A0A096NQD4_PAPAN Loading...

Cilia- and flagella-associated protein 206

Essential for sperm motility and is involved in the regulation of the beating frequency of motile cilia on the epithelial cells of the respiratory tract. Required for the establishment of radial spokes in sperm flagella.

AlphaFold DB (Q95JU3), UniProt , Accession A0A096NQD4, Species PAPAN (Papio anubis, Olive baboon), Gene CFAP206, Length 622 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.7	Very low	64.2	Low	234 Å²	234	108.4 Å²	108.4	100%	1.153	58%	0.584	S	S	*	*				0	140.7	0	-76	-170.2	167.5	0	0	108.2
2	P	43.2	Very low	66	Low	115 Å²	115	103.3 Å²	103.3	75%	0.747	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-59.3	141.2	165.7	25.9	-30.7	0	0	0	108.8	T4	P2-T4 PolarHBondContact O-N 3.23Å
3	P	45.1	Very low	67.6	Low	76 Å²	76	95.7 Å²	95.7	49%	0.494	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-56.7	137.8	179	22.8	-31.5	0	0	0	109.3	E7	P3-E7 WeakPolarHBondContact CA-OE2 3.39Å; P3-E7 HydrophobicContact CB-CB 4.12Å; P3-E7 WeakPolarHBondContact CB-OE2 3.49Å
4	T	61.7	Low	69.2	Low	79 Å²	79	90.4 Å²	90.4	49%	0.485	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-59.7	152.2	175.2	60.9	0	0	0	0	109.3	P2 A6 E7 S8	P2-T4 PolarHBondContact O-N 3.23Å; T4-A6 PolarHBondContact O-N 3.23Å; T4-E7 PolarHBondContact O-N 2.93Å; T4-E7 WeakPolarHBondContact OG1-CG 2.95Å; T4-E7 PolarHBondContact OG1-N 3.24Å; T4-S8 PolarHBondContact O-N 2.94Å
5	Q	63.1	Low	70.6	Confident	170 Å²	170	93.4 Å²	93.4	79%	0.794	49%	0.493	S	S	*	.	H	α-helix	trans	-54.7	-28.2	177.1	-171.5	176.6	3.6	0	0	112	S8 V9	Q5-S8 PolarHBondContact O-OG 3.34Å; Q5-S8 VanDerWaalsContact O-OG 3.06Å; Q5-V9 VanDerWaalsContact O-CG2 3.26Å; Q5-V9 WeakPolarHBondContact O-CG2 3.08Å; Q5-V9 PolarHBondContact O-N 2.87Å
6	A	67.6	Low	71.9	Confident	60 Å²	60	92.3 Å²	92.3	50%	0.496	49%	0.485	S	S	.	.	H	α-helix	trans	-68.8	-43.9	174.1	0	0	0	0	0	113	T4 S8 V9 I10	T4-A6 PolarHBondContact O-N 3.23Å; A6-S8 VanDerWaalsContact C-N 3.34Å; A6-S8 PolarHBondContact O-N 3.44Å; A6-V9 PolarHBondContact O-N 2.77Å; A6-I10 WeakPolarHBondContact O-CG1 3.47Å; A6-I10 PolarHBondContact O-N 3.38Å
7	E	70.3	Confident	73.1	Confident	91 Å²	91	86.9 Å²	86.9	43%	0.425	46%	0.456	S	S	.	.	H	α-helix	trans	-62.6	-39.1	178.7	-77.9	172.4	-161.8	0	0	112.7	P3 T4 I10 R11	P3-E7 WeakPolarHBondContact CA-OE2 3.39Å; P3-E7 HydrophobicContact CB-CB 4.12Å; P3-E7 WeakPolarHBondContact CB-OE2 3.49Å; T4-E7 PolarHBondContact O-N 2.93Å; T4-E7 WeakPolarHBondContact OG1-CG 2.95Å; T4-E7 PolarHBondContact OG1-N 3.24Å; E7-I10 PolarHBondContact O-N 3.46Å; E7-R11 WeakPolarHBondContact O-CG 3.32Å; E7-R11 PolarHBondContact O-N 3.18Å
