61%	0.61	53%	0.532	S	S	*	.	H	α-helix	trans	-67.4	-39	175.5	-161	72.8	0	0	0	112.3	N249 W250 L251 L256 I257	N249-W253 PolarHBondContact O-N 3.34Å; N249-W253 VanDerWaalsContact O-N 3.14Å; W250-W253 PolarHBondContact O-N 3.49Å; L251-W253 VanDerWaalsContact C-N 3.33Å; L251-W253 PolarHBondContact O-N 3Å; W253-L256 WeakPolarHBondContact O-CB 3.04Å; W253-L256 PolarHBondContact O-N 2.87Å; W253-I257 HydrophobicContact CD2-CD1 3.71Å; W253-I257 HydrophobicContact CE3-CD1 3.31Å; W253-I257 HydrophobicContact CE3-CG1 4.49Å; W253-I257 HydrophobicContact CH2-CD1 3.53Å; W253-I257 HydrophobicContact CZ2-CD1 3.89Å; W253-I257 HydrophobicContact CZ3-CD1 3.22Å; W253-I257 WeakPolarHBondContact O-CG1 3.46Å; W253-I257 PolarHBondContact O-N 3.42Å
254	L	86.5	Confident	77.6	Confident	81 Å²	81	105 Å²	105	42%	0.424	53%	0.525	S	S	.	.	H	α-helix	trans	-63.2	-42.3	174.6	-172.8	123.1	0	0	0	112	W250 L251 L256 I257 L258	W250-L254 HydrophobicContact CH2-CD1 4.02Å; W250-L254 HydrophobicContact CZ2-CD1 4.31Å; W250-L254 HydrophobicContact CZ3-CD1 4.32Å; W250-L254 WeakPolarHBondContact O-CB 3.14Å; W250-L254 PolarHBondContact O-N 3.01Å; L251-L254 PolarHBondContact O-N 3.12Å; L254-L256 VanDerWaalsContact C-N 3.34Å; L254-I257 PolarHBondContact O-N 3.47Å; L254-L258 PolarHBondContact O-N 3.12Å
255	M	82.9	Confident	78.8	Confident	118 Å²	118	103 Å²	103	58%	0.581	52%	0.515	S	S	*	.	H	α-helix	trans	-64.5	-37.6	174.9	-70.7	-69.1	-106.7	0	0	111.9	L251 L252 L258 V259	L251-M255 WeakPolarHBondContact O-CB 3.43Å; L251-M255 VanDerWaalsContact O-CG 3.23Å; L251-M255 WeakPolarHBondContact O-CG 3.47Å; L251-M255 PolarHBondContact O-N 2.9Å; L252-M255 PolarHBondContact O-N 2.93Å; M255-L258 PolarHBondContact O-N 2.95Å; M255-V259 WeakPolarHBondContact O-CG2 3.3Å; M255-V259 PolarHBondContact O-N 3.39Å
256	L	86.9	Confident	80.4	Confident	116 Å²	116	102.5 Å²	102.5	61%	0.607	52%	0.516	S	S	*	.	H	α-helix	trans	-64.3	-42.4	175.3	-175.2	69.8	0	0	0	112.1	L252 W253 L254 V259 S260	L252-L256 PolarHBondContact O-N 2.9Å; W253-L256 WeakPolarHBondContact O-CB 3.04Å; W253-L256 PolarHBondContact O-N 2.87Å; L254-L256 VanDerWaalsContact C-N 3.34Å; L256-V259 PolarHBondContact O-N 3.49Å; L256-S260 PolarHBondContact O-N 3.06Å; L256-S260 VanDerWaalsContact O-N 3.14Å
257	I	88.9	Confident	81.6	Confident	78 Å²	78	99.3 Å²	99.3	40%	0.4	51%	0.506	S	S	.	.	H	α-helix	trans	-64.3	-41.9	176.7	-71.6	166.5	0	0	0	111.3	W253 L254 V259 S260 F261	W253-I257 HydrophobicContact CD2-CD1 3.71Å; W253-I257 HydrophobicContact CE3-CD1 3.31Å; W253-I257 HydrophobicContact CE3-CG1 4.49Å; W253-I257 HydrophobicContact CH2-CD1 3.53Å; W253-I257 HydrophobicContact CZ2-CD1 3.89Å; W253-I257 HydrophobicContact CZ3-CD1 3.22Å; W253-I257 WeakPolarHBondContact O-CG1 3.46Å; W253-I257 PolarHBondContact O-N 3.42Å; L254-I257 PolarHBondContact O-N 3.47Å; I257-V259 VanDerWaalsContact C-N 3.32Å; I257-V259 PolarHBondContact O-N 3.13Å; I257-S260 WeakPolarHBondContact O-CB 3.48Å; I257-S260 PolarHBondContact O-N 3.26Å; I257-F261 PolarHBondContact O-N 3.43Å
