A0A0D9S767_CHLSB Loading...

Tetratricopeptide repeat domain 22

AlphaFold DB , UniProt , Accession A0A0D9S767, Species CHLSB (Chlorocebus sabaeus, Green monkey), Gene TTC22, Length 569 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	36.6	Very low	36.4	Very low	250 Å²	250	118.9 Å²	118.9	100%	1.232	68%	0.678	S	S	*	*				0	93.8	0	-70.6	-156.2	-58	0	0	107
2	A	32.2	Very low	36.9	Very low	92 Å²	92	117.8 Å²	117.8	76%	0.76	67%	0.668	S	S	*	*			trans	-170.7	124.8	178.1	0	0	0	0	0	101.5
3	E	33.5	Very low	37.3	Very low	145 Å²	145	112.8 Å²	112.8	68%	0.678	65%	0.651	S	S	*	*			cis	-154.4	152.2	6.8	-80	158.4	164.6	0	0	105.7
4	P	40.4	Very low	37.8	Very low	117 Å²	117	110.1 Å²	110.1	76%	0.76	63%	0.633	S	S	*	*	S	Bend	trans	-101.8	-9.9	158.3	16.9	0.8	0	0	0	113
5	E	36.5	Very low	38.5	Very low	154 Å²	154	106.6 Å²	106.6	72%	0.72	61%	0.61	S	S	*	*	H	α-helix	trans	-79.5	-27.4	-174.6	-77.2	174.9	155.7	0	0	113.5	V7 A8 D9	E5-V7 VanDerWaalsContact C-N 3.3Å; E5-V7 PolarHBondContact O-N 3.49Å; E5-A8 PolarHBondContact O-N 3.45Å; E5-D9 PolarHBondContact O-N 3.29Å
6	A	30.7	Very low	39.1	Very low	48 Å²	48	108.9 Å²	108.9	40%	0.397	62%	0.62	S	S	.	*	H	α-helix	trans	-70.5	-19.5	-176.8	0	0	0	0	0	114.7
7	V	36.3	Very low	40	Very low	110 Å²	110	111.2 Å²	111.2	67%	0.667	63%	0.63	S	S	*	*	H	α-helix	trans	-86.7	-28.4	-179.1	-173.9	0	0	0	0	111.7	E5 L11	E5-V7 VanDerWaalsContact C-N 3.3Å; E5-V7 PolarHBondContact O-N 3.49Å; V7-L11 PolarHBondContact O-N 3.45Å
8	A	35.1	Very low	41.5	Very low	56 Å²	56	107.7 Å²	107.7	46%	0.463	61%	0.609	S	S	.	*	H	α-helix	trans	-74.5	-41.6	177.2	0	0	0	0	0	111.7	E5 D10 L11 D12	E5-A8 PolarHBondContact O-N 3.45Å; A8-D10 PolarHBondContact O-N 3.17Å; A8-L11 PolarHBondContact O-N 3.33Å; A8-D12 PolarHBondContact O-N 3.2Å
9	D	34	Very low	43.4	Very low	120 Å²	120	107.9 Å²	107.9	64%	0.642	61%	0.608	S	S	*	*	H	α-helix	trans	-65.4	-26.6	176.3	-78.9	-18.3	0	0	0	112.8	E5 A13	E5-D9 PolarHBondContact O-N 3.29Å; D9-A13 WeakPolarHBondContact O-CB 3.46Å; D9-A13 PolarHBondContact O-N 3.31Å
10	D	45	Very low	45.5	Very low	108 Å²	108	104.2 Å²	104.2	58%	0.578	58%	0.584	S	S	*	*	H	α-helix	trans	-76.3	-30.8	176.3	-125	-6.2	0	0	0	111.7	A8 L14	A8-D10 PolarHBondContact O-N 3.17Å; D10-L14 WeakPolarHBondContact O-CB 3.24Å; D10-L14 VanDerWaalsContact O-CD1 3.24Å; D10-L14 WeakPolarHBondContact O-CD1 3.32Å; D10-L14 PolarHBondContact O-N 3.44Å
11	L	39.9	Very low	47.7	Very low	108 Å²	108	102.6 Å²	102.6	57%	0.565	57%	0.574	S	S	*	*	H	α-helix	trans	-74.8	-42	-179.6	-147.6	91.8	0	0	0	111.9	V7 A8 L14 I15	V7-L11 PolarHBondContact O-N 3.45Å; A8-L11 PolarHBondContact O-N 3.33Å; L11-L14 PolarHBondContact O-N 3Å; L11-I15 HydrophobicContact CD2-CD1 4.43Å; L11-I15 WeakPolarHBondContact O-CD1 3.49Å; L11-I15 WeakPolarHBondContact O-CG1 3.33Å; L11-I15 PolarHBondContact O-N 3.34Å
12	D	42.8	Very low	50.5	Low	105 Å²	105	91 Å²	91	56%	0.561	52%	0.518	S	S	*	.	H	α-helix	trans	-68.3	-36.6	177.4	-76.7	-25	0	0	0	111.9	A8 I15 D16	A8-D12 PolarHBondContact O-N 3.2Å; D12-I15 PolarHBondContact O-N 3.41Å; D12-D16 PolarHBondContact O-N 3.04Å
13	A	42	Very low	53.6	Low	53 Å²	53	86.9 Å²	86.9	44%	0.438	48%	0.484	S	S	.	.	H	α-helix	trans	-68.9	-34.9	172	0	0	0	0	0	112.7	D9 I15	D9-A13 WeakPolarHBondContact O-CB 3.46Å; D9-A13 PolarHBondContact O-N 3.31Å; A13-I15 VanDerWaalsContact C-N 3.34Å
14	L	44.7	Very low	56.6	Low	76 Å²	76	80 Å²	80	40%	0.398	45%	0.452	S	S	.	.	H	α-helix	trans	-68.4	-31.7	171.9	-106.5	121.7	0	0	0	112.5	D10 L11 D17 L18 L132	D10-L14 WeakPolarHBondContact O-CB 3.24Å; D10-L14 VanDerWaalsContact O-CD1 3.24Å; D10-L14 WeakPolarHBondContact O-CD1 3.32Å; D10-L14 PolarHBondContact O-N 3.44Å; L11-L14 PolarHBondContact O-N 3Å; L14-D17 PolarHBondContact O-N 3.43Å; L14-L18 WeakPolarHBondContact O-CG 3.36Å; L14-L18 PolarHBondContact O-N 3.4Å; L14-L132 HydrophobicContact CD2-CD2 3.76Å
15	I	48.2	Very low	59.2	Low	57 Å²	57	75.7 Å²	75.7	29%	0.292	42%	0.421	S	S	.	.	H	α-helix	trans	-69.4	-35.9	176.8	-72.3	162	0	0	0	111.6	L11 D12 A13 D17 L18 L21	L11-I15 HydrophobicContact CD2-CD1 4.43Å; L11-I15 WeakPolarHBondContact O-CD1 3.49Å; L11-I15 WeakPolarHBondContact O-CG1 3.33Å; L11-I15 PolarHBondContact O-N 3.34Å; D12-I15 PolarHBondContact O-N 3.41Å; A13-I15 VanDerWaalsContact C-N 3.34Å; I15-D17 PolarHBondContact O-N 2.97Å; I15-L18 HydrophobicContact CG1-CD1 4.45Å; I15-L18 PolarHBondContact O-N 2.85Å; I15-L21 HydrophobicContact CG2-CD1 4.19Å
16	D	48.3	Very low	61.9	Low	144 Å²	144	72 Å²	72	77%	0.77	40%	0.404	S	S	*	.	H	α-helix	trans	-65.8	-25.1	175.2	-85.7	-14.5	0	0	0	113.3	D12	D12-D16 PolarHBondContact O-N 3.04Å
17	D	53.9	Low	64.9	Low	148 Å²	148	70.2 Å²	70.2	79%	0.791	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-7.5	176.3	-83.2	-17.3	0	0	0	113.5	L14 I15	L14-D17 PolarHBondContact O-N 3.43Å; I15-D17 PolarHBondContact O-N 2.97Å
18	L	66.4	Low	67.5	Low	48 Å²	48	72 Å²	72	25%	0.251	39%	0.389	S	S	.	.			trans	-79.2	127.8	177.9	-74	171	0	0	0	111.1	L14 I15 Y20 M130 L132	L14-L18 WeakPolarHBondContact O-CG 3.36Å; L14-L18 PolarHBondContact O-N 3.4Å; I15-L18 HydrophobicContact CG1-CD1 4.45Å; I15-L18 PolarHBondContact O-N 2.85Å; L18-Y20 PolarHBondContact O-N 3.27Å; L18-M130 HydrophobicContact CD1-CE 3.54Å; L18-M130 HydrophobicContact CD2-CE 3.94Å; L18-M130 HydrophobicContact CG-CE 4.37Å; L18-L132 HydrophobicContact CD1-CD1 4.34Å
19	D	77.3	Confident	70.2	Confident	112 Å²	112	69.5 Å²	69.5	60%	0.599	37%	0.367	S	S	*	.	S	Bend	trans	-59.5	-19.5	172.9	-75.1	-35.3	0	0	0	112.7	K182 Y186	D19-K182 WeakPolarHBondContact O-CE 3.49Å; D19-K182 PolarHBondContact O-NZ 2.85Å; D19-Y186 WeakPolarHBondContact CB-OH 3.48Å; D19-Y186 VanDerWaalsContact CG-OH 3.3Å; D19-Y186 PolarHBondContact OD2-OH 3.42Å
20	Y	85.7	Confident	72.8	Confident	32 Å²	32	65.2 Å²	65.2	13%	0.125	34%	0.343	C	S	.	.			trans	-154.8	148	178.4	68.3	-77.1	0	0	0	111.8	L18 P22 L100 A146 C149	L18-Y20 PolarHBondContact O-N 3.27Å; Y20-P22 HydrophobicContact CD2-CG 4.34Å; Y20-P22 HydrophobicContact CE2-CG 4.03Å; Y20-L100 HydrophobicContact CE2-CD1 3.72Å; Y20-L100 VanDerWaalsContact OH-CD1 3.29Å; Y20-L100 WeakPolarHBondContact OH-CD1 3.48Å; Y20-A146 HydrophobicContact CD1-CB 4.14Å; Y20-A146 HydrophobicContact CE1-CB 3.37Å; Y20-A146 HydrophobicContact CE2-CB 4.09Å; Y20-A146 WeakPolarHBondContact OH-CB 3.41Å; Y20-C149 HydrophobicContact CD2-CB 4.42Å; Y20-C149 HydrophobicContact CE2-CB 4.17Å
21	L	92.2	Very high	74.9	Confident	71 Å²	71	60.1 Å²	60.1	37%	0.372	32%	0.316	S	S	.	.			trans	-104.5	127.9	173.1	-175.2	62.4	0	0	0	109.2	I15 H26 Q153	I15-L21 HydrophobicContact CG2-CD1 4.19Å; L21-H26 HydrophobicContact CD2-CB 3.88Å; L21-H26 PolarHBondContact O-CE1 3.43Å; L21-H26 VanDerWaalsContact O-CE1 3.25Å; L21-H26 PolarHBondContact O-NE2 3.48Å; L21-Q153 PolarHBondContact O-NE2 3.42Å
22	P	95.6	Very high	77.3	Confident	8 Å²	8	56.4 Å²	56.4	5%	0.052	30%	0.297	C	S	.	.			trans	-75.8	151.4	173.2	-22	35.8	0	0	0	113.9	Y20 H26 L100 A104 L126 M130	Y20-P22 HydrophobicContact CD2-CG 4.34Å; Y20-P22 HydrophobicContact CE2-CG 4.03Å; P22-H26 PolarHBondContact O-CD2 2.95Å; P22-L100 HydrophobicContact CB-CB 3.87Å; P22-L100 HydrophobicContact CG-CB 3.99Å; P22-L100 HydrophobicContact CG-CD1 4.45Å; P22-A104 HydrophobicContact CB-CB 3.95Å; P22-A104 WeakPolarHBondContact O-CB 3.36Å; P22-L126 HydrophobicContact CB-CD1 4.21Å; P22-L126 HydrophobicContact CG-CD1 4.17Å; P22-M130 HydrophobicContact CG-CE 3.98Å; P22-M130 HydrophobicContact CG-SD 3.69Å
23	G	96.6	Very high	79.4	Confident	4 Å²	4	56.2 Å²	56.2	4%	0.041	29%	0.291	C	S	.	.	S	Bend	trans	112.4	175	176.8	0	0	0	0	0	113.1	H26 N101 N105 Q153	G23-H26 PolarHBondContact O-NE2 3.04Å; G23-H26 VanDerWaalsContact O-NE2 3.1Å; G23-N101 PolarHBondContact N-OD1 3.35Å; G23-N105 VanDerWaalsContact CA-OD1 3.28Å; G23-N105 WeakPolarHBondContact CA-OD1 3.44Å; G23-Q153 PolarHBondContact O-NE2 3.42Å
24	H	96.9	Very high	81	Confident	1 Å²	1	62 Å²	62	1%	0.005	31%	0.309	C	S	.	.	S	Bend	trans	-112.9	-21.8	-176.8	-68.5	64.6	0	0	0	113.4	H26 L27 N32 H70 N105	H24-H26 VanDerWaalsContact C-N 3.3Å; H24-H26 PolarHBondContact O-N 2.89Å; H24-L27 HydrophobicContact CB-CD1 4.28Å; H24-L27 WeakPolarHBondContact O-CB 3.18Å; H24-L27 WeakPolarHBondContact O-CG 3.42Å; H24-L27 PolarHBondContact O-N 2.8Å; H24-N32 PolarHBondContact O-ND2 3.21Å; H24-H70 VanDerWaalsContact CE1-CB 3.41Å; H24-H70 WeakPolarHBondContact CE1-CB 3.49Å; H24-H70 AromaticContact CE1-CD2 3.58Å; H24-H70 AromaticContact CE1-CG 3.45Å; H24-H70 VanDerWaalsContact CE1-CG 3.45Å; H24-H70 WeakPolarHBondContact NE2-CB 3.48Å; H24-H70 AromaticContact NE2-CG 3.96Å; H24-N105 PolarHBondContact N-OD1 3.43Å; H24-N105 PolarHBondContact ND1-ND2 3.35Å; H24-N105 VanDerWaalsContact ND1-ND2 3.12Å; H24-N105 PolarHBondContact ND1-OD1 3.11Å
25	F	95.5	Very high	82.1	Confident	27 Å²	27	61.8 Å²	61.8	12%	0.118	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-16.1	-174.2	-58.6	-64.7	0	0	0	113.9	N32 A74 F77 Y78 F89 N105 H108	F25-N32 PolarHBondContact O-ND2 3.21Å; F25-A74 HydrophobicContact CE1-CB 4.45Å; F25-F77 HydrophobicContact CD1-CD1 4.06Å; F25-F77 HydrophobicContact CD1-CE1 4.11Å; F25-F77 HydrophobicContact CE1-CB 3.94Å; F25-F77 AromaticContact CE1-CD1 3.37Å; F25-F77 HydrophobicContact CE1-CD1 3.37Å; F25-F77 HydrophobicContact CE1-CD2 4.23Å; F25-F77 AromaticContact CE1-CE1 3.82Å; F25-F77 HydrophobicContact CE1-CE1 3.82Å; F25-F77 AromaticContact CE1-CG 3.58Å; F25-F77 HydrophobicContact CE1-CG 3.58Å; F25-F77 HydrophobicContact CE1-CZ 4.39Å; F25-F77 HydrophobicContact CZ-CB 3.98Å; F25-F77 AromaticContact CZ-CD1 3.98Å; F25-F77 HydrophobicContact CZ-CD1 3.98Å; F25-F77 AromaticContact CZ-CD2 3.98Å; F25-F77 HydrophobicContact CZ-CD2 3.98Å; F25-F77 HydrophobicContact CZ-CE1 4.43Å; F25-F77 HydrophobicContact CZ-CE2 4.41Å; F25-F77 AromaticContact CZ-CG 3.72Å; F25-F77 HydrophobicContact CZ-CG 3.72Å; F25-Y78 HydrophobicContact CD1-CE2 4.09Å; F25-Y78 HydrophobicContact CE1-CE2 4.18Å; F25-F89 HydrophobicContact CE2-CE2 4.44Å; F25-F89 HydrophobicContact CE2-CZ 4.47Å; F25-F89 HydrophobicContact CZ-CE2 4.23Å; F25-F89 HydrophobicContact CZ-CZ 4.18Å; F25-N105 HydrophobicContact CE2-CB 4.01Å; F25-H108 HydrophobicContact CD2-CB 3.59Å; F25-H108 AromaticContact CD2-CD2 3.18Å; F25-H108 WeakPolarHBondContact CD2-CD2 3.13Å; F25-H108 AromaticContact CD2-CG 3.39Å; F25-H108 AromaticContact CD2-NE2 3.97Å; F25-H108 HydrophobicContact CE2-CB 3.82Å; F25-H108 AromaticContact CE2-CD2 3.49Å; F25-H108 VanDerWaalsContact CE2-CD2 3.49Å; F25-H108 WeakPolarHBondContact CE2-CD2 3.44Å; F25-H108 AromaticContact CE2-CG 3.88Å; F25-H108 AromaticContact CG-CD2 3.48Å; F25-H108 VanDerWaalsContact CG-CD2 3.48Å; F25-H108 WeakPolarHBondContact CG-CD2 3.5Å; F25-H108 AromaticContact CG-CG 3.97Å; F25-H108 AromaticContact CG-NE2 3.79Å
26	H	93.3	Very high	83	Confident	77 Å²	77	65.5 Å²	65.5	36%	0.356	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-6	175.3	73.4	80.6	0	0	0	113.2	L21 P22 G23 H24 Q153	L21-H26 HydrophobicContact CD2-CB 3.88Å; L21-H26 PolarHBondContact O-CE1 3.43Å; L21-H26 VanDerWaalsContact O-CE1 3.25Å; L21-H26 PolarHBondContact O-NE2 3.48Å; P22-H26 PolarHBondContact O-CD2 2.95Å; G23-H26 PolarHBondContact O-NE2 3.04Å; G23-H26 VanDerWaalsContact O-NE2 3.1Å; H24-H26 VanDerWaalsContact C-N 3.3Å; H24-H26 PolarHBondContact O-N 2.89Å; H26-Q153 PolarHBondContact NE2-NE2 3.2Å
27	L	94	Very high	83.9	Confident	10 Å²	10	60 Å²	60	5%	0.052	30%	0.301	C	S	.	.	S	Bend	trans	-67	148.2	-176.3	-62.4	176.9	0	0	0	110.7	H24 M29 N32 Q153 A156	H24-L27 HydrophobicContact CB-CD1 4.28Å; H24-L27 WeakPolarHBondContact O-CB 3.18Å; H24-L27 WeakPolarHBondContact O-CG 3.42Å; H24-L27 PolarHBondContact O-N 2.8Å; L27-M29 HydrophobicContact CB-CG 3.94Å; L27-M29 HydrophobicContact CD1-SD 4.29Å; L27-M29 PolarHBondContact O-N 2.94Å; L27-N32 PolarHBondContact N-ND2 3.32Å; L27-N32 PolarHBondContact O-ND2 2.92Å; L27-Q153 HydrophobicContact CD1-CB 4.02Å; L27-Q153 HydrophobicContact CD1-CG 4.11Å; L27-Q153 HydrophobicContact CD2-CB 3.92Å; L27-Q153 HydrophobicContact CD2-CG 3.9Å; L27-A156 HydrophobicContact CD1-CB 4.17Å
28	E	90.6	Very high	84.9	Confident	148 Å²	148	56.6 Å²	56.6	69%	0.692	29%	0.287	S	S	*	.	S	Bend	trans	-76.3	58.2	173.9	-62.6	-172.9	163.9	0	0	111.5	F33	E28-F33 HydrophobicContact CB-CE2 4.34Å; E28-F33 HydrophobicContact CB-CZ 4.36Å; E28-F33 HydrophobicContact CG-CZ 4.41Å
29	M	91.5	Very high	85.3	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.01	30%	0.304	C	S	.	.			trans	-100.7	143.1	172.5	-62.2	-165.4	-38.9	0	0	109	L27 L31 N32 F33 A156 D160	L27-M29 HydrophobicContact CB-CG 3.94Å; L27-M29 HydrophobicContact CD1-SD 4.29Å; L27-M29 PolarHBondContact O-N 2.94Å; M29-L31 HydrophobicContact CB-CB 4.29Å; M29-L31 HydrophobicContact CE-CB 4.21Å; M29-L31 HydrophobicContact CE-CD2 3.84Å; M29-L31 PolarHBondContact O-N 3.43Å; M29-L31 VanDerWaalsContact O-N 3.16Å; M29-N32 PolarHBondContact O-N 3.32Å; M29-F33 WeakPolarHBondContact O-CD2 3.48Å; M29-F33 WeakPolarHBondContact O-CE2 3.46Å; M29-A156 HydrophobicContact SD-CB 3.84Å; M29-D160 WeakPolarHBondContact CA-OD2 3.44Å; M29-D160 WeakPolarHBondContact CB-OD1 3.27Å
30	Q	89.6	Confident	85.4	Confident	31 Å²	31	57 Å²	57	15%	0.145	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-57.7	-29.4	174.4	-62.9	-53.2	-45.9	0	0	112	N32 F33 D160	Q30-N32 PolarHBondContact O-N 3.31Å; Q30-F33 PolarHBondContact O-N 3.2Å; Q30-D160 VanDerWaalsContact N-CG 3.28Å; Q30-D160 PolarHBondContact N-OD1 3.08Å; Q30-D160 PolarHBondContact N-OD2 3.38Å
31	L	88.4	Confident	85.1	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-55.7	-29.7	169.2	-174.4	72.6	0	0	0	113.6	M29 R42 M46 F75 Y78 D160 V161	M29-L31 HydrophobicContact CB-CB 4.29Å; M29-L31 HydrophobicContact CE-CB 4.21Å; M29-L31 HydrophobicContact CE-CD2 3.84Å; M29-L31 PolarHBondContact O-N 3.43Å; M29-L31 VanDerWaalsContact O-N 3.16Å; L31-R42 PolarHBondContact O-NH2 3.38Å; L31-M46 HydrophobicContact CD1-CG 3.96Å; L31-M46 HydrophobicContact CD1-SD 3.32Å; L31-M46 WeakPolarHBondContact CD1-SD 3.26Å; L31-F75 HydrophobicContact CD1-CD1 4.38Å; L31-F75 HydrophobicContact CD1-CE1 4.39Å; L31-F75 HydrophobicContact CD2-CD1 3.92Å; L31-F75 HydrophobicContact CD2-CE1 3.81Å; L31-Y78 HydrophobicContact CD1-CD2 3.74Å; L31-Y78 HydrophobicContact CD1-CE2 4.31Å; L31-Y78 HydrophobicContact CD1-CG 4.04Å; L31-Y78 HydrophobicContact CD2-CD2 3.59Å; L31-Y78 HydrophobicContact CD2-CE2 3.67Å; L31-Y78 HydrophobicContact CG-CD2 3.49Å; L31-Y78 VanDerWaalsContact CG-CD2 3.49Å; L31-Y78 HydrophobicContact CG-CE2 3.56Å; L31-Y78 HydrophobicContact CG-CG 4.19Å; L31-Y78 WeakPolarHBondContact O-CE1 3.19Å; L31-D160 PolarHBondContact N-OD1 3.49Å; L31-V161 PolarHBondContact N-O 3.03Å
32	N	89.9	Confident	84.6	Confident	30 Å²	30	54 Å²	54	16%	0.16	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-92.4	-11.9	-175.6	-62.7	-11.2	0	0	0	113.3	H24 F25 L27 M29 Q30 Y78	H24-N32 PolarHBondContact O-ND2 3.21Å; F25-N32 PolarHBondContact O-ND2 3.21Å; L27-N32 PolarHBondContact N-ND2 3.32Å; L27-N32 PolarHBondContact O-ND2 2.92Å; M29-N32 PolarHBondContact O-N 3.32Å; Q30-N32 PolarHBondContact O-N 3.31Å; N32-Y78 WeakPolarHBondContact CA-OH 3.45Å; N32-Y78 WeakPolarHBondContact OD1-CE2 3.33Å; N32-Y78 PolarHBondContact OD1-OH 2.92Å
33	F	86.3	Confident	84.2	Confident	102 Å²	102	55 Å²	55	45%	0.447	30%	0.298	S	S	.	.	S	Bend	trans	-96.2	168	-179.4	-62.6	-65.5	0	0	0	112.9	E28 M29 Q30 R42	E28-F33 HydrophobicContact CB-CE2 4.34Å; E28-F33 HydrophobicContact CB-CZ 4.36Å; E28-F33 HydrophobicContact CG-CZ 4.41Å; M29-F33 WeakPolarHBondContact O-CD2 3.48Å; M29-F33 WeakPolarHBondContact O-CE2 3.46Å; Q30-F33 PolarHBondContact O-N 3.2Å; F33-R42 PolarHBondContact O-NH1 3.36Å
34	E	76.6	Confident	83.9	Confident	173 Å²	173	55.4 Å²	55.4	81%	0.808	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-54.9	128.4	170.5	-74.1	-168.2	167.8	0	0	109.9	H36	E34-H36 PolarHBondContact O-N 3.42Å
35	P	67.9	Low	83.6	Confident	72 Å²	72	57.4 Å²	57.4	47%	0.468	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-68	127.6	-172.6	24	-31.6	0	0	0	111.8	S37	P35-S37 VanDerWaalsContact C-N 3.31Å; P35-S37 WeakPolarHBondContact CB-O 3.48Å
36	H	67.4	Low	83.4	Confident	135 Å²	135	56.5 Å²	56.5	63%	0.625	31%	0.305	S	S	*	.	S	Bend	trans	-74.9	-24.9	165	-59.8	92	0	0	0	111.9	E34	E34-H36 PolarHBondContact O-N 3.42Å
37	S	66.5	Low	83.3	Confident	30 Å²	30	53.9 Å²	53.9	21%	0.21	29%	0.293	C	S	.	.	S	Bend	trans	-96.7	150.4	180	58.7	0	0	0	0	112.7	P35 A39	P35-S37 VanDerWaalsContact C-N 3.31Å; P35-S37 WeakPolarHBondContact CB-O 3.48Å; S37-A39 PolarHBondContact O-N 3.4Å
38	P	74.3	Confident	83.2	Confident	76 Å²	76	56 Å²	56	49%	0.494	30%	0.304	S	S	.	.			trans	-52.5	136	172	-25.4	31.5	0	0	0	112.8	P40 Q41 R42	P38-P40 VanDerWaalsContact C-N 3.31Å; P38-P40 VanDerWaalsContact O-N 3.12Å; P38-Q41 VanDerWaalsContact CD-OE1 3.28Å; P38-Q41 PolarHBondContact O-N 3.05Å; P38-R42 PolarHBondContact O-N 3.2Å
39	A	75.4	Confident	83.2	Confident	74 Å²	74	52.7 Å²	52.7	61%	0.612	29%	0.288	S	S	*	.	H	α-helix	trans	-48.9	-40.3	-178.8	0	0	0	0	0	114.9	S37 Q41 R42 A43	S37-A39 PolarHBondContact O-N 3.4Å; A39-Q41 PolarHBondContact O-N 3.34Å; A39-R42 PolarHBondContact O-N 3.01Å; A39-A43 WeakPolarHBondContact O-CB 3.49Å; A39-A43 PolarHBondContact O-N 3.18Å
40	P	79.2	Confident	83.3	Confident	93 Å²	93	53.5 Å²	53.5	60%	0.604	29%	0.291	S	S	*	.	H	α-helix	trans	-64.7	-35.1	177.8	-23.4	35.1	0	0	0	114.5	P38 R44	P38-P40 VanDerWaalsContact C-N 3.31Å; P38-P40 VanDerWaalsContact O-N 3.12Å; P40-R44 PolarHBondContact O-N 2.95Å
41	Q	79.3	Confident	83.2	Confident	19 Å²	19	54.1 Å²	54.1	9%	0.089	29%	0.294	C	S	.	.	H	α-helix	trans	-71.9	-44.6	179.2	-73	175.7	-23.2	0	0	110.4	P38 A39 A43 R44 D45 L461 D462 D463	P38-Q41 VanDerWaalsContact CD-OE1 3.28Å; P38-Q41 PolarHBondContact O-N 3.05Å; A39-Q41 PolarHBondContact O-N 3.34Å; Q41-A43 VanDerWaalsContact C-N 3.33Å; Q41-A43 PolarHBondContact O-N 3.24Å; Q41-R44 WeakPolarHBondContact O-CB 3.04Å; Q41-R44 PolarHBondContact O-N 2.91Å; Q41-D45 VanDerWaalsContact O-CG 3.24Å; Q41-D45 PolarHBondContact O-N 3.15Å; Q41-L461 PolarHBondContact NE2-O 3.01Å; Q41-D462 PolarHBondContact NE2-O 3.39Å; Q41-D463 PolarHBondContact NE2-OD1 3.15Å
42	R	82.8	Confident	83.2	Confident	22 Å²	22	55.7 Å²	55.7	8%	0.083	31%	0.311	C	S	.	.	H	α-helix	trans	-60.1	-43.7	175	-173.6	172.2	159.9	172	-14.4	111.7	L31 F33 P38 A39 D45 M46	L31-R42 PolarHBondContact O-NH2 3.38Å; F33-R42 PolarHBondContact O-NH1 3.36Å; P38-R42 PolarHBondContact O-N 3.2Å; A39-R42 PolarHBondContact O-N 3.01Å; R42-D45 PolarHBondContact O-N 2.99Å; R42-M46 HydrophobicContact CG-CE 3.97Å; R42-M46 WeakPolarHBondContact O-CB 3.45Å; R42-M46 WeakPolarHBondContact O-CG 3.36Å; R42-M46 PolarHBondContact O-N 3.38Å
43	A	87.4	Confident	83.3	Confident	28 Å²	28	54.3 Å²	54.3	23%	0.231	30%	0.303	C	S	.	.	H	α-helix	trans	-60.9	-43.7	175.6	0	0	0	0	0	112.3	A39 Q41 K47 L79	A39-A43 WeakPolarHBondContact O-CB 3.49Å; A39-A43 PolarHBondContact O-N 3.18Å; Q41-A43 VanDerWaalsContact C-N 3.33Å; Q41-A43 PolarHBondContact O-N 3.24Å; A43-K47 WeakPolarHBondContact O-CB 3.41Å; A43-K47 VanDerWaalsContact O-CG 3.27Å; A43-K47 WeakPolarHBondContact O-CG 2.9Å; A43-K47 PolarHBondContact O-N 2.95Å; A43-L79 HydrophobicContact CB-CD2 4.14Å
44	R	90	Very high	83.6	Confident	14 Å²	14	54.3 Å²	54.3	5%	0.053	30%	0.3	C	S	.	.	H	α-helix	trans	-57.6	-50.7	173.4	174.6	-164.6	72.4	-160	-3	111.1	P40 Q41 M46 K47 L48 T430 L461 D463	P40-R44 PolarHBondContact O-N 2.95Å; Q41-R44 WeakPolarHBondContact O-CB 3.04Å; Q41-R44 PolarHBondContact O-N 2.91Å; R44-M46 PolarHBondContact O-N 2.89Å; R44-K47 PolarHBondContact O-N 2.66Å; R44-L48 HydrophobicContact CG-CD1 4.02Å; R44-L48 HydrophobicContact CG-CG 4.45Å; R44-L48 WeakPolarHBondContact O-CG 3.42Å; R44-L48 PolarHBondContact O-N 3.35Å; R44-T430 WeakPolarHBondContact CD-O 3.33Å; R44-T430 VanDerWaalsContact CG-OG1 3.31Å; R44-T430 WeakPolarHBondContact CG-OG1 3.39Å; R44-L461 PolarHBondContact NH1-O 2.82Å; R44-D463 IonicContact CZ-OD1 3.28Å; R44-D463 IonicContact CZ-OD2 3.94Å; R44-D463 IonicContact NH1-OD1 2.68Å; R44-D463 IonicContact NH2-OD1 3.15Å; R44-D463 PolarHBondContact NH2-OD1 3Å; R44-D463 IonicContact NH2-OD2 3.49Å; R44-D463 PolarHBondContact NH2-OD2 3.44Å
45	D	89.5	Confident	84	Confident	43 Å²	43	48.7 Å²	48.7	23%	0.23	27%	0.274	C	S	.	.	H	α-helix	trans	-64.7	-41.3	-175.5	-64.3	-8.8	0	0	0	111.5	Q41 R42 L48 Q49 V161	Q41-D45 VanDerWaalsContact O-CG 3.24Å; Q41-D45 PolarHBondContact O-N 3.15Å; R42-D45 PolarHBondContact O-N 2.99Å; D45-L48 PolarHBondContact O-N 3.09Å; D45-Q49 WeakPolarHBondContact O-CG 3.44Å; D45-Q49 PolarHBondContact O-N 3.26Å; D45-V161 HydrophobicContact CB-CG1 3.52Å
46	M	91.4	Very high	84.8	Confident	8 Å²	8	47.3 Å²	47.3	4%	0.039	26%	0.261	C	S	.	.	H	α-helix	trans	-59.9	-45.5	172.6	-73.1	-173.3	-68	0	0	111.7	L31 R42 R44 L48 Q49 R50 F75 Y78 L79 V161	L31-M46 HydrophobicContact CD1-CG 3.96Å; L31-M46 HydrophobicContact CD1-SD 3.32Å; L31-M46 WeakPolarHBondContact CD1-SD 3.26Å; R42-M46 HydrophobicContact CG-CE 3.97Å; R42-M46 WeakPolarHBondContact O-CB 3.45Å; R42-M46 WeakPolarHBondContact O-CG 3.36Å; R42-M46 PolarHBondContact O-N 3.38Å; R44-M46 PolarHBondContact O-N 2.89Å; M46-L48 VanDerWaalsContact C-N 3.35Å; M46-L48 PolarHBondContact O-N 2.88Å; M46-Q49 PolarHBondContact O-N 3.1Å; M46-R50 VanDerWaalsContact O-CB 3.27Å; M46-R50 WeakPolarHBondContact O-CB 3.2Å; M46-R50 PolarHBondContact O-N 2.99Å; M46-F75 HydrophobicContact CG-CD1 4.25Å; M46-Y78 VanDerWaalsContact SD-CB 3.59Å; M46-Y78 HydrophobicContact SD-CG 4.48Å; M46-L79 HydrophobicContact CB-CD2 4.39Å; M46-L79 HydrophobicContact CE-CD2 3.91Å; M46-L79 HydrophobicContact CE-CG 4.38Å; M46-V161 HydrophobicContact CG-CB 4.31Å; M46-V161 HydrophobicContact CG-CG1 4.06Å; M46-V161 HydrophobicContact CG-CG2 4.37Å
47	K	92.2	Very high	85.9	Confident	22 Å²	22	42.9 Å²	42.9	10%	0.096	24%	0.242	C	C	.	.	H	α-helix	trans	-63.9	-39.4	178	-73.1	178.7	-175.5	-168	0	111.7	A43 R44 R50 E51 L79 E426 L427	A43-K47 WeakPolarHBondContact O-CB 3.41Å; A43-K47 VanDerWaalsContact O-CG 3.27Å; A43-K47 WeakPolarHBondContact O-CG 2.9Å; A43-K47 PolarHBondContact O-N 2.95Å; R44-K47 PolarHBondContact O-N 2.66Å; K47-R50 PolarHBondContact O-N 3Å; K47-E51 WeakPolarHBondContact O-CG 3.39Å; K47-E51 PolarHBondContact O-N 3.13Å; K47-E51 VanDerWaalsContact O-N 3.07Å; K47-L79 HydrophobicContact CD-CD2 4.48Å; K47-L79 HydrophobicContact CG-CD1 3.75Å; K47-L79 HydrophobicContact CG-CD2 4.03Å; K47-E426 IonicContact NZ-OE1 3.19Å; K47-E426 PolarHBondContact NZ-OE1 3.5Å; K47-E426 IonicContact NZ-OE2 3.31Å; K47-E426 PolarHBondContact NZ-OE2 3.05Å; K47-L427 HydrophobicContact CB-CD1 4.03Å; K47-L427 HydrophobicContact CB-CD2 3.31Å; K47-L427 HydrophobicContact CB-CG 3.88Å; K47-L427 HydrophobicContact CD-CD2 4.14Å; K47-L427 HydrophobicContact CD-CG 4.28Å; K47-L427 HydrophobicContact CG-CD2 4.33Å
48	L	90.3	Very high	86.8	Confident	54 Å²	54	48.4 Å²	48.4	28%	0.283	27%	0.265	S	S	.	.	H	α-helix	trans	-64.7	-43.3	175	-72.6	173.1	0	0	0	112.3	R44 D45 M46 E51 G52 F383 L427	R44-L48 HydrophobicContact CG-CD1 4.02Å; R44-L48 HydrophobicContact CG-CG 4.45Å; R44-L48 WeakPolarHBondContact O-CG 3.42Å; R44-L48 PolarHBondContact O-N 3.35Å; D45-L48 PolarHBondContact O-N 3.09Å; M46-L48 VanDerWaalsContact C-N 3.35Å; M46-L48 PolarHBondContact O-N 2.88Å; L48-E51 PolarHBondContact O-N 2.97Å; L48-G52 PolarHBondContact O-N 3.02Å; L48-F383 HydrophobicContact CD2-CZ 4.38Å; L48-L427 HydrophobicContact CD2-CD2 4.36Å; L48-L427 HydrophobicContact CG-CD2 4.28Å
49	Q	91.8	Very high	87.1	Confident	79 Å²	79	47.9 Å²	47.9	37%	0.369	26%	0.257	S	S	.	.	H	α-helix	trans	-64.2	-42.9	174.9	-69.9	-61.1	-20.8	0	0	111.5	D45 M46 E51 G52 L53 F75 V161	D45-Q49 WeakPolarHBondContact O-CG 3.44Å; D45-Q49 PolarHBondContact O-N 3.26Å; M46-Q49 PolarHBondContact O-N 3.1Å; Q49-E51 VanDerWaalsContact C-N 3.33Å; Q49-E51 PolarHBondContact O-N 3.47Å; Q49-G52 WeakPolarHBondContact O-CA 3.46Å; Q49-G52 PolarHBondContact O-N 2.92Å; Q49-L53 PolarHBondContact O-N 2.9Å; Q49-F75 HydrophobicContact CB-CD2 4.42Å; Q49-F75 HydrophobicContact CB-CE2 3.52Å; Q49-F75 HydrophobicContact CB-CZ 3.83Å; Q49-F75 HydrophobicContact CG-CZ 4.49Å; Q49-V161 HydrophobicContact CB-CG2 4.45Å; Q49-V161 HydrophobicContact CG-CG2 3.75Å
50	R	92.8	Very high	87.4	Confident	18 Å²	18	44.5 Å²	44.5	7%	0.068	23%	0.229	C	C	.	.	H	α-helix	trans	-56.8	-43.2	176.7	-177.3	168.2	69.7	165.3	-9	112.5	M46 K47 G52 L53 R54 L72 F75 E81 E84	M46-R50 VanDerWaalsContact O-CB 3.27Å; M46-R50 WeakPolarHBondContact O-CB 3.2Å; M46-R50 PolarHBondContact O-N 2.99Å; K47-R50 PolarHBondContact O-N 3Å; R50-G52 VanDerWaalsContact C-N 3.33Å; R50-G52 PolarHBondContact O-N 3.49Å; R50-L53 PolarHBondContact O-N 2.84Å; R50-R54 WeakPolarHBondContact O-CG 3.32Å; R50-R54 PolarHBondContact O-N 3.36Å; R50-L72 HydrophobicContact CG-CD2 3.79Å; R50-F75 HydrophobicContact CB-CD2 4.06Å; R50-E81 IonicContact CZ-OE1 3.24Å; R50-E81 IonicContact CZ-OE2 3.35Å; R50-E81 IonicContact NH1-OE1 3.75Å; R50-E81 IonicContact NH1-OE2 3.49Å; R50-E81 PolarHBondContact NH1-OE2 3.35Å; R50-E81 IonicContact NH2-OE1 3.03Å; R50-E81 PolarHBondContact NH2-OE1 3.12Å; R50-E81 IonicContact NH2-OE2 2.92Å; R50-E81 PolarHBondContact NH2-OE2 3.04Å; R50-E84 IonicContact NH1-OE1 2.94Å; R50-E84 PolarHBondContact NH1-OE1 2.95Å; R50-E84 IonicContact NH1-OE2 3.78Å
51	E	88.8	Confident	87.4	Confident	44 Å²	44	41.6 Å²	41.6	21%	0.206	21%	0.213	C	C	.	.	H	α-helix	trans	-62.2	-39.8	174.8	-72.4	-170	158.7	0	0	113.1	K47 L48 Q49 Q55 F383 K384 L427	K47-E51 WeakPolarHBondContact O-CG 3.39Å; K47-E51 PolarHBondContact O-N 3.13Å; K47-E51 VanDerWaalsContact O-N 3.07Å; L48-E51 PolarHBondContact O-N 2.97Å; Q49-E51 VanDerWaalsContact C-N 3.33Å; Q49-E51 PolarHBondContact O-N 3.47Å; E51-Q55 PolarHBondContact O-N 3.35Å; E51-F383 VanDerWaalsContact OE1-CE1 3.25Å; E51-F383 WeakPolarHBondContact OE1-CE1 3.32Å; E51-F383 WeakPolarHBondContact OE2-CE1 3.41Å; E51-F383 WeakPolarHBondContact OE2-CZ 2.85Å; E51-K384 WeakPolarHBondContact OE2-CE 3.34Å; E51-K384 IonicContact OE2-NZ 2.88Å; E51-K384 PolarHBondContact OE2-NZ 2.96Å; E51-L427 VanDerWaalsContact CD-CD1 3.46Å; E51-L427 HydrophobicContact CG-CD1 4.1Å; E51-L427 WeakPolarHBondContact OE1-CD1 3.45Å
52	G	88.1	Confident	87.6	Confident	34 Å²	34	43.6 Å²	43.6	35%	0.351	23%	0.233	S	C	.	.	H	α-helix	trans	-62.6	-44.2	175	0	0	0	0	0	112.1	L48 Q49 R50 Q55 E56	L48-G52 PolarHBondContact O-N 3.02Å; Q49-G52 WeakPolarHBondContact O-CA 3.46Å; Q49-G52 PolarHBondContact O-N 2.92Å; R50-G52 VanDerWaalsContact C-N 3.33Å; R50-G52 PolarHBondContact O-N 3.49Å; G52-Q55 PolarHBondContact O-N 2.87Å; G52-E56 PolarHBondContact O-N 3.37Å
53	L	92.2	Very high	87.6	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-66.9	-36.1	178.6	-74.5	173.8	0	0	0	113.1	Q49 R50 Q55 E56 L57 V68 L71 L72 F75 F159	Q49-L53 PolarHBondContact O-N 2.9Å; R50-L53 PolarHBondContact O-N 2.84Å; L53-Q55 VanDerWaalsContact C-N 3.3Å; L53-Q55 PolarHBondContact O-N 2.96Å; L53-E56 CarbonylContact O-C 3.54Å; L53-E56 PolarHBondContact O-N 3.15Å; L53-E56 VanDerWaalsContact O-N 3.11Å; L53-L57 PolarHBondContact O-N 3.41Å; L53-V68 HydrophobicContact CB-CG1 4.31Å; L53-V68 HydrophobicContact CD2-CG1 4.24Å; L53-V68 WeakPolarHBondContact O-CG1 3.41Å; L53-L71 HydrophobicContact CD1-CB 3.56Å; L53-L71 HydrophobicContact CD1-CD1 4.02Å; L53-L71 HydrophobicContact CD1-CG 4.45Å; L53-L71 HydrophobicContact CD2-CD1 4.07Å; L53-L72 HydrophobicContact CB-CD2 3.65Å; L53-L72 HydrophobicContact CB-CG 4.2Å; L53-L72 HydrophobicContact CD1-CD2 4.38Å; L53-F75 HydrophobicContact CD1-CD2 3.87Å; L53-F75 HydrophobicContact CD1-CE2 3.43Å; L53-F75 VanDerWaalsContact CD1-CE2 3.43Å; L53-F75 HydrophobicContact CD1-CZ 4.44Å; L53-F159 HydrophobicContact CD2-CD1 3.73Å; L53-F159 HydrophobicContact CD2-CD2 4.5Å; L53-F159 HydrophobicContact CD2-CE1 3.44Å; L53-F159 VanDerWaalsContact CD2-CE1 3.44Å; L53-F159 HydrophobicContact CD2-CE2 4.27Å; L53-F159 HydrophobicContact CD2-CG 4.24Å; L53-F159 HydrophobicContact CD2-CZ 3.73Å; L53-F159 HydrophobicContact CG-CD1 4.15Å; L53-F159 HydrophobicContact CG-CE1 4.19Å
54	R	91.3	Very high	87.6	Confident	102 Å²	102	46 Å²	46	39%	0.385	25%	0.247	S	C	.	.	H	α-helix	trans	-59.9	-42.5	174.3	-75	178.5	179.8	154.1	-3.2	111.3	R50 E56 L57 E58 L72 E84	R50-R54 WeakPolarHBondContact O-CG 3.32Å; R50-R54 PolarHBondContact O-N 3.36Å; R54-E56 VanDerWaalsContact C-N 3.34Å; R54-L57 PolarHBondContact O-N 2.91Å; R54-E58 PolarHBondContact O-N 3.18Å; R54-L72 HydrophobicContact CG-CD1 4.44Å; R54-L72 HydrophobicContact CG-CD2 3.85Å; R54-E84 IonicContact CZ-OE1 2.73Å; R54-E84 IonicContact NH2-OE1 2.76Å; R54-E84 PolarHBondContact NH2-OE1 2.75Å; R54-E84 IonicContact NH2-OE2 2.88Å
55	Q	84.6	Confident	87.7	Confident	56 Å²	56	49.9 Å²	49.9	26%	0.262	26%	0.261	S	S	.	.	H	α-helix	trans	-66.8	-36.2	173.6	-64.8	174.5	10.2	0	0	112.1	E51 G52 L53	E51-Q55 PolarHBondContact O-N 3.35Å; G52-Q55 PolarHBondContact O-N 2.87Å; L53-Q55 VanDerWaalsContact C-N 3.3Å; L53-Q55 PolarHBondContact O-N 2.96Å
56	E	86.4	Confident	88	Confident	43 Å²	43	48 Å²	48	20%	0.201	25%	0.252	C	S	.	.	H	α-helix	trans	-66.9	-37.3	176.2	-171.9	166.2	166.5	0	0	112.1	G52 L53 R54 E58 L59 A60 Y155	G52-E56 PolarHBondContact O-N 3.37Å; L53-E56 CarbonylContact O-C 3.54Å; L53-E56 PolarHBondContact O-N 3.15Å; L53-E56 VanDerWaalsContact O-N 3.11Å; R54-E56 VanDerWaalsContact C-N 3.34Å; E56-E58 VanDerWaalsContact C-N 3.33Å; E56-E58 PolarHBondContact O-N 3.2Å; E56-L59 CarbonylContact O-C 3.48Å; E56-L59 PolarHBondContact O-N 3.36Å; E56-L59 VanDerWaalsContact O-N 3.07Å; E56-A60 WeakPolarHBondContact O-CB 3.38Å; E56-A60 PolarHBondContact O-N 2.85Å; E56-Y155 PolarHBondContact OE1-OH 3.47Å; E56-Y155 PolarHBondContact OE2-OH 2.94Å
57	L	90.6	Very high	88.2	Confident	41 Å²	41	47.9 Å²	47.9	22%	0.215	25%	0.252	C	S	.	.	H	α-helix	trans	-59.7	-41.9	178.9	-175.8	62.2	0	0	0	112.2	L53 R54 L59 A60 R65 V68 R69 L72	L53-L57 PolarHBondContact O-N 3.41Å; R54-L57 PolarHBondContact O-N 2.91Å; L57-L59 PolarHBondContact O-N 3.11Å; L57-A60 PolarHBondContact O-N 3.41Å; L57-R65 HydrophobicContact CD1-CB 4.13Å; L57-R65 HydrophobicContact CD1-CG 4.12Å; L57-V68 HydrophobicContact CB-CG1 3.79Å; L57-V68 HydrophobicContact CD1-CB 4.09Å; L57-V68 HydrophobicContact CD1-CG1 4.03Å; L57-V68 HydrophobicContact CG-CG1 4.45Å; L57-R69 HydrophobicContact CD1-CG 4.07Å; L57-R69 HydrophobicContact CD2-CG 4.32Å; L57-L72 HydrophobicContact CD2-CD1 3.9Å
58	E	84.5	Confident	88.4	Confident	147 Å²	147	46.9 Å²	46.9	69%	0.687	25%	0.248	S	C	*	.	H	α-helix	trans	-59.5	-33.8	176.3	-67.8	176.3	179.6	0	0	112.1	R54 E56	R54-E58 PolarHBondContact O-N 3.18Å; E56-E58 VanDerWaalsContact C-N 3.33Å; E56-E58 PolarHBondContact O-N 3.2Å
59	L	79.8	Confident	88.7	Confident	64 Å²	64	45.5 Å²	45.5	34%	0.335	24%	0.239	S	C	.	.	H	α-helix	trans	-95.5	-12.7	-177.4	-59.6	177.5	0	0	0	113.2	E56 L57 R244 P296	E56-L59 CarbonylContact O-C 3.48Å; E56-L59 PolarHBondContact O-N 3.36Å; E56-L59 VanDerWaalsContact O-N 3.07Å; L57-L59 PolarHBondContact O-N 3.11Å; L59-R244 PolarHBondContact O-NH1 3.2Å; L59-P296 HydrophobicContact CD2-CB 3.79Å
60	A	82.4	Confident	89	Confident	3 Å²	3	41.7 Å²	41.7	3%	0.025	22%	0.221	C	C	.	.			trans	-70.9	132.2	-171.6	0	0	0	0	0	112	E56 L57 R65 V68	E56-A60 WeakPolarHBondContact O-CB 3.38Å; E56-A60 PolarHBondContact O-N 2.85Å; L57-A60 PolarHBondContact O-N 3.41Å; A60-R65 HydrophobicContact CB-CG 3.97Å; A60-R65 PolarHBondContact O-NE 3.49Å; A60-R65 VanDerWaalsContact O-NE 3.09Å; A60-V68 HydrophobicContact CB-CG2 4.34Å
61	A	80.2	Confident	89.2	Confident	33 Å²	33	40.9 Å²	40.9	27%	0.273	22%	0.218	S	C	.	.			trans	-60.9	148.1	169.2	0	0	0	0	0	110.2	P63 Q64 R65	A61-P63 VanDerWaalsContact C-CD 3.42Å; A61-P63 VanDerWaalsContact C-N 3.32Å; A61-P63 VanDerWaalsContact O-N 3.13Å; A61-Q64 PolarHBondContact O-N 3.31Å; A61-R65 PolarHBondContact O-N 3.4Å
62	A	81.9	Confident	89.6	Confident	61 Å²	61	39.3 Å²	39.3	50%	0.504	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-49	-43.2	-174	0	0	0	0	0	114.4	Q64 R65	A62-Q64 PolarHBondContact O-N 3.41Å; A62-R65 PolarHBondContact O-N 3.39Å
63	P	84.6	Confident	90.1	Very high	75 Å²	75	37.7 Å²	37.7	49%	0.487	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-66.3	-19.7	178.9	-21.1	34.3	0	0	0	115	A61 E194	A61-P63 VanDerWaalsContact C-CD 3.42Å; A61-P63 VanDerWaalsContact C-N 3.32Å; A61-P63 VanDerWaalsContact O-N 3.13Å; P63-E194 HydrophobicContact CB-CG 4.19Å
64	Q	86.6	Confident	90.3	Very high	24 Å²	24	37.8 Å²	37.8	11%	0.112	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-94.8	-19.4	-178.1	-168.6	175	22	0	0	112.6	A61 A62 P66 A67 V68	A61-Q64 PolarHBondContact O-N 3.31Å; A62-Q64 PolarHBondContact O-N 3.41Å; Q64-P66 VanDerWaalsContact C-CD 3.48Å; Q64-A67 WeakPolarHBondContact O-CB 3.45Å; Q64-A67 PolarHBondContact O-N 2.89Å; Q64-V68 PolarHBondContact O-N 3.49Å
65	R	92.1	Very high	90.5	Very high	96 Å²	96	33 Å²	33	36%	0.362	18%	0.177	S	C	.	.	H	α-helix	trans	-56.2	-39.9	-177.9	-68.4	-178.2	-179.7	-177.1	-6.4	114.3	L57 A60 A61 A62 A67 V68 R69	L57-R65 HydrophobicContact CD1-CB 4.13Å; L57-R65 HydrophobicContact CD1-CG 4.12Å; A60-R65 HydrophobicContact CB-CG 3.97Å; A60-R65 PolarHBondContact O-NE 3.49Å; A60-R65 VanDerWaalsContact O-NE 3.09Å; A61-R65 PolarHBondContact O-N 3.4Å; A62-R65 PolarHBondContact O-N 3.39Å; R65-A67 VanDerWaalsContact C-N 3.35Å; R65-A67 PolarHBondContact O-N 3.38Å; R65-V68 PolarHBondContact O-N 3.43Å; R65-R69 PolarHBondContact O-N 3.43Å
66	P	95.9	Very high	91.1	Very high	4 Å²	4	30.3 Å²	30.3	3%	0.026	16%	0.164	C	C	.	.	H	α-helix	trans	-57.7	-45.5	176	-28	37.9	0	0	0	112.8	Q64 V68 R69 H70 V92 E152	Q64-P66 VanDerWaalsContact C-CD 3.48Å; P66-V68 VanDerWaalsContact C-N 3.31Å; P66-V68 PolarHBondContact O-N 2.85Å; P66-R69 PolarHBondContact O-N 3.16Å; P66-H70 PolarHBondContact O-CD2 2.95Å; P66-H70 VanDerWaalsContact O-CG 3.3Å; P66-H70 PolarHBondContact O-N 3.46Å; P66-V92 HydrophobicContact CB-CG1 3.99Å; P66-E152 WeakPolarHBondContact CB-OE1 3.18Å
67	A	96.1	Very high	91.6	Very high	6 Å²	6	28.9 Å²	28.9	5%	0.05	16%	0.157	C	C	.	.	H	α-helix	trans	-59.4	-42	179	0	0	0	0	0	112.2	Q64 R65 H70 L71 E152 Y155	Q64-A67 WeakPolarHBondContact O-CB 3.45Å; Q64-A67 PolarHBondContact O-N 2.89Å; R65-A67 VanDerWaalsContact C-N 3.35Å; R65-A67 PolarHBondContact O-N 3.38Å; A67-H70 PolarHBondContact O-N 3.44Å; A67-L71 PolarHBondContact O-N 2.9Å; A67-E152 HydrophobicContact CB-CB 4.28Å; A67-E152 HydrophobicContact CB-CG 3.99Å; A67-Y155 HydrophobicContact CB-CD1 3.54Å; A67-Y155 HydrophobicContact CB-CE1 4.12Å; A67-Y155 HydrophobicContact CB-CG 3.77Å
68	V	96.3	Very high	91.7	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-65.8	-46.5	176.8	-177.4	0	0	0	0	111.1	L53 L57 A60 Q64 R65 P66 H70 L71 L72 Y155	L53-V68 HydrophobicContact CB-CG1 4.31Å; L53-V68 HydrophobicContact CD2-CG1 4.24Å; L53-V68 WeakPolarHBondContact O-CG1 3.41Å; L57-V68 HydrophobicContact CB-CG1 3.79Å; L57-V68 HydrophobicContact CD1-CB 4.09Å; L57-V68 HydrophobicContact CD1-CG1 4.03Å; L57-V68 HydrophobicContact CG-CG1 4.45Å; A60-V68 HydrophobicContact CB-CG2 4.34Å; Q64-V68 PolarHBondContact O-N 3.49Å; R65-V68 PolarHBondContact O-N 3.43Å; P66-V68 VanDerWaalsContact C-N 3.31Å; P66-V68 PolarHBondContact O-N 2.85Å; V68-H70 VanDerWaalsContact C-N 3.31Å; V68-H70 PolarHBondContact O-N 3.28Å; V68-L71 PolarHBondContact O-N 2.94Å; V68-L72 HydrophobicContact CG1-CD1 4.33Å; V68-L72 WeakPolarHBondContact O-CG 3.28Å; V68-L72 PolarHBondContact O-N 3.13Å; V68-Y155 HydrophobicContact CG2-CE1 4.09Å; V68-Y155 WeakPolarHBondContact CG2-OH 3.18Å
69	R	97	Very high	92.1	Very high	25 Å²	25	23.8 Å²	23.8	9%	0.094	13%	0.132	C	C	.	.	H	α-helix	trans	-63.3	-36	178.3	-77.1	-169.1	175.5	117.6	-14.4	112.6	L57 R65 P66 L71 L72 G73 E91 V92 E95	L57-R69 HydrophobicContact CD1-CG 4.07Å; L57-R69 HydrophobicContact CD2-CG 4.32Å; R65-R69 PolarHBondContact O-N 3.43Å; P66-R69 PolarHBondContact O-N 3.16Å; R69-L71 VanDerWaalsContact C-N 3.34Å; R69-L71 PolarHBondContact O-N 3.3Å; R69-L72 PolarHBondContact O-N 3.28Å; R69-G73 PolarHBondContact O-N 3.31Å; R69-E91 IonicContact CZ-OE2 3.99Å; R69-E91 IonicContact NE-OE2 2.72Å; R69-E91 PolarHBondContact NE-OE2 3.1Å; R69-E91 IonicContact NH2-OE2 3.58Å; R69-E91 PolarHBondContact NH2-OE2 2.86Å; R69-E91 VanDerWaalsContact NH2-OE2 3.13Å; R69-V92 HydrophobicContact CB-CG2 3.58Å; R69-V92 HydrophobicContact CG-CG2 4.28Å; R69-E95 IonicContact CZ-OE1 3.89Å; R69-E95 VanDerWaalsContact CZ-OE1 3.31Å; R69-E95 IonicContact CZ-OE2 3.99Å; R69-E95 IonicContact NH1-OE1 3.48Å; R69-E95 PolarHBondContact NH1-OE1 2.77Å; R69-E95 VanDerWaalsContact NH1-OE1 3.16Å; R69-E95 IonicContact NH1-OE2 3.33Å; R69-E95 PolarHBondContact NH1-OE2 3.04Å; R69-E95 IonicContact NH2-OE1 3.79Å; R69-E95 PolarHBondContact NH2-OE1 3.5Å; R69-E95 IonicContact NH2-OE2 3.56Å
70	H	97.6	Very high	92.8	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-61.4	-43.8	176.6	-72.4	-47.8	0	0	0	112.2	H24 P66 A67 V68 G73 A74 F89 N99 N101 A102 N105 E152	H24-H70 VanDerWaalsContact CE1-CB 3.41Å; H24-H70 WeakPolarHBondContact CE1-CB 3.49Å; H24-H70 AromaticContact CE1-CD2 3.58Å; H24-H70 AromaticContact CE1-CG 3.45Å; H24-H70 VanDerWaalsContact CE1-CG 3.45Å; H24-H70 WeakPolarHBondContact NE2-CB 3.48Å; H24-H70 AromaticContact NE2-CG 3.96Å; P66-H70 PolarHBondContact O-CD2 2.95Å; P66-H70 VanDerWaalsContact O-CG 3.3Å; P66-H70 PolarHBondContact O-N 3.46Å; A67-H70 PolarHBondContact O-N 3.44Å; V68-H70 VanDerWaalsContact C-N 3.31Å; V68-H70 PolarHBondContact O-N 3.28Å; H70-G73 PolarHBondContact O-N 2.56Å; H70-A74 WeakPolarHBondContact O-CB 3.33Å; H70-A74 PolarHBondContact O-N 3.28Å; H70-F89 HydrophobicContact CB-CE1 4.41Å; H70-F89 AromaticContact ND1-CD1 3.62Å; H70-F89 AromaticContact ND1-CE1 3.82Å; H70-F89 WeakPolarHBondContact O-CE1 3.48Å; H70-N99 PolarHBondContact CE1-OD1 2.79Å; H70-N99 PolarHBondContact NE2-OD1 3.34Å; H70-N101 WeakPolarHBondContact NE2-CB 3.38Å; H70-A102 PolarHBondContact CE1-N 2.83Å; H70-A102 VanDerWaalsContact CE1-N 3.35Å; H70-N105 PolarHBondContact ND1-ND2 3.21Å; H70-E152 IonicContact CD2-OE2 3.6Å; H70-E152 PolarHBondContact CD2-OE2 3.25Å; H70-E152 IonicContact NE2-OE2 2.76Å; H70-E152 PolarHBondContact NE2-OE2 2.95Å
71	L	96.9	Very high	93.5	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-66.1	-40.3	175.1	-78.6	176.2	0	0	0	112.7	L53 A67 V68 R69 G73 A74 F75 Y155 A156 F159	L53-L71 HydrophobicContact CD1-CB 3.56Å; L53-L71 HydrophobicContact CD1-CD1 4.02Å; L53-L71 HydrophobicContact CD1-CG 4.45Å; L53-L71 HydrophobicContact CD2-CD1 4.07Å; A67-L71 PolarHBondContact O-N 2.9Å; V68-L71 PolarHBondContact O-N 2.94Å; R69-L71 VanDerWaalsContact C-N 3.34Å; R69-L71 PolarHBondContact O-N 3.3Å; L71-G73 VanDerWaalsContact C-N 3.31Å; L71-G73 PolarHBondContact O-N 2.76Å; L71-A74 PolarHBondContact O-N 3.33Å; L71-F75 WeakPolarHBondContact O-CB 3.32Å; L71-F75 WeakPolarHBondContact O-CG 3.3Å; L71-F75 PolarHBondContact O-N 3.23Å; L71-Y155 HydrophobicContact CD1-CD1 3.74Å; L71-Y155 HydrophobicContact CD1-CE1 3.58Å; L71-A156 HydrophobicContact CD2-CB 3.69Å; L71-A156 HydrophobicContact CG-CB 4.24Å; L71-F159 HydrophobicContact CD1-CB 3.76Å; L71-F159 HydrophobicContact CD1-CD2 3.33Å; L71-F159 HydrophobicContact CD1-CE2 4.02Å; L71-F159 HydrophobicContact CD1-CG 3.62Å; L71-F159 HydrophobicContact CD2-CB 4.37Å
72	L	97.4	Very high	94.3	Very high	10 Å²	10	29.3 Å²	29.3	5%	0.052	15%	0.15	C	C	.	.	H	α-helix	trans	-59.1	-44.6	174.2	-70.1	173.4	0	0	0	111.1	R50 L53 R54 L57 V68 R69 F75 A76	R50-L72 HydrophobicContact CG-CD2 3.79Å; L53-L72 HydrophobicContact CB-CD2 3.65Å; L53-L72 HydrophobicContact CB-CG 4.2Å; L53-L72 HydrophobicContact CD1-CD2 4.38Å; R54-L72 HydrophobicContact CG-CD1 4.44Å; R54-L72 HydrophobicContact CG-CD2 3.85Å; L57-L72 HydrophobicContact CD2-CD1 3.9Å; V68-L72 HydrophobicContact CG1-CD1 4.33Å; V68-L72 WeakPolarHBondContact O-CG 3.28Å; V68-L72 PolarHBondContact O-N 3.13Å; R69-L72 PolarHBondContact O-N 3.28Å; L72-F75 PolarHBondContact O-N 3.02Å; L72-A76 WeakPolarHBondContact O-CB 3.37Å; L72-A76 PolarHBondContact O-N 2.91Å
73	G	97.5	Very high	95	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-65.1	-42.8	176.1	0	0	0	0	0	113	R69 H70 L71 A76 F77 A85	R69-G73 PolarHBondContact O-N 3.31Å; H70-G73 PolarHBondContact O-N 2.56Å; L71-G73 VanDerWaalsContact C-N 3.31Å; L71-G73 PolarHBondContact O-N 2.76Å; G73-A76 PolarHBondContact O-N 3Å; G73-F77 WeakPolarHBondContact O-CB 3.48Å; G73-F77 PolarHBondContact O-N 3.4Å; G73-A85 VanDerWaalsContact O-CB 3.31Å; G73-A85 WeakPolarHBondContact O-CB 3.31Å
74	A	96.9	Very high	95.6	Very high	2 Å²	2	30.6 Å²	30.6	2%	0.017	14%	0.142	C	C	.	.	H	α-helix	trans	-62.9	-42.8	176	0	0	0	0	0	111.8	F25 H70 L71 F77 Y78	F25-A74 HydrophobicContact CE1-CB 4.45Å; H70-A74 WeakPolarHBondContact O-CB 3.33Å; H70-A74 PolarHBondContact O-N 3.28Å; L71-A74 PolarHBondContact O-N 3.33Å; A74-F77 WeakPolarHBondContact O-CB 3.43Å; A74-F77 PolarHBondContact O-N 3.49Å; A74-Y78 WeakPolarHBondContact O-CD2 3.47Å; A74-Y78 PolarHBondContact O-N 3.4Å
75	F	96.1	Very high	96.2	Very high	1 Å²	1	29.4 Å²	29.4	0%	0.004	14%	0.137	C	C	.	.	H	α-helix	trans	-65.6	-41.6	174.6	-68.7	-24.7	0	0	0	112.5	L31 M46 Q49 R50 L53 L71 L72 F77 Y78 L79 F159 V161	L31-F75 HydrophobicContact CD1-CD1 4.38Å; L31-F75 HydrophobicContact CD1-CE1 4.39Å; L31-F75 HydrophobicContact CD2-CD1 3.92Å; L31-F75 HydrophobicContact CD2-CE1 3.81Å; M46-F75 HydrophobicContact CG-CD1 4.25Å; Q49-F75 HydrophobicContact CB-CD2 4.42Å; Q49-F75 HydrophobicContact CB-CE2 3.52Å; Q49-F75 HydrophobicContact CB-CZ 3.83Å; Q49-F75 HydrophobicContact CG-CZ 4.49Å; R50-F75 HydrophobicContact CB-CD2 4.06Å; L53-F75 HydrophobicContact CD1-CD2 3.87Å; L53-F75 HydrophobicContact CD1-CE2 3.43Å; L53-F75 VanDerWaalsContact CD1-CE2 3.43Å; L53-F75 HydrophobicContact CD1-CZ 4.44Å; L71-F75 WeakPolarHBondContact O-CB 3.32Å; L71-F75 WeakPolarHBondContact O-CG 3.3Å; L71-F75 PolarHBondContact O-N 3.23Å; L72-F75 PolarHBondContact O-N 3.02Å; F75-F77 VanDerWaalsContact C-N 3.27Å; F75-F77 PolarHBondContact O-N 3.42Å; F75-Y78 PolarHBondContact O-N 3.41Å; F75-L79 WeakPolarHBondContact O-CB 3.5Å; F75-L79 WeakPolarHBondContact O-CG 3.29Å; F75-L79 PolarHBondContact O-N 3.45Å; F75-F159 HydrophobicContact CZ-CB 4.37Å; F75-V161 HydrophobicContact CE1-CG2 4.11Å; F75-V161 HydrophobicContact CZ-CG2 4.14Å
76	A	96.6	Very high	96.5	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-59.2	-41.3	174	0	0	0	0	0	111.3	L72 G73 L79 E80 E81 E84 A85	L72-A76 WeakPolarHBondContact O-CB 3.37Å; L72-A76 PolarHBondContact O-N 2.91Å; G73-A76 PolarHBondContact O-N 3Å; A76-L79 CarbonylContact O-C 3.57Å; A76-L79 PolarHBondContact O-N 3.31Å; A76-E80 PolarHBondContact O-N 2.93Å; A76-E81 HydrophobicContact CB-CB 4.31Å; A76-E81 WeakPolarHBondContact O-CA 3.36Å; A76-E81 WeakPolarHBondContact O-CB 3.42Å; A76-E81 PolarHBondContact O-N 3.45Å; A76-E84 HydrophobicContact CB-CB 4.08Å; A76-E84 HydrophobicContact CB-CG 4.09Å; A76-A85 HydrophobicContact CB-CB 3.95Å
77	F	96.2	Very high	96.6	Very high	13 Å²	13	30.3 Å²	30.3	6%	0.057	14%	0.143	C	C	.	.	H	α-helix	trans	-59.2	-51.5	175.9	178.1	-90.5	0	0	0	112.5	F25 G73 A74 F75 L79 E80 L82 A85 H108 V109 R112	F25-F77 HydrophobicContact CD1-CD1 4.06Å; F25-F77 HydrophobicContact CD1-CE1 4.11Å; F25-F77 HydrophobicContact CE1-CB 3.94Å; F25-F77 AromaticContact CE1-CD1 3.37Å; F25-F77 HydrophobicContact CE1-CD1 3.37Å; F25-F77 HydrophobicContact CE1-CD2 4.23Å; F25-F77 AromaticContact CE1-CE1 3.82Å; F25-F77 HydrophobicContact CE1-CE1 3.82Å; F25-F77 AromaticContact CE1-CG 3.58Å; F25-F77 HydrophobicContact CE1-CG 3.58Å; F25-F77 HydrophobicContact CE1-CZ 4.39Å; F25-F77 HydrophobicContact CZ-CB 3.98Å; F25-F77 AromaticContact CZ-CD1 3.98Å; F25-F77 HydrophobicContact CZ-CD1 3.98Å; F25-F77 AromaticContact CZ-CD2 3.98Å; F25-F77 HydrophobicContact CZ-CD2 3.98Å; F25-F77 HydrophobicContact CZ-CE1 4.43Å; F25-F77 HydrophobicContact CZ-CE2 4.41Å; F25-F77 AromaticContact CZ-CG 3.72Å; F25-F77 HydrophobicContact CZ-CG 3.72Å; G73-F77 WeakPolarHBondContact O-CB 3.48Å; G73-F77 PolarHBondContact O-N 3.4Å; A74-F77 WeakPolarHBondContact O-CB 3.43Å; A74-F77 PolarHBondContact O-N 3.49Å; F75-F77 VanDerWaalsContact C-N 3.27Å; F75-F77 PolarHBondContact O-N 3.42Å; F77-L79 PolarHBondContact O-N 3.3Å; F77-E80 WeakPolarHBondContact O-CA 3.45Å; F77-E80 PolarHBondContact O-N 2.89Å; F77-L82 HydrophobicContact CD2-CD2 3.51Å; F77-L82 HydrophobicContact CE2-CD2 3.88Å; F77-L82 HydrophobicContact CG-CD2 4.32Å; F77-A85 HydrophobicContact CB-CB 4.01Å; F77-H108 AromaticContact CE2-CD2 3.74Å; F77-H108 AromaticContact CZ-CD2 3.5Å; F77-H108 AromaticContact CZ-NE2 3.41Å; F77-H108 WeakPolarHBondContact CZ-NE2 3.35Å; F77-V109 HydrophobicContact CD2-CG2 3.97Å; F77-V109 HydrophobicContact CE2-CG2 4.45Å; F77-R112 HydrophobicContact CE2-CB 4.05Å; F77-R112 HydrophobicContact CE2-CG 3.68Å; F77-R112 HydrophobicContact CZ-CG 3.77Å
78	Y	93.4	Very high	96.6	Very high	54 Å²	54	30.9 Å²	30.9	21%	0.212	15%	0.146	C	C	.	.	H	α-helix	trans	-70.7	-13.7	178.7	-75	-67.9	0	0	0	114.2	F25 L31 N32 M46 A74 F75 E80	F25-Y78 HydrophobicContact CD1-CE2 4.09Å; F25-Y78 HydrophobicContact CE1-CE2 4.18Å; L31-Y78 HydrophobicContact CD1-CD2 3.74Å; L31-Y78 HydrophobicContact CD1-CE2 4.31Å; L31-Y78 HydrophobicContact CD1-CG 4.04Å; L31-Y78 HydrophobicContact CD2-CD2 3.59Å; L31-Y78 HydrophobicContact CD2-CE2 3.67Å; L31-Y78 HydrophobicContact CG-CD2 3.49Å; L31-Y78 VanDerWaalsContact CG-CD2 3.49Å; L31-Y78 HydrophobicContact CG-CE2 3.56Å; L31-Y78 HydrophobicContact CG-CG 4.19Å; L31-Y78 WeakPolarHBondContact O-CE1 3.19Å; N32-Y78 WeakPolarHBondContact CA-OH 3.45Å; N32-Y78 WeakPolarHBondContact OD1-CE2 3.33Å; N32-Y78 PolarHBondContact OD1-OH 2.92Å; M46-Y78 VanDerWaalsContact SD-CB 3.59Å; M46-Y78 HydrophobicContact SD-CG 4.48Å; A74-Y78 WeakPolarHBondContact O-CD2 3.47Å; A74-Y78 PolarHBondContact O-N 3.4Å; F75-Y78 PolarHBondContact O-N 3.41Å; Y78-E80 VanDerWaalsContact C-N 3.29Å
79	L	93	Very high	96.7	Very high	28 Å²	28	30.9 Å²	30.9	15%	0.147	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	5.2	169.9	-69.1	171.6	0	0	0	112.6	A43 M46 K47 F75 A76 F77 E81	A43-L79 HydrophobicContact CB-CD2 4.14Å; M46-L79 HydrophobicContact CB-CD2 4.39Å; M46-L79 HydrophobicContact CE-CD2 3.91Å; M46-L79 HydrophobicContact CE-CG 4.38Å; K47-L79 HydrophobicContact CD-CD2 4.48Å; K47-L79 HydrophobicContact CG-CD1 3.75Å; K47-L79 HydrophobicContact CG-CD2 4.03Å; F75-L79 WeakPolarHBondContact O-CB 3.5Å; F75-L79 WeakPolarHBondContact O-CG 3.29Å; F75-L79 PolarHBondContact O-N 3.45Å; A76-L79 CarbonylContact O-C 3.57Å; A76-L79 PolarHBondContact O-N 3.31Å; F77-L79 PolarHBondContact O-N 3.3Å; L79-E81 HydrophobicContact CB-CG 4.13Å; L79-E81 PolarHBondContact O-N 2.74Å
80	E	94.5	Very high	96.8	Very high	129 Å²	129	31.1 Å²	31.1	60%	0.603	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.7	23.6	-176.2	-55.8	-67.8	163.9	0	0	113.3	A76 F77 Y78 L82	A76-E80 PolarHBondContact O-N 2.93Å; F77-E80 WeakPolarHBondContact O-CA 3.45Å; F77-E80 PolarHBondContact O-N 2.89Å; Y78-E80 VanDerWaalsContact C-N 3.29Å; E80-L82 VanDerWaalsContact C-N 3.33Å; E80-L82 PolarHBondContact O-N 3.27Å
81	E	96.3	Very high	96.7	Very high	58 Å²	58	34.9 Å²	34.9	27%	0.271	17%	0.167	S	C	.	.			trans	-95.5	58.4	176.3	-59.3	173	-158.3	0	0	109.3	R50 A76 L79 D83 E84 A85	R50-E81 IonicContact CZ-OE1 3.24Å; R50-E81 IonicContact CZ-OE2 3.35Å; R50-E81 IonicContact NH1-OE1 3.75Å; R50-E81 IonicContact NH1-OE2 3.49Å; R50-E81 PolarHBondContact NH1-OE2 3.35Å; R50-E81 IonicContact NH2-OE1 3.03Å; R50-E81 PolarHBondContact NH2-OE1 3.12Å; R50-E81 IonicContact NH2-OE2 2.92Å; R50-E81 PolarHBondContact NH2-OE2 3.04Å; A76-E81 HydrophobicContact CB-CB 4.31Å; A76-E81 WeakPolarHBondContact O-CA 3.36Å; A76-E81 WeakPolarHBondContact O-CB 3.42Å; A76-E81 PolarHBondContact O-N 3.45Å; L79-E81 HydrophobicContact CB-CG 4.13Å; L79-E81 PolarHBondContact O-N 2.74Å; E81-D83 VanDerWaalsContact C-N 3.3Å; E81-D83 PolarHBondContact O-N 3.26Å; E81-E84 HydrophobicContact CB-CB 4.35Å; E81-E84 PolarHBondContact O-N 3.02Å; E81-A85 PolarHBondContact O-N 3.45Å