8	S	76.2	Confident	74.1	Confident	62 Å²	62	83.2 Å²	83.2	43%	0.434	44%	0.443	S	S	.	.	H	α-helix	trans	-67.2	-38.1	178.7	72.1	0	0	0	0	111.9	T4 Q5 A6 S12	T4-S8 PolarHBondContact O-N 2.94Å; Q5-S8 PolarHBondContact O-OG 3.34Å; Q5-S8 VanDerWaalsContact O-OG 3.06Å; A6-S8 VanDerWaalsContact C-N 3.34Å; A6-S8 PolarHBondContact O-N 3.44Å; S8-S12 PolarHBondContact O-N 2.9Å
9	V	78.7	Confident	75.1	Confident	60 Å²	60	85.4 Å²	85.4	36%	0.364	45%	0.45	S	S	.	.	H	α-helix	trans	-64.2	-48.9	174.2	172.6	0	0	0	0	110.4	Q5 A6 R11 S12 I13	Q5-V9 VanDerWaalsContact O-CG2 3.26Å; Q5-V9 WeakPolarHBondContact O-CG2 3.08Å; Q5-V9 PolarHBondContact O-N 2.87Å; A6-V9 PolarHBondContact O-N 2.77Å; V9-R11 PolarHBondContact O-N 3.48Å; V9-S12 WeakPolarHBondContact O-CB 3.33Å; V9-S12 PolarHBondContact O-N 2.64Å; V9-S12 VanDerWaalsContact O-N 3.08Å; V9-I13 HydrophobicContact CG1-CD1 3.9Å; V9-I13 HydrophobicContact CG1-CG1 4.48Å; V9-I13 WeakPolarHBondContact O-CG1 3.37Å; V9-I13 PolarHBondContact O-N 3.33Å
10	I	79.7	Confident	75.9	Confident	79 Å²	79	85.6 Å²	85.6	41%	0.405	45%	0.448	S	S	.	.	H	α-helix	trans	-59.6	-44.7	179	-67.8	166.8	0	0	0	111.2	A6 E7 S12 I13 I14	A6-I10 WeakPolarHBondContact O-CG1 3.47Å; A6-I10 PolarHBondContact O-N 3.38Å; E7-I10 PolarHBondContact O-N 3.46Å; I10-S12 VanDerWaalsContact C-N 3.29Å; I10-S12 PolarHBondContact O-N 3.39Å; I10-I13 PolarHBondContact O-N 2.85Å; I10-I14 HydrophobicContact CG2-CD1 3.8Å; I10-I14 HydrophobicContact CG2-CG1 4.4Å; I10-I14 WeakPolarHBondContact O-CG1 2.82Å; I10-I14 PolarHBondContact O-N 3.49Å
11	R	84.4	Confident	76.7	Confident	166 Å²	166	81.5 Å²	81.5	63%	0.626	43%	0.427	S	S	*	.	H	α-helix	trans	-62	-36.3	175.6	-74.9	-176.4	-175.1	-174	2.4	112.7	E7 V9 R15	E7-R11 WeakPolarHBondContact O-CG 3.32Å; E7-R11 PolarHBondContact O-N 3.18Å; V9-R11 PolarHBondContact O-N 3.48Å; R11-R15 WeakPolarHBondContact O-CB 3.46Å; R11-R15 PolarHBondContact O-N 3.3Å; R11-R15 VanDerWaalsContact O-N 3.07Å
12	S	86.4	Confident	79.3	Confident	47 Å²	47	73 Å²	73	33%	0.329	39%	0.394	S	S	.	.	H	α-helix	trans	-64.8	-42.8	175	-165.4	0	0	0	0	111.5	S8 V9 I10 R15 E16	S8-S12 PolarHBondContact O-N 2.9Å; V9-S12 WeakPolarHBondContact O-CB 3.33Å; V9-S12 PolarHBondContact O-N 2.64Å; V9-S12 VanDerWaalsContact O-N 3.08Å; I10-S12 VanDerWaalsContact C-N 3.29Å; I10-S12 PolarHBondContact O-N 3.39Å; S12-R15 PolarHBondContact O-N 3.42Å; S12-R15 PolarHBondContact OG-NH2 3.44Å; S12-E16 WeakPolarHBondContact O-CB 3.48Å; S12-E16 PolarHBondContact O-N 3.43Å