258	L	88	Confident	82.7	Confident	106 Å²	106	101.2 Å²	101.2	56%	0.555	51%	0.512	S	S	*	.	H	α-helix	trans	-57.5	-46.6	178.9	-170.8	80.1	0	0	0	111.2	L254 M255 F261 T262	L254-L258 PolarHBondContact O-N 3.12Å; M255-L258 PolarHBondContact O-N 2.95Å; L258-F261 PolarHBondContact O-N 3.4Å; L258-T262 PolarHBondContact O-N 3.43Å
259	V	88.8	Confident	83.3	Confident	79 Å²	79	104.3 Å²	104.3	48%	0.479	52%	0.519	S	S	.	.	H	α-helix	trans	-62.1	-46.2	177.1	175.2	0	0	0	0	110.6	M255 L256 I257 F261 T262 F263	M255-V259 WeakPolarHBondContact O-CG2 3.3Å; M255-V259 PolarHBondContact O-N 3.39Å; L256-V259 PolarHBondContact O-N 3.49Å; I257-V259 VanDerWaalsContact C-N 3.32Å; I257-V259 PolarHBondContact O-N 3.13Å; V259-F261 VanDerWaalsContact C-N 3.29Å; V259-F261 PolarHBondContact O-N 3.19Å; V259-T262 PolarHBondContact O-N 2.98Å; V259-T262 VanDerWaalsContact O-N 3.15Å; V259-T262 PolarHBondContact O-OG1 2.87Å; V259-F263 HydrophobicContact CG1-CD2 4.15Å; V259-F263 HydrophobicContact CG1-CE2 3.98Å; V259-F263 WeakPolarHBondContact O-CD2 3.47Å; V259-F263 PolarHBondContact O-N 3.1Å
260	S	86.9	Confident	83.5	Confident	63 Å²	63	105.2 Å²	105.2	44%	0.441	52%	0.523	S	S	.	.	H	α-helix	trans	-56.8	-41.5	175.7	-175	0	0	0	0	112.5	L256 I257 T262 F263 I264	L256-S260 PolarHBondContact O-N 3.06Å; L256-S260 VanDerWaalsContact O-N 3.14Å; I257-S260 WeakPolarHBondContact O-CB 3.48Å; I257-S260 PolarHBondContact O-N 3.26Å; S260-T262 VanDerWaalsContact C-N 3.34Å; S260-T262 PolarHBondContact O-N 3.22Å; S260-F263 WeakPolarHBondContact O-CB 3.27Å; S260-F263 PolarHBondContact O-N 3.41Å; S260-I264 WeakPolarHBondContact O-CG1 3.4Å; S260-I264 PolarHBondContact O-N 3.04Å
261	F	90.7	Very high	83.3	Confident	135 Å²	135	107.4 Å²	107.4	59%	0.592	53%	0.531	S	S	*	.	H	α-helix	trans	-64.1	-35.8	178.6	-168.1	-95.1	0	0	0	112.9	I257 L258 V259 I264 S265	I257-F261 PolarHBondContact O-N 3.43Å; L258-F261 PolarHBondContact O-N 3.4Å; V259-F261 VanDerWaalsContact C-N 3.29Å; V259-F261 PolarHBondContact O-N 3.19Å; F261-I264 PolarHBondContact O-N 3.22Å; F261-S265 WeakPolarHBondContact CE1-OG 3.37Å; F261-S265 VanDerWaalsContact O-CB 3.27Å; F261-S265 WeakPolarHBondContact O-CB 3.28Å; F261-S265 PolarHBondContact O-N 3.46Å; F261-S265 PolarHBondContact O-OG 3.48Å
262	T	86.3	Confident	83	Confident	81 Å²	81	109 Å²	109	50%	0.497	54%	0.539	S	S	.	.	H	α-helix	trans	-65.8	-38.8	175.2	64.5	0	0	0	0	112.4	L258 V259 S260 S265 M266	L258-T262 PolarHBondContact O-N 3.43Å; V259-T262 PolarHBondContact O-N 2.98Å; V259-T262 VanDerWaalsContact O-N 3.15Å; V259-T262 PolarHBondContact O-OG1 2.87Å; S260-T262 VanDerWaalsContact C-N 3.34Å; S260-T262 PolarHBondContact O-N 3.22Å; T262-S265 PolarHBondContact O-N 3.42Å; T262-M266 WeakPolarHBondContact O-CB 3.3Å; T262-M266 PolarHBondContact O-N 3.38Å