82	L	97.6	Very high	96.7	Very high	29 Å²	29	34.8 Å²	34.8	15%	0.152	17%	0.166	C	C	.	.	H	α-helix	trans	-59.5	-33.5	-168.2	-62.3	-179.6	0	0	0	114.2	F77 E80 A85 R86 R112 L113	F77-L82 HydrophobicContact CD2-CD2 3.51Å; F77-L82 HydrophobicContact CE2-CD2 3.88Å; F77-L82 HydrophobicContact CG-CD2 4.32Å; E80-L82 VanDerWaalsContact C-N 3.33Å; E80-L82 PolarHBondContact O-N 3.27Å; L82-A85 WeakPolarHBondContact O-CB 3.31Å; L82-A85 PolarHBondContact O-N 3.44Å; L82-R86 WeakPolarHBondContact O-CB 3.49Å; L82-R86 PolarHBondContact O-N 2.96Å; L82-R112 HydrophobicContact CD1-CB 4.45Å; L82-L113 HydrophobicContact CB-CD2 3.78Å; L82-L113 HydrophobicContact CB-CG 4.28Å; L82-L113 HydrophobicContact CD1-CD2 3.69Å; L82-L113 HydrophobicContact CD1-CG 4.18Å; L82-L113 HydrophobicContact CG-CD2 4.4Å
83	D	97.3	Very high	96.7	Very high	97 Å²	97	34.9 Å²	34.9	52%	0.519	17%	0.167	S	C	.	.	H	α-helix	trans	-67	-39.6	175.5	-73.7	-54.7	0	0	0	112.2	E81 R86 E87	E81-D83 VanDerWaalsContact C-N 3.3Å; E81-D83 PolarHBondContact O-N 3.26Å; D83-R86 PolarHBondContact O-N 2.83Å; D83-R86 IonicContact OD1-CZ 2.96Å; D83-R86 IonicContact OD1-NH1 3.99Å; D83-R86 PolarHBondContact OD1-NH1 2.86Å; D83-R86 IonicContact OD1-NH2 3.55Å; D83-R86 PolarHBondContact OD1-NH2 3.25Å; D83-E87 PolarHBondContact O-N 2.88Å
84	E	96.9	Very high	96.6	Very high	65 Å²	65	42.2 Å²	42.2	30%	0.304	20%	0.195	S	C	.	.	H	α-helix	trans	-67.9	-39.1	175.4	-175.7	175.2	159.1	0	0	110.5	R50 R54 A76 E81 E87 C88	R50-E84 IonicContact NH1-OE1 2.94Å; R50-E84 PolarHBondContact NH1-OE1 2.95Å; R50-E84 IonicContact NH1-OE2 3.78Å; R54-E84 IonicContact CZ-OE1 2.73Å; R54-E84 IonicContact NH2-OE1 2.76Å; R54-E84 PolarHBondContact NH2-OE1 2.75Å; R54-E84 IonicContact NH2-OE2 2.88Å; A76-E84 HydrophobicContact CB-CB 4.08Å; A76-E84 HydrophobicContact CB-CG 4.09Å; E81-E84 HydrophobicContact CB-CB 4.35Å; E81-E84 PolarHBondContact O-N 3.02Å; E84-E87 PolarHBondContact O-N 3.21Å; E84-C88 PolarHBondContact O-N 2.82Å; E84-C88 PolarHBondContact O-SG 3.15Å
85	A	98.1	Very high	96.4	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-58.9	-48.2	173.4	0	0	0	0	0	111.5	G73 A76 F77 E81 L82 E87 C88 F89 V109	G73-A85 VanDerWaalsContact O-CB 3.31Å; G73-A85 WeakPolarHBondContact O-CB 3.31Å; A76-A85 HydrophobicContact CB-CB 3.95Å; F77-A85 HydrophobicContact CB-CB 4.01Å; E81-A85 PolarHBondContact O-N 3.45Å; L82-A85 WeakPolarHBondContact O-CB 3.31Å; L82-A85 PolarHBondContact O-N 3.44Å; A85-E87 PolarHBondContact O-N 3.48Å; A85-C88 PolarHBondContact O-N 3.02Å; A85-F89 HydrophobicContact CB-CE2 4.35Å; A85-F89 WeakPolarHBondContact O-CD2 3.05Å; A85-F89 PolarHBondContact O-N 3.49Å; A85-V109 HydrophobicContact CB-CG2 4.25Å
86	R	98.3	Very high	96.2	Very high	46 Å²	46	49.8 Å²	49.8	17%	0.174	23%	0.23	C	C	.	.	H	α-helix	trans	-57.1	-50.2	176.5	-174.9	-174.9	64.8	-131.5	-11.9	111.4	L82 D83 C88 F89 L90 L106 V109 Y110	L82-R86 WeakPolarHBondContact O-CB 3.49Å; L82-R86 PolarHBondContact O-N 2.96Å; D83-R86 PolarHBondContact O-N 2.83Å; D83-R86 IonicContact OD1-CZ 2.96Å; D83-R86 IonicContact OD1-NH1 3.99Å; D83-R86 PolarHBondContact OD1-NH1 2.86Å; D83-R86 IonicContact OD1-NH2 3.55Å; D83-R86 PolarHBondContact OD1-NH2 3.25Å; R86-C88 VanDerWaalsContact C-N 3.34Å; R86-C88 PolarHBondContact O-N 3.12Å; R86-F89 PolarHBondContact O-N 3.25Å; R86-L90 HydrophobicContact CG-CD1 3.83Å; R86-L90 HydrophobicContact CG-CG 4.2Å; R86-L90 WeakPolarHBondContact O-CB 3.43Å; R86-L90 WeakPolarHBondContact O-CG 3.4Å; R86-L90 PolarHBondContact O-N 3.35Å; R86-L106 HydrophobicContact CG-CD2 4.14Å; R86-V109 HydrophobicContact CB-CG1 4.03Å; R86-Y110 HydrophobicContact CG-CE1 4.15Å
87	E	97.9	Very high	96.1	Very high	73 Å²	73	53.1 Å²	53.1	34%	0.341	25%	0.251	S	S	.	.	H	α-helix	trans	-62.2	-40.2	-179.3	-73.2	-52.2	132.9	0	0	112.4	D83 E84 A85 F89 L90 E91 R94	D83-E87 PolarHBondContact O-N 2.88Å; E84-E87 PolarHBondContact O-N 3.21Å; A85-E87 PolarHBondContact O-N 3.48Å; E87-F89 VanDerWaalsContact C-N 3.33Å; E87-F89 PolarHBondContact O-N 3.47Å; E87-L90 PolarHBondContact O-N 2.81Å; E87-E91 WeakPolarHBondContact O-CG 3.3Å; E87-E91 PolarHBondContact O-N 3.34Å; E87-R94 IonicContact OE2-CZ 2.8Å; E87-R94 IonicContact OE2-NH1 3.17Å; E87-R94 IonicContact OE2-NH2 2.9Å; E87-R94 PolarHBondContact OE2-NH2 2.92Å
88	C	97.4	Very high	95.9	Very high	18 Å²	18	53.9 Å²	53.9	12%	0.122	26%	0.263	C	S	.	.	H	α-helix	trans	-56.5	-47.2	176.8	-71.3	0	0	0	0	111.9	E84 A85 R86 V92	E84-C88 PolarHBondContact O-N 2.82Å; E84-C88 PolarHBondContact O-SG 3.15Å; A85-C88 PolarHBondContact O-N 3.02Å; R86-C88 VanDerWaalsContact C-N 3.34Å; R86-C88 PolarHBondContact O-N 3.12Å; C88-V92 PolarHBondContact O-N 2.97Å
89	F	98.2	Very high	96	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-74.8	-36.2	-179.6	-55.5	-52.3	0	0	0	112.2	F25 H70 A85 R86 E87 E91 V92 T93 N105 L106 V109	F25-F89 HydrophobicContact CE2-CE2 4.44Å; F25-F89 HydrophobicContact CE2-CZ 4.47Å; F25-F89 HydrophobicContact CZ-CE2 4.23Å; F25-F89 HydrophobicContact CZ-CZ 4.18Å; H70-F89 HydrophobicContact CB-CE1 4.41Å; H70-F89 AromaticContact ND1-CD1 3.62Å; H70-F89 AromaticContact ND1-CE1 3.82Å; H70-F89 WeakPolarHBondContact O-CE1 3.48Å; A85-F89 HydrophobicContact CB-CE2 4.35Å; A85-F89 WeakPolarHBondContact O-CD2 3.05Å; A85-F89 PolarHBondContact O-N 3.49Å; R86-F89 PolarHBondContact O-N 3.25Å; E87-F89 VanDerWaalsContact C-N 3.33Å; E87-F89 PolarHBondContact O-N 3.47Å; F89-E91 VanDerWaalsContact C-N 3.35Å; F89-E91 PolarHBondContact O-N 2.79Å; F89-V92 PolarHBondContact O-N 3.02Å; F89-V92 VanDerWaalsContact O-N 3.15Å; F89-T93 PolarHBondContact O-N 3.24Å; F89-N105 HydrophobicContact CD1-CB 3.74Å; F89-N105 HydrophobicContact CD2-CB 3.78Å; F89-N105 HydrophobicContact CE1-CB 3.6Å; F89-N105 WeakPolarHBondContact CE1-ND2 3.3Å; F89-N105 HydrophobicContact CE2-CB 3.67Å; F89-N105 HydrophobicContact CG-CB 3.83Å; F89-N105 HydrophobicContact CZ-CB 3.58Å; F89-L106 HydrophobicContact CB-CD1 4.34Å; F89-L106 HydrophobicContact CB-CD2 3.69Å; F89-L106 HydrophobicContact CB-CG 3.59Å; F89-V109 HydrophobicContact CD2-CG2 3.93Å; F89-V109 HydrophobicContact CE2-CG2 3.68Å
90	L	97.9	Very high	96.1	Very high	30 Å²	30	50.8 Å²	50.8	16%	0.157	25%	0.25	C	S	.	.	H	α-helix	trans	-59.3	-43.7	173.6	-78.6	176.4	0	0	0	111.6	R86 E87 V92 T93 R94 L106	R86-L90 HydrophobicContact CG-CD1 3.83Å; R86-L90 HydrophobicContact CG-CG 4.2Å; R86-L90 WeakPolarHBondContact O-CB 3.43Å; R86-L90 WeakPolarHBondContact O-CG 3.4Å; R86-L90 PolarHBondContact O-N 3.35Å; E87-L90 PolarHBondContact O-N 2.81Å; L90-V92 VanDerWaalsContact C-N 3.28Å; L90-V92 PolarHBondContact O-N 2.84Å; L90-T93 PolarHBondContact O-N 2.78Å; L90-T93 VanDerWaalsContact O-N 3.12Å; L90-T93 PolarHBondContact O-OG1 3.42Å; L90-R94 VanDerWaalsContact O-CG 3.31Å; L90-R94 WeakPolarHBondContact O-CG 3.4Å; L90-R94 PolarHBondContact O-N 3.41Å; L90-L106 HydrophobicContact CD2-CD1 3.94Å; L90-L106 HydrophobicContact CD2-CD2 4.12Å; L90-L106 HydrophobicContact CG-CD1 4.46Å; L90-L106 HydrophobicContact CG-CD2 3.92Å
91	E	96.5	Very high	96.2	Very high	78 Å²	78	44.6 Å²	44.6	36%	0.364	22%	0.221	S	C	.	.	H	α-helix	trans	-55.9	-43.2	174.2	-76.4	-174.3	-174.5	0	0	112.3	R69 E87 F89 T93 R94 E95	R69-E91 IonicContact CZ-OE2 3.99Å; R69-E91 IonicContact NE-OE2 2.72Å; R69-E91 PolarHBondContact NE-OE2 3.1Å; R69-E91 IonicContact NH2-OE2 3.58Å; R69-E91 PolarHBondContact NH2-OE2 2.86Å; R69-E91 VanDerWaalsContact NH2-OE2 3.13Å; E87-E91 WeakPolarHBondContact O-CG 3.3Å; E87-E91 PolarHBondContact O-N 3.34Å; F89-E91 VanDerWaalsContact C-N 3.35Å; F89-E91 PolarHBondContact O-N 2.79Å; E91-T93 PolarHBondContact O-N 3.32Å; E91-R94 PolarHBondContact O-N 2.96Å; E91-E95 PolarHBondContact O-N 3.28Å
92	V	97.3	Very high	96.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63	-42.3	176.4	-178.5	0	0	0	0	110.8	P66 R69 C88 F89 L90 R94 E95 H96 N99 A102	P66-V92 HydrophobicContact CB-CG1 3.99Å; R69-V92 HydrophobicContact CB-CG2 3.58Å; R69-V92 HydrophobicContact CG-CG2 4.28Å; C88-V92 PolarHBondContact O-N 2.97Å; F89-V92 PolarHBondContact O-N 3.02Å; F89-V92 VanDerWaalsContact O-N 3.15Å; L90-V92 VanDerWaalsContact C-N 3.28Å; L90-V92 PolarHBondContact O-N 2.84Å; V92-R94 VanDerWaalsContact C-N 3.33Å; V92-R94 PolarHBondContact O-N 3.28Å; V92-E95 PolarHBondContact O-N 3.47Å; V92-H96 CarbonylContact O-C 3.46Å; V92-H96 WeakPolarHBondContact O-CA 3.43Å; V92-H96 WeakPolarHBondContact O-CB 3.34Å; V92-H96 PolarHBondContact O-N 3.09Å; V92-N99 HydrophobicContact CG1-CB 3.95Å; V92-A102 HydrophobicContact CB-CB 3.97Å; V92-A102 HydrophobicContact CG1-CB 3.75Å
93	T	96.3	Very high	96.3	Very high	11 Å²	11	42.5 Å²	42.5	7%	0.067	21%	0.209	C	C	.	.	H	α-helix	trans	-66.5	-32.6	177	65.5	0	0	0	0	113.4	F89 L90 E91 H96 P97 A102 W103 L106	F89-T93 PolarHBondContact O-N 3.24Å; L90-T93 PolarHBondContact O-N 2.78Å; L90-T93 VanDerWaalsContact O-N 3.12Å; L90-T93 PolarHBondContact O-OG1 3.42Å; E91-T93 PolarHBondContact O-N 3.32Å; T93-H96 CarbonylContact O-C 3.5Å; T93-P97 WeakPolarHBondContact O-CA 3.28Å; T93-P97 WeakPolarHBondContact O-CG 3.13Å; T93-P97 VanDerWaalsContact O-N 3.16Å; T93-A102 HydrophobicContact CG2-CB 3.61Å; T93-W103 HydrophobicContact CG2-CD2 3.83Å; T93-W103 HydrophobicContact CG2-CE3 4.1Å; T93-W103 HydrophobicContact CG2-CG 4.39Å; T93-W103 HydrophobicContact CG2-CH2 4.1Å; T93-W103 HydrophobicContact CG2-CZ2 3.84Å; T93-W103 HydrophobicContact CG2-CZ3 4.23Å; T93-L106 HydrophobicContact CG2-CD1 3.49Å; T93-L106 VanDerWaalsContact CG2-CD1 3.49Å
94	R	95.3	Very high	96.4	Very high	154 Å²	154	38.6 Å²	38.6	58%	0.581	19%	0.19	S	C	*	.	H	α-helix	trans	-68.7	-43.6	176.7	-68.1	170.4	-165.1	144.3	2.8	111.2	E87 L90 E91 V92	E87-R94 IonicContact OE2-CZ 2.8Å; E87-R94 IonicContact OE2-NH1 3.17Å; E87-R94 IonicContact OE2-NH2 2.9Å; E87-R94 PolarHBondContact OE2-NH2 2.92Å; L90-R94 VanDerWaalsContact O-CG 3.31Å; L90-R94 WeakPolarHBondContact O-CG 3.4Å; L90-R94 PolarHBondContact O-N 3.41Å; E91-R94 PolarHBondContact O-N 2.96Å; V92-R94 VanDerWaalsContact C-N 3.33Å; V92-R94 PolarHBondContact O-N 3.28Å
95	E	93.6	Very high	96.4	Very high	93 Å²	93	35.5 Å²	35.5	44%	0.435	18%	0.176	S	C	.	.	H	α-helix	trans	-78.7	-34.7	179.3	-68.7	-180	-164.1	0	0	112.7	R69 E91 V92	R69-E95 IonicContact CZ-OE1 3.89Å; R69-E95 VanDerWaalsContact CZ-OE1 3.31Å; R69-E95 IonicContact CZ-OE2 3.99Å; R69-E95 IonicContact NH1-OE1 3.48Å; R69-E95 PolarHBondContact NH1-OE1 2.77Å; R69-E95 VanDerWaalsContact NH1-OE1 3.16Å; R69-E95 IonicContact NH1-OE2 3.33Å; R69-E95 PolarHBondContact NH1-OE2 3.04Å; R69-E95 IonicContact NH2-OE1 3.79Å; R69-E95 PolarHBondContact NH2-OE1 3.5Å; R69-E95 IonicContact NH2-OE2 3.56Å; E91-E95 PolarHBondContact O-N 3.28Å; V92-E95 PolarHBondContact O-N 3.47Å
96	H	92.6	Very high	96.4	Very high	70 Å²	70	35.5 Å²	35.5	32%	0.324	18%	0.176	S	C	.	.			trans	-135	78.3	-176.3	-58.2	-70	0	0	0	111.1	V92 T93 G98 N99	V92-H96 CarbonylContact O-C 3.46Å; V92-H96 WeakPolarHBondContact O-CA 3.43Å; V92-H96 WeakPolarHBondContact O-CB 3.34Å; V92-H96 PolarHBondContact O-N 3.09Å; T93-H96 CarbonylContact O-C 3.5Å; H96-G98 PolarHBondContact O-N 3.35Å; H96-N99 HydrophobicContact CB-CB 4.08Å; H96-N99 VanDerWaalsContact O-CB 3.3Å; H96-N99 WeakPolarHBondContact O-CB 3.46Å; H96-N99 PolarHBondContact O-N 3.46Å
97	P	93.1	Very high	96.4	Very high	69 Å²	69	34 Å²	34	45%	0.448	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-17.5	-176	-25.5	34.2	0	0	0	115.3	T93 W103	T93-P97 WeakPolarHBondContact O-CA 3.28Å; T93-P97 WeakPolarHBondContact O-CG 3.13Å; T93-P97 VanDerWaalsContact O-N 3.16Å; P97-W103 PolarHBondContact O-NE1 2.98Å
98	G	92.3	Very high	96.4	Very high	29 Å²	29	34.2 Å²	34.2	30%	0.299	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	9.5	176.6	0	0	0	0	0	115.2	H96 L100 R145	H96-G98 PolarHBondContact O-N 3.35Å; G98-L100 PolarHBondContact O-N 3.39Å; G98-R145 VanDerWaalsContact O-CD 3.3Å; G98-R145 WeakPolarHBondContact O-CD 3.48Å
99	N	94.9	Very high	96.4	Very high	14 Å²	14	33.3 Å²	33.3	8%	0.075	17%	0.168	C	C	.	.			trans	-74.3	110.8	-179.6	-172.3	-68.1	0	0	0	110.9	H70 V92 H96 N101 A102 E152	H70-N99 PolarHBondContact CE1-OD1 2.79Å; H70-N99 PolarHBondContact NE2-OD1 3.34Å; V92-N99 HydrophobicContact CG1-CB 3.95Å; H96-N99 HydrophobicContact CB-CB 4.08Å; H96-N99 VanDerWaalsContact O-CB 3.3Å; H96-N99 WeakPolarHBondContact O-CB 3.46Å; H96-N99 PolarHBondContact O-N 3.46Å; N99-N101 WeakPolarHBondContact OD1-CB 3.45Å; N99-N101 PolarHBondContact OD1-N 3.46Å; N99-A102 HydrophobicContact CB-CB 3.99Å; N99-A102 PolarHBondContact O-N 3.31Å; N99-A102 WeakPolarHBondContact OD1-CB 3.33Å; N99-A102 PolarHBondContact OD1-N 3.24Å; N99-E152 VanDerWaalsContact ND2-CD 3.32Å; N99-E152 PolarHBondContact ND2-OE1 3.16Å; N99-E152 PolarHBondContact ND2-OE2 2.81Å; N99-E152 PolarHBondContact OD1-OE2 2.84Å
100	L	95.9	Very high	96.4	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.016	17%	0.173	C	C	.	.	H	α-helix	trans	-64.6	-43.8	-175.7	-57.9	178.5	0	0	0	112.3	Y20 P22 G98 A102 W103 A104 L126 L129 M130 R145 C149	Y20-L100 HydrophobicContact CE2-CD1 3.72Å; Y20-L100 VanDerWaalsContact OH-CD1 3.29Å; Y20-L100 WeakPolarHBondContact OH-CD1 3.48Å; P22-L100 HydrophobicContact CB-CB 3.87Å; P22-L100 HydrophobicContact CG-CB 3.99Å; P22-L100 HydrophobicContact CG-CD1 4.45Å; G98-L100 PolarHBondContact O-N 3.39Å; L100-A102 VanDerWaalsContact C-N 3.3Å; L100-A102 PolarHBondContact O-N 2.97Å; L100-W103 PolarHBondContact O-N 3.35Å; L100-A104 PolarHBondContact O-N 3.35Å; L100-A104 VanDerWaalsContact O-N 3.11Å; L100-L126 HydrophobicContact CB-CD1 4.05Å; L100-L126 HydrophobicContact CD2-CD1 3.99Å; L100-L126 WeakPolarHBondContact O-CD1 3.36Å; L100-L129 HydrophobicContact CD2-CB 3.56Å; L100-L129 HydrophobicContact CD2-CD1 4.27Å; L100-M130 HydrophobicContact CD1-CG 4.5Å; L100-M130 HydrophobicContact CD2-CG 4.02Å; L100-R145 HydrophobicContact CD1-CB 4.03Å; L100-R145 HydrophobicContact CG-CB 4.19Å; L100-C149 HydrophobicContact CB-CB 4.3Å; L100-C149 HydrophobicContact CD1-CB 4.15Å
101	N	97.7	Very high	96.3	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60.4	-39.5	179.1	-74.4	-36.7	0	0	0	112.3	G23 H70 N99 A104 N105 C149 E152 Q153	G23-N101 PolarHBondContact N-OD1 3.35Å; H70-N101 WeakPolarHBondContact NE2-CB 3.38Å; N99-N101 WeakPolarHBondContact OD1-CB 3.45Å; N99-N101 PolarHBondContact OD1-N 3.46Å; N101-A104 PolarHBondContact O-N 3.38Å; N101-N105 VanDerWaalsContact O-CB 3.32Å; N101-N105 WeakPolarHBondContact O-CB 3.46Å; N101-N105 PolarHBondContact O-N 3.42Å; N101-N105 PolarHBondContact O-ND2 3.04Å; N101-C149 WeakPolarHBondContact ND2-CA 3.44Å; N101-C149 PolarHBondContact ND2-O 3.33Å; N101-C149 PolarHBondContact OD1-SG 3.22Å; N101-E152 WeakPolarHBondContact ND2-CB 3.48Å; N101-E152 PolarHBondContact ND2-OE2 3.46Å; N101-Q153 PolarHBondContact OD1-NE2 3.37Å
102	A	98	Very high	96.3	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-62.5	-46.2	-177.9	0	0	0	0	0	111.7	H70 V92 T93 N99 L100 L106	H70-A102 PolarHBondContact CE1-N 2.83Å; H70-A102 VanDerWaalsContact CE1-N 3.35Å; V92-A102 HydrophobicContact CB-CB 3.97Å; V92-A102 HydrophobicContact CG1-CB 3.75Å; T93-A102 HydrophobicContact CG2-CB 3.61Å; N99-A102 HydrophobicContact CB-CB 3.99Å; N99-A102 PolarHBondContact O-N 3.31Å; N99-A102 WeakPolarHBondContact OD1-CB 3.33Å; N99-A102 PolarHBondContact OD1-N 3.24Å; L100-A102 VanDerWaalsContact C-N 3.3Å; L100-A102 PolarHBondContact O-N 2.97Å; A102-L106 WeakPolarHBondContact O-CB 3.46Å; A102-L106 VanDerWaalsContact O-CG 3.32Å; A102-L106 WeakPolarHBondContact O-CG 3.35Å; A102-L106 PolarHBondContact O-N 3.02Å
103	W	97.9	Very high	96.2	Very high	43 Å²	43	40.4 Å²	40.4	16%	0.163	20%	0.203	C	C	.	.	H	α-helix	trans	-67.5	-41.4	178.1	-67.1	112.8	0	0	0	112.2	T93 P97 L100 L106 A107 C122 R125 L126 L129	T93-W103 HydrophobicContact CG2-CD2 3.83Å; T93-W103 HydrophobicContact CG2-CE3 4.1Å; T93-W103 HydrophobicContact CG2-CG 4.39Å; T93-W103 HydrophobicContact CG2-CH2 4.1Å; T93-W103 HydrophobicContact CG2-CZ2 3.84Å; T93-W103 HydrophobicContact CG2-CZ3 4.23Å; P97-W103 PolarHBondContact O-NE1 2.98Å; L100-W103 PolarHBondContact O-N 3.35Å; W103-L106 HydrophobicContact CE3-CD1 4.19Å; W103-L106 HydrophobicContact CZ3-CD1 4.35Å; W103-L106 PolarHBondContact O-N 2.91Å; W103-A107 PolarHBondContact O-N 3.18Å; W103-C122 HydrophobicContact CE3-CB 4.25Å; W103-R125 HydrophobicContact CD2-CB 4.29Å; W103-R125 HydrophobicContact CD2-CG 3.79Å; W103-R125 HydrophobicContact CE3-CB 4.29Å; W103-R125 HydrophobicContact CE3-CG 4.13Å; W103-R125 HydrophobicContact CG-CG 4.28Å; W103-R125 HydrophobicContact CH2-CG 4.2Å; W103-R125 HydrophobicContact CZ2-CG 3.86Å; W103-R125 HydrophobicContact CZ3-CG 4.32Å; W103-L126 HydrophobicContact CB-CB 4.15Å; W103-L126 HydrophobicContact CB-CD1 4.36Å; W103-L129 HydrophobicContact CG-CD1 4.28Å
104	A	97.9	Very high	96.2	Very high	15 Å²	15	42.6 Å²	42.6	12%	0.124	23%	0.227	C	C	.	.	H	α-helix	trans	-62.7	-45.3	175.6	0	0	0	0	0	112.2	P22 L100 N101 A107 H108 L126	P22-A104 HydrophobicContact CB-CB 3.95Å; P22-A104 WeakPolarHBondContact O-CB 3.36Å; L100-A104 PolarHBondContact O-N 3.35Å; L100-A104 VanDerWaalsContact O-N 3.11Å; N101-A104 PolarHBondContact O-N 3.38Å; A104-A107 PolarHBondContact O-N 2.72Å; A104-H108 PolarHBondContact O-N 3.05Å; A104-H108 VanDerWaalsContact O-N 3.15Å; A104-L126 HydrophobicContact CB-CD2 3.79Å
105	N	98.3	Very high	96.2	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-66.1	-38.7	177.3	-63.7	-24.7	0	0	0	111.7	G23 H24 F25 H70 F89 N101 H108 V109	G23-N105 VanDerWaalsContact CA-OD1 3.28Å; G23-N105 WeakPolarHBondContact CA-OD1 3.44Å; H24-N105 PolarHBondContact N-OD1 3.43Å; H24-N105 PolarHBondContact ND1-ND2 3.35Å; H24-N105 VanDerWaalsContact ND1-ND2 3.12Å; H24-N105 PolarHBondContact ND1-OD1 3.11Å; F25-N105 HydrophobicContact CE2-CB 4.01Å; H70-N105 PolarHBondContact ND1-ND2 3.21Å; F89-N105 HydrophobicContact CD1-CB 3.74Å; F89-N105 HydrophobicContact CD2-CB 3.78Å; F89-N105 HydrophobicContact CE1-CB 3.6Å; F89-N105 WeakPolarHBondContact CE1-ND2 3.3Å; F89-N105 HydrophobicContact CE2-CB 3.67Å; F89-N105 HydrophobicContact CG-CB 3.83Å; F89-N105 HydrophobicContact CZ-CB 3.58Å; N101-N105 VanDerWaalsContact O-CB 3.32Å; N101-N105 WeakPolarHBondContact O-CB 3.46Å; N101-N105 PolarHBondContact O-N 3.42Å; N101-N105 PolarHBondContact O-ND2 3.04Å; N105-H108 PolarHBondContact O-N 2.93Å; N105-V109 WeakPolarHBondContact O-CG2 3.47Å; N105-V109 PolarHBondContact O-N 3.05Å
106	L	98.1	Very high	96.3	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.8	-46.1	175.9	-82	170.3	0	0	0	112.3	R86 F89 L90 T93 A102 W103 H108 V109 Y110	R86-L106 HydrophobicContact CG-CD2 4.14Å; F89-L106 HydrophobicContact CB-CD1 4.34Å; F89-L106 HydrophobicContact CB-CD2 3.69Å; F89-L106 HydrophobicContact CB-CG 3.59Å; L90-L106 HydrophobicContact CD2-CD1 3.94Å; L90-L106 HydrophobicContact CD2-CD2 4.12Å; L90-L106 HydrophobicContact CG-CD1 4.46Å; L90-L106 HydrophobicContact CG-CD2 3.92Å; T93-L106 HydrophobicContact CG2-CD1 3.49Å; T93-L106 VanDerWaalsContact CG2-CD1 3.49Å; A102-L106 WeakPolarHBondContact O-CB 3.46Å; A102-L106 VanDerWaalsContact O-CG 3.32Å; A102-L106 WeakPolarHBondContact O-CG 3.35Å; A102-L106 PolarHBondContact O-N 3.02Å; W103-L106 HydrophobicContact CE3-CD1 4.19Å; W103-L106 HydrophobicContact CZ3-CD1 4.35Å; W103-L106 PolarHBondContact O-N 2.91Å; L106-H108 VanDerWaalsContact C-N 3.26Å; L106-H108 PolarHBondContact O-N 3.4Å; L106-V109 PolarHBondContact O-N 3.03Å; L106-V109 VanDerWaalsContact O-N 3.13Å; L106-Y110 HydrophobicContact CB-CD2 4.29Å; L106-Y110 HydrophobicContact CB-CE2 4.19Å; L106-Y110 HydrophobicContact CD2-CE2 4.14Å; L106-Y110 WeakPolarHBondContact O-CB 3.27Å; L106-Y110 WeakPolarHBondContact O-CD2 3.49Å; L106-Y110 PolarHBondContact O-N 3.33Å
107	A	97.7	Very high	96.5	Very high	13 Å²	13	45.5 Å²	45.5	11%	0.107	25%	0.248	C	C	.	.	H	α-helix	trans	-54.7	-47.4	175.3	0	0	0	0	0	110.5	W103 A104 V109 Y110 G111 E119 C122	W103-A107 PolarHBondContact O-N 3.18Å; A104-A107 PolarHBondContact O-N 2.72Å; A107-V109 PolarHBondContact O-N 3.33Å; A107-Y110 PolarHBondContact O-N 2.87Å; A107-G111 PolarHBondContact O-N 3.13Å; A107-E119 HydrophobicContact CB-CG 4.38Å; A107-C122 HydrophobicContact CB-CB 3.82Å
108	H	97.2	Very high	96.7	Very high	78 Å²	78	45.9 Å²	45.9	36%	0.361	24%	0.243	S	C	.	.	H	α-helix	trans	-60.6	-40.8	177	-166.4	80.5	0	0	0	113.4	F25 F77 A104 N105 L106 R112	F25-H108 HydrophobicContact CD2-CB 3.59Å; F25-H108 AromaticContact CD2-CD2 3.18Å; F25-H108 WeakPolarHBondContact CD2-CD2 3.13Å; F25-H108 AromaticContact CD2-CG 3.39Å; F25-H108 AromaticContact CD2-NE2 3.97Å; F25-H108 HydrophobicContact CE2-CB 3.82Å; F25-H108 AromaticContact CE2-CD2 3.49Å; F25-H108 VanDerWaalsContact CE2-CD2 3.49Å; F25-H108 WeakPolarHBondContact CE2-CD2 3.44Å; F25-H108 AromaticContact CE2-CG 3.88Å; F25-H108 AromaticContact CG-CD2 3.48Å; F25-H108 VanDerWaalsContact CG-CD2 3.48Å; F25-H108 WeakPolarHBondContact CG-CD2 3.5Å; F25-H108 AromaticContact CG-CG 3.97Å; F25-H108 AromaticContact CG-NE2 3.79Å; F77-H108 AromaticContact CE2-CD2 3.74Å; F77-H108 AromaticContact CZ-CD2 3.5Å; F77-H108 AromaticContact CZ-NE2 3.41Å; F77-H108 WeakPolarHBondContact CZ-NE2 3.35Å; A104-H108 PolarHBondContact O-N 3.05Å; A104-H108 VanDerWaalsContact O-N 3.15Å; N105-H108 PolarHBondContact O-N 2.93Å; L106-H108 VanDerWaalsContact C-N 3.26Å; L106-H108 PolarHBondContact O-N 3.4Å; H108-R112 WeakPolarHBondContact O-CG 3.37Å; H108-R112 PolarHBondContact O-N 3.38Å
109	V	97.8	Very high	97	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-67.4	-43.3	176.5	172.1	0	0	0	0	111.3	F77 A85 R86 F89 N105 L106 A107 R112 L113	F77-V109 HydrophobicContact CD2-CG2 3.97Å; F77-V109 HydrophobicContact CE2-CG2 4.45Å; A85-V109 HydrophobicContact CB-CG2 4.25Å; R86-V109 HydrophobicContact CB-CG1 4.03Å; F89-V109 HydrophobicContact CD2-CG2 3.93Å; F89-V109 HydrophobicContact CE2-CG2 3.68Å; N105-V109 WeakPolarHBondContact O-CG2 3.47Å; N105-V109 PolarHBondContact O-N 3.05Å; L106-V109 PolarHBondContact O-N 3.03Å; L106-V109 VanDerWaalsContact O-N 3.13Å; A107-V109 PolarHBondContact O-N 3.33Å; V109-R112 PolarHBondContact O-N 2.74Å; V109-L113 HydrophobicContact CG1-CD1 3.98Å; V109-L113 WeakPolarHBondContact O-CG 3.42Å; V109-L113 PolarHBondContact O-N 3.16Å
110	Y	98.1	Very high	96.9	Very high	26 Å²	26	54.3 Å²	54.3	10%	0.102	28%	0.275	C	S	.	.	H	α-helix	trans	-64	-41.2	178.9	-75.5	-50.3	0	0	0	112.4	R86 L106 A107 R112 L113 G114 Q115 E118	R86-Y110 HydrophobicContact CG-CE1 4.15Å; L106-Y110 HydrophobicContact CB-CD2 4.29Å; L106-Y110 HydrophobicContact CB-CE2 4.19Å; L106-Y110 HydrophobicContact CD2-CE2 4.14Å; L106-Y110 WeakPolarHBondContact O-CB 3.27Å; L106-Y110 WeakPolarHBondContact O-CD2 3.49Å; L106-Y110 PolarHBondContact O-N 3.33Å; A107-Y110 PolarHBondContact O-N 2.87Å; Y110-R112 VanDerWaalsContact C-N 3.27Å; Y110-R112 PolarHBondContact O-N 3.2Å; Y110-L113 HydrophobicContact CD1-CD1 4.39Å; Y110-L113 CarbonylContact O-C 3.58Å; Y110-L113 WeakPolarHBondContact O-CA 3.41Å; Y110-L113 PolarHBondContact O-N 2.87Å; Y110-G114 PolarHBondContact O-N 3.31Å; Y110-Q115 HydrophobicContact CD1-CB 3.91Å; Y110-Q115 VanDerWaalsContact CE1-OE1 3.23Å; Y110-Q115 HydrophobicContact CG-CB 4.46Å; Y110-Q115 PolarHBondContact O-N 3.01Å; Y110-E118 HydrophobicContact CD1-CB 3.74Å; Y110-E118 HydrophobicContact CD1-CG 4.47Å; Y110-E118 HydrophobicContact CD2-CB 3.68Å; Y110-E118 HydrophobicContact CE1-CB 3.85Å; Y110-E118 HydrophobicContact CE1-CG 4.21Å; Y110-E118 HydrophobicContact CE2-CB 3.79Å; Y110-E118 HydrophobicContact CG-CB 3.66Å
111	G	96.1	Very high	96.9	Very high	30 Å²	30	57 Å²	57	31%	0.309	30%	0.297	S	S	.	.	H	α-helix	trans	-60.6	-36.8	173.1	0	0	0	0	0	112.7	A107 L113 G114 E119	A107-G111 PolarHBondContact O-N 3.13Å; G111-L113 VanDerWaalsContact C-N 3.34Å; G111-L113 PolarHBondContact O-N 3.49Å; G111-G114 PolarHBondContact O-N 3.22Å; G111-E119 WeakPolarHBondContact CA-OE2 3.46Å
112	R	95.9	Very high	96.8	Very high	144 Å²	144	57.3 Å²	57.3	54%	0.543	30%	0.299	S	S	.	.	H	α-helix	trans	-71.5	-26.4	174.1	-70	-69.1	-66.5	-143	-3.9	114.1	F77 L82 H108 V109 Y110 G114	F77-R112 HydrophobicContact CE2-CB 4.05Å; F77-R112 HydrophobicContact CE2-CG 3.68Å; F77-R112 HydrophobicContact CZ-CG 3.77Å; L82-R112 HydrophobicContact CD1-CB 4.45Å; H108-R112 WeakPolarHBondContact O-CG 3.37Å; H108-R112 PolarHBondContact O-N 3.38Å; V109-R112 PolarHBondContact O-N 2.74Å; Y110-R112 VanDerWaalsContact C-N 3.27Å; Y110-R112 PolarHBondContact O-N 3.2Å; R112-G114 VanDerWaalsContact C-N 3.32Å
113	L	96	Very high	96.5	Very high	57 Å²	57	59.6 Å²	59.6	30%	0.298	32%	0.318	S	S	.	.	H	α-helix	trans	-81.7	-9.8	172.2	-71.1	169.7	0	0	0	113	L82 V109 Y110 G111 Q115	L82-L113 HydrophobicContact CB-CD2 3.78Å; L82-L113 HydrophobicContact CB-CG 4.28Å; L82-L113 HydrophobicContact CD1-CD2 3.69Å; L82-L113 HydrophobicContact CD1-CG 4.18Å; L82-L113 HydrophobicContact CG-CD2 4.4Å; V109-L113 HydrophobicContact CG1-CD1 3.98Å; V109-L113 WeakPolarHBondContact O-CG 3.42Å; V109-L113 PolarHBondContact O-N 3.16Å; Y110-L113 HydrophobicContact CD1-CD1 4.39Å; Y110-L113 CarbonylContact O-C 3.58Å; Y110-L113 WeakPolarHBondContact O-CA 3.41Å; Y110-L113 PolarHBondContact O-N 2.87Å; G111-L113 VanDerWaalsContact C-N 3.34Å; G111-L113 PolarHBondContact O-N 3.49Å; L113-Q115 VanDerWaalsContact C-N 3.31Å; L113-Q115 HydrophobicContact CB-CB 4.45Å; L113-Q115 HydrophobicContact CB-CG 3.99Å
114	G	95.5	Very high	96.2	Very high	57 Å²	57	60.5 Å²	60.5	59%	0.588	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.9	26.2	-173	0	0	0	0	0	113.3	Y110 G111 R112 E116	Y110-G114 PolarHBondContact O-N 3.31Å; G111-G114 PolarHBondContact O-N 3.22Å; R112-G114 VanDerWaalsContact C-N 3.32Å; G114-E116 PolarHBondContact O-N 3.42Å
115	Q	96.8	Very high	96	Very high	63 Å²	63	63.6 Å²	63.6	29%	0.294	34%	0.343	S	S	.	.			trans	-96.6	74.4	-179.9	-71.4	-173	-40.2	0	0	109.6	Y110 L113 E117 E118 E119	Y110-Q115 HydrophobicContact CD1-CB 3.91Å; Y110-Q115 VanDerWaalsContact CE1-OE1 3.23Å; Y110-Q115 HydrophobicContact CG-CB 4.46Å; Y110-Q115 PolarHBondContact O-N 3.01Å; L113-Q115 VanDerWaalsContact C-N 3.31Å; L113-Q115 HydrophobicContact CB-CB 4.45Å; L113-Q115 HydrophobicContact CB-CG 3.99Å; Q115-E117 PolarHBondContact O-N 3.32Å; Q115-E118 HydrophobicContact CB-CB 4.39Å; Q115-E118 WeakPolarHBondContact CB-OE2 3.47Å; Q115-E118 PolarHBondContact O-N 3.37Å; Q115-E119 WeakPolarHBondContact O-CB 3.4Å; Q115-E119 PolarHBondContact O-N 3.36Å
116	E	95.8	Very high	95.7	Very high	155 Å²	155	64.8 Å²	64.8	72%	0.724	35%	0.35	S	S	*	.	H	α-helix	trans	-62.2	-39.6	-170.5	-65.3	178.6	-178.1	0	0	113.1	G114 E119 E120	G114-E116 PolarHBondContact O-N 3.42Å; E116-E119 PolarHBondContact O-N 2.9Å; E116-E120 WeakPolarHBondContact O-CB 3.44Å; E116-E120 PolarHBondContact O-N 3.31Å
117	E	96.6	Very high	95.3	Very high	160 Å²	160	66.1 Å²	66.1	75%	0.748	36%	0.361	S	S	*	.	H	α-helix	trans	-64.6	-43.5	180	-66.1	-174.8	179.9	0	0	111.5	Q115 A121	Q115-E117 PolarHBondContact O-N 3.32Å; E117-A121 WeakPolarHBondContact O-CB 3.38Å; E117-A121 PolarHBondContact O-N 2.95Å
118	E	97.4	Very high	94.9	Very high	77 Å²	77	65.8 Å²	65.8	36%	0.36	36%	0.358	S	S	.	.	H	α-helix	trans	-71.2	-34.9	178	-67	87.4	164.2	0	0	112.7	Y110 Q115 C122	Y110-E118 HydrophobicContact CD1-CB 3.74Å; Y110-E118 HydrophobicContact CD1-CG 4.47Å; Y110-E118 HydrophobicContact CD2-CB 3.68Å; Y110-E118 HydrophobicContact CE1-CB 3.85Å; Y110-E118 HydrophobicContact CE1-CG 4.21Å; Y110-E118 HydrophobicContact CE2-CB 3.79Å; Y110-E118 HydrophobicContact CG-CB 3.66Å; Q115-E118 HydrophobicContact CB-CB 4.39Å; Q115-E118 WeakPolarHBondContact CB-OE2 3.47Å; Q115-E118 PolarHBondContact O-N 3.37Å; E118-C122 WeakPolarHBondContact O-CB 3.16Å; E118-C122 PolarHBondContact O-N 2.9Å; E118-C122 PolarHBondContact O-SG 3.46Å
119	E	96.9	Very high	94.5	Very high	74 Å²	74	62.2 Å²	62.2	35%	0.346	34%	0.342	S	S	.	.	H	α-helix	trans	-60.7	-52	172.4	178.3	175.6	-167.3	0	0	111	A107 G111 Q115 E116 A121 C122 A123	A107-E119 HydrophobicContact CB-CG 4.38Å; G111-E119 WeakPolarHBondContact CA-OE2 3.46Å; Q115-E119 WeakPolarHBondContact O-CB 3.4Å; Q115-E119 PolarHBondContact O-N 3.36Å; E116-E119 PolarHBondContact O-N 2.9Å; E119-A121 VanDerWaalsContact C-N 3.33Å; E119-A121 PolarHBondContact O-N 3.06Å; E119-C122 PolarHBondContact O-N 3.46Å; E119-C122 VanDerWaalsContact O-N 3.15Å; E119-A123 PolarHBondContact O-N 3.28Å
120	E	94.3	Very high	93.9	Very high	146 Å²	146	63.7 Å²	63.7	68%	0.682	35%	0.349	S	S	*	.	H	α-helix	trans	-61.4	-41.6	178.7	-171.6	177.6	-174.3	0	0	111.2	E116 C122 A123 A124	E116-E120 WeakPolarHBondContact O-CB 3.44Å; E116-E120 PolarHBondContact O-N 3.31Å; E120-C122 VanDerWaalsContact C-N 3.33Å; E120-C122 PolarHBondContact O-N 3.47Å; E120-A123 PolarHBondContact O-N 2.73Å; E120-A124 WeakPolarHBondContact O-CB 3.32Å; E120-A124 PolarHBondContact O-N 3.3Å
121	A	95.4	Very high	93.1	Very high	60 Å²	60	64.9 Å²	64.9	50%	0.496	37%	0.369	S	S	.	.	H	α-helix	trans	-61.4	-40.4	175.7	0	0	0	0	0	112.4	E117 E119 R125	E117-A121 WeakPolarHBondContact O-CB 3.38Å; E117-A121 PolarHBondContact O-N 2.95Å; E119-A121 VanDerWaalsContact C-N 3.33Å; E119-A121 PolarHBondContact O-N 3.06Å; A121-R125 WeakPolarHBondContact O-CB 3.44Å; A121-R125 PolarHBondContact O-N 3.07Å
122	C	95.4	Very high	92.4	Very high	6 Å²	6	67.3 Å²	67.3	4%	0.041	38%	0.375	C	S	.	.	H	α-helix	trans	-67.6	-42.1	175.7	-70.3	0	0	0	0	111.9	W103 A107 E118 E119 E120 R125 L126	W103-C122 HydrophobicContact CE3-CB 4.25Å; A107-C122 HydrophobicContact CB-CB 3.82Å; E118-C122 WeakPolarHBondContact O-CB 3.16Å; E118-C122 PolarHBondContact O-N 2.9Å; E118-C122 PolarHBondContact O-SG 3.46Å; E119-C122 PolarHBondContact O-N 3.46Å; E119-C122 VanDerWaalsContact O-N 3.15Å; E120-C122 VanDerWaalsContact C-N 3.33Å; E120-C122 PolarHBondContact O-N 3.47Å; C122-R125 PolarHBondContact O-N 3.19Å; C122-L126 WeakPolarHBondContact O-CB 3.37Å; C122-L126 PolarHBondContact O-N 2.89Å
123	A	92.6	Very high	91.2	Very high	47 Å²	47	62.4 Å²	62.4	39%	0.388	37%	0.365	S	S	.	.	H	α-helix	trans	-64.1	-45.7	177.9	0	0	0	0	0	111.8	E119 E120 R125 L126 A127	E119-A123 PolarHBondContact O-N 3.28Å; E120-A123 PolarHBondContact O-N 2.73Å; A123-R125 VanDerWaalsContact C-N 3.32Å; A123-R125 PolarHBondContact O-N 3.5Å; A123-L126 WeakPolarHBondContact O-CB 3.44Å; A123-L126 PolarHBondContact O-N 3.34Å; A123-A127 WeakPolarHBondContact O-CB 3.19Å; A123-A127 PolarHBondContact O-N 2.85Å
124	A	90.9	Very high	89.4	Confident	63 Å²	63	69.4 Å²	69.4	52%	0.521	40%	0.396	S	S	.	.	H	α-helix	trans	-60.1	-42.9	174.9	0	0	0	0	0	111.4	E120 L126 A127 G128	E120-A124 WeakPolarHBondContact O-CB 3.32Å; E120-A124 PolarHBondContact O-N 3.3Å; A124-L126 PolarHBondContact O-N 3.35Å; A124-A127 PolarHBondContact O-N 3.36Å; A124-G128 PolarHBondContact O-N 3.25Å
125	R	92.9	Very high	87.5	Confident	79 Å²	79	74.3 Å²	74.3	30%	0.298	40%	0.404	S	S	.	.	H	α-helix	trans	-62.9	-42.4	176.1	-173.7	58.1	174.1	-174.7	-1.4	112	W103 A121 C122 A123 G128 L129 E137	W103-R125 HydrophobicContact CD2-CB 4.29Å; W103-R125 HydrophobicContact CD2-CG 3.79Å; W103-R125 HydrophobicContact CE3-CB 4.29Å; W103-R125 HydrophobicContact CE3-CG 4.13Å; W103-R125 HydrophobicContact CG-CG 4.28Å; W103-R125 HydrophobicContact CH2-CG 4.2Å; W103-R125 HydrophobicContact CZ2-CG 3.86Å; W103-R125 HydrophobicContact CZ3-CG 4.32Å; A121-R125 WeakPolarHBondContact O-CB 3.44Å; A121-R125 PolarHBondContact O-N 3.07Å; C122-R125 PolarHBondContact O-N 3.19Å; A123-R125 VanDerWaalsContact C-N 3.32Å; A123-R125 PolarHBondContact O-N 3.5Å; R125-G128 PolarHBondContact O-N 3.29Å; R125-L129 HydrophobicContact CG-CD1 4.41Å; R125-L129 VanDerWaalsContact O-CG 3.26Å; R125-L129 WeakPolarHBondContact O-CG 3.17Å; R125-L129 PolarHBondContact O-N 2.87Å; R125-E137 IonicContact CZ-OE2 3.09Å; R125-E137 IonicContact NH1-OE2 3.92Å; R125-E137 PolarHBondContact NH1-OE2 3.42Å
126	L	92.6	Very high	85.6	Confident	26 Å²	26	76.6 Å²	76.6	14%	0.136	42%	0.424	C	S	.	.	H	α-helix	trans	-62	-47.9	176.1	179.8	61.8	0	0	0	111.4	P22 L100 W103 A104 C122 A123 A124 G128 L129 M130	P22-L126 HydrophobicContact CB-CD1 4.21Å; P22-L126 HydrophobicContact CG-CD1 4.17Å; L100-L126 HydrophobicContact CB-CD1 4.05Å; L100-L126 HydrophobicContact CD2-CD1 3.99Å; L100-L126 WeakPolarHBondContact O-CD1 3.36Å; W103-L126 HydrophobicContact CB-CB 4.15Å; W103-L126 HydrophobicContact CB-CD1 4.36Å; A104-L126 HydrophobicContact CB-CD2 3.79Å; C122-L126 WeakPolarHBondContact O-CB 3.37Å; C122-L126 PolarHBondContact O-N 2.89Å; A123-L126 WeakPolarHBondContact O-CB 3.44Å; A123-L126 PolarHBondContact O-N 3.34Å; A124-L126 PolarHBondContact O-N 3.35Å; L126-G128 VanDerWaalsContact C-N 3.35Å; L126-G128 PolarHBondContact O-N 2.75Å; L126-L129 WeakPolarHBondContact O-CB 3.49Å; L126-L129 PolarHBondContact O-N 3.43Å; L126-L129 VanDerWaalsContact O-N 3.1Å; L126-M130 HydrophobicContact CD1-CG 4.29Å; L126-M130 HydrophobicContact CD1-SD 4.02Å; L126-M130 HydrophobicContact CG-SD 3.98Å; L126-M130 WeakPolarHBondContact O-CG 3.4Å; L126-M130 PolarHBondContact O-N 3.22Å
127	A	89.3	Confident	83.7	Confident	28 Å²	28	75.6 Å²	75.6	23%	0.231	42%	0.42	C	S	.	.	H	α-helix	trans	-59.3	-43.9	177.6	0	0	0	0	0	112	A123 A124 L129 M130 G131 L132	A123-A127 WeakPolarHBondContact O-CB 3.19Å; A123-A127 PolarHBondContact O-N 2.85Å; A124-A127 PolarHBondContact O-N 3.36Å; A127-L129 VanDerWaalsContact C-N 3.32Å; A127-L129 PolarHBondContact O-N 3.44Å; A127-M130 PolarHBondContact O-N 3.17Å; A127-G131 PolarHBondContact O-N 3.44Å; A127-G131 VanDerWaalsContact O-N 3.08Å; A127-L132 HydrophobicContact CB-CB 4.4Å; A127-L132 PolarHBondContact O-N 2.57Å
128	G	88.7	Confident	81.9	Confident	5 Å²	5	69.4 Å²	69.4	5%	0.052	40%	0.395	C	S	.	.	H	α-helix	trans	-61.5	-38.6	173.9	0	0	0	0	0	112.9	A124 R125 L126 G131	A124-G128 PolarHBondContact O-N 3.25Å; R125-G128 PolarHBondContact O-N 3.29Å; L126-G128 VanDerWaalsContact C-N 3.35Å; L126-G128 PolarHBondContact O-N 2.75Å; G128-G131 PolarHBondContact O-N 3.29Å
129	L	88.9	Confident	80	Confident	4 Å²	4	71 Å²	71	2%	0.021	42%	0.422	C	S	.	.	H	α-helix	trans	-67.9	-38.3	174.5	-70.9	171.9	0	0	0	112	L100 W103 R125 L126 A127 G131 A138 R145	L100-L129 HydrophobicContact CD2-CB 3.56Å; L100-L129 HydrophobicContact CD2-CD1 4.27Å; W103-L129 HydrophobicContact CG-CD1 4.28Å; R125-L129 HydrophobicContact CG-CD1 4.41Å; R125-L129 VanDerWaalsContact O-CG 3.26Å; R125-L129 WeakPolarHBondContact O-CG 3.17Å; R125-L129 PolarHBondContact O-N 2.87Å; L126-L129 WeakPolarHBondContact O-CB 3.49Å; L126-L129 PolarHBondContact O-N 3.43Å; L126-L129 VanDerWaalsContact O-N 3.1Å; A127-L129 VanDerWaalsContact C-N 3.32Å; A127-L129 PolarHBondContact O-N 3.44Å; L129-G131 PolarHBondContact O-N 3.05Å; L129-A138 HydrophobicContact CD2-CB 3.6Å; L129-R145 VanDerWaalsContact C-NH1 3.27Å; L129-R145 VanDerWaalsContact CB-NH1 3.3Å; L129-R145 PolarHBondContact O-NH1 3.25Å; L129-R145 PolarHBondContact O-NH2 3.41Å; L129-R145 VanDerWaalsContact O-NH2 3.09Å
130	M	86.3	Confident	78.6	Confident	31 Å²	31	70 Å²	70	15%	0.153	43%	0.431	C	S	.	.	H	α-helix	trans	-74.9	-7.4	178.1	-65.8	179.8	72	0	0	113.2	L18 P22 L100 L126 A127 L132	L18-M130 HydrophobicContact CD1-CE 3.54Å; L18-M130 HydrophobicContact CD2-CE 3.94Å; L18-M130 HydrophobicContact CG-CE 4.37Å; P22-M130 HydrophobicContact CG-CE 3.98Å; P22-M130 HydrophobicContact CG-SD 3.69Å; L100-M130 HydrophobicContact CD1-CG 4.5Å; L100-M130 HydrophobicContact CD2-CG 4.02Å; L126-M130 HydrophobicContact CD1-CG 4.29Å; L126-M130 HydrophobicContact CD1-SD 4.02Å; L126-M130 HydrophobicContact CG-SD 3.98Å; L126-M130 WeakPolarHBondContact O-CG 3.4Å; L126-M130 PolarHBondContact O-N 3.22Å; A127-M130 PolarHBondContact O-N 3.17Å; M130-L132 VanDerWaalsContact C-N 3.3Å; M130-L132 HydrophobicContact CB-CD1 4.05Å; M130-L132 HydrophobicContact CB-CG 3.95Å; M130-L132 HydrophobicContact CE-CD1 4.47Å
131	G	81.9	Confident	78	Confident	51 Å²	51	64.7 Å²	64.7	53%	0.526	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	76	21.2	-177.9	0	0	0	0	0	113.1	A127 G128 L129	A127-G131 PolarHBondContact O-N 3.44Å; A127-G131 VanDerWaalsContact O-N 3.08Å; G128-G131 PolarHBondContact O-N 3.29Å; L129-G131 PolarHBondContact O-N 3.05Å
132	L	80.1	Confident	77.5	Confident	80 Å²	80	65 Å²	65	42%	0.419	41%	0.405	S	S	.	.			trans	-90.7	-11.8	177.3	-58	177.5	0	0	0	112.2	L14 L18 A127 M130	L14-L132 HydrophobicContact CD2-CD2 3.76Å; L18-L132 HydrophobicContact CD1-CD1 4.34Å; A127-L132 HydrophobicContact CB-CB 4.4Å; A127-L132 PolarHBondContact O-N 2.57Å; M130-L132 VanDerWaalsContact C-N 3.3Å; M130-L132 HydrophobicContact CB-CD1 4.05Å; M130-L132 HydrophobicContact CB-CG 3.95Å; M130-L132 HydrophobicContact CE-CD1 4.47Å
133	A	71.6	Confident	77.1	Confident	41 Å²	41	69.4 Å²	69.4	34%	0.339	43%	0.425	S	S	.	.	S	Bend	trans	-80.8	150.4	176.2	0	0	0	0	0	112.3	E135	A133-E135 PolarHBondContact O-N 2.83Å
134	E	56.9	Low	77	Confident	204 Å²	204	68.7 Å²	68.7	95%	0.953	41%	0.414	S	S	*	.	S	Bend	trans	-59.3	-27.2	-179.8	-64.4	-168.7	154.9	0	0	113.4
135	E	57.1	Low	77	Confident	160 Å²	160	67.2 Å²	67.2	75%	0.748	40%	0.395	S	S	*	.	S	Bend	trans	-122.5	115.6	173.2	-65.9	-167.6	168.8	0	0	111.1	A133 E137	A133-E135 PolarHBondContact O-N 2.83Å; E135-E137 PolarHBondContact O-N 3Å
136	P	55.8	Low	76.9	Confident	112 Å²	112	63.6 Å²	63.6	73%	0.727	38%	0.382	S	S	*	.			trans	-71	102.8	178.7	24.4	-30.1	0	0	0	111.2
137	E	55.7	Low	77	Confident	134 Å²	134	62.3 Å²	62.3	63%	0.626	38%	0.375	S	S	*	.			trans	-75.5	-24.5	-178.2	-73.4	-167.1	145.3	0	0	114.7	R125 E135	R125-E137 IonicContact CZ-OE2 3.09Å; R125-E137 IonicContact NH1-OE2 3.92Å; R125-E137 PolarHBondContact NH1-OE2 3.42Å; E135-E137 PolarHBondContact O-N 3Å
138	A	59	Low	77.2	Confident	29 Å²	29	65.2 Å²	65.2	24%	0.24	38%	0.38	C	S	.	.			trans	-100.9	119	-158.9	0	0	0	0	0	113.8	L129 G140	L129-A138 HydrophobicContact CD2-CB 3.6Å; A138-G140 PolarHBondContact O-N 3.31Å
139	A	57.6	Low	77.5	Confident	111 Å²	111	65.1 Å²	65.1	92%	0.917	38%	0.379	S	S	*	.			trans	-67.7	118.8	165.4	0	0	0	0	0	110.3
140	G	68.7	Low	77.9	Confident	53 Å²	53	65 Å²	65	55%	0.546	38%	0.378	S	S	.	.	S	Bend	trans	141.5	163	173.8	0	0	0	0	0	114	A138 P142	A138-G140 PolarHBondContact O-N 3.31Å; G140-P142 WeakPolarHBondContact O-CD 3.45Å
141	D	81.1	Confident	78.4	Confident	34 Å²	34	63.7 Å²	63.7	18%	0.182	37%	0.372	C	S	.	.			trans	-74	119.3	-178.5	176.6	20.5	0	0	0	111.4	Q143 L144 R145 Q189	D141-Q143 VanDerWaalsContact C-N 3.28Å; D141-Q143 PolarHBondContact O-N 3.08Å; D141-Q143 WeakPolarHBondContact OD1-CB 3.41Å; D141-Q143 PolarHBondContact OD1-N 3.45Å; D141-L144 HydrophobicContact CB-CB 3.94Å; D141-L144 PolarHBondContact O-N 3.37Å; D141-L144 PolarHBondContact OD2-N 3.02Å; D141-L144 VanDerWaalsContact OD2-N 3.13Å; D141-R145 PolarHBondContact O-N 3.43Å; D141-R145 PolarHBondContact O-NE 3.4Å; D141-Q189 PolarHBondContact OD2-NE2 3.45Å; D141-Q189 PolarHBondContact OD2-OE1 3.04Å
142	P	84.9	Confident	79.1	Confident	68 Å²	68	62 Å²	62	44%	0.442	35%	0.35	S	S	.	.	H	α-helix	trans	-62.4	-32.3	174.3	25.9	-33.9	0	0	0	112.8	G140 R145 A146	G140-P142 WeakPolarHBondContact O-CD 3.45Å; P142-R145 PolarHBondContact O-N 3.37Å; P142-A146 PolarHBondContact O-N 3.37Å
143	Q	87.1	Confident	79.9	Confident	98 Å²	98	58.4 Å²	58.4	46%	0.458	33%	0.331	S	S	.	.	H	α-helix	trans	-69.1	-40.5	179.1	-64.8	-176	-11	0	0	111.7	D141 R145 A146 A147	D141-Q143 VanDerWaalsContact C-N 3.28Å; D141-Q143 PolarHBondContact O-N 3.08Å; D141-Q143 WeakPolarHBondContact OD1-CB 3.41Å; D141-Q143 PolarHBondContact OD1-N 3.45Å; Q143-R145 VanDerWaalsContact C-N 3.3Å; Q143-R145 PolarHBondContact O-N 2.98Å; Q143-A146 WeakPolarHBondContact O-CB 3.49Å; Q143-A146 PolarHBondContact O-N 3.02Å; Q143-A147 WeakPolarHBondContact O-CB 3.45Å; Q143-A147 PolarHBondContact O-N 3.08Å
144	L	89.8	Confident	81.2	Confident	31 Å²	31	56.4 Å²	56.4	16%	0.162	32%	0.315	C	S	.	.	H	α-helix	trans	-61.3	-38.6	173.1	-178.3	59.6	0	0	0	112.4	D141 A147 R148 I190	D141-L144 HydrophobicContact CB-CB 3.94Å; D141-L144 PolarHBondContact O-N 3.37Å; D141-L144 PolarHBondContact OD2-N 3.02Å; D141-L144 VanDerWaalsContact OD2-N 3.13Å; L144-A147 PolarHBondContact O-N 3.07Å; L144-R148 WeakPolarHBondContact O-CG 3.48Å; L144-R148 PolarHBondContact O-N 3.19Å; L144-I190 HydrophobicContact CD1-CB 4.18Å; L144-I190 HydrophobicContact CD1-CG1 3.69Å; L144-I190 HydrophobicContact CD1-CG2 4.47Å
145	R	90.7	Very high	83.1	Confident	33 Å²	33	47 Å²	47	13%	0.125	27%	0.271	C	S	.	.	H	α-helix	trans	-67.4	-43.2	176.2	-74.6	179.7	-75.6	158.4	2.7	111.8	G98 L100 L129 D141 P142 Q143 A147 R148 C149	G98-R145 VanDerWaalsContact O-CD 3.3Å; G98-R145 WeakPolarHBondContact O-CD 3.48Å; L100-R145 HydrophobicContact CD1-CB 4.03Å; L100-R145 HydrophobicContact CG-CB 4.19Å; L129-R145 VanDerWaalsContact C-NH1 3.27Å; L129-R145 VanDerWaalsContact CB-NH1 3.3Å; L129-R145 PolarHBondContact O-NH1 3.25Å; L129-R145 PolarHBondContact O-NH2 3.41Å; L129-R145 VanDerWaalsContact O-NH2 3.09Å; D141-R145 PolarHBondContact O-N 3.43Å; D141-R145 PolarHBondContact O-NE 3.4Å; P142-R145 PolarHBondContact O-N 3.37Å; Q143-R145 VanDerWaalsContact C-N 3.3Å; Q143-R145 PolarHBondContact O-N 2.98Å; R145-A147 VanDerWaalsContact C-N 3.35Å; R145-A147 PolarHBondContact O-N 3.07Å; R145-R148 PolarHBondContact O-N 3.36Å; R145-C149 VanDerWaalsContact O-CB 3.28Å; R145-C149 WeakPolarHBondContact O-CB 3.38Å; R145-C149 PolarHBondContact O-N 3.37Å
146	A	92	Very high	84.9	Confident	2 Å²	2	39.4 Å²	39.4	2%	0.017	24%	0.235	C	C	.	.	H	α-helix	trans	-57.6	-46.7	172.4	0	0	0	0	0	111.8	Y20 P142 Q143 R148 C149 L150 Y186	Y20-A146 HydrophobicContact CD1-CB 4.14Å; Y20-A146 HydrophobicContact CE1-CB 3.37Å; Y20-A146 HydrophobicContact CE2-CB 4.09Å; Y20-A146 WeakPolarHBondContact OH-CB 3.41Å; P142-A146 PolarHBondContact O-N 3.37Å; Q143-A146 WeakPolarHBondContact O-CB 3.49Å; Q143-A146 PolarHBondContact O-N 3.02Å; A146-R148 PolarHBondContact O-N 2.96Å; A146-C149 WeakPolarHBondContact O-CB 3.42Å; A146-C149 PolarHBondContact O-N 3.17Å; A146-L150 WeakPolarHBondContact O-CG 3.48Å; A146-L150 PolarHBondContact O-N 3.06Å; A146-Y186 HydrophobicContact CB-CD1 4.11Å; A146-Y186 HydrophobicContact CB-CE1 4.3Å; A146-Y186 HydrophobicContact CB-CG 4.33Å
147	A	93.8	Very high	86.8	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-60.3	-46.6	178.9	0	0	0	0	0	112.1	Q143 L144 R145 L150 A151 A183 I190 W198	Q143-A147 WeakPolarHBondContact O-CB 3.45Å; Q143-A147 PolarHBondContact O-N 3.08Å; L144-A147 PolarHBondContact O-N 3.07Å; R145-A147 VanDerWaalsContact C-N 3.35Å; R145-A147 PolarHBondContact O-N 3.07Å; A147-L150 PolarHBondContact O-N 2.69Å; A147-A151 WeakPolarHBondContact O-CB 3.34Å; A147-A151 PolarHBondContact O-N 3.33Å; A147-A183 WeakPolarHBondContact CB-O 3.32Å; A147-A183 VanDerWaalsContact O-CB 3.27Å; A147-A183 WeakPolarHBondContact O-CB 3.48Å; A147-I190 HydrophobicContact CB-CD1 3.93Å; A147-I190 HydrophobicContact CB-CG1 4.16Å; A147-W198 HydrophobicContact CB-CH2 3.92Å; A147-W198 HydrophobicContact CB-CZ3 4.38Å
148	R	94.5	Very high	88.6	Confident	89 Å²	89	28.2 Å²	28.2	34%	0.336	17%	0.174	S	C	.	.	H	α-helix	trans	-64.7	-40.4	176.6	-75.4	172.9	173.4	163.7	-0.1	112.4	L144 R145 A146 L150 A151 E152 E194 W198	L144-R148 WeakPolarHBondContact O-CG 3.48Å; L144-R148 PolarHBondContact O-N 3.19Å; R145-R148 PolarHBondContact O-N 3.36Å; A146-R148 PolarHBondContact O-N 2.96Å; R148-L150 PolarHBondContact O-N 3.16Å; R148-A151 PolarHBondContact O-N 3.4Å; R148-E152 WeakPolarHBondContact O-CB 3.44Å; R148-E152 VanDerWaalsContact O-CG 3.3Å; R148-E152 WeakPolarHBondContact O-CG 3.44Å; R148-E152 PolarHBondContact O-N 3.06Å; R148-E194 WeakPolarHBondContact CG-OE1 3.36Å; R148-E194 IonicContact CZ-OE1 3.93Å; R148-E194 IonicContact CZ-OE2 3.28Å; R148-E194 IonicContact NE-OE1 3.55Å; R148-E194 PolarHBondContact NE-OE1 3.32Å; R148-E194 IonicContact NE-OE2 2.88Å; R148-E194 PolarHBondContact NE-OE2 3.18Å; R148-E194 IonicContact NH2-OE1 3.64Å; R148-E194 IonicContact NH2-OE2 3.76Å; R148-E194 PolarHBondContact NH2-OE2 3.09Å; R148-W198 HydrophobicContact CG-CZ2 4.07Å
149	C	95.3	Very high	90.3	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.014	17%	0.169	C	C	.	.	H	α-helix	trans	-53.9	-53.5	175.4	-174.1	0	0	0	0	111	Y20 L100 N101 R145 A146 E152 Q153	Y20-C149 HydrophobicContact CD2-CB 4.42Å; Y20-C149 HydrophobicContact CE2-CB 4.17Å; L100-C149 HydrophobicContact CB-CB 4.3Å; L100-C149 HydrophobicContact CD1-CB 4.15Å; N101-C149 WeakPolarHBondContact ND2-CA 3.44Å; N101-C149 PolarHBondContact ND2-O 3.33Å; N101-C149 PolarHBondContact OD1-SG 3.22Å; R145-C149 VanDerWaalsContact O-CB 3.28Å; R145-C149 WeakPolarHBondContact O-CB 3.38Å; R145-C149 PolarHBondContact O-N 3.37Å; A146-C149 WeakPolarHBondContact O-CB 3.42Å; A146-C149 PolarHBondContact O-N 3.17Å; C149-E152 PolarHBondContact O-N 2.94Å; C149-Q153 WeakPolarHBondContact O-CG 3.49Å; C149-Q153 PolarHBondContact O-N 2.98Å; C149-Q153 VanDerWaalsContact O-N 3.09Å
150	L	96.3	Very high	91.9	Very high	3 Å²	3	24.2 Å²	24.2	2%	0.016	13%	0.132	C	C	.	.	H	α-helix	trans	-65.1	-39.1	178.7	-70.5	167.1	0	0	0	112.8	A146 A147 R148 Q153 G154 L179 K182 A183 Y186	A146-L150 WeakPolarHBondContact O-CG 3.48Å; A146-L150 PolarHBondContact O-N 3.06Å; A147-L150 PolarHBondContact O-N 2.69Å; R148-L150 PolarHBondContact O-N 3.16Å; L150-Q153 PolarHBondContact O-N 3.45Å; L150-G154 PolarHBondContact O-N 2.63Å; L150-L179 HydrophobicContact CD2-CD2 3.78Å; L150-K182 HydrophobicContact CD1-CB 4.24Å; L150-K182 HydrophobicContact CD1-CD 4.07Å; L150-K182 HydrophobicContact CD1-CG 3.83Å; L150-K182 HydrophobicContact CD2-CD 4.13Å; L150-A183 HydrophobicContact CB-CB 3.77Å; L150-Y186 HydrophobicContact CD1-CD2 3.71Å; L150-Y186 HydrophobicContact CD1-CE2 3.6Å
151	A	96.4	Very high	92.8	Very high	3 Å²	3	22 Å²	22	3%	0.025	11%	0.108	C	C	.	.	H	α-helix	trans	-66.3	-38.4	178.4	0	0	0	0	0	112.6	A147 R148 G154 Y155 Y180 A183 W198	A147-A151 WeakPolarHBondContact O-CB 3.34Å; A147-A151 PolarHBondContact O-N 3.33Å; R148-A151 PolarHBondContact O-N 3.4Å; A151-G154 PolarHBondContact O-N 3.43Å; A151-Y155 PolarHBondContact O-N 2.95Å; A151-Y180 HydrophobicContact CB-CD1 4.03Å; A151-Y180 HydrophobicContact CB-CE1 3.72Å; A151-Y180 WeakPolarHBondContact O-CE1 3.47Å; A151-Y180 VanDerWaalsContact O-CZ 3.24Å; A151-Y180 PolarHBondContact O-OH 2.64Å; A151-Y180 VanDerWaalsContact O-OH 3.08Å; A151-A183 HydrophobicContact CB-CB 4.15Å; A151-W198 HydrophobicContact CB-CD2 3.78Å; A151-W198 HydrophobicContact CB-CE3 4.06Å; A151-W198 HydrophobicContact CB-CG 4.37Å; A151-W198 HydrophobicContact CB-CH2 3.92Å; A151-W198 HydrophobicContact CB-CZ2 3.65Å; A151-W198 HydrophobicContact CB-CZ3 4.08Å
152	E	97.2	Very high	93	Very high	15 Å²	15	21.2 Å²	21.2	7%	0.07	11%	0.108	C	C	.	.	H	α-helix	trans	-67	-41.3	174	-73	168.9	-167.9	0	0	111.5	P66 A67 H70 N99 N101 R148 C149 Y155 A156	P66-E152 WeakPolarHBondContact CB-OE1 3.18Å; A67-E152 HydrophobicContact CB-CB 4.28Å; A67-E152 HydrophobicContact CB-CG 3.99Å; H70-E152 IonicContact CD2-OE2 3.6Å; H70-E152 PolarHBondContact CD2-OE2 3.25Å; H70-E152 IonicContact NE2-OE2 2.76Å; H70-E152 PolarHBondContact NE2-OE2 2.95Å; N99-E152 VanDerWaalsContact ND2-CD 3.32Å; N99-E152 PolarHBondContact ND2-OE1 3.16Å; N99-E152 PolarHBondContact ND2-OE2 2.81Å; N99-E152 PolarHBondContact OD1-OE2 2.84Å; N101-E152 WeakPolarHBondContact ND2-CB 3.48Å; N101-E152 PolarHBondContact ND2-OE2 3.46Å; R148-E152 WeakPolarHBondContact O-CB 3.44Å; R148-E152 VanDerWaalsContact O-CG 3.3Å; R148-E152 WeakPolarHBondContact O-CG 3.44Å; R148-E152 PolarHBondContact O-N 3.06Å; C149-E152 PolarHBondContact O-N 2.94Å; E152-Y155 WeakPolarHBondContact O-CB 3.31Å; E152-Y155 PolarHBondContact O-N 3.09Å; E152-A156 PolarHBondContact O-N 2.99Å