13	I	86.9	Confident	81.6	Confident	5 Å²	5	71.4 Å²	71.4	3%	0.026	39%	0.39	C	S	.	.	H	α-helix	trans	-63.1	-45.9	177.5	-64.8	169.6	0	0	0	110.7	V9 I10 R15 E16 I17 V37 V59 L62 V63	V9-I13 HydrophobicContact CG1-CD1 3.9Å; V9-I13 HydrophobicContact CG1-CG1 4.48Å; V9-I13 WeakPolarHBondContact O-CG1 3.37Å; V9-I13 PolarHBondContact O-N 3.33Å; I10-I13 PolarHBondContact O-N 2.85Å; I13-R15 VanDerWaalsContact C-N 3.32Å; I13-R15 PolarHBondContact O-N 2.95Å; I13-E16 PolarHBondContact O-N 2.9Å; I13-I17 HydrophobicContact CG2-CD1 3.73Å; I13-I17 HydrophobicContact CG2-CG1 4.42Å; I13-I17 WeakPolarHBondContact O-CG1 3.46Å; I13-I17 PolarHBondContact O-N 3.3Å; I13-V37 HydrophobicContact CG2-CG2 4.37Å; I13-V59 HydrophobicContact CD1-CG1 3.98Å; I13-V59 HydrophobicContact CD1-CG2 4.07Å; I13-V59 HydrophobicContact CG1-CG1 3.78Å; I13-L62 HydrophobicContact CD1-CD2 4.29Å; I13-L62 HydrophobicContact CG2-CD2 4.32Å; I13-V63 HydrophobicContact CG2-CG2 4.18Å
14	I	89.4	Confident	83.7	Confident	21 Å²	21	73.5 Å²	73.5	11%	0.108	39%	0.393	C	S	.	.	H	α-helix	trans	-58.5	-45.6	177.5	-69.3	165.8	0	0	0	110.8	I10 I17 G18 E30 I33 A34	I10-I14 HydrophobicContact CG2-CD1 3.8Å; I10-I14 HydrophobicContact CG2-CG1 4.4Å; I10-I14 WeakPolarHBondContact O-CG1 2.82Å; I10-I14 PolarHBondContact O-N 3.49Å; I14-I17 PolarHBondContact O-N 2.93Å; I14-G18 PolarHBondContact O-N 3.25Å; I14-E30 HydrophobicContact CG2-CB 4.16Å; I14-E30 HydrophobicContact CG2-CG 4.25Å; I14-I33 HydrophobicContact CB-CG2 4.16Å; I14-I33 HydrophobicContact CG1-CG2 4.14Å; I14-I33 HydrophobicContact CG2-CB 4.14Å; I14-I33 HydrophobicContact CG2-CG2 3.91Å; I14-A34 HydrophobicContact CD1-CB 3.84Å
15	R	90.4	Very high	85	Confident	136 Å²	136	72.7 Å²	72.7	51%	0.513	40%	0.401	S	S	.	.	H	α-helix	trans	-64.6	-41.4	178.7	-174.6	178.6	62.5	-116.3	-6.9	112.2	R11 S12 I13 G18 Q19	R11-R15 WeakPolarHBondContact O-CB 3.46Å; R11-R15 PolarHBondContact O-N 3.3Å; R11-R15 VanDerWaalsContact O-N 3.07Å; S12-R15 PolarHBondContact O-N 3.42Å; S12-R15 PolarHBondContact OG-NH2 3.44Å; I13-R15 VanDerWaalsContact C-N 3.32Å; I13-R15 PolarHBondContact O-N 2.95Å; R15-G18 PolarHBondContact O-N 3.41Å; R15-Q19 WeakPolarHBondContact O-CG 3.44Å; R15-Q19 PolarHBondContact O-N 3.46Å