263	F	88.9	Confident	82.2	Confident	122 Å²	122	109.8 Å²	109.8	54%	0.535	54%	0.538	S	S	.	.	H	α-helix	trans	-64.2	-45.9	173.6	-85.4	-80.1	0	0	0	111.8	V259 S260 S265 M266 I267	V259-F263 HydrophobicContact CG1-CD2 4.15Å; V259-F263 HydrophobicContact CG1-CE2 3.98Å; V259-F263 WeakPolarHBondContact O-CD2 3.47Å; V259-F263 PolarHBondContact O-N 3.1Å; S260-F263 WeakPolarHBondContact O-CB 3.27Å; S260-F263 PolarHBondContact O-N 3.41Å; F263-S265 VanDerWaalsContact C-N 3.31Å; F263-S265 PolarHBondContact O-N 3.17Å; F263-M266 HydrophobicContact CD1-CE 4.49Å; F263-M266 PolarHBondContact O-N 3.19Å; F263-I267 WeakPolarHBondContact O-CG1 3.4Å; F263-I267 PolarHBondContact O-N 3.17Å
264	I	85.4	Confident	81.2	Confident	86 Å²	86	106.6 Å²	106.6	44%	0.441	54%	0.538	S	S	.	.	H	α-helix	trans	-62.1	-42.3	176.1	-65.8	171.9	0	0	0	110.2	S260 F261 M266 I267 L268	S260-I264 WeakPolarHBondContact O-CG1 3.4Å; S260-I264 PolarHBondContact O-N 3.04Å; F261-I264 PolarHBondContact O-N 3.22Å; I264-M266 VanDerWaalsContact C-N 3.35Å; I264-M266 PolarHBondContact O-N 2.92Å; I264-I267 PolarHBondContact O-N 3.38Å; I264-L268 HydrophobicContact CG2-CD1 3.78Å; I264-L268 HydrophobicContact CG2-CG 4.08Å; I264-L268 VanDerWaalsContact O-CB 3.28Å; I264-L268 WeakPolarHBondContact O-CB 3.46Å; I264-L268 VanDerWaalsContact O-CG 3.29Å; I264-L268 WeakPolarHBondContact O-CG 3.34Å; I264-L268 PolarHBondContact O-N 2.98Å
265	S	78.5	Confident	79.7	Confident	46 Å²	46	113.6 Å²	113.6	32%	0.322	56%	0.559	S	S	.	*	H	α-helix	trans	-62.1	-40.7	177.2	-63.7	0	0	0	0	111.9	F261 T262 F263 L268 F269	F261-S265 WeakPolarHBondContact CE1-OG 3.37Å; F261-S265 VanDerWaalsContact O-CB 3.27Å; F261-S265 WeakPolarHBondContact O-CB 3.28Å; F261-S265 PolarHBondContact O-N 3.46Å; F261-S265 PolarHBondContact O-OG 3.48Å; T262-S265 PolarHBondContact O-N 3.42Å; F263-S265 VanDerWaalsContact C-N 3.31Å; F263-S265 PolarHBondContact O-N 3.17Å; S265-L268 PolarHBondContact O-N 3.25Å; S265-F269 WeakPolarHBondContact O-CB 3.45Å; S265-F269 PolarHBondContact O-N 3.3Å
266	M	84.7	Confident	78.4	Confident	117 Å²	117	115.3 Å²	115.3	58%	0.576	57%	0.569	S	S	*	*	H	α-helix	trans	-63.8	-44.2	175.9	-174.9	160	75.7	0	0	112.1	T262 F263 I264 F269 I270	T262-M266 WeakPolarHBondContact O-CB 3.3Å; T262-M266 PolarHBondContact O-N 3.38Å; F263-M266 HydrophobicContact CD1-CE 4.49Å; F263-M266 PolarHBondContact O-N 3.19Å; I264-M266 VanDerWaalsContact C-N 3.35Å; I264-M266 PolarHBondContact O-N 2.92Å; M266-F269 WeakPolarHBondContact O-CB 3.32Å; M266-F269 PolarHBondContact O-N 3.44Å; M266-I270 PolarHBondContact O-N 3.13Å