153	Q	97.5	Very high	92.9	Very high	4 Å²	4	19.1 Å²	19.1	2%	0.019	9%	0.094	C	C	.	.	H	α-helix	trans	-64.2	-41	173.1	-68.6	171	-23	0	0	111.7	L21 G23 H26 L27 N101 C149 L150 Y155 A156 H157 L179	L21-Q153 PolarHBondContact O-NE2 3.42Å; G23-Q153 PolarHBondContact O-NE2 3.42Å; H26-Q153 PolarHBondContact NE2-NE2 3.2Å; L27-Q153 HydrophobicContact CD1-CB 4.02Å; L27-Q153 HydrophobicContact CD1-CG 4.11Å; L27-Q153 HydrophobicContact CD2-CB 3.92Å; L27-Q153 HydrophobicContact CD2-CG 3.9Å; N101-Q153 PolarHBondContact OD1-NE2 3.37Å; C149-Q153 WeakPolarHBondContact O-CG 3.49Å; C149-Q153 PolarHBondContact O-N 2.98Å; C149-Q153 VanDerWaalsContact O-N 3.09Å; L150-Q153 PolarHBondContact O-N 3.45Å; Q153-Y155 VanDerWaalsContact C-N 3.28Å; Q153-Y155 PolarHBondContact O-N 3.42Å; Q153-A156 VanDerWaalsContact O-CB 3.32Å; Q153-A156 WeakPolarHBondContact O-CB 3.47Å; Q153-A156 PolarHBondContact O-N 3.46Å; Q153-A156 VanDerWaalsContact O-N 3.08Å; Q153-H157 PolarHBondContact O-CD2 3.31Å; Q153-L179 HydrophobicContact CB-CD1 3.92Å
154	G	97.1	Very high	92.5	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-61	-35.7	175.3	0	0	0	0	0	113.1	L150 A151 A156	L150-G154 PolarHBondContact O-N 2.63Å; A151-G154 PolarHBondContact O-N 3.43Å; G154-A156 VanDerWaalsContact C-N 3.33Å
155	Y	96.8	Very high	92.3	Very high	6 Å²	6	18.3 Å²	18.3	2%	0.024	11%	0.107	C	C	.	.	H	α-helix	trans	-62	-40.9	172.7	-177.9	-99.7	0	0	0	111.6	E56 A67 V68 L71 A151 E152 Q153 H157 G158 F159 Y180 T201	E56-Y155 PolarHBondContact OE1-OH 3.47Å; E56-Y155 PolarHBondContact OE2-OH 2.94Å; A67-Y155 HydrophobicContact CB-CD1 3.54Å; A67-Y155 HydrophobicContact CB-CE1 4.12Å; A67-Y155 HydrophobicContact CB-CG 3.77Å; V68-Y155 HydrophobicContact CG2-CE1 4.09Å; V68-Y155 WeakPolarHBondContact CG2-OH 3.18Å; L71-Y155 HydrophobicContact CD1-CD1 3.74Å; L71-Y155 HydrophobicContact CD1-CE1 3.58Å; A151-Y155 PolarHBondContact O-N 2.95Å; E152-Y155 WeakPolarHBondContact O-CB 3.31Å; E152-Y155 PolarHBondContact O-N 3.09Å; Q153-Y155 VanDerWaalsContact C-N 3.28Å; Q153-Y155 PolarHBondContact O-N 3.42Å; Y155-H157 VanDerWaalsContact C-N 3.32Å; Y155-H157 PolarHBondContact O-N 3Å; Y155-G158 PolarHBondContact O-N 2.84Å; Y155-F159 HydrophobicContact CD1-CD2 4.42Å; Y155-F159 HydrophobicContact CD1-CE2 4.11Å; Y155-F159 HydrophobicContact CD2-CE2 4.34Å; Y155-F159 HydrophobicContact CE1-CD2 4.12Å; Y155-F159 AromaticContact CE1-CE2 3.55Å; Y155-F159 HydrophobicContact CE1-CE2 3.55Å; Y155-F159 HydrophobicContact CE1-CZ 4.23Å; Y155-F159 AromaticContact CE2-CE2 3.77Å; Y155-F159 HydrophobicContact CE2-CE2 3.77Å; Y155-F159 HydrophobicContact CE2-CZ 4.28Å; Y155-F159 HydrophobicContact CG-CE2 4.48Å; Y155-F159 AromaticContact CZ-CE2 3.33Å; Y155-F159 AromaticContact CZ-CZ 3.72Å; Y155-F159 WeakPolarHBondContact O-CD2 3.4Å; Y155-F159 WeakPolarHBondContact OH-CE2 3.27Å; Y155-F159 WeakPolarHBondContact OH-CZ 3.28Å; Y155-Y180 WeakPolarHBondContact CB-OH 3.49Å; Y155-Y180 PolarHBondContact N-OH 3.05Å; Y155-T201 HydrophobicContact CD2-CG2 3.8Å; Y155-T201 HydrophobicContact CE2-CG2 4.45Å
156	A	96.8	Very high	92.2	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-59.2	-39.1	-175.4	0	0	0	0	0	113.6	L27 M29 L71 E152 Q153 G154 G158 F159	L27-A156 HydrophobicContact CD1-CB 4.17Å; M29-A156 HydrophobicContact SD-CB 3.84Å; L71-A156 HydrophobicContact CD2-CB 3.69Å; L71-A156 HydrophobicContact CG-CB 4.24Å; E152-A156 PolarHBondContact O-N 2.99Å; Q153-A156 VanDerWaalsContact O-CB 3.32Å; Q153-A156 WeakPolarHBondContact O-CB 3.47Å; Q153-A156 PolarHBondContact O-N 3.46Å; Q153-A156 VanDerWaalsContact O-N 3.08Å; G154-A156 VanDerWaalsContact C-N 3.33Å; A156-G158 PolarHBondContact O-N 3.33Å; A156-G158 VanDerWaalsContact O-N 3.08Å; A156-F159 PolarHBondContact O-N 3.46Å
157	H	95.5	Very high	92.2	Very high	8 Å²	8	23.1 Å²	23.1	4%	0.037	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-60.2	-20.4	176.8	-77.4	-79.6	0	0	0	114.2	Q153 Y155 F159 G172	Q153-H157 PolarHBondContact O-CD2 3.31Å; Y155-H157 VanDerWaalsContact C-N 3.32Å; Y155-H157 PolarHBondContact O-N 3Å; H157-F159 PolarHBondContact O-N 3.05Å; H157-G172 WeakPolarHBondContact CB-O 3.42Å; H157-G172 PolarHBondContact ND1-O 3.09Å
158	G	93.5	Very high	92	Very high	3 Å²	3	24.9 Å²	24.9	3%	0.031	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-66.4	-18.2	171.7	0	0	0	0	0	113.6	Y155 A156 R208	Y155-G158 PolarHBondContact O-N 2.84Å; A156-G158 PolarHBondContact O-N 3.33Å; A156-G158 VanDerWaalsContact O-N 3.08Å; G158-R208 PolarHBondContact O-NH1 2.67Å; G158-R208 PolarHBondContact O-NH2 3.11Å
159	F	93.3	Very high	91.9	Very high	31 Å²	31	26.3 Å²	26.3	14%	0.136	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-122.6	16.7	-171.1	-61.4	-93.1	0	0	0	112.7	L53 L71 F75 Y155 A156 H157	L53-F159 HydrophobicContact CD2-CD1 3.73Å; L53-F159 HydrophobicContact CD2-CD2 4.5Å; L53-F159 HydrophobicContact CD2-CE1 3.44Å; L53-F159 VanDerWaalsContact CD2-CE1 3.44Å; L53-F159 HydrophobicContact CD2-CE2 4.27Å; L53-F159 HydrophobicContact CD2-CG 4.24Å; L53-F159 HydrophobicContact CD2-CZ 3.73Å; L53-F159 HydrophobicContact CG-CD1 4.15Å; L53-F159 HydrophobicContact CG-CE1 4.19Å; L71-F159 HydrophobicContact CD1-CB 3.76Å; L71-F159 HydrophobicContact CD1-CD2 3.33Å; L71-F159 HydrophobicContact CD1-CE2 4.02Å; L71-F159 HydrophobicContact CD1-CG 3.62Å; L71-F159 HydrophobicContact CD2-CB 4.37Å; F75-F159 HydrophobicContact CZ-CB 4.37Å; Y155-F159 HydrophobicContact CD1-CD2 4.42Å; Y155-F159 HydrophobicContact CD1-CE2 4.11Å; Y155-F159 HydrophobicContact CD2-CE2 4.34Å; Y155-F159 HydrophobicContact CE1-CD2 4.12Å; Y155-F159 AromaticContact CE1-CE2 3.55Å; Y155-F159 HydrophobicContact CE1-CE2 3.55Å; Y155-F159 HydrophobicContact CE1-CZ 4.23Å; Y155-F159 AromaticContact CE2-CE2 3.77Å; Y155-F159 HydrophobicContact CE2-CE2 3.77Å; Y155-F159 HydrophobicContact CE2-CZ 4.28Å; Y155-F159 HydrophobicContact CG-CE2 4.48Å; Y155-F159 AromaticContact CZ-CE2 3.33Å; Y155-F159 AromaticContact CZ-CZ 3.72Å; Y155-F159 WeakPolarHBondContact O-CD2 3.4Å; Y155-F159 WeakPolarHBondContact OH-CE2 3.27Å; Y155-F159 WeakPolarHBondContact OH-CZ 3.28Å; A156-F159 PolarHBondContact O-N 3.46Å; H157-F159 PolarHBondContact O-N 3.05Å
160	D	91.9	Very high	91.8	Very high	26 Å²	26	26.6 Å²	26.6	14%	0.139	15%	0.151	C	C	.	.			trans	-57.2	140.8	178.3	-164.5	10.1	0	0	0	111.6	M29 Q30 L31	M29-D160 WeakPolarHBondContact CA-OD2 3.44Å; M29-D160 WeakPolarHBondContact CB-OD1 3.27Å; Q30-D160 VanDerWaalsContact N-CG 3.28Å; Q30-D160 PolarHBondContact N-OD1 3.08Å; Q30-D160 PolarHBondContact N-OD2 3.38Å; L31-D160 PolarHBondContact N-OD1 3.49Å
161	V	88.4	Confident	91.7	Very high	7 Å²	7	34.3 Å²	34.3	4%	0.042	18%	0.18	C	C	.	.			trans	-123.4	139.5	-175.7	178.8	0	0	0	0	108.8	L31 D45 M46 Q49 F75	L31-V161 PolarHBondContact N-O 3.03Å; D45-V161 HydrophobicContact CB-CG1 3.52Å; M46-V161 HydrophobicContact CG-CB 4.31Å; M46-V161 HydrophobicContact CG-CG1 4.06Å; M46-V161 HydrophobicContact CG-CG2 4.37Å; Q49-V161 HydrophobicContact CB-CG2 4.45Å; Q49-V161 HydrophobicContact CG-CG2 3.75Å; F75-V161 HydrophobicContact CE1-CG2 4.11Å; F75-V161 HydrophobicContact CZ-CG2 4.14Å
162	G	83.5	Confident	91.6	Very high	17 Å²	17	34.6 Å²	34.6	18%	0.175	18%	0.182	C	C	.	.			trans	97	8.4	177.9	0	0	0	0	0	114.8	A164	G162-A164 PolarHBondContact O-N 2.95Å
163	C	84.4	Confident	91.5	Very high	23 Å²	23	34 Å²	34	16%	0.155	18%	0.18	C	C	.	.			trans	-62.2	119.5	168.5	-52.4	0	0	0	0	110.2	E168 R169	C163-E168 HydrophobicContact CB-CB 4.22Å; C163-R169 HydrophobicContact CB-CB 4.18Å
164	A	78.8	Confident	91.5	Very high	79 Å²	79	35.9 Å²	35.9	65%	0.653	20%	0.196	S	C	*	.			trans	-81.8	-22.5	-179.5	0	0	0	0	0	112.4	G162 E168	G162-A164 PolarHBondContact O-N 2.95Å; A164-E168 PolarHBondContact N-OE2 3.29Å
165	S	84.3	Confident	91.4	Very high	33 Å²	33	37.4 Å²	37.4	23%	0.231	21%	0.209	C	C	.	.	S	Bend	trans	-134	158.8	-178.9	96.3	0	0	0	0	113.9	E167 E168 R169	S165-E167 VanDerWaalsContact C-N 3.25Å; S165-E167 WeakPolarHBondContact CB-OE2 3.37Å; S165-E167 PolarHBondContact O-N 3.35Å; S165-E167 PolarHBondContact OG-N 3.21Å; S165-E167 PolarHBondContact OG-OE2 2.88Å; S165-E168 PolarHBondContact N-OE2 3.33Å; S165-E168 PolarHBondContact O-N 3.31Å; S165-E168 PolarHBondContact OG-N 3.23Å; S165-R169 PolarHBondContact O-N 3.24Å
166	P	88.9	Confident	91.4	Very high	46 Å²	46	37.1 Å²	37.1	30%	0.299	21%	0.208	S	C	.	.	H	α-helix	trans	-59.2	-35	171.8	-20.5	31.8	0	0	0	112.8	R169 A170 I212 L216	P166-R169 PolarHBondContact O-N 3.31Å; P166-A170 WeakPolarHBondContact O-CB 3.49Å; P166-A170 PolarHBondContact O-N 3.08Å; P166-I212 HydrophobicContact CB-CG2 3.78Å; P166-I212 WeakPolarHBondContact O-CG2 3.34Å; P166-L216 HydrophobicContact CB-CD1 4.37Å; P166-L216 HydrophobicContact CB-CD2 4.09Å; P166-L216 HydrophobicContact CB-CG 4.31Å; P166-L216 HydrophobicContact CG-CD2 4.38Å
167	E	91.5	Very high	91.4	Very high	91 Å²	91	37.5 Å²	37.5	43%	0.425	21%	0.21	S	C	.	.	H	α-helix	trans	-65.6	-40.9	178.2	-59.6	78.6	-175.4	0	0	112.6	S165 R169 A170 R171 L216	S165-E167 VanDerWaalsContact C-N 3.25Å; S165-E167 WeakPolarHBondContact CB-OE2 3.37Å; S165-E167 PolarHBondContact O-N 3.35Å; S165-E167 PolarHBondContact OG-N 3.21Å; S165-E167 PolarHBondContact OG-OE2 2.88Å; E167-R169 VanDerWaalsContact C-N 3.35Å; E167-A170 PolarHBondContact O-N 3.03Å; E167-R171 WeakPolarHBondContact O-CG 3.5Å; E167-R171 PolarHBondContact O-N 3.11Å; E167-L216 HydrophobicContact CG-CD1 3.95Å; E167-L216 WeakPolarHBondContact OE1-CD2 3.48Å
168	E	90.4	Very high	91.5	Very high	37 Å²	37	39.9 Å²	39.9	17%	0.173	23%	0.231	C	C	.	.	H	α-helix	trans	-61	-46.1	172.9	-76.1	173.7	178.9	0	0	111.3	C163 A164 S165 A170 R171 G172	C163-E168 HydrophobicContact CB-CB 4.22Å; A164-E168 PolarHBondContact N-OE2 3.29Å; S165-E168 PolarHBondContact N-OE2 3.33Å; S165-E168 PolarHBondContact O-N 3.31Å; S165-E168 PolarHBondContact OG-N 3.23Å; E168-A170 VanDerWaalsContact C-N 3.31Å; E168-A170 PolarHBondContact O-N 3.45Å; E168-R171 PolarHBondContact O-N 2.61Å; E168-G172 PolarHBondContact O-N 3.45Å
169	R	91.5	Very high	91.6	Very high	118 Å²	118	41.2 Å²	41.2	45%	0.445	24%	0.237	S	C	.	.	H	α-helix	trans	-61.2	-41	176.2	-170.2	-178.5	-65.1	159.8	2.5	111.5	C163 S165 P166 E167 G172 L173 I212	C163-R169 HydrophobicContact CB-CB 4.18Å; S165-R169 PolarHBondContact O-N 3.24Å; P166-R169 PolarHBondContact O-N 3.31Å; E167-R169 VanDerWaalsContact C-N 3.35Å; R169-G172 PolarHBondContact O-N 3.2Å; R169-L173 WeakPolarHBondContact O-CG 3.5Å; R169-L173 PolarHBondContact O-N 2.89Å; R169-I212 HydrophobicContact CB-CD1 4.04Å; R169-I212 HydrophobicContact CG-CD1 3.75Å
170	A	94.3	Very high	91.8	Very high	8 Å²	8	40 Å²	40	7%	0.066	23%	0.232	C	C	.	.	H	α-helix	trans	-62.1	-42.5	175.9	0	0	0	0	0	112.2	P166 E167 E168 L173 A174 L209 I212 F213	P166-A170 WeakPolarHBondContact O-CB 3.49Å; P166-A170 PolarHBondContact O-N 3.08Å; E167-A170 PolarHBondContact O-N 3.03Å; E168-A170 VanDerWaalsContact C-N 3.31Å; E168-A170 PolarHBondContact O-N 3.45Å; A170-L173 PolarHBondContact O-N 3.16Å; A170-A174 WeakPolarHBondContact O-CB 3.49Å; A170-A174 PolarHBondContact O-N 3.28Å; A170-L209 HydrophobicContact CB-CD1 3.58Å; A170-L209 WeakPolarHBondContact O-CD1 3.37Å; A170-I212 HydrophobicContact CB-CG2 4Å; A170-F213 HydrophobicContact CB-CE1 4.16Å
171	R	94	Very high	91.9	Very high	166 Å²	166	42 Å²	42	63%	0.626	24%	0.242	S	C	*	.	H	α-helix	trans	-61.6	-45.7	174.9	-74.9	-171.5	-70	163.8	-2.5	111.9	E167 E168 L173 A174 A175	E167-R171 WeakPolarHBondContact O-CG 3.5Å; E167-R171 PolarHBondContact O-N 3.11Å; E168-R171 PolarHBondContact O-N 2.61Å; R171-L173 PolarHBondContact O-N 2.82Å; R171-A174 PolarHBondContact O-N 3.09Å; R171-A175 PolarHBondContact O-N 2.98Å
172	G	94	Very high	92.2	Very high	8 Å²	8	45.9 Å²	45.9	8%	0.082	26%	0.259	C	S	.	.	H	α-helix	trans	-58.1	-47.8	176.3	0	0	0	0	0	112.3	H157 E168 R169 A174 A175 G176	H157-G172 WeakPolarHBondContact CB-O 3.42Å; H157-G172 PolarHBondContact ND1-O 3.09Å; E168-G172 PolarHBondContact O-N 3.45Å; R169-G172 PolarHBondContact O-N 3.2Å; G172-A174 VanDerWaalsContact C-N 3.33Å; G172-A174 PolarHBondContact O-N 3.47Å; G172-A175 WeakPolarHBondContact O-CB 3.35Å; G172-A175 PolarHBondContact O-N 3.05Å; G172-G176 PolarHBondContact O-N 3.45Å
173	L	96	Very high	92.7	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.01	25%	0.25	C	S	.	.	H	α-helix	trans	-61.9	-39.6	176.7	-65.6	175.6	0	0	0	112.5	R169 A170 R171 G176 I177 L205 R208 L209 I212	R169-L173 WeakPolarHBondContact O-CG 3.5Å; R169-L173 PolarHBondContact O-N 2.89Å; A170-L173 PolarHBondContact O-N 3.16Å; R171-L173 PolarHBondContact O-N 2.82Å; L173-G176 PolarHBondContact O-N 2.77Å; L173-I177 WeakPolarHBondContact O-CD1 3.49Å; L173-I177 WeakPolarHBondContact O-CG1 3.47Å; L173-I177 PolarHBondContact O-N 3.32Å; L173-L205 HydrophobicContact CD2-CD2 3.67Å; L173-R208 HydrophobicContact CD1-CB 3.81Å; L173-L209 HydrophobicContact CB-CD1 4.48Å; L173-L209 HydrophobicContact CD1-CB 4.3Å; L173-I212 HydrophobicContact CD1-CD1 3.79Å
174	A	96	Very high	93.1	Very high	45 Å²	45	45.5 Å²	45.5	37%	0.372	25%	0.251	S	S	.	.	H	α-helix	trans	-65.2	-39	176.8	0	0	0	0	0	112.4	A170 R171 G172 I177 A178	A170-A174 WeakPolarHBondContact O-CB 3.49Å; A170-A174 PolarHBondContact O-N 3.28Å; R171-A174 PolarHBondContact O-N 3.09Å; G172-A174 VanDerWaalsContact C-N 3.33Å; G172-A174 PolarHBondContact O-N 3.47Å; A174-I177 PolarHBondContact O-N 3.37Å; A174-A178 PolarHBondContact O-N 3.2Å
175	A	96.1	Very high	93.6	Very high	32 Å²	32	44.9 Å²	44.9	26%	0.264	25%	0.252	S	S	.	.	H	α-helix	trans	-61.7	-44.4	173.7	0	0	0	0	0	111.5	R171 G172 I177 A178 L179	R171-A175 PolarHBondContact O-N 2.98Å; G172-A175 WeakPolarHBondContact O-CB 3.35Å; G172-A175 PolarHBondContact O-N 3.05Å; A175-I177 VanDerWaalsContact C-N 3.34Å; A175-I177 PolarHBondContact O-N 3.39Å; A175-A178 WeakPolarHBondContact O-CB 3.37Å; A175-A178 PolarHBondContact O-N 3.33Å; A175-L179 WeakPolarHBondContact O-CG 3.34Å; A175-L179 PolarHBondContact O-N 3.41Å
176	G	96.8	Very high	93.6	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-59.2	-41.9	174.6	0	0	0	0	0	113.5	G172 L173 L179 Y180	G172-G176 PolarHBondContact O-N 3.45Å; L173-G176 PolarHBondContact O-N 2.77Å; G176-L179 PolarHBondContact O-N 3.43Å; G176-Y180 VanDerWaalsContact O-CD2 3.31Å; G176-Y180 WeakPolarHBondContact O-CD2 3.38Å; G176-Y180 PolarHBondContact O-N 3.21Å
177	I	97.3	Very high	92.4	Very high	8 Å²	8	43.4 Å²	43.4	4%	0.041	24%	0.237	C	C	.	.	H	α-helix	trans	-62.4	-43.8	175	-70.4	160.3	0	0	0	111.1	L173 A174 A175 L179 Y180 D181 M202 L205 Y206 L209	L173-I177 WeakPolarHBondContact O-CD1 3.49Å; L173-I177 WeakPolarHBondContact O-CG1 3.47Å; L173-I177 PolarHBondContact O-N 3.32Å; A174-I177 PolarHBondContact O-N 3.37Å; A175-I177 VanDerWaalsContact C-N 3.34Å; A175-I177 PolarHBondContact O-N 3.39Å; I177-L179 VanDerWaalsContact C-N 3.31Å; I177-L179 PolarHBondContact O-N 3.48Å; I177-Y180 WeakPolarHBondContact O-CB 3.48Å; I177-Y180 PolarHBondContact O-N 3.02Å; I177-Y180 VanDerWaalsContact O-N 3.16Å; I177-D181 PolarHBondContact O-N 3.21Å; I177-M202 HydrophobicContact CG2-CE 4.38Å; I177-L205 HydrophobicContact CD1-CB 4.02Å; I177-L205 HydrophobicContact CG1-CB 3.84Å; I177-L205 HydrophobicContact CG1-CD1 4.11Å; I177-Y206 HydrophobicContact CD1-CD1 3.62Å; I177-Y206 HydrophobicContact CD1-CD2 4.4Å; I177-Y206 HydrophobicContact CD1-CE1 3.72Å; I177-Y206 HydrophobicContact CD1-CE2 4.48Å; I177-Y206 HydrophobicContact CD1-CG 3.99Å; I177-Y206 HydrophobicContact CG1-CE1 4.48Å; I177-Y206 HydrophobicContact CG2-CE1 3.95Å; I177-Y206 HydrophobicContact CG2-CE2 4Å; I177-Y206 VanDerWaalsContact CG2-CZ 3.47Å; I177-Y206 VanDerWaalsContact CG2-OH 3.26Å; I177-Y206 WeakPolarHBondContact CG2-OH 3.49Å; I177-L209 HydrophobicContact CD1-CD2 4.12Å
178	A	96.6	Very high	91.3	Very high	58 Å²	58	48 Å²	48	48%	0.479	26%	0.258	S	S	.	.	H	α-helix	trans	-62.4	-37.7	178.7	0	0	0	0	0	112.3	A174 A175 D181 K182	A174-A178 PolarHBondContact O-N 3.2Å; A175-A178 WeakPolarHBondContact O-CB 3.37Å; A175-A178 PolarHBondContact O-N 3.33Å; A178-D181 PolarHBondContact O-N 2.81Å; A178-K182 WeakPolarHBondContact O-CB 3.37Å; A178-K182 PolarHBondContact O-N 3.32Å
179	L	96.4	Very high	90.8	Very high	31 Å²	31	51.7 Å²	51.7	16%	0.162	28%	0.275	C	S	.	.	H	α-helix	trans	-63.3	-40.2	173.9	-71.2	169.7	0	0	0	112.1	L150 Q153 A175 G176 I177 K182 A183	L150-L179 HydrophobicContact CD2-CD2 3.78Å; Q153-L179 HydrophobicContact CB-CD1 3.92Å; A175-L179 WeakPolarHBondContact O-CG 3.34Å; A175-L179 PolarHBondContact O-N 3.41Å; G176-L179 PolarHBondContact O-N 3.43Å; I177-L179 VanDerWaalsContact C-N 3.31Å; I177-L179 PolarHBondContact O-N 3.48Å; L179-K182 PolarHBondContact O-N 3.23Å; L179-A183 WeakPolarHBondContact O-CB 3.47Å; L179-A183 PolarHBondContact O-N 2.99Å
180	Y	96.4	Very high	90.7	Very high	6 Å²	6	46.5 Å²	46.5	2%	0.024	26%	0.256	C	S	.	.	H	α-helix	trans	-65.5	-42.3	173	-83.4	-66.5	0	0	0	113.1	A151 Y155 G176 I177 K182 A183 L184 W198 T201 M202 L205	A151-Y180 HydrophobicContact CB-CD1 4.03Å; A151-Y180 HydrophobicContact CB-CE1 3.72Å; A151-Y180 WeakPolarHBondContact O-CE1 3.47Å; A151-Y180 VanDerWaalsContact O-CZ 3.24Å; A151-Y180 PolarHBondContact O-OH 2.64Å; A151-Y180 VanDerWaalsContact O-OH 3.08Å; Y155-Y180 WeakPolarHBondContact CB-OH 3.49Å; Y155-Y180 PolarHBondContact N-OH 3.05Å; G176-Y180 VanDerWaalsContact O-CD2 3.31Å; G176-Y180 WeakPolarHBondContact O-CD2 3.38Å; G176-Y180 PolarHBondContact O-N 3.21Å; I177-Y180 WeakPolarHBondContact O-CB 3.48Å; I177-Y180 PolarHBondContact O-N 3.02Å; I177-Y180 VanDerWaalsContact O-N 3.16Å; Y180-K182 VanDerWaalsContact C-N 3.27Å; Y180-K182 PolarHBondContact O-N 2.63Å; Y180-A183 WeakPolarHBondContact O-CB 3.35Å; Y180-A183 PolarHBondContact O-N 2.69Å; Y180-L184 VanDerWaalsContact O-CG 3.28Å; Y180-L184 WeakPolarHBondContact O-CG 3.42Å; Y180-L184 PolarHBondContact O-N 3.46Å; Y180-W198 HydrophobicContact CD1-CB 3.93Å; Y180-W198 HydrophobicContact CD1-CG 4.24Å; Y180-W198 HydrophobicContact CE1-CB 3.82Å; Y180-W198 HydrophobicContact CE1-CD2 4.46Å; Y180-W198 AromaticContact CE1-CG 3.92Å; Y180-W198 HydrophobicContact CE1-CG 3.92Å; Y180-T201 HydrophobicContact CE2-CG2 3.92Å; Y180-T201 WeakPolarHBondContact OH-CG2 3.49Å; Y180-M202 VanDerWaalsContact CB-SD 3.58Å; Y180-M202 HydrophobicContact CD1-CG 4.14Å; Y180-M202 HydrophobicContact CD2-CG 3.65Å; Y180-M202 HydrophobicContact CE2-CG 4.38Å; Y180-M202 HydrophobicContact CG-CG 3.51Å; Y180-M202 HydrophobicContact CG-SD 4.12Å; Y180-L205 HydrophobicContact CD2-CD1 4.17Å; Y180-L205 HydrophobicContact CE2-CD1 4Å
181	D	95.3	Very high	90.5	Very high	67 Å²	67	49.3 Å²	49.3	36%	0.358	27%	0.274	S	S	.	.	H	α-helix	trans	-61.4	-39.8	175.8	-79.1	-37.4	0	0	0	110.8	I177 A178 L184 G185 M202 R229	I177-D181 PolarHBondContact O-N 3.21Å; A178-D181 PolarHBondContact O-N 2.81Å; D181-L184 PolarHBondContact O-N 3.37Å; D181-G185 PolarHBondContact O-N 3.07Å; D181-G185 VanDerWaalsContact O-N 3.11Å; D181-M202 WeakPolarHBondContact OD1-CE 3.46Å; D181-R229 IonicContact OD1-NH2 3.51Å
182	K	94.1	Very high	90.4	Very high	89 Å²	89	45.1 Å²	45.1	39%	0.387	26%	0.263	S	S	.	.	H	α-helix	trans	-63.8	-45.8	173.1	-165.7	176.3	-177	165.9	0	111.9	D19 L150 A178 L179 Y180 L184 G185 Y186	D19-K182 WeakPolarHBondContact O-CE 3.49Å; D19-K182 PolarHBondContact O-NZ 2.85Å; L150-K182 HydrophobicContact CD1-CB 4.24Å; L150-K182 HydrophobicContact CD1-CD 4.07Å; L150-K182 HydrophobicContact CD1-CG 3.83Å; L150-K182 HydrophobicContact CD2-CD 4.13Å; A178-K182 WeakPolarHBondContact O-CB 3.37Å; A178-K182 PolarHBondContact O-N 3.32Å; L179-K182 PolarHBondContact O-N 3.23Å; Y180-K182 VanDerWaalsContact C-N 3.27Å; Y180-K182 PolarHBondContact O-N 2.63Å; K182-L184 VanDerWaalsContact C-N 3.29Å; K182-L184 PolarHBondContact O-N 3.22Å; K182-G185 WeakPolarHBondContact O-CA 3.33Å; K182-G185 PolarHBondContact O-N 2.97Å; K182-Y186 HydrophobicContact CG-CE2 4.18Å; K182-Y186 WeakPolarHBondContact O-CD2 3.32Å; K182-Y186 PolarHBondContact O-N 3.34Å
183	A	94.3	Very high	90.4	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-56.6	-42.1	175.6	0	0	0	0	0	112.3	A147 L150 A151 L179 Y180 G185 Y186 W198	A147-A183 WeakPolarHBondContact CB-O 3.32Å; A147-A183 VanDerWaalsContact O-CB 3.27Å; A147-A183 WeakPolarHBondContact O-CB 3.48Å; L150-A183 HydrophobicContact CB-CB 3.77Å; A151-A183 HydrophobicContact CB-CB 4.15Å; L179-A183 WeakPolarHBondContact O-CB 3.47Å; L179-A183 PolarHBondContact O-N 2.99Å; Y180-A183 WeakPolarHBondContact O-CB 3.35Å; Y180-A183 PolarHBondContact O-N 2.69Å; A183-G185 VanDerWaalsContact C-N 3.27Å; A183-G185 PolarHBondContact O-N 3.37Å; A183-Y186 PolarHBondContact O-N 3.43Å; A183-W198 HydrophobicContact CB-CE3 4.4Å; A183-W198 HydrophobicContact CB-CZ3 3.87Å
184	L	93	Very high	90.2	Very high	32 Å²	32	48.1 Å²	48.1	17%	0.168	27%	0.274	C	S	.	.	H	α-helix	trans	-67.8	-27.4	176.2	-68.7	167.9	0	0	0	112.4	Y180 D181 K182 G187 K195 W198 Y199 M202	Y180-L184 VanDerWaalsContact O-CG 3.28Å; Y180-L184 WeakPolarHBondContact O-CG 3.42Å; Y180-L184 PolarHBondContact O-N 3.46Å; D181-L184 PolarHBondContact O-N 3.37Å; K182-L184 VanDerWaalsContact C-N 3.29Å; K182-L184 PolarHBondContact O-N 3.22Å; L184-G187 WeakPolarHBondContact O-CA 3.49Å; L184-G187 PolarHBondContact O-N 3.47Å; L184-K195 HydrophobicContact CD2-CD 4.37Å; L184-K195 HydrophobicContact CD2-CG 4.3Å; L184-W198 HydrophobicContact CD2-CE3 3.94Å; L184-W198 HydrophobicContact CD2-CZ3 4.38Å; L184-W198 HydrophobicContact CG-CE3 4.42Å; L184-Y199 HydrophobicContact CD1-CD1 4.31Å; L184-Y199 HydrophobicContact CD1-CE1 3.7Å; L184-Y199 HydrophobicContact CD2-CE1 3.72Å; L184-Y199 HydrophobicContact CG-CE1 4.38Å; L184-M202 HydrophobicContact CD1-CE 4.42Å; L184-M202 HydrophobicContact CD1-SD 3.92Å
185	G	89.3	Confident	90.1	Very high	66 Å²	66	47.8 Å²	47.8	68%	0.68	26%	0.264	S	S	*	.	H	α-helix	trans	-63	-38.6	173.2	0	0	0	0	0	113.6	D181 K182 A183 G187	D181-G185 PolarHBondContact O-N 3.07Å; D181-G185 VanDerWaalsContact O-N 3.11Å; K182-G185 WeakPolarHBondContact O-CA 3.33Å; K182-G185 PolarHBondContact O-N 2.97Å; A183-G185 VanDerWaalsContact C-N 3.27Å; A183-G185 PolarHBondContact O-N 3.37Å; G185-G187 PolarHBondContact O-N 3.32Å
186	Y	83.7	Confident	90.1	Very high	45 Å²	45	48.1 Å²	48.1	18%	0.176	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-7.2	170.5	-73.2	-83.3	0	0	0	113.1	D19 A146 L150 K182 A183 Q188	D19-Y186 WeakPolarHBondContact CB-OH 3.48Å; D19-Y186 VanDerWaalsContact CG-OH 3.3Å; D19-Y186 PolarHBondContact OD2-OH 3.42Å; A146-Y186 HydrophobicContact CB-CD1 4.11Å; A146-Y186 HydrophobicContact CB-CE1 4.3Å; A146-Y186 HydrophobicContact CB-CG 4.33Å; L150-Y186 HydrophobicContact CD1-CD2 3.71Å; L150-Y186 HydrophobicContact CD1-CE2 3.6Å; K182-Y186 HydrophobicContact CG-CE2 4.18Å; K182-Y186 WeakPolarHBondContact O-CD2 3.32Å; K182-Y186 PolarHBondContact O-N 3.34Å; A183-Y186 PolarHBondContact O-N 3.43Å; Y186-Q188 PolarHBondContact O-N 3.31Å
187	G	62.9	Low	90	Very high	3 Å²	3	48.7 Å²	48.7	3%	0.031	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	31.1	-146.5	0	0	0	0	0	118.9	L184 G185 Q189 K195	L184-G187 WeakPolarHBondContact O-CA 3.49Å; L184-G187 PolarHBondContact O-N 3.47Å; G185-G187 PolarHBondContact O-N 3.32Å; G187-Q189 VanDerWaalsContact C-N 3.26Å; G187-Q189 PolarHBondContact O-N 3.46Å; G187-K195 WeakPolarHBondContact O-CE 3.18Å; G187-K195 PolarHBondContact O-NZ 2.96Å
188	Q	69	Low	89.9	Confident	187 Å²	187	49.3 Å²	49.3	87%	0.874	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-30	178.9	-69.9	-168.3	11.3	0	0	113	Y186	Y186-Q188 PolarHBondContact O-N 3.31Å
189	Q	79.6	Confident	90	Very high	115 Å²	115	48.3 Å²	48.3	54%	0.537	25%	0.251	S	S	.	.	S	Bend	trans	-99.8	-3.7	-174.4	-56.4	-170.7	29.3	0	0	114.8	D141 G187	D141-Q189 PolarHBondContact OD2-NE2 3.45Å; D141-Q189 PolarHBondContact OD2-OE1 3.04Å; G187-Q189 VanDerWaalsContact C-N 3.26Å; G187-Q189 PolarHBondContact O-N 3.46Å
190	I	88.8	Confident	90	Very high	9 Å²	9	47.8 Å²	47.8	5%	0.046	25%	0.247	C	C	.	.	S	Bend	trans	-70.5	129.5	-178.1	-50.4	151.7	0	0	0	109.5	L144 A147 M192 E194 K195 W198	L144-I190 HydrophobicContact CD1-CB 4.18Å; L144-I190 HydrophobicContact CD1-CG1 3.69Å; L144-I190 HydrophobicContact CD1-CG2 4.47Å; A147-I190 HydrophobicContact CB-CD1 3.93Å; A147-I190 HydrophobicContact CB-CG1 4.16Å; I190-M192 PolarHBondContact O-N 3.47Å; I190-E194 HydrophobicContact CG2-CB 3.97Å; I190-E194 HydrophobicContact CG2-CG 4Å; I190-K195 HydrophobicContact CB-CD 4.49Å; I190-K195 HydrophobicContact CB-CG 3.99Å; I190-K195 HydrophobicContact CD1-CG 4.47Å; I190-K195 HydrophobicContact CG2-CG 3.78Å; I190-K195 WeakPolarHBondContact O-CE 3.44Å; I190-W198 HydrophobicContact CD1-CE3 4.28Å; I190-W198 HydrophobicContact CD1-CH2 3.42Å; I190-W198 VanDerWaalsContact CD1-CH2 3.42Å; I190-W198 HydrophobicContact CD1-CZ3 3.27Å; I190-W198 HydrophobicContact CG1-CH2 3.91Å; I190-W198 HydrophobicContact CG1-CZ3 4.25Å; I190-W198 HydrophobicContact CG2-CH2 3.99Å; I190-W198 HydrophobicContact CG2-CZ2 4.15Å; I190-W198 HydrophobicContact CG2-CZ3 4.43Å
191	P	91.1	Very high	90	Very high	67 Å²	67	48 Å²	48	44%	0.435	25%	0.249	S	C	.	.			trans	-52.6	137	173.5	-25.8	34.4	0	0	0	111.7	E193 E194 K195	P191-E193 PolarHBondContact O-N 3.41Å; P191-E194 HydrophobicContact CB-CB 4.26Å; P191-E194 WeakPolarHBondContact O-CB 3.06Å; P191-E194 PolarHBondContact O-N 3.38Å; P191-E194 VanDerWaalsContact O-N 3.07Å; P191-K195 PolarHBondContact O-N 3.29Å
192	M	92.1	Very high	90.1	Very high	78 Å²	78	44.8 Å²	44.8	38%	0.384	23%	0.232	S	C	.	.	H	α-helix	trans	-60.2	-33.8	-176.5	-173	62.2	-166.7	0	0	112.4	I190 K195 R196 Y199	I190-M192 PolarHBondContact O-N 3.47Å; M192-K195 WeakPolarHBondContact O-CB 3.49Å; M192-K195 PolarHBondContact O-N 3.22Å; M192-K195 HydrophobicContact SD-CB 4.44Å; M192-K195 HydrophobicContact SD-CD 4.27Å; M192-R196 HydrophobicContact CE-CG 4.33Å; M192-R196 WeakPolarHBondContact O-CG 3.49Å; M192-R196 PolarHBondContact O-N 2.89Å; M192-Y199 HydrophobicContact CE-CE2 3.96Å
193	E	93.1	Very high	90.3	Very high	56 Å²	56	40.5 Å²	40.5	26%	0.262	21%	0.214	S	C	.	.	H	α-helix	trans	-66.9	-38.7	177.5	-171	54.8	-149	0	0	112.3	P191 R196 G197 S240 E241	P191-E193 PolarHBondContact O-N 3.41Å; E193-R196 WeakPolarHBondContact O-CB 3.26Å; E193-R196 PolarHBondContact O-N 3.19Å; E193-R196 WeakPolarHBondContact OE2-CD 3.37Å; E193-R196 IonicContact OE2-CZ 2.83Å; E193-R196 IonicContact OE2-NH1 3.58Å; E193-R196 PolarHBondContact OE2-NH1 2.76Å; E193-G197 PolarHBondContact O-N 2.93Å; E193-G197 VanDerWaalsContact O-N 3.16Å; E193-S240 WeakPolarHBondContact OE1-CB 3.49Å; E193-S240 PolarHBondContact OE1-OG 3.27Å; E193-S240 WeakPolarHBondContact OE2-CA 3.41Å; E193-E241 PolarHBondContact OE1-N 3.25Å; E193-E241 PolarHBondContact OE2-N 3.47Å
194	E	93.3	Very high	90.4	Very high	17 Å²	17	41.9 Å²	41.9	8%	0.079	22%	0.222	C	C	.	.	H	α-helix	trans	-64.7	-43.1	173.2	-173.5	176.1	164	0	0	110.9	P63 R148 I190 P191 R196 G197 W198	P63-E194 HydrophobicContact CB-CG 4.19Å; R148-E194 WeakPolarHBondContact CG-OE1 3.36Å; R148-E194 IonicContact CZ-OE1 3.93Å; R148-E194 IonicContact CZ-OE2 3.28Å; R148-E194 IonicContact NE-OE1 3.55Å; R148-E194 PolarHBondContact NE-OE1 3.32Å; R148-E194 IonicContact NE-OE2 2.88Å; R148-E194 PolarHBondContact NE-OE2 3.18Å; R148-E194 IonicContact NH2-OE1 3.64Å; R148-E194 IonicContact NH2-OE2 3.76Å; R148-E194 PolarHBondContact NH2-OE2 3.09Å; I190-E194 HydrophobicContact CG2-CB 3.97Å; I190-E194 HydrophobicContact CG2-CG 4Å; P191-E194 HydrophobicContact CB-CB 4.26Å; P191-E194 WeakPolarHBondContact O-CB 3.06Å; P191-E194 PolarHBondContact O-N 3.38Å; P191-E194 VanDerWaalsContact O-N 3.07Å; E194-R196 VanDerWaalsContact C-N 3.26Å; E194-R196 PolarHBondContact O-N 3.38Å; E194-G197 WeakPolarHBondContact O-CA 3.43Å; E194-G197 PolarHBondContact O-N 3.07Å; E194-W198 HydrophobicContact CG-CZ2 4.14Å; E194-W198 PolarHBondContact O-N 2.82Å; E194-W198 VanDerWaalsContact O-N 3.09Å; E194-W198 WeakPolarHBondContact OE1-CZ2 3.43Å
195	K	94	Very high	90.6	Very high	38 Å²	38	40.5 Å²	40.5	17%	0.165	22%	0.215	C	C	.	.	H	α-helix	trans	-57.7	-37.1	172.5	-67.3	-173.1	-177.6	-177.9	0	112.4	L184 G187 I190 P191 M192 G197 W198 Y199	L184-K195 HydrophobicContact CD2-CD 4.37Å; L184-K195 HydrophobicContact CD2-CG 4.3Å; G187-K195 WeakPolarHBondContact O-CE 3.18Å; G187-K195 PolarHBondContact O-NZ 2.96Å; I190-K195 HydrophobicContact CB-CD 4.49Å; I190-K195 HydrophobicContact CB-CG 3.99Å; I190-K195 HydrophobicContact CD1-CG 4.47Å; I190-K195 HydrophobicContact CG2-CG 3.78Å; I190-K195 WeakPolarHBondContact O-CE 3.44Å; P191-K195 PolarHBondContact O-N 3.29Å; M192-K195 WeakPolarHBondContact O-CB 3.49Å; M192-K195 PolarHBondContact O-N 3.22Å; M192-K195 HydrophobicContact SD-CB 4.44Å; M192-K195 HydrophobicContact SD-CD 4.27Å; K195-G197 VanDerWaalsContact C-N 3.34Å; K195-W198 WeakPolarHBondContact O-CB 3.38Å; K195-W198 PolarHBondContact O-N 2.82Å; K195-Y199 HydrophobicContact CB-CE2 4.09Å; K195-Y199 WeakPolarHBondContact O-CD1 3.43Å; K195-Y199 WeakPolarHBondContact O-CD2 3.31Å; K195-Y199 PolarHBondContact O-N 3.31Å
196	R	95.4	Very high	90.9	Very high	38 Å²	38	38.8 Å²	38.8	14%	0.143	19%	0.188	C	C	.	.	H	α-helix	trans	-66.1	-36.8	176.3	-70.5	172.4	-172.5	147.7	-5.6	111.8	M192 E193 E194 W198 Y199 F200 Q236 K239	M192-R196 HydrophobicContact CE-CG 4.33Å; M192-R196 WeakPolarHBondContact O-CG 3.49Å; M192-R196 PolarHBondContact O-N 2.89Å; E193-R196 WeakPolarHBondContact O-CB 3.26Å; E193-R196 PolarHBondContact O-N 3.19Å; E193-R196 WeakPolarHBondContact OE2-CD 3.37Å; E193-R196 IonicContact OE2-CZ 2.83Å; E193-R196 IonicContact OE2-NH1 3.58Å; E193-R196 PolarHBondContact OE2-NH1 2.76Å; E194-R196 VanDerWaalsContact C-N 3.26Å; E194-R196 PolarHBondContact O-N 3.38Å; R196-W198 VanDerWaalsContact C-N 3.3Å; R196-W198 PolarHBondContact O-N 3.11Å; R196-Y199 PolarHBondContact O-N 2.93Å; R196-F200 WeakPolarHBondContact O-CB 3.41Å; R196-F200 PolarHBondContact O-N 2.93Å; R196-Q236 PolarHBondContact NE-O 3.41Å; R196-K239 PolarHBondContact NH1-O 3.36Å; R196-K239 PolarHBondContact NH2-O 2.94Å
197	G	94.6	Very high	91.5	Very high	13 Å²	13	37.3 Å²	37.3	13%	0.134	18%	0.183	C	C	.	.	H	α-helix	trans	-60.2	-40	170.3	0	0	0	0	0	112.4	E193 E194 K195 F200 T201	E193-G197 PolarHBondContact O-N 2.93Å; E193-G197 VanDerWaalsContact O-N 3.16Å; E194-G197 WeakPolarHBondContact O-CA 3.43Å; E194-G197 PolarHBondContact O-N 3.07Å; K195-G197 VanDerWaalsContact C-N 3.34Å; G197-F200 PolarHBondContact O-N 3.31Å; G197-T201 PolarHBondContact O-N 3.01Å; G197-T201 VanDerWaalsContact O-N 3.09Å; G197-T201 PolarHBondContact O-OG1 2.67Å; G197-T201 VanDerWaalsContact O-OG1 3.11Å
198	W	95.9	Very high	93.1	Very high	21 Å²	21	42.2 Å²	42.2	8%	0.08	20%	0.201	C	C	.	.	H	α-helix	trans	-68.3	-45	175.1	-58.1	-3	0	0	0	111.6	A147 R148 A151 Y180 A183 L184 I190 E194 K195 R196 F200 T201 M202	A147-W198 HydrophobicContact CB-CH2 3.92Å; A147-W198 HydrophobicContact CB-CZ3 4.38Å; R148-W198 HydrophobicContact CG-CZ2 4.07Å; A151-W198 HydrophobicContact CB-CD2 3.78Å; A151-W198 HydrophobicContact CB-CE3 4.06Å; A151-W198 HydrophobicContact CB-CG 4.37Å; A151-W198 HydrophobicContact CB-CH2 3.92Å; A151-W198 HydrophobicContact CB-CZ2 3.65Å; A151-W198 HydrophobicContact CB-CZ3 4.08Å; Y180-W198 HydrophobicContact CD1-CB 3.93Å; Y180-W198 HydrophobicContact CD1-CG 4.24Å; Y180-W198 HydrophobicContact CE1-CB 3.82Å; Y180-W198 HydrophobicContact CE1-CD2 4.46Å; Y180-W198 AromaticContact CE1-CG 3.92Å; Y180-W198 HydrophobicContact CE1-CG 3.92Å; A183-W198 HydrophobicContact CB-CE3 4.4Å; A183-W198 HydrophobicContact CB-CZ3 3.87Å; L184-W198 HydrophobicContact CD2-CE3 3.94Å; L184-W198 HydrophobicContact CD2-CZ3 4.38Å; L184-W198 HydrophobicContact CG-CE3 4.42Å; I190-W198 HydrophobicContact CD1-CE3 4.28Å; I190-W198 HydrophobicContact CD1-CH2 3.42Å; I190-W198 VanDerWaalsContact CD1-CH2 3.42Å; I190-W198 HydrophobicContact CD1-CZ3 3.27Å; I190-W198 HydrophobicContact CG1-CH2 3.91Å; I190-W198 HydrophobicContact CG1-CZ3 4.25Å; I190-W198 HydrophobicContact CG2-CH2 3.99Å; I190-W198 HydrophobicContact CG2-CZ2 4.15Å; I190-W198 HydrophobicContact CG2-CZ3 4.43Å; E194-W198 HydrophobicContact CG-CZ2 4.14Å; E194-W198 PolarHBondContact O-N 2.82Å; E194-W198 VanDerWaalsContact O-N 3.09Å; E194-W198 WeakPolarHBondContact OE1-CZ2 3.43Å; K195-W198 WeakPolarHBondContact O-CB 3.38Å; K195-W198 PolarHBondContact O-N 2.82Å; R196-W198 VanDerWaalsContact C-N 3.3Å; R196-W198 PolarHBondContact O-N 3.11Å; W198-F200 VanDerWaalsContact C-N 3.26Å; W198-F200 PolarHBondContact O-N 2.73Å; W198-T201 PolarHBondContact O-N 2.71Å; W198-T201 VanDerWaalsContact O-N 3.11Å; W198-M202 WeakPolarHBondContact O-CG 3.21Å; W198-M202 PolarHBondContact O-N 2.82Å
199	Y	97.3	Very high	94.3	Very high	37 Å²	37	33.9 Å²	33.9	15%	0.145	16%	0.162	C	C	.	.	H	α-helix	trans	-59	-37.9	175.4	-62	-24.3	0	0	0	112.3	L184 M192 K195 R196 M202 A203 L233 Q236	L184-Y199 HydrophobicContact CD1-CD1 4.31Å; L184-Y199 HydrophobicContact CD1-CE1 3.7Å; L184-Y199 HydrophobicContact CD2-CE1 3.72Å; L184-Y199 HydrophobicContact CG-CE1 4.38Å; M192-Y199 HydrophobicContact CE-CE2 3.96Å; K195-Y199 HydrophobicContact CB-CE2 4.09Å; K195-Y199 WeakPolarHBondContact O-CD1 3.43Å; K195-Y199 WeakPolarHBondContact O-CD2 3.31Å; K195-Y199 PolarHBondContact O-N 3.31Å; R196-Y199 PolarHBondContact O-N 2.93Å; Y199-M202 HydrophobicContact CD1-SD 4.34Å; Y199-A203 VanDerWaalsContact O-CB 3.27Å; Y199-A203 WeakPolarHBondContact O-CB 3.43Å; Y199-A203 PolarHBondContact O-N 3.4Å; Y199-L233 HydrophobicContact CD1-CD2 3.43Å; Y199-L233 VanDerWaalsContact CD1-CD2 3.43Å; Y199-L233 HydrophobicContact CE1-CD2 4.13Å; Y199-L233 HydrophobicContact CG-CD2 3.71Å; Y199-Q236 HydrophobicContact CD2-CB 3.77Å; Y199-Q236 HydrophobicContact CD2-CG 4.42Å; Y199-Q236 HydrophobicContact CE2-CB 4.08Å; Y199-Q236 HydrophobicContact CE2-CG 4.37Å
200	F	96.6	Very high	94.9	Very high	19 Å²	19	28.6 Å²	28.6	8%	0.083	14%	0.137	C	C	.	.	H	α-helix	trans	-61.9	-49.5	174.1	177.8	-105.2	0	0	0	110.8	R196 G197 W198 A203 T204 V237 H245 L248 Y252	R196-F200 WeakPolarHBondContact O-CB 3.41Å; R196-F200 PolarHBondContact O-N 2.93Å; G197-F200 PolarHBondContact O-N 3.31Å; W198-F200 VanDerWaalsContact C-N 3.26Å; W198-F200 PolarHBondContact O-N 2.73Å; F200-A203 PolarHBondContact O-N 3.47Å; F200-T204 HydrophobicContact CE1-CG2 4.4Å; F200-T204 HydrophobicContact CZ-CG2 4.29Å; F200-T204 WeakPolarHBondContact O-CG2 3.46Å; F200-T204 PolarHBondContact O-N 2.72Å; F200-V237 HydrophobicContact CB-CG1 3.97Å; F200-V237 HydrophobicContact CB-CG2 3.89Å; F200-V237 HydrophobicContact CD2-CG1 3.96Å; F200-V237 HydrophobicContact CG-CG1 4.36Å; F200-H245 AromaticContact CD1-CD2 3.62Å; F200-H245 AromaticContact CD1-NE2 3.97Å; F200-H245 AromaticContact CG-CD2 3.76Å; F200-L248 HydrophobicContact CE1-CD1 4.47Å; F200-L248 HydrophobicContact CE2-CB 3.62Å; F200-L248 HydrophobicContact CE2-CD1 4.44Å; F200-L248 HydrophobicContact CZ-CB 3.71Å; F200-L248 HydrophobicContact CZ-CD1 3.69Å; F200-L248 HydrophobicContact CZ-CG 4.37Å; F200-Y252 AromaticContact CE2-CD2 3.98Å; F200-Y252 HydrophobicContact CE2-CD2 3.98Å; F200-Y252 AromaticContact CE2-CE2 3.77Å; F200-Y252 HydrophobicContact CE2-CE2 3.77Å; F200-Y252 AromaticContact CZ-CE2 3.87Å; F200-Y252 HydrophobicContact CZ-CE2 3.87Å
201	T	96	Very high	95.1	Very high	10 Å²	10	28.9 Å²	28.9	6%	0.061	14%	0.143	C	C	.	.	H	α-helix	trans	-60.8	-50.4	177.4	-53.8	0	0	0	0	111.3	Y155 Y180 G197 W198 A203 T204 L205	Y155-T201 HydrophobicContact CD2-CG2 3.8Å; Y155-T201 HydrophobicContact CE2-CG2 4.45Å; Y180-T201 HydrophobicContact CE2-CG2 3.92Å; Y180-T201 WeakPolarHBondContact OH-CG2 3.49Å; G197-T201 PolarHBondContact O-N 3.01Å; G197-T201 VanDerWaalsContact O-N 3.09Å; G197-T201 PolarHBondContact O-OG1 2.67Å; G197-T201 VanDerWaalsContact O-OG1 3.11Å; W198-T201 PolarHBondContact O-N 2.71Å; W198-T201 VanDerWaalsContact O-N 3.11Å; T201-A203 VanDerWaalsContact C-N 3.28Å; T201-A203 PolarHBondContact O-N 2.7Å; T201-T204 PolarHBondContact O-N 3.48Å; T201-T204 PolarHBondContact O-OG1 3.26Å; T201-L205 WeakPolarHBondContact O-CG 3.01Å; T201-L205 PolarHBondContact O-N 2.53Å
202	M	97.9	Very high	95.2	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-54.2	-44.1	175.9	-69.8	177.9	84.2	0	0	112.1	I177 Y180 D181 L184 W198 Y199 T204 L205 Y206 L233	I177-M202 HydrophobicContact CG2-CE 4.38Å; Y180-M202 VanDerWaalsContact CB-SD 3.58Å; Y180-M202 HydrophobicContact CD1-CG 4.14Å; Y180-M202 HydrophobicContact CD2-CG 3.65Å; Y180-M202 HydrophobicContact CE2-CG 4.38Å; Y180-M202 HydrophobicContact CG-CG 3.51Å; Y180-M202 HydrophobicContact CG-SD 4.12Å; D181-M202 WeakPolarHBondContact OD1-CE 3.46Å; L184-M202 HydrophobicContact CD1-CE 4.42Å; L184-M202 HydrophobicContact CD1-SD 3.92Å; W198-M202 WeakPolarHBondContact O-CG 3.21Å; W198-M202 PolarHBondContact O-N 2.82Å; Y199-M202 HydrophobicContact CD1-SD 4.34Å; M202-T204 VanDerWaalsContact C-N 3.31Å; M202-T204 PolarHBondContact O-N 3.33Å; M202-L205 PolarHBondContact O-N 3.03Å; M202-Y206 VanDerWaalsContact O-CD2 3.27Å; M202-Y206 WeakPolarHBondContact O-CD2 3.32Å; M202-Y206 PolarHBondContact O-N 3.09Å; M202-L233 HydrophobicContact CB-CD1 3.81Å; M202-L233 HydrophobicContact SD-CD2 4.44Å
203	A	97.9	Very high	95.2	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-60.3	-41.8	177	0	0	0	0	0	111.5	Y199 F200 T201 L205 Y206 I207 T230 L233 L234	Y199-A203 VanDerWaalsContact O-CB 3.27Å; Y199-A203 WeakPolarHBondContact O-CB 3.43Å; Y199-A203 PolarHBondContact O-N 3.4Å; F200-A203 PolarHBondContact O-N 3.47Å; T201-A203 VanDerWaalsContact C-N 3.28Å; T201-A203 PolarHBondContact O-N 2.7Å; A203-L205 PolarHBondContact O-N 3.24Å; A203-Y206 PolarHBondContact O-N 3.1Å; A203-I207 WeakPolarHBondContact O-CB 3.35Å; A203-I207 WeakPolarHBondContact O-CD1 3.42Å; A203-I207 VanDerWaalsContact O-CG1 3.23Å; A203-I207 WeakPolarHBondContact O-CG1 3.4Å; A203-I207 PolarHBondContact O-N 2.96Å; A203-T230 HydrophobicContact CB-CG2 3.98Å; A203-L233 HydrophobicContact CB-CB 4.3Å; A203-L234 HydrophobicContact CB-CD2 3.72Å; A203-L234 HydrophobicContact CB-CG 4.01Å
204	T	96.1	Very high	95.1	Very high	29 Å²	29	25.4 Å²	25.4	18%	0.178	12%	0.121	C	C	.	.	H	α-helix	trans	-65.8	-35.3	175.1	66.3	0	0	0	0	113.1	F200 T201 M202 I207 R208 Y252	F200-T204 HydrophobicContact CE1-CG2 4.4Å; F200-T204 HydrophobicContact CZ-CG2 4.29Å; F200-T204 WeakPolarHBondContact O-CG2 3.46Å; F200-T204 PolarHBondContact O-N 2.72Å; T201-T204 PolarHBondContact O-N 3.48Å; T201-T204 PolarHBondContact O-OG1 3.26Å; M202-T204 VanDerWaalsContact C-N 3.31Å; M202-T204 PolarHBondContact O-N 3.33Å; T204-I207 PolarHBondContact O-N 3.39Å; T204-R208 VanDerWaalsContact O-CG 3.3Å; T204-R208 WeakPolarHBondContact O-CG 3.3Å; T204-R208 PolarHBondContact O-N 3.19Å; T204-R208 VanDerWaalsContact O-N 3.1Å; T204-Y252 HydrophobicContact CG2-CD2 4.32Å; T204-Y252 HydrophobicContact CG2-CE2 3.65Å
205	L	97.1	Very high	94.9	Very high	3 Å²	3	31.4 Å²	31.4	2%	0.016	15%	0.149	C	C	.	.	H	α-helix	trans	-65.4	-46.1	173.9	-62.7	178.3	0	0	0	111.1	L173 I177 Y180 T201 M202 A203 I207 R208 L209	L173-L205 HydrophobicContact CD2-CD2 3.67Å; I177-L205 HydrophobicContact CD1-CB 4.02Å; I177-L205 HydrophobicContact CG1-CB 3.84Å; I177-L205 HydrophobicContact CG1-CD1 4.11Å; Y180-L205 HydrophobicContact CD2-CD1 4.17Å; Y180-L205 HydrophobicContact CE2-CD1 4Å; T201-L205 WeakPolarHBondContact O-CG 3.01Å; T201-L205 PolarHBondContact O-N 2.53Å; M202-L205 PolarHBondContact O-N 3.03Å; A203-L205 PolarHBondContact O-N 3.24Å; L205-I207 PolarHBondContact O-N 2.88Å; L205-R208 PolarHBondContact O-N 3.45Å; L205-L209 WeakPolarHBondContact O-CB 3.41Å; L205-L209 PolarHBondContact O-N 3.33Å
206	Y	97.5	Very high	94.7	Very high	29 Å²	29	32.7 Å²	32.7	11%	0.114	16%	0.157	C	C	.	.	H	α-helix	trans	-62	-40.6	175.7	-80.3	-61.7	0	0	0	112.8	I177 M202 A203 R208 L209 D210 A226 R229 T230 L233	I177-Y206 HydrophobicContact CD1-CD1 3.62Å; I177-Y206 HydrophobicContact CD1-CD2 4.4Å; I177-Y206 HydrophobicContact CD1-CE1 3.72Å; I177-Y206 HydrophobicContact CD1-CE2 4.48Å; I177-Y206 HydrophobicContact CD1-CG 3.99Å; I177-Y206 HydrophobicContact CG1-CE1 4.48Å; I177-Y206 HydrophobicContact CG2-CE1 3.95Å; I177-Y206 HydrophobicContact CG2-CE2 4Å; I177-Y206 VanDerWaalsContact CG2-CZ 3.47Å; I177-Y206 VanDerWaalsContact CG2-OH 3.26Å; I177-Y206 WeakPolarHBondContact CG2-OH 3.49Å; M202-Y206 VanDerWaalsContact O-CD2 3.27Å; M202-Y206 WeakPolarHBondContact O-CD2 3.32Å; M202-Y206 PolarHBondContact O-N 3.09Å; A203-Y206 PolarHBondContact O-N 3.1Å; Y206-R208 VanDerWaalsContact C-N 3.33Å; Y206-R208 PolarHBondContact O-N 3.45Å; Y206-L209 PolarHBondContact O-N 2.87Å; Y206-D210 WeakPolarHBondContact O-CB 3.47Å; Y206-D210 PolarHBondContact O-N 3.34Å; Y206-A226 HydrophobicContact CD1-CB 3.64Å; Y206-A226 HydrophobicContact CE1-CB 3.95Å; Y206-R229 HydrophobicContact CD2-CG 4.5Å; Y206-R229 HydrophobicContact CE2-CB 4.42Å; Y206-R229 HydrophobicContact CE2-CG 3.69Å; Y206-T230 WeakPolarHBondContact CB-OG1 3.44Å; Y206-L233 HydrophobicContact CD2-CD1 3.91Å; Y206-L233 HydrophobicContact CE2-CD1 3.84Å
207	I	95.8	Very high	94.3	Very high	14 Å²	14	34 Å²	34	7%	0.072	18%	0.182	C	C	.	.	H	α-helix	trans	-60.3	-43.5	176.6	-77	161.5	0	0	0	111.4	A203 T204 L205 G211 T230 Y252 M255 L256	A203-I207 WeakPolarHBondContact O-CB 3.35Å; A203-I207 WeakPolarHBondContact O-CD1 3.42Å; A203-I207 VanDerWaalsContact O-CG1 3.23Å; A203-I207 WeakPolarHBondContact O-CG1 3.4Å; A203-I207 PolarHBondContact O-N 2.96Å; T204-I207 PolarHBondContact O-N 3.39Å; L205-I207 PolarHBondContact O-N 2.88Å; I207-G211 PolarHBondContact O-N 3.01Å; I207-G211 VanDerWaalsContact O-N 3.11Å; I207-T230 HydrophobicContact CD1-CG2 4.17Å; I207-T230 HydrophobicContact CG1-CG2 3.94Å; I207-Y252 HydrophobicContact CD1-CD1 4.01Å; I207-Y252 HydrophobicContact CD1-CD2 4.44Å; I207-Y252 HydrophobicContact CD1-CG 3.84Å; I207-M255 HydrophobicContact CB-CE 4.24Å; I207-M255 HydrophobicContact CD1-CE 3.85Å; I207-M255 HydrophobicContact CG1-CE 3.84Å; I207-M255 HydrophobicContact CG2-CE 3.38Å; I207-M255 HydrophobicContact CG2-SD 4.31Å; I207-L256 HydrophobicContact CG1-CD2 4.24Å
208	R	95.1	Very high	94	Very high	107 Å²	107	35 Å²	35	40%	0.404	19%	0.187	S	C	.	.	H	α-helix	trans	-67.1	-42.6	177.2	-72.4	170.1	63.7	-178.3	-1.8	111.2	G158 L173 T204 L205 Y206 G211 I212	G158-R208 PolarHBondContact O-NH1 2.67Å; G158-R208 PolarHBondContact O-NH2 3.11Å; L173-R208 HydrophobicContact CD1-CB 3.81Å; T204-R208 VanDerWaalsContact O-CG 3.3Å; T204-R208 WeakPolarHBondContact O-CG 3.3Å; T204-R208 PolarHBondContact O-N 3.19Å; T204-R208 VanDerWaalsContact O-N 3.1Å; L205-R208 PolarHBondContact O-N 3.45Å; Y206-R208 VanDerWaalsContact C-N 3.33Å; Y206-R208 PolarHBondContact O-N 3.45Å; R208-G211 PolarHBondContact O-N 2.8Å; R208-I212 WeakPolarHBondContact O-CG1 3.27Å; R208-I212 PolarHBondContact O-N 2.7Å; R208-I212 VanDerWaalsContact O-N 3.09Å
209	L	94.9	Very high	93.6	Very high	11 Å²	11	39.8 Å²	39.8	6%	0.058	21%	0.21	C	C	.	.	H	α-helix	trans	-61.6	-43.6	176.4	-177	63	0	0	0	111.8	A170 L173 I177 L205 Y206 G211 I212 F213	A170-L209 HydrophobicContact CB-CD1 3.58Å; A170-L209 WeakPolarHBondContact O-CD1 3.37Å; L173-L209 HydrophobicContact CB-CD1 4.48Å; L173-L209 HydrophobicContact CD1-CB 4.3Å; I177-L209 HydrophobicContact CD1-CD2 4.12Å; L205-L209 WeakPolarHBondContact O-CB 3.41Å; L205-L209 PolarHBondContact O-N 3.33Å; Y206-L209 PolarHBondContact O-N 2.87Å; L209-G211 VanDerWaalsContact C-N 3.32Å; L209-G211 PolarHBondContact O-N 3.35Å; L209-I212 PolarHBondContact O-N 3.49Å; L209-F213 HydrophobicContact CD1-CD2 4.46Å; L209-F213 HydrophobicContact CD1-CE1 4.09Å; L209-F213 HydrophobicContact CD1-CE2 3.85Å; L209-F213 HydrophobicContact CD1-CZ 3.63Å; L209-F213 HydrophobicContact CD2-CE2 3.96Å; L209-F213 HydrophobicContact CD2-CZ 4.31Å; L209-F213 HydrophobicContact CG-CD2 4.08Å; L209-F213 HydrophobicContact CG-CE2 3.58Å; L209-F213 HydrophobicContact CG-CZ 3.92Å; L209-F213 WeakPolarHBondContact O-CG 3.36Å; L209-F213 PolarHBondContact O-N 2.76Å
210	D	93.4	Very high	93.2	Very high	5 Å²	5	40.5 Å²	40.5	3%	0.027	22%	0.215	C	C	.	.	H	α-helix	trans	-60.2	-40.5	174.7	178.9	66.5	0	0	0	112.2	Y206 F213 L214 R223 R259	Y206-D210 WeakPolarHBondContact O-CB 3.47Å; Y206-D210 PolarHBondContact O-N 3.34Å; D210-F213 PolarHBondContact O-N 3.46Å; D210-L214 PolarHBondContact O-N 2.91Å; D210-R223 IonicContact OD1-CZ 3.75Å; D210-R223 IonicContact OD1-NE 3.83Å; D210-R223 PolarHBondContact OD1-NE 2.92Å; D210-R223 IonicContact OD1-NH2 2.69Å; D210-R223 PolarHBondContact OD1-NH2 3.05Å; D210-R223 IonicContact OD2-NH2 3.55Å; D210-R223 PolarHBondContact OD2-NH2 3.13Å; D210-R259 IonicContact OD2-CZ 3.45Å; D210-R259 IonicContact OD2-NH1 3.67Å; D210-R259 PolarHBondContact OD2-NH1 3.37Å
211	G	92.3	Very high	92.8	Very high	15 Å²	15	45.1 Å²	45.1	16%	0.155	24%	0.237	C	C	.	.	H	α-helix	trans	-59.9	-45.6	173.9	0	0	0	0	0	112.7	I207 R208 L209 F213 L214 E215	I207-G211 PolarHBondContact O-N 3.01Å; I207-G211 VanDerWaalsContact O-N 3.11Å; R208-G211 PolarHBondContact O-N 2.8Å; L209-G211 VanDerWaalsContact C-N 3.32Å; L209-G211 PolarHBondContact O-N 3.35Å; G211-F213 VanDerWaalsContact C-N 3.34Å; G211-F213 PolarHBondContact O-N 3.47Å; G211-L214 WeakPolarHBondContact O-CB 3.23Å; G211-L214 PolarHBondContact O-N 2.72Å; G211-E215 WeakPolarHBondContact O-CG 3.46Å; G211-E215 PolarHBondContact O-N 3.29Å; G211-E215 VanDerWaalsContact O-N 3.08Å
212	I	92.8	Very high	92.4	Very high	10 Å²	10	51.2 Å²	51.2	5%	0.051	26%	0.262	C	S	.	.	H	α-helix	trans	-63.2	-42.3	176.1	-65.4	166.7	0	0	0	110.9	P166 R169 A170 L173 R208 L209 L214 E215 L216	P166-I212 HydrophobicContact CB-CG2 3.78Å; P166-I212 WeakPolarHBondContact O-CG2 3.34Å; R169-I212 HydrophobicContact CB-CD1 4.04Å; R169-I212 HydrophobicContact CG-CD1 3.75Å; A170-I212 HydrophobicContact CB-CG2 4Å; L173-I212 HydrophobicContact CD1-CD1 3.79Å; R208-I212 WeakPolarHBondContact O-CG1 3.27Å; R208-I212 PolarHBondContact O-N 2.7Å; R208-I212 VanDerWaalsContact O-N 3.09Å; L209-I212 PolarHBondContact O-N 3.49Å; I212-L214 VanDerWaalsContact C-N 3.29Å; I212-L214 PolarHBondContact O-N 3.46Å; I212-E215 WeakPolarHBondContact O-CB 3.42Å; I212-E215 PolarHBondContact O-N 3.1Å; I212-L216 HydrophobicContact CG2-CD1 3.88Å; I212-L216 HydrophobicContact CG2-CG 4.31Å; I212-L216 WeakPolarHBondContact O-CG 3.44Å; I212-L216 PolarHBondContact O-N 2.9Å
213	F	92.4	Very high	92.2	Very high	52 Å²	52	51.6 Å²	51.6	23%	0.228	26%	0.264	C	S	.	.	H	α-helix	trans	-64.8	-32.5	177.7	-72	-26.3	0	0	0	113.3	A170 L209 D210 G211 G217 S218 R223	A170-F213 HydrophobicContact CB-CE1 4.16Å; L209-F213 HydrophobicContact CD1-CD2 4.46Å; L209-F213 HydrophobicContact CD1-CE1 4.09Å; L209-F213 HydrophobicContact CD1-CE2 3.85Å; L209-F213 HydrophobicContact CD1-CZ 3.63Å; L209-F213 HydrophobicContact CD2-CE2 3.96Å; L209-F213 HydrophobicContact CD2-CZ 4.31Å; L209-F213 HydrophobicContact CG-CD2 4.08Å; L209-F213 HydrophobicContact CG-CE2 3.58Å; L209-F213 HydrophobicContact CG-CZ 3.92Å; L209-F213 WeakPolarHBondContact O-CG 3.36Å; L209-F213 PolarHBondContact O-N 2.76Å; D210-F213 PolarHBondContact O-N 3.46Å; G211-F213 VanDerWaalsContact C-N 3.34Å; G211-F213 PolarHBondContact O-N 3.47Å; F213-G217 PolarHBondContact O-N 2.97Å; F213-S218 VanDerWaalsContact O-CB 3.29Å; F213-S218 WeakPolarHBondContact O-CB 3.27Å; F213-S218 PolarHBondContact O-N 3.38Å; F213-S218 PolarHBondContact O-OG 3.01Å; F213-R223 HydrophobicContact CB-CG 3.83Å; F213-R223 HydrophobicContact CD2-CG 4.15Å; F213-R223 HydrophobicContact CG-CG 4.42Å