16	E	91.8	Very high	86.2	Confident	76 Å²	76	68.3 Å²	68.3	36%	0.355	38%	0.38	S	S	.	.	H	α-helix	trans	-62.1	-48.5	177.1	-174.3	174.2	172	0	0	111.1	S12 I13 G18 Q19 E20	S12-E16 WeakPolarHBondContact O-CB 3.48Å; S12-E16 PolarHBondContact O-N 3.43Å; I13-E16 PolarHBondContact O-N 2.9Å; E16-G18 VanDerWaalsContact C-N 3.3Å; E16-G18 PolarHBondContact O-N 2.77Å; E16-Q19 PolarHBondContact O-N 3.49Å; E16-E20 WeakPolarHBondContact O-CG 3.49Å; E16-E20 PolarHBondContact O-N 3.19Å
17	I	92.3	Very high	87.1	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-59.5	-42	175.7	-65.3	164.9	0	0	0	111.1	I13 I14 E20 C21 I33 V37 V63 C66 M67 L70	I13-I17 HydrophobicContact CG2-CD1 3.73Å; I13-I17 HydrophobicContact CG2-CG1 4.42Å; I13-I17 WeakPolarHBondContact O-CG1 3.46Å; I13-I17 PolarHBondContact O-N 3.3Å; I14-I17 PolarHBondContact O-N 2.93Å; I17-E20 PolarHBondContact O-N 3.48Å; I17-C21 WeakPolarHBondContact O-CB 3.49Å; I17-C21 PolarHBondContact O-N 3Å; I17-C21 PolarHBondContact O-SG 3.21Å; I17-I33 HydrophobicContact CB-CG2 3.82Å; I17-I33 HydrophobicContact CD1-CG2 3.97Å; I17-I33 HydrophobicContact CG2-CD1 4.42Å; I17-I33 HydrophobicContact CG2-CG1 4.25Å; I17-I33 HydrophobicContact CG2-CG2 3.73Å; I17-V37 HydrophobicContact CD1-CG2 3.63Å; I17-V63 HydrophobicContact CD1-CG2 4.48Å; I17-V63 HydrophobicContact CG1-CB 4.31Å; I17-V63 HydrophobicContact CG1-CG1 4.07Å; I17-V63 HydrophobicContact CG1-CG2 4.03Å; I17-C66 HydrophobicContact CD1-CB 3.78Å; I17-C66 HydrophobicContact CG1-CB 4.43Å; I17-M67 HydrophobicContact CG2-SD 4Å; I17-L70 HydrophobicContact CG2-CD1 3.62Å
18	G	91.6	Very high	88	Confident	21 Å²	21	70.2 Å²	70.2	22%	0.216	39%	0.385	C	S	.	.	H	α-helix	trans	-63.7	-40.5	178.5	0	0	0	0	0	113.2	I14 R15 E16 A22	I14-G18 PolarHBondContact O-N 3.25Å; R15-G18 PolarHBondContact O-N 3.41Å; E16-G18 VanDerWaalsContact C-N 3.3Å; E16-G18 PolarHBondContact O-N 2.77Å; G18-A22 WeakPolarHBondContact O-CB 3.37Å; G18-A22 PolarHBondContact O-N 3.3Å
19	Q	92.7	Very high	88.7	Confident	125 Å²	125	70 Å²	70	58%	0.584	38%	0.383	S	S	*	.	H	α-helix	trans	-66	-42.8	175.5	-73.5	176	-17.4	0	0	111.9	R15 E16 A22 A23	R15-Q19 WeakPolarHBondContact O-CG 3.44Å; R15-Q19 PolarHBondContact O-N 3.46Å; E16-Q19 PolarHBondContact O-N 3.49Å; Q19-A22 PolarHBondContact O-N 2.99Å; Q19-A23 PolarHBondContact O-N 3.35Å