267	I	82.8	Confident	76.3	Confident	106 Å²	106	125.2 Å²	125.2	54%	0.544	60%	0.599	S	S	.	*	H	α-helix	trans	-69.8	-41.1	177.8	-66.6	176.5	0	0	0	111.3	F263 I264 F269 I270 R271	F263-I267 WeakPolarHBondContact O-CG1 3.4Å; F263-I267 PolarHBondContact O-N 3.17Å; I264-I267 PolarHBondContact O-N 3.38Å; I267-F269 VanDerWaalsContact C-N 3.27Å; I267-F269 PolarHBondContact O-N 3.35Å; I267-I270 PolarHBondContact O-N 3.44Å; I267-R271 PolarHBondContact O-N 3.46Å
268	L	79	Confident	75.7	Confident	92 Å²	92	127.6 Å²	127.6	48%	0.482	61%	0.609	S	S	.	*	H	α-helix	trans	-60.1	-40.1	174.4	-79.7	176.5	0	0	0	110.7	I264 S265 I270 R271 I272	I264-L268 HydrophobicContact CG2-CD1 3.78Å; I264-L268 HydrophobicContact CG2-CG 4.08Å; I264-L268 VanDerWaalsContact O-CB 3.28Å; I264-L268 WeakPolarHBondContact O-CB 3.46Å; I264-L268 VanDerWaalsContact O-CG 3.29Å; I264-L268 WeakPolarHBondContact O-CG 3.34Å; I264-L268 PolarHBondContact O-N 2.98Å; S265-L268 PolarHBondContact O-N 3.25Å; L268-I270 VanDerWaalsContact C-N 3.33Å; L268-I270 PolarHBondContact O-N 3.01Å; L268-R271 CarbonylContact O-C 3.56Å; L268-R271 PolarHBondContact O-N 2.99Å; L268-R271 VanDerWaalsContact O-N 3.16Å; L268-I272 WeakPolarHBondContact O-CB 3.3Å; L268-I272 WeakPolarHBondContact O-CG2 3.44Å; L268-I272 PolarHBondContact O-N 3.4Å
269	F	74.9	Confident	75.1	Confident	137 Å²	137	128.7 Å²	128.7	60%	0.601	61%	0.611	S	S	*	*	H	α-helix	trans	-58.8	-44.6	176.7	-143.1	-93	0	0	0	111.7	S265 M266 I267 R271 F273	S265-F269 WeakPolarHBondContact O-CB 3.45Å; S265-F269 PolarHBondContact O-N 3.3Å; M266-F269 WeakPolarHBondContact O-CB 3.32Å; M266-F269 PolarHBondContact O-N 3.44Å; I267-F269 VanDerWaalsContact C-N 3.27Å; I267-F269 PolarHBondContact O-N 3.35Å; F269-R271 VanDerWaalsContact C-N 3.33Å; F269-R271 PolarHBondContact O-N 3.26Å; F269-F273 AromaticContact CD1-CD2 3.76Å; F269-F273 HydrophobicContact CD1-CD2 3.76Å; F269-F273 AromaticContact CD1-CE2 3.92Å; F269-F273 HydrophobicContact CD1-CE2 3.92Å; F269-F273 HydrophobicContact CD2-CE2 4.15Å; F269-F273 AromaticContact CE1-CD2 3.72Å; F269-F273 HydrophobicContact CE1-CD2 3.72Å; F269-F273 AromaticContact CE1-CE2 3.5Å; F269-F273 HydrophobicContact CE1-CE2 3.5Å; F269-F273 HydrophobicContact CE1-CZ 4.41Å; F269-F273 HydrophobicContact CE2-CD2 4.5Å; F269-F273 AromaticContact CE2-CE2 3.76Å; F269-F273 HydrophobicContact CE2-CE2 3.76Å; F269-F273 HydrophobicContact CG-CD2 4.19Å; F269-F273 HydrophobicContact CG-CE2 4.24Å; F269-F273 HydrophobicContact CZ-CD2 4.11Å; F269-F273 AromaticContact CZ-CE2 3.42Å; F269-F273 HydrophobicContact CZ-CE2 3.42Å; F269-F273 VanDerWaalsContact CZ-CE2 3.42Å; F269-F273 HydrophobicContact CZ-CZ 4.16Å; F269-F273 WeakPolarHBondContact O-CD2 3.48Å; F269-F273 PolarHBondContact O-N 3.44Å
270	I	77.4	Confident	74.3	Confident	133 Å²	133	131.4 Å²	131.4	68%	0.682	62%	0.619	S	S	*	*	H	α-helix	trans	-67.1	-35.9	177.6	-60.7	167.1	0	0	0	111.3	M266 I267 L268	M266-I270 PolarHBondContact O-N 3.13Å; I267-I270 PolarHBondContact O-N 3.44Å; L268-I270 VanDerWaalsContact C-N 3.33Å; L268-I270 PolarHBondContact O-N 3.01Å