214	L	90.4	Very high	92	Very high	66 Å²	66	54.5 Å²	54.5	35%	0.346	28%	0.279	S	S	.	.	H	α-helix	trans	-63.3	-47.4	169.9	-81.5	166.3	0	0	0	111.7	D210 G211 I212 L216 G217 R223	D210-L214 PolarHBondContact O-N 2.91Å; G211-L214 WeakPolarHBondContact O-CB 3.23Å; G211-L214 PolarHBondContact O-N 2.72Å; I212-L214 VanDerWaalsContact C-N 3.29Å; I212-L214 PolarHBondContact O-N 3.46Å; L214-L216 VanDerWaalsContact C-N 3.27Å; L214-L216 PolarHBondContact O-N 3.49Å; L214-G217 PolarHBondContact O-N 3.49Å; L214-R223 VanDerWaalsContact CG-CZ 3.44Å
215	E	89.4	Confident	91.8	Very high	143 Å²	143	57.1 Å²	57.1	67%	0.668	30%	0.297	S	S	*	.	H	α-helix	trans	-60.1	-38.3	177.9	-70.2	171.2	-168.9	0	0	112.1	G211 I212 G217	G211-E215 WeakPolarHBondContact O-CG 3.46Å; G211-E215 PolarHBondContact O-N 3.29Å; G211-E215 VanDerWaalsContact O-N 3.08Å; I212-E215 WeakPolarHBondContact O-CB 3.42Å; I212-E215 PolarHBondContact O-N 3.1Å; E215-G217 PolarHBondContact O-N 3.42Å
216	L	89.3	Confident	91.6	Very high	65 Å²	65	57.7 Å²	57.7	34%	0.34	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-1.2	177.5	-65.7	177.7	0	0	0	114.1	P166 E167 I212 L214 S218	P166-L216 HydrophobicContact CB-CD1 4.37Å; P166-L216 HydrophobicContact CB-CD2 4.09Å; P166-L216 HydrophobicContact CB-CG 4.31Å; P166-L216 HydrophobicContact CG-CD2 4.38Å; E167-L216 HydrophobicContact CG-CD1 3.95Å; E167-L216 WeakPolarHBondContact OE1-CD2 3.48Å; I212-L216 HydrophobicContact CG2-CD1 3.88Å; I212-L216 HydrophobicContact CG2-CG 4.31Å; I212-L216 WeakPolarHBondContact O-CG 3.44Å; I212-L216 PolarHBondContact O-N 2.9Å; L214-L216 VanDerWaalsContact C-N 3.27Å; L214-L216 PolarHBondContact O-N 3.49Å; L216-S218 VanDerWaalsContact C-N 3.28Å; L216-S218 PolarHBondContact O-N 3.17Å
217	G	88	Confident	91.5	Very high	64 Å²	64	56.4 Å²	56.4	66%	0.66	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.6	32.1	-178	0	0	0	0	0	113.5	F213 L214 E215	F213-G217 PolarHBondContact O-N 2.97Å; L214-G217 PolarHBondContact O-N 3.49Å; E215-G217 PolarHBondContact O-N 3.42Å
218	S	87.3	Confident	91.5	Very high	35 Å²	35	57.7 Å²	57.7	25%	0.245	30%	0.304	C	S	.	.			trans	-66.1	145.2	-179	-64.7	0	0	0	0	112.2	F213 L216	F213-S218 VanDerWaalsContact O-CB 3.29Å; F213-S218 WeakPolarHBondContact O-CB 3.27Å; F213-S218 PolarHBondContact O-N 3.38Å; F213-S218 PolarHBondContact O-OG 3.01Å; L216-S218 VanDerWaalsContact C-N 3.28Å; L216-S218 PolarHBondContact O-N 3.17Å
219	E	87.9	Confident	91.5	Very high	122 Å²	122	57.2 Å²	57.2	57%	0.57	30%	0.302	S	S	*	.			trans	-57.2	139.8	177.5	-65.4	176.2	166.3	0	0	112.3	Q221 K222	E219-Q221 PolarHBondContact O-N 3.06Å; E219-Q221 VanDerWaalsContact O-N 3.15Å; E219-K222 PolarHBondContact O-N 2.89Å
220	E	89.9	Confident	91.6	Very high	52 Å²	52	56.8 Å²	56.8	24%	0.243	30%	0.3	C	S	.	.	H	α-helix	trans	-55.8	-33.8	179.5	64.4	175.3	-173.9	0	0	112.5	K222 R223 L224 F263 S264	E220-K222 PolarHBondContact O-N 3.26Å; E220-R223 PolarHBondContact O-N 3.04Å; E220-R223 VanDerWaalsContact O-N 3.11Å; E220-L224 WeakPolarHBondContact O-CB 3.41Å; E220-L224 PolarHBondContact O-N 3.22Å; E220-F263 HydrophobicContact CB-CD1 4.04Å; E220-F263 HydrophobicContact CB-CE1 4.43Å; E220-S264 VanDerWaalsContact CD-OG 3.27Å; E220-S264 PolarHBondContact OE1-OG 2.93Å; E220-S264 VanDerWaalsContact OE2-CB 3.31Å; E220-S264 WeakPolarHBondContact OE2-CB 3.45Å; E220-S264 PolarHBondContact OE2-N 3.28Å; E220-S264 PolarHBondContact OE2-OG 3.26Å
221	Q	87.9	Confident	91.8	Very high	116 Å²	116	56.6 Å²	56.6	54%	0.542	30%	0.299	S	S	.	.	H	α-helix	trans	-62.8	-31.2	-179.9	-69.8	74.2	15.9	0	0	112.2	E219 P225	E219-Q221 PolarHBondContact O-N 3.06Å; E219-Q221 VanDerWaalsContact O-N 3.15Å; Q221-P225 WeakPolarHBondContact O-CD 3.49Å
222	K	88.1	Confident	92.1	Very high	137 Å²	137	57.6 Å²	57.6	60%	0.596	31%	0.306	S	S	*	.	H	α-helix	trans	-76.7	-32.3	176.9	-64.6	-178.1	-176.9	176.1	0	111.9	E219 E220	E219-K222 PolarHBondContact O-N 2.89Å; E220-K222 PolarHBondContact O-N 3.26Å
223	R	92.8	Very high	92.3	Very high	8 Å²	8	57.3 Å²	57.3	3%	0.03	30%	0.304	C	S	.	.	H	α-helix	trans	-81.6	-33.4	-178.3	-67.2	174.2	55.5	-136.6	-7.9	112.8	D210 F213 L214 E220 A226 F227 T262 F263	D210-R223 IonicContact OD1-CZ 3.75Å; D210-R223 IonicContact OD1-NE 3.83Å; D210-R223 PolarHBondContact OD1-NE 2.92Å; D210-R223 IonicContact OD1-NH2 2.69Å; D210-R223 PolarHBondContact OD1-NH2 3.05Å; D210-R223 IonicContact OD2-NH2 3.55Å; D210-R223 PolarHBondContact OD2-NH2 3.13Å; F213-R223 HydrophobicContact CB-CG 3.83Å; F213-R223 HydrophobicContact CD2-CG 4.15Å; F213-R223 HydrophobicContact CG-CG 4.42Å; L214-R223 VanDerWaalsContact CG-CZ 3.44Å; E220-R223 PolarHBondContact O-N 3.04Å; E220-R223 VanDerWaalsContact O-N 3.11Å; R223-A226 PolarHBondContact O-N 3.44Å; R223-F227 PolarHBondContact O-N 2.83Å; R223-T262 PolarHBondContact NH2-OG1 3.45Å; R223-F263 HydrophobicContact CB-CE1 4.28Å; R223-F263 HydrophobicContact CB-CZ 4.41Å
224	L	93.6	Very high	92.6	Very high	62 Å²	62	54.8 Å²	54.8	33%	0.325	29%	0.293	S	S	.	.	H	α-helix	trans	-53.7	-44.4	-172.9	-177.1	66.7	0	0	0	114.8	E220 F227 N228 F263 P267	E220-L224 WeakPolarHBondContact O-CB 3.41Å; E220-L224 PolarHBondContact O-N 3.22Å; L224-F227 PolarHBondContact O-N 3.45Å; L224-N228 PolarHBondContact O-N 3.24Å; L224-N228 PolarHBondContact O-ND2 3.3Å; L224-F263 HydrophobicContact CB-CE1 4.25Å; L224-F263 HydrophobicContact CD1-CD1 4.27Å; L224-F263 HydrophobicContact CD1-CE1 4.21Å; L224-P267 HydrophobicContact CD1-CB 3.52Å; L224-P267 HydrophobicContact CD1-CG 3.76Å
225	P	92.9	Very high	92.9	Very high	83 Å²	83	56.8 Å²	56.8	54%	0.539	30%	0.296	S	S	.	.	H	α-helix	trans	-63	-43.9	178.7	-23.1	35	0	0	0	112.8	Q221 N228 R229	Q221-P225 WeakPolarHBondContact O-CD 3.49Å; P225-N228 PolarHBondContact O-N 2.97Å; P225-R229 VanDerWaalsContact O-CB 3.31Å; P225-R229 WeakPolarHBondContact O-CB 3.36Å; P225-R229 PolarHBondContact O-N 3.09Å
226	A	92.9	Very high	93.2	Very high	16 Å²	16	53 Å²	53	13%	0.132	28%	0.279	C	S	.	.	H	α-helix	trans	-64.4	-42	177.7	0	0	0	0	0	111.4	Y206 R223 R229 T230	Y206-A226 HydrophobicContact CD1-CB 3.64Å; Y206-A226 HydrophobicContact CE1-CB 3.95Å; R223-A226 PolarHBondContact O-N 3.44Å; A226-R229 PolarHBondContact O-N 2.7Å; A226-T230 WeakPolarHBondContact O-CB 3.41Å; A226-T230 PolarHBondContact O-N 2.9Å; A226-T230 PolarHBondContact O-OG1 3.49Å
227	F	94.8	Very high	93.6	Very high	2 Å²	2	50 Å²	50	1%	0.009	26%	0.263	C	S	.	.	H	α-helix	trans	-59.3	-51.3	175.8	-174.4	-89.1	0	0	0	111.8	R223 L224 R229 T230 L231 L256 R259 F263 P267 V270	R223-F227 PolarHBondContact O-N 2.83Å; L224-F227 PolarHBondContact O-N 3.45Å; F227-R229 VanDerWaalsContact C-N 3.33Å; F227-R229 PolarHBondContact O-N 2.91Å; F227-T230 WeakPolarHBondContact O-CB 3.46Å; F227-T230 PolarHBondContact O-N 3.48Å; F227-L231 HydrophobicContact CD1-CD1 4.07Å; F227-L231 HydrophobicContact CE1-CD1 3.64Å; F227-L231 HydrophobicContact CE1-CG 4.27Å; F227-L231 HydrophobicContact CZ-CD1 4.43Å; F227-L231 PolarHBondContact O-N 3.16Å; F227-L231 VanDerWaalsContact O-N 3.14Å; F227-L256 HydrophobicContact CD2-CD2 3.91Å; F227-L256 HydrophobicContact CE2-CB 4.09Å; F227-L256 HydrophobicContact CE2-CD2 3.68Å; F227-L256 HydrophobicContact CE2-CG 4.46Å; F227-L256 HydrophobicContact CZ-CB 4.25Å; F227-L256 WeakPolarHBondContact CZ-O 3.03Å; F227-R259 HydrophobicContact CE2-CB 4.42Å; F227-F263 HydrophobicContact CB-CZ 3.97Å; F227-F263 HydrophobicContact CD1-CE2 4.32Å; F227-F263 HydrophobicContact CD1-CZ 4.49Å; F227-F263 AromaticContact CD2-CE2 3.72Å; F227-F263 HydrophobicContact CD2-CE2 3.72Å; F227-F263 AromaticContact CD2-CZ 3.94Å; F227-F263 HydrophobicContact CD2-CZ 3.94Å; F227-F263 HydrophobicContact CE1-CE2 4.49Å; F227-F263 AromaticContact CE2-CE2 3.91Å; F227-F263 HydrophobicContact CE2-CE2 3.91Å; F227-F263 AromaticContact CG-CE2 3.93Å; F227-F263 HydrophobicContact CG-CE2 3.93Å; F227-F263 AromaticContact CG-CZ 3.88Å; F227-F263 HydrophobicContact CG-CZ 3.88Å; F227-F263 HydrophobicContact CZ-CE2 4.3Å; F227-P267 HydrophobicContact CD1-CB 3.78Å; F227-P267 HydrophobicContact CD1-CG 3.84Å; F227-P267 HydrophobicContact CE1-CB 3.84Å; F227-P267 HydrophobicContact CE1-CG 3.75Å; F227-V270 HydrophobicContact CE1-CG2 4.15Å
228	N	95.3	Very high	94.1	Very high	40 Å²	40	48.2 Å²	48.2	21%	0.214	24%	0.238	C	C	.	.	H	α-helix	trans	-61.8	-41	178.2	-71.4	-26.4	0	0	0	112.1	L224 P225 T230 L231 A232 P267 G269	L224-N228 PolarHBondContact O-N 3.24Å; L224-N228 PolarHBondContact O-ND2 3.3Å; P225-N228 PolarHBondContact O-N 2.97Å; N228-T230 VanDerWaalsContact C-N 3.33Å; N228-T230 PolarHBondContact O-N 3.47Å; N228-L231 PolarHBondContact O-N 3.32Å; N228-A232 PolarHBondContact O-N 3.31Å; N228-A232 VanDerWaalsContact O-N 3.16Å; N228-P267 WeakPolarHBondContact OD1-CB 3.45Å; N228-G269 VanDerWaalsContact OD1-CA 3.3Å; N228-G269 WeakPolarHBondContact OD1-CA 3.46Å; N228-G269 PolarHBondContact OD1-N 3.25Å
229	R	95.8	Very high	94.5	Very high	97 Å²	97	51.6 Å²	51.6	37%	0.366	25%	0.248	S	C	.	.	H	α-helix	trans	-62	-41.9	176.2	-177.4	57.7	169.7	166.3	-1.5	111.4	D181 Y206 P225 A226 F227 L231 A232 L233	D181-R229 IonicContact OD1-NH2 3.51Å; Y206-R229 HydrophobicContact CD2-CG 4.5Å; Y206-R229 HydrophobicContact CE2-CB 4.42Å; Y206-R229 HydrophobicContact CE2-CG 3.69Å; P225-R229 VanDerWaalsContact O-CB 3.31Å; P225-R229 WeakPolarHBondContact O-CB 3.36Å; P225-R229 PolarHBondContact O-N 3.09Å; A226-R229 PolarHBondContact O-N 2.7Å; F227-R229 VanDerWaalsContact C-N 3.33Å; F227-R229 PolarHBondContact O-N 2.91Å; R229-L231 PolarHBondContact O-N 3.26Å; R229-A232 PolarHBondContact O-N 3.42Å; R229-L233 HydrophobicContact CG-CD1 4.18Å; R229-L233 HydrophobicContact CG-CG 4.48Å; R229-L233 WeakPolarHBondContact O-CG 3.09Å; R229-L233 PolarHBondContact O-N 3.19Å
230	T	97.4	Very high	94.8	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.018	22%	0.221	C	C	.	.	H	α-helix	trans	-60	-45.2	177.9	-53.8	0	0	0	0	111.6	A203 Y206 I207 A226 F227 N228 A232 L233 L234 L256	A203-T230 HydrophobicContact CB-CG2 3.98Å; Y206-T230 WeakPolarHBondContact CB-OG1 3.44Å; I207-T230 HydrophobicContact CD1-CG2 4.17Å; I207-T230 HydrophobicContact CG1-CG2 3.94Å; A226-T230 WeakPolarHBondContact O-CB 3.41Å; A226-T230 PolarHBondContact O-N 2.9Å; A226-T230 PolarHBondContact O-OG1 3.49Å; F227-T230 WeakPolarHBondContact O-CB 3.46Å; F227-T230 PolarHBondContact O-N 3.48Å; N228-T230 VanDerWaalsContact C-N 3.33Å; N228-T230 PolarHBondContact O-N 3.47Å; T230-A232 VanDerWaalsContact C-N 3.33Å; T230-A232 PolarHBondContact O-N 2.95Å; T230-L233 PolarHBondContact O-N 3.22Å; T230-L234 HydrophobicContact CG2-CD1 4.23Å; T230-L234 HydrophobicContact CG2-CG 4.42Å; T230-L234 WeakPolarHBondContact O-CG 3.41Å; T230-L234 PolarHBondContact O-N 3.46Å; T230-L256 HydrophobicContact CG2-CD1 3.53Å
231	L	97.2	Very high	95	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-59.6	-43.5	175.8	-68.4	176.1	0	0	0	112.1	F227 N228 R229 L233 L234 R235 L253 L256 V270 Y275	F227-L231 HydrophobicContact CD1-CD1 4.07Å; F227-L231 HydrophobicContact CE1-CD1 3.64Å; F227-L231 HydrophobicContact CE1-CG 4.27Å; F227-L231 HydrophobicContact CZ-CD1 4.43Å; F227-L231 PolarHBondContact O-N 3.16Å; F227-L231 VanDerWaalsContact O-N 3.14Å; N228-L231 PolarHBondContact O-N 3.32Å; R229-L231 PolarHBondContact O-N 3.26Å; L231-L233 PolarHBondContact O-N 3Å; L231-L234 PolarHBondContact O-N 2.93Å; L231-R235 WeakPolarHBondContact O-CB 3.32Å; L231-R235 PolarHBondContact O-N 3.45Å; L231-L253 HydrophobicContact CD2-CD1 3.58Å; L231-L256 HydrophobicContact CD2-CB 4.24Å; L231-L256 HydrophobicContact CD2-CD1 3.98Å; L231-V270 HydrophobicContact CD1-CB 4.48Å; L231-V270 HydrophobicContact CD1-CG2 3.79Å; L231-Y275 HydrophobicContact CD2-CD2 4.34Å; L231-Y275 HydrophobicContact CD2-CE2 4.45Å
232	A	97.3	Very high	95.2	Very high	36 Å²	36	47.4 Å²	47.4	30%	0.298	23%	0.23	S	C	.	.	H	α-helix	trans	-64.4	-39.3	178.1	0	0	0	0	0	112.5	N228 R229 T230 Q236	N228-A232 PolarHBondContact O-N 3.31Å; N228-A232 VanDerWaalsContact O-N 3.16Å; R229-A232 PolarHBondContact O-N 3.42Å; T230-A232 VanDerWaalsContact C-N 3.33Å; T230-A232 PolarHBondContact O-N 2.95Å; A232-Q236 PolarHBondContact O-N 3.01Å
233	L	97.9	Very high	95.4	Very high	4 Å²	4	42.7 Å²	42.7	2%	0.021	21%	0.213	C	C	.	.	H	α-helix	trans	-64.6	-52.5	175.3	-69.2	171.2	0	0	0	110.7	Y199 M202 A203 Y206 R229 T230 L231 R235 Q236 V237	Y199-L233 HydrophobicContact CD1-CD2 3.43Å; Y199-L233 VanDerWaalsContact CD1-CD2 3.43Å; Y199-L233 HydrophobicContact CE1-CD2 4.13Å; Y199-L233 HydrophobicContact CG-CD2 3.71Å; M202-L233 HydrophobicContact CB-CD1 3.81Å; M202-L233 HydrophobicContact SD-CD2 4.44Å; A203-L233 HydrophobicContact CB-CB 4.3Å; Y206-L233 HydrophobicContact CD2-CD1 3.91Å; Y206-L233 HydrophobicContact CE2-CD1 3.84Å; R229-L233 HydrophobicContact CG-CD1 4.18Å; R229-L233 HydrophobicContact CG-CG 4.48Å; R229-L233 WeakPolarHBondContact O-CG 3.09Å; R229-L233 PolarHBondContact O-N 3.19Å; T230-L233 PolarHBondContact O-N 3.22Å; L231-L233 PolarHBondContact O-N 3Å; L233-R235 VanDerWaalsContact C-N 3.26Å; L233-R235 PolarHBondContact O-N 3.39Å; L233-Q236 WeakPolarHBondContact O-CA 3.14Å; L233-Q236 WeakPolarHBondContact O-CB 3.31Å; L233-Q236 PolarHBondContact O-N 3.19Å; L233-V237 WeakPolarHBondContact O-CG2 3.44Å; L233-V237 PolarHBondContact O-N 3.36Å
234	L	97.9	Very high	95.4	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-57.8	-38.6	178.9	-70	178.4	0	0	0	111.9	A203 T230 L231 Q236 V237 L238 A249 L253 L256	A203-L234 HydrophobicContact CB-CD2 3.72Å; A203-L234 HydrophobicContact CB-CG 4.01Å; T230-L234 HydrophobicContact CG2-CD1 4.23Å; T230-L234 HydrophobicContact CG2-CG 4.42Å; T230-L234 WeakPolarHBondContact O-CG 3.41Å; T230-L234 PolarHBondContact O-N 3.46Å; L231-L234 PolarHBondContact O-N 2.93Å; L234-Q236 PolarHBondContact O-N 3.11Å; L234-V237 PolarHBondContact O-N 3.15Å; L234-L238 WeakPolarHBondContact O-CG 3.35Å; L234-L238 PolarHBondContact O-N 3.41Å; L234-A249 HydrophobicContact CD2-CB 4Å; L234-L253 HydrophobicContact CD1-CB 4.42Å; L234-L256 HydrophobicContact CD1-CD1 3.55Å
235	R	97.3	Very high	95.4	Very high	108 Å²	108	41.5 Å²	41.5	41%	0.408	21%	0.205	S	C	.	.	H	α-helix	trans	-57.5	-33.1	174.2	-175.2	178.9	178.4	-174	5.5	113.2	L231 L233 D272 Y275	L231-R235 WeakPolarHBondContact O-CB 3.32Å; L231-R235 PolarHBondContact O-N 3.45Å; L233-R235 VanDerWaalsContact C-N 3.26Å; L233-R235 PolarHBondContact O-N 3.39Å; R235-D272 PolarHBondContact NH1-O 3.45Å; R235-Y275 WeakPolarHBondContact CB-OH 3.46Å
236	Q	96.9	Very high	95.6	Very high	64 Å²	64	40.2 Å²	40.2	30%	0.299	19%	0.192	S	C	.	.	H	α-helix	trans	-79	-37.3	174.3	-61.5	-58	-22.9	0	0	112	R196 Y199 A232 L233 L234 L238 K239	R196-Q236 PolarHBondContact NE-O 3.41Å; Y199-Q236 HydrophobicContact CD2-CB 3.77Å; Y199-Q236 HydrophobicContact CD2-CG 4.42Å; Y199-Q236 HydrophobicContact CE2-CB 4.08Å; Y199-Q236 HydrophobicContact CE2-CG 4.37Å; A232-Q236 PolarHBondContact O-N 3.01Å; L233-Q236 WeakPolarHBondContact O-CA 3.14Å; L233-Q236 WeakPolarHBondContact O-CB 3.31Å; L233-Q236 PolarHBondContact O-N 3.19Å; L234-Q236 PolarHBondContact O-N 3.11Å; Q236-L238 VanDerWaalsContact C-N 3.29Å; Q236-L238 PolarHBondContact O-N 3.03Å; Q236-K239 WeakPolarHBondContact O-CB 3.49Å; Q236-K239 PolarHBondContact O-N 3.29Å; Q236-K239 VanDerWaalsContact O-N 3.13Å
237	V	97.4	Very high	95.8	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.4	-35.6	176.3	-177.5	0	0	0	0	111.5	F200 L233 L234 K239 S240 H245 A249	F200-V237 HydrophobicContact CB-CG1 3.97Å; F200-V237 HydrophobicContact CB-CG2 3.89Å; F200-V237 HydrophobicContact CD2-CG1 3.96Å; F200-V237 HydrophobicContact CG-CG1 4.36Å; L233-V237 WeakPolarHBondContact O-CG2 3.44Å; L233-V237 PolarHBondContact O-N 3.36Å; L234-V237 PolarHBondContact O-N 3.15Å; V237-K239 PolarHBondContact O-N 2.91Å; V237-S240 WeakPolarHBondContact O-CB 3.25Å; V237-S240 PolarHBondContact O-N 3.02Å; V237-H245 HydrophobicContact CG1-CB 3.83Å; V237-A249 HydrophobicContact CB-CB 4.05Å; V237-A249 HydrophobicContact CG1-CB 3.71Å
238	L	97.1	Very high	95.9	Very high	28 Å²	28	39.8 Å²	39.8	15%	0.147	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-14.6	174.9	-72.2	176.3	0	0	0	114.1	L234 Q236 A249 W250 L253	L234-L238 WeakPolarHBondContact O-CG 3.35Å; L234-L238 PolarHBondContact O-N 3.41Å; Q236-L238 VanDerWaalsContact C-N 3.29Å; Q236-L238 PolarHBondContact O-N 3.03Å; L238-A249 HydrophobicContact CD2-CB 3.81Å; L238-A249 HydrophobicContact CG-CB 4.22Å; L238-W250 HydrophobicContact CD1-CD2 4.44Å; L238-W250 HydrophobicContact CD1-CH2 4.22Å; L238-W250 HydrophobicContact CD1-CZ2 4.12Å; L238-W250 HydrophobicContact CD1-CZ3 4.45Å; L238-W250 HydrophobicContact CD2-CB 4.4Å; L238-W250 VanDerWaalsContact CD2-CD1 3.44Å; L238-W250 HydrophobicContact CD2-CD2 3.69Å; L238-W250 HydrophobicContact CD2-CE3 4.49Å; L238-W250 HydrophobicContact CD2-CG 3.62Å; L238-W250 HydrophobicContact CD2-CZ2 4.22Å; L238-L253 HydrophobicContact CD1-CD2 4.2Å
239	K	96.4	Very high	96	Very high	105 Å²	105	37.9 Å²	37.9	46%	0.457	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	2.4	175.7	-53.8	173.6	-171.3	166.3	0	113.2	R196 Q236 V237	R196-K239 PolarHBondContact NH1-O 3.36Å; R196-K239 PolarHBondContact NH2-O 2.94Å; Q236-K239 WeakPolarHBondContact O-CB 3.49Å; Q236-K239 PolarHBondContact O-N 3.29Å; Q236-K239 VanDerWaalsContact O-N 3.13Å; V237-K239 PolarHBondContact O-N 2.91Å
240	S	95	Very high	96.2	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.007	17%	0.168	C	C	.	.			trans	-61.4	150.1	178.1	171.3	0	0	0	0	110.8	E193 V237 D242 Q246	E193-S240 WeakPolarHBondContact OE1-CB 3.49Å; E193-S240 PolarHBondContact OE1-OG 3.27Å; E193-S240 WeakPolarHBondContact OE2-CA 3.41Å; V237-S240 WeakPolarHBondContact O-CB 3.25Å; V237-S240 PolarHBondContact O-N 3.02Å; S240-D242 VanDerWaalsContact C-N 3.3Å; S240-D242 PolarHBondContact OG-N 3.43Å; S240-D242 VanDerWaalsContact OG-N 3.1Å; S240-Q246 WeakPolarHBondContact O-CG 3.3Å; S240-Q246 PolarHBondContact O-NE2 2.95Å
241	E	92.7	Very high	96.2	Very high	168 Å²	168	35.2 Å²	35.2	79%	0.785	17%	0.167	S	C	*	.	S	Bend	trans	-82.6	-14.2	173.2	-64.9	178.2	-175	0	0	111.8	E193 P243	E193-E241 PolarHBondContact OE1-N 3.25Å; E193-E241 PolarHBondContact OE2-N 3.47Å; E241-P243 WeakPolarHBondContact O-CD 3.41Å
242	D	91.9	Very high	96.2	Very high	34 Å²	34	36.5 Å²	36.5	18%	0.182	17%	0.172	C	C	.	.			trans	-80.1	113.6	176.8	-178.1	0.3	0	0	0	110.6	S240 R244 H245 Q246	S240-D242 VanDerWaalsContact C-N 3.3Å; S240-D242 PolarHBondContact OG-N 3.43Å; S240-D242 VanDerWaalsContact OG-N 3.1Å; D242-R244 PolarHBondContact O-N 3.18Å; D242-R244 VanDerWaalsContact O-N 3.16Å; D242-R244 WeakPolarHBondContact OD1-CB 3.28Å; D242-R244 PolarHBondContact OD1-N 2.69Å; D242-R244 IonicContact OD2-CZ 3.5Å; D242-R244 IonicContact OD2-NE 3.06Å; D242-R244 PolarHBondContact OD2-NE 3.06Å; D242-R244 IonicContact OD2-NH2 2.87Å; D242-H245 HydrophobicContact CB-CB 4.2Å; D242-H245 PolarHBondContact O-N 3.18Å; D242-H245 VanDerWaalsContact O-N 3.15Å; D242-H245 IonicContact OD2-CD2 3.31Å; D242-H245 IonicContact OD2-CE1 3.39Å; D242-H245 PolarHBondContact OD2-CE1 3.07Å; D242-H245 IonicContact OD2-CG 3.16Å; D242-H245 IonicContact OD2-ND1 2.74Å; D242-H245 PolarHBondContact OD2-ND1 3.45Å; D242-H245 IonicContact OD2-NE2 3.13Å; D242-Q246 PolarHBondContact O-N 3.14Å
243	P	93.7	Very high	96.2	Very high	38 Å²	38	34.8 Å²	34.8	25%	0.247	16%	0.158	C	C	.	.	H	α-helix	trans	-59.9	-27.9	178.6	25.5	-34.6	0	0	0	112.4	E241 Q246 A247 I290 I297	E241-P243 WeakPolarHBondContact O-CD 3.41Å; P243-Q246 PolarHBondContact O-N 3.04Å; P243-A247 VanDerWaalsContact O-CB 3.27Å; P243-A247 WeakPolarHBondContact O-CB 3.39Å; P243-A247 PolarHBondContact O-N 3.33Å; P243-I290 HydrophobicContact CB-CG2 4.04Å; P243-I297 HydrophobicContact CB-CD1 4.18Å; P243-I297 HydrophobicContact CG-CD1 4.31Å
244	R	92.7	Very high	96.1	Very high	37 Å²	37	34.6 Å²	34.6	14%	0.14	16%	0.157	C	C	.	.	H	α-helix	trans	-64.7	-50.3	176	-175.9	-175.2	66.8	136.9	15	110.8	L59 D242 Q246 A247 L248 I297	L59-R244 PolarHBondContact O-NH1 3.2Å; D242-R244 PolarHBondContact O-N 3.18Å; D242-R244 VanDerWaalsContact O-N 3.16Å; D242-R244 WeakPolarHBondContact OD1-CB 3.28Å; D242-R244 PolarHBondContact OD1-N 2.69Å; D242-R244 IonicContact OD2-CZ 3.5Å; D242-R244 IonicContact OD2-NE 3.06Å; D242-R244 PolarHBondContact OD2-NE 3.06Å; D242-R244 IonicContact OD2-NH2 2.87Å; R244-Q246 VanDerWaalsContact C-N 3.34Å; R244-Q246 PolarHBondContact O-N 2.73Å; R244-A247 PolarHBondContact O-N 3.07Å; R244-L248 HydrophobicContact CG-CD1 4.06Å; R244-L248 WeakPolarHBondContact O-CB 3.48Å; R244-L248 VanDerWaalsContact O-CG 3.22Å; R244-L248 WeakPolarHBondContact O-CG 3.29Å; R244-L248 PolarHBondContact O-N 2.94Å; R244-I297 HydrophobicContact CB-CD1 3.99Å; R244-I297 HydrophobicContact CB-CG1 4.22Å; R244-I297 HydrophobicContact CG-CG1 4.43Å
245	H	94.1	Very high	96	Very high	8 Å²	8	35.1 Å²	35.1	4%	0.037	16%	0.159	C	C	.	.	H	α-helix	trans	-61.9	-42.2	176.3	-71.1	148.8	0	0	0	111.6	F200 V237 D242 A249	F200-H245 AromaticContact CD1-CD2 3.62Å; F200-H245 AromaticContact CD1-NE2 3.97Å; F200-H245 AromaticContact CG-CD2 3.76Å; V237-H245 HydrophobicContact CG1-CB 3.83Å; D242-H245 HydrophobicContact CB-CB 4.2Å; D242-H245 PolarHBondContact O-N 3.18Å; D242-H245 VanDerWaalsContact O-N 3.15Å; D242-H245 IonicContact OD2-CD2 3.31Å; D242-H245 IonicContact OD2-CE1 3.39Å; D242-H245 PolarHBondContact OD2-CE1 3.07Å; D242-H245 IonicContact OD2-CG 3.16Å; D242-H245 IonicContact OD2-ND1 2.74Å; D242-H245 PolarHBondContact OD2-ND1 3.45Å; D242-H245 IonicContact OD2-NE2 3.13Å; H245-A249 WeakPolarHBondContact O-CB 3.47Å; H245-A249 PolarHBondContact O-N 3.48Å
246	Q	96.5	Very high	95.9	Very high	55 Å²	55	30 Å²	30	26%	0.257	14%	0.14	S	C	.	.	H	α-helix	trans	-61.7	-51	177.5	-68.4	-173.5	-12.9	0	0	112.3	S240 D242 P243 R244 A249 W250 I290	S240-Q246 WeakPolarHBondContact O-CG 3.3Å; S240-Q246 PolarHBondContact O-NE2 2.95Å; D242-Q246 PolarHBondContact O-N 3.14Å; P243-Q246 PolarHBondContact O-N 3.04Å; R244-Q246 VanDerWaalsContact C-N 3.34Å; R244-Q246 PolarHBondContact O-N 2.73Å; Q246-A249 PolarHBondContact O-N 3.03Å; Q246-W250 VanDerWaalsContact O-CD1 3.28Å; Q246-W250 PolarHBondContact O-N 3.35Å; Q246-I290 HydrophobicContact CB-CD1 4.12Å
247	A	97.3	Very high	95.8	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-62.1	-46.4	-178.3	0	0	0	0	0	111.5	P243 R244 W250 C251 A287 I290 A291 I297	P243-A247 VanDerWaalsContact O-CB 3.27Å; P243-A247 WeakPolarHBondContact O-CB 3.39Å; P243-A247 PolarHBondContact O-N 3.33Å; R244-A247 PolarHBondContact O-N 3.07Å; A247-W250 PolarHBondContact O-N 3.14Å; A247-C251 PolarHBondContact O-N 3.12Å; A247-A287 WeakPolarHBondContact O-CB 3.49Å; A247-I290 HydrophobicContact CB-CB 4.23Å; A247-I290 HydrophobicContact CB-CG2 4.01Å; A247-A291 HydrophobicContact CB-CB 4.5Å; A247-I297 HydrophobicContact CB-CG2 3.67Å
248	L	96.6	Very high	95.6	Very high	9 Å²	9	31.1 Å²	31.1	5%	0.047	15%	0.146	C	C	.	.	H	α-helix	trans	-68.4	-35.4	178.7	-62.4	-179.3	0	0	0	112.1	F200 R244 C251 Y252 R300 L301 I304	F200-L248 HydrophobicContact CE1-CD1 4.47Å; F200-L248 HydrophobicContact CE2-CB 3.62Å; F200-L248 HydrophobicContact CE2-CD1 4.44Å; F200-L248 HydrophobicContact CZ-CB 3.71Å; F200-L248 HydrophobicContact CZ-CD1 3.69Å; F200-L248 HydrophobicContact CZ-CG 4.37Å; R244-L248 HydrophobicContact CG-CD1 4.06Å; R244-L248 WeakPolarHBondContact O-CB 3.48Å; R244-L248 VanDerWaalsContact O-CG 3.22Å; R244-L248 WeakPolarHBondContact O-CG 3.29Å; R244-L248 PolarHBondContact O-N 2.94Å; L248-C251 WeakPolarHBondContact O-CB 3.15Å; L248-C251 PolarHBondContact O-N 3.29Å; L248-Y252 HydrophobicContact CB-CE2 4.3Å; L248-Y252 WeakPolarHBondContact O-CD2 3.2Å; L248-Y252 PolarHBondContact O-N 2.92Å; L248-R300 HydrophobicContact CD1-CG 4.12Å; L248-R300 HydrophobicContact CD2-CB 4.34Å; L248-R300 HydrophobicContact CD2-CG 3.74Å; L248-L301 HydrophobicContact CD2-CD2 3.88Å; L248-L301 HydrophobicContact CD2-CG 4.34Å; L248-I304 HydrophobicContact CD2-CD1 3.68Å
249	A	97.8	Very high	95.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-66	-39.4	174.9	0	0	0	0	0	112.5	L234 V237 L238 H245 Q246 C251 Y252 L253	L234-A249 HydrophobicContact CD2-CB 4Å; V237-A249 HydrophobicContact CB-CB 4.05Å; V237-A249 HydrophobicContact CG1-CB 3.71Å; L238-A249 HydrophobicContact CD2-CB 3.81Å; L238-A249 HydrophobicContact CG-CB 4.22Å; H245-A249 WeakPolarHBondContact O-CB 3.47Å; H245-A249 PolarHBondContact O-N 3.48Å; Q246-A249 PolarHBondContact O-N 3.03Å; A249-C251 VanDerWaalsContact C-N 3.34Å; A249-Y252 PolarHBondContact O-N 2.99Å; A249-L253 VanDerWaalsContact O-CB 3.29Å; A249-L253 WeakPolarHBondContact O-CB 3.22Å; A249-L253 PolarHBondContact O-N 3.49Å
250	W	98.2	Very high	94.9	Very high	45 Å²	45	28.9 Å²	28.9	17%	0.17	13%	0.134	C	C	.	.	H	α-helix	trans	-62.1	-42	171.2	-84.6	116.7	0	0	0	111.9	L238 Q246 A247 L253 G254 C283 K286 A287 I290	L238-W250 HydrophobicContact CD1-CD2 4.44Å; L238-W250 HydrophobicContact CD1-CH2 4.22Å; L238-W250 HydrophobicContact CD1-CZ2 4.12Å; L238-W250 HydrophobicContact CD1-CZ3 4.45Å; L238-W250 HydrophobicContact CD2-CB 4.4Å; L238-W250 VanDerWaalsContact CD2-CD1 3.44Å; L238-W250 HydrophobicContact CD2-CD2 3.69Å; L238-W250 HydrophobicContact CD2-CE3 4.49Å; L238-W250 HydrophobicContact CD2-CG 3.62Å; L238-W250 HydrophobicContact CD2-CZ2 4.22Å; Q246-W250 VanDerWaalsContact O-CD1 3.28Å; Q246-W250 PolarHBondContact O-N 3.35Å; A247-W250 PolarHBondContact O-N 3.14Å; W250-L253 HydrophobicContact CE3-CD2 3.86Å; W250-L253 HydrophobicContact CZ3-CD2 3.67Å; W250-L253 PolarHBondContact O-N 3.29Å; W250-G254 PolarHBondContact O-N 3.31Å; W250-C283 HydrophobicContact CE3-CB 4.09Å; W250-C283 WeakPolarHBondContact O-CB 3.37Å; W250-K286 HydrophobicContact CD2-CB 4Å; W250-K286 HydrophobicContact CD2-CD 3.99Å; W250-K286 HydrophobicContact CE3-CB 4.45Å; W250-K286 HydrophobicContact CE3-CD 3.96Å; W250-K286 HydrophobicContact CG-CB 4.04Å; W250-K286 HydrophobicContact CH2-CD 3.77Å; W250-K286 HydrophobicContact CZ2-CD 3.74Å; W250-K286 HydrophobicContact CZ3-CD 3.86Å; W250-A287 HydrophobicContact CB-CB 3.87Å; W250-I290 VanDerWaalsContact CD1-CD1 3.46Å
251	C	97.8	Very high	94.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-61	-49.4	176.4	-173.9	0	0	0	0	111.6	A247 L248 A249 L253 G254 M255 F284 A287 L301	A247-C251 PolarHBondContact O-N 3.12Å; L248-C251 WeakPolarHBondContact O-CB 3.15Å; L248-C251 PolarHBondContact O-N 3.29Å; A249-C251 VanDerWaalsContact C-N 3.34Å; C251-L253 VanDerWaalsContact C-N 3.33Å; C251-L253 PolarHBondContact O-N 3.39Å; C251-G254 PolarHBondContact O-N 3.12Å; C251-M255 PolarHBondContact O-N 3.36Å; C251-M255 VanDerWaalsContact O-N 3.09Å; C251-F284 VanDerWaalsContact O-CE1 3.27Å; C251-F284 WeakPolarHBondContact O-CE1 3.38Å; C251-A287 HydrophobicContact CB-CB 4.14Å; C251-L301 HydrophobicContact CB-CD2 3.61Å
252	Y	97.8	Very high	94.3	Very high	27 Å²	27	30.8 Å²	30.8	11%	0.106	15%	0.152	C	C	.	.	H	α-helix	trans	-67	-32.5	178.1	-67.8	-46.8	0	0	0	113.3	F200 T204 I207 L248 A249 M255 L256 I304	F200-Y252 AromaticContact CE2-CD2 3.98Å; F200-Y252 HydrophobicContact CE2-CD2 3.98Å; F200-Y252 AromaticContact CE2-CE2 3.77Å; F200-Y252 HydrophobicContact CE2-CE2 3.77Å; F200-Y252 AromaticContact CZ-CE2 3.87Å; F200-Y252 HydrophobicContact CZ-CE2 3.87Å; T204-Y252 HydrophobicContact CG2-CD2 4.32Å; T204-Y252 HydrophobicContact CG2-CE2 3.65Å; I207-Y252 HydrophobicContact CD1-CD1 4.01Å; I207-Y252 HydrophobicContact CD1-CD2 4.44Å; I207-Y252 HydrophobicContact CD1-CG 3.84Å; L248-Y252 HydrophobicContact CB-CE2 4.3Å; L248-Y252 WeakPolarHBondContact O-CD2 3.2Å; L248-Y252 PolarHBondContact O-N 2.92Å; A249-Y252 PolarHBondContact O-N 2.99Å; Y252-M255 HydrophobicContact CD1-CE 4.23Å; Y252-M255 HydrophobicContact CD1-SD 4.47Å; Y252-M255 PolarHBondContact O-N 3.07Å; Y252-L256 WeakPolarHBondContact O-CG 3.46Å; Y252-L256 PolarHBondContact O-N 2.97Å; Y252-I304 HydrophobicContact CE1-CD1 4.23Å
253	L	97.6	Very high	94.2	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-62.5	-46.8	172.4	178	62	0	0	0	111	L231 L234 L238 A249 W250 C251 M255 L256 L257 Y275	L231-L253 HydrophobicContact CD2-CD1 3.58Å; L234-L253 HydrophobicContact CD1-CB 4.42Å; L238-L253 HydrophobicContact CD1-CD2 4.2Å; A249-L253 VanDerWaalsContact O-CB 3.29Å; A249-L253 WeakPolarHBondContact O-CB 3.22Å; A249-L253 PolarHBondContact O-N 3.49Å; W250-L253 HydrophobicContact CE3-CD2 3.86Å; W250-L253 HydrophobicContact CZ3-CD2 3.67Å; W250-L253 PolarHBondContact O-N 3.29Å; C251-L253 VanDerWaalsContact C-N 3.33Å; C251-L253 PolarHBondContact O-N 3.39Å; L253-M255 VanDerWaalsContact C-N 3.33Å; L253-M255 PolarHBondContact O-N 3.3Å; L253-L256 PolarHBondContact O-N 3.15Å; L253-L257 HydrophobicContact CD1-CD1 4.37Å; L253-L257 HydrophobicContact CD1-CG 4.23Å; L253-L257 HydrophobicContact CG-CD1 4.22Å; L253-L257 HydrophobicContact CG-CG 4.47Å; L253-L257 WeakPolarHBondContact O-CG 3.43Å; L253-L257 PolarHBondContact O-N 3.48Å; L253-Y275 HydrophobicContact CD1-CD2 3.77Å; L253-Y275 HydrophobicContact CD1-CE1 4.42Å; L253-Y275 HydrophobicContact CD1-CE2 3.63Å; L253-Y275 HydrophobicContact CD1-CG 4.22Å; L253-Y275 HydrophobicContact CD2-CD1 3.95Å; L253-Y275 HydrophobicContact CD2-CE1 3.5Å; L253-Y275 HydrophobicContact CD2-CE2 4.14Å; L253-Y275 HydrophobicContact CD2-CG 4.46Å
254	G	96.4	Very high	94.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-55.7	-48.3	175.3	0	0	0	0	0	111.8	W250 C251 L256 L257 E258	W250-G254 PolarHBondContact O-N 3.31Å; C251-G254 PolarHBondContact O-N 3.12Å; G254-L256 PolarHBondContact O-N 3.35Å; G254-L257 PolarHBondContact O-N 3.47Å; G254-E258 PolarHBondContact O-N 3.49Å; G254-E258 VanDerWaalsContact O-N 3.07Å
255	M	95.5	Very high	93.9	Very high	10 Å²	10	35.4 Å²	35.4	5%	0.049	19%	0.187	C	C	.	.	H	α-helix	trans	-59.5	-41.1	176.2	178	-159.3	73.8	0	0	113	I207 C251 Y252 L253 E258 R259 L308	I207-M255 HydrophobicContact CB-CE 4.24Å; I207-M255 HydrophobicContact CD1-CE 3.85Å; I207-M255 HydrophobicContact CG1-CE 3.84Å; I207-M255 HydrophobicContact CG2-CE 3.38Å; I207-M255 HydrophobicContact CG2-SD 4.31Å; C251-M255 PolarHBondContact O-N 3.36Å; C251-M255 VanDerWaalsContact O-N 3.09Å; Y252-M255 HydrophobicContact CD1-CE 4.23Å; Y252-M255 HydrophobicContact CD1-SD 4.47Å; Y252-M255 PolarHBondContact O-N 3.07Å; L253-M255 VanDerWaalsContact C-N 3.33Å; L253-M255 PolarHBondContact O-N 3.3Å; M255-E258 PolarHBondContact O-N 3Å; M255-R259 WeakPolarHBondContact O-CG 3.17Å; M255-R259 PolarHBondContact O-N 3.07Å; M255-L308 HydrophobicContact CB-CD1 4.21Å; M255-L308 HydrophobicContact CG-CD1 4.25Å; M255-L308 HydrophobicContact CG-CD2 3.82Å; M255-L308 HydrophobicContact SD-CD2 3.74Å
256	L	94.8	Very high	93.7	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-67.2	-37.5	176.9	-74.1	170.1	0	0	0	112.3	I207 F227 T230 L231 L234 Y252 L253 G254 E258 R259 N260	I207-L256 HydrophobicContact CG1-CD2 4.24Å; F227-L256 HydrophobicContact CD2-CD2 3.91Å; F227-L256 HydrophobicContact CE2-CB 4.09Å; F227-L256 HydrophobicContact CE2-CD2 3.68Å; F227-L256 HydrophobicContact CE2-CG 4.46Å; F227-L256 HydrophobicContact CZ-CB 4.25Å; F227-L256 WeakPolarHBondContact CZ-O 3.03Å; T230-L256 HydrophobicContact CG2-CD1 3.53Å; L231-L256 HydrophobicContact CD2-CB 4.24Å; L231-L256 HydrophobicContact CD2-CD1 3.98Å; L234-L256 HydrophobicContact CD1-CD1 3.55Å; Y252-L256 WeakPolarHBondContact O-CG 3.46Å; Y252-L256 PolarHBondContact O-N 2.97Å; L253-L256 PolarHBondContact O-N 3.15Å; G254-L256 PolarHBondContact O-N 3.35Å; L256-E258 VanDerWaalsContact C-N 3.32Å; L256-E258 PolarHBondContact O-N 3.01Å; L256-R259 WeakPolarHBondContact O-CB 3.22Å; L256-R259 PolarHBondContact O-N 2.9Å; L256-R259 VanDerWaalsContact O-N 3.13Å; L256-N260 PolarHBondContact O-N 2.82Å
257	L	94.8	Very high	93.5	Very high	16 Å²	16	36.7 Å²	36.7	8%	0.084	20%	0.2	C	C	.	.	H	α-helix	trans	-66.3	-33.9	176.8	-67	176.9	0	0	0	111.8	L253 G254 R259 N260 V270 T278 P280	L253-L257 HydrophobicContact CD1-CD1 4.37Å; L253-L257 HydrophobicContact CD1-CG 4.23Å; L253-L257 HydrophobicContact CG-CD1 4.22Å; L253-L257 HydrophobicContact CG-CG 4.47Å; L253-L257 WeakPolarHBondContact O-CG 3.43Å; L253-L257 PolarHBondContact O-N 3.48Å; G254-L257 PolarHBondContact O-N 3.47Å; L257-R259 VanDerWaalsContact C-N 3.3Å; L257-R259 PolarHBondContact O-N 3.16Å; L257-N260 WeakPolarHBondContact O-CB 3.4Å; L257-N260 PolarHBondContact O-N 3.49Å; L257-V270 HydrophobicContact CD2-CG1 4.14Å; L257-V270 HydrophobicContact CD2-CG2 4.43Å; L257-T278 HydrophobicContact CD1-CG2 3.9Å; L257-P280 HydrophobicContact CB-CB 4.46Å; L257-P280 HydrophobicContact CB-CG 3.85Å
258	E	92.9	Very high	93.2	Very high	72 Å²	72	42.3 Å²	42.3	34%	0.336	23%	0.228	S	C	.	.	H	α-helix	trans	-65.4	-34	170.8	-65.5	-176.7	148.9	0	0	112.2	G254 M255 L256 N260 P280 K310	G254-E258 PolarHBondContact O-N 3.49Å; G254-E258 VanDerWaalsContact O-N 3.07Å; M255-E258 PolarHBondContact O-N 3Å; L256-E258 VanDerWaalsContact C-N 3.32Å; L256-E258 PolarHBondContact O-N 3.01Å; E258-N260 PolarHBondContact O-N 3.33Å; E258-P280 HydrophobicContact CG-CB 3.48Å; E258-P280 VanDerWaalsContact CG-CB 3.48Å; E258-P280 HydrophobicContact CG-CG 3.67Å; E258-K310 IonicContact OE1-NZ 2.76Å; E258-K310 PolarHBondContact OE1-NZ 2.82Å; E258-K310 WeakPolarHBondContact OE2-CE 3.36Å; E258-K310 IonicContact OE2-NZ 3.38Å; E258-K310 PolarHBondContact OE2-NZ 2.65Å
259	R	90.4	Very high	93	Very high	56 Å²	56	42.1 Å²	42.1	21%	0.211	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-74.6	-5	176.1	-69.4	-178	179.8	-174.7	3.3	113.8	D210 F227 M255 L256 L257 D261 T262	D210-R259 IonicContact OD2-CZ 3.45Å; D210-R259 IonicContact OD2-NH1 3.67Å; D210-R259 PolarHBondContact OD2-NH1 3.37Å; F227-R259 HydrophobicContact CE2-CB 4.42Å; M255-R259 WeakPolarHBondContact O-CG 3.17Å; M255-R259 PolarHBondContact O-N 3.07Å; L256-R259 WeakPolarHBondContact O-CB 3.22Å; L256-R259 PolarHBondContact O-N 2.9Å; L256-R259 VanDerWaalsContact O-N 3.13Å; L257-R259 VanDerWaalsContact C-N 3.3Å; L257-R259 PolarHBondContact O-N 3.16Å; R259-D261 PolarHBondContact O-N 3.07Å; R259-T262 WeakPolarHBondContact O-CB 3.31Å; R259-T262 WeakPolarHBondContact O-CG2 3.16Å; R259-T262 PolarHBondContact O-N 3.1Å; R259-T262 PolarHBondContact O-OG1 3.49Å
260	N	88.4	Confident	92.7	Very high	30 Å²	30	42.5 Å²	42.5	16%	0.16	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-55.2	-36	176.7	-174.3	43.3	0	0	0	111.9	L256 L257 E258 T262 F263 P267	L256-N260 PolarHBondContact O-N 2.82Å; L257-N260 WeakPolarHBondContact O-CB 3.4Å; L257-N260 PolarHBondContact O-N 3.49Å; E258-N260 PolarHBondContact O-N 3.33Å; N260-T262 PolarHBondContact O-N 3.07Å; N260-T262 VanDerWaalsContact O-N 3.11Å; N260-F263 PolarHBondContact O-N 2.93Å; N260-F263 VanDerWaalsContact O-N 3.12Å; N260-P267 WeakPolarHBondContact OD1-CD 3.45Å
261	D	86.1	Confident	92.4	Very high	146 Å²	146	46 Å²	46	78%	0.781	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-69.8	-6.8	179.9	-64.4	-15.3	0	0	0	113.5	R259 F263	R259-D261 PolarHBondContact O-N 3.07Å; D261-F263 VanDerWaalsContact C-N 3.28Å
262	T	89.1	Confident	92.1	Very high	62 Å²	62	50.8 Å²	50.8	38%	0.38	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-81.8	-5.4	172.7	71.6	0	0	0	0	113.4	R223 R259 N260	R223-T262 PolarHBondContact NH2-OG1 3.45Å; R259-T262 WeakPolarHBondContact O-CB 3.31Å; R259-T262 WeakPolarHBondContact O-CG2 3.16Å; R259-T262 PolarHBondContact O-N 3.1Å; R259-T262 PolarHBondContact O-OG1 3.49Å; N260-T262 PolarHBondContact O-N 3.07Å; N260-T262 VanDerWaalsContact O-N 3.11Å
263	F	90.1	Very high	91.9	Very high	17 Å²	17	50.1 Å²	50.1	8%	0.075	27%	0.273	C	S	.	.	S	Bend	trans	-106.9	145.7	176.2	-63.4	-88.2	0	0	0	110.8	E220 R223 L224 F227 N260 D261 T265 P267	E220-F263 HydrophobicContact CB-CD1 4.04Å; E220-F263 HydrophobicContact CB-CE1 4.43Å; R223-F263 HydrophobicContact CB-CE1 4.28Å; R223-F263 HydrophobicContact CB-CZ 4.41Å; L224-F263 HydrophobicContact CB-CE1 4.25Å; L224-F263 HydrophobicContact CD1-CD1 4.27Å; L224-F263 HydrophobicContact CD1-CE1 4.21Å; F227-F263 HydrophobicContact CB-CZ 3.97Å; F227-F263 HydrophobicContact CD1-CE2 4.32Å; F227-F263 HydrophobicContact CD1-CZ 4.49Å; F227-F263 AromaticContact CD2-CE2 3.72Å; F227-F263 HydrophobicContact CD2-CE2 3.72Å; F227-F263 AromaticContact CD2-CZ 3.94Å; F227-F263 HydrophobicContact CD2-CZ 3.94Å; F227-F263 HydrophobicContact CE1-CE2 4.49Å; F227-F263 AromaticContact CE2-CE2 3.91Å; F227-F263 HydrophobicContact CE2-CE2 3.91Å; F227-F263 AromaticContact CG-CE2 3.93Å; F227-F263 HydrophobicContact CG-CE2 3.93Å; F227-F263 AromaticContact CG-CZ 3.88Å; F227-F263 HydrophobicContact CG-CZ 3.88Å; F227-F263 HydrophobicContact CZ-CE2 4.3Å; N260-F263 PolarHBondContact O-N 2.93Å; N260-F263 VanDerWaalsContact O-N 3.12Å; D261-F263 VanDerWaalsContact C-N 3.28Å; F263-T265 WeakPolarHBondContact CB-O 3.09Å; F263-T265 PolarHBondContact O-N 3.16Å; F263-P267 HydrophobicContact CB-CG 4.17Å; F263-P267 HydrophobicContact CD1-CG 4.21Å; F263-P267 HydrophobicContact CD2-CG 3.65Å; F263-P267 HydrophobicContact CE2-CG 4.06Å; F263-P267 HydrophobicContact CG-CG 3.74Å
264	S	90.7	Very high	91.6	Very high	85 Å²	85	52.9 Å²	52.9	59%	0.594	30%	0.301	S	S	*	.	S	Bend	trans	-63.3	-28.5	177.5	62.9	0	0	0	0	113.3	E220	E220-S264 VanDerWaalsContact CD-OG 3.27Å; E220-S264 PolarHBondContact OE1-OG 2.93Å; E220-S264 VanDerWaalsContact OE2-CB 3.31Å; E220-S264 WeakPolarHBondContact OE2-CB 3.45Å; E220-S264 PolarHBondContact OE2-N 3.28Å; E220-S264 PolarHBondContact OE2-OG 3.26Å
265	T	89.8	Confident	91.5	Very high	104 Å²	104	53.8 Å²	53.8	64%	0.638	31%	0.305	S	S	*	.	S	Bend	trans	-137.4	147.4	176.3	55.7	0	0	0	0	109.3	F263 P267	F263-T265 WeakPolarHBondContact CB-O 3.09Å; F263-T265 PolarHBondContact O-N 3.16Å; T265-P267 VanDerWaalsContact O-CD 3.31Å; T265-P267 WeakPolarHBondContact O-CD 3.4Å; T265-P267 VanDerWaalsContact O-N 3.15Å
266	T	89.6	Confident	91.2	Very high	88 Å²	88	56.6 Å²	56.6	54%	0.54	33%	0.325	S	S	.	.			trans	-55.8	120.2	177.2	-57.6	0	0	0	0	110.1	M268 V270	T266-M268 PolarHBondContact O-N 3.49Å; T266-V270 HydrophobicContact CG2-CB 4.06Å; T266-V270 HydrophobicContact CG2-CG1 4.26Å; T266-V270 HydrophobicContact CG2-CG2 4.26Å
267	P	92.6	Very high	90.8	Very high	3 Å²	3	60.8 Å²	60.8	2%	0.019	37%	0.369	C	S	.	.			trans	-55.6	134.8	177.5	-30.9	40.9	0	0	0	112.3	L224 F227 N228 N260 F263 T265 G269 V270	L224-P267 HydrophobicContact CD1-CB 3.52Å; L224-P267 HydrophobicContact CD1-CG 3.76Å; F227-P267 HydrophobicContact CD1-CB 3.78Å; F227-P267 HydrophobicContact CD1-CG 3.84Å; F227-P267 HydrophobicContact CE1-CB 3.84Å; F227-P267 HydrophobicContact CE1-CG 3.75Å; N228-P267 WeakPolarHBondContact OD1-CB 3.45Å; N260-P267 WeakPolarHBondContact OD1-CD 3.45Å; F263-P267 HydrophobicContact CB-CG 4.17Å; F263-P267 HydrophobicContact CD1-CG 4.21Å; F263-P267 HydrophobicContact CD2-CG 3.65Å; F263-P267 HydrophobicContact CE2-CG 4.06Å; F263-P267 HydrophobicContact CG-CG 3.74Å; T265-P267 VanDerWaalsContact O-CD 3.31Å; T265-P267 WeakPolarHBondContact O-CD 3.4Å; T265-P267 VanDerWaalsContact O-N 3.15Å; P267-G269 PolarHBondContact O-N 3.22Å; P267-G269 VanDerWaalsContact O-N 3.11Å; P267-V270 HydrophobicContact CB-CG2 4.43Å; P267-V270 WeakPolarHBondContact O-CB 3.14Å; P267-V270 PolarHBondContact O-N 2.86Å
268	M	90.9	Very high	90.7	Very high	118 Å²	118	62 Å²	62	58%	0.581	38%	0.377	S	S	*	.	H	α-helix	trans	-57.8	-30.5	-178	-163	62.8	64.9	0	0	112.8	T266 V270 H271 D272	T266-M268 PolarHBondContact O-N 3.49Å; M268-V270 PolarHBondContact O-N 3.42Å; M268-V270 VanDerWaalsContact O-N 3.15Å; M268-H271 WeakPolarHBondContact O-CA 3.33Å; M268-H271 WeakPolarHBondContact O-CB 3.49Å; M268-H271 PolarHBondContact O-N 3.44Å; M268-H271 HydrophobicContact SD-CB 4.38Å; M268-D272 WeakPolarHBondContact CG-OD2 3.38Å; M268-D272 PolarHBondContact O-N 2.88Å
269	G	91	Very high	90.8	Very high	5 Å²	5	62.1 Å²	62.1	5%	0.052	38%	0.38	C	S	.	.	H	α-helix	trans	-58.3	-27.9	176.8	0	0	0	0	0	113.8	N228 P267 C273	N228-G269 VanDerWaalsContact OD1-CA 3.3Å; N228-G269 WeakPolarHBondContact OD1-CA 3.46Å; N228-G269 PolarHBondContact OD1-N 3.25Å; P267-G269 PolarHBondContact O-N 3.22Å; P267-G269 VanDerWaalsContact O-N 3.11Å; G269-C273 WeakPolarHBondContact O-CB 3.48Å; G269-C273 PolarHBondContact O-N 3.16Å; G269-C273 PolarHBondContact O-SG 3.34Å
270	V	92.9	Very high	91	Very high	7 Å²	7	60.8 Å²	60.8	4%	0.042	38%	0.378	C	S	.	.	H	α-helix	trans	-63.9	-44.7	173.5	178.6	0	0	0	0	110.1	F227 L231 L257 T266 P267 M268 G274 Y275	F227-V270 HydrophobicContact CE1-CG2 4.15Å; L231-V270 HydrophobicContact CD1-CB 4.48Å; L231-V270 HydrophobicContact CD1-CG2 3.79Å; L257-V270 HydrophobicContact CD2-CG1 4.14Å; L257-V270 HydrophobicContact CD2-CG2 4.43Å; T266-V270 HydrophobicContact CG2-CB 4.06Å; T266-V270 HydrophobicContact CG2-CG1 4.26Å; T266-V270 HydrophobicContact CG2-CG2 4.26Å; P267-V270 HydrophobicContact CB-CG2 4.43Å; P267-V270 WeakPolarHBondContact O-CB 3.14Å; P267-V270 PolarHBondContact O-N 2.86Å; M268-V270 PolarHBondContact O-N 3.42Å; M268-V270 VanDerWaalsContact O-N 3.15Å; V270-G274 PolarHBondContact O-N 2.69Å; V270-Y275 WeakPolarHBondContact O-CA 3.36Å; V270-Y275 PolarHBondContact O-N 3.08Å
271	H	91.6	Very high	91.3	Very high	119 Å²	119	64 Å²	64	55%	0.551	40%	0.395	S	S	*	.	H	α-helix	trans	-70.4	-49.4	177.3	176.8	-87.9	0	0	0	111.9	M268 C273 G274 S276	M268-H271 WeakPolarHBondContact O-CA 3.33Å; M268-H271 WeakPolarHBondContact O-CB 3.49Å; M268-H271 PolarHBondContact O-N 3.44Å; M268-H271 HydrophobicContact SD-CB 4.38Å; H271-C273 PolarHBondContact O-N 2.87Å; H271-G274 WeakPolarHBondContact O-CA 3.37Å; H271-G274 PolarHBondContact O-N 2.87Å; H271-S276 WeakPolarHBondContact CA-OG 3.29Å
272	D	92.1	Very high	91.8	Very high	100 Å²	100	61.6 Å²	61.6	54%	0.535	38%	0.382	S	S	.	.	H	α-helix	trans	-63.2	-29.5	-176.3	-65.2	-17.7	0	0	0	112.9	R235 M268 G274	R235-D272 PolarHBondContact NH1-O 3.45Å; M268-D272 WeakPolarHBondContact CG-OD2 3.38Å; M268-D272 PolarHBondContact O-N 2.88Å; D272-G274 VanDerWaalsContact C-N 3.34Å
273	C	92.6	Very high	92.2	Very high	13 Å²	13	58.6 Å²	58.6	9%	0.088	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-6	174.9	-63	0	0	0	0	114	G269 H271 Y275	G269-C273 WeakPolarHBondContact O-CB 3.48Å; G269-C273 PolarHBondContact O-N 3.16Å; G269-C273 PolarHBondContact O-SG 3.34Å; H271-C273 PolarHBondContact O-N 2.87Å; C273-Y275 HydrophobicContact CB-CD2 3.42Å; C273-Y275 VanDerWaalsContact CB-CD2 3.42Å; C273-Y275 HydrophobicContact CB-CE2 3.25Å; C273-Y275 HydrophobicContact CB-CG 4.36Å
274	G	91.9	Very high	92.5	Very high	58 Å²	58	57.9 Å²	57.9	60%	0.598	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.8	26.3	178.6	0	0	0	0	0	114.1	V270 H271 D272	V270-G274 PolarHBondContact O-N 2.69Å; H271-G274 WeakPolarHBondContact O-CA 3.37Å; H271-G274 PolarHBondContact O-N 2.87Å; D272-G274 VanDerWaalsContact C-N 3.34Å
275	Y	93.4	Very high	92.8	Very high	19 Å²	19	55.7 Å²	55.7	8%	0.075	35%	0.352	C	S	.	.			trans	-98.9	6	-179.9	-55.5	-50.2	0	0	0	113.3	L231 R235 L253 V270 C273 G277 T278	L231-Y275 HydrophobicContact CD2-CD2 4.34Å; L231-Y275 HydrophobicContact CD2-CE2 4.45Å; R235-Y275 WeakPolarHBondContact CB-OH 3.46Å; L253-Y275 HydrophobicContact CD1-CD2 3.77Å; L253-Y275 HydrophobicContact CD1-CE1 4.42Å; L253-Y275 HydrophobicContact CD1-CE2 3.63Å; L253-Y275 HydrophobicContact CD1-CG 4.22Å; L253-Y275 HydrophobicContact CD2-CD1 3.95Å; L253-Y275 HydrophobicContact CD2-CE1 3.5Å; L253-Y275 HydrophobicContact CD2-CE2 4.14Å; L253-Y275 HydrophobicContact CD2-CG 4.46Å; V270-Y275 WeakPolarHBondContact O-CA 3.36Å; V270-Y275 PolarHBondContact O-N 3.08Å; C273-Y275 HydrophobicContact CB-CD2 3.42Å; C273-Y275 VanDerWaalsContact CB-CD2 3.42Å; C273-Y275 HydrophobicContact CB-CE2 3.25Å; C273-Y275 HydrophobicContact CB-CG 4.36Å; Y275-G277 PolarHBondContact O-N 2.98Å; Y275-T278 WeakPolarHBondContact CA-OG1 3.41Å; Y275-T278 WeakPolarHBondContact O-CB 3.2Å; Y275-T278 PolarHBondContact O-N 3Å; Y275-T278 PolarHBondContact O-OG1 3.05Å
276	S	89.9	Confident	93.2	Very high	69 Å²	69	55.3 Å²	55.3	48%	0.483	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	121.1	172.9	-62.7	0	0	0	0	110.9	H271 T278	H271-S276 WeakPolarHBondContact CA-OG 3.29Å; S276-T278 VanDerWaalsContact C-N 3.3Å; S276-T278 PolarHBondContact O-N 3.18Å
277	G	86.8	Confident	93.6	Very high	90 Å²	90	51.1 Å²	51.1	93%	0.928	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	8.5	-178.3	0	0	0	0	0	115	Y275	Y275-G277 PolarHBondContact O-N 2.98Å
278	T	92.8	Very high	93.9	Very high	41 Å²	41	52.5 Å²	52.5	25%	0.252	32%	0.323	S	S	.	.			trans	-76.9	125.1	170.8	-58.3	0	0	0	0	109.7	L257 Y275 S276 C283	L257-T278 HydrophobicContact CD1-CG2 3.9Å; Y275-T278 WeakPolarHBondContact CA-OG1 3.41Å; Y275-T278 WeakPolarHBondContact O-CB 3.2Å; Y275-T278 PolarHBondContact O-N 3Å; Y275-T278 PolarHBondContact O-OG1 3.05Å; S276-T278 VanDerWaalsContact C-N 3.3Å; S276-T278 PolarHBondContact O-N 3.18Å; T278-C283 VanDerWaalsContact CG2-SG 3.59Å
279	D	93.6	Very high	94.2	Very high	75 Å²	75	52 Å²	52	40%	0.401	32%	0.319	S	S	.	.			trans	-75.2	131.3	173.7	-168.1	-38.4	0	0	0	109.9	L281 D282 C283	D279-L281 PolarHBondContact O-N 2.92Å; D279-L281 WeakPolarHBondContact OD1-CB 3.39Å; D279-L281 PolarHBondContact OD1-N 2.86Å; D279-D282 HydrophobicContact CB-CB 4.45Å; D279-D282 WeakPolarHBondContact O-CB 3.35Å; D279-D282 PolarHBondContact O-N 3.24Å; D279-D282 VanDerWaalsContact O-N 3.14Å; D279-C283 PolarHBondContact O-N 3.07Å
280	P	94.8	Very high	94.5	Very high	27 Å²	27	54 Å²	54	18%	0.175	33%	0.328	C	S	.	.	H	α-helix	trans	-50.7	-36.7	171	-27.9	34	0	0	0	114.8	L257 E258 D282 C283 F284	L257-P280 HydrophobicContact CB-CB 4.46Å; L257-P280 HydrophobicContact CB-CG 3.85Å; E258-P280 HydrophobicContact CG-CB 3.48Å; E258-P280 VanDerWaalsContact CG-CB 3.48Å; E258-P280 HydrophobicContact CG-CG 3.67Å; P280-D282 VanDerWaalsContact C-N 3.33Å; P280-D282 PolarHBondContact O-N 3.35Å; P280-C283 VanDerWaalsContact O-CB 3.31Å; P280-C283 WeakPolarHBondContact O-CB 3.44Å; P280-C283 PolarHBondContact O-N 3.37Å; P280-C283 VanDerWaalsContact O-N 3.13Å; P280-F284 HydrophobicContact CB-CE2 4.4Å; P280-F284 VanDerWaalsContact O-CD2 3.3Å; P280-F284 WeakPolarHBondContact O-CD2 3.31Å; P280-F284 PolarHBondContact O-N 3.07Å
281	L	94.8	Very high	94.6	Very high	97 Å²	97	53.7 Å²	53.7	51%	0.508	33%	0.326	S	S	.	.	H	α-helix	trans	-65.5	-35.7	179.9	-65.5	179.2	0	0	0	112.1	D279 C283 F284 G285 M313	D279-L281 PolarHBondContact O-N 2.92Å; D279-L281 WeakPolarHBondContact OD1-CB 3.39Å; D279-L281 PolarHBondContact OD1-N 2.86Å; L281-C283 PolarHBondContact O-N 2.93Å; L281-F284 HydrophobicContact CD2-CD2 4.24Å; L281-F284 PolarHBondContact O-N 3.18Å; L281-G285 PolarHBondContact O-N 2.96Å; L281-M313 HydrophobicContact CD2-CE 4.07Å
282	D	96.3	Very high	94.8	Very high	96 Å²	96	52 Å²	52	51%	0.513	32%	0.317	S	S	.	.	H	α-helix	trans	-63.5	-34.4	174.6	-70.3	-25.6	0	0	0	111.3	D279 P280 G285 K286	D279-D282 HydrophobicContact CB-CB 4.45Å; D279-D282 WeakPolarHBondContact O-CB 3.35Å; D279-D282 PolarHBondContact O-N 3.24Å; D279-D282 VanDerWaalsContact O-N 3.14Å; P280-D282 VanDerWaalsContact C-N 3.33Å; P280-D282 PolarHBondContact O-N 3.35Å; D282-G285 PolarHBondContact O-N 2.87Å; D282-K286 WeakPolarHBondContact O-CG 3.3Å; D282-K286 PolarHBondContact O-N 3.08Å
283	C	97.5	Very high	94.9	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-66.4	-44.7	176.5	-61.6	0	0	0	0	111	W250 T278 D279 P280 L281 K286 A287	W250-C283 HydrophobicContact CE3-CB 4.09Å; W250-C283 WeakPolarHBondContact O-CB 3.37Å; T278-C283 VanDerWaalsContact CG2-SG 3.59Å; D279-C283 PolarHBondContact O-N 3.07Å; P280-C283 VanDerWaalsContact O-CB 3.31Å; P280-C283 WeakPolarHBondContact O-CB 3.44Å; P280-C283 PolarHBondContact O-N 3.37Å; P280-C283 VanDerWaalsContact O-N 3.13Å; L281-C283 PolarHBondContact O-N 2.93Å; C283-K286 PolarHBondContact O-N 3.25Å; C283-A287 PolarHBondContact O-N 3.47Å