20	E	91.6	Very high	89.2	Confident	89 Å²	89	74.1 Å²	74.1	42%	0.416	40%	0.398	S	S	.	.	H	α-helix	trans	-66.2	-41.4	177.1	-71.8	-66.8	157.6	0	0	111.9	E16 I17 A22 A23 H24 M67	E16-E20 WeakPolarHBondContact O-CG 3.49Å; E16-E20 PolarHBondContact O-N 3.19Å; I17-E20 PolarHBondContact O-N 3.48Å; E20-A22 PolarHBondContact O-N 2.95Å; E20-A23 WeakPolarHBondContact O-CB 3.35Å; E20-A23 PolarHBondContact O-N 3.29Å; E20-H24 PolarHBondContact O-N 3.22Å; E20-H24 PolarHBondContact O-ND1 3.03Å; E20-M67 HydrophobicContact CB-CE 3.66Å; E20-M67 HydrophobicContact CB-CG 4.38Å; E20-M67 HydrophobicContact CB-SD 3.55Å; E20-M67 VanDerWaalsContact CB-SD 3.55Å
21	C	91.2	Very high	89.5	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-60.3	-46.1	173.6	-70.9	0	0	0	0	111.3	I17 A23 H24 G25 E26 V28 M67	I17-C21 WeakPolarHBondContact O-CB 3.49Å; I17-C21 PolarHBondContact O-N 3Å; I17-C21 PolarHBondContact O-SG 3.21Å; C21-A23 VanDerWaalsContact C-N 3.28Å; C21-A23 PolarHBondContact O-N 3.29Å; C21-H24 CarbonylContact O-C 3.12Å; C21-H24 WeakPolarHBondContact O-CA 3.14Å; C21-H24 PolarHBondContact O-N 3.31Å; C21-G25 PolarHBondContact O-N 3.3Å; C21-E26 CarbonylContact C-O 3.53Å; C21-E26 WeakPolarHBondContact CB-O 3.22Å; C21-E26 PolarHBondContact O-N 3.24Å; C21-V28 HydrophobicContact CB-CG2 4.01Å; C21-M67 HydrophobicContact CB-SD 4.49Å; C21-M67 PolarHBondContact SG-SD 3.44Å
22	A	91.2	Very high	89.8	Confident	55 Å²	55	66.1 Å²	66.1	46%	0.455	37%	0.371	S	S	.	.	H	α-helix	trans	-62.8	-35.6	178.6	0	0	0	0	0	112.2	G18 Q19 E20 H24 G25 E26	G18-A22 WeakPolarHBondContact O-CB 3.37Å; G18-A22 PolarHBondContact O-N 3.3Å; Q19-A22 PolarHBondContact O-N 2.99Å; E20-A22 PolarHBondContact O-N 2.95Å; A22-H24 PolarHBondContact O-N 3.43Å; A22-G25 PolarHBondContact O-N 3.23Å; A22-E26 WeakPolarHBondContact CA-O 3.3Å; A22-E26 PolarHBondContact N-O 2.73Å
23	A	91.1	Very high	90	Very high	81 Å²	81	64 Å²	64	67%	0.669	36%	0.356	S	S	*	.	H	α-helix	trans	-63.4	-25.8	173.8	0	0	0	0	0	113	Q19 E20 C21	Q19-A23 PolarHBondContact O-N 3.35Å; E20-A23 WeakPolarHBondContact O-CB 3.35Å; E20-A23 PolarHBondContact O-N 3.29Å; C21-A23 VanDerWaalsContact C-N 3.28Å; C21-A23 PolarHBondContact O-N 3.29Å
24	H	90.1	Very high	90.1	Very high	120 Å²	120	65.2 Å²	65.2	56%	0.556	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	4.3	173.9	-66.6	77.3	0	0	0	113.2	E20 C21 A22 L71	E20-H24 PolarHBondContact O-N 3.22Å; E20-H24 PolarHBondContact O-ND1 3.03Å; C21-H24 CarbonylContact O-C 3.12Å; C21-H24 WeakPolarHBondContact O-CA 3.14Å; C21-H24 PolarHBondContact O-N 3.31Å; A22-H24 PolarHBondContact O-N 3.43Å; H24-L71 HydrophobicContact CB-CD1 4.13Å; H24-L71 HydrophobicContact CB-CD2 3.88Å
25	G	88.2	Confident	90	Very high	63 Å²	63	65.7 Å²	65.7	65%	0.649	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.4	4.8	177.4	0	0	0	0	0	115.4	C21 A22	C21-G25 PolarHBondContact O-N 3.3Å; A22-G25 PolarHBondContact O-N 3.23Å