271	R	69.9	Low	73.6	Confident	207 Å²	207	135.5 Å²	135.5	78%	0.781	63%	0.629	S	S	*	*	H	α-helix	trans	-88.6	-17.8	-176.3	-135.8	-161.2	-177.2	132.7	3.9	115.1	I267 L268 F269 P274	I267-R271 PolarHBondContact O-N 3.46Å; L268-R271 CarbonylContact O-C 3.56Å; L268-R271 PolarHBondContact O-N 2.99Å; L268-R271 VanDerWaalsContact O-N 3.16Å; F269-R271 VanDerWaalsContact C-N 3.33Å; F269-R271 PolarHBondContact O-N 3.26Å; R271-P274 WeakPolarHBondContact O-CD 3.11Å; R271-P274 VanDerWaalsContact O-CG 3.22Å; R271-P274 WeakPolarHBondContact O-CG 3.36Å
272	I	71.5	Confident	72.5	Confident	115 Å²	115	135.5 Å²	135.5	59%	0.59	63%	0.632	S	S	*	*	H	α-helix	trans	-93.9	-20.9	179.9	-153.5	126	0	0	0	112.4	L268	L268-I272 WeakPolarHBondContact O-CB 3.3Å; L268-I272 WeakPolarHBondContact O-CG2 3.44Å; L268-I272 PolarHBondContact O-N 3.4Å
273	F	62.4	Low	71.6	Confident	127 Å²	127	139.1 Å²	139.1	56%	0.557	64%	0.641	S	S	*	*			trans	-93.6	18	172.5	-79	-76.8	0	0	0	118.2	F269 R275	F269-F273 AromaticContact CD1-CD2 3.76Å; F269-F273 HydrophobicContact CD1-CD2 3.76Å; F269-F273 AromaticContact CD1-CE2 3.92Å; F269-F273 HydrophobicContact CD1-CE2 3.92Å; F269-F273 HydrophobicContact CD2-CE2 4.15Å; F269-F273 AromaticContact CE1-CD2 3.72Å; F269-F273 HydrophobicContact CE1-CD2 3.72Å; F269-F273 AromaticContact CE1-CE2 3.5Å; F269-F273 HydrophobicContact CE1-CE2 3.5Å; F269-F273 HydrophobicContact CE1-CZ 4.41Å; F269-F273 HydrophobicContact CE2-CD2 4.5Å; F269-F273 AromaticContact CE2-CE2 3.76Å; F269-F273 HydrophobicContact CE2-CE2 3.76Å; F269-F273 HydrophobicContact CG-CD2 4.19Å; F269-F273 HydrophobicContact CG-CE2 4.24Å; F269-F273 HydrophobicContact CZ-CD2 4.11Å; F269-F273 AromaticContact CZ-CE2 3.42Å; F269-F273 HydrophobicContact CZ-CE2 3.42Å; F269-F273 VanDerWaalsContact CZ-CE2 3.42Å; F269-F273 HydrophobicContact CZ-CZ 4.16Å; F269-F273 WeakPolarHBondContact O-CD2 3.48Å; F269-F273 PolarHBondContact O-N 3.44Å; F273-R275 VanDerWaalsContact C-N 3.32Å; F273-R275 PolarHBondContact O-N 3.47Å
274	P	63.1	Low	70.3	Confident	94 Å²	94	140.4 Å²	140.4	61%	0.61	65%	0.648	S	S	*	*	S	Bend	trans	-79	-6.2	176.7	28.2	-30.3	0	0	0	114.6	R271	R271-P274 WeakPolarHBondContact O-CD 3.11Å; R271-P274 VanDerWaalsContact O-CG 3.22Å; R271-P274 WeakPolarHBondContact O-CG 3.36Å
275	R	55.6	Low	69.2	Low	227 Å²	227	144.5 Å²	144.5	86%	0.857	66%	0.664	S	S	*	*			trans	-156	85.3	172.5	-71	-163	-176.7	175.5	1.5	113.9	F273	F273-R275 VanDerWaalsContact C-N 3.32Å; F273-R275 PolarHBondContact O-N 3.47Å
276	L	55.3	Low	68.4	Low	155 Å²	155	152.8 Å²	152.8	81%	0.812	69%	0.692	S	S	*	*			trans	-128.1	89.3	143.9	-96.9	105.4	0	0	0	108.2
277	R	44.1	Very low	66.9	Low	323 Å²	323	156 Å²	156	100%	1.219	70%	0.703	S	S	*	*			trans	78.1	0	171.7	-151.5	174	-162.8	153.5	2.6	117.7

Retrieved 277 of 277 residues in 202 ms (Link to these results)

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