284	F	97.5	Very high	95.1	Very high	1 Å²	1	55.7 Å²	55.7	0%	0.004	33%	0.334	C	S	.	.	H	α-helix	trans	-64.3	-40.4	174.8	-58.9	-46.7	0	0	0	112.1	C251 P280 L281 K286 A287 I288 F305 K310 M313	C251-F284 VanDerWaalsContact O-CE1 3.27Å; C251-F284 WeakPolarHBondContact O-CE1 3.38Å; P280-F284 HydrophobicContact CB-CE2 4.4Å; P280-F284 VanDerWaalsContact O-CD2 3.3Å; P280-F284 WeakPolarHBondContact O-CD2 3.31Å; P280-F284 PolarHBondContact O-N 3.07Å; L281-F284 HydrophobicContact CD2-CD2 4.24Å; L281-F284 PolarHBondContact O-N 3.18Å; F284-K286 PolarHBondContact O-N 3.39Å; F284-A287 WeakPolarHBondContact O-CB 3.46Å; F284-A287 PolarHBondContact O-N 2.92Å; F284-I288 WeakPolarHBondContact O-CG1 3.47Å; F284-I288 PolarHBondContact O-N 3.14Å; F284-F305 HydrophobicContact CB-CE1 4.1Å; F284-F305 HydrophobicContact CB-CZ 4.03Å; F284-F305 AromaticContact CD1-CE1 3.46Å; F284-F305 HydrophobicContact CD1-CE1 3.46Å; F284-F305 VanDerWaalsContact CD1-CE1 3.46Å; F284-F305 HydrophobicContact CD1-CZ 4.07Å; F284-F305 AromaticContact CE1-CE1 3.97Å; F284-F305 HydrophobicContact CE1-CE1 3.97Å; F284-F305 AromaticContact CG-CE1 3.83Å; F284-F305 HydrophobicContact CG-CE1 3.83Å; F284-F305 HydrophobicContact CG-CZ 4.26Å; F284-K310 HydrophobicContact CE2-CD 4.1Å; F284-K310 HydrophobicContact CZ-CD 4.15Å; F284-M313 HydrophobicContact CB-SD 4.06Å; F284-M313 HydrophobicContact CD2-CE 4.11Å; F284-M313 HydrophobicContact CD2-SD 4.05Å; F284-M313 HydrophobicContact CG-SD 4.24Å
285	G	97.3	Very high	95.2	Very high	40 Å²	40	53.7 Å²	53.7	41%	0.412	31%	0.31	S	S	.	.	H	α-helix	trans	-58.5	-45.3	174.6	0	0	0	0	0	112.5	L281 D282 A287 I288 E289	L281-G285 PolarHBondContact O-N 2.96Å; D282-G285 PolarHBondContact O-N 2.87Å; G285-A287 PolarHBondContact O-N 3.11Å; G285-I288 PolarHBondContact O-N 3.38Å; G285-E289 WeakPolarHBondContact O-CB 3.18Å; G285-E289 PolarHBondContact O-N 3.38Å
286	K	97.8	Very high	95.2	Very high	96 Å²	96	55.9 Å²	55.9	42%	0.417	33%	0.327	S	S	.	.	H	α-helix	trans	-62.8	-40.4	174.5	-73.8	174.5	-175.9	171.9	0	112.7	W250 D282 C283 F284 E289 I290	W250-K286 HydrophobicContact CD2-CB 4Å; W250-K286 HydrophobicContact CD2-CD 3.99Å; W250-K286 HydrophobicContact CE3-CB 4.45Å; W250-K286 HydrophobicContact CE3-CD 3.96Å; W250-K286 HydrophobicContact CG-CB 4.04Å; W250-K286 HydrophobicContact CH2-CD 3.77Å; W250-K286 HydrophobicContact CZ2-CD 3.74Å; W250-K286 HydrophobicContact CZ3-CD 3.86Å; D282-K286 WeakPolarHBondContact O-CG 3.3Å; D282-K286 PolarHBondContact O-N 3.08Å; C283-K286 PolarHBondContact O-N 3.25Å; F284-K286 PolarHBondContact O-N 3.39Å; K286-E289 PolarHBondContact O-N 3.06Å; K286-I290 WeakPolarHBondContact O-CG1 3.42Å; K286-I290 PolarHBondContact O-N 3.26Å; K286-I290 VanDerWaalsContact O-N 3.07Å
287	A	98	Very high	95.5	Very high	0 Å²	0	53 Å²	53	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-59.4	-46.8	176.7	0	0	0	0	0	111.5	A247 W250 C251 C283 F284 G285 A291 L301	A247-A287 WeakPolarHBondContact O-CB 3.49Å; W250-A287 HydrophobicContact CB-CB 3.87Å; C251-A287 HydrophobicContact CB-CB 4.14Å; C283-A287 PolarHBondContact O-N 3.47Å; F284-A287 WeakPolarHBondContact O-CB 3.46Å; F284-A287 PolarHBondContact O-N 2.92Å; G285-A287 PolarHBondContact O-N 3.11Å; A287-A291 WeakPolarHBondContact O-CB 3.4Å; A287-A291 PolarHBondContact O-N 3.37Å; A287-L301 HydrophobicContact CB-CD1 4.27Å; A287-L301 HydrophobicContact CB-CD2 4.1Å
288	I	97.8	Very high	96	Very high	31 Å²	31	48.8 Å²	48.8	16%	0.159	26%	0.262	C	S	.	.	H	α-helix	trans	-65.9	-42.3	178.1	-65.8	167	0	0	0	110.9	F284 G285 I290 A291 K292 F305 M320	F284-I288 WeakPolarHBondContact O-CG1 3.47Å; F284-I288 PolarHBondContact O-N 3.14Å; G285-I288 PolarHBondContact O-N 3.38Å; I288-I290 PolarHBondContact O-N 2.96Å; I288-A291 CarbonylContact O-C 3.54Å; I288-A291 PolarHBondContact O-N 3.38Å; I288-K292 WeakPolarHBondContact O-CA 3.42Å; I288-K292 PolarHBondContact O-N 2.88Å; I288-F305 HydrophobicContact CD1-CE2 3.93Å; I288-F305 HydrophobicContact CD1-CZ 4.21Å; I288-F305 HydrophobicContact CG1-CE2 4.04Å; I288-F305 HydrophobicContact CG1-CZ 4.32Å; I288-M320 HydrophobicContact CG2-CE 3.67Å; I288-M320 HydrophobicContact CG2-SD 3.64Å
289	E	97.6	Very high	96.1	Very high	107 Å²	107	47.2 Å²	47.2	50%	0.5	25%	0.252	S	S	.	.	H	α-helix	trans	-62.3	-39.9	-179.5	179.8	58.7	-162.6	0	0	112.6	G285 K286 A291 K292	G285-E289 WeakPolarHBondContact O-CB 3.18Å; G285-E289 PolarHBondContact O-N 3.38Å; K286-E289 PolarHBondContact O-N 3.06Å; E289-A291 VanDerWaalsContact C-N 3.3Å; E289-A291 PolarHBondContact O-N 2.96Å; E289-K292 WeakPolarHBondContact O-CD 3.41Å; E289-K292 VanDerWaalsContact O-CG 3.28Å; E289-K292 WeakPolarHBondContact O-CG 3.49Å; E289-K292 WeakPolarHBondContact OE1-CE 3.28Å; E289-K292 IonicContact OE1-NZ 2.69Å; E289-K292 PolarHBondContact OE1-NZ 3.31Å; E289-K292 IonicContact OE2-NZ 2.64Å
290	I	97.1	Very high	96.1	Very high	48 Å²	48	48.5 Å²	48.5	25%	0.246	25%	0.251	C	S	.	.	H	α-helix	trans	-65	-38.4	173.9	-66.9	165.1	0	0	0	110.5	P243 Q246 A247 W250 K286 I288	P243-I290 HydrophobicContact CB-CG2 4.04Å; Q246-I290 HydrophobicContact CB-CD1 4.12Å; A247-I290 HydrophobicContact CB-CB 4.23Å; A247-I290 HydrophobicContact CB-CG2 4.01Å; W250-I290 VanDerWaalsContact CD1-CD1 3.46Å; K286-I290 WeakPolarHBondContact O-CG1 3.42Å; K286-I290 PolarHBondContact O-N 3.26Å; K286-I290 VanDerWaalsContact O-N 3.07Å; I288-I290 PolarHBondContact O-N 2.96Å
291	A	96.4	Very high	96.2	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-82.8	-9.9	-176.5	0	0	0	0	0	114.4	A247 A287 I288 E289 N293 Q294 I297 L298 L301	A247-A291 HydrophobicContact CB-CB 4.5Å; A287-A291 WeakPolarHBondContact O-CB 3.4Å; A287-A291 PolarHBondContact O-N 3.37Å; I288-A291 CarbonylContact O-C 3.54Å; I288-A291 PolarHBondContact O-N 3.38Å; E289-A291 VanDerWaalsContact C-N 3.3Å; E289-A291 PolarHBondContact O-N 2.96Å; A291-N293 PolarHBondContact O-N 2.81Å; A291-Q294 PolarHBondContact O-N 3.39Å; A291-I297 HydrophobicContact CB-CB 3.92Å; A291-I297 HydrophobicContact CB-CG2 3.48Å; A291-I297 VanDerWaalsContact CB-CG2 3.48Å; A291-L298 HydrophobicContact CB-CD2 3.69Å; A291-L298 HydrophobicContact CB-CG 3.99Å; A291-L298 WeakPolarHBondContact O-CD1 3.13Å; A291-L298 VanDerWaalsContact O-CG 3.28Å; A291-L298 WeakPolarHBondContact O-CG 3.46Å; A291-L301 HydrophobicContact CB-CD1 3.64Å
292	K	94.9	Very high	96.3	Very high	84 Å²	84	42.6 Å²	42.6	37%	0.365	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-25.3	-162.2	71	-175.5	176.2	-175.8	0	117	I288 E289 M320 V324	I288-K292 WeakPolarHBondContact O-CA 3.42Å; I288-K292 PolarHBondContact O-N 2.88Å; E289-K292 WeakPolarHBondContact O-CD 3.41Å; E289-K292 VanDerWaalsContact O-CG 3.28Å; E289-K292 WeakPolarHBondContact O-CG 3.49Å; E289-K292 WeakPolarHBondContact OE1-CE 3.28Å; E289-K292 IonicContact OE1-NZ 2.69Å; E289-K292 PolarHBondContact OE1-NZ 3.31Å; E289-K292 IonicContact OE2-NZ 2.64Å; K292-M320 HydrophobicContact CB-CE 4.15Å; K292-V324 WeakPolarHBondContact O-CG2 3.25Å
293	N	94.5	Very high	96.3	Very high	115 Å²	115	41.8 Å²	41.8	62%	0.615	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-114.3	12.8	-179.8	-63.4	-27.7	0	0	0	113	A291	A291-N293 PolarHBondContact O-N 2.81Å
294	Q	95.3	Very high	96.2	Very high	76 Å²	76	42.6 Å²	42.6	36%	0.355	21%	0.214	S	C	.	.			trans	-126.7	89.3	-173.8	-60	-167.1	27.4	0	0	110	A291 P296 I297 L298	A291-Q294 PolarHBondContact O-N 3.39Å; Q294-P296 VanDerWaalsContact C-CD 3.42Å; Q294-P296 VanDerWaalsContact C-N 3.32Å; Q294-I297 HydrophobicContact CB-CB 4.3Å; Q294-I297 HydrophobicContact CB-CD1 4.03Å; Q294-I297 HydrophobicContact CB-CG1 4.12Å; Q294-I297 HydrophobicContact CG-CD1 4.47Å; Q294-I297 PolarHBondContact O-N 3.22Å; Q294-L298 PolarHBondContact O-N 2.89Å
295	P	95.4	Very high	96.1	Very high	16 Å²	16	42.5 Å²	42.5	10%	0.104	21%	0.214	C	C	.	.	H	α-helix	trans	-51	-41	-177.9	-24.8	31.9	0	0	0	114.6	I297 L298 N299 V324 L325	P295-I297 VanDerWaalsContact C-N 3.31Å; P295-I297 PolarHBondContact O-N 3.04Å; P295-L298 PolarHBondContact O-N 3.44Å; P295-N299 WeakPolarHBondContact O-CB 3.2Å; P295-N299 PolarHBondContact O-N 3.21Å; P295-N299 PolarHBondContact O-ND2 3.43Å; P295-V324 HydrophobicContact CG-CB 4.06Å; P295-V324 HydrophobicContact CG-CG1 3.62Å; P295-L325 HydrophobicContact CB-CB 4.19Å; P295-L325 HydrophobicContact CB-CD2 4.35Å; P295-L325 HydrophobicContact CG-CB 3.64Å; P295-L325 HydrophobicContact CG-CD2 4.24Å
296	P	93.3	Very high	96	Very high	65 Å²	65	42.8 Å²	42.8	42%	0.422	20%	0.203	S	C	.	.	H	α-helix	trans	-60.8	-37.1	177.9	-25.1	35.6	0	0	0	113.9	L59 Q294 R300	L59-P296 HydrophobicContact CD2-CB 3.79Å; Q294-P296 VanDerWaalsContact C-CD 3.42Å; Q294-P296 VanDerWaalsContact C-N 3.32Å; P296-R300 PolarHBondContact O-N 2.74Å
297	I	95.2	Very high	95.7	Very high	9 Å²	9	44.6 Å²	44.6	5%	0.046	21%	0.211	C	C	.	.	H	α-helix	trans	-73.6	-43.4	177.2	-56.4	-179.7	0	0	0	110.1	P243 R244 A247 A291 Q294 P295 N299 R300 L301	P243-I297 HydrophobicContact CB-CD1 4.18Å; P243-I297 HydrophobicContact CG-CD1 4.31Å; R244-I297 HydrophobicContact CB-CD1 3.99Å; R244-I297 HydrophobicContact CB-CG1 4.22Å; R244-I297 HydrophobicContact CG-CG1 4.43Å; A247-I297 HydrophobicContact CB-CG2 3.67Å; A291-I297 HydrophobicContact CB-CB 3.92Å; A291-I297 HydrophobicContact CB-CG2 3.48Å; A291-I297 VanDerWaalsContact CB-CG2 3.48Å; Q294-I297 HydrophobicContact CB-CB 4.3Å; Q294-I297 HydrophobicContact CB-CD1 4.03Å; Q294-I297 HydrophobicContact CB-CG1 4.12Å; Q294-I297 HydrophobicContact CG-CD1 4.47Å; Q294-I297 PolarHBondContact O-N 3.22Å; P295-I297 VanDerWaalsContact C-N 3.31Å; P295-I297 PolarHBondContact O-N 3.04Å; I297-N299 VanDerWaalsContact C-N 3.32Å; I297-N299 PolarHBondContact O-N 3.06Å; I297-R300 PolarHBondContact O-N 2.99Å; I297-R300 VanDerWaalsContact O-N 3.15Å; I297-L301 HydrophobicContact CG2-CD1 4.25Å; I297-L301 HydrophobicContact CG2-CG 4.42Å; I297-L301 WeakPolarHBondContact O-CG 3.31Å; I297-L301 PolarHBondContact O-N 2.95Å
298	L	97.4	Very high	95.4	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-58.7	-43.4	176.1	-69.1	168.4	0	0	0	111.4	A291 Q294 P295 R300 L301 A302 T317 M320 A321	A291-L298 HydrophobicContact CB-CD2 3.69Å; A291-L298 HydrophobicContact CB-CG 3.99Å; A291-L298 WeakPolarHBondContact O-CD1 3.13Å; A291-L298 VanDerWaalsContact O-CG 3.28Å; A291-L298 WeakPolarHBondContact O-CG 3.46Å; Q294-L298 PolarHBondContact O-N 2.89Å; P295-L298 PolarHBondContact O-N 3.44Å; L298-R300 VanDerWaalsContact C-N 3.32Å; L298-R300 PolarHBondContact O-N 3.11Å; L298-L301 PolarHBondContact O-N 2.87Å; L298-A302 WeakPolarHBondContact O-CB 3.44Å; L298-A302 PolarHBondContact O-N 3Å; L298-T317 HydrophobicContact CB-CG2 4.04Å; L298-T317 HydrophobicContact CD2-CG2 3.79Å; L298-T317 VanDerWaalsContact O-CG2 3.22Å; L298-T317 WeakPolarHBondContact O-CG2 3.29Å; L298-M320 HydrophobicContact CD1-CB 4.25Å; L298-A321 HydrophobicContact CB-CB 3.78Å; L298-A321 HydrophobicContact CD1-CB 4.18Å
299	N	95.6	Very high	95.1	Very high	8 Å²	8	46.3 Å²	46.3	4%	0.043	23%	0.228	C	C	.	.	H	α-helix	trans	-60.5	-42	175.6	-70.5	-18.5	0	0	0	112	P295 I297 A302 K303 A321 N331 Q333 A334	P295-N299 WeakPolarHBondContact O-CB 3.2Å; P295-N299 PolarHBondContact O-N 3.21Å; P295-N299 PolarHBondContact O-ND2 3.43Å; I297-N299 VanDerWaalsContact C-N 3.32Å; I297-N299 PolarHBondContact O-N 3.06Å; N299-A302 PolarHBondContact O-N 2.82Å; N299-K303 WeakPolarHBondContact O-CB 3.36Å; N299-K303 PolarHBondContact O-N 3.3Å; N299-A321 WeakPolarHBondContact OD1-CB 3.39Å; N299-N331 PolarHBondContact ND2-OD1 2.84Å; N299-Q333 HydrophobicContact CB-CB 4.23Å; N299-A334 VanDerWaalsContact OD1-CB 3.3Å; N299-A334 WeakPolarHBondContact OD1-CB 3.48Å
300	R	94.1	Very high	94.9	Very high	103 Å²	103	42.8 Å²	42.8	39%	0.389	21%	0.211	S	C	.	.	H	α-helix	trans	-65.6	-42.9	176.6	-172.5	62.1	-179.5	-163.3	0.5	111.8	L248 P296 I297 L298 K303 I304	L248-R300 HydrophobicContact CD1-CG 4.12Å; L248-R300 HydrophobicContact CD2-CB 4.34Å; L248-R300 HydrophobicContact CD2-CG 3.74Å; P296-R300 PolarHBondContact O-N 2.74Å; I297-R300 PolarHBondContact O-N 2.99Å; I297-R300 VanDerWaalsContact O-N 3.15Å; L298-R300 VanDerWaalsContact C-N 3.32Å; L298-R300 PolarHBondContact O-N 3.11Å; R300-K303 PolarHBondContact O-N 2.98Å; R300-I304 HydrophobicContact CG-CD1 4.34Å; R300-I304 WeakPolarHBondContact O-CG1 3.46Å; R300-I304 PolarHBondContact O-N 3.15Å
301	L	96.9	Very high	94.8	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.1	-46	175.6	-73.1	174.5	0	0	0	111.7	L248 C251 A287 A291 I297 L298 K303 I304 F305 T317	L248-L301 HydrophobicContact CD2-CD2 3.88Å; L248-L301 HydrophobicContact CD2-CG 4.34Å; C251-L301 HydrophobicContact CB-CD2 3.61Å; A287-L301 HydrophobicContact CB-CD1 4.27Å; A287-L301 HydrophobicContact CB-CD2 4.1Å; A291-L301 HydrophobicContact CB-CD1 3.64Å; I297-L301 HydrophobicContact CG2-CD1 4.25Å; I297-L301 HydrophobicContact CG2-CG 4.42Å; I297-L301 WeakPolarHBondContact O-CG 3.31Å; I297-L301 PolarHBondContact O-N 2.95Å; L298-L301 PolarHBondContact O-N 2.87Å; L301-K303 VanDerWaalsContact C-N 3.29Å; L301-K303 PolarHBondContact O-N 3.1Å; L301-I304 PolarHBondContact O-N 3.41Å; L301-I304 VanDerWaalsContact O-N 3.09Å; L301-F305 HydrophobicContact CB-CD2 4.49Å; L301-F305 HydrophobicContact CB-CE2 4.13Å; L301-F305 VanDerWaalsContact O-CD2 3.27Å; L301-F305 WeakPolarHBondContact O-CD2 3.4Å; L301-F305 WeakPolarHBondContact O-CG 3.48Å; L301-F305 PolarHBondContact O-N 3.04Å; L301-T317 HydrophobicContact CB-CG2 4.09Å
302	A	97.4	Very high	94.7	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-58.2	-42.8	177.4	0	0	0	0	0	111.7	L298 N299 F305 Y306 T317 C318 T337	L298-A302 WeakPolarHBondContact O-CB 3.44Å; L298-A302 PolarHBondContact O-N 3Å; N299-A302 PolarHBondContact O-N 2.82Å; A302-F305 PolarHBondContact O-N 2.79Å; A302-Y306 WeakPolarHBondContact O-CB 3.49Å; A302-Y306 PolarHBondContact O-N 3.49Å; A302-T317 HydrophobicContact CB-CG2 4.02Å; A302-C318 VanDerWaalsContact CB-SG 3.54Å; A302-T337 HydrophobicContact CB-CG2 4.23Å
303	K	95.1	Very high	94.7	Very high	79 Å²	79	48.7 Å²	48.7	34%	0.343	24%	0.244	S	C	.	.	H	α-helix	trans	-62.5	-41.9	174.7	-174.9	171.4	-178.8	176.6	0	112	N299 R300 L301 Y306 F307	N299-K303 WeakPolarHBondContact O-CB 3.36Å; N299-K303 PolarHBondContact O-N 3.3Å; R300-K303 PolarHBondContact O-N 2.98Å; L301-K303 VanDerWaalsContact C-N 3.29Å; L301-K303 PolarHBondContact O-N 3.1Å; K303-Y306 PolarHBondContact O-N 3.48Å; K303-F307 HydrophobicContact CD-CE2 4.2Å; K303-F307 HydrophobicContact CG-CD2 3.99Å; K303-F307 HydrophobicContact CG-CE2 3.55Å; K303-F307 HydrophobicContact CG-CZ 4.49Å; K303-F307 WeakPolarHBondContact O-CD2 3.42Å; K303-F307 PolarHBondContact O-N 3.19Å; K303-F307 VanDerWaalsContact O-N 3.1Å
304	I	94.8	Very high	94.8	Very high	16 Å²	16	43.2 Å²	43.2	8%	0.082	22%	0.215	C	C	.	.	H	α-helix	trans	-63.9	-47.4	174.9	-67.2	165.8	0	0	0	110.6	L248 Y252 R300 L301 Y306 F307 L308	L248-I304 HydrophobicContact CD2-CD1 3.68Å; Y252-I304 HydrophobicContact CE1-CD1 4.23Å; R300-I304 HydrophobicContact CG-CD1 4.34Å; R300-I304 WeakPolarHBondContact O-CG1 3.46Å; R300-I304 PolarHBondContact O-N 3.15Å; L301-I304 PolarHBondContact O-N 3.41Å; L301-I304 VanDerWaalsContact O-N 3.09Å; I304-Y306 VanDerWaalsContact C-N 3.3Å; I304-Y306 PolarHBondContact O-N 2.85Å; I304-F307 PolarHBondContact O-N 3.07Å; I304-F307 VanDerWaalsContact O-N 3.08Å; I304-L308 HydrophobicContact CG2-CD1 3.85Å; I304-L308 HydrophobicContact CG2-CG 4.19Å; I304-L308 WeakPolarHBondContact O-CG 3.39Å; I304-L308 PolarHBondContact O-N 3.08Å
305	F	96.7	Very high	94.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-59.9	-40	177.5	-67.4	-41.4	0	0	0	112.7	F284 I288 L301 A302 F307 L308 G309 K310 M313 A314	F284-F305 HydrophobicContact CB-CE1 4.1Å; F284-F305 HydrophobicContact CB-CZ 4.03Å; F284-F305 AromaticContact CD1-CE1 3.46Å; F284-F305 HydrophobicContact CD1-CE1 3.46Å; F284-F305 VanDerWaalsContact CD1-CE1 3.46Å; F284-F305 HydrophobicContact CD1-CZ 4.07Å; F284-F305 AromaticContact CE1-CE1 3.97Å; F284-F305 HydrophobicContact CE1-CE1 3.97Å; F284-F305 AromaticContact CG-CE1 3.83Å; F284-F305 HydrophobicContact CG-CE1 3.83Å; F284-F305 HydrophobicContact CG-CZ 4.26Å; I288-F305 HydrophobicContact CD1-CE2 3.93Å; I288-F305 HydrophobicContact CD1-CZ 4.21Å; I288-F305 HydrophobicContact CG1-CE2 4.04Å; I288-F305 HydrophobicContact CG1-CZ 4.32Å; L301-F305 HydrophobicContact CB-CD2 4.49Å; L301-F305 HydrophobicContact CB-CE2 4.13Å; L301-F305 VanDerWaalsContact O-CD2 3.27Å; L301-F305 WeakPolarHBondContact O-CD2 3.4Å; L301-F305 WeakPolarHBondContact O-CG 3.48Å; L301-F305 PolarHBondContact O-N 3.04Å; A302-F305 PolarHBondContact O-N 2.79Å; F305-F307 VanDerWaalsContact C-N 3.34Å; F305-F307 PolarHBondContact O-N 3.3Å; F305-L308 CarbonylContact O-C 3.56Å; F305-L308 PolarHBondContact O-N 3.14Å; F305-G309 PolarHBondContact O-N 3.03Å; F305-K310 HydrophobicContact CB-CB 4.13Å; F305-K310 HydrophobicContact CD1-CB 4.41Å; F305-K310 HydrophobicContact CD1-CD 4.04Å; F305-K310 PolarHBondContact O-N 3.41Å; F305-M313 HydrophobicContact CB-CB 4.41Å; F305-M313 HydrophobicContact CD1-CB 4.43Å; F305-M313 HydrophobicContact CD2-CB 4.02Å; F305-M313 HydrophobicContact CE1-SD 4.24Å; F305-M313 HydrophobicContact CE2-CB 4.38Å; F305-M313 HydrophobicContact CG-CB 4.06Å; F305-M313 HydrophobicContact CZ-SD 4.46Å; F305-A314 HydrophobicContact CB-CB 3.7Å
306	Y	95.4	Very high	95	Very high	46 Å²	46	42.3 Å²	42.3	18%	0.18	22%	0.218	C	C	.	.	H	α-helix	trans	-58.9	-44.2	172.9	170.5	-107.5	0	0	0	112.1	A302 K303 I304 L308 G309 K340 I341 R344	A302-Y306 WeakPolarHBondContact O-CB 3.49Å; A302-Y306 PolarHBondContact O-N 3.49Å; K303-Y306 PolarHBondContact O-N 3.48Å; I304-Y306 VanDerWaalsContact C-N 3.3Å; I304-Y306 PolarHBondContact O-N 2.85Å; Y306-L308 VanDerWaalsContact C-N 3.35Å; Y306-G309 PolarHBondContact O-N 2.93Å; Y306-K340 HydrophobicContact CE2-CB 4.5Å; Y306-I341 HydrophobicContact CD2-CB 4.43Å; Y306-I341 HydrophobicContact CD2-CG1 3.53Å; Y306-I341 HydrophobicContact CE2-CG1 4.18Å; Y306-I341 HydrophobicContact CG-CG1 4.25Å; Y306-R344 HydrophobicContact CE2-CB 4.2Å; Y306-R344 PolarHBondContact O-NH1 3.33Å
307	F	91.7	Very high	95.2	Very high	134 Å²	134	39.2 Å²	39.2	59%	0.588	20%	0.199	S	C	*	.	H	α-helix	trans	-67.5	-33.5	176.3	-74.3	-56.5	0	0	0	113.2	K303 I304 F305 G309	K303-F307 HydrophobicContact CD-CE2 4.2Å; K303-F307 HydrophobicContact CG-CD2 3.99Å; K303-F307 HydrophobicContact CG-CE2 3.55Å; K303-F307 HydrophobicContact CG-CZ 4.49Å; K303-F307 WeakPolarHBondContact O-CD2 3.42Å; K303-F307 PolarHBondContact O-N 3.19Å; K303-F307 VanDerWaalsContact O-N 3.1Å; I304-F307 PolarHBondContact O-N 3.07Å; I304-F307 VanDerWaalsContact O-N 3.08Å; F305-F307 VanDerWaalsContact C-N 3.34Å; F305-F307 PolarHBondContact O-N 3.3Å; F307-G309 PolarHBondContact O-N 3.28Å
308	L	91.1	Very high	95.4	Very high	34 Å²	34	38.8 Å²	38.8	18%	0.178	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	4.9	175	-64.1	178.7	0	0	0	113.8	M255 I304 F305 Y306 K310	M255-L308 HydrophobicContact CB-CD1 4.21Å; M255-L308 HydrophobicContact CG-CD1 4.25Å; M255-L308 HydrophobicContact CG-CD2 3.82Å; M255-L308 HydrophobicContact SD-CD2 3.74Å; I304-L308 HydrophobicContact CG2-CD1 3.85Å; I304-L308 HydrophobicContact CG2-CG 4.19Å; I304-L308 WeakPolarHBondContact O-CG 3.39Å; I304-L308 PolarHBondContact O-N 3.08Å; F305-L308 CarbonylContact O-C 3.56Å; F305-L308 PolarHBondContact O-N 3.14Å; Y306-L308 VanDerWaalsContact C-N 3.35Å; L308-K310 HydrophobicContact CB-CD 3.99Å; L308-K310 HydrophobicContact CB-CG 4.2Å; L308-K310 HydrophobicContact CD1-CD 4.25Å; L308-K310 PolarHBondContact O-N 3.43Å
309	G	91.3	Very high	95.4	Very high	32 Å²	32	41.5 Å²	41.5	33%	0.33	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	8.4	-177.5	0	0	0	0	0	114.5	F305 Y306 F307 Q311	F305-G309 PolarHBondContact O-N 3.03Å; Y306-G309 PolarHBondContact O-N 2.93Å; F307-G309 PolarHBondContact O-N 3.28Å; G309-Q311 VanDerWaalsContact C-N 3.29Å; G309-Q311 PolarHBondContact O-N 2.85Å
310	K	93.5	Very high	95.5	Very high	33 Å²	33	44.2 Å²	44.2	14%	0.143	22%	0.224	C	C	.	.			trans	-85	65.5	-177.8	-70.4	170.5	-176.1	-62.1	0	111	E258 F284 F305 L308 D312 M313 A314	E258-K310 IonicContact OE1-NZ 2.76Å; E258-K310 PolarHBondContact OE1-NZ 2.82Å; E258-K310 WeakPolarHBondContact OE2-CE 3.36Å; E258-K310 IonicContact OE2-NZ 3.38Å; E258-K310 PolarHBondContact OE2-NZ 2.65Å; F284-K310 HydrophobicContact CE2-CD 4.1Å; F284-K310 HydrophobicContact CZ-CD 4.15Å; F305-K310 HydrophobicContact CB-CB 4.13Å; F305-K310 HydrophobicContact CD1-CB 4.41Å; F305-K310 HydrophobicContact CD1-CD 4.04Å; F305-K310 PolarHBondContact O-N 3.41Å; L308-K310 HydrophobicContact CB-CD 3.99Å; L308-K310 HydrophobicContact CB-CG 4.2Å; L308-K310 HydrophobicContact CD1-CD 4.25Å; L308-K310 PolarHBondContact O-N 3.43Å; K310-D312 PolarHBondContact O-N 3.1Å; K310-M313 HydrophobicContact CB-CB 4.36Å; K310-M313 HydrophobicContact CB-CE 3.91Å; K310-M313 HydrophobicContact CD-CE 3.52Å; K310-M313 HydrophobicContact CD-SD 4.48Å; K310-M313 HydrophobicContact CG-CE 3.74Å; K310-M313 PolarHBondContact O-N 3.39Å; K310-A314 WeakPolarHBondContact O-CB 3.27Å; K310-A314 PolarHBondContact O-N 3.27Å
311	Q	94	Very high	95.7	Very high	63 Å²	63	39.3 Å²	39.3	29%	0.294	21%	0.206	S	C	.	.	H	α-helix	trans	-57.2	-47.5	-169.8	-65	-176.2	-8.5	0	0	113.4	G309 M313 A314 I315 I341	G309-Q311 VanDerWaalsContact C-N 3.29Å; G309-Q311 PolarHBondContact O-N 2.85Å; Q311-M313 PolarHBondContact O-N 3.36Å; Q311-A314 WeakPolarHBondContact O-CB 3.26Å; Q311-A314 PolarHBondContact O-N 2.87Å; Q311-A314 VanDerWaalsContact O-N 3.14Å; Q311-I315 WeakPolarHBondContact O-CG1 3.28Å; Q311-I315 PolarHBondContact O-N 2.9Å; Q311-I341 HydrophobicContact CB-CG2 4.18Å; Q311-I341 HydrophobicContact CG-CG2 4.34Å
312	D	94.4	Very high	95.7	Very high	142 Å²	142	39.9 Å²	39.9	76%	0.759	21%	0.208	S	C	*	.	H	α-helix	trans	-62.1	-43.8	-178.4	-64.4	-33	0	0	0	112.5	K310 A314 I315 G316	K310-D312 PolarHBondContact O-N 3.1Å; D312-A314 VanDerWaalsContact C-N 3.33Å; D312-I315 PolarHBondContact O-N 3.18Å; D312-G316 PolarHBondContact O-N 3.45Å
313	M	95.9	Very high	95.7	Very high	52 Å²	52	46.5 Å²	46.5	26%	0.256	24%	0.244	S	C	.	.	H	α-helix	trans	-64.4	-40.1	174.9	-75.2	-172.1	-101	0	0	111.4	L281 F284 F305 K310 Q311 G316 T317	L281-M313 HydrophobicContact CD2-CE 4.07Å; F284-M313 HydrophobicContact CB-SD 4.06Å; F284-M313 HydrophobicContact CD2-CE 4.11Å; F284-M313 HydrophobicContact CD2-SD 4.05Å; F284-M313 HydrophobicContact CG-SD 4.24Å; F305-M313 HydrophobicContact CB-CB 4.41Å; F305-M313 HydrophobicContact CD1-CB 4.43Å; F305-M313 HydrophobicContact CD2-CB 4.02Å; F305-M313 HydrophobicContact CE1-SD 4.24Å; F305-M313 HydrophobicContact CE2-CB 4.38Å; F305-M313 HydrophobicContact CG-CB 4.06Å; F305-M313 HydrophobicContact CZ-SD 4.46Å; K310-M313 HydrophobicContact CB-CB 4.36Å; K310-M313 HydrophobicContact CB-CE 3.91Å; K310-M313 HydrophobicContact CD-CE 3.52Å; K310-M313 HydrophobicContact CD-SD 4.48Å; K310-M313 HydrophobicContact CG-CE 3.74Å; K310-M313 PolarHBondContact O-N 3.39Å; Q311-M313 PolarHBondContact O-N 3.36Å; M313-G316 PolarHBondContact O-N 2.74Å; M313-T317 VanDerWaalsContact O-CB 3.29Å; M313-T317 WeakPolarHBondContact O-CB 3.46Å; M313-T317 PolarHBondContact O-N 3Å; M313-T317 PolarHBondContact O-OG1 2.83Å
314	A	97.1	Very high	95.8	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.4	-45.7	178.3	0	0	0	0	0	111.6	F305 K310 Q311 D312 T317 C318 I341	F305-A314 HydrophobicContact CB-CB 3.7Å; K310-A314 WeakPolarHBondContact O-CB 3.27Å; K310-A314 PolarHBondContact O-N 3.27Å; Q311-A314 WeakPolarHBondContact O-CB 3.26Å; Q311-A314 PolarHBondContact O-N 2.87Å; Q311-A314 VanDerWaalsContact O-N 3.14Å; D312-A314 VanDerWaalsContact C-N 3.33Å; A314-T317 PolarHBondContact O-N 3.22Å; A314-C318 PolarHBondContact O-N 3.37Å; A314-C318 PolarHBondContact O-SG 3.2Å; A314-I341 HydrophobicContact CB-CD1 3.47Å; A314-I341 VanDerWaalsContact CB-CD1 3.47Å; A314-I341 HydrophobicContact CB-CG1 4.29Å
315	I	97.1	Very high	95.9	Very high	41 Å²	41	47.7 Å²	47.7	21%	0.21	26%	0.256	C	S	.	.	H	α-helix	trans	-63.3	-48.8	175.9	-65.7	176	0	0	0	110.4	Q311 D312 T317 C318 N319 I341	Q311-I315 WeakPolarHBondContact O-CG1 3.28Å; Q311-I315 PolarHBondContact O-N 2.9Å; D312-I315 PolarHBondContact O-N 3.18Å; I315-T317 VanDerWaalsContact C-N 3.29Å; I315-T317 PolarHBondContact O-N 2.88Å; I315-C318 WeakPolarHBondContact O-CB 3.44Å; I315-C318 PolarHBondContact O-N 3.42Å; I315-N319 VanDerWaalsContact O-CG 3.29Å; I315-N319 PolarHBondContact O-N 3Å; I315-N319 PolarHBondContact O-ND2 2.79Å; I315-I341 HydrophobicContact CD1-CG2 3.75Å; I315-I341 HydrophobicContact CG1-CB 4.23Å; I315-I341 HydrophobicContact CG1-CD1 3.96Å; I315-I341 HydrophobicContact CG1-CG2 3.64Å
316	G	97.2	Very high	95.9	Very high	31 Å²	31	54.8 Å²	54.8	32%	0.32	29%	0.289	S	S	.	.	H	α-helix	trans	-56.8	-43.6	178.2	0	0	0	0	0	112.1	D312 M313 N319 M320	D312-G316 PolarHBondContact O-N 3.45Å; M313-G316 PolarHBondContact O-N 2.74Å; G316-N319 PolarHBondContact O-N 3.16Å; G316-M320 WeakPolarHBondContact O-CG 3.46Å; G316-M320 PolarHBondContact O-N 3.09Å
317	T	97.9	Very high	95.9	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.006	30%	0.299	C	S	.	.	H	α-helix	trans	-67.7	-38.5	177.9	-51.5	0	0	0	0	112.1	L298 L301 A302 M313 A314 I315 M320 A321	L298-T317 HydrophobicContact CB-CG2 4.04Å; L298-T317 HydrophobicContact CD2-CG2 3.79Å; L298-T317 VanDerWaalsContact O-CG2 3.22Å; L298-T317 WeakPolarHBondContact O-CG2 3.29Å; L301-T317 HydrophobicContact CB-CG2 4.09Å; A302-T317 HydrophobicContact CB-CG2 4.02Å; M313-T317 VanDerWaalsContact O-CB 3.29Å; M313-T317 WeakPolarHBondContact O-CB 3.46Å; M313-T317 PolarHBondContact O-N 3Å; M313-T317 PolarHBondContact O-OG1 2.83Å; A314-T317 PolarHBondContact O-N 3.22Å; I315-T317 VanDerWaalsContact C-N 3.29Å; I315-T317 PolarHBondContact O-N 2.88Å; T317-M320 PolarHBondContact O-N 2.96Å; T317-A321 PolarHBondContact O-N 2.95Å
318	C	97.8	Very high	96	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-62	-44.5	172.7	-67.9	0	0	0	0	111.3	A302 A314 I315 M320 A321 L322 R338	A302-C318 VanDerWaalsContact CB-SG 3.54Å; A314-C318 PolarHBondContact O-N 3.37Å; A314-C318 PolarHBondContact O-SG 3.2Å; I315-C318 WeakPolarHBondContact O-CB 3.44Å; I315-C318 PolarHBondContact O-N 3.42Å; C318-M320 VanDerWaalsContact C-N 3.35Å; C318-M320 PolarHBondContact O-N 3.31Å; C318-A321 WeakPolarHBondContact O-CB 3.05Å; C318-A321 PolarHBondContact O-N 3.02Å; C318-L322 WeakPolarHBondContact O-CG 3.13Å; C318-L322 PolarHBondContact O-N 3.07Å; C318-R338 HydrophobicContact CB-CB 3.99Å; C318-R338 HydrophobicContact CB-CG 4.42Å
319	N	97.9	Very high	96	Very high	56 Å²	56	55 Å²	55	30%	0.299	30%	0.296	S	S	.	.	H	α-helix	trans	-61.6	-44.5	178.4	-67.5	-19	0	0	0	111	I315 G316 A321 L322 D323 R338	I315-N319 VanDerWaalsContact O-CG 3.29Å; I315-N319 PolarHBondContact O-N 3Å; I315-N319 PolarHBondContact O-ND2 2.79Å; G316-N319 PolarHBondContact O-N 3.16Å; N319-A321 VanDerWaalsContact C-N 3.31Å; N319-A321 PolarHBondContact O-N 3.38Å; N319-L322 PolarHBondContact O-N 3.02Å; N319-L322 VanDerWaalsContact O-N 3.14Å; N319-D323 WeakPolarHBondContact O-CB 3.2Å; N319-D323 PolarHBondContact O-N 3.05Å; N319-R338 WeakPolarHBondContact OD1-CD 3.33Å; N319-R338 PolarHBondContact OD1-NH1 2.98Å
320	M	97.8	Very high	96	Very high	66 Å²	66	59.2 Å²	59.2	33%	0.325	31%	0.311	S	S	.	.	H	α-helix	trans	-58.9	-41.5	174	-69.3	177.5	69.6	0	0	112.4	I288 K292 L298 G316 T317 C318 L322 D323 V324	I288-M320 HydrophobicContact CG2-CE 3.67Å; I288-M320 HydrophobicContact CG2-SD 3.64Å; K292-M320 HydrophobicContact CB-CE 4.15Å; L298-M320 HydrophobicContact CD1-CB 4.25Å; G316-M320 WeakPolarHBondContact O-CG 3.46Å; G316-M320 PolarHBondContact O-N 3.09Å; T317-M320 PolarHBondContact O-N 2.96Å; C318-M320 VanDerWaalsContact C-N 3.35Å; C318-M320 PolarHBondContact O-N 3.31Å; M320-L322 VanDerWaalsContact C-N 3.3Å; M320-L322 PolarHBondContact O-N 2.57Å; M320-D323 PolarHBondContact O-N 3.41Å; M320-V324 WeakPolarHBondContact O-CG2 3.44Å; M320-V324 PolarHBondContact O-N 3.15Å; M320-V324 VanDerWaalsContact O-N 3.15Å
321	A	97.9	Very high	96.1	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-62.1	-40.2	176.9	0	0	0	0	0	111.9	L298 N299 T317 C318 N319 V324 L325 N331 A334	L298-A321 HydrophobicContact CB-CB 3.78Å; L298-A321 HydrophobicContact CD1-CB 4.18Å; N299-A321 WeakPolarHBondContact OD1-CB 3.39Å; T317-A321 PolarHBondContact O-N 2.95Å; C318-A321 WeakPolarHBondContact O-CB 3.05Å; C318-A321 PolarHBondContact O-N 3.02Å; N319-A321 VanDerWaalsContact C-N 3.31Å; N319-A321 PolarHBondContact O-N 3.38Å; A321-V324 PolarHBondContact O-N 3.34Å; A321-L325 PolarHBondContact O-N 2.89Å; A321-N331 PolarHBondContact O-ND2 3.28Å; A321-N331 VanDerWaalsContact O-ND2 3.14Å; A321-A334 HydrophobicContact CB-CB 4.17Å
322	L	97.4	Very high	96	Very high	11 Å²	11	58 Å²	58	6%	0.058	30%	0.303	C	S	.	.	H	α-helix	trans	-74	-32.8	179	-68.2	171.6	0	0	0	113	C318 N319 M320 V324 L325 Q326 A334 Y335 R338	C318-L322 WeakPolarHBondContact O-CG 3.13Å; C318-L322 PolarHBondContact O-N 3.07Å; N319-L322 PolarHBondContact O-N 3.02Å; N319-L322 VanDerWaalsContact O-N 3.14Å; M320-L322 VanDerWaalsContact C-N 3.3Å; M320-L322 PolarHBondContact O-N 2.57Å; L322-V324 VanDerWaalsContact C-N 3.26Å; L322-V324 PolarHBondContact O-N 3.43Å; L322-L325 CarbonylContact O-C 3.57Å; L322-L325 VanDerWaalsContact O-C 3.3Å; L322-Q326 WeakPolarHBondContact O-CA 3.19Å; L322-Q326 PolarHBondContact O-N 3.24Å; L322-A334 HydrophobicContact CD1-CB 4.33Å; L322-A334 HydrophobicContact CD2-CB 3.63Å; L322-A334 HydrophobicContact CG-CB 3.73Å; L322-Y335 HydrophobicContact CD1-CE1 4.41Å; L322-Y335 HydrophobicContact CD2-CD1 4.46Å; L322-Y335 HydrophobicContact CD2-CD2 3.58Å; L322-Y335 HydrophobicContact CD2-CE1 4.17Å; L322-Y335 HydrophobicContact CD2-CE2 3.2Å; L322-Y335 HydrophobicContact CD2-CG 4.2Å; L322-R338 VanDerWaalsContact CD1-NH1 3.26Å
323	D	97.4	Very high	95.9	Very high	140 Å²	140	53.1 Å²	53.1	75%	0.749	28%	0.275	S	S	*	.	H	α-helix	trans	-64.9	-33.5	173.2	-69.7	-21.5	0	0	0	111.2	N319 M320	N319-D323 WeakPolarHBondContact O-CB 3.2Å; N319-D323 PolarHBondContact O-N 3.05Å; M320-D323 PolarHBondContact O-N 3.41Å
324	V	97.2	Very high	96	Very high	68 Å²	68	50.6 Å²	50.6	41%	0.412	26%	0.263	S	S	.	.	H	α-helix	trans	-80	-43.2	175.7	177.3	0	0	0	0	111.9	K292 P295 M320 A321 L322	K292-V324 WeakPolarHBondContact O-CG2 3.25Å; P295-V324 HydrophobicContact CG-CB 4.06Å; P295-V324 HydrophobicContact CG-CG1 3.62Å; M320-V324 WeakPolarHBondContact O-CG2 3.44Å; M320-V324 PolarHBondContact O-N 3.15Å; M320-V324 VanDerWaalsContact O-N 3.15Å; A321-V324 PolarHBondContact O-N 3.34Å; L322-V324 VanDerWaalsContact C-N 3.26Å; L322-V324 PolarHBondContact O-N 3.43Å
325	L	96.5	Very high	96	Very high	52 Å²	52	51.5 Å²	51.5	27%	0.272	27%	0.267	S	S	.	.			trans	-139	96	-179.1	-178.4	62.1	0	0	0	110.5	P295 A321 L322 D327 L330 N331	P295-L325 HydrophobicContact CB-CB 4.19Å; P295-L325 HydrophobicContact CB-CD2 4.35Å; P295-L325 HydrophobicContact CG-CB 3.64Å; P295-L325 HydrophobicContact CG-CD2 4.24Å; A321-L325 PolarHBondContact O-N 2.89Å; L322-L325 CarbonylContact O-C 3.57Å; L322-L325 VanDerWaalsContact O-C 3.3Å; L325-D327 HydrophobicContact CD1-CB 4.31Å; L325-L330 HydrophobicContact CD1-CB 4.4Å; L325-L330 HydrophobicContact CD1-CD1 4.34Å; L325-L330 HydrophobicContact CD2-CB 3.89Å; L325-L330 HydrophobicContact CG-CB 4.4Å; L325-N331 HydrophobicContact CB-CB 4.38Å; L325-N331 HydrophobicContact CD2-CB 3.93Å; L325-N331 HydrophobicContact CG-CB 3.92Å; L325-N331 WeakPolarHBondContact O-CB 3.39Å; L325-N331 PolarHBondContact O-ND2 3.29Å
326	Q	96.6	Very high	95.9	Very high	149 Å²	149	50.2 Å²	50.2	70%	0.696	26%	0.261	S	S	*	.			trans	-79.4	-22.3	-177	-169	177.5	10.7	0	0	113.2	L322 P328 Y335	L322-Q326 WeakPolarHBondContact O-CA 3.19Å; L322-Q326 PolarHBondContact O-N 3.24Å; Q326-P328 WeakPolarHBondContact O-CD 3.47Å; Q326-P328 VanDerWaalsContact O-N 3.11Å; Q326-Y335 PolarHBondContact O-OH 2.99Å
327	D	95.8	Very high	95.9	Very high	73 Å²	73	49.7 Å²	49.7	39%	0.39	25%	0.252	S	S	.	.			trans	-59.9	114.7	-175.1	-168.3	-28.6	0	0	0	111.3	L325 E329 L330 N331	L325-D327 HydrophobicContact CD1-CB 4.31Å; D327-E329 PolarHBondContact O-N 3.1Å; D327-E329 WeakPolarHBondContact OD1-CB 3.29Å; D327-E329 PolarHBondContact OD1-N 2.89Å; D327-L330 HydrophobicContact CB-CB 4.34Å; D327-L330 HydrophobicContact CB-CD1 4.35Å; D327-L330 HydrophobicContact CB-CG 4.38Å; D327-L330 PolarHBondContact O-N 3.22Å; D327-N331 WeakPolarHBondContact O-CB 3.18Å; D327-N331 PolarHBondContact O-N 3.25Å
328	P	93.3	Very high	95.9	Very high	15 Å²	15	51.9 Å²	51.9	10%	0.097	26%	0.26	C	S	.	.	H	α-helix	trans	-63.1	-26.7	-179	-22.4	34.8	0	0	0	113.4	Q326 L330 W332 Y335 E375 V379	Q326-P328 WeakPolarHBondContact O-CD 3.47Å; Q326-P328 VanDerWaalsContact O-N 3.11Å; P328-L330 VanDerWaalsContact C-N 3.35Å; P328-W332 WeakPolarHBondContact O-CA 3.27Å; P328-W332 VanDerWaalsContact O-CB 3.27Å; P328-W332 WeakPolarHBondContact O-CB 3.34Å; P328-W332 PolarHBondContact O-N 3.47Å; P328-Y335 HydrophobicContact CB-CD2 4.27Å; P328-Y335 HydrophobicContact CB-CE2 3.94Å; P328-Y335 HydrophobicContact CG-CE2 3.88Å; P328-E375 HydrophobicContact CB-CB 4.25Å; P328-E375 HydrophobicContact CG-CB 4.11Å; P328-V379 HydrophobicContact CB-CG2 3.89Å
329	E	92.2	Very high	95.9	Very high	130 Å²	130	51.9 Å²	51.9	61%	0.607	26%	0.26	S	S	*	.	H	α-helix	trans	-69	-38.3	179.2	-170.2	173.4	169.5	0	0	110.8	D327 V379	D327-E329 PolarHBondContact O-N 3.1Å; D327-E329 WeakPolarHBondContact OD1-CB 3.29Å; D327-E329 PolarHBondContact OD1-N 2.89Å; E329-V379 HydrophobicContact CB-CB 4.25Å; E329-V379 HydrophobicContact CB-CG2 4.45Å
330	L	91.6	Very high	95.8	Very high	120 Å²	120	52.5 Å²	52.5	63%	0.628	26%	0.26	S	S	*	.	H	α-helix	trans	-91.7	-19	-178.5	-56.9	178.1	0	0	0	113.3	L325 D327 P328	L325-L330 HydrophobicContact CD1-CB 4.4Å; L325-L330 HydrophobicContact CD1-CD1 4.34Å; L325-L330 HydrophobicContact CD2-CB 3.89Å; L325-L330 HydrophobicContact CG-CB 4.4Å; D327-L330 HydrophobicContact CB-CB 4.34Å; D327-L330 HydrophobicContact CB-CD1 4.35Å; D327-L330 HydrophobicContact CB-CG 4.38Å; D327-L330 PolarHBondContact O-N 3.22Å; P328-L330 VanDerWaalsContact C-N 3.35Å
331	N	94.1	Very high	95.8	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.011	25%	0.245	C	C	.	.	H	α-helix	trans	-133.7	31.2	-174.5	-159.3	13	0	0	0	114.5	N299 A321 L325 D327 Q333 A334	N299-N331 PolarHBondContact ND2-OD1 2.84Å; A321-N331 PolarHBondContact O-ND2 3.28Å; A321-N331 VanDerWaalsContact O-ND2 3.14Å; L325-N331 HydrophobicContact CB-CB 4.38Å; L325-N331 HydrophobicContact CD2-CB 3.93Å; L325-N331 HydrophobicContact CG-CB 3.92Å; L325-N331 WeakPolarHBondContact O-CB 3.39Å; L325-N331 PolarHBondContact O-ND2 3.29Å; D327-N331 WeakPolarHBondContact O-CB 3.18Å; D327-N331 PolarHBondContact O-N 3.25Å; N331-Q333 PolarHBondContact O-N 3.43Å; N331-A334 PolarHBondContact O-N 2.91Å; N331-A334 VanDerWaalsContact O-N 3.13Å
332	W	93.5	Very high	95.8	Very high	68 Å²	68	50.5 Å²	50.5	26%	0.258	25%	0.25	S	C	.	.	H	α-helix	trans	-52.9	-29.1	178.1	62.6	-94.4	0	0	0	113.5	P328 A334 Y335 C336 V376 C380	P328-W332 WeakPolarHBondContact O-CA 3.27Å; P328-W332 VanDerWaalsContact O-CB 3.27Å; P328-W332 WeakPolarHBondContact O-CB 3.34Å; P328-W332 PolarHBondContact O-N 3.47Å; W332-A334 VanDerWaalsContact C-N 3.33Å; W332-A334 PolarHBondContact O-N 3.41Å; W332-Y335 PolarHBondContact O-N 3.03Å; W332-C336 HydrophobicContact CE3-CB 4.44Å; W332-C336 PolarHBondContact O-N 3.07Å; W332-C336 PolarHBondContact O-SG 3.02Å; W332-V376 HydrophobicContact CB-CG1 4.19Å; W332-V376 HydrophobicContact CB-CG2 4.21Å; W332-C380 HydrophobicContact CB-CB 4.45Å; W332-C380 HydrophobicContact CG-CB 4.46Å
333	Q	92.7	Very high	95.7	Very high	40 Å²	40	50.4 Å²	50.4	19%	0.187	25%	0.249	C	C	.	.	H	α-helix	trans	-61.7	-38.3	-179.5	-67.6	-179.3	6.4	0	0	112.8	N299 N331 T337	N299-Q333 HydrophobicContact CB-CB 4.23Å; N331-Q333 PolarHBondContact O-N 3.43Å; Q333-T337 WeakPolarHBondContact O-CB 3.47Å; Q333-T337 PolarHBondContact O-N 3.19Å; Q333-T337 PolarHBondContact O-OG1 2.89Å
334	A	96.2	Very high	95.6	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.8	-47.2	177.9	0	0	0	0	0	110.6	N299 A321 L322 N331 W332 T337 R338	N299-A334 VanDerWaalsContact OD1-CB 3.3Å; N299-A334 WeakPolarHBondContact OD1-CB 3.48Å; A321-A334 HydrophobicContact CB-CB 4.17Å; L322-A334 HydrophobicContact CD1-CB 4.33Å; L322-A334 HydrophobicContact CD2-CB 3.63Å; L322-A334 HydrophobicContact CG-CB 3.73Å; N331-A334 PolarHBondContact O-N 2.91Å; N331-A334 VanDerWaalsContact O-N 3.13Å; W332-A334 VanDerWaalsContact C-N 3.33Å; W332-A334 PolarHBondContact O-N 3.41Å; A334-T337 PolarHBondContact O-N 3.4Å; A334-R338 WeakPolarHBondContact O-CB 3.49Å; A334-R338 PolarHBondContact O-N 3.33Å
335	Y	97.4	Very high	95.5	Very high	19 Å²	19	45.5 Å²	45.5	8%	0.075	22%	0.215	C	C	.	.	H	α-helix	trans	-59	-50.8	175.4	-72.5	-81.7	0	0	0	111.9	L322 Q326 P328 W332 T337 R338 A339 D372 V376	L322-Y335 HydrophobicContact CD1-CE1 4.41Å; L322-Y335 HydrophobicContact CD2-CD1 4.46Å; L322-Y335 HydrophobicContact CD2-CD2 3.58Å; L322-Y335 HydrophobicContact CD2-CE1 4.17Å; L322-Y335 HydrophobicContact CD2-CE2 3.2Å; L322-Y335 HydrophobicContact CD2-CG 4.2Å; Q326-Y335 PolarHBondContact O-OH 2.99Å; P328-Y335 HydrophobicContact CB-CD2 4.27Å; P328-Y335 HydrophobicContact CB-CE2 3.94Å; P328-Y335 HydrophobicContact CG-CE2 3.88Å; W332-Y335 PolarHBondContact O-N 3.03Å; Y335-T337 VanDerWaalsContact C-N 3.33Å; Y335-T337 PolarHBondContact O-N 3.28Å; Y335-R338 PolarHBondContact O-N 3.38Å; Y335-A339 WeakPolarHBondContact O-CB 3.14Å; Y335-A339 PolarHBondContact O-N 3.04Å; Y335-D372 HydrophobicContact CD1-CB 4.01Å; Y335-D372 WeakPolarHBondContact CD1-OD1 3.13Å; Y335-V376 VanDerWaalsContact CB-CG2 3.41Å; Y335-V376 HydrophobicContact CG-CG2 4.17Å
336	C	95.7	Very high	95.5	Very high	14 Å²	14	43.1 Å²	43.1	10%	0.095	20%	0.202	C	C	.	.	H	α-helix	trans	-60.4	-41.6	178.2	-73.7	0	0	0	0	112.5	W332 K340	W332-C336 HydrophobicContact CE3-CB 4.44Å; W332-C336 PolarHBondContact O-N 3.07Å; W332-C336 PolarHBondContact O-SG 3.02Å; C336-K340 VanDerWaalsContact O-CG 3.32Å; C336-K340 WeakPolarHBondContact O-CG 3.49Å; C336-K340 PolarHBondContact O-N 3.36Å
337	T	96.4	Very high	95.3	Very high	19 Å²	19	37.8 Å²	37.8	12%	0.117	18%	0.178	C	C	.	.	H	α-helix	trans	-68.2	-44.1	-179.7	-55.6	0	0	0	0	110.8	A302 Q333 A334 Y335 K340 I341	A302-T337 HydrophobicContact CB-CG2 4.23Å; Q333-T337 WeakPolarHBondContact O-CB 3.47Å; Q333-T337 PolarHBondContact O-N 3.19Å; Q333-T337 PolarHBondContact O-OG1 2.89Å; A334-T337 PolarHBondContact O-N 3.4Å; Y335-T337 VanDerWaalsContact C-N 3.33Å; Y335-T337 PolarHBondContact O-N 3.28Å; T337-K340 PolarHBondContact O-N 3.37Å; T337-I341 HydrophobicContact CG2-CD1 4.35Å; T337-I341 WeakPolarHBondContact O-CG1 3.31Å; T337-I341 PolarHBondContact O-N 3.41Å; T337-I341 VanDerWaalsContact O-N 3.08Å
338	R	97.8	Very high	95.2	Very high	48 Å²	48	38.8 Å²	38.8	18%	0.181	18%	0.18	C	C	.	.	H	α-helix	trans	-63	-43.2	176.5	-168.4	169.6	68.1	-177.3	-0.4	112.2	C318 N319 L322 A334 Y335 K340 I341 H342 D372	C318-R338 HydrophobicContact CB-CB 3.99Å; C318-R338 HydrophobicContact CB-CG 4.42Å; N319-R338 WeakPolarHBondContact OD1-CD 3.33Å; N319-R338 PolarHBondContact OD1-NH1 2.98Å; L322-R338 VanDerWaalsContact CD1-NH1 3.26Å; A334-R338 WeakPolarHBondContact O-CB 3.49Å; A334-R338 PolarHBondContact O-N 3.33Å; Y335-R338 PolarHBondContact O-N 3.38Å; R338-K340 PolarHBondContact O-N 2.88Å; R338-I341 PolarHBondContact O-N 2.95Å; R338-H342 PolarHBondContact O-CD2 3.01Å; R338-H342 PolarHBondContact O-N 3.37Å; R338-H342 VanDerWaalsContact O-N 3.11Å; R338-D372 IonicContact CZ-OD1 3.53Å; R338-D372 IonicContact CZ-OD2 3.58Å; R338-D372 IonicContact NE-OD1 3.55Å; R338-D372 IonicContact NE-OD2 2.8Å; R338-D372 PolarHBondContact NE-OD2 2.96Å; R338-D372 IonicContact NH2-OD1 2.68Å; R338-D372 PolarHBondContact NH2-OD1 3.35Å; R338-D372 IonicContact NH2-OD2 3.51Å
339	A	97.8	Very high	95.1	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-58.6	-44.8	174	0	0	0	0	0	112.2	Y335 I341 H342 I343 A369 D372 L373	Y335-A339 WeakPolarHBondContact O-CB 3.14Å; Y335-A339 PolarHBondContact O-N 3.04Å; A339-I341 VanDerWaalsContact C-N 3.33Å; A339-I341 PolarHBondContact O-N 3.19Å; A339-H342 PolarHBondContact O-N 3.38Å; A339-I343 WeakPolarHBondContact O-CG1 3.09Å; A339-I343 PolarHBondContact O-N 3.43Å; A339-A369 HydrophobicContact CB-CB 4.25Å; A339-D372 HydrophobicContact CB-CB 4.03Å; A339-L373 HydrophobicContact CB-CD1 3.91Å; A339-L373 HydrophobicContact CB-CD2 3.97Å; A339-L373 HydrophobicContact CB-CG 3.62Å
340	K	96.8	Very high	95.1	Very high	69 Å²	69	34.1 Å²	34.1	30%	0.3	16%	0.159	S	C	.	.	H	α-helix	trans	-62.9	-35.9	177.1	-76.4	-179.8	-178.6	-166.7	0	113.6	Y306 C336 T337 R338 R344 D388	Y306-K340 HydrophobicContact CE2-CB 4.5Å; C336-K340 VanDerWaalsContact O-CG 3.32Å; C336-K340 WeakPolarHBondContact O-CG 3.49Å; C336-K340 PolarHBondContact O-N 3.36Å; T337-K340 PolarHBondContact O-N 3.37Å; R338-K340 PolarHBondContact O-N 2.88Å; K340-R344 WeakPolarHBondContact O-CB 3.39Å; K340-R344 PolarHBondContact O-N 3.25Å; K340-D388 WeakPolarHBondContact CE-OD2 3.28Å; K340-D388 IonicContact NZ-OD2 3.55Å; K340-D388 PolarHBondContact NZ-OD2 3.05Å
341	I	96.9	Very high	95.1	Very high	1 Å²	1	34 Å²	34	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-63.6	-46.4	174.5	-62.2	157.2	0	0	0	109.7	Y306 Q311 A314 I315 T337 R338 A339 R344 A345	Y306-I341 HydrophobicContact CD2-CB 4.43Å; Y306-I341 HydrophobicContact CD2-CG1 3.53Å; Y306-I341 HydrophobicContact CE2-CG1 4.18Å; Y306-I341 HydrophobicContact CG-CG1 4.25Å; Q311-I341 HydrophobicContact CB-CG2 4.18Å; Q311-I341 HydrophobicContact CG-CG2 4.34Å; A314-I341 HydrophobicContact CB-CD1 3.47Å; A314-I341 VanDerWaalsContact CB-CD1 3.47Å; A314-I341 HydrophobicContact CB-CG1 4.29Å; I315-I341 HydrophobicContact CD1-CG2 3.75Å; I315-I341 HydrophobicContact CG1-CB 4.23Å; I315-I341 HydrophobicContact CG1-CD1 3.96Å; I315-I341 HydrophobicContact CG1-CG2 3.64Å; T337-I341 HydrophobicContact CG2-CD1 4.35Å; T337-I341 WeakPolarHBondContact O-CG1 3.31Å; T337-I341 PolarHBondContact O-N 3.41Å; T337-I341 VanDerWaalsContact O-N 3.08Å; R338-I341 PolarHBondContact O-N 2.95Å; A339-I341 VanDerWaalsContact C-N 3.33Å; A339-I341 PolarHBondContact O-N 3.19Å; I341-R344 PolarHBondContact O-N 3Å; I341-A345 WeakPolarHBondContact O-CB 3.47Å; I341-A345 PolarHBondContact O-N 3.36Å
342	H	97.8	Very high	94.9	Very high	23 Å²	23	38.9 Å²	38.9	11%	0.106	17%	0.173	C	C	.	.	H	α-helix	trans	-64.2	-42.8	177.8	-75.3	-51	0	0	0	113.1	R338 A339 R344 A345 Y346 H365 C368 A369	R338-H342 PolarHBondContact O-CD2 3.01Å; R338-H342 PolarHBondContact O-N 3.37Å; R338-H342 VanDerWaalsContact O-N 3.11Å; A339-H342 PolarHBondContact O-N 3.38Å; H342-R344 VanDerWaalsContact C-N 3.32Å; H342-R344 PolarHBondContact O-N 2.99Å; H342-A345 PolarHBondContact O-N 3.08Å; H342-Y346 PolarHBondContact O-N 2.87Å; H342-H365 HydrophobicContact CB-CB 4.36Å; H342-H365 WeakPolarHBondContact CB-O 3.39Å; H342-H365 AromaticContact ND1-ND1 3.5Å; H342-H365 PolarHBondContact ND1-ND1 3.47Å; H342-H365 WeakPolarHBondContact O-CB 3.37Å; H342-C368 VanDerWaalsContact CD2-CB 3.49Å; H342-C368 WeakPolarHBondContact CD2-CB 3.48Å; H342-A369 HydrophobicContact CB-CB 4.02Å
343	I	96.8	Very high	94.7	Very high	8 Å²	8	36.6 Å²	36.6	4%	0.041	17%	0.169	C	C	.	.	H	α-helix	trans	-57.9	-47.3	173.7	-66.9	164.8	0	0	0	110.1	A339 A345 Y346 L347 A369 L373 D388 V392	A339-I343 WeakPolarHBondContact O-CG1 3.09Å; A339-I343 PolarHBondContact O-N 3.43Å; I343-A345 PolarHBondContact O-N 3.09Å; I343-Y346 PolarHBondContact O-N 3.14Å; I343-L347 HydrophobicContact CG2-CD1 3.96Å; I343-L347 HydrophobicContact CG2-CG 4.34Å; I343-L347 VanDerWaalsContact O-CG 3.31Å; I343-L347 WeakPolarHBondContact O-CG 3.49Å; I343-L347 PolarHBondContact O-N 3.48Å; I343-A369 HydrophobicContact CD1-CB 4.45Å; I343-A369 HydrophobicContact CG1-CB 3.87Å; I343-L373 HydrophobicContact CD1-CD1 4.24Å; I343-D388 HydrophobicContact CD1-CB 4.41Å; I343-V392 HydrophobicContact CD1-CG2 3.63Å; I343-V392 HydrophobicContact CG1-CG2 3.65Å
344	R	95.2	Very high	94.4	Very high	96 Å²	96	39.6 Å²	39.6	36%	0.362	18%	0.182	S	C	.	.	H	α-helix	trans	-63.3	-39.7	179.2	-172.6	175.2	-179	-176.5	0.1	112.5	Y306 K340 I341 H342 L347 H348	Y306-R344 HydrophobicContact CE2-CB 4.2Å; Y306-R344 PolarHBondContact O-NH1 3.33Å; K340-R344 WeakPolarHBondContact O-CB 3.39Å; K340-R344 PolarHBondContact O-N 3.25Å; I341-R344 PolarHBondContact O-N 3Å; H342-R344 VanDerWaalsContact C-N 3.32Å; H342-R344 PolarHBondContact O-N 2.99Å; R344-L347 PolarHBondContact O-N 2.97Å; R344-H348 WeakPolarHBondContact O-CB 3.34Å; R344-H348 PolarHBondContact O-N 3.4Å
345	A	94.6	Very high	94	Very high	10 Å²	10	45.3 Å²	45.3	8%	0.083	21%	0.21	C	C	.	.	H	α-helix	trans	-61.9	-45.8	175.6	0	0	0	0	0	111.2	I341 H342 I343 L347 H348 D349	I341-A345 WeakPolarHBondContact O-CB 3.47Å; I341-A345 PolarHBondContact O-N 3.36Å; H342-A345 PolarHBondContact O-N 3.08Å; I343-A345 PolarHBondContact O-N 3.09Å; A345-L347 PolarHBondContact O-N 3.06Å; A345-H348 PolarHBondContact O-N 2.95Å; A345-D349 PolarHBondContact O-N 3.17Å; A345-D349 VanDerWaalsContact O-N 3.08Å
346	Y	95.7	Very high	93.5	Very high	1 Å²	1	47.5 Å²	47.5	0%	0.004	24%	0.238	C	C	.	.	H	α-helix	trans	-59.8	-47.2	175	179.1	-93.6	0	0	0	112.5	H342 I343 H348 D349 L350 P361 L366 Y395	H342-Y346 PolarHBondContact O-N 2.87Å; I343-Y346 PolarHBondContact O-N 3.14Å; Y346-H348 VanDerWaalsContact C-N 3.34Å; Y346-H348 PolarHBondContact O-N 2.84Å; Y346-D349 PolarHBondContact O-N 3.3Å; Y346-L350 HydrophobicContact CE1-CB 4.47Å; Y346-L350 HydrophobicContact CE1-CD2 4.18Å; Y346-L350 WeakPolarHBondContact O-CB 3.48Å; Y346-L350 PolarHBondContact O-N 3.45Å; Y346-P361 HydrophobicContact CD2-CB 3.87Å; Y346-P361 HydrophobicContact CE2-CB 3.51Å; Y346-P361 HydrophobicContact CE2-CG 4.5Å; Y346-L366 HydrophobicContact CD1-CD1 4.36Å; Y346-L366 HydrophobicContact CD1-CD2 3.8Å; Y346-L366 HydrophobicContact CD1-CG 4.2Å; Y346-L366 HydrophobicContact CD2-CD1 3.92Å; Y346-L366 HydrophobicContact CD2-CD2 4.12Å; Y346-L366 HydrophobicContact CD2-CG 3.65Å; Y346-L366 HydrophobicContact CE1-CD1 4.07Å; Y346-L366 HydrophobicContact CE1-CD2 4.23Å; Y346-L366 HydrophobicContact CE1-CG 4.41Å; Y346-L366 HydrophobicContact CE2-CD1 3.56Å; Y346-L366 HydrophobicContact CE2-CG 3.86Å; Y346-L366 HydrophobicContact CG-CD1 4.3Å; Y346-L366 HydrophobicContact CG-CD2 3.74Å; Y346-L366 HydrophobicContact CG-CG 3.83Å; Y346-Y395 HydrophobicContact CD1-CG 4.22Å; Y346-Y395 AromaticContact CE1-CD1 3.77Å; Y346-Y395 HydrophobicContact CE1-CD1 3.77Å; Y346-Y395 HydrophobicContact CE1-CD2 4.41Å; Y346-Y395 AromaticContact CE1-CG 3.7Å; Y346-Y395 HydrophobicContact CE1-CG 3.7Å
347	L	93.5	Very high	92.9	Very high	38 Å²	38	52.2 Å²	52.2	20%	0.199	26%	0.262	C	S	.	.	H	α-helix	trans	-61.4	-42.2	179.4	-72.4	176.9	0	0	0	112.2	I343 R344 A345 D349 L350 E351 Y395	I343-L347 HydrophobicContact CG2-CD1 3.96Å; I343-L347 HydrophobicContact CG2-CG 4.34Å; I343-L347 VanDerWaalsContact O-CG 3.31Å; I343-L347 WeakPolarHBondContact O-CG 3.49Å; I343-L347 PolarHBondContact O-N 3.48Å; R344-L347 PolarHBondContact O-N 2.97Å; A345-L347 PolarHBondContact O-N 3.06Å; L347-D349 VanDerWaalsContact C-N 3.34Å; L347-D349 PolarHBondContact O-N 3.23Å; L347-L350 WeakPolarHBondContact O-CB 3.38Å; L347-L350 PolarHBondContact O-N 3.42Å; L347-E351 WeakPolarHBondContact O-CG 3.44Å; L347-E351 PolarHBondContact O-N 3.22Å; L347-Y395 HydrophobicContact CD2-CD2 4.27Å; L347-Y395 HydrophobicContact CD2-CE1 4Å; L347-Y395 HydrophobicContact CD2-CE2 3.44Å; L347-Y395 VanDerWaalsContact CD2-CE2 3.44Å; L347-Y395 VanDerWaalsContact CD2-OH 3.26Å; L347-Y395 WeakPolarHBondContact CD2-OH 3.46Å; L347-Y395 HydrophobicContact CG-CE2 4.42Å
348	H	92.4	Very high	92.3	Very high	93 Å²	93	53.3 Å²	53.3	43%	0.431	28%	0.276	S	S	.	.	H	α-helix	trans	-60.9	-43.2	176	173.2	-92	0	0	0	111.7	R344 A345 Y346 L350 E351 R352	R344-H348 WeakPolarHBondContact O-CB 3.34Å; R344-H348 PolarHBondContact O-N 3.4Å; A345-H348 PolarHBondContact O-N 2.95Å; Y346-H348 VanDerWaalsContact C-N 3.34Å; Y346-H348 PolarHBondContact O-N 2.84Å; H348-L350 VanDerWaalsContact C-N 3.35Å; H348-E351 PolarHBondContact O-N 3.27Å; H348-R352 WeakPolarHBondContact CE1-CD 3.31Å; H348-R352 WeakPolarHBondContact O-CG 2.86Å; H348-R352 PolarHBondContact O-N 3.2Å
349	D	92.9	Very high	91.8	Very high	42 Å²	42	53.9 Å²	53.9	23%	0.225	30%	0.297	C	S	.	.	H	α-helix	trans	-66.3	-37.8	175.7	-71	-13.8	0	0	0	112.1	A345 Y346 L347 R352 A353 P361	A345-D349 PolarHBondContact O-N 3.17Å; A345-D349 VanDerWaalsContact O-N 3.08Å; Y346-D349 PolarHBondContact O-N 3.3Å; L347-D349 VanDerWaalsContact C-N 3.34Å; L347-D349 PolarHBondContact O-N 3.23Å; D349-R352 PolarHBondContact O-N 2.95Å; D349-A353 WeakPolarHBondContact O-CB 3.5Å; D349-A353 PolarHBondContact O-N 3.39Å; D349-P361 HydrophobicContact CB-CB 3.93Å; D349-P361 HydrophobicContact CB-CG 4.39Å
350	L	91.9	Very high	91.3	Very high	5 Å²	5	61.6 Å²	61.6	3%	0.026	34%	0.335	C	S	.	.	H	α-helix	trans	-62.8	-45.4	175.5	-179.3	64.5	0	0	0	112	Y346 L347 H348 R352 A353 K354 P361 Y395 A400 E403	Y346-L350 HydrophobicContact CE1-CB 4.47Å; Y346-L350 HydrophobicContact CE1-CD2 4.18Å; Y346-L350 WeakPolarHBondContact O-CB 3.48Å; Y346-L350 PolarHBondContact O-N 3.45Å; L347-L350 WeakPolarHBondContact O-CB 3.38Å; L347-L350 PolarHBondContact O-N 3.42Å; H348-L350 VanDerWaalsContact C-N 3.35Å; L350-R352 VanDerWaalsContact C-N 3.34Å; L350-R352 PolarHBondContact O-N 3.43Å; L350-A353 PolarHBondContact O-N 2.69Å; L350-K354 WeakPolarHBondContact O-CG 3.33Å; L350-K354 PolarHBondContact O-N 3.31Å; L350-P361 HydrophobicContact CB-CG 3.93Å; L350-P361 HydrophobicContact CD1-CG 4.02Å; L350-Y395 HydrophobicContact CD2-CD1 4.09Å; L350-Y395 HydrophobicContact CD2-CE1 3.72Å; L350-A400 WeakPolarHBondContact CD1-O 3.47Å; L350-E403 HydrophobicContact CD2-CG 4.45Å
351	E	90.8	Very high	91	Very high	117 Å²	117	58.7 Å²	58.7	55%	0.547	32%	0.324	S	S	.	.	H	α-helix	trans	-61.2	-43.6	175.2	-74.5	175.7	-173.7	0	0	111.5	L347 H348 A353 K354 M355	L347-E351 WeakPolarHBondContact O-CG 3.44Å; L347-E351 PolarHBondContact O-N 3.22Å; H348-E351 PolarHBondContact O-N 3.27Å; E351-A353 PolarHBondContact O-N 3.21Å; E351-K354 PolarHBondContact O-N 3.48Å; E351-M355 HydrophobicContact CB-CE 4.47Å; E351-M355 WeakPolarHBondContact O-CE 3.27Å; E351-M355 WeakPolarHBondContact O-CG 3.45Å; E351-M355 PolarHBondContact O-N 2.98Å
352	R	90.6	Very high	90.8	Very high	105 Å²	105	61.8 Å²	61.8	40%	0.396	34%	0.34	S	S	.	.	H	α-helix	trans	-62.5	-41.3	175.2	-73.6	-176.8	62.7	-162.7	0.1	112.4	H348 D349 L350 M355 G356 L357	H348-R352 WeakPolarHBondContact CE1-CD 3.31Å; H348-R352 WeakPolarHBondContact O-CG 2.86Å; H348-R352 PolarHBondContact O-N 3.2Å; D349-R352 PolarHBondContact O-N 2.95Å; L350-R352 VanDerWaalsContact C-N 3.34Å; L350-R352 PolarHBondContact O-N 3.43Å; R352-M355 HydrophobicContact CG-CE 4.49Å; R352-M355 PolarHBondContact O-N 3.13Å; R352-G356 PolarHBondContact O-N 2.85Å; R352-L357 PolarHBondContact NE-O 3.46Å; R352-L357 PolarHBondContact NH2-O 3.08Å; R352-L357 PolarHBondContact O-N 3.3Å
353	A	89.6	Confident	90.6	Very high	21 Å²	21	66.6 Å²	66.6	17%	0.174	36%	0.357	C	S	.	.	H	α-helix	trans	-62.3	-44.5	176.2	0	0	0	0	0	111.4	D349 L350 E351 M355 G356 G359 P361	D349-A353 WeakPolarHBondContact O-CB 3.5Å; D349-A353 PolarHBondContact O-N 3.39Å; L350-A353 PolarHBondContact O-N 2.69Å; E351-A353 PolarHBondContact O-N 3.21Å; A353-M355 VanDerWaalsContact C-N 3.27Å; A353-M355 PolarHBondContact O-N 3.5Å; A353-G356 PolarHBondContact O-N 3.12Å; A353-G359 WeakPolarHBondContact CB-O 3.38Å; A353-P361 HydrophobicContact CB-CG 4.31Å
354	K	86.8	Confident	90.5	Very high	103 Å²	103	71.1 Å²	71.1	45%	0.448	38%	0.382	S	S	.	.	H	α-helix	trans	-60.4	-34.6	175.3	-75.4	176	177.7	-175	0	113.2	L350 E351 G356 V401 E403	L350-K354 WeakPolarHBondContact O-CG 3.33Å; L350-K354 PolarHBondContact O-N 3.31Å; E351-K354 PolarHBondContact O-N 3.48Å; K354-G356 VanDerWaalsContact C-N 3.25Å; K354-G356 PolarHBondContact O-N 3.11Å; K354-V401 WeakPolarHBondContact CG-O 3.26Å; K354-E403 WeakPolarHBondContact CE-OE1 3.4Å; K354-E403 IonicContact NZ-OE1 2.6Å; K354-E403 PolarHBondContact NZ-OE1 3.02Å
355	M	86.2	Confident	90.6	Very high	120 Å²	120	68.7 Å²	68.7	59%	0.591	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-3.6	174.5	-68.3	-173.9	-75.1	0	0	113.7	E351 R352 A353 L357	E351-M355 HydrophobicContact CB-CE 4.47Å; E351-M355 WeakPolarHBondContact O-CE 3.27Å; E351-M355 WeakPolarHBondContact O-CG 3.45Å; E351-M355 PolarHBondContact O-N 2.98Å; R352-M355 HydrophobicContact CG-CE 4.49Å; R352-M355 PolarHBondContact O-N 3.13Å; A353-M355 VanDerWaalsContact C-N 3.27Å; A353-M355 PolarHBondContact O-N 3.5Å; M355-L357 HydrophobicContact CB-CB 4.36Å; M355-L357 HydrophobicContact CB-CD1 3.96Å; M355-L357 HydrophobicContact CB-CG 3.98Å; M355-L357 PolarHBondContact O-N 2.78Å; M355-L357 HydrophobicContact SD-CD1 4.36Å
356	G	86.6	Confident	90.7	Very high	65 Å²	65	68.3 Å²	68.3	67%	0.67	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.4	17.7	-173.2	0	0	0	0	0	113.8	R352 A353 K354	R352-G356 PolarHBondContact O-N 2.85Å; A353-G356 PolarHBondContact O-N 3.12Å; K354-G356 VanDerWaalsContact C-N 3.25Å; K354-G356 PolarHBondContact O-N 3.11Å
357	L	84.4	Confident	90.8	Very high	113 Å²	113	70.6 Å²	70.6	59%	0.592	39%	0.39	S	S	*	.	S	Bend	trans	-103.4	21	-175.1	-63.7	177.5	0	0	0	113.3	R352 M355	R352-L357 PolarHBondContact NE-O 3.46Å; R352-L357 PolarHBondContact NH2-O 3.08Å; R352-L357 PolarHBondContact O-N 3.3Å; M355-L357 HydrophobicContact CB-CB 4.36Å; M355-L357 HydrophobicContact CB-CD1 3.96Å; M355-L357 HydrophobicContact CB-CG 3.98Å; M355-L357 PolarHBondContact O-N 2.78Å; M355-L357 HydrophobicContact SD-CD1 4.36Å
358	G	82.4	Confident	91	Very high	41 Å²	41	71.4 Å²	71.4	42%	0.423	40%	0.398	S	S	.	.	S	Bend	trans	-169.1	174.8	-177	0	0	0	0	0	113.4
359	G	87.4	Confident	91.3	Very high	60 Å²	60	67 Å²	67	62%	0.619	38%	0.378	S	S	*	.	S	Bend	trans	-81.2	-170.2	169.2	0	0	0	0	0	112	A353	A353-G359 WeakPolarHBondContact CB-O 3.38Å
360	M	87.2	Confident	91.5	Very high	163 Å²	163	67.4 Å²	67.4	80%	0.803	38%	0.378	S	S	*	.	S	Bend	trans	-62.4	142.2	172.1	-72.9	-176	176.4	0	0	110.9
361	P	92.3	Very high	91.8	Very high	8 Å²	8	69.7 Å²	69.7	5%	0.052	40%	0.397	C	S	.	.			trans	-59.4	140.5	176.6	-24.8	35.5	0	0	0	112.9	Y346 D349 L350 A353 R363 A400	Y346-P361 HydrophobicContact CD2-CB 3.87Å; Y346-P361 HydrophobicContact CE2-CB 3.51Å; Y346-P361 HydrophobicContact CE2-CG 4.5Å; D349-P361 HydrophobicContact CB-CB 3.93Å; D349-P361 HydrophobicContact CB-CG 4.39Å; L350-P361 HydrophobicContact CB-CG 3.93Å; L350-P361 HydrophobicContact CD1-CG 4.02Å; A353-P361 HydrophobicContact CB-CG 4.31Å; P361-R363 PolarHBondContact O-N 2.9Å; P361-R363 VanDerWaalsContact O-N 3.17Å; P361-A400 WeakPolarHBondContact CD-O 3.4Å; P361-A400 HydrophobicContact CG-CB 4.34Å
362	D	92.3	Very high	92.1	Very high	66 Å²	66	64.6 Å²	64.6	35%	0.353	37%	0.374	S	S	.	.			trans	-72.5	110.1	178.9	-172.6	0.6	0	0	0	111.3	N364 H365	D362-N364 PolarHBondContact O-N 3.45Å; D362-N364 VanDerWaalsContact OD1-CB 3.26Å; D362-N364 WeakPolarHBondContact OD1-CB 3.47Å; D362-N364 VanDerWaalsContact OD1-CG 3.3Å; D362-N364 PolarHBondContact OD1-N 3.42Å; D362-N364 PolarHBondContact OD1-ND2 3.26Å; D362-N364 PolarHBondContact OD2-ND2 3.1Å; D362-H365 WeakPolarHBondContact O-CB 3.33Å; D362-H365 PolarHBondContact O-N 2.88Å
363	R	93.1	Very high	92.5	Very high	124 Å²	124	59.6 Å²	59.6	47%	0.468	36%	0.355	S	S	.	.	H	α-helix	trans	-67.1	-15.8	177.4	-74.3	-171.1	164.9	-178.2	-6.3	113.6	P361 H365 L366 A367	P361-R363 PolarHBondContact O-N 2.9Å; P361-R363 VanDerWaalsContact O-N 3.17Å; R363-H365 PolarHBondContact O-N 2.77Å; R363-L366 PolarHBondContact O-N 3.04Å; R363-L366 VanDerWaalsContact O-N 3.14Å; R363-A367 PolarHBondContact O-N 2.92Å; R363-A367 VanDerWaalsContact O-N 3.11Å
364	N	95.5	Very high	92.8	Very high	103 Å²	103	61.9 Å²	61.9	55%	0.551	36%	0.362	S	S	*	.	H	α-helix	trans	-61.3	-32	173.7	-67.1	-32.9	0	0	0	111.7	D362 L366 A367 C368	D362-N364 PolarHBondContact O-N 3.45Å; D362-N364 VanDerWaalsContact OD1-CB 3.26Å; D362-N364 WeakPolarHBondContact OD1-CB 3.47Å; D362-N364 VanDerWaalsContact OD1-CG 3.3Å; D362-N364 PolarHBondContact OD1-N 3.42Å; D362-N364 PolarHBondContact OD1-ND2 3.26Å; D362-N364 PolarHBondContact OD2-ND2 3.1Å; N364-L366 VanDerWaalsContact C-N 3.33Å; N364-L366 PolarHBondContact O-N 3.47Å; N364-A367 PolarHBondContact O-N 2.89Å; N364-C368 PolarHBondContact O-N 3.23Å; N364-C368 PolarHBondContact O-SG 3.5Å; N364-C368 VanDerWaalsContact O-SG 3.35Å
365	H	96.5	Very high	93.2	Very high	44 Å²	44	60.7 Å²	60.7	20%	0.204	36%	0.358	C	S	.	.	H	α-helix	trans	-59.2	-44.5	174.1	-69.8	-33.9	0	0	0	111.9	H342 D362 R363 A367 C368 A369	H342-H365 HydrophobicContact CB-CB 4.36Å; H342-H365 WeakPolarHBondContact CB-O 3.39Å; H342-H365 AromaticContact ND1-ND1 3.5Å; H342-H365 PolarHBondContact ND1-ND1 3.47Å; H342-H365 WeakPolarHBondContact O-CB 3.37Å; D362-H365 WeakPolarHBondContact O-CB 3.33Å; D362-H365 PolarHBondContact O-N 2.88Å; R363-H365 PolarHBondContact O-N 2.77Å; H365-A367 PolarHBondContact O-N 3.24Å; H365-C368 PolarHBondContact O-N 3.26Å; H365-A369 WeakPolarHBondContact O-CB 3.5Å; H365-A369 PolarHBondContact O-N 3.2Å
366	L	97.2	Very high	93.7	Very high	2 Å²	2	55 Å²	55	1%	0.01	33%	0.33	C	S	.	.	H	α-helix	trans	-65.5	-38.9	175.5	-62.8	178.3	0	0	0	111.9	Y346 R363 N364 A369 K370 V392 M396	Y346-L366 HydrophobicContact CD1-CD1 4.36Å; Y346-L366 HydrophobicContact CD1-CD2 3.8Å; Y346-L366 HydrophobicContact CD1-CG 4.2Å; Y346-L366 HydrophobicContact CD2-CD1 3.92Å; Y346-L366 HydrophobicContact CD2-CD2 4.12Å; Y346-L366 HydrophobicContact CD2-CG 3.65Å; Y346-L366 HydrophobicContact CE1-CD1 4.07Å; Y346-L366 HydrophobicContact CE1-CD2 4.23Å; Y346-L366 HydrophobicContact CE1-CG 4.41Å; Y346-L366 HydrophobicContact CE2-CD1 3.56Å; Y346-L366 HydrophobicContact CE2-CG 3.86Å; Y346-L366 HydrophobicContact CG-CD1 4.3Å; Y346-L366 HydrophobicContact CG-CD2 3.74Å; Y346-L366 HydrophobicContact CG-CG 3.83Å; R363-L366 PolarHBondContact O-N 3.04Å; R363-L366 VanDerWaalsContact O-N 3.14Å; N364-L366 VanDerWaalsContact C-N 3.33Å; N364-L366 PolarHBondContact O-N 3.47Å; L366-A369 PolarHBondContact O-N 3.4Å; L366-K370 VanDerWaalsContact O-CB 3.25Å; L366-K370 WeakPolarHBondContact O-CB 3.33Å; L366-K370 PolarHBondContact O-N 2.87Å; L366-V392 HydrophobicContact CB-CG1 4.41Å; L366-V392 HydrophobicContact CD2-CG1 4.48Å; L366-V392 WeakPolarHBondContact O-CG1 3.36Å; L366-M396 HydrophobicContact CB-CG 3.95Å; L366-M396 HydrophobicContact CD1-CG 3.86Å; L366-M396 HydrophobicContact CG-CG 4.49Å
367	A	97.6	Very high	94.1	Very high	50 Å²	50	53 Å²	53	41%	0.413	30%	0.304	S	S	.	.	H	α-helix	trans	-63.1	-44.2	177.5	0	0	0	0	0	112.3	R363 N364 H365 K370 A371	R363-A367 PolarHBondContact O-N 2.92Å; R363-A367 VanDerWaalsContact O-N 3.11Å; N364-A367 PolarHBondContact O-N 2.89Å; H365-A367 PolarHBondContact O-N 3.24Å; A367-K370 PolarHBondContact O-N 3.1Å; A367-A371 PolarHBondContact O-N 3.26Å; A367-A371 VanDerWaalsContact O-N 3.07Å
368	C	97.4	Very high	94.6	Very high	55 Å²	55	55.3 Å²	55.3	37%	0.372	31%	0.306	S	S	.	.	H	α-helix	trans	-64.2	-46.5	175.4	-66.7	0	0	0	0	111.7	H342 N364 H365 K370 A371 D372	H342-C368 VanDerWaalsContact CD2-CB 3.49Å; H342-C368 WeakPolarHBondContact CD2-CB 3.48Å; N364-C368 PolarHBondContact O-N 3.23Å; N364-C368 PolarHBondContact O-SG 3.5Å; N364-C368 VanDerWaalsContact O-SG 3.35Å; H365-C368 PolarHBondContact O-N 3.26Å; C368-K370 VanDerWaalsContact C-N 3.33Å; C368-K370 PolarHBondContact O-N 3.46Å; C368-A371 PolarHBondContact O-N 3.05Å; C368-D372 PolarHBondContact O-N 3Å; C368-D372 VanDerWaalsContact O-N 3.14Å
369	A	98.2	Very high	95.1	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-61.5	-41.2	177.9	0	0	0	0	0	112.3	A339 H342 I343 H365 L366 D372 L373 V392	A339-A369 HydrophobicContact CB-CB 4.25Å; H342-A369 HydrophobicContact CB-CB 4.02Å; I343-A369 HydrophobicContact CD1-CB 4.45Å; I343-A369 HydrophobicContact CG1-CB 3.87Å; H365-A369 WeakPolarHBondContact O-CB 3.5Å; H365-A369 PolarHBondContact O-N 3.2Å; L366-A369 PolarHBondContact O-N 3.4Å; A369-D372 PolarHBondContact O-N 2.88Å; A369-L373 WeakPolarHBondContact O-CB 3.32Å; A369-L373 WeakPolarHBondContact O-CD1 3.37Å; A369-L373 VanDerWaalsContact O-CG 3.28Å; A369-L373 WeakPolarHBondContact O-CG 3.4Å; A369-L373 PolarHBondContact O-N 3.5Å; A369-V392 HydrophobicContact CB-CG2 3.75Å
370	K	98.3	Very high	95.1	Very high	51 Å²	51	54.5 Å²	54.5	22%	0.222	28%	0.282	C	S	.	.	H	α-helix	trans	-58.4	-50.5	174.9	178.9	-179.6	178.2	-69.2	0	111.2	L366 A367 C368 D372 L373 E374 V392 Y393 M396	L366-K370 VanDerWaalsContact O-CB 3.25Å; L366-K370 WeakPolarHBondContact O-CB 3.33Å; L366-K370 PolarHBondContact O-N 2.87Å; A367-K370 PolarHBondContact O-N 3.1Å; C368-K370 VanDerWaalsContact C-N 3.33Å; C368-K370 PolarHBondContact O-N 3.46Å; K370-D372 VanDerWaalsContact C-N 3.32Å; K370-D372 PolarHBondContact O-N 2.86Å; K370-L373 PolarHBondContact O-N 3.48Å; K370-E374 WeakPolarHBondContact CE-OE1 3.32Å; K370-E374 HydrophobicContact CG-CG 4.24Å; K370-E374 IonicContact NZ-OE1 2.74Å; K370-E374 PolarHBondContact NZ-OE1 2.88Å; K370-E374 IonicContact NZ-OE2 2.75Å; K370-E374 PolarHBondContact NZ-OE2 3.24Å; K370-E374 WeakPolarHBondContact O-CB 3.4Å; K370-E374 VanDerWaalsContact O-CG 3.31Å; K370-E374 WeakPolarHBondContact O-CG 3.38Å; K370-E374 PolarHBondContact O-N 3.48Å; K370-V392 HydrophobicContact CB-CG1 3.84Å; K370-Y393 VanDerWaalsContact CE-OH 3.22Å; K370-Y393 WeakPolarHBondContact CE-OH 3.49Å; K370-M396 HydrophobicContact CB-SD 4.47Å; K370-M396 HydrophobicContact CD-CE 3.97Å; K370-M396 HydrophobicContact CD-SD 3.78Å
371	A	97.8	Very high	95.2	Very high	53 Å²	53	50.5 Å²	50.5	44%	0.438	27%	0.268	S	S	.	.	H	α-helix	trans	-59.1	-43.9	-178	0	0	0	0	0	112	A367 C368	A367-A371 PolarHBondContact O-N 3.26Å; A367-A371 VanDerWaalsContact O-N 3.07Å; C368-A371 PolarHBondContact O-N 3.05Å
372	D	97.7	Very high	95.1	Very high	10 Å²	10	51.5 Å²	51.5	5%	0.053	28%	0.28	C	S	.	.	H	α-helix	trans	-65.2	-45	178	-76.4	-14.1	0	0	0	112.2	Y335 R338 A339 C368 A369 K370 E375 V376	Y335-D372 HydrophobicContact CD1-CB 4.01Å; Y335-D372 WeakPolarHBondContact CD1-OD1 3.13Å; R338-D372 IonicContact CZ-OD1 3.53Å; R338-D372 IonicContact CZ-OD2 3.58Å; R338-D372 IonicContact NE-OD1 3.55Å; R338-D372 IonicContact NE-OD2 2.8Å; R338-D372 PolarHBondContact NE-OD2 2.96Å; R338-D372 IonicContact NH2-OD1 2.68Å; R338-D372 PolarHBondContact NH2-OD1 3.35Å; R338-D372 IonicContact NH2-OD2 3.51Å; A339-D372 HydrophobicContact CB-CB 4.03Å; C368-D372 PolarHBondContact O-N 3Å; C368-D372 VanDerWaalsContact O-N 3.14Å; A369-D372 PolarHBondContact O-N 2.88Å; K370-D372 VanDerWaalsContact C-N 3.32Å; K370-D372 PolarHBondContact O-N 2.86Å; D372-E375 PolarHBondContact O-N 3.46Å; D372-V376 WeakPolarHBondContact O-CG2 3.41Å; D372-V376 PolarHBondContact O-N 2.93Å
373	L	97.9	Very high	95.1	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-74.1	-29.7	-176.3	-69.2	166.7	0	0	0	113	A339 I343 A369 K370 E375 V376 V377 D388 I389 V392	A339-L373 HydrophobicContact CB-CD1 3.91Å; A339-L373 HydrophobicContact CB-CD2 3.97Å; A339-L373 HydrophobicContact CB-CG 3.62Å; I343-L373 HydrophobicContact CD1-CD1 4.24Å; A369-L373 WeakPolarHBondContact O-CB 3.32Å; A369-L373 WeakPolarHBondContact O-CD1 3.37Å; A369-L373 VanDerWaalsContact O-CG 3.28Å; A369-L373 WeakPolarHBondContact O-CG 3.4Å; A369-L373 PolarHBondContact O-N 3.5Å; K370-L373 PolarHBondContact O-N 3.48Å; L373-E375 VanDerWaalsContact C-N 3.34Å; L373-V376 PolarHBondContact O-N 3.47Å; L373-V377 WeakPolarHBondContact O-CB 3.06Å; L373-V377 VanDerWaalsContact O-CG2 3.26Å; L373-V377 WeakPolarHBondContact O-CG2 3.4Å; L373-V377 PolarHBondContact O-N 3.29Å; L373-D388 HydrophobicContact CD1-CB 3.88Å; L373-D388 HydrophobicContact CD2-CB 3.97Å; L373-I389 HydrophobicContact CB-CB 3.95Å; L373-I389 HydrophobicContact CB-CD1 4.03Å; L373-I389 HydrophobicContact CB-CG1 3.87Å; L373-I389 HydrophobicContact CD1-CB 4.16Å; L373-V392 HydrophobicContact CD1-CG2 3.93Å
374	E	96.6	Very high	95	Very high	68 Å²	68	47 Å²	47	32%	0.318	26%	0.26	S	S	.	.	H	α-helix	trans	-64	-39.2	174.6	-77.7	179.8	152.5	0	0	111.9	K370 R378 I389 Y393	K370-E374 WeakPolarHBondContact CE-OE1 3.32Å; K370-E374 HydrophobicContact CG-CG 4.24Å; K370-E374 IonicContact NZ-OE1 2.74Å; K370-E374 PolarHBondContact NZ-OE1 2.88Å; K370-E374 IonicContact NZ-OE2 2.75Å; K370-E374 PolarHBondContact NZ-OE2 3.24Å; K370-E374 WeakPolarHBondContact O-CB 3.4Å; K370-E374 VanDerWaalsContact O-CG 3.31Å; K370-E374 WeakPolarHBondContact O-CG 3.38Å; K370-E374 PolarHBondContact O-N 3.48Å; E374-R378 PolarHBondContact O-N 2.96Å; E374-I389 HydrophobicContact CG-CD1 3.86Å; E374-Y393 PolarHBondContact OE1-OH 3.27Å
375	E	95.6	Very high	94.9	Very high	78 Å²	78	42.4 Å²	42.4	36%	0.364	24%	0.237	S	C	.	.	H	α-helix	trans	-65.1	-45.2	173.3	-73.2	-57.1	148.4	0	0	111.6	P328 D372 L373 R378 V379	P328-E375 HydrophobicContact CB-CB 4.25Å; P328-E375 HydrophobicContact CG-CB 4.11Å; D372-E375 PolarHBondContact O-N 3.46Å; L373-E375 VanDerWaalsContact C-N 3.34Å; E375-R378 WeakPolarHBondContact O-CB 3.33Å; E375-R378 PolarHBondContact O-N 2.94Å; E375-R378 IonicContact OE2-CZ 3.45Å; E375-R378 IonicContact OE2-NE 3.33Å; E375-R378 PolarHBondContact OE2-NE 2.91Å; E375-R378 IonicContact OE2-NH2 2.63Å; E375-R378 PolarHBondContact OE2-NH2 3.31Å; E375-V379 WeakPolarHBondContact O-CG2 3.34Å; E375-V379 PolarHBondContact O-N 3.4Å
376	V	95.8	Very high	94.9	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.006	24%	0.235	C	C	.	.	H	α-helix	trans	-63.7	-47.9	179.8	174.7	0	0	0	0	111.5	W332 Y335 D372 L373 R378 V379 C380 A385	W332-V376 HydrophobicContact CB-CG1 4.19Å; W332-V376 HydrophobicContact CB-CG2 4.21Å; Y335-V376 VanDerWaalsContact CB-CG2 3.41Å; Y335-V376 HydrophobicContact CG-CG2 4.17Å; D372-V376 WeakPolarHBondContact O-CG2 3.41Å; D372-V376 PolarHBondContact O-N 2.93Å; L373-V376 PolarHBondContact O-N 3.47Å; V376-R378 PolarHBondContact O-N 3.47Å; V376-V379 PolarHBondContact O-N 3.13Å; V376-V379 VanDerWaalsContact O-N 3.08Å; V376-C380 CarbonylContact O-C 3.3Å; V376-C380 PolarHBondContact O-N 3.03Å; V376-A385 HydrophobicContact CG1-CB 4.08Å
377	V	95.8	Very high	94.9	Very high	22 Å²	22	43 Å²	43	13%	0.133	24%	0.239	C	C	.	.	H	α-helix	trans	-61.2	-28.5	-178.1	165.1	0	0	0	0	112	L373 A385 Y386 I389 F418	L373-V377 WeakPolarHBondContact O-CB 3.06Å; L373-V377 VanDerWaalsContact O-CG2 3.26Å; L373-V377 WeakPolarHBondContact O-CG2 3.4Å; L373-V377 PolarHBondContact O-N 3.29Å; V377-A385 HydrophobicContact CG2-CB 4.01Å; V377-Y386 HydrophobicContact CG1-CD1 4.14Å; V377-Y386 HydrophobicContact CG1-CE1 3.58Å; V377-Y386 HydrophobicContact CG2-CD1 4.17Å; V377-Y386 HydrophobicContact CG2-CE1 4.35Å; V377-I389 HydrophobicContact CG2-CD1 4.12Å; V377-I389 HydrophobicContact CG2-CG2 4.18Å; V377-F418 HydrophobicContact CG1-CE1 3.95Å
378	R	94.2	Very high	94.9	Very high	163 Å²	163	41.4 Å²	41.4	62%	0.615	22%	0.223	S	C	*	.	H	α-helix	trans	-70.3	-35.1	176.8	-174.1	-178.5	62.1	73.7	1.2	112.9	E374 E375 V376	E374-R378 PolarHBondContact O-N 2.96Å; E375-R378 WeakPolarHBondContact O-CB 3.33Å; E375-R378 PolarHBondContact O-N 2.94Å; E375-R378 IonicContact OE2-CZ 3.45Å; E375-R378 IonicContact OE2-NE 3.33Å; E375-R378 PolarHBondContact OE2-NE 2.91Å; E375-R378 IonicContact OE2-NH2 2.63Å; E375-R378 PolarHBondContact OE2-NH2 3.31Å; V376-R378 PolarHBondContact O-N 3.47Å
379	V	92.8	Very high	94.9	Very high	34 Å²	34	38.8 Å²	38.8	21%	0.206	21%	0.206	C	C	.	.	H	α-helix	trans	-107.8	-34.8	-171.5	-58	0	0	0	0	113.9	P328 E329 E375 V376	P328-V379 HydrophobicContact CB-CG2 3.89Å; E329-V379 HydrophobicContact CB-CB 4.25Å; E329-V379 HydrophobicContact CB-CG2 4.45Å; E375-V379 WeakPolarHBondContact O-CG2 3.34Å; E375-V379 PolarHBondContact O-N 3.4Å; V376-V379 PolarHBondContact O-N 3.13Å; V376-V379 VanDerWaalsContact O-N 3.08Å
380	C	88.2	Confident	94.9	Very high	50 Å²	50	38.8 Å²	38.8	34%	0.338	21%	0.206	S	C	.	.	S	Bend	trans	-134.5	71.8	-175.4	-171.1	0	0	0	0	109.2	W332 V376 G382	W332-C380 HydrophobicContact CB-CB 4.45Å; W332-C380 HydrophobicContact CG-CB 4.46Å; V376-C380 CarbonylContact O-C 3.3Å; V376-C380 PolarHBondContact O-N 3.03Å; C380-G382 PolarHBondContact O-N 2.75Å
381	P	89.4	Confident	94.9	Very high	78 Å²	78	38.6 Å²	38.6	51%	0.506	21%	0.205	S	C	.	.			trans	-65.5	125.6	178.3	27.5	-33.7	0	0	0	110	Y386	P381-Y386 HydrophobicContact CB-CE2 4.18Å; P381-Y386 WeakPolarHBondContact CB-OH 3.5Å
382	G	89.6	Confident	94.9	Very high	30 Å²	30	36 Å²	36	31%	0.309	19%	0.185	S	C	.	.			trans	-153	154.4	177.1	0	0	0	0	0	110.8	C380 K384 A385 Y386	C380-G382 PolarHBondContact O-N 2.75Å; G382-K384 PolarHBondContact O-N 3.33Å; G382-A385 PolarHBondContact O-N 2.81Å; G382-Y386 WeakPolarHBondContact O-CD2 3.32Å; G382-Y386 PolarHBondContact O-N 3.14Å
383	F	91.2	Very high	94.9	Very high	18 Å²	18	36.9 Å²	36.9	8%	0.079	19%	0.187	C	C	.	.	H	α-helix	trans	-59.3	-33.8	-175.1	76.4	-85.9	0	0	0	112.7	L48 E51 Y386 L387 A422 L427 L431	L48-F383 HydrophobicContact CD2-CZ 4.38Å; E51-F383 VanDerWaalsContact OE1-CE1 3.25Å; E51-F383 WeakPolarHBondContact OE1-CE1 3.32Å; E51-F383 WeakPolarHBondContact OE2-CE1 3.41Å; E51-F383 WeakPolarHBondContact OE2-CZ 2.85Å; F383-Y386 PolarHBondContact O-N 3.01Å; F383-L387 VanDerWaalsContact O-CB 3.28Å; F383-L387 WeakPolarHBondContact O-CB 3.45Å; F383-L387 PolarHBondContact O-N 3.01Å; F383-A422 HydrophobicContact CB-CB 4.45Å; F383-L427 HydrophobicContact CE1-CB 4.21Å; F383-L427 HydrophobicContact CE1-CD1 4.11Å; F383-L427 HydrophobicContact CZ-CB 4.19Å; F383-L427 HydrophobicContact CZ-CD1 4.26Å; F383-L431 HydrophobicContact CD2-CD1 3.87Å; F383-L431 HydrophobicContact CE2-CD1 3.73Å
384	K	91.8	Very high	94.9	Very high	76 Å²	76	36.9 Å²	36.9	33%	0.33	19%	0.187	S	C	.	.	H	α-helix	trans	-63.8	-46.9	175.2	-67.5	178.6	-175.8	150.7	0	111.4	E51 G382 Y386 L387 D388	E51-K384 WeakPolarHBondContact OE2-CE 3.34Å; E51-K384 IonicContact OE2-NZ 2.88Å; E51-K384 PolarHBondContact OE2-NZ 2.96Å; G382-K384 PolarHBondContact O-N 3.33Å; K384-Y386 VanDerWaalsContact C-N 3.33Å; K384-Y386 PolarHBondContact O-N 2.87Å; K384-L387 PolarHBondContact O-N 2.91Å; K384-D388 WeakPolarHBondContact O-CB 3.45Å; K384-D388 PolarHBondContact O-N 3.36Å
385	A	93.9	Very high	94.9	Very high	7 Å²	7	34.4 Å²	34.4	6%	0.058	18%	0.175	C	C	.	.	H	α-helix	trans	-63.9	-39.5	176.9	0	0	0	0	0	111.6	V376 V377 G382 I389	V376-A385 HydrophobicContact CG1-CB 4.08Å; V377-A385 HydrophobicContact CG2-CB 4.01Å; G382-A385 PolarHBondContact O-N 2.81Å; A385-I389 WeakPolarHBondContact O-CB 3.32Å; A385-I389 VanDerWaalsContact O-CG2 3.26Å; A385-I389 WeakPolarHBondContact O-CG2 3.49Å; A385-I389 PolarHBondContact O-N 3.46Å
386	Y	96.9	Very high	95	Very high	41 Å²	41	33.2 Å²	33.2	16%	0.161	17%	0.17	C	C	.	.	H	α-helix	trans	-66.3	-38.5	174.6	-70.7	-40.4	0	0	0	113.5	V377 P381 G382 F383 K384 I389 G390 F418 K421	V377-Y386 HydrophobicContact CG1-CD1 4.14Å; V377-Y386 HydrophobicContact CG1-CE1 3.58Å; V377-Y386 HydrophobicContact CG2-CD1 4.17Å; V377-Y386 HydrophobicContact CG2-CE1 4.35Å; P381-Y386 HydrophobicContact CB-CE2 4.18Å; P381-Y386 WeakPolarHBondContact CB-OH 3.5Å; G382-Y386 WeakPolarHBondContact O-CD2 3.32Å; G382-Y386 PolarHBondContact O-N 3.14Å; F383-Y386 PolarHBondContact O-N 3.01Å; K384-Y386 VanDerWaalsContact C-N 3.33Å; K384-Y386 PolarHBondContact O-N 2.87Å; Y386-I389 WeakPolarHBondContact O-CG2 3.33Å; Y386-G390 PolarHBondContact O-N 2.99Å; Y386-F418 AromaticContact CD1-CD1 3.58Å; Y386-F418 HydrophobicContact CD1-CD1 3.58Å; Y386-F418 HydrophobicContact CD1-CE1 4.1Å; Y386-F418 HydrophobicContact CE1-CD1 4Å; Y386-F418 HydrophobicContact CE1-CE1 4.15Å; Y386-K421 HydrophobicContact CD1-CB 4.36Å; Y386-K421 HydrophobicContact CD1-CD 4.41Å; Y386-K421 HydrophobicContact CD2-CB 3.8Å; Y386-K421 HydrophobicContact CE1-CB 4.44Å; Y386-K421 HydrophobicContact CE1-CD 3.93Å; Y386-K421 HydrophobicContact CE2-CB 3.92Å; Y386-K421 HydrophobicContact CE2-CD 4.46Å; Y386-K421 HydrophobicContact CG-CB 4.04Å
387	L	96.6	Very high	95	Very high	17 Å²	17	33.2 Å²	33.2	9%	0.089	17%	0.17	C	C	.	.	H	α-helix	trans	-65.9	-50.3	174.8	177.9	61.8	0	0	0	110.9	F383 K384 I389 G390 Q391 L419 A422 L431 E433 L434	F383-L387 VanDerWaalsContact O-CB 3.28Å; F383-L387 WeakPolarHBondContact O-CB 3.45Å; F383-L387 PolarHBondContact O-N 3.01Å; K384-L387 PolarHBondContact O-N 2.91Å; L387-I389 PolarHBondContact O-N 3.49Å; L387-G390 PolarHBondContact O-N 2.76Å; L387-Q391 PolarHBondContact O-N 2.95Å; L387-L419 HydrophobicContact CD1-CD2 3.87Å; L387-A422 HydrophobicContact CB-CB 4.47Å; L387-L431 HydrophobicContact CD2-CD1 4.01Å; L387-E433 HydrophobicContact CD2-CG 3.81Å; L387-L434 HydrophobicContact CD1-CB 3.99Å; L387-L434 HydrophobicContact CD1-CG 4.35Å
388	D	97	Very high	94.9	Very high	17 Å²	17	32.1 Å²	32.1	9%	0.091	16%	0.164	C	C	.	.	H	α-helix	trans	-60.4	-45.8	-179.4	-67.9	-28.1	0	0	0	110.8	K340 I343 L373 K384 Q391 V392	K340-D388 WeakPolarHBondContact CE-OD2 3.28Å; K340-D388 IonicContact NZ-OD2 3.55Å; K340-D388 PolarHBondContact NZ-OD2 3.05Å; I343-D388 HydrophobicContact CD1-CB 4.41Å; L373-D388 HydrophobicContact CD1-CB 3.88Å; L373-D388 HydrophobicContact CD2-CB 3.97Å; K384-D388 WeakPolarHBondContact O-CB 3.45Å; K384-D388 PolarHBondContact O-N 3.36Å; D388-Q391 WeakPolarHBondContact O-CB 3.41Å; D388-Q391 PolarHBondContact O-N 3.07Å; D388-V392 WeakPolarHBondContact O-CG2 3.22Å; D388-V392 PolarHBondContact O-N 2.83Å; D388-V392 VanDerWaalsContact O-N 3.1Å
389	I	98.1	Very high	94.7	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-70.1	-35.3	179.1	-158	176.6	0	0	0	111.4	L373 E374 V377 A385 Y386 L387 Q391 V392 Y393 F418	L373-I389 HydrophobicContact CB-CB 3.95Å; L373-I389 HydrophobicContact CB-CD1 4.03Å; L373-I389 HydrophobicContact CB-CG1 3.87Å; L373-I389 HydrophobicContact CD1-CB 4.16Å; E374-I389 HydrophobicContact CG-CD1 3.86Å; V377-I389 HydrophobicContact CG2-CD1 4.12Å; V377-I389 HydrophobicContact CG2-CG2 4.18Å; A385-I389 WeakPolarHBondContact O-CB 3.32Å; A385-I389 VanDerWaalsContact O-CG2 3.26Å; A385-I389 WeakPolarHBondContact O-CG2 3.49Å; A385-I389 PolarHBondContact O-N 3.46Å; Y386-I389 WeakPolarHBondContact O-CG2 3.33Å; L387-I389 PolarHBondContact O-N 3.49Å; I389-Q391 VanDerWaalsContact C-N 3.29Å; I389-Q391 PolarHBondContact O-N 2.81Å; I389-V392 PolarHBondContact O-N 2.97Å; I389-Y393 HydrophobicContact CD1-CE2 3.98Å; I389-Y393 HydrophobicContact CG1-CD2 3.91Å; I389-Y393 HydrophobicContact CG1-CE2 3.8Å; I389-Y393 VanDerWaalsContact O-CD2 3.28Å; I389-Y393 WeakPolarHBondContact O-CD2 3.41Å; I389-Y393 PolarHBondContact O-N 2.84Å; I389-F418 HydrophobicContact CD1-CE2 3.92Å; I389-F418 HydrophobicContact CD1-CZ 3.98Å; I389-F418 HydrophobicContact CG1-CD2 4.48Å; I389-F418 HydrophobicContact CG1-CE2 4.29Å; I389-F418 HydrophobicContact CG2-CB 3.83Å; I389-F418 HydrophobicContact CG2-CD1 3.79Å; I389-F418 HydrophobicContact CG2-CD2 3.61Å; I389-F418 HydrophobicContact CG2-CE1 4.2Å; I389-F418 HydrophobicContact CG2-CE2 4Å; I389-F418 HydrophobicContact CG2-CG 3.48Å; I389-F418 VanDerWaalsContact CG2-CG 3.48Å; I389-F418 HydrophobicContact CG2-CZ 4.29Å
390	G	97.8	Very high	94.4	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.6	-39.8	173.2	0	0	0	0	0	111.9	Y386 L387 Y393 Y394 A415	Y386-G390 PolarHBondContact O-N 2.99Å; L387-G390 PolarHBondContact O-N 2.76Å; G390-Y393 PolarHBondContact O-N 3.42Å; G390-Y394 WeakPolarHBondContact O-CB 3.42Å; G390-Y394 PolarHBondContact O-N 3.24Å; G390-A415 WeakPolarHBondContact O-CB 3.3Å
391	Q	97.8	Very high	94	Very high	47 Å²	47	25.4 Å²	25.4	22%	0.22	14%	0.139	C	C	.	.	H	α-helix	trans	-64.6	-43.4	175.1	-170.8	176.4	28.6	0	0	112.1	L387 D388 I389 Y394 Y395 L437	L387-Q391 PolarHBondContact O-N 2.95Å; D388-Q391 WeakPolarHBondContact O-CB 3.41Å; D388-Q391 PolarHBondContact O-N 3.07Å; I389-Q391 VanDerWaalsContact C-N 3.29Å; I389-Q391 PolarHBondContact O-N 2.81Å; Q391-Y394 PolarHBondContact O-N 2.98Å; Q391-Y395 HydrophobicContact CG-CD2 3.83Å; Q391-Y395 HydrophobicContact CG-CE2 3.49Å; Q391-Y395 VanDerWaalsContact CG-CE2 3.49Å; Q391-Y395 WeakPolarHBondContact O-CD2 3.32Å; Q391-Y395 PolarHBondContact O-N 2.86Å; Q391-Y395 VanDerWaalsContact O-N 3.09Å; Q391-L437 VanDerWaalsContact CA-CD2 3.43Å; Q391-L437 HydrophobicContact CB-CD2 3.67Å; Q391-L437 HydrophobicContact CG-CD2 4.13Å
392	V	98.1	Very high	93.6	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-59	-49.9	175	173.2	0	0	0	0	110.8	I343 L366 A369 K370 L373 D388 I389 Y394 Y395 M396	I343-V392 HydrophobicContact CD1-CG2 3.63Å; I343-V392 HydrophobicContact CG1-CG2 3.65Å; L366-V392 HydrophobicContact CB-CG1 4.41Å; L366-V392 HydrophobicContact CD2-CG1 4.48Å; L366-V392 WeakPolarHBondContact O-CG1 3.36Å; A369-V392 HydrophobicContact CB-CG2 3.75Å; K370-V392 HydrophobicContact CB-CG1 3.84Å; L373-V392 HydrophobicContact CD1-CG2 3.93Å; D388-V392 WeakPolarHBondContact O-CG2 3.22Å; D388-V392 PolarHBondContact O-N 2.83Å; D388-V392 VanDerWaalsContact O-N 3.1Å; I389-V392 PolarHBondContact O-N 2.97Å; V392-Y394 VanDerWaalsContact C-N 3.31Å; V392-Y394 PolarHBondContact O-N 3.48Å; V392-Y395 PolarHBondContact O-N 3.4Å; V392-M396 HydrophobicContact CG1-CG 4.42Å; V392-M396 HydrophobicContact CG1-SD 3.94Å; V392-M396 WeakPolarHBondContact O-CG 3.42Å; V392-M396 PolarHBondContact O-N 3.28Å
393	Y	98.4	Very high	93.6	Very high	27 Å²	27	26.6 Å²	26.6	11%	0.106	13%	0.13	C	C	.	.	H	α-helix	trans	-62.6	-36.3	179.1	-87	-68.3	0	0	0	112.9	K370 E374 I389 G390 M396 G397 A411 Q414 F418	K370-Y393 VanDerWaalsContact CE-OH 3.22Å; K370-Y393 WeakPolarHBondContact CE-OH 3.49Å; E374-Y393 PolarHBondContact OE1-OH 3.27Å; I389-Y393 HydrophobicContact CD1-CE2 3.98Å; I389-Y393 HydrophobicContact CG1-CD2 3.91Å; I389-Y393 HydrophobicContact CG1-CE2 3.8Å; I389-Y393 VanDerWaalsContact O-CD2 3.28Å; I389-Y393 WeakPolarHBondContact O-CD2 3.41Å; I389-Y393 PolarHBondContact O-N 2.84Å; G390-Y393 PolarHBondContact O-N 3.42Å; Y393-M396 PolarHBondContact O-N 2.95Å; Y393-G397 PolarHBondContact O-N 3.44Å; Y393-A411 HydrophobicContact CD1-CB 4.1Å; Y393-Q414 HydrophobicContact CD1-CB 3.86Å; Y393-Q414 HydrophobicContact CD1-CG 3.96Å; Y393-Q414 HydrophobicContact CD2-CB 4.39Å; Y393-Q414 HydrophobicContact CD2-CG 3.84Å; Y393-Q414 HydrophobicContact CE1-CB 4.03Å; Y393-Q414 HydrophobicContact CE1-CG 3.78Å; Y393-Q414 HydrophobicContact CE2-CG 3.71Å; Y393-Q414 HydrophobicContact CG-CB 4.04Å; Y393-Q414 HydrophobicContact CG-CG 3.98Å; Y393-F418 AromaticContact CD2-CD2 3.8Å; Y393-F418 HydrophobicContact CD2-CD2 3.8Å; Y393-F418 AromaticContact CD2-CE2 3.78Å; Y393-F418 HydrophobicContact CD2-CE2 3.78Å; Y393-F418 HydrophobicContact CE2-CD2 4.02Å; Y393-F418 AromaticContact CE2-CE2 3.49Å; Y393-F418 HydrophobicContact CE2-CE2 3.49Å; Y393-F418 VanDerWaalsContact CE2-CE2 3.49Å
394	Y	97.7	Very high	93.4	Very high	1 Å²	1	30.2 Å²	30.2	0%	0.004	15%	0.15	C	C	.	.	H	α-helix	trans	-59.5	-51.9	173.4	166.9	-101.9	0	0	0	111.4	G390 Q391 V392 M396 G397 V398 E403 L412 L437 K440 C441	G390-Y394 WeakPolarHBondContact O-CB 3.42Å; G390-Y394 PolarHBondContact O-N 3.24Å; Q391-Y394 PolarHBondContact O-N 2.98Å; V392-Y394 VanDerWaalsContact C-N 3.31Å; V392-Y394 PolarHBondContact O-N 3.48Å; Y394-M396 VanDerWaalsContact C-N 3.28Å; Y394-M396 PolarHBondContact O-N 3.07Å; Y394-G397 WeakPolarHBondContact O-CA 3.47Å; Y394-G397 PolarHBondContact O-N 3.37Å; Y394-V398 HydrophobicContact CD2-CG1 4.07Å; Y394-V398 HydrophobicContact CE1-CG2 4.32Å; Y394-V398 HydrophobicContact CE2-CG1 3.65Å; Y394-V398 PolarHBondContact O-N 3.2Å; Y394-V398 VanDerWaalsContact O-N 3.15Å; Y394-E403 WeakPolarHBondContact CE1-OE2 3.28Å; Y394-E403 PolarHBondContact OH-OE2 3.09Å; Y394-L412 HydrophobicContact CD2-CD2 4.13Å; Y394-L437 HydrophobicContact CD1-CD1 3.38Å; Y394-L437 HydrophobicContact CD2-CD1 4.12Å; Y394-L437 HydrophobicContact CE1-CD1 3.94Å; Y394-L437 HydrophobicContact CG-CD1 3.47Å; Y394-L437 VanDerWaalsContact CG-CD1 3.47Å; Y394-L437 HydrophobicContact CG-CG 4.47Å; Y394-K440 HydrophobicContact CE1-CD 4.41Å; Y394-K440 HydrophobicContact CE2-CB 3.71Å; Y394-C441 WeakPolarHBondContact CD2-SG 3.26Å
395	Y	97	Very high	93.3	Very high	16 Å²	16	32.2 Å²	32.2	6%	0.063	16%	0.164	C	C	.	.	H	α-helix	trans	-68.5	-25.7	-179.6	-72.7	-60.7	0	0	0	113.9	Y346 L347 L350 Q391 V392 G397 V398 E403	Y346-Y395 HydrophobicContact CD1-CG 4.22Å; Y346-Y395 AromaticContact CE1-CD1 3.77Å; Y346-Y395 HydrophobicContact CE1-CD1 3.77Å; Y346-Y395 HydrophobicContact CE1-CD2 4.41Å; Y346-Y395 AromaticContact CE1-CG 3.7Å; Y346-Y395 HydrophobicContact CE1-CG 3.7Å; L347-Y395 HydrophobicContact CD2-CD2 4.27Å; L347-Y395 HydrophobicContact CD2-CE1 4Å; L347-Y395 HydrophobicContact CD2-CE2 3.44Å; L347-Y395 VanDerWaalsContact CD2-CE2 3.44Å; L347-Y395 VanDerWaalsContact CD2-OH 3.26Å; L347-Y395 WeakPolarHBondContact CD2-OH 3.46Å; L347-Y395 HydrophobicContact CG-CE2 4.42Å; L350-Y395 HydrophobicContact CD2-CD1 4.09Å; L350-Y395 HydrophobicContact CD2-CE1 3.72Å; Q391-Y395 HydrophobicContact CG-CD2 3.83Å; Q391-Y395 HydrophobicContact CG-CE2 3.49Å; Q391-Y395 VanDerWaalsContact CG-CE2 3.49Å; Q391-Y395 WeakPolarHBondContact O-CD2 3.32Å; Q391-Y395 PolarHBondContact O-N 2.86Å; Q391-Y395 VanDerWaalsContact O-N 3.09Å; V392-Y395 PolarHBondContact O-N 3.4Å; Y395-G397 VanDerWaalsContact C-N 3.31Å; Y395-V398 HydrophobicContact CD1-CG2 4.38Å; Y395-E403 HydrophobicContact CE1-CG 4.5Å
396	M	96.3	Very high	93.3	Very high	53 Å²	53	34.1 Å²	34.1	26%	0.261	18%	0.179	S	C	.	.	H	α-helix	trans	-70.4	-30.8	169	-69.8	-179.2	70.3	0	0	112.2	L366 K370 V392 Y393 Y394 A411	L366-M396 HydrophobicContact CB-CG 3.95Å; L366-M396 HydrophobicContact CD1-CG 3.86Å; L366-M396 HydrophobicContact CG-CG 4.49Å; K370-M396 HydrophobicContact CB-SD 4.47Å; K370-M396 HydrophobicContact CD-CE 3.97Å; K370-M396 HydrophobicContact CD-SD 3.78Å; V392-M396 HydrophobicContact CG1-CG 4.42Å; V392-M396 HydrophobicContact CG1-SD 3.94Å; V392-M396 WeakPolarHBondContact O-CG 3.42Å; V392-M396 PolarHBondContact O-N 3.28Å; Y393-M396 PolarHBondContact O-N 2.95Å; Y394-M396 VanDerWaalsContact C-N 3.28Å; Y394-M396 PolarHBondContact O-N 3.07Å; M396-A411 HydrophobicContact CB-CB 4.19Å
397	G	95.8	Very high	93.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-84.4	-16.5	-176	0	0	0	0	0	115.9	Y393 Y394 Y395 V407 D408	Y393-G397 PolarHBondContact O-N 3.44Å; Y394-G397 WeakPolarHBondContact O-CA 3.47Å; Y394-G397 PolarHBondContact O-N 3.37Å; Y395-G397 VanDerWaalsContact C-N 3.31Å; G397-V407 WeakPolarHBondContact O-CG2 3.41Å; G397-V407 PolarHBondContact O-N 3.49Å; G397-D408 WeakPolarHBondContact CA-O 3.32Å; G397-D408 PolarHBondContact O-N 2.81Å
398	V	94.9	Very high	93.2	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-110.5	161.8	-178.9	-57.7	0	0	0	0	113.4	Y394 Y395 E403 L405 V407 L412 I444	Y394-V398 HydrophobicContact CD2-CG1 4.07Å; Y394-V398 HydrophobicContact CE1-CG2 4.32Å; Y394-V398 HydrophobicContact CE2-CG1 3.65Å; Y394-V398 PolarHBondContact O-N 3.2Å; Y394-V398 VanDerWaalsContact O-N 3.15Å; Y395-V398 HydrophobicContact CD1-CG2 4.38Å; V398-E403 HydrophobicContact CG2-CB 4.19Å; V398-E403 HydrophobicContact CG2-CG 3.98Å; V398-L405 CarbonylContact C-O 3.58Å; V398-L405 WeakPolarHBondContact CA-O 3.35Å; V398-V407 VanDerWaalsContact C-CG2 3.48Å; V398-V407 WeakPolarHBondContact O-CG2 3.41Å; V398-L412 HydrophobicContact CG1-CD2 3.91Å; V398-I444 HydrophobicContact CG1-CD1 4.47Å; V398-I444 HydrophobicContact CG1-CG1 4.09Å
399	D	90.2	Very high	93.1	Very high	24 Å²	24	44.3 Å²	44.3	13%	0.128	24%	0.235	C	C	.	.			trans	-63.5	138.2	172.4	75	-83.8	0	0	0	111.5	V401 Q402 E403 L404 L405 V407	D399-V401 PolarHBondContact O-N 2.87Å; D399-V401 PolarHBondContact OD2-N 3.24Å; D399-Q402 PolarHBondContact OD2-N 3.44Å; D399-E403 PolarHBondContact O-N 3.27Å; D399-E403 WeakPolarHBondContact OD1-CA 3.27Å; D399-E403 PolarHBondContact OD1-N 3.13Å; D399-E403 PolarHBondContact OD2-N 3.28Å; D399-L404 PolarHBondContact OD1-N 3.36Å; D399-L405 HydrophobicContact CB-CB 4.35Å; D399-L405 PolarHBondContact N-O 2.89Å; D399-L405 PolarHBondContact OD1-N 3.35Å; D399-V407 HydrophobicContact CB-CG1 4Å
400	A	85.6	Confident	93	Very high	13 Å²	13	47.6 Å²	47.6	11%	0.107	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	28.7	-174.7	0	0	0	0	0	113.3	L350 P361	L350-A400 WeakPolarHBondContact CD1-O 3.47Å; P361-A400 WeakPolarHBondContact CD-O 3.4Å; P361-A400 HydrophobicContact CG-CB 4.34Å
401	V	80.3	Confident	93	Very high	68 Å²	68	47.8 Å²	47.8	41%	0.412	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.1	-60.7	-176.6	-170.2	0	0	0	0	110.8	K354 D399	K354-V401 WeakPolarHBondContact CG-O 3.26Å; D399-V401 PolarHBondContact O-N 2.87Å; D399-V401 PolarHBondContact OD2-N 3.24Å
402	Q	81.4	Confident	92.9	Very high	124 Å²	124	45.6 Å²	45.6	58%	0.579	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.7	-14.1	-172.6	-60.7	-170.1	-18.2	0	0	113.5	D399 L404	D399-Q402 PolarHBondContact OD2-N 3.44Å; Q402-L404 VanDerWaalsContact C-N 3.29Å; Q402-L404 HydrophobicContact CB-CB 4.31Å; Q402-L404 HydrophobicContact CB-CD1 3.86Å; Q402-L404 HydrophobicContact CB-CG 3.8Å
403	E	89.9	Confident	92.8	Very high	9 Å²	9	49 Å²	49	4%	0.042	27%	0.271	C	S	.	.	S	Bend	trans	55.4	46.8	-172.4	-52.5	171.6	-122.2	0	0	111.3	L350 K354 Y394 Y395 V398 D399 K440 I444	L350-E403 HydrophobicContact CD2-CG 4.45Å; K354-E403 WeakPolarHBondContact CE-OE1 3.4Å; K354-E403 IonicContact NZ-OE1 2.6Å; K354-E403 PolarHBondContact NZ-OE1 3.02Å; Y394-E403 WeakPolarHBondContact CE1-OE2 3.28Å; Y394-E403 PolarHBondContact OH-OE2 3.09Å; Y395-E403 HydrophobicContact CE1-CG 4.5Å; V398-E403 HydrophobicContact CG2-CB 4.19Å; V398-E403 HydrophobicContact CG2-CG 3.98Å; D399-E403 PolarHBondContact O-N 3.27Å; D399-E403 WeakPolarHBondContact OD1-CA 3.27Å; D399-E403 PolarHBondContact OD1-N 3.13Å; D399-E403 PolarHBondContact OD2-N 3.28Å; E403-K440 IonicContact OE2-NZ 3.8Å; E403-I444 WeakPolarHBondContact O-CD1 3.34Å
404	L	86.4	Confident	92.8	Very high	95 Å²	95	50.7 Å²	50.7	50%	0.497	28%	0.28	S	S	.	.			trans	-119.6	-16.6	-179.4	-65.4	-178.6	0	0	0	112.8	D399 Q402 I444	D399-L404 PolarHBondContact OD1-N 3.36Å; Q402-L404 VanDerWaalsContact C-N 3.29Å; Q402-L404 HydrophobicContact CB-CB 4.31Å; Q402-L404 HydrophobicContact CB-CD1 3.86Å; Q402-L404 HydrophobicContact CB-CG 3.8Å; L404-I444 WeakPolarHBondContact O-CD1 3.47Å
405	L	89.8	Confident	92.8	Very high	118 Å²	118	50.6 Å²	50.6	62%	0.618	28%	0.28	S	S	*	.	S	Bend	trans	-123.3	138.2	-177	-61.6	173.8	0	0	0	111.1	V398 D399	V398-L405 CarbonylContact C-O 3.58Å; V398-L405 WeakPolarHBondContact CA-O 3.35Å; D399-L405 HydrophobicContact CB-CB 4.35Å; D399-L405 PolarHBondContact N-O 2.89Å; D399-L405 PolarHBondContact OD1-N 3.35Å
406	A	94	Very high	92.9	Very high	46 Å²	46	51.3 Å²	51.3	38%	0.38	28%	0.284	S	S	.	.	B	Isolated β-bridge	trans	-71.3	127.4	168	0	0	0	0	0	109.9	E409 L412 I444	A406-E409 HydrophobicContact CB-CG 4.38Å; A406-L412 HydrophobicContact CB-CD1 3.72Å; A406-I444 HydrophobicContact CB-CG2 3.75Å
407	V	94.4	Very high	93	Very high	77 Å²	77	51.9 Å²	51.9	47%	0.467	29%	0.291	S	S	.	.	S	Bend	trans	-111.3	-23.3	171.5	-59.1	0	0	0	0	112.3	G397 V398 D399	G397-V407 WeakPolarHBondContact O-CG2 3.41Å; G397-V407 PolarHBondContact O-N 3.49Å; V398-V407 VanDerWaalsContact C-CG2 3.48Å; V398-V407 WeakPolarHBondContact O-CG2 3.41Å; D399-V407 HydrophobicContact CB-CG1 4Å
408	D	95.4	Very high	93.1	Very high	70 Å²	70	52.8 Å²	52.8	37%	0.374	29%	0.294	S	S	.	.			trans	-144.7	100.8	172.7	-177	-15.1	0	0	0	109.7	G397 A410 A411 L412	G397-D408 WeakPolarHBondContact CA-O 3.32Å; G397-D408 PolarHBondContact O-N 2.81Å; D408-A410 VanDerWaalsContact C-N 3.3Å; D408-A410 PolarHBondContact O-N 2.88Å; D408-A410 WeakPolarHBondContact OD1-CA 3.32Å; D408-A410 WeakPolarHBondContact OD1-CB 3.48Å; D408-A410 PolarHBondContact OD1-N 3.07Å; D408-A411 HydrophobicContact CB-CB 3.94Å; D408-A411 PolarHBondContact O-N 3.21Å; D408-A411 PolarHBondContact OD1-N 3.5Å; D408-L412 PolarHBondContact O-N 3.41Å; D408-L412 VanDerWaalsContact O-N 3.16Å
409	E	94.9	Very high	93.2	Very high	143 Å²	143	52.8 Å²	52.8	67%	0.668	29%	0.294	S	S	*	.	H	α-helix	trans	-66.7	-30	178.9	-67.7	-172.8	179.1	0	0	113	A406 L412 N413	A406-E409 HydrophobicContact CB-CG 4.38Å; E409-L412 PolarHBondContact O-N 3.07Å; E409-N413 WeakPolarHBondContact O-CB 3.47Å; E409-N413 VanDerWaalsContact O-CG 3.23Å; E409-N413 PolarHBondContact O-N 3.05Å; E409-N413 PolarHBondContact O-ND2 3.41Å; E409-N413 VanDerWaalsContact O-ND2 3.07Å
410	A	96.8	Very high	93.5	Very high	68 Å²	68	53.7 Å²	53.7	56%	0.562	31%	0.305	S	S	*	.	H	α-helix	trans	-67.9	-41.5	178.1	0	0	0	0	0	110.2	D408 N413 Q414	D408-A410 VanDerWaalsContact C-N 3.3Å; D408-A410 PolarHBondContact O-N 2.88Å; D408-A410 WeakPolarHBondContact OD1-CA 3.32Å; D408-A410 WeakPolarHBondContact OD1-CB 3.48Å; D408-A410 PolarHBondContact OD1-N 3.07Å; A410-N413 PolarHBondContact O-N 3.36Å; A410-Q414 WeakPolarHBondContact O-CB 3.46Å; A410-Q414 PolarHBondContact O-N 2.68Å
411	A	96.9	Very high	94.1	Very high	4 Å²	4	56.9 Å²	56.9	3%	0.033	32%	0.317	C	S	.	.	H	α-helix	trans	-61.1	-44	172.6	0	0	0	0	0	111.9	Y393 M396 D408 N413 Q414 A415	Y393-A411 HydrophobicContact CD1-CB 4.1Å; M396-A411 HydrophobicContact CB-CB 4.19Å; D408-A411 HydrophobicContact CB-CB 3.94Å; D408-A411 PolarHBondContact O-N 3.21Å; D408-A411 PolarHBondContact OD1-N 3.5Å; A411-N413 PolarHBondContact O-N 3.18Å; A411-Q414 PolarHBondContact O-N 2.83Å; A411-A415 PolarHBondContact O-N 3.13Å
412	L	96.4	Very high	94.8	Very high	2 Å²	2	53.6 Å²	53.6	1%	0.01	30%	0.297	C	S	.	.	H	α-helix	trans	-62.1	-40.4	175.7	-70.3	174.9	0	0	0	113	Y394 V398 A406 D408 E409 Q414 A415 L416 I444	Y394-L412 HydrophobicContact CD2-CD2 4.13Å; V398-L412 HydrophobicContact CG1-CD2 3.91Å; A406-L412 HydrophobicContact CB-CD1 3.72Å; D408-L412 PolarHBondContact O-N 3.41Å; D408-L412 VanDerWaalsContact O-N 3.16Å; E409-L412 PolarHBondContact O-N 3.07Å; L412-Q414 VanDerWaalsContact C-N 3.33Å; L412-A415 WeakPolarHBondContact O-CB 2.67Å; L412-A415 PolarHBondContact O-N 3.16Å; L412-L416 PolarHBondContact O-N 3.19Å; L412-I444 HydrophobicContact CD1-CB 4.42Å; L412-I444 HydrophobicContact CD1-CG2 3.55Å
413	N	97.1	Very high	95.5	Very high	70 Å²	70	49 Å²	49	37%	0.374	28%	0.282	S	S	.	.	H	α-helix	trans	-64	-41.2	175	-71.1	-35.5	0	0	0	111.1	E409 A410 A411 A415 L416 V417 K445	E409-N413 WeakPolarHBondContact O-CB 3.47Å; E409-N413 VanDerWaalsContact O-CG 3.23Å; E409-N413 PolarHBondContact O-N 3.05Å; E409-N413 PolarHBondContact O-ND2 3.41Å; E409-N413 VanDerWaalsContact O-ND2 3.07Å; A410-N413 PolarHBondContact O-N 3.36Å; A411-N413 PolarHBondContact O-N 3.18Å; N413-A415 VanDerWaalsContact C-N 3.34Å; N413-L416 PolarHBondContact O-N 3.24Å; N413-V417 WeakPolarHBondContact O-CG2 3.3Å; N413-V417 PolarHBondContact O-N 3.47Å; N413-K445 PolarHBondContact OD1-NZ 3.03Å
414	Q	98	Very high	95.7	Very high	63 Å²	63	56 Å²	56	29%	0.294	32%	0.315	S	S	.	.	H	α-helix	trans	-66.2	-37.4	176.7	-166.2	58.7	50.9	0	0	112	Y393 A410 A411 L412 V417 F418	Y393-Q414 HydrophobicContact CD1-CB 3.86Å; Y393-Q414 HydrophobicContact CD1-CG 3.96Å; Y393-Q414 HydrophobicContact CD2-CB 4.39Å; Y393-Q414 HydrophobicContact CD2-CG 3.84Å; Y393-Q414 HydrophobicContact CE1-CB 4.03Å; Y393-Q414 HydrophobicContact CE1-CG 3.78Å; Y393-Q414 HydrophobicContact CE2-CG 3.71Å; Y393-Q414 HydrophobicContact CG-CB 4.04Å; Y393-Q414 HydrophobicContact CG-CG 3.98Å; A410-Q414 WeakPolarHBondContact O-CB 3.46Å; A410-Q414 PolarHBondContact O-N 2.68Å; A411-Q414 PolarHBondContact O-N 2.83Å; L412-Q414 VanDerWaalsContact C-N 3.33Å; Q414-V417 PolarHBondContact O-N 3.1Å; Q414-F418 HydrophobicContact CG-CD2 3.82Å; Q414-F418 HydrophobicContact CG-CE2 3.52Å; Q414-F418 VanDerWaalsContact NE2-CZ 3.33Å; Q414-F418 VanDerWaalsContact O-CD2 3.25Å; Q414-F418 WeakPolarHBondContact O-CD2 3.31Å; Q414-F418 PolarHBondContact O-N 3.24Å
415	A	98.1	Very high	95.9	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-57.2	-50.3	171.9	0	0	0	0	0	110.8	G390 A411 L412 N413 V417 F418 L419	G390-A415 WeakPolarHBondContact O-CB 3.3Å; A411-A415 PolarHBondContact O-N 3.13Å; L412-A415 WeakPolarHBondContact O-CB 2.67Å; L412-A415 PolarHBondContact O-N 3.16Å; N413-A415 VanDerWaalsContact C-N 3.34Å; A415-V417 VanDerWaalsContact C-N 3.33Å; A415-V417 PolarHBondContact O-N 3.08Å; A415-F418 PolarHBondContact O-N 3.46Å; A415-L419 WeakPolarHBondContact O-CB 3.43Å; A415-L419 WeakPolarHBondContact O-CG 3.06Å; A415-L419 PolarHBondContact O-N 3.36Å
416	L	98	Very high	95.8	Very high	30 Å²	30	54.1 Å²	54.1	16%	0.157	31%	0.306	C	S	.	.	H	α-helix	trans	-60	-39.5	177.6	-73.6	171.4	0	0	0	112.9	L412 N413 L419 A420 R438 C441 L442 K445	L412-L416 PolarHBondContact O-N 3.19Å; N413-L416 PolarHBondContact O-N 3.24Å; L416-L419 PolarHBondContact O-N 2.9Å; L416-A420 WeakPolarHBondContact O-CB 3.36Å; L416-A420 PolarHBondContact O-N 2.88Å; L416-R438 HydrophobicContact CD2-CG 4.08Å; L416-C441 HydrophobicContact CD1-CB 4.39Å; L416-C441 HydrophobicContact CD2-CB 3.52Å; L416-C441 HydrophobicContact CG-CB 3.81Å; L416-L442 HydrophobicContact CD1-CD2 4.44Å; L416-L442 HydrophobicContact CD2-CD2 4.29Å; L416-L442 HydrophobicContact CD2-CG 4.18Å; L416-K445 HydrophobicContact CD1-CD 3.85Å
417	V	97.9	Very high	95.4	Very high	66 Å²	66	52.7 Å²	52.7	40%	0.4	29%	0.291	S	S	.	.	H	α-helix	trans	-61.5	-47.5	176	169.2	0	0	0	0	111.1	N413 Q414 A415 A420 K421	N413-V417 WeakPolarHBondContact O-CG2 3.3Å; N413-V417 PolarHBondContact O-N 3.47Å; Q414-V417 PolarHBondContact O-N 3.1Å; A415-V417 VanDerWaalsContact C-N 3.33Å; A415-V417 PolarHBondContact O-N 3.08Å; V417-A420 PolarHBondContact O-N 3.25Å; V417-K421 WeakPolarHBondContact O-CG 3.25Å; V417-K421 PolarHBondContact O-N 3.09Å; V417-K421 VanDerWaalsContact O-N 3.1Å
418	F	98.1	Very high	95.1	Very high	18 Å²	18	49 Å²	49	8%	0.079	27%	0.269	C	S	.	.	H	α-helix	trans	-70.3	-37.3	179.8	-73.4	-57	0	0	0	112.8	V377 Y386 I389 Y393 Q414 A415 A420 K421 A422	V377-F418 HydrophobicContact CG1-CE1 3.95Å; Y386-F418 AromaticContact CD1-CD1 3.58Å; Y386-F418 HydrophobicContact CD1-CD1 3.58Å; Y386-F418 HydrophobicContact CD1-CE1 4.1Å; Y386-F418 HydrophobicContact CE1-CD1 4Å; Y386-F418 HydrophobicContact CE1-CE1 4.15Å; I389-F418 HydrophobicContact CD1-CE2 3.92Å; I389-F418 HydrophobicContact CD1-CZ 3.98Å; I389-F418 HydrophobicContact CG1-CD2 4.48Å; I389-F418 HydrophobicContact CG1-CE2 4.29Å; I389-F418 HydrophobicContact CG2-CB 3.83Å; I389-F418 HydrophobicContact CG2-CD1 3.79Å; I389-F418 HydrophobicContact CG2-CD2 3.61Å; I389-F418 HydrophobicContact CG2-CE1 4.2Å; I389-F418 HydrophobicContact CG2-CE2 4Å; I389-F418 HydrophobicContact CG2-CG 3.48Å; I389-F418 VanDerWaalsContact CG2-CG 3.48Å; I389-F418 HydrophobicContact CG2-CZ 4.29Å; Y393-F418 AromaticContact CD2-CD2 3.8Å; Y393-F418 HydrophobicContact CD2-CD2 3.8Å; Y393-F418 AromaticContact CD2-CE2 3.78Å; Y393-F418 HydrophobicContact CD2-CE2 3.78Å; Y393-F418 HydrophobicContact CE2-CD2 4.02Å; Y393-F418 AromaticContact CE2-CE2 3.49Å; Y393-F418 HydrophobicContact CE2-CE2 3.49Å; Y393-F418 VanDerWaalsContact CE2-CE2 3.49Å; Q414-F418 HydrophobicContact CG-CD2 3.82Å; Q414-F418 HydrophobicContact CG-CE2 3.52Å; Q414-F418 VanDerWaalsContact NE2-CZ 3.33Å; Q414-F418 VanDerWaalsContact O-CD2 3.25Å; Q414-F418 WeakPolarHBondContact O-CD2 3.31Å; Q414-F418 PolarHBondContact O-N 3.24Å; A415-F418 PolarHBondContact O-N 3.46Å; F418-A420 VanDerWaalsContact C-N 3.31Å; F418-A420 PolarHBondContact O-N 2.83Å; F418-K421 HydrophobicContact CD1-CD 4.37Å; F418-K421 PolarHBondContact O-N 2.92Å; F418-A422 WeakPolarHBondContact O-CB 3.09Å; F418-A422 PolarHBondContact O-N 3.37Å
419	L	97.8	Very high	94.9	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-65.9	-34.9	174.8	-65.5	167.7	0	0	0	112.2	L387 A415 L416 A422 G423 L434 L437 R438	L387-L419 HydrophobicContact CD1-CD2 3.87Å; A415-L419 WeakPolarHBondContact O-CB 3.43Å; A415-L419 WeakPolarHBondContact O-CG 3.06Å; A415-L419 PolarHBondContact O-N 3.36Å; L416-L419 PolarHBondContact O-N 2.9Å; L419-A422 PolarHBondContact O-N 3.02Å; L419-G423 PolarHBondContact O-N 3.2Å; L419-L434 HydrophobicContact CD2-CG 4.43Å; L419-L437 HydrophobicContact CD1-CB 4.25Å; L419-L437 HydrophobicContact CD1-CD2 4.1Å; L419-L437 HydrophobicContact CD1-CG 3.86Å; L419-L437 HydrophobicContact CD2-CB 4.33Å; L419-L437 HydrophobicContact CD2-CD2 3.65Å; L419-L437 HydrophobicContact CD2-CG 4.2Å; L419-L437 HydrophobicContact CG-CD2 4.42Å; L419-R438 HydrophobicContact CD1-CB 4.26Å
420	A	96.8	Very high	94.7	Very high	43 Å²	43	42 Å²	42	36%	0.355	24%	0.242	S	C	.	.	H	α-helix	trans	-62.7	-48.8	171.9	0	0	0	0	0	111.1	L416 V417 F418 A422 G423 E424	L416-A420 WeakPolarHBondContact O-CB 3.36Å; L416-A420 PolarHBondContact O-N 2.88Å; V417-A420 PolarHBondContact O-N 3.25Å; F418-A420 VanDerWaalsContact C-N 3.31Å; F418-A420 PolarHBondContact O-N 2.83Å; A420-A422 VanDerWaalsContact C-N 3.33Å; A420-A422 PolarHBondContact O-N 3.37Å; A420-G423 CarbonylContact O-C 3.58Å; A420-G423 WeakPolarHBondContact O-CA 3.43Å; A420-G423 PolarHBondContact O-N 3.49Å; A420-E424 PolarHBondContact O-N 3.46Å; A420-E424 VanDerWaalsContact O-N 3.1Å
421	K	96.7	Very high	94.4	Very high	80 Å²	80	39.1 Å²	39.1	35%	0.348	22%	0.217	S	C	.	.	H	α-helix	trans	-59.9	-40.6	175.6	-70.4	179.4	178.3	-174.8	0	112.8	Y386 V417 F418 G423 E424	Y386-K421 HydrophobicContact CD1-CB 4.36Å; Y386-K421 HydrophobicContact CD1-CD 4.41Å; Y386-K421 HydrophobicContact CD2-CB 3.8Å; Y386-K421 HydrophobicContact CE1-CB 4.44Å; Y386-K421 HydrophobicContact CE1-CD 3.93Å; Y386-K421 HydrophobicContact CE2-CB 3.92Å; Y386-K421 HydrophobicContact CE2-CD 4.46Å; Y386-K421 HydrophobicContact CG-CB 4.04Å; V417-K421 WeakPolarHBondContact O-CG 3.25Å; V417-K421 PolarHBondContact O-N 3.09Å; V417-K421 VanDerWaalsContact O-N 3.1Å; F418-K421 HydrophobicContact CD1-CD 4.37Å; F418-K421 PolarHBondContact O-N 2.92Å; K421-G423 VanDerWaalsContact C-N 3.26Å; K421-G423 PolarHBondContact O-N 3.02Å; K421-E424 PolarHBondContact O-N 3.26Å
422	A	96.1	Very high	94.3	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-60.9	-39	174.4	0	0	0	0	0	111.2	F383 L387 F418 L419 A420 E424 S425 G428 L434	F383-A422 HydrophobicContact CB-CB 4.45Å; L387-A422 HydrophobicContact CB-CB 4.47Å; F418-A422 WeakPolarHBondContact O-CB 3.09Å; F418-A422 PolarHBondContact O-N 3.37Å; L419-A422 PolarHBondContact O-N 3.02Å; A420-A422 VanDerWaalsContact C-N 3.33Å; A420-A422 PolarHBondContact O-N 3.37Å; A422-E424 VanDerWaalsContact C-N 3.34Å; A422-E424 PolarHBondContact O-N 2.85Å; A422-S425 PolarHBondContact O-N 3.43Å; A422-G428 WeakPolarHBondContact O-CA 3.34Å; A422-L434 HydrophobicContact CB-CD1 3.44Å; A422-L434 VanDerWaalsContact CB-CD1 3.44Å
423	G	94.9	Very high	94.2	Very high	26 Å²	26	44 Å²	44	27%	0.268	24%	0.241	S	C	.	.	H	α-helix	trans	-77	-10.2	179.2	0	0	0	0	0	115.7	L419 A420 K421 S425	L419-G423 PolarHBondContact O-N 3.2Å; A420-G423 CarbonylContact O-C 3.58Å; A420-G423 WeakPolarHBondContact O-CA 3.43Å; A420-G423 PolarHBondContact O-N 3.49Å; K421-G423 VanDerWaalsContact C-N 3.26Å; K421-G423 PolarHBondContact O-N 3.02Å; G423-S425 VanDerWaalsContact C-N 3.25Å
424	E	94.3	Very high	94.2	Very high	157 Å²	157	40.7 Å²	40.7	73%	0.734	22%	0.224	S	C	*	.	H	α-helix	trans	-69.1	-27.1	171.6	-71.1	169.5	-169.3	0	0	111.7	A420 K421 A422	A420-E424 PolarHBondContact O-N 3.46Å; A420-E424 VanDerWaalsContact O-N 3.1Å; K421-E424 PolarHBondContact O-N 3.26Å; A422-E424 VanDerWaalsContact C-N 3.34Å; A422-E424 PolarHBondContact O-N 2.85Å
425	S	91	Very high	94.1	Very high	43 Å²	43	38.8 Å²	38.8	30%	0.301	22%	0.215	S	C	.	.	S	Bend	trans	-73.5	135.6	171	175.4	0	0	0	0	110.5	A422 G423 L427 G428 A429	A422-S425 PolarHBondContact O-N 3.43Å; G423-S425 VanDerWaalsContact C-N 3.25Å; S425-L427 PolarHBondContact O-N 2.94Å; S425-L427 PolarHBondContact OG-N 3.42Å; S425-G428 PolarHBondContact O-N 3.36Å; S425-A429 PolarHBondContact O-N 3.4Å
426	E	87.5	Confident	94.1	Very high	131 Å²	131	40.2 Å²	40.2	61%	0.612	22%	0.222	S	C	*	.	H	α-helix	trans	-54.3	-42.2	175.8	-165.3	-163.4	164.2	0	0	111.6	K47 A429 T430	K47-E426 IonicContact NZ-OE1 3.19Å; K47-E426 PolarHBondContact NZ-OE1 3.5Å; K47-E426 IonicContact NZ-OE2 3.31Å; K47-E426 PolarHBondContact NZ-OE2 3.05Å; E426-A429 PolarHBondContact O-N 2.98Å; E426-T430 WeakPolarHBondContact O-CG2 3.32Å
427	L	86.6	Confident	94	Very high	15 Å²	15	39.3 Å²	39.3	8%	0.079	22%	0.218	C	C	.	.	H	α-helix	trans	-62.8	-47.7	174.7	-91	174.9	0	0	0	111.7	K47 L48 E51 F383 S425 A429 T430	K47-L427 HydrophobicContact CB-CD1 4.03Å; K47-L427 HydrophobicContact CB-CD2 3.31Å; K47-L427 HydrophobicContact CB-CG 3.88Å; K47-L427 HydrophobicContact CD-CD2 4.14Å; K47-L427 HydrophobicContact CD-CG 4.28Å; K47-L427 HydrophobicContact CG-CD2 4.33Å; L48-L427 HydrophobicContact CD2-CD2 4.36Å; L48-L427 HydrophobicContact CG-CD2 4.28Å; E51-L427 VanDerWaalsContact CD-CD1 3.46Å; E51-L427 HydrophobicContact CG-CD1 4.1Å; E51-L427 WeakPolarHBondContact OE1-CD1 3.45Å; F383-L427 HydrophobicContact CE1-CB 4.21Å; F383-L427 HydrophobicContact CE1-CD1 4.11Å; F383-L427 HydrophobicContact CZ-CB 4.19Å; F383-L427 HydrophobicContact CZ-CD1 4.26Å; S425-L427 PolarHBondContact O-N 2.94Å; S425-L427 PolarHBondContact OG-N 3.42Å; L427-A429 VanDerWaalsContact C-N 3.29Å; L427-A429 PolarHBondContact O-N 3.02Å; L427-T430 PolarHBondContact O-N 3.29Å; L427-T430 PolarHBondContact O-OG1 3.12Å
428	G	88.8	Confident	94	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.4	-37.7	179.8	0	0	0	0	0	112.8	A422 S425 T430 L431	A422-G428 WeakPolarHBondContact O-CA 3.34Å; S425-G428 PolarHBondContact O-N 3.36Å; G428-T430 PolarHBondContact O-N 3.21Å; G428-T430 VanDerWaalsContact O-N 3.14Å; G428-L431 PolarHBondContact O-N 3.49Å
429	A	89.6	Confident	93.9	Very high	36 Å²	36	40.3 Å²	40.3	30%	0.298	21%	0.214	S	C	.	.	H	α-helix	trans	-63.4	-18	176.7	0	0	0	0	0	114.1	S425 E426 L427	S425-A429 PolarHBondContact O-N 3.4Å; E426-A429 PolarHBondContact O-N 2.98Å; L427-A429 VanDerWaalsContact C-N 3.29Å; L427-A429 PolarHBondContact O-N 3.02Å
430	T	90.6	Very high	93.9	Very high	29 Å²	29	40.7 Å²	40.7	18%	0.178	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	1.2	179.4	65.1	0	0	0	0	114.4	R44 E426 L427 G428	R44-T430 WeakPolarHBondContact CD-O 3.33Å; R44-T430 VanDerWaalsContact CG-OG1 3.31Å; R44-T430 WeakPolarHBondContact CG-OG1 3.39Å; E426-T430 WeakPolarHBondContact O-CG2 3.32Å; L427-T430 PolarHBondContact O-N 3.29Å; L427-T430 PolarHBondContact O-OG1 3.12Å; G428-T430 PolarHBondContact O-N 3.21Å; G428-T430 VanDerWaalsContact O-N 3.14Å
431	L	92.3	Very high	93.9	Very high	8 Å²	8	38.7 Å²	38.7	4%	0.042	20%	0.198	C	C	.	.			trans	-88.3	120.9	-179.4	-60.9	179.1	0	0	0	112	F383 L387 G428 E433 L434	F383-L431 HydrophobicContact CD2-CD1 3.87Å; F383-L431 HydrophobicContact CE2-CD1 3.73Å; L387-L431 HydrophobicContact CD2-CD1 4.01Å; G428-L431 PolarHBondContact O-N 3.49Å; L431-E433 VanDerWaalsContact C-N 3.32Å; L431-E433 HydrophobicContact CB-CG 4.42Å; L431-E433 PolarHBondContact O-N 3.2Å; L431-L434 HydrophobicContact CB-CB 4.09Å; L431-L434 PolarHBondContact O-N 3.37Å
432	P	93.8	Very high	93.9	Very high	21 Å²	21	35.4 Å²	35.4	14%	0.136	19%	0.185	C	C	.	.	H	α-helix	trans	-62.5	-37.4	176.9	23.9	-32.2	0	0	0	112.6	L434 Q435 L436 L461	P432-L434 VanDerWaalsContact C-N 3.31Å; P432-L434 PolarHBondContact O-N 2.98Å; P432-Q435 PolarHBondContact O-N 3.45Å; P432-L436 WeakPolarHBondContact O-CB 3.47Å; P432-L436 PolarHBondContact O-N 3.26Å; P432-L461 HydrophobicContact CB-CB 4.04Å
433	E	94.3	Very high	93.8	Very high	88 Å²	88	37.3 Å²	37.3	41%	0.411	19%	0.192	S	C	.	.	H	α-helix	trans	-64	-33.5	-179.1	64.1	-86.7	-155.9	0	0	113.1	L387 L431 L437	L387-E433 HydrophobicContact CD2-CG 3.81Å; L431-E433 VanDerWaalsContact C-N 3.32Å; L431-E433 HydrophobicContact CB-CG 4.42Å; L431-E433 PolarHBondContact O-N 3.2Å; E433-L437 VanDerWaalsContact O-CB 3.32Å; E433-L437 WeakPolarHBondContact O-CB 3.25Å; E433-L437 PolarHBondContact O-N 3.45Å
434	L	96.5	Very high	93.8	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-65.3	-45.2	175	-176.6	153.8	0	0	0	110.5	L387 L419 A422 L431 P432 L437 R438	L387-L434 HydrophobicContact CD1-CB 3.99Å; L387-L434 HydrophobicContact CD1-CG 4.35Å; L419-L434 HydrophobicContact CD2-CG 4.43Å; A422-L434 HydrophobicContact CB-CD1 3.44Å; A422-L434 VanDerWaalsContact CB-CD1 3.44Å; L431-L434 HydrophobicContact CB-CB 4.09Å; L431-L434 PolarHBondContact O-N 3.37Å; P432-L434 VanDerWaalsContact C-N 3.31Å; P432-L434 PolarHBondContact O-N 2.98Å; L434-L437 PolarHBondContact O-N 3.38Å; L434-R438 WeakPolarHBondContact O-CB 3.17Å; L434-R438 PolarHBondContact O-N 3.45Å
435	Q	96.8	Very high	93.8	Very high	22 Å²	22	34.3 Å²	34.3	10%	0.103	17%	0.17	C	C	.	.	H	α-helix	trans	-68.9	-40.8	-179.9	-60.2	-61.5	-24.3	0	0	111.3	P432 R438 G439 C454 R457 A458 L461	P432-Q435 PolarHBondContact O-N 3.45Å; Q435-R438 PolarHBondContact O-N 2.87Å; Q435-G439 PolarHBondContact O-N 3.47Å; Q435-C454 WeakPolarHBondContact O-CB 3.46Å; Q435-R457 HydrophobicContact CG-CB 4.24Å; Q435-R457 HydrophobicContact CG-CG 3.82Å; Q435-A458 HydrophobicContact CB-CB 3.97Å; Q435-L461 HydrophobicContact CG-CD1 3.98Å
436	L	96.9	Very high	93.8	Very high	30 Å²	30	34.6 Å²	34.6	16%	0.157	18%	0.179	C	C	.	.	H	α-helix	trans	-55.9	-52.7	173.4	176	61.3	0	0	0	111.1	P432 R438 G439 K440 F455 A458 E470	P432-L436 WeakPolarHBondContact O-CB 3.47Å; P432-L436 PolarHBondContact O-N 3.26Å; L436-R438 PolarHBondContact O-N 3.06Å; L436-G439 PolarHBondContact O-N 3.27Å; L436-K440 HydrophobicContact CD1-CD 4.5Å; L436-K440 HydrophobicContact CG-CD 4.47Å; L436-K440 WeakPolarHBondContact O-CG 3.43Å; L436-K440 PolarHBondContact O-N 3.13Å; L436-F455 HydrophobicContact CD1-CD1 4.08Å; L436-F455 HydrophobicContact CD1-CE1 3.98Å; L436-F455 WeakPolarHBondContact O-CE1 3.33Å; L436-A458 HydrophobicContact CB-CB 4.48Å; L436-E470 HydrophobicContact CD1-CG 4.37Å; L436-E470 HydrophobicContact CD2-CB 4.49Å; L436-E470 HydrophobicContact CD2-CG 4.49Å
437	L	96.8	Very high	94.2	Very high	12 Å²	12	31.8 Å²	31.8	6%	0.063	17%	0.166	C	C	.	.	H	α-helix	trans	-66.4	-40.8	-177	-169.9	62	0	0	0	112.1	Q391 Y394 L419 E433 L434 G439 K440 C441	Q391-L437 VanDerWaalsContact CA-CD2 3.43Å; Q391-L437 HydrophobicContact CB-CD2 3.67Å; Q391-L437 HydrophobicContact CG-CD2 4.13Å; Y394-L437 HydrophobicContact CD1-CD1 3.38Å; Y394-L437 HydrophobicContact CD2-CD1 4.12Å; Y394-L437 HydrophobicContact CE1-CD1 3.94Å; Y394-L437 HydrophobicContact CG-CD1 3.47Å; Y394-L437 VanDerWaalsContact CG-CD1 3.47Å; Y394-L437 HydrophobicContact CG-CG 4.47Å; L419-L437 HydrophobicContact CD1-CB 4.25Å; L419-L437 HydrophobicContact CD1-CD2 4.1Å; L419-L437 HydrophobicContact CD1-CG 3.86Å; L419-L437 HydrophobicContact CD2-CB 4.33Å; L419-L437 HydrophobicContact CD2-CD2 3.65Å; L419-L437 HydrophobicContact CD2-CG 4.2Å; L419-L437 HydrophobicContact CG-CD2 4.42Å; E433-L437 VanDerWaalsContact O-CB 3.32Å; E433-L437 WeakPolarHBondContact O-CB 3.25Å; E433-L437 PolarHBondContact O-N 3.45Å; L434-L437 PolarHBondContact O-N 3.38Å; L437-G439 VanDerWaalsContact C-N 3.35Å; L437-G439 PolarHBondContact O-N 3.45Å; L437-K440 PolarHBondContact O-N 3.07Å; L437-C441 PolarHBondContact O-N 3.14Å; L437-C441 PolarHBondContact O-SG 3Å; L437-C441 VanDerWaalsContact O-SG 3.35Å
438	R	97.5	Very high	94.5	Very high	105 Å²	105	31.6 Å²	31.6	40%	0.396	17%	0.166	S	C	.	.	H	α-helix	trans	-61.4	-43.6	173.9	-175.9	178.8	174.4	-177.3	-0.9	111.5	L416 L419 L434 Q435 L436 C441 L442	L416-R438 HydrophobicContact CD2-CG 4.08Å; L419-R438 HydrophobicContact CD1-CB 4.26Å; L434-R438 WeakPolarHBondContact O-CB 3.17Å; L434-R438 PolarHBondContact O-N 3.45Å; Q435-R438 PolarHBondContact O-N 2.87Å; L436-R438 PolarHBondContact O-N 3.06Å; R438-C441 WeakPolarHBondContact O-CB 3.43Å; R438-C441 PolarHBondContact O-N 2.96Å; R438-L442 HydrophobicContact CG-CD1 4.1Å; R438-L442 WeakPolarHBondContact O-CG 3.33Å; R438-L442 PolarHBondContact O-N 3.16Å
439	G	97.3	Very high	94.8	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-61.3	-42.8	176	0	0	0	0	0	112.1	Q435 L436 L437 L442 R443 A451 F455	Q435-G439 PolarHBondContact O-N 3.47Å; L436-G439 PolarHBondContact O-N 3.27Å; L437-G439 VanDerWaalsContact C-N 3.35Å; L437-G439 PolarHBondContact O-N 3.45Å; G439-L442 PolarHBondContact O-N 3.49Å; G439-R443 WeakPolarHBondContact O-CB 3.15Å; G439-R443 PolarHBondContact O-N 3.35Å; G439-A451 WeakPolarHBondContact O-CB 3.49Å; G439-F455 WeakPolarHBondContact O-CZ 3.3Å
440	K	96.8	Very high	95.1	Very high	8 Å²	8	36.3 Å²	36.3	4%	0.035	19%	0.192	C	C	.	.	H	α-helix	trans	-59.8	-47	175	-74.1	177.6	170.1	-170	0	111.9	Y394 E403 L436 L437 L442 R443 I444 F455 E470	Y394-K440 HydrophobicContact CE1-CD 4.41Å; Y394-K440 HydrophobicContact CE2-CB 3.71Å; E403-K440 IonicContact OE2-NZ 3.8Å; L436-K440 HydrophobicContact CD1-CD 4.5Å; L436-K440 HydrophobicContact CG-CD 4.47Å; L436-K440 WeakPolarHBondContact O-CG 3.43Å; L436-K440 PolarHBondContact O-N 3.13Å; L437-K440 PolarHBondContact O-N 3.07Å; K440-L442 PolarHBondContact O-N 3.18Å; K440-R443 PolarHBondContact O-N 3.17Å; K440-I444 WeakPolarHBondContact O-CG1 3.42Å; K440-I444 PolarHBondContact O-N 2.88Å; K440-I444 VanDerWaalsContact O-N 3.11Å; K440-F455 HydrophobicContact CG-CE1 4.16Å; K440-F455 HydrophobicContact CG-CZ 4.31Å; K440-E470 VanDerWaalsContact CE-OE1 3.32Å; K440-E470 WeakPolarHBondContact CE-OE1 3.37Å; K440-E470 IonicContact NZ-OE1 2.75Å; K440-E470 PolarHBondContact NZ-OE1 3.35Å; K440-E470 IonicContact NZ-OE2 3.69Å; K440-E470 PolarHBondContact NZ-OE2 2.92Å
441	C	97.1	Very high	95.5	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-56.2	-47.8	174.8	-68	0	0	0	0	112.2	Y394 L416 L437 R438 I444 K445	Y394-C441 WeakPolarHBondContact CD2-SG 3.26Å; L416-C441 HydrophobicContact CD1-CB 4.39Å; L416-C441 HydrophobicContact CD2-CB 3.52Å; L416-C441 HydrophobicContact CG-CB 3.81Å; L437-C441 PolarHBondContact O-N 3.14Å; L437-C441 PolarHBondContact O-SG 3Å; L437-C441 VanDerWaalsContact O-SG 3.35Å; R438-C441 WeakPolarHBondContact O-CB 3.43Å; R438-C441 PolarHBondContact O-N 2.96Å; C441-I444 PolarHBondContact O-N 3.23Å; C441-K445 WeakPolarHBondContact O-CG 3.5Å; C441-K445 PolarHBondContact O-N 2.98Å
442	L	96.6	Very high	95.7	Very high	12 Å²	12	34.7 Å²	34.7	6%	0.063	18%	0.183	C	C	.	.	H	α-helix	trans	-65.2	-39.2	-178.8	-70.5	166.6	0	0	0	112.1	L416 R438 G439 K440 K445 G446 E447 N450 A451	L416-L442 HydrophobicContact CD1-CD2 4.44Å; L416-L442 HydrophobicContact CD2-CD2 4.29Å; L416-L442 HydrophobicContact CD2-CG 4.18Å; R438-L442 HydrophobicContact CG-CD1 4.1Å; R438-L442 WeakPolarHBondContact O-CG 3.33Å; R438-L442 PolarHBondContact O-N 3.16Å; G439-L442 PolarHBondContact O-N 3.49Å; K440-L442 PolarHBondContact O-N 3.18Å; L442-K445 CarbonylContact O-C 3.47Å; L442-K445 PolarHBondContact O-N 3.23Å; L442-K445 VanDerWaalsContact O-N 3.13Å; L442-G446 PolarHBondContact O-N 3.3Å; L442-E447 HydrophobicContact CB-CB 4.24Å; L442-E447 HydrophobicContact CD2-CB 4.32Å; L442-E447 PolarHBondContact O-N 3.3Å; L442-N450 HydrophobicContact CD1-CB 3.93Å; L442-A451 HydrophobicContact CB-CB 4.03Å
443	R	95.3	Very high	95.9	Very high	40 Å²	40	36.4 Å²	36.4	15%	0.151	20%	0.199	C	C	.	.	H	α-helix	trans	-62	-44.4	177	-170.1	177.5	70.2	179.1	9.4	111.8	G439 K440 K445 G446 A451 E477	G439-R443 WeakPolarHBondContact O-CB 3.15Å; G439-R443 PolarHBondContact O-N 3.35Å; K440-R443 PolarHBondContact O-N 3.17Å; R443-K445 PolarHBondContact O-N 3.37Å; R443-G446 PolarHBondContact O-N 3.37Å; R443-A451 HydrophobicContact CB-CB 3.88Å; R443-E477 IonicContact CZ-OE2 3.27Å; R443-E477 IonicContact NH1-OE2 2.67Å; R443-E477 PolarHBondContact NH1-OE2 3.23Å; R443-E477 IonicContact NH2-OE2 2.95Å
444	I	94.8	Very high	96.1	Very high	29 Å²	29	32.7 Å²	32.7	15%	0.149	18%	0.182	C	C	.	.	H	α-helix	trans	-60.2	-31	175.8	-65.7	-64.6	0	0	0	111.9	V398 E403 L404 A406 L412 K440 C441 G446	V398-I444 HydrophobicContact CG1-CD1 4.47Å; V398-I444 HydrophobicContact CG1-CG1 4.09Å; E403-I444 WeakPolarHBondContact O-CD1 3.34Å; L404-I444 WeakPolarHBondContact O-CD1 3.47Å; A406-I444 HydrophobicContact CB-CG2 3.75Å; L412-I444 HydrophobicContact CD1-CB 4.42Å; L412-I444 HydrophobicContact CD1-CG2 3.55Å; K440-I444 WeakPolarHBondContact O-CG1 3.42Å; K440-I444 PolarHBondContact O-N 2.88Å; K440-I444 VanDerWaalsContact O-N 3.11Å; C441-I444 PolarHBondContact O-N 3.23Å; I444-G446 VanDerWaalsContact C-N 3.26Å; I444-G446 PolarHBondContact O-N 3.29Å
445	K	93.1	Very high	96.1	Very high	91 Å²	91	32.6 Å²	32.6	40%	0.396	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	0.9	175.5	-64.5	-173.2	68.7	171.5	0	114.1	N413 L416 C441 L442 R443 E447	N413-K445 PolarHBondContact OD1-NZ 3.03Å; L416-K445 HydrophobicContact CD1-CD 3.85Å; C441-K445 WeakPolarHBondContact O-CG 3.5Å; C441-K445 PolarHBondContact O-N 2.98Å; L442-K445 CarbonylContact O-C 3.47Å; L442-K445 PolarHBondContact O-N 3.23Å; L442-K445 VanDerWaalsContact O-N 3.13Å; R443-K445 PolarHBondContact O-N 3.37Å; K445-E447 VanDerWaalsContact C-N 3.33Å
446	G	91.7	Very high	96.2	Very high	48 Å²	48	33.9 Å²	33.9	50%	0.495	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.9	14.4	-178.1	0	0	0	0	0	114.4	L442 R443 I444 D448	L442-G446 PolarHBondContact O-N 3.3Å; R443-G446 PolarHBondContact O-N 3.37Å; I444-G446 VanDerWaalsContact C-N 3.26Å; I444-G446 PolarHBondContact O-N 3.29Å; G446-D448 VanDerWaalsContact C-N 3.29Å; G446-D448 PolarHBondContact O-N 3.06Å
447	E	94.8	Very high	96.1	Very high	73 Å²	73	37.2 Å²	37.2	34%	0.341	20%	0.198	S	C	.	.			trans	-89.4	59.2	176.9	-64.2	-173.8	-135.3	0	0	111.3	L442 K445 A449 N450 A451	L442-E447 HydrophobicContact CB-CB 4.24Å; L442-E447 HydrophobicContact CD2-CB 4.32Å; L442-E447 PolarHBondContact O-N 3.3Å; K445-E447 VanDerWaalsContact C-N 3.33Å; E447-A449 VanDerWaalsContact C-N 3.29Å; E447-A449 PolarHBondContact O-N 2.91Å; E447-N450 HydrophobicContact CB-CB 4.24Å; E447-N450 PolarHBondContact O-N 3.27Å; E447-N450 VanDerWaalsContact O-N 3.1Å; E447-N450 PolarHBondContact OE2-ND2 3.48Å; E447-A451 WeakPolarHBondContact O-CB 3.4Å; E447-A451 PolarHBondContact O-N 2.97Å
448	D	94.2	Very high	96.1	Very high	11 Å²	11	36.7 Å²	36.7	6%	0.059	20%	0.195	C	C	.	.	H	α-helix	trans	-59.6	-34	-170	-67.1	-56.9	0	0	0	114	G446 A452 Q482 Q485	G446-D448 VanDerWaalsContact C-N 3.29Å; G446-D448 PolarHBondContact O-N 3.06Å; D448-A452 WeakPolarHBondContact O-CB 3.47Å; D448-A452 PolarHBondContact O-N 3.34Å; D448-Q482 HydrophobicContact CB-CG 3.7Å; D448-Q482 PolarHBondContact O-NE2 2.98Å; D448-Q485 PolarHBondContact OD2-NE2 2.85Å
449	A	94.8	Very high	95.9	Very high	48 Å²	48	31.7 Å²	31.7	40%	0.397	18%	0.177	S	C	.	.	H	α-helix	trans	-64.9	-45.4	175.9	0	0	0	0	0	112.3	E447 A452 A453	E447-A449 VanDerWaalsContact C-N 3.29Å; E447-A449 PolarHBondContact O-N 2.91Å; A449-A452 PolarHBondContact O-N 3.35Å; A449-A453 PolarHBondContact O-N 3.21Å; A449-A453 VanDerWaalsContact O-N 3.1Å
450	N	96.6	Very high	95.7	Very high	87 Å²	87	34.6 Å²	34.6	47%	0.465	19%	0.19	S	C	.	.	H	α-helix	trans	-70.2	-38.5	177.6	-66.8	-29.1	0	0	0	110.8	L442 E447 A453 C454	L442-N450 HydrophobicContact CD1-CB 3.93Å; E447-N450 HydrophobicContact CB-CB 4.24Å; E447-N450 PolarHBondContact O-N 3.27Å; E447-N450 VanDerWaalsContact O-N 3.1Å; E447-N450 PolarHBondContact OE2-ND2 3.48Å; N450-A453 PolarHBondContact O-N 2.86Å; N450-C454 PolarHBondContact O-N 2.94Å; N450-C454 VanDerWaalsContact O-N 3.08Å
451	A	97.4	Very high	95.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60	-47.3	173.8	0	0	0	0	0	111.6	G439 L442 R443 E447 A453 C454 F455	G439-A451 WeakPolarHBondContact O-CB 3.49Å; L442-A451 HydrophobicContact CB-CB 4.03Å; R443-A451 HydrophobicContact CB-CB 3.88Å; E447-A451 WeakPolarHBondContact O-CB 3.4Å; E447-A451 PolarHBondContact O-N 2.97Å; A451-A453 VanDerWaalsContact C-N 3.32Å; A451-A453 PolarHBondContact O-N 3.19Å; A451-C454 WeakPolarHBondContact O-CB 3.28Å; A451-C454 PolarHBondContact O-N 3.32Å; A451-C454 VanDerWaalsContact O-N 3.14Å; A451-F455 HydrophobicContact CB-CD2 4.42Å; A451-F455 HydrophobicContact CB-CE2 3.84Å; A451-F455 HydrophobicContact CB-CZ 4.46Å; A451-F455 WeakPolarHBondContact O-CD2 3.4Å; A451-F455 WeakPolarHBondContact O-CG 3.45Å; A451-F455 PolarHBondContact O-N 3.27Å
452	A	97.6	Very high	95.2	Very high	3 Å²	3	35.4 Å²	35.4	3%	0.025	19%	0.194	C	C	.	.	H	α-helix	trans	-59.5	-41.3	175.7	0	0	0	0	0	111.9	D448 A449 C454 F455 K456 L475 A478	D448-A452 WeakPolarHBondContact O-CB 3.47Å; D448-A452 PolarHBondContact O-N 3.34Å; A449-A452 PolarHBondContact O-N 3.35Å; A452-C454 VanDerWaalsContact C-N 3.33Å; A452-C454 PolarHBondContact O-N 2.91Å; A452-F455 PolarHBondContact O-N 3.17Å; A452-K456 WeakPolarHBondContact O-CB 3.34Å; A452-K456 WeakPolarHBondContact O-CG 3.38Å; A452-K456 PolarHBondContact O-N 3.13Å; A452-L475 HydrophobicContact CB-CD1 4.04Å; A452-A478 HydrophobicContact CB-CB 4.05Å
453	A	97.4	Very high	94.6	Very high	56 Å²	56	37.7 Å²	37.7	46%	0.463	21%	0.207	S	C	.	.	H	α-helix	trans	-60.3	-41.6	175.3	0	0	0	0	0	112.4	A449 N450 A451 R457	A449-A453 PolarHBondContact O-N 3.21Å; A449-A453 VanDerWaalsContact O-N 3.1Å; N450-A453 PolarHBondContact O-N 2.86Å; A451-A453 VanDerWaalsContact C-N 3.32Å; A451-A453 PolarHBondContact O-N 3.19Å; A453-R457 PolarHBondContact O-N 3.29Å
454	C	97.7	Very high	94.1	Very high	10 Å²	10	39.6 Å²	39.6	7%	0.068	23%	0.231	C	C	.	.	H	α-helix	trans	-63.2	-46.1	173.4	-76.7	0	0	0	0	112.3	Q435 N450 A451 A452 R457 A458	Q435-C454 WeakPolarHBondContact O-CB 3.46Å; N450-C454 PolarHBondContact O-N 2.94Å; N450-C454 VanDerWaalsContact O-N 3.08Å; A451-C454 WeakPolarHBondContact O-CB 3.28Å; A451-C454 PolarHBondContact O-N 3.32Å; A451-C454 VanDerWaalsContact O-N 3.14Å; A452-C454 VanDerWaalsContact C-N 3.33Å; A452-C454 PolarHBondContact O-N 2.91Å; C454-R457 WeakPolarHBondContact O-CB 3.34Å; C454-R457 PolarHBondContact O-N 3.02Å; C454-A458 PolarHBondContact O-N 3.43Å
455	F	98.1	Very high	93.5	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-67.4	-37.9	179.4	-59.1	-46.7	0	0	0	112.9	L436 G439 K440 A451 A452 R457 A458 V459 C474 L475 A478	L436-F455 HydrophobicContact CD1-CD1 4.08Å; L436-F455 HydrophobicContact CD1-CE1 3.98Å; L436-F455 WeakPolarHBondContact O-CE1 3.33Å; G439-F455 WeakPolarHBondContact O-CZ 3.3Å; K440-F455 HydrophobicContact CG-CE1 4.16Å; K440-F455 HydrophobicContact CG-CZ 4.31Å; A451-F455 HydrophobicContact CB-CD2 4.42Å; A451-F455 HydrophobicContact CB-CE2 3.84Å; A451-F455 HydrophobicContact CB-CZ 4.46Å; A451-F455 WeakPolarHBondContact O-CD2 3.4Å; A451-F455 WeakPolarHBondContact O-CG 3.45Å; A451-F455 PolarHBondContact O-N 3.27Å; A452-F455 PolarHBondContact O-N 3.17Å; F455-R457 VanDerWaalsContact C-N 3.31Å; F455-R457 PolarHBondContact O-N 3.35Å; F455-A458 WeakPolarHBondContact O-CB 3.26Å; F455-A458 PolarHBondContact O-N 3.28Å; F455-V459 WeakPolarHBondContact O-CG2 3.44Å; F455-V459 PolarHBondContact O-N 2.98Å; F455-C474 HydrophobicContact CD1-CB 3.65Å; F455-C474 HydrophobicContact CD2-CB 3.85Å; F455-C474 WeakPolarHBondContact CD2-O 3.42Å; F455-C474 HydrophobicContact CE1-CB 3.48Å; F455-C474 VanDerWaalsContact CE1-CB 3.48Å; F455-C474 HydrophobicContact CE2-CB 3.7Å; F455-C474 HydrophobicContact CG-CB 3.84Å; F455-C474 HydrophobicContact CZ-CB 3.52Å; F455-L475 HydrophobicContact CB-CB 3.7Å; F455-L475 HydrophobicContact CB-CD1 4.28Å; F455-A478 HydrophobicContact CD2-CB 4.1Å; F455-A478 HydrophobicContact CE2-CB 4.16Å
456	K	97.4	Very high	93.1	Very high	48 Å²	48	37 Å²	37	21%	0.209	24%	0.236	C	C	.	.	H	α-helix	trans	-52.4	-54.2	168.7	-74	177.6	179.5	-172	0	109.2	A452 A458 V459 E460 L475 E496 W500	A452-K456 WeakPolarHBondContact O-CB 3.34Å; A452-K456 WeakPolarHBondContact O-CG 3.38Å; A452-K456 PolarHBondContact O-N 3.13Å; K456-A458 VanDerWaalsContact C-N 3.32Å; K456-A458 PolarHBondContact O-N 3.41Å; K456-V459 PolarHBondContact O-N 3.28Å; K456-V459 VanDerWaalsContact O-N 3.14Å; K456-E460 VanDerWaalsContact O-CG 3.28Å; K456-E460 WeakPolarHBondContact O-CG 3.17Å; K456-E460 PolarHBondContact O-N 3.4Å; K456-L475 HydrophobicContact CD-CD1 4.48Å; K456-L475 HydrophobicContact CG-CD1 3.62Å; K456-L475 HydrophobicContact CG-CD2 3.88Å; K456-L475 HydrophobicContact CG-CG 4.43Å; K456-E496 WeakPolarHBondContact CE-OE2 3.41Å; K456-E496 IonicContact NZ-OE1 3.37Å; K456-E496 PolarHBondContact NZ-OE1 3.02Å; K456-E496 IonicContact NZ-OE2 2.65Å; K456-E496 PolarHBondContact NZ-OE2 2.96Å; K456-W500 HydrophobicContact CB-CH2 3.55Å; K456-W500 HydrophobicContact CB-CZ2 3.53Å; K456-W500 HydrophobicContact CB-CZ3 4.2Å; K456-W500 HydrophobicContact CD-CH2 4.49Å; K456-W500 HydrophobicContact CD-CZ2 3.6Å; K456-W500 HydrophobicContact CG-CD2 4.18Å; K456-W500 VanDerWaalsContact CG-CE2 3.49Å; K456-W500 HydrophobicContact CG-CH2 3.89Å; K456-W500 HydrophobicContact CG-CZ2 3.36Å; K456-W500 HydrophobicContact CG-CZ3 4.47Å
457	R	95.8	Very high	92.8	Very high	100 Å²	100	38.1 Å²	38.1	38%	0.377	24%	0.236	S	C	.	.	H	α-helix	trans	-59.7	-39.6	179.5	-173.3	59.8	179.3	168	0.4	112.9	Q435 A453 C454 F455 E460 L461	Q435-R457 HydrophobicContact CG-CB 4.24Å; Q435-R457 HydrophobicContact CG-CG 3.82Å; A453-R457 PolarHBondContact O-N 3.29Å; C454-R457 WeakPolarHBondContact O-CB 3.34Å; C454-R457 PolarHBondContact O-N 3.02Å; F455-R457 VanDerWaalsContact C-N 3.31Å; F455-R457 PolarHBondContact O-N 3.35Å; R457-E460 IonicContact NH1-OE2 2.77Å; R457-E460 PolarHBondContact NH1-OE2 2.93Å; R457-E460 VanDerWaalsContact NH1-OE2 3.09Å; R457-E460 WeakPolarHBondContact O-CB 3.39Å; R457-E460 PolarHBondContact O-N 3.45Å; R457-L461 HydrophobicContact CG-CD1 3.98Å; R457-L461 HydrophobicContact CG-CG 4.44Å; R457-L461 VanDerWaalsContact O-CG 3.29Å; R457-L461 WeakPolarHBondContact O-CG 3.46Å; R457-L461 PolarHBondContact O-N 3.29Å
458	A	95.7	Very high	92.4	Very high	2 Å²	2	41 Å²	41	2%	0.017	25%	0.249	C	C	.	.	H	α-helix	trans	-58.2	-49.9	174.6	0	0	0	0	0	111.2	Q435 L436 C454 F455 K456 E460 L461 D462	Q435-A458 HydrophobicContact CB-CB 3.97Å; L436-A458 HydrophobicContact CB-CB 4.48Å; C454-A458 PolarHBondContact O-N 3.43Å; F455-A458 WeakPolarHBondContact O-CB 3.26Å; F455-A458 PolarHBondContact O-N 3.28Å; K456-A458 VanDerWaalsContact C-N 3.32Å; K456-A458 PolarHBondContact O-N 3.41Å; A458-E460 VanDerWaalsContact C-N 3.27Å; A458-E460 PolarHBondContact O-N 3.03Å; A458-L461 PolarHBondContact O-N 3.38Å; A458-D462 PolarHBondContact O-N 3.1Å; A458-D462 VanDerWaalsContact O-N 3.07Å
459	V	95	Very high	92.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-60.5	-35.9	176.1	175.5	0	0	0	0	111.5	F455 K456 L461 F472 W500 K507 Y508	F455-V459 WeakPolarHBondContact O-CG2 3.44Å; F455-V459 PolarHBondContact O-N 2.98Å; K456-V459 PolarHBondContact O-N 3.28Å; K456-V459 VanDerWaalsContact O-N 3.14Å; V459-L461 VanDerWaalsContact C-N 3.33Å; V459-L461 PolarHBondContact O-N 2.92Å; V459-F472 HydrophobicContact CG2-CB 3.91Å; V459-W500 HydrophobicContact CB-CE3 4.25Å; V459-W500 HydrophobicContact CB-CZ3 4.07Å; V459-W500 HydrophobicContact CG1-CE3 3.95Å; V459-W500 HydrophobicContact CG1-CZ3 4.01Å; V459-K507 WeakPolarHBondContact O-CD 3.46Å; V459-K507 WeakPolarHBondContact O-CE 3.5Å; V459-K507 PolarHBondContact O-NZ 3.37Å; V459-Y508 HydrophobicContact CG1-CE2 4.36Å
460	E	92.7	Very high	92.3	Very high	61 Å²	61	42.5 Å²	42.5	29%	0.285	25%	0.248	S	C	.	.	H	α-helix	trans	-66.7	-33.3	175.8	-58.3	-165.5	136.1	0	0	113.6	K456 R457 A458 W500 R503 K507	K456-E460 VanDerWaalsContact O-CG 3.28Å; K456-E460 WeakPolarHBondContact O-CG 3.17Å; K456-E460 PolarHBondContact O-N 3.4Å; R457-E460 IonicContact NH1-OE2 2.77Å; R457-E460 PolarHBondContact NH1-OE2 2.93Å; R457-E460 VanDerWaalsContact NH1-OE2 3.09Å; R457-E460 WeakPolarHBondContact O-CB 3.39Å; R457-E460 PolarHBondContact O-N 3.45Å; A458-E460 VanDerWaalsContact C-N 3.27Å; A458-E460 PolarHBondContact O-N 3.03Å; E460-W500 HydrophobicContact CG-CH2 3.74Å; E460-W500 HydrophobicContact CG-CZ3 3.96Å; E460-R503 IonicContact OE1-CZ 2.81Å; E460-R503 IonicContact OE1-NH1 2.74Å; E460-R503 PolarHBondContact OE1-NH1 2.89Å; E460-R503 IonicContact OE1-NH2 2.74Å; E460-R503 PolarHBondContact OE1-NH2 3.36Å; E460-K507 PolarHBondContact O-NZ 3.16Å
461	L	91.6	Very high	92.2	Very high	14 Å²	14	38.5 Å²	38.5	7%	0.073	23%	0.228	C	C	.	.	H	α-helix	trans	-83.6	-23.9	-177	-69.4	171.2	0	0	0	113	Q41 R44 P432 Q435 R457 A458 V459	Q41-L461 PolarHBondContact NE2-O 3.01Å; R44-L461 PolarHBondContact NH1-O 2.82Å; P432-L461 HydrophobicContact CB-CB 4.04Å; Q435-L461 HydrophobicContact CG-CD1 3.98Å; R457-L461 HydrophobicContact CG-CD1 3.98Å; R457-L461 HydrophobicContact CG-CG 4.44Å; R457-L461 VanDerWaalsContact O-CG 3.29Å; R457-L461 WeakPolarHBondContact O-CG 3.46Å; R457-L461 PolarHBondContact O-N 3.29Å; A458-L461 PolarHBondContact O-N 3.38Å; V459-L461 VanDerWaalsContact C-N 3.33Å; V459-L461 PolarHBondContact O-N 2.92Å
462	D	90.5	Very high	92.2	Very high	10 Å²	10	38.5 Å²	38.5	5%	0.053	23%	0.228	C	C	.	.	S	Bend	trans	-57.1	143	177.5	-81.9	-37.6	0	0	0	113.5	Q41 A458 K507 Y508	Q41-D462 PolarHBondContact NE2-O 3.39Å; A458-D462 PolarHBondContact O-N 3.1Å; A458-D462 VanDerWaalsContact O-N 3.07Å; D462-K507 HydrophobicContact CB-CD 4.46Å; D462-K507 PolarHBondContact O-NZ 2.73Å; D462-Y508 HydrophobicContact CB-CE1 3.98Å; D462-Y508 WeakPolarHBondContact OD2-CE1 3.19Å; D462-Y508 PolarHBondContact OD2-OH 3.46Å
463	D	85.5	Confident	92.1	Very high	60 Å²	60	38.4 Å²	38.4	32%	0.321	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-76.2	154.7	177.7	-58.7	-39.7	0	0	0	112.4	Q41 R44 G465 S466	Q41-D463 PolarHBondContact NE2-OD1 3.15Å; R44-D463 IonicContact CZ-OD1 3.28Å; R44-D463 IonicContact CZ-OD2 3.94Å; R44-D463 IonicContact NH1-OD1 2.68Å; R44-D463 IonicContact NH2-OD1 3.15Å; R44-D463 PolarHBondContact NH2-OD1 3Å; R44-D463 IonicContact NH2-OD2 3.49Å; R44-D463 PolarHBondContact NH2-OD2 3.44Å; D463-G465 PolarHBondContact O-N 3.14Å; D463-S466 WeakPolarHBondContact O-CB 3.32Å; D463-S466 PolarHBondContact O-N 3.44Å; D463-S466 VanDerWaalsContact O-N 3.08Å
464	A	84.3	Confident	92	Very high	80 Å²	80	35.8 Å²	35.8	66%	0.661	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	132.9	168	0	0	0	0	0	109.6	K507	A464-K507 CarbonylContact C-O 3.45Å
465	G	82.1	Confident	92	Very high	53 Å²	53	35.3 Å²	35.3	55%	0.546	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	83	2.6	-171.7	0	0	0	0	0	115	D463 K507	D463-G465 PolarHBondContact O-N 3.14Å; G465-K507 WeakPolarHBondContact CA-O 3.43Å; G465-K507 PolarHBondContact N-O 3.15Å
466	S	85.1	Confident	91.9	Very high	14 Å²	14	35.7 Å²	35.7	10%	0.098	20%	0.204	C	C	.	.			trans	-57.4	139.1	-179.8	-179.9	0	0	0	0	112	D463 H468 Y508 P509	D463-S466 WeakPolarHBondContact O-CB 3.32Å; D463-S466 PolarHBondContact O-N 3.44Å; D463-S466 VanDerWaalsContact O-N 3.08Å; S466-H468 PolarHBondContact OG-N 2.94Å; S466-H468 VanDerWaalsContact OG-N 3.16Å; S466-H468 PolarHBondContact OG-ND1 3.29Å; S466-Y508 WeakPolarHBondContact O-CD1 3.25Å; S466-P509 WeakPolarHBondContact O-CD 3.39Å
467	S	84.1	Confident	91.8	Very high	70 Å²	70	34.3 Å²	34.3	49%	0.49	20%	0.198	S	C	.	.			trans	-88.4	-9.3	172.2	55.6	0	0	0	0	113	T469	S467-T469 PolarHBondContact O-N 3.42Å
468	H	87.6	Confident	91.8	Very high	134 Å²	134	29.6 Å²	29.6	62%	0.62	18%	0.18	S	C	*	.			trans	-83.3	74.1	-175.2	-55.3	102.7	0	0	0	111.6	S466 E470	S466-H468 PolarHBondContact OG-N 2.94Å; S466-H468 VanDerWaalsContact OG-N 3.16Å; S466-H468 PolarHBondContact OG-ND1 3.29Å; H468-E470 VanDerWaalsContact C-N 3.29Å; H468-E470 PolarHBondContact O-N 3.28Å
469	T	92.9	Very high	91.8	Very high	13 Å²	13	29.6 Å²	29.6	8%	0.08	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-5.9	-177.6	51.7	0	0	0	0	114.4	S467 G471 F472 G473 Y508 R512	S467-T469 PolarHBondContact O-N 3.42Å; T469-G471 VanDerWaalsContact C-N 3.32Å; T469-G471 PolarHBondContact O-N 3.39Å; T469-F472 WeakPolarHBondContact O-CB 3.33Å; T469-F472 PolarHBondContact O-N 3.05Å; T469-G473 PolarHBondContact O-N 2.93Å; T469-G473 VanDerWaalsContact O-N 3.13Å; T469-Y508 HydrophobicContact CG2-CD1 3.97Å; T469-Y508 HydrophobicContact CG2-CD2 4.22Å; T469-Y508 HydrophobicContact CG2-CG 3.77Å; T469-R512 HydrophobicContact CG2-CB 3.92Å
470	E	93.1	Very high	91.7	Very high	78 Å²	78	29.9 Å²	29.9	36%	0.364	18%	0.182	S	C	.	.	H	α-helix	trans	-58.6	-39.5	-174.1	-173.1	177.4	-154.4	0	0	113.1	L436 K440 H468 F472 G473 C474	L436-E470 HydrophobicContact CD1-CG 4.37Å; L436-E470 HydrophobicContact CD2-CB 4.49Å; L436-E470 HydrophobicContact CD2-CG 4.49Å; K440-E470 VanDerWaalsContact CE-OE1 3.32Å; K440-E470 WeakPolarHBondContact CE-OE1 3.37Å; K440-E470 IonicContact NZ-OE1 2.75Å; K440-E470 PolarHBondContact NZ-OE1 3.35Å; K440-E470 IonicContact NZ-OE2 3.69Å; K440-E470 PolarHBondContact NZ-OE2 2.92Å; H468-E470 VanDerWaalsContact C-N 3.29Å; H468-E470 PolarHBondContact O-N 3.28Å; E470-F472 VanDerWaalsContact C-N 3.28Å; E470-F472 PolarHBondContact O-N 3.43Å; E470-G473 PolarHBondContact O-N 3.06Å; E470-G473 VanDerWaalsContact O-N 3.13Å; E470-C474 PolarHBondContact O-N 2.8Å; E470-C474 PolarHBondContact O-SG 3.3Å
471	G	95.3	Very high	91.7	Very high	3 Å²	3	28.2 Å²	28.2	3%	0.031	18%	0.178	C	C	.	.	H	α-helix	trans	-60.2	-37.9	177.2	0	0	0	0	0	113.1	T469 L475	T469-G471 VanDerWaalsContact C-N 3.32Å; T469-G471 PolarHBondContact O-N 3.39Å; G471-L475 WeakPolarHBondContact O-CB 3.49Å; G471-L475 PolarHBondContact O-N 3.33Å
472	F	96.9	Very high	91.8	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-68.6	-41.8	173.8	176.4	-110.5	0	0	0	111.9	V459 T469 E470 L475 L476 W500 L501 A504 Y508 L513 L517	V459-F472 HydrophobicContact CG2-CB 3.91Å; T469-F472 WeakPolarHBondContact O-CB 3.33Å; T469-F472 PolarHBondContact O-N 3.05Å; E470-F472 VanDerWaalsContact C-N 3.28Å; E470-F472 PolarHBondContact O-N 3.43Å; F472-L475 WeakPolarHBondContact O-CB 3.37Å; F472-L475 PolarHBondContact O-N 2.64Å; F472-L476 HydrophobicContact CD1-CD1 4.27Å; F472-L476 HydrophobicContact CE1-CD1 3.61Å; F472-L476 HydrophobicContact CE1-CG 4.24Å; F472-L476 HydrophobicContact CE2-CD1 4.36Å; F472-L476 HydrophobicContact CE2-CD2 4.17Å; F472-L476 HydrophobicContact CE2-CG 4.17Å; F472-L476 HydrophobicContact CZ-CD1 3.66Å; F472-L476 HydrophobicContact CZ-CD2 4.07Å; F472-L476 HydrophobicContact CZ-CG 3.97Å; F472-L476 PolarHBondContact O-N 3.43Å; F472-L476 VanDerWaalsContact O-N 3.09Å; F472-W500 HydrophobicContact CE2-CB 4.19Å; F472-L501 HydrophobicContact CZ-CB 4.38Å; F472-L501 HydrophobicContact CZ-CD1 4.07Å; F472-A504 HydrophobicContact CD1-CB 4.23Å; F472-A504 HydrophobicContact CD2-CB 3.75Å; F472-A504 HydrophobicContact CE1-CB 4.23Å; F472-A504 HydrophobicContact CE2-CB 3.76Å; F472-A504 HydrophobicContact CG-CB 3.99Å; F472-A504 HydrophobicContact CZ-CB 3.99Å; F472-Y508 HydrophobicContact CB-CE2 3.99Å; F472-L513 HydrophobicContact CD1-CD1 3.57Å; F472-L513 HydrophobicContact CE1-CD1 3.41Å; F472-L513 VanDerWaalsContact CE1-CD1 3.41Å; F472-L513 HydrophobicContact CZ-CD1 4.28Å; F472-L517 HydrophobicContact CE1-CD2 3.69Å; F472-L517 HydrophobicContact CE1-CG 4.12Å; F472-L517 HydrophobicContact CZ-CD2 4.2Å
473	G	95.3	Very high	92	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-58.9	-48.5	174.8	0	0	0	0	0	112.4	T469 E470 L475 L476 E477 E516	T469-G473 PolarHBondContact O-N 2.93Å; T469-G473 VanDerWaalsContact O-N 3.13Å; E470-G473 PolarHBondContact O-N 3.06Å; E470-G473 VanDerWaalsContact O-N 3.13Å; G473-L475 VanDerWaalsContact C-N 3.29Å; G473-L475 PolarHBondContact O-N 3.09Å; G473-L476 PolarHBondContact O-N 3.28Å; G473-E477 WeakPolarHBondContact O-CG 3.32Å; G473-E477 PolarHBondContact O-N 3.18Å; G473-E516 WeakPolarHBondContact CA-OE1 3.45Å
474	C	96.1	Very high	92.2	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.014	20%	0.195	C	C	.	.	H	α-helix	trans	-62.7	-33.9	176.6	-68.7	0	0	0	0	113	F455 E470 A478	F455-C474 HydrophobicContact CD1-CB 3.65Å; F455-C474 HydrophobicContact CD2-CB 3.85Å; F455-C474 WeakPolarHBondContact CD2-O 3.42Å; F455-C474 HydrophobicContact CE1-CB 3.48Å; F455-C474 VanDerWaalsContact CE1-CB 3.48Å; F455-C474 HydrophobicContact CE2-CB 3.7Å; F455-C474 HydrophobicContact CG-CB 3.84Å; F455-C474 HydrophobicContact CZ-CB 3.52Å; E470-C474 PolarHBondContact O-N 2.8Å; E470-C474 PolarHBondContact O-SG 3.3Å; C474-A478 WeakPolarHBondContact O-CB 3.26Å; C474-A478 PolarHBondContact O-N 2.92Å
475	L	97.7	Very high	92.6	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.3	-48.3	173.1	175.9	56.4	0	0	0	111.4	A452 F455 K456 G471 F472 G473 E477 A478 L479 W500	A452-L475 HydrophobicContact CB-CD1 4.04Å; F455-L475 HydrophobicContact CB-CB 3.7Å; F455-L475 HydrophobicContact CB-CD1 4.28Å; K456-L475 HydrophobicContact CD-CD1 4.48Å; K456-L475 HydrophobicContact CG-CD1 3.62Å; K456-L475 HydrophobicContact CG-CD2 3.88Å; K456-L475 HydrophobicContact CG-CG 4.43Å; G471-L475 WeakPolarHBondContact O-CB 3.49Å; G471-L475 PolarHBondContact O-N 3.33Å; F472-L475 WeakPolarHBondContact O-CB 3.37Å; F472-L475 PolarHBondContact O-N 2.64Å; G473-L475 VanDerWaalsContact C-N 3.29Å; G473-L475 PolarHBondContact O-N 3.09Å; L475-E477 VanDerWaalsContact C-N 3.34Å; L475-E477 PolarHBondContact O-N 3.41Å; L475-A478 PolarHBondContact O-N 3.08Å; L475-L479 HydrophobicContact CD1-CD1 4.09Å; L475-L479 HydrophobicContact CD1-CG 4.06Å; L475-L479 HydrophobicContact CG-CD1 4.11Å; L475-L479 HydrophobicContact CG-CG 4.5Å; L475-L479 WeakPolarHBondContact O-CG 3.31Å; L475-L479 PolarHBondContact O-N 3.17Å; L475-W500 HydrophobicContact CD2-CB 3.88Å; L475-W500 HydrophobicContact CD2-CD2 3.67Å; L475-W500 HydrophobicContact CD2-CE3 3.96Å; L475-W500 HydrophobicContact CD2-CG 3.58Å
476	L	95.6	Very high	93	Very high	7 Å²	7	33.6 Å²	33.6	4%	0.037	19%	0.194	C	C	.	.	H	α-helix	trans	-61.7	-44.1	179.1	-67.5	-179.8	0	0	0	111.5	F472 G473 A478 L479 L480 V497 L517 V520	F472-L476 HydrophobicContact CD1-CD1 4.27Å; F472-L476 HydrophobicContact CE1-CD1 3.61Å; F472-L476 HydrophobicContact CE1-CG 4.24Å; F472-L476 HydrophobicContact CE2-CD1 4.36Å; F472-L476 HydrophobicContact CE2-CD2 4.17Å; F472-L476 HydrophobicContact CE2-CG 4.17Å; F472-L476 HydrophobicContact CZ-CD1 3.66Å; F472-L476 HydrophobicContact CZ-CD2 4.07Å; F472-L476 HydrophobicContact CZ-CG 3.97Å; F472-L476 PolarHBondContact O-N 3.43Å; F472-L476 VanDerWaalsContact O-N 3.09Å; G473-L476 PolarHBondContact O-N 3.28Å; L476-A478 VanDerWaalsContact C-N 3.34Å; L476-A478 PolarHBondContact O-N 2.87Å; L476-L479 PolarHBondContact O-N 3.18Å; L476-L480 VanDerWaalsContact O-CG 3.32Å; L476-L480 WeakPolarHBondContact O-CG 3.37Å; L476-L480 PolarHBondContact O-N 3.48Å; L476-V497 HydrophobicContact CD2-CG1 4.34Å; L476-V497 HydrophobicContact CD2-CG2 4.24Å; L476-L517 HydrophobicContact CD1-CD2 3.59Å; L476-V520 HydrophobicContact CB-CG1 3.96Å
477	E	94.6	Very high	93.3	Very high	20 Å²	20	37.7 Å²	37.7	9%	0.093	21%	0.212	C	C	.	.	H	α-helix	trans	-58.8	-44.1	176	-67.2	169.5	-179.1	0	0	111.4	R443 G473 L475 L480 A481 R519 V520	R443-E477 IonicContact CZ-OE2 3.27Å; R443-E477 IonicContact NH1-OE2 2.67Å; R443-E477 PolarHBondContact NH1-OE2 3.23Å; R443-E477 IonicContact NH2-OE2 2.95Å; G473-E477 WeakPolarHBondContact O-CG 3.32Å; G473-E477 PolarHBondContact O-N 3.18Å; L475-E477 VanDerWaalsContact C-N 3.34Å; L475-E477 PolarHBondContact O-N 3.41Å; E477-L480 PolarHBondContact O-N 3.01Å; E477-A481 WeakPolarHBondContact O-CB 3.35Å; E477-A481 PolarHBondContact O-N 3.37Å; E477-R519 IonicContact OE1-CZ 3.39Å; E477-R519 VanDerWaalsContact OE1-CZ 3.27Å; E477-R519 IonicContact OE1-NH1 2.86Å; E477-R519 PolarHBondContact OE1-NH1 3.33Å; E477-R519 IonicContact OE1-NH2 2.6Å; E477-R519 PolarHBondContact OE1-NH2 3.11Å; E477-V520 HydrophobicContact CG-CG1 3.92Å; E477-V520 HydrophobicContact CG-CG2 4.18Å
478	A	95.6	Very high	93.6	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-66.9	-36.8	177.9	0	0	0	0	0	113.1	A452 F455 C474 L475 L476 A481 Q482	A452-A478 HydrophobicContact CB-CB 4.05Å; F455-A478 HydrophobicContact CD2-CB 4.1Å; F455-A478 HydrophobicContact CE2-CB 4.16Å; C474-A478 WeakPolarHBondContact O-CB 3.26Å; C474-A478 PolarHBondContact O-N 2.92Å; L475-A478 PolarHBondContact O-N 3.08Å; L476-A478 VanDerWaalsContact C-N 3.34Å; L476-A478 PolarHBondContact O-N 2.87Å; A478-A481 PolarHBondContact O-N 2.9Å; A478-Q482 WeakPolarHBondContact O-CG 3.44Å; A478-Q482 PolarHBondContact O-N 3.31Å
479	L	95.6	Very high	93.8	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.01	19%	0.185	C	C	.	.	H	α-helix	trans	-67.9	-40.6	175.6	-70.5	173.3	0	0	0	111.8	L475 L476 A481 Q482 W483 L488 L493 E496 V497	L475-L479 HydrophobicContact CD1-CD1 4.09Å; L475-L479 HydrophobicContact CD1-CG 4.06Å; L475-L479 HydrophobicContact CG-CD1 4.11Å; L475-L479 HydrophobicContact CG-CG 4.5Å; L475-L479 WeakPolarHBondContact O-CG 3.31Å; L475-L479 PolarHBondContact O-N 3.17Å; L476-L479 PolarHBondContact O-N 3.18Å; L479-A481 VanDerWaalsContact C-N 3.34Å; L479-Q482 PolarHBondContact O-N 2.98Å; L479-W483 PolarHBondContact O-N 2.65Å; L479-L488 HydrophobicContact CD2-CD1 3.96Å; L479-L493 HydrophobicContact CB-CD1 3.79Å; L479-E496 HydrophobicContact CD1-CB 3.97Å; L479-E496 HydrophobicContact CD2-CB 4.17Å; L479-E496 HydrophobicContact CD2-CG 4.38Å; L479-V497 HydrophobicContact CD1-CG2 4.47Å
480	L	93.7	Very high	93.6	Very high	7 Å²	7	35.1 Å²	35.1	4%	0.037	20%	0.201	C	C	.	.	H	α-helix	trans	-64	-40.2	174.7	-68.9	174	0	0	0	111.3	L476 E477 W483 S484 L493 V520 H524 E527 V528 L531	L476-L480 VanDerWaalsContact O-CG 3.32Å; L476-L480 WeakPolarHBondContact O-CG 3.37Å; L476-L480 PolarHBondContact O-N 3.48Å; E477-L480 PolarHBondContact O-N 3.01Å; L480-W483 PolarHBondContact O-N 2.66Å; L480-S484 PolarHBondContact O-N 3.29Å; L480-L493 HydrophobicContact CD2-CD2 4.3Å; L480-V520 HydrophobicContact CD1-CG1 4.31Å; L480-H524 HydrophobicContact CD1-CB 3.89Å; L480-E527 HydrophobicContact CB-CB 4.49Å; L480-E527 HydrophobicContact CD2-CB 4.18Å; L480-V528 HydrophobicContact CD1-CG2 4.29Å; L480-L531 HydrophobicContact CD2-CD2 4.31Å
481	A	92.7	Very high	93.4	Very high	25 Å²	25	32.6 Å²	32.6	21%	0.207	20%	0.196	C	C	.	.	H	α-helix	trans	-63.5	-44	175.2	0	0	0	0	0	112.6	E477 A478 L479 W483 S484 Q485	E477-A481 WeakPolarHBondContact O-CB 3.35Å; E477-A481 PolarHBondContact O-N 3.37Å; A478-A481 PolarHBondContact O-N 2.9Å; L479-A481 VanDerWaalsContact C-N 3.34Å; A481-W483 VanDerWaalsContact C-N 3.29Å; A481-W483 PolarHBondContact O-N 2.98Å; A481-S484 PolarHBondContact O-N 2.95Å; A481-S484 PolarHBondContact O-OG 3.43Å; A481-Q485 WeakPolarHBondContact O-CB 3.35Å; A481-Q485 VanDerWaalsContact O-CG 3.26Å; A481-Q485 WeakPolarHBondContact O-CG 3.45Å; A481-Q485 PolarHBondContact O-N 3.17Å
482	Q	94.2	Very high	93.2	Very high	18 Å²	18	36.1 Å²	36.1	8%	0.084	21%	0.211	C	C	.	.	H	α-helix	trans	-61.5	-38.8	174.8	-74.7	175.3	54.7	0	0	112.3	D448 A478 L479 Q485 A486 Q487 L488	D448-Q482 HydrophobicContact CB-CG 3.7Å; D448-Q482 PolarHBondContact O-NE2 2.98Å; A478-Q482 WeakPolarHBondContact O-CG 3.44Å; A478-Q482 PolarHBondContact O-N 3.31Å; L479-Q482 PolarHBondContact O-N 2.98Å; Q482-Q485 CarbonylContact O-C 3.59Å; Q482-Q485 PolarHBondContact O-N 3.46Å; Q482-A486 PolarHBondContact O-N 2.89Å; Q482-Q487 HydrophobicContact CB-CB 4.2Å; Q482-Q487 WeakPolarHBondContact O-CB 3.48Å; Q482-Q487 PolarHBondContact O-N 3.47Å; Q482-L488 HydrophobicContact CB-CD1 3.71Å; Q482-L488 HydrophobicContact CB-CG 3.93Å
483	W	93.9	Very high	93	Very high	51 Å²	51	36.1 Å²	36.1	19%	0.193	21%	0.211	C	C	.	.	H	α-helix	trans	-68.5	-42.8	177.1	178.6	68.3	0	0	0	112.4	L479 L480 A481 Q485 A486 L488 D490 L493 E527	L479-W483 PolarHBondContact O-N 2.65Å; L480-W483 PolarHBondContact O-N 2.66Å; A481-W483 VanDerWaalsContact C-N 3.29Å; A481-W483 PolarHBondContact O-N 2.98Å; W483-Q485 PolarHBondContact O-N 3.43Å; W483-A486 PolarHBondContact O-N 3.43Å; W483-L488 HydrophobicContact CB-CB 4.42Å; W483-D490 PolarHBondContact NE1-OD1 2.82Å; W483-L493 HydrophobicContact CB-CD1 4.44Å; W483-L493 HydrophobicContact CB-CD2 3.68Å; W483-L493 HydrophobicContact CB-CG 4.44Å; W483-L493 HydrophobicContact CD2-CD2 3.59Å; W483-L493 HydrophobicContact CE3-CD2 4.03Å; W483-L493 HydrophobicContact CG-CB 4.45Å; W483-L493 HydrophobicContact CG-CD2 3.42Å; W483-L493 VanDerWaalsContact CG-CD2 3.42Å; W483-L493 HydrophobicContact CG-CG 4.45Å; W483-E527 HydrophobicContact CZ3-CB 4.23Å; W483-E527 WeakPolarHBondContact CZ3-O 3.29Å
484	S	90.7	Very high	92.6	Very high	76 Å²	76	36.1 Å²	36.1	53%	0.531	21%	0.211	S	C	.	.	H	α-helix	trans	-64	-28.1	176.2	70.9	0	0	0	0	112.4	L480 A481 A486	L480-S484 PolarHBondContact O-N 3.29Å; A481-S484 PolarHBondContact O-N 2.95Å; A481-S484 PolarHBondContact O-OG 3.43Å; S484-A486 VanDerWaalsContact C-N 3.3Å
485	Q	91.3	Very high	92.4	Very high	96 Å²	96	42.9 Å²	42.9	45%	0.449	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	6.6	172.7	-64.7	172.7	27.2	0	0	114.2	D448 A481 Q482 W483 Q487	D448-Q485 PolarHBondContact OD2-NE2 2.85Å; A481-Q485 WeakPolarHBondContact O-CB 3.35Å; A481-Q485 VanDerWaalsContact O-CG 3.26Å; A481-Q485 WeakPolarHBondContact O-CG 3.45Å; A481-Q485 PolarHBondContact O-N 3.17Å; Q482-Q485 CarbonylContact O-C 3.59Å; Q482-Q485 PolarHBondContact O-N 3.46Å; W483-Q485 PolarHBondContact O-N 3.43Å; Q485-Q487 HydrophobicContact CB-CG 4.15Å; Q485-Q487 PolarHBondContact O-N 2.67Å
486	A	90.7	Very high	92.2	Very high	89 Å²	89	45.5 Å²	45.5	74%	0.736	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.2	24	-177.6	0	0	0	0	0	115.1	Q482 W483 S484	Q482-A486 PolarHBondContact O-N 2.89Å; W483-A486 PolarHBondContact O-N 3.43Å; S484-A486 VanDerWaalsContact C-N 3.3Å
487	Q	91.1	Very high	92.1	Very high	100 Å²	100	45.9 Å²	45.9	47%	0.467	25%	0.251	S	S	.	.	S	Bend	trans	-80.9	-22.3	172.6	-59.4	-177.4	7.3	0	0	112.3	Q482 Q485	Q482-Q487 HydrophobicContact CB-CB 4.2Å; Q482-Q487 WeakPolarHBondContact O-CB 3.48Å; Q482-Q487 PolarHBondContact O-N 3.47Å; Q485-Q487 HydrophobicContact CB-CG 4.15Å; Q485-Q487 PolarHBondContact O-N 2.67Å
488	L	91.3	Very high	91.9	Very high	28 Å²	28	46.3 Å²	46.3	15%	0.147	25%	0.254	C	S	.	.	S	Bend	trans	-118	139.2	173.8	-68.4	173	0	0	0	110.3	L479 Q482 W483 E492 L493	L479-L488 HydrophobicContact CD2-CD1 3.96Å; Q482-L488 HydrophobicContact CB-CD1 3.71Å; Q482-L488 HydrophobicContact CB-CG 3.93Å; W483-L488 HydrophobicContact CB-CB 4.42Å; L488-E492 HydrophobicContact CD2-CB 4.09Å; L488-L493 HydrophobicContact CD1-CD1 4.5Å
489	S	92.4	Very high	91.8	Very high	59 Å²	59	48.9 Å²	48.9	41%	0.413	28%	0.276	S	S	.	.			trans	-77.1	159.5	166.8	65.9	0	0	0	0	111.7	G491 E492 L493	S489-G491 PolarHBondContact O-N 3.05Å; S489-G491 VanDerWaalsContact O-N 3.16Å; S489-E492 VanDerWaalsContact CB-OE2 3.31Å; S489-E492 WeakPolarHBondContact CB-OE2 3.09Å; S489-E492 PolarHBondContact N-OE2 3.23Å; S489-E492 PolarHBondContact O-N 3.43Å; S489-E492 VanDerWaalsContact OG-CG 3.29Å; S489-E492 WeakPolarHBondContact OG-CG 3.48Å; S489-E492 PolarHBondContact OG-N 3.35Å; S489-E492 PolarHBondContact OG-OE2 2.98Å; S489-L493 PolarHBondContact O-N 2.88Å
490	D	88.6	Confident	91.8	Very high	77 Å²	77	49.9 Å²	49.9	41%	0.412	28%	0.279	S	S	.	.	H	α-helix	trans	-48.8	-43.2	174.4	-73.7	3.9	0	0	0	112.5	W483 G494 A534 Q538	W483-D490 PolarHBondContact NE1-OD1 2.82Å; D490-G494 PolarHBondContact O-N 2.67Å; D490-G494 VanDerWaalsContact O-N 3.09Å; D490-A534 HydrophobicContact CB-CB 3.89Å; D490-Q538 PolarHBondContact O-NE2 3.29Å
491	G	87.7	Confident	91.8	Very high	24 Å²	24	50 Å²	50	25%	0.247	28%	0.28	C	S	.	.	H	α-helix	trans	-73.4	-27.3	-179	0	0	0	0	0	113.9	S489 R495	S489-G491 PolarHBondContact O-N 3.05Å; S489-G491 VanDerWaalsContact O-N 3.16Å; G491-R495 WeakPolarHBondContact O-CB 3.39Å; G491-R495 VanDerWaalsContact O-CG 3.3Å; G491-R495 WeakPolarHBondContact O-CG 3.38Å; G491-R495 PolarHBondContact O-N 3.46Å; G491-R495 PolarHBondContact O-NE 3.38Å; G491-R495 VanDerWaalsContact O-NE 3.12Å
492	E	91.8	Very high	91.8	Very high	78 Å²	78	55.6 Å²	55.6	36%	0.364	30%	0.296	S	S	.	.	H	α-helix	trans	-76.8	-47.3	174.5	-72.9	160.7	151.4	0	0	110.9	L488 S489 G494 R495 E496	L488-E492 HydrophobicContact CD2-CB 4.09Å; S489-E492 VanDerWaalsContact CB-OE2 3.31Å; S489-E492 WeakPolarHBondContact CB-OE2 3.09Å; S489-E492 PolarHBondContact N-OE2 3.23Å; S489-E492 PolarHBondContact O-N 3.43Å; S489-E492 VanDerWaalsContact OG-CG 3.29Å; S489-E492 WeakPolarHBondContact OG-CG 3.48Å; S489-E492 PolarHBondContact OG-N 3.35Å; S489-E492 PolarHBondContact OG-OE2 2.98Å; E492-G494 VanDerWaalsContact C-N 3.33Å; E492-G494 PolarHBondContact O-N 3.43Å; E492-R495 PolarHBondContact O-N 3.41Å; E492-R495 VanDerWaalsContact O-N 3.12Å; E492-E496 WeakPolarHBondContact O-CG 3.27Å; E492-E496 PolarHBondContact O-N 3.12Å
493	L	91.6	Very high	91.7	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-57.2	-47.9	176.4	179	64	0	0	0	111	L479 L480 W483 L488 S489 R495 E496 V497 L531	L479-L493 HydrophobicContact CB-CD1 3.79Å; L480-L493 HydrophobicContact CD2-CD2 4.3Å; W483-L493 HydrophobicContact CB-CD1 4.44Å; W483-L493 HydrophobicContact CB-CD2 3.68Å; W483-L493 HydrophobicContact CB-CG 4.44Å; W483-L493 HydrophobicContact CD2-CD2 3.59Å; W483-L493 HydrophobicContact CE3-CD2 4.03Å; W483-L493 HydrophobicContact CG-CB 4.45Å; W483-L493 HydrophobicContact CG-CD2 3.42Å; W483-L493 VanDerWaalsContact CG-CD2 3.42Å; W483-L493 HydrophobicContact CG-CG 4.45Å; L488-L493 HydrophobicContact CD1-CD1 4.5Å; S489-L493 PolarHBondContact O-N 2.88Å; L493-R495 VanDerWaalsContact C-N 3.27Å; L493-R495 PolarHBondContact O-N 3.32Å; L493-E496 PolarHBondContact O-N 2.95Å; L493-V497 HydrophobicContact CD1-CG2 3.93Å; L493-V497 HydrophobicContact CG-CG2 4.35Å; L493-V497 WeakPolarHBondContact O-CG2 3.33Å; L493-V497 PolarHBondContact O-N 3.34Å; L493-L531 HydrophobicContact CD2-CB 4.48Å; L493-L531 HydrophobicContact CD2-CD1 3.68Å; L493-L531 HydrophobicContact CD2-CG 4.44Å; L493-L531 HydrophobicContact CG-CD1 3.93Å
494	G	88.5	Confident	91.7	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-61.8	-33.2	179	0	0	0	0	0	113.6	D490 E492 D498 R540	D490-G494 PolarHBondContact O-N 2.67Å; D490-G494 VanDerWaalsContact O-N 3.09Å; E492-G494 VanDerWaalsContact C-N 3.33Å; E492-G494 PolarHBondContact O-N 3.43Å; G494-D498 WeakPolarHBondContact O-CB 3.49Å; G494-D498 PolarHBondContact O-N 3.4Å; G494-R540 VanDerWaalsContact C-NH1 3.35Å; G494-R540 PolarHBondContact O-NH1 2.91Å
495	R	90.8	Very high	91.7	Very high	144 Å²	144	57.8 Å²	57.8	54%	0.543	30%	0.296	S	S	.	.	H	α-helix	trans	-71.5	-46.2	175.1	-82.2	-175.5	-66.4	178.4	6.2	112.2	G491 E492 L493 D498 A499	G491-R495 WeakPolarHBondContact O-CB 3.39Å; G491-R495 VanDerWaalsContact O-CG 3.3Å; G491-R495 WeakPolarHBondContact O-CG 3.38Å; G491-R495 PolarHBondContact O-N 3.46Å; G491-R495 PolarHBondContact O-NE 3.38Å; G491-R495 VanDerWaalsContact O-NE 3.12Å; E492-R495 PolarHBondContact O-N 3.41Å; E492-R495 VanDerWaalsContact O-N 3.12Å; L493-R495 VanDerWaalsContact C-N 3.27Å; L493-R495 PolarHBondContact O-N 3.32Å; R495-D498 PolarHBondContact O-N 3.4Å; R495-A499 WeakPolarHBondContact O-CB 3.28Å; R495-A499 PolarHBondContact O-N 3.07Å
496	E	94.8	Very high	91.6	Very high	54 Å²	54	59.5 Å²	59.5	25%	0.252	31%	0.308	S	S	.	.	H	α-helix	trans	-62.3	-49.2	179.5	-75.3	-75.6	173.6	0	0	111.1	K456 L479 E492 L493 D498 A499 W500	K456-E496 WeakPolarHBondContact CE-OE2 3.41Å; K456-E496 IonicContact NZ-OE1 3.37Å; K456-E496 PolarHBondContact NZ-OE1 3.02Å; K456-E496 IonicContact NZ-OE2 2.65Å; K456-E496 PolarHBondContact NZ-OE2 2.96Å; L479-E496 HydrophobicContact CD1-CB 3.97Å; L479-E496 HydrophobicContact CD2-CB 4.17Å; L479-E496 HydrophobicContact CD2-CG 4.38Å; E492-E496 WeakPolarHBondContact O-CG 3.27Å; E492-E496 PolarHBondContact O-N 3.12Å; L493-E496 PolarHBondContact O-N 2.95Å; E496-D498 VanDerWaalsContact C-N 3.35Å; E496-D498 PolarHBondContact O-N 2.75Å; E496-A499 PolarHBondContact O-N 3.39Å; E496-W500 PolarHBondContact O-N 3.14Å; E496-W500 VanDerWaalsContact OE2-CD1 3.25Å; E496-W500 PolarHBondContact OE2-NE1 3.14Å
497	V	92.3	Very high	91.5	Very high	15 Å²	15	56.4 Å²	56.4	9%	0.091	28%	0.278	C	S	.	.	H	α-helix	trans	-59.9	-44.2	179.1	173.2	0	0	0	0	111.4	L476 L479 L493 L501 L531	L476-V497 HydrophobicContact CD2-CG1 4.34Å; L476-V497 HydrophobicContact CD2-CG2 4.24Å; L479-V497 HydrophobicContact CD1-CG2 4.47Å; L493-V497 HydrophobicContact CD1-CG2 3.93Å; L493-V497 HydrophobicContact CG-CG2 4.35Å; L493-V497 WeakPolarHBondContact O-CG2 3.33Å; L493-V497 PolarHBondContact O-N 3.34Å; V497-L501 WeakPolarHBondContact O-CB 3.46Å; V497-L501 PolarHBondContact O-N 3.15Å; V497-L531 HydrophobicContact CG2-CD2 4.44Å
498	D	90.6	Very high	91.5	Very high	30 Å²	30	52 Å²	52	16%	0.16	26%	0.257	C	S	.	.	H	α-helix	trans	-61.6	-48.3	177.4	-170.2	19.2	0	0	0	112	G494 R495 E496 W500 L501 R502 R540 L543	G494-D498 WeakPolarHBondContact O-CB 3.49Å; G494-D498 PolarHBondContact O-N 3.4Å; R495-D498 PolarHBondContact O-N 3.4Å; E496-D498 VanDerWaalsContact C-N 3.35Å; E496-D498 PolarHBondContact O-N 2.75Å; D498-W500 PolarHBondContact O-N 3.34Å; D498-L501 PolarHBondContact O-N 2.6Å; D498-R502 WeakPolarHBondContact O-CG 3.28Å; D498-R502 PolarHBondContact O-N 2.89Å; D498-R502 VanDerWaalsContact O-N 3.07Å; D498-R502 IonicContact OD1-CZ 3.67Å; D498-R502 IonicContact OD1-NE 3.72Å; D498-R502 PolarHBondContact OD1-NE 2.73Å; D498-R502 IonicContact OD1-NH2 3.57Å; D498-R502 PolarHBondContact OD1-NH2 2.9Å; D498-R502 IonicContact OD2-CZ 2.73Å; D498-R502 IonicContact OD2-NE 2.75Å; D498-R502 IonicContact OD2-NH2 3.19Å; D498-R502 PolarHBondContact OD2-NH2 3.31Å; D498-R540 IonicContact OD2-NH1 3.82Å; D498-R540 PolarHBondContact OD2-NH1 3.45Å; D498-L543 HydrophobicContact CB-CD1 3.62Å; D498-L543 HydrophobicContact CB-CD2 4.34Å
499	A	94.3	Very high	91.5	Very high	54 Å²	54	53.4 Å²	53.4	45%	0.446	27%	0.268	S	S	.	.	H	α-helix	trans	-62.1	-47.1	-177.5	0	0	0	0	0	111.8	R495 E496 R503	R495-A499 WeakPolarHBondContact O-CB 3.28Å; R495-A499 PolarHBondContact O-N 3.07Å; E496-A499 PolarHBondContact O-N 3.39Å; A499-R503 PolarHBondContact O-N 2.96Å; A499-R503 VanDerWaalsContact O-N 3.16Å
500	W	95.5	Very high	91.4	Very high	23 Å²	23	54.3 Å²	54.3	9%	0.087	28%	0.279	C	S	.	.	H	α-helix	trans	-76.5	-29.8	-177.7	-72.4	103.9	0	0	0	113.1	K456 V459 E460 F472 L475 E496 D498 R503 A504	K456-W500 HydrophobicContact CB-CH2 3.55Å; K456-W500 HydrophobicContact CB-CZ2 3.53Å; K456-W500 HydrophobicContact CB-CZ3 4.2Å; K456-W500 HydrophobicContact CD-CH2 4.49Å; K456-W500 HydrophobicContact CD-CZ2 3.6Å; K456-W500 HydrophobicContact CG-CD2 4.18Å; K456-W500 VanDerWaalsContact CG-CE2 3.49Å; K456-W500 HydrophobicContact CG-CH2 3.89Å; K456-W500 HydrophobicContact CG-CZ2 3.36Å; K456-W500 HydrophobicContact CG-CZ3 4.47Å; V459-W500 HydrophobicContact CB-CE3 4.25Å; V459-W500 HydrophobicContact CB-CZ3 4.07Å; V459-W500 HydrophobicContact CG1-CE3 3.95Å; V459-W500 HydrophobicContact CG1-CZ3 4.01Å; E460-W500 HydrophobicContact CG-CH2 3.74Å; E460-W500 HydrophobicContact CG-CZ3 3.96Å; F472-W500 HydrophobicContact CE2-CB 4.19Å; L475-W500 HydrophobicContact CD2-CB 3.88Å; L475-W500 HydrophobicContact CD2-CD2 3.67Å; L475-W500 HydrophobicContact CD2-CE3 3.96Å; L475-W500 HydrophobicContact CD2-CG 3.58Å; E496-W500 PolarHBondContact O-N 3.14Å; E496-W500 VanDerWaalsContact OE2-CD1 3.25Å; E496-W500 PolarHBondContact OE2-NE1 3.14Å; D498-W500 PolarHBondContact O-N 3.34Å; W500-R503 HydrophobicContact CE3-CB 4.5Å; W500-R503 PolarHBondContact O-N 2.84Å; W500-A504 WeakPolarHBondContact O-CB 3.19Å; W500-A504 PolarHBondContact O-N 2.74Å
501	L	93.1	Very high	91.4	Very high	9 Å²	9	54.3 Å²	54.3	5%	0.047	29%	0.289	C	S	.	.	H	α-helix	trans	-64.8	-44.2	171.9	175.7	66.9	0	0	0	111.7	F472 V497 D498 R503 A504 Q505 L513 L517 L543 L546	F472-L501 HydrophobicContact CZ-CB 4.38Å; F472-L501 HydrophobicContact CZ-CD1 4.07Å; V497-L501 WeakPolarHBondContact O-CB 3.46Å; V497-L501 PolarHBondContact O-N 3.15Å; D498-L501 PolarHBondContact O-N 2.6Å; L501-R503 VanDerWaalsContact C-N 3.33Å; L501-R503 PolarHBondContact O-N 3.07Å; L501-A504 WeakPolarHBondContact O-CB 3.31Å; L501-A504 PolarHBondContact O-N 2.95Å; L501-Q505 VanDerWaalsContact O-CG 3.31Å; L501-Q505 WeakPolarHBondContact O-CG 3.48Å; L501-Q505 PolarHBondContact O-N 2.86Å; L501-L513 HydrophobicContact CD1-CD2 4.36Å; L501-L517 HydrophobicContact CD1-CD1 3.94Å; L501-L517 HydrophobicContact CD1-CD2 4.44Å; L501-L543 HydrophobicContact CD2-CD2 3.73Å; L501-L546 HydrophobicContact CD1-CD2 4.23Å; L501-L546 HydrophobicContact CD2-CD2 3.26Å; L501-L546 HydrophobicContact CG-CD2 4.23Å
502	R	92.1	Very high	91.6	Very high	142 Å²	142	59 Å²	59	54%	0.536	30%	0.3	S	S	.	.	H	α-helix	trans	-60.5	-45.7	175.2	-70.1	176.7	-164.3	-149	7.9	111.1	D498 A504 Q505 D506	D498-R502 WeakPolarHBondContact O-CG 3.28Å; D498-R502 PolarHBondContact O-N 2.89Å; D498-R502 VanDerWaalsContact O-N 3.07Å; D498-R502 IonicContact OD1-CZ 3.67Å; D498-R502 IonicContact OD1-NE 3.72Å; D498-R502 PolarHBondContact OD1-NE 2.73Å; D498-R502 IonicContact OD1-NH2 3.57Å; D498-R502 PolarHBondContact OD1-NH2 2.9Å; D498-R502 IonicContact OD2-CZ 2.73Å; D498-R502 IonicContact OD2-NE 2.75Å; D498-R502 IonicContact OD2-NH2 3.19Å; D498-R502 PolarHBondContact OD2-NH2 3.31Å; R502-A504 VanDerWaalsContact C-N 3.26Å; R502-A504 PolarHBondContact O-N 2.83Å; R502-Q505 WeakPolarHBondContact O-CB 3.22Å; R502-Q505 PolarHBondContact O-N 3Å; R502-Q505 VanDerWaalsContact O-N 3.09Å; R502-D506 PolarHBondContact O-N 2.98Å; R502-D506 VanDerWaalsContact O-N 3.1Å
503	R	93	Very high	91.6	Very high	92 Å²	92	55.7 Å²	55.7	35%	0.347	29%	0.285	S	S	.	.	H	α-helix	trans	-62	-35.4	176.6	-165.1	165.8	-169.8	170	-2.4	112.8	E460 A499 W500 L501 K507	E460-R503 IonicContact OE1-CZ 2.81Å; E460-R503 IonicContact OE1-NH1 2.74Å; E460-R503 PolarHBondContact OE1-NH1 2.89Å; E460-R503 IonicContact OE1-NH2 2.74Å; E460-R503 PolarHBondContact OE1-NH2 3.36Å; A499-R503 PolarHBondContact O-N 2.96Å; A499-R503 VanDerWaalsContact O-N 3.16Å; W500-R503 HydrophobicContact CE3-CB 4.5Å; W500-R503 PolarHBondContact O-N 2.84Å; L501-R503 VanDerWaalsContact C-N 3.33Å; L501-R503 PolarHBondContact O-N 3.07Å; R503-K507 WeakPolarHBondContact O-CG 3.32Å; R503-K507 PolarHBondContact O-N 3.33Å
504	A	92.9	Very high	91.5	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-69.6	-36.7	174.2	0	0	0	0	0	112.1	F472 W500 L501 R502 D506 K507 Y508 L513	F472-A504 HydrophobicContact CD1-CB 4.23Å; F472-A504 HydrophobicContact CD2-CB 3.75Å; F472-A504 HydrophobicContact CE1-CB 4.23Å; F472-A504 HydrophobicContact CE2-CB 3.76Å; F472-A504 HydrophobicContact CG-CB 3.99Å; F472-A504 HydrophobicContact CZ-CB 3.99Å; W500-A504 WeakPolarHBondContact O-CB 3.19Å; W500-A504 PolarHBondContact O-N 2.74Å; L501-A504 WeakPolarHBondContact O-CB 3.31Å; L501-A504 PolarHBondContact O-N 2.95Å; R502-A504 VanDerWaalsContact C-N 3.26Å; R502-A504 PolarHBondContact O-N 2.83Å; A504-D506 VanDerWaalsContact C-N 3.31Å; A504-D506 PolarHBondContact O-N 3.19Å; A504-K507 PolarHBondContact O-N 2.94Å; A504-Y508 HydrophobicContact CB-CD2 3.68Å; A504-Y508 HydrophobicContact CB-CE2 3.75Å; A504-Y508 WeakPolarHBondContact O-CD2 3.5Å; A504-Y508 PolarHBondContact O-N 2.74Å; A504-L513 HydrophobicContact CB-CD1 3.82Å; A504-L513 HydrophobicContact CB-CD2 4.28Å
505	Q	91.9	Very high	91.6	Very high	99 Å²	99	67 Å²	67	46%	0.463	33%	0.332	S	S	.	.	H	α-helix	trans	-64.2	-34.8	175.1	-73.1	169.9	-11.2	0	0	112.5	L501 R502 K507 L513	L501-Q505 VanDerWaalsContact O-CG 3.31Å; L501-Q505 WeakPolarHBondContact O-CG 3.48Å; L501-Q505 PolarHBondContact O-N 2.86Å; R502-Q505 WeakPolarHBondContact O-CB 3.22Å; R502-Q505 PolarHBondContact O-N 3Å; R502-Q505 VanDerWaalsContact O-N 3.09Å; Q505-K507 VanDerWaalsContact C-N 3.25Å; Q505-K507 PolarHBondContact O-N 3.44Å; Q505-L513 HydrophobicContact CB-CD2 4.31Å; Q505-L513 HydrophobicContact CG-CD2 3.56Å
506	D	88.9	Confident	91.7	Very high	132 Å²	132	61 Å²	61	71%	0.706	31%	0.31	S	S	*	.	H	α-helix	trans	-72.8	-19.9	176.6	-62.7	-27.1	0	0	0	112.7	R502 A504	R502-D506 PolarHBondContact O-N 2.98Å; R502-D506 VanDerWaalsContact O-N 3.1Å; A504-D506 VanDerWaalsContact C-N 3.31Å; A504-D506 PolarHBondContact O-N 3.19Å
507	K	88.2	Confident	91.6	Very high	25 Å²	25	58.7 Å²	58.7	11%	0.109	30%	0.3	C	S	.	.	H	α-helix	trans	-106.4	-40.7	-173.1	-73.9	-173.2	170.5	-133.9	0	114.3	V459 E460 D462 A464 G465 R503 A504 Q505	V459-K507 WeakPolarHBondContact O-CD 3.46Å; V459-K507 WeakPolarHBondContact O-CE 3.5Å; V459-K507 PolarHBondContact O-NZ 3.37Å; E460-K507 PolarHBondContact O-NZ 3.16Å; D462-K507 HydrophobicContact CB-CD 4.46Å; D462-K507 PolarHBondContact O-NZ 2.73Å; A464-K507 CarbonylContact C-O 3.45Å; G465-K507 WeakPolarHBondContact CA-O 3.43Å; G465-K507 PolarHBondContact N-O 3.15Å; R503-K507 WeakPolarHBondContact O-CG 3.32Å; R503-K507 PolarHBondContact O-N 3.33Å; A504-K507 PolarHBondContact O-N 2.94Å; Q505-K507 VanDerWaalsContact C-N 3.25Å; Q505-K507 PolarHBondContact O-N 3.44Å
508	Y	92.1	Very high	91.5	Very high	7 Å²	7	60 Å²	60	3%	0.027	31%	0.305	C	S	.	.	S	Bend	trans	-108.5	145.3	-168	-50.8	-61.6	0	0	0	111.6	V459 D462 S466 T469 F472 A504 A510 L513	V459-Y508 HydrophobicContact CG1-CE2 4.36Å; D462-Y508 HydrophobicContact CB-CE1 3.98Å; D462-Y508 WeakPolarHBondContact OD2-CE1 3.19Å; D462-Y508 PolarHBondContact OD2-OH 3.46Å; S466-Y508 WeakPolarHBondContact O-CD1 3.25Å; T469-Y508 HydrophobicContact CG2-CD1 3.97Å; T469-Y508 HydrophobicContact CG2-CD2 4.22Å; T469-Y508 HydrophobicContact CG2-CG 3.77Å; F472-Y508 HydrophobicContact CB-CE2 3.99Å; A504-Y508 HydrophobicContact CB-CD2 3.68Å; A504-Y508 HydrophobicContact CB-CE2 3.75Å; A504-Y508 WeakPolarHBondContact O-CD2 3.5Å; A504-Y508 PolarHBondContact O-N 2.74Å; Y508-A510 PolarHBondContact O-N 2.75Å; Y508-L513 HydrophobicContact CD2-CD1 4.37Å
509	P	91.3	Very high	91.5	Very high	57 Å²	57	63.9 Å²	63.9	37%	0.37	32%	0.317	S	S	.	.			trans	-55.7	133.5	171.4	-24.4	33.8	0	0	0	111.4	S466 A511 R512 L513	S466-P509 WeakPolarHBondContact O-CD 3.39Å; P509-A511 PolarHBondContact O-N 3.29Å; P509-A511 VanDerWaalsContact O-N 3.07Å; P509-R512 HydrophobicContact CB-CG 4.37Å; P509-R512 PolarHBondContact O-N 3.4Å; P509-L513 PolarHBondContact O-N 3.39Å
510	A	89.6	Confident	91.3	Very high	79 Å²	79	61.3 Å²	61.3	65%	0.653	30%	0.296	S	S	*	.	H	α-helix	trans	-53.5	-36.5	-173.6	0	0	0	0	0	113.9	Y508 R514	Y508-A510 PolarHBondContact O-N 2.75Å; A510-R514 VanDerWaalsContact O-CB 3.31Å; A510-R514 WeakPolarHBondContact O-CB 3.42Å; A510-R514 PolarHBondContact O-N 3.41Å
511	A	89.4	Confident	91	Very high	76 Å²	76	60.8 Å²	60.8	63%	0.628	29%	0.294	S	S	*	.	H	α-helix	trans	-64.9	-42.7	177.1	0	0	0	0	0	112.6	P509 R514 Q515	P509-A511 PolarHBondContact O-N 3.29Å; P509-A511 VanDerWaalsContact O-N 3.07Å; A511-R514 PolarHBondContact O-N 2.96Å; A511-Q515 PolarHBondContact O-N 3.45Å
512	R	91.1	Very high	90.6	Very high	124 Å²	124	67.1 Å²	67.1	47%	0.468	32%	0.317	S	S	.	.	H	α-helix	trans	-69.1	-45.1	178.4	-67.3	-61.9	-172.8	178.1	4.5	111.1	T469 P509 R514 Q515 E516	T469-R512 HydrophobicContact CG2-CB 3.92Å; P509-R512 HydrophobicContact CB-CG 4.37Å; P509-R512 PolarHBondContact O-N 3.4Å; R512-R514 VanDerWaalsContact C-N 3.29Å; R512-R514 PolarHBondContact O-N 2.93Å; R512-Q515 PolarHBondContact O-N 3.24Å; R512-E516 PolarHBondContact O-N 3.11Å
513	L	91.6	Very high	90.3	Very high	8 Å²	8	63 Å²	63	4%	0.042	32%	0.32	C	S	.	.	H	α-helix	trans	-58.1	-43.7	175.8	-177	58.5	0	0	0	111.4	F472 L501 A504 Q505 Y508 P509 E516 L517	F472-L513 HydrophobicContact CD1-CD1 3.57Å; F472-L513 HydrophobicContact CE1-CD1 3.41Å; F472-L513 VanDerWaalsContact CE1-CD1 3.41Å; F472-L513 HydrophobicContact CZ-CD1 4.28Å; L501-L513 HydrophobicContact CD1-CD2 4.36Å; A504-L513 HydrophobicContact CB-CD1 3.82Å; A504-L513 HydrophobicContact CB-CD2 4.28Å; Q505-L513 HydrophobicContact CB-CD2 4.31Å; Q505-L513 HydrophobicContact CG-CD2 3.56Å; Y508-L513 HydrophobicContact CD2-CD1 4.37Å; P509-L513 PolarHBondContact O-N 3.39Å; L513-E516 PolarHBondContact O-N 3.31Å; L513-L517 HydrophobicContact CD1-CD1 4.35Å; L513-L517 HydrophobicContact CD1-CG 4.31Å; L513-L517 HydrophobicContact CG-CD1 4.04Å; L513-L517 HydrophobicContact CG-CG 4.46Å; L513-L517 WeakPolarHBondContact O-CB 3.44Å; L513-L517 WeakPolarHBondContact O-CG 3.49Å; L513-L517 PolarHBondContact O-N 3Å
514	R	90.2	Very high	90.1	Very high	125 Å²	125	61.2 Å²	61.2	47%	0.472	32%	0.315	S	S	.	.	H	α-helix	trans	-61.1	-44.9	176.1	-176.1	-175.7	-61.3	-149.6	-3.5	112.4	A510 A511 R512 E516 L517 Q518 T550	A510-R514 VanDerWaalsContact O-CB 3.31Å; A510-R514 WeakPolarHBondContact O-CB 3.42Å; A510-R514 PolarHBondContact O-N 3.41Å; A511-R514 PolarHBondContact O-N 2.96Å; R512-R514 VanDerWaalsContact C-N 3.29Å; R512-R514 PolarHBondContact O-N 2.93Å; R514-E516 VanDerWaalsContact C-N 3.33Å; R514-E516 PolarHBondContact O-N 3.43Å; R514-L517 PolarHBondContact O-N 3.49Å; R514-Q518 WeakPolarHBondContact O-CB 3.4Å; R514-Q518 WeakPolarHBondContact O-CG 3.47Å; R514-Q518 PolarHBondContact O-N 2.68Å; R514-T550 HydrophobicContact CG-CG2 4.42Å
515	Q	90.4	Very high	89.8	Confident	111 Å²	111	64 Å²	64	52%	0.519	33%	0.332	S	S	.	.	H	α-helix	trans	-60.8	-43.8	178.3	-176.2	-178.4	6.1	0	0	111.4	A511 R512 Q518 R519	A511-Q515 PolarHBondContact O-N 3.45Å; R512-Q515 PolarHBondContact O-N 3.24Å; Q515-Q518 WeakPolarHBondContact O-CB 3.49Å; Q515-Q518 PolarHBondContact O-N 3.15Å; Q515-R519 PolarHBondContact O-N 3.25Å
516	E	93	Very high	89.6	Confident	19 Å²	19	65.4 Å²	65.4	9%	0.089	34%	0.343	C	S	.	.	H	α-helix	trans	-68.1	-43.7	-179	-170.4	59.9	-158.5	0	0	112	G473 R512 L513 R514 Q518 R519 V520	G473-E516 WeakPolarHBondContact CA-OE1 3.45Å; R512-E516 PolarHBondContact O-N 3.11Å; L513-E516 PolarHBondContact O-N 3.31Å; R514-E516 VanDerWaalsContact C-N 3.33Å; R514-E516 PolarHBondContact O-N 3.43Å; E516-Q518 VanDerWaalsContact C-N 3.33Å; E516-Q518 PolarHBondContact O-N 3.35Å; E516-R519 VanDerWaalsContact O-CB 3.3Å; E516-R519 WeakPolarHBondContact O-CB 3.37Å; E516-R519 PolarHBondContact O-N 2.86Å; E516-R519 VanDerWaalsContact O-N 3.12Å; E516-R519 IonicContact OE1-CZ 2.66Å; E516-R519 IonicContact OE1-NE 3.98Å; E516-R519 PolarHBondContact OE1-NE 3.07Å; E516-R519 IonicContact OE1-NH2 3.86Å; E516-R519 PolarHBondContact OE1-NH2 3.43Å; E516-R519 IonicContact OE2-NE 3.42Å; E516-R519 PolarHBondContact OE2-NE 3.49Å; E516-V520 PolarHBondContact O-N 3.29Å
517	L	91.5	Very high	89.6	Confident	6 Å²	6	62 Å²	62	3%	0.031	32%	0.322	C	S	.	.	H	α-helix	trans	-56.8	-45.3	172.5	-84.4	179.6	0	0	0	112.3	F472 L476 L501 L513 R514 R519 V520 W521	F472-L517 HydrophobicContact CE1-CD2 3.69Å; F472-L517 HydrophobicContact CE1-CG 4.12Å; F472-L517 HydrophobicContact CZ-CD2 4.2Å; L476-L517 HydrophobicContact CD1-CD2 3.59Å; L501-L517 HydrophobicContact CD1-CD1 3.94Å; L501-L517 HydrophobicContact CD1-CD2 4.44Å; L513-L517 HydrophobicContact CD1-CD1 4.35Å; L513-L517 HydrophobicContact CD1-CG 4.31Å; L513-L517 HydrophobicContact CG-CD1 4.04Å; L513-L517 HydrophobicContact CG-CG 4.46Å; L513-L517 WeakPolarHBondContact O-CB 3.44Å; L513-L517 WeakPolarHBondContact O-CG 3.49Å; L513-L517 PolarHBondContact O-N 3Å; R514-L517 PolarHBondContact O-N 3.49Å; L517-R519 VanDerWaalsContact C-N 3.31Å; L517-R519 PolarHBondContact O-N 3.48Å; L517-V520 PolarHBondContact O-N 3.14Å; L517-W521 VanDerWaalsContact C-CE3 3.44Å; L517-W521 HydrophobicContact CB-CD2 4.5Å; L517-W521 HydrophobicContact CB-CE3 3.84Å; L517-W521 HydrophobicContact CB-CH2 3.78Å; L517-W521 HydrophobicContact CB-CZ2 4.4Å; L517-W521 HydrophobicContact CB-CZ3 3.36Å; L517-W521 HydrophobicContact CD1-CH2 3.66Å; L517-W521 HydrophobicContact CD1-CZ2 4.43Å; L517-W521 HydrophobicContact CD1-CZ3 3.98Å; L517-W521 HydrophobicContact CD2-CH2 3.52Å; L517-W521 HydrophobicContact CD2-CZ2 3.47Å; L517-W521 VanDerWaalsContact CD2-CZ2 3.47Å; L517-W521 HydrophobicContact CD2-CZ3 3.99Å; L517-W521 HydrophobicContact CG-CH2 3.84Å; L517-W521 HydrophobicContact CG-CZ2 4.3Å; L517-W521 HydrophobicContact CG-CZ3 3.97Å; L517-W521 WeakPolarHBondContact O-CB 3.49Å; L517-W521 VanDerWaalsContact O-CG 3.32Å; L517-W521 PolarHBondContact O-N 2.8Å
518	Q	90.6	Very high	89.5	Confident	43 Å²	43	60.9 Å²	60.9	20%	0.201	32%	0.318	C	S	.	.	H	α-helix	trans	-59.5	-40	173.9	-81.9	177.4	-6.3	0	0	112.9	R514 Q515 E516 R522 T550	R514-Q518 WeakPolarHBondContact O-CB 3.4Å; R514-Q518 WeakPolarHBondContact O-CG 3.47Å; R514-Q518 PolarHBondContact O-N 2.68Å; Q515-Q518 WeakPolarHBondContact O-CB 3.49Å; Q515-Q518 PolarHBondContact O-N 3.15Å; E516-Q518 VanDerWaalsContact C-N 3.33Å; E516-Q518 PolarHBondContact O-N 3.35Å; Q518-R522 WeakPolarHBondContact O-CB 3.45Å; Q518-R522 VanDerWaalsContact O-CG 3.27Å; Q518-R522 WeakPolarHBondContact O-CG 3.5Å; Q518-R522 PolarHBondContact O-N 3.27Å; Q518-R522 VanDerWaalsContact O-N 3.14Å; Q518-T550 WeakPolarHBondContact CG-O 3.49Å; Q518-T550 PolarHBondContact NE2-O 2.94Å
519	R	90.4	Very high	89.3	Confident	110 Å²	110	63.7 Å²	63.7	42%	0.415	33%	0.333	S	S	.	.	H	α-helix	trans	-60.2	-53.8	177.2	-175.6	-170.5	73.3	72.9	2.5	110.6	E477 Q515 E516 L517 G523	E477-R519 IonicContact OE1-CZ 3.39Å; E477-R519 VanDerWaalsContact OE1-CZ 3.27Å; E477-R519 IonicContact OE1-NH1 2.86Å; E477-R519 PolarHBondContact OE1-NH1 3.33Å; E477-R519 IonicContact OE1-NH2 2.6Å; E477-R519 PolarHBondContact OE1-NH2 3.11Å; Q515-R519 PolarHBondContact O-N 3.25Å; E516-R519 VanDerWaalsContact O-CB 3.3Å; E516-R519 WeakPolarHBondContact O-CB 3.37Å; E516-R519 PolarHBondContact O-N 2.86Å; E516-R519 VanDerWaalsContact O-N 3.12Å; E516-R519 IonicContact OE1-CZ 2.66Å; E516-R519 IonicContact OE1-NE 3.98Å; E516-R519 PolarHBondContact OE1-NE 3.07Å; E516-R519 IonicContact OE1-NH2 3.86Å; E516-R519 PolarHBondContact OE1-NH2 3.43Å; E516-R519 IonicContact OE2-NE 3.42Å; E516-R519 PolarHBondContact OE2-NE 3.49Å; L517-R519 VanDerWaalsContact C-N 3.31Å; L517-R519 PolarHBondContact O-N 3.48Å; R519-G523 PolarHBondContact O-N 2.99Å; R519-G523 VanDerWaalsContact O-N 3.15Å
520	V	91	Very high	89.1	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.006	32%	0.319	C	S	.	.	H	α-helix	trans	-62.5	-48.3	-178.1	176.9	0	0	0	0	110.9	L476 E477 L480 E516 L517 R522 G523 H524	L476-V520 HydrophobicContact CB-CG1 3.96Å; E477-V520 HydrophobicContact CG-CG1 3.92Å; E477-V520 HydrophobicContact CG-CG2 4.18Å; L480-V520 HydrophobicContact CD1-CG1 4.31Å; E516-V520 PolarHBondContact O-N 3.29Å; L517-V520 PolarHBondContact O-N 3.14Å; V520-R522 PolarHBondContact O-N 2.77Å; V520-G523 PolarHBondContact O-N 3.48Å; V520-G523 VanDerWaalsContact O-N 3.12Å; V520-H524 PolarHBondContact O-CD2 3.42Å; V520-H524 PolarHBondContact O-N 2.81Å; V520-H524 VanDerWaalsContact O-N 3.07Å
521	W	88.3	Confident	89	Confident	12 Å²	12	57.7 Å²	57.7	5%	0.045	29%	0.289	C	S	.	.	H	α-helix	trans	-67.6	-35	-174.2	-66.3	-32.8	0	0	0	114	L517 G523 H524 T525 V528 L547 T550	L517-W521 VanDerWaalsContact C-CE3 3.44Å; L517-W521 HydrophobicContact CB-CD2 4.5Å; L517-W521 HydrophobicContact CB-CE3 3.84Å; L517-W521 HydrophobicContact CB-CH2 3.78Å; L517-W521 HydrophobicContact CB-CZ2 4.4Å; L517-W521 HydrophobicContact CB-CZ3 3.36Å; L517-W521 HydrophobicContact CD1-CH2 3.66Å; L517-W521 HydrophobicContact CD1-CZ2 4.43Å; L517-W521 HydrophobicContact CD1-CZ3 3.98Å; L517-W521 HydrophobicContact CD2-CH2 3.52Å; L517-W521 HydrophobicContact CD2-CZ2 3.47Å; L517-W521 VanDerWaalsContact CD2-CZ2 3.47Å; L517-W521 HydrophobicContact CD2-CZ3 3.99Å; L517-W521 HydrophobicContact CG-CH2 3.84Å; L517-W521 HydrophobicContact CG-CZ2 4.3Å; L517-W521 HydrophobicContact CG-CZ3 3.97Å; L517-W521 WeakPolarHBondContact O-CB 3.49Å; L517-W521 VanDerWaalsContact O-CG 3.32Å; L517-W521 PolarHBondContact O-N 2.8Å; W521-G523 VanDerWaalsContact C-N 3.33Å; W521-H524 CarbonylContact O-C 3.6Å; W521-H524 PolarHBondContact O-N 3.49Å; W521-T525 PolarHBondContact O-N 3.39Å; W521-V528 HydrophobicContact CB-CG1 4.42Å; W521-V528 HydrophobicContact CB-CG2 4.21Å; W521-V528 HydrophobicContact CG-CG1 4.26Å; W521-V528 HydrophobicContact CG-CG2 4.09Å; W521-L547 HydrophobicContact CD2-CD2 3.96Å; W521-L547 HydrophobicContact CG-CD2 4.41Å; W521-L547 HydrophobicContact CH2-CD2 4.1Å; W521-L547 HydrophobicContact CZ2-CD2 3.24Å; W521-L547 HydrophobicContact CZ2-CG 4.1Å; W521-L547 VanDerWaalsContact NE1-CD2 3.32Å; W521-T550 HydrophobicContact CE3-CG2 4.45Å; W521-T550 HydrophobicContact CH2-CG2 4.03Å; W521-T550 HydrophobicContact CZ3-CG2 3.45Å; W521-T550 VanDerWaalsContact CZ3-CG2 3.45Å; W521-T550 WeakPolarHBondContact CZ3-OG1 3.42Å
522	R	86	Confident	88.9	Confident	141 Å²	141	54.5 Å²	54.5	53%	0.532	26%	0.262	S	S	.	.	H	α-helix	trans	-69	-34.7	173.4	-71.3	177.6	-178.6	166.4	5.9	111.9	Q518 V520 H524 T525	Q518-R522 WeakPolarHBondContact O-CB 3.45Å; Q518-R522 VanDerWaalsContact O-CG 3.27Å; Q518-R522 WeakPolarHBondContact O-CG 3.5Å; Q518-R522 PolarHBondContact O-N 3.27Å; Q518-R522 VanDerWaalsContact O-N 3.14Å; V520-R522 PolarHBondContact O-N 2.77Å; R522-H524 VanDerWaalsContact C-N 3.29Å; R522-H524 PolarHBondContact O-N 2.6Å; R522-T525 PolarHBondContact O-OG1 3.24Å
523	G	85.9	Confident	88.8	Confident	57 Å²	57	56.5 Å²	56.5	59%	0.588	27%	0.27	S	S	*	.	H	α-helix	trans	-67.6	-26.8	175.6	0	0	0	0	0	114	R519 V520 W521	R519-G523 PolarHBondContact O-N 2.99Å; R519-G523 VanDerWaalsContact O-N 3.15Å; V520-G523 PolarHBondContact O-N 3.48Å; V520-G523 VanDerWaalsContact O-N 3.12Å; W521-G523 VanDerWaalsContact C-N 3.33Å
524	H	88.4	Confident	88.5	Confident	53 Å²	53	56.4 Å²	56.4	25%	0.245	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.9	49.4	-172.2	-64.2	-79.5	0	0	0	112.3	L480 V520 W521 R522 D526 E527 V528	L480-H524 HydrophobicContact CD1-CB 3.89Å; V520-H524 PolarHBondContact O-CD2 3.42Å; V520-H524 PolarHBondContact O-N 2.81Å; V520-H524 VanDerWaalsContact O-N 3.07Å; W521-H524 CarbonylContact O-C 3.6Å; W521-H524 PolarHBondContact O-N 3.49Å; R522-H524 VanDerWaalsContact C-N 3.29Å; R522-H524 PolarHBondContact O-N 2.6Å; H524-D526 VanDerWaalsContact C-N 3.33Å; H524-D526 PolarHBondContact O-N 2.93Å; H524-E527 WeakPolarHBondContact CA-OE2 3.37Å; H524-E527 HydrophobicContact CB-CB 4.47Å; H524-E527 PolarHBondContact O-N 3.49Å; H524-V528 HydrophobicContact CB-CG2 4.45Å; H524-V528 WeakPolarHBondContact O-CB 3.4Å; H524-V528 WeakPolarHBondContact O-CG2 3.21Å; H524-V528 PolarHBondContact O-N 2.9Å
525	T	86.8	Confident	88.4	Confident	59 Å²	59	50.5 Å²	50.5	36%	0.362	25%	0.248	S	C	.	.	H	α-helix	trans	-60.5	-40.4	-170.1	-60.3	0	0	0	0	112.4	W521 R522 V528 L529	W521-T525 PolarHBondContact O-N 3.39Å; R522-T525 PolarHBondContact O-OG1 3.24Å; T525-V528 PolarHBondContact O-N 3.28Å; T525-L529 HydrophobicContact CG2-CD1 4.13Å; T525-L529 HydrophobicContact CG2-CG 4.44Å; T525-L529 VanDerWaalsContact O-CG 3.28Å; T525-L529 WeakPolarHBondContact O-CG 3.41Å; T525-L529 PolarHBondContact O-N 3.45Å
526	D	86.7	Confident	88.4	Confident	129 Å²	129	48.9 Å²	48.9	69%	0.69	25%	0.245	S	C	*	.	H	α-helix	trans	-68.7	-44.8	-177.1	-72.2	-30.9	0	0	0	111.7	H524 V528 L529 G530	H524-D526 VanDerWaalsContact C-N 3.33Å; H524-D526 PolarHBondContact O-N 2.93Å; D526-V528 VanDerWaalsContact C-N 3.3Å; D526-V528 PolarHBondContact O-N 2.98Å; D526-L529 PolarHBondContact O-N 3.46Å; D526-G530 PolarHBondContact O-N 3.29Å
527	E	88.9	Confident	88.1	Confident	59 Å²	59	52.3 Å²	52.3	28%	0.276	28%	0.277	S	S	.	.	H	α-helix	trans	-64.1	-39.1	176.8	-61.6	85.9	166.6	0	0	111	L480 W483 H524 G530 L531	L480-E527 HydrophobicContact CB-CB 4.49Å; L480-E527 HydrophobicContact CD2-CB 4.18Å; W483-E527 HydrophobicContact CZ3-CB 4.23Å; W483-E527 WeakPolarHBondContact CZ3-O 3.29Å; H524-E527 WeakPolarHBondContact CA-OE2 3.37Å; H524-E527 HydrophobicContact CB-CB 4.47Å; H524-E527 PolarHBondContact O-N 3.49Å; E527-G530 CarbonylContact O-C 3.47Å; E527-G530 WeakPolarHBondContact O-CA 3.47Å; E527-G530 PolarHBondContact O-N 2.9Å; E527-L531 PolarHBondContact O-N 3.48Å
528	V	86.8	Confident	87.8	Confident	3 Å²	3	55 Å²	55	2%	0.018	29%	0.289	C	S	.	.	H	α-helix	trans	-68.5	-40.2	179	171.3	0	0	0	0	112.2	L480 W521 H524 T525 D526 G530 L531 A532 L547 M551	L480-V528 HydrophobicContact CD1-CG2 4.29Å; W521-V528 HydrophobicContact CB-CG1 4.42Å; W521-V528 HydrophobicContact CB-CG2 4.21Å; W521-V528 HydrophobicContact CG-CG1 4.26Å; W521-V528 HydrophobicContact CG-CG2 4.09Å; H524-V528 HydrophobicContact CB-CG2 4.45Å; H524-V528 WeakPolarHBondContact O-CB 3.4Å; H524-V528 WeakPolarHBondContact O-CG2 3.21Å; H524-V528 PolarHBondContact O-N 2.9Å; T525-V528 PolarHBondContact O-N 3.28Å; D526-V528 VanDerWaalsContact C-N 3.3Å; D526-V528 PolarHBondContact O-N 2.98Å; V528-G530 VanDerWaalsContact C-N 3.26Å; V528-G530 PolarHBondContact O-N 3.5Å; V528-L531 PolarHBondContact O-N 3.41Å; V528-A532 WeakPolarHBondContact O-CB 3.41Å; V528-A532 PolarHBondContact O-N 3.47Å; V528-L547 HydrophobicContact CG1-CD2 4.1Å; V528-M551 HydrophobicContact CG1-SD 4.36Å
529	L	87.3	Confident	87.5	Confident	65 Å²	65	55.6 Å²	55.6	34%	0.34	31%	0.307	S	S	.	.	H	α-helix	trans	-63.7	-35.8	172.6	-72.7	173.7	0	0	0	111.5	T525 D526 R533	T525-L529 HydrophobicContact CG2-CD1 4.13Å; T525-L529 HydrophobicContact CG2-CG 4.44Å; T525-L529 VanDerWaalsContact O-CG 3.28Å; T525-L529 WeakPolarHBondContact O-CG 3.41Å; T525-L529 PolarHBondContact O-N 3.45Å; D526-L529 PolarHBondContact O-N 3.46Å; L529-R533 PolarHBondContact O-N 3.27Å
530	G	87.3	Confident	87.3	Confident	8 Å²	8	53.5 Å²	53.5	8%	0.082	30%	0.299	C	S	.	.	H	α-helix	trans	-62.6	-49.6	171.2	0	0	0	0	0	112.8	D526 E527 V528 A532 R533 A534	D526-G530 PolarHBondContact O-N 3.29Å; E527-G530 CarbonylContact O-C 3.47Å; E527-G530 WeakPolarHBondContact O-CA 3.47Å; E527-G530 PolarHBondContact O-N 2.9Å; V528-G530 VanDerWaalsContact C-N 3.26Å; V528-G530 PolarHBondContact O-N 3.5Å; G530-A532 VanDerWaalsContact C-N 3.33Å; G530-A532 PolarHBondContact O-N 2.91Å; G530-R533 WeakPolarHBondContact O-CB 3.36Å; G530-R533 PolarHBondContact O-N 3.42Å; G530-A534 PolarHBondContact O-N 3.49Å
531	L	87.1	Confident	87.1	Confident	3 Å²	3	57.9 Å²	57.9	2%	0.016	32%	0.322	C	S	.	.	H	α-helix	trans	-57.9	-43.2	174.9	173.5	59.3	0	0	0	111.7	L480 L493 V497 E527 V528 R533 A534 L535	L480-L531 HydrophobicContact CD2-CD2 4.31Å; L493-L531 HydrophobicContact CD2-CB 4.48Å; L493-L531 HydrophobicContact CD2-CD1 3.68Å; L493-L531 HydrophobicContact CD2-CG 4.44Å; L493-L531 HydrophobicContact CG-CD1 3.93Å; V497-L531 HydrophobicContact CG2-CD2 4.44Å; E527-L531 PolarHBondContact O-N 3.48Å; V528-L531 PolarHBondContact O-N 3.41Å; L531-R533 VanDerWaalsContact C-N 3.31Å; L531-R533 PolarHBondContact O-N 2.88Å; L531-A534 WeakPolarHBondContact O-CB 3.44Å; L531-A534 PolarHBondContact O-N 2.93Å; L531-A534 VanDerWaalsContact O-N 3.16Å; L531-L535 HydrophobicContact CD1-CD1 3.89Å; L531-L535 HydrophobicContact CD1-CD2 4.21Å; L531-L535 HydrophobicContact CD1-CG 3.75Å; L531-L535 HydrophobicContact CD2-CD1 4.49Å; L531-L535 HydrophobicContact CG-CD1 3.83Å; L531-L535 HydrophobicContact CG-CG 4.17Å; L531-L535 WeakPolarHBondContact O-CB 3.37Å; L531-L535 VanDerWaalsContact O-CG 3.28Å; L531-L535 WeakPolarHBondContact O-CG 3.35Å; L531-L535 PolarHBondContact O-N 3.08Å
532	A	88.1	Confident	86.8	Confident	8 Å²	8	61 Å²	61	7%	0.066	35%	0.351	C	S	.	.	H	α-helix	trans	-58.5	-43.3	177.7	0	0	0	0	0	111.6	V528 G530 L535 V536 F548	V528-A532 WeakPolarHBondContact O-CB 3.41Å; V528-A532 PolarHBondContact O-N 3.47Å; G530-A532 VanDerWaalsContact C-N 3.33Å; G530-A532 PolarHBondContact O-N 2.91Å; A532-L535 PolarHBondContact O-N 3.05Å; A532-V536 VanDerWaalsContact O-CG2 3.32Å; A532-V536 WeakPolarHBondContact O-CG2 3.36Å; A532-V536 PolarHBondContact O-N 3.38Å; A532-F548 HydrophobicContact CB-CZ 4.46Å
533	R	88.6	Confident	86.6	Confident	167 Å²	167	55.2 Å²	55.2	63%	0.63	33%	0.33	S	S	*	.	H	α-helix	trans	-62.3	-44.7	175	-71.5	-175.9	-73.4	-98.2	2.2	111.8	L529 G530 L531 V536 A537	L529-R533 PolarHBondContact O-N 3.27Å; G530-R533 WeakPolarHBondContact O-CB 3.36Å; G530-R533 PolarHBondContact O-N 3.42Å; L531-R533 VanDerWaalsContact C-N 3.31Å; L531-R533 PolarHBondContact O-N 2.88Å; R533-V536 PolarHBondContact O-N 2.96Å; R533-A537 PolarHBondContact O-N 3.43Å
534	A	86	Confident	86.5	Confident	5 Å²	5	53.1 Å²	53.1	4%	0.041	31%	0.305	C	S	.	.	H	α-helix	trans	-61.1	-43.9	177.2	0	0	0	0	0	112.2	D490 G530 L531 A537 Q538	D490-A534 HydrophobicContact CB-CB 3.89Å; G530-A534 PolarHBondContact O-N 3.49Å; L531-A534 WeakPolarHBondContact O-CB 3.44Å; L531-A534 PolarHBondContact O-N 2.93Å; L531-A534 VanDerWaalsContact O-N 3.16Å; A534-A537 PolarHBondContact O-N 3.22Å; A534-Q538 VanDerWaalsContact O-CG 3.26Å; A534-Q538 WeakPolarHBondContact O-CG 3.45Å; A534-Q538 PolarHBondContact O-N 3.25Å; A534-Q538 VanDerWaalsContact O-N 3.1Å; A534-Q538 PolarHBondContact O-NE2 3.47Å
535	L	87.8	Confident	86.4	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-66.2	-37.3	178.3	-69.8	173.3	0	0	0	112.6	L531 A532 Q538 G539 R540 L543 V544 L547	L531-L535 HydrophobicContact CD1-CD1 3.89Å; L531-L535 HydrophobicContact CD1-CD2 4.21Å; L531-L535 HydrophobicContact CD1-CG 3.75Å; L531-L535 HydrophobicContact CD2-CD1 4.49Å; L531-L535 HydrophobicContact CG-CD1 3.83Å; L531-L535 HydrophobicContact CG-CG 4.17Å; L531-L535 WeakPolarHBondContact O-CB 3.37Å; L531-L535 VanDerWaalsContact O-CG 3.28Å; L531-L535 WeakPolarHBondContact O-CG 3.35Å; L531-L535 PolarHBondContact O-N 3.08Å; A532-L535 PolarHBondContact O-N 3.05Å; L535-Q538 CarbonylContact O-C 3.45Å; L535-Q538 PolarHBondContact O-N 3.48Å; L535-G539 PolarHBondContact O-N 3.39Å; L535-R540 HydrophobicContact CB-CB 4.29Å; L535-R540 HydrophobicContact CD2-CB 4.01Å; L535-R540 HydrophobicContact CD2-CG 4.41Å; L535-R540 PolarHBondContact O-N 3.19Å; L535-L543 HydrophobicContact CD1-CB 4Å; L535-L543 HydrophobicContact CD2-CD1 4.14Å; L535-V544 HydrophobicContact CB-CG2 3.53Å; L535-V544 HydrophobicContact CD1-CG2 4.34Å; L535-L547 HydrophobicContact CD1-CD1 3.49Å; L535-L547 VanDerWaalsContact CD1-CD1 3.49Å
536	V	90.1	Very high	86.1	Confident	78 Å²	78	57.9 Å²	57.9	47%	0.473	32%	0.318	S	S	.	.	H	α-helix	trans	-61.8	-46.3	172.8	170.1	0	0	0	0	110.6	A532 R533 Q538 G539 L541 V544	A532-V536 VanDerWaalsContact O-CG2 3.32Å; A532-V536 WeakPolarHBondContact O-CG2 3.36Å; A532-V536 PolarHBondContact O-N 3.38Å; R533-V536 PolarHBondContact O-N 2.96Å; V536-Q538 PolarHBondContact O-N 3.04Å; V536-G539 PolarHBondContact O-N 2.91Å; V536-L541 HydrophobicContact CG2-CD2 4.47Å; V536-V544 HydrophobicContact CG2-CG1 4.11Å; V536-V544 HydrophobicContact CG2-CG2 3.89Å
537	A	87.2	Confident	85.8	Confident	91 Å²	91	52.1 Å²	52.1	75%	0.752	29%	0.287	S	S	*	.	H	α-helix	trans	-60.8	-28.7	177.5	0	0	0	0	0	112.6	R533 A534	R533-A537 PolarHBondContact O-N 3.43Å; A534-A537 PolarHBondContact O-N 3.22Å
538	Q	84.8	Confident	85.5	Confident	63 Å²	63	54 Å²	54	29%	0.294	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-0.1	176.9	-65.8	168.2	40.5	0	0	114.1	D490 A534 L535 V536 R540	D490-Q538 PolarHBondContact O-NE2 3.29Å; A534-Q538 VanDerWaalsContact O-CG 3.26Å; A534-Q538 WeakPolarHBondContact O-CG 3.45Å; A534-Q538 PolarHBondContact O-N 3.25Å; A534-Q538 VanDerWaalsContact O-N 3.1Å; A534-Q538 PolarHBondContact O-NE2 3.47Å; L535-Q538 CarbonylContact O-C 3.45Å; L535-Q538 PolarHBondContact O-N 3.48Å; V536-Q538 PolarHBondContact O-N 3.04Å; Q538-R540 VanDerWaalsContact C-N 3.27Å; Q538-R540 HydrophobicContact CB-CG 4.18Å; Q538-R540 PolarHBondContact O-N 3Å
539	G	85.1	Confident	85.2	Confident	55 Å²	55	59.2 Å²	59.2	57%	0.567	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.4	15.1	-177.6	0	0	0	0	0	114.8	L535 V536 L541	L535-G539 PolarHBondContact O-N 3.39Å; V536-G539 PolarHBondContact O-N 2.91Å; G539-L541 PolarHBondContact O-N 3.44Å
540	R	84.8	Confident	84.8	Confident	66 Å²	66	56.3 Å²	56.3	25%	0.249	30%	0.304	C	S	.	.			trans	-85.6	54.9	-178.4	-66.4	178.8	177.5	-112.3	-16.2	112.2	G494 D498 L535 Q538 A542 L543 V544	G494-R540 VanDerWaalsContact C-NH1 3.35Å; G494-R540 PolarHBondContact O-NH1 2.91Å; D498-R540 IonicContact OD2-NH1 3.82Å; D498-R540 PolarHBondContact OD2-NH1 3.45Å; L535-R540 HydrophobicContact CB-CB 4.29Å; L535-R540 HydrophobicContact CD2-CB 4.01Å; L535-R540 HydrophobicContact CD2-CG 4.41Å; L535-R540 PolarHBondContact O-N 3.19Å; Q538-R540 VanDerWaalsContact C-N 3.27Å; Q538-R540 HydrophobicContact CB-CG 4.18Å; Q538-R540 PolarHBondContact O-N 3Å; R540-A542 VanDerWaalsContact C-N 3.26Å; R540-A542 PolarHBondContact O-N 2.84Å; R540-L543 HydrophobicContact CB-CD1 4.24Å; R540-L543 PolarHBondContact O-N 3.44Å; R540-V544 PolarHBondContact O-N 2.96Å
541	L	86.3	Confident	84	Confident	92 Å²	92	59 Å²	59	48%	0.482	32%	0.315	S	S	.	.	H	α-helix	trans	-63.7	-25.9	-171.1	-59.6	179.6	0	0	0	114.3	V536 G539 V544 R545	V536-L541 HydrophobicContact CG2-CD2 4.47Å; G539-L541 PolarHBondContact O-N 3.44Å; L541-V544 PolarHBondContact O-N 3.2Å; L541-R545 WeakPolarHBondContact O-CG 3.4Å; L541-R545 PolarHBondContact O-N 2.99Å
542	A	83.3	Confident	83.1	Confident	79 Å²	79	65.3 Å²	65.3	65%	0.653	34%	0.344	S	S	*	.	H	α-helix	trans	-65.4	-42	177.5	0	0	0	0	0	112.4	R540 V544 R545 L546	R540-A542 VanDerWaalsContact C-N 3.26Å; R540-A542 PolarHBondContact O-N 2.84Å; A542-V544 VanDerWaalsContact C-N 3.35Å; A542-R545 PolarHBondContact O-N 2.85Å; A542-L546 PolarHBondContact O-N 3.14Å; A542-L546 VanDerWaalsContact O-N 3.07Å
543	L	80.9	Confident	81.5	Confident	18 Å²	18	75.3 Å²	75.3	9%	0.094	38%	0.38	C	S	.	.	H	α-helix	trans	-68.6	-37.2	176.3	-67.7	168.6	0	0	0	111.3	D498 L501 L535 R540 R545 L546 L547	D498-L543 HydrophobicContact CB-CD1 3.62Å; D498-L543 HydrophobicContact CB-CD2 4.34Å; L501-L543 HydrophobicContact CD2-CD2 3.73Å; L535-L543 HydrophobicContact CD1-CB 4Å; L535-L543 HydrophobicContact CD2-CD1 4.14Å; R540-L543 HydrophobicContact CB-CD1 4.24Å; R540-L543 PolarHBondContact O-N 3.44Å; L543-R545 VanDerWaalsContact C-N 3.34Å; L543-L546 PolarHBondContact O-N 3.11Å; L543-L547 WeakPolarHBondContact O-CB 3.38Å; L543-L547 VanDerWaalsContact O-CG 3.25Å; L543-L547 WeakPolarHBondContact O-CG 3.48Å; L543-L547 PolarHBondContact O-N 3.32Å
544	V	84.6	Confident	79.6	Confident	13 Å²	13	75.7 Å²	75.7	8%	0.079	39%	0.389	C	S	.	.	H	α-helix	trans	-61.9	-43.1	175.1	179.8	0	0	0	0	110.9	L535 V536 R540 L541 A542 L547 F548	L535-V544 HydrophobicContact CB-CG2 3.53Å; L535-V544 HydrophobicContact CD1-CG2 4.34Å; V536-V544 HydrophobicContact CG2-CG1 4.11Å; V536-V544 HydrophobicContact CG2-CG2 3.89Å; R540-V544 PolarHBondContact O-N 2.96Å; L541-V544 PolarHBondContact O-N 3.2Å; A542-V544 VanDerWaalsContact C-N 3.35Å; V544-L547 WeakPolarHBondContact O-CB 3.47Å; V544-L547 PolarHBondContact O-N 2.99Å; V544-F548 HydrophobicContact CG1-CD2 3.77Å; V544-F548 HydrophobicContact CG1-CE2 3.52Å; V544-F548 WeakPolarHBondContact O-CD2 3.22Å; V544-F548 PolarHBondContact O-N 3.23Å; V544-F548 VanDerWaalsContact O-N 3.14Å
545	R	85.3	Confident	77.2	Confident	168 Å²	168	78.4 Å²	78.4	63%	0.634	42%	0.418	S	S	*	.	H	α-helix	trans	-60.7	-49.1	174.7	-73.5	176.7	-173.4	-179.5	1.3	111.5	L541 A542 L543 L547 F548 E549	L541-R545 WeakPolarHBondContact O-CG 3.4Å; L541-R545 PolarHBondContact O-N 2.99Å; A542-R545 PolarHBondContact O-N 2.85Å; L543-R545 VanDerWaalsContact C-N 3.34Å; R545-L547 VanDerWaalsContact C-N 3.28Å; R545-L547 PolarHBondContact O-N 3.17Å; R545-F548 PolarHBondContact O-N 3.35Å; R545-F548 VanDerWaalsContact O-N 3.08Å; R545-E549 WeakPolarHBondContact O-CB 3.44Å; R545-E549 WeakPolarHBondContact O-CG 3.36Å; R545-E549 PolarHBondContact O-N 2.86Å
546	L	81.8	Confident	74.7	Confident	44 Å²	44	88.3 Å²	88.3	23%	0.23	46%	0.464	C	S	.	.	H	α-helix	trans	-59.4	-40.1	178.6	-174.9	71.8	0	0	0	112.1	L501 A542 L543 F548 T550	L501-L546 HydrophobicContact CD1-CD2 4.23Å; L501-L546 HydrophobicContact CD2-CD2 3.26Å; L501-L546 HydrophobicContact CG-CD2 4.23Å; A542-L546 PolarHBondContact O-N 3.14Å; A542-L546 VanDerWaalsContact O-N 3.07Å; L543-L546 PolarHBondContact O-N 3.11Å; L546-F548 VanDerWaalsContact C-N 3.31Å; L546-F548 PolarHBondContact O-N 3.24Å; L546-T550 HydrophobicContact CD1-CG2 4.35Å; L546-T550 WeakPolarHBondContact O-CB 3.47Å; L546-T550 WeakPolarHBondContact O-CG2 3.26Å; L546-T550 PolarHBondContact O-N 2.77Å; L546-T550 PolarHBondContact O-OG1 3.27Å
547	L	80.8	Confident	72	Confident	8 Å²	8	88.2 Å²	88.2	4%	0.042	48%	0.478	C	S	.	.	H	α-helix	trans	-59.4	-39.9	175.1	-78.3	163.7	0	0	0	112.4	W521 V528 L535 L543 V544 R545 T550 M551	W521-L547 HydrophobicContact CD2-CD2 3.96Å; W521-L547 HydrophobicContact CG-CD2 4.41Å; W521-L547 HydrophobicContact CH2-CD2 4.1Å; W521-L547 HydrophobicContact CZ2-CD2 3.24Å; W521-L547 HydrophobicContact CZ2-CG 4.1Å; W521-L547 VanDerWaalsContact NE1-CD2 3.32Å; V528-L547 HydrophobicContact CG1-CD2 4.1Å; L535-L547 HydrophobicContact CD1-CD1 3.49Å; L535-L547 VanDerWaalsContact CD1-CD1 3.49Å; L543-L547 WeakPolarHBondContact O-CB 3.38Å; L543-L547 VanDerWaalsContact O-CG 3.25Å; L543-L547 WeakPolarHBondContact O-CG 3.48Å; L543-L547 PolarHBondContact O-N 3.32Å; V544-L547 WeakPolarHBondContact O-CB 3.47Å; V544-L547 PolarHBondContact O-N 2.99Å; R545-L547 VanDerWaalsContact C-N 3.28Å; R545-L547 PolarHBondContact O-N 3.17Å; L547-T550 PolarHBondContact O-OG1 3.33Å; L547-M551 VanDerWaalsContact O-CG 3.25Å; L547-M551 WeakPolarHBondContact O-CG 3.38Å; L547-M551 PolarHBondContact O-N 2.86Å
548	F	81.1	Confident	69.3	Low	98 Å²	98	88.2 Å²	88.2	43%	0.43	48%	0.478	S	S	.	.	H	α-helix	trans	-80.3	-41.3	-180	-75.1	-63	0	0	0	112.8	A532 V544 R545 L546 T550 M551 E552	A532-F548 HydrophobicContact CB-CZ 4.46Å; V544-F548 HydrophobicContact CG1-CD2 3.77Å; V544-F548 HydrophobicContact CG1-CE2 3.52Å; V544-F548 WeakPolarHBondContact O-CD2 3.22Å; V544-F548 PolarHBondContact O-N 3.23Å; V544-F548 VanDerWaalsContact O-N 3.14Å; R545-F548 PolarHBondContact O-N 3.35Å; R545-F548 VanDerWaalsContact O-N 3.08Å; L546-F548 VanDerWaalsContact C-N 3.31Å; L546-F548 PolarHBondContact O-N 3.24Å; F548-T550 PolarHBondContact O-N 3.47Å; F548-T550 VanDerWaalsContact O-N 3.16Å; F548-M551 PolarHBondContact O-N 3.23Å; F548-E552 PolarHBondContact O-N 3.35Å
549	E	82.3	Confident	66.7	Low	113 Å²	113	91 Å²	91	53%	0.528	51%	0.505	S	S	.	.	H	α-helix	trans	-56.9	-31.4	178.1	-77.3	172.1	-168.1	0	0	112.8	R545	R545-E549 WeakPolarHBondContact O-CB 3.44Å; R545-E549 WeakPolarHBondContact O-CG 3.36Å; R545-E549 PolarHBondContact O-N 2.86Å
550	T	77.1	Confident	63.9	Low	5 Å²	5	92.5 Å²	92.5	3%	0.031	51%	0.512	C	S	.	.	H	α-helix	trans	-87	-27.1	-180	54.1	0	0	0	0	112.4	R514 Q518 W521 L546 L547 F548 E552	R514-T550 HydrophobicContact CG-CG2 4.42Å; Q518-T550 WeakPolarHBondContact CG-O 3.49Å; Q518-T550 PolarHBondContact NE2-O 2.94Å; W521-T550 HydrophobicContact CE3-CG2 4.45Å; W521-T550 HydrophobicContact CH2-CG2 4.03Å; W521-T550 HydrophobicContact CZ3-CG2 3.45Å; W521-T550 VanDerWaalsContact CZ3-CG2 3.45Å; W521-T550 WeakPolarHBondContact CZ3-OG1 3.42Å; L546-T550 HydrophobicContact CD1-CG2 4.35Å; L546-T550 WeakPolarHBondContact O-CB 3.47Å; L546-T550 WeakPolarHBondContact O-CG2 3.26Å; L546-T550 PolarHBondContact O-N 2.77Å; L546-T550 PolarHBondContact O-OG1 3.27Å; L547-T550 PolarHBondContact O-OG1 3.33Å; F548-T550 PolarHBondContact O-N 3.47Å; F548-T550 VanDerWaalsContact O-N 3.16Å; T550-E552 VanDerWaalsContact C-N 3.35Å
551	M	71.1	Confident	61.3	Low	64 Å²	64	94.4 Å²	94.4	32%	0.315	53%	0.533	S	S	.	.	H	α-helix	trans	-73.4	-26.7	170.5	-74	-177.2	74.2	0	0	112.4	V528 L547 F548	V528-M551 HydrophobicContact CG1-SD 4.36Å; L547-M551 VanDerWaalsContact O-CG 3.25Å; L547-M551 WeakPolarHBondContact O-CG 3.38Å; L547-M551 PolarHBondContact O-N 2.86Å; F548-M551 PolarHBondContact O-N 3.23Å
552	E	68.2	Low	58.9	Low	135 Å²	135	102.1 Å²	102.1	63%	0.631	56%	0.555	S	S	*	*	S	Bend	trans	-59.6	134.4	174.3	-75.9	-179.1	177.1	0	0	111.4	F548 T550	F548-E552 PolarHBondContact O-N 3.35Å; T550-E552 VanDerWaalsContact C-N 3.35Å
553	R	54.9	Low	56.2	Low	219 Å²	219	105 Å²	105	83%	0.826	56%	0.56	S	S	*	*			trans	-69.6	134.6	171.8	-81.3	-178	164.4	-174.8	-5.2	108.3	G555	R553-G555 PolarHBondContact O-N 3.34Å
554	E	47.2	Very low	53.6	Low	174 Å²	174	115 Å²	115	81%	0.813	60%	0.596	S	S	*	*			trans	-57	113.1	152	-74.3	-173.4	170.4	0	0	107
555	G	37.3	Very low	50.8	Low	62 Å²	62	125.8 Å²	125.8	64%	0.639	64%	0.636	S	S	*	*			trans	-61.6	154.1	-179.9	0	0	0	0	0	111.7	R553 G557	R553-G555 PolarHBondContact O-N 3.34Å; G555-G557 PolarHBondContact O-N 3.3Å
556	E	35.1	Very low	47.9	Very low	210 Å²	210	122.5 Å²	122.5	98%	0.981	64%	0.644	S	S	*	*	S	Bend	trans	-62.7	47.4	174.7	-65	172.3	136.8	0	0	113.7
557	G	32.9	Very low	45.1	Very low	75 Å²	75	125.2 Å²	125.2	77%	0.773	66%	0.662	S	S	*	*			trans	-118.8	10.7	-166.5	0	0	0	0	0	116.5	G555	G555-G557 PolarHBondContact O-N 3.3Å
558	A	29.7	Very low	42.3	Very low	91 Å²	91	130.3 Å²	130.3	75%	0.752	70%	0.699	S	S	*	*			trans	-141	104.4	169.4	0	0	0	0	0	109.3	A560	A558-A560 PolarHBondContact O-N 2.86Å
559	S	30.7	Very low	39.7	Very low	123 Å²	123	135.6 Å²	135.6	86%	0.86	72%	0.722	S	S	*	*			trans	-58.3	99.2	165.2	53.7	0	0	0	0	108.8
560	A	27.6	Very low	37.5	Very low	85 Å²	85	136.7 Å²	136.7	70%	0.702	73%	0.731	S	S	*	*			trans	-62.4	133.4	164.7	0	0	0	0	0	108.4	A558 R562	A558-A560 PolarHBondContact O-N 2.86Å; A560-R562 PolarHBondContact O-N 3.27Å
561	P	29.7	Very low	35.4	Very low	106 Å²	106	143.6 Å²	143.6	69%	0.688	77%	0.768	S	S	*	*			trans	-62.3	130.8	166.7	24.3	-24.7	0	0	0	107.4	D563	P561-D563 VanDerWaalsContact C-N 3.29Å; P561-D563 PolarHBondContact O-N 2.82Å
562	R	34.4	Very low	33.5	Very low	255 Å²	255	148.1 Å²	148.1	96%	0.962	79%	0.793	S	S	*	*			trans	-57.6	96.1	167.1	-83.5	177.7	162.2	168.5	-4.5	107.8	A560	A560-R562 PolarHBondContact O-N 3.27Å
563	D	27.2	Very low	31.4	Very low	138 Å²	138	148.8 Å²	148.8	74%	0.738	80%	0.803	S	S	*	*			trans	-110.8	150	170	-104.4	-36.3	0	0	0	112.3	P561	P561-D563 VanDerWaalsContact C-N 3.29Å; P561-D563 PolarHBondContact O-N 2.82Å
564	R	25.8	Very low	30	Very low	229 Å²	229	144.4 Å²	144.4	86%	0.864	80%	0.802	S	S	*	*			trans	-67.5	149.1	-152.8	-72.8	159.2	165.2	178.7	-4.5	113	A566	R564-A566 PolarHBondContact O-N 3.39Å
565	R	27.4	Very low	28.8	Very low	240 Å²	240	142.5 Å²	142.5	91%	0.906	80%	0.801	S	S	*	*			trans	-31.1	104	159.9	-71.1	173.6	174.6	174.6	-3.3	111.3
566	A	22.7	Very low	28.2	Very low	99 Å²	99	148.2 Å²	148.2	82%	0.818	81%	0.812	S	S	*	*			trans	-85.8	102.7	154.2	0	0	0	0	0	106.3	R564 S568	R564-A566 PolarHBondContact O-N 3.39Å; A566-S568 PolarHBondContact O-N 3.49Å
567	V	23.9	Very low	27.7	Very low	100 Å²	100	143.5 Å²	143.5	61%	0.606	80%	0.799	S	S	*	*			trans	-70.6	105.8	161.5	-179.5	0	0	0	0	104.8	F569	V567-F569 HydrophobicContact CB-CE2 4.23Å; V567-F569 HydrophobicContact CG1-CD2 3.83Å; V567-F569 HydrophobicContact CG1-CE1 4.39Å; V567-F569 HydrophobicContact CG1-CE2 3.5Å; V567-F569 HydrophobicContact CG1-CG 4.41Å; V567-F569 HydrophobicContact CG1-CZ 3.82Å; V567-F569 PolarHBondContact O-N 3.18Å
568	S	21.4	Very low	27.2	Very low	115 Å²	115	149.2 Å²	149.2	80%	0.804	80%	0.802	S	S	*	*			trans	-80.1	112.5	165.3	70	0	0	0	0	107.4	A566	A566-S568 PolarHBondContact O-N 3.49Å
569	F	26.1	Very low	27	Very low	209 Å²	209	154.5 Å²	154.5	92%	0.917	81%	0.806	S	S	*	*			trans	-81	0	166.3	-77.4	-79.8	0	0	0	110.4	V567	V567-F569 HydrophobicContact CB-CE2 4.23Å; V567-F569 HydrophobicContact CG1-CD2 3.83Å; V567-F569 HydrophobicContact CG1-CE1 4.39Å; V567-F569 HydrophobicContact CG1-CE2 3.5Å; V567-F569 HydrophobicContact CG1-CG 4.41Å; V567-F569 HydrophobicContact CG1-CZ 3.82Å; V567-F569 PolarHBondContact O-N 3.18Å

Retrieved 569 of 569 residues in 353.1 ms (Link to these results)

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