26	E	87.7	Confident	90	Very high	78 Å²	78	59.3 Å²	59.3	36%	0.364	34%	0.344	S	S	.	.			trans	-106.9	119.5	-178.6	-70.6	-66.6	164.4	0	0	110.9	C21 A22 L71	C21-E26 CarbonylContact C-O 3.53Å; C21-E26 WeakPolarHBondContact CB-O 3.22Å; C21-E26 PolarHBondContact O-N 3.24Å; A22-E26 WeakPolarHBondContact CA-O 3.3Å; A22-E26 PolarHBondContact N-O 2.73Å; E26-L71 HydrophobicContact CB-CD2 4.21Å; E26-L71 HydrophobicContact CG-CD2 4.03Å
27	I	88	Confident	89.9	Confident	163 Å²	163	56.4 Å²	56.4	84%	0.836	33%	0.332	S	S	*	.			trans	-93.1	111.7	176.6	-59.8	174.3	0	0	0	108.6
28	V	89.1	Confident	89.5	Confident	28 Å²	28	60.5 Å²	60.5	17%	0.17	35%	0.349	C	S	.	.			trans	-112.6	136.9	-177.3	-171.1	0	0	0	0	110.8	C21 L32 I33 L70	C21-V28 HydrophobicContact CB-CG2 4.01Å; V28-L32 HydrophobicContact CG1-CB 3.91Å; V28-L32 HydrophobicContact CG1-CD2 3.7Å; V28-L32 HydrophobicContact CG1-CG 3.98Å; V28-I33 HydrophobicContact CB-CD1 4.22Å; V28-I33 HydrophobicContact CB-CG1 4.13Å; V28-I33 HydrophobicContact CG1-CD1 4.29Å; V28-I33 HydrophobicContact CG1-CG1 3.69Å; V28-L70 HydrophobicContact CG1-CD2 4.2Å
29	S	89.8	Confident	89.4	Confident	56 Å²	56	59.5 Å²	59.5	39%	0.392	34%	0.339	S	S	.	.			trans	-69.4	146.5	176.9	67.7	0	0	0	0	111.9	T31 L32 I33	S29-T31 PolarHBondContact O-N 3.41Å; S29-L32 PolarHBondContact O-N 3.4Å; S29-L32 VanDerWaalsContact O-N 3.09Å; S29-L32 WeakPolarHBondContact OG-CB 3.48Å; S29-L32 PolarHBondContact OG-N 3.23Å; S29-I33 WeakPolarHBondContact O-CG1 3.45Å; S29-I33 PolarHBondContact O-N 3.02Å; S29-I33 VanDerWaalsContact O-N 3.09Å
30	E	89.7	Confident	89.2	Confident	147 Å²	147	53.6 Å²	53.6	69%	0.687	31%	0.311	S	S	*	.	H	α-helix	trans	-56.9	-34.7	177.3	-68	-170.2	167.9	0	0	112.2	I14 I33 A34	I14-E30 HydrophobicContact CG2-CB 4.16Å; I14-E30 HydrophobicContact CG2-CG 4.25Å; E30-I33 PolarHBondContact O-N 3.39Å; E30-A34 WeakPolarHBondContact O-CB 3.3Å; E30-A34 PolarHBondContact O-N 2.96Å
31	T	86.5	Confident	89	Confident	66 Å²	66	51.2 Å²	51.2	41%	0.405	30%	0.303	S	S	.	.	H	α-helix	trans	-63.5	-44.8	176.5	-45.3	0	0	0	0	112.2	S29 I33 A34 F35 V85 M89	S29-T31 PolarHBondContact O-N 3.41Å; T31-I33 VanDerWaalsContact C-N 3.35Å; T31-A34 PolarHBondContact O-N 2.97Å; T31-F35 PolarHBondContact O-N 3.3Å; T31-V85 HydrophobicContact CG2-CG1 3.9Å; T31-M89 HydrophobicContact CG2-CG 4.2Å; T31-M89 HydrophobicContact CG2-SD 3.7Å
32	L	90.3	Very high	88.7	Confident	11 Å²	11	52.1 Å²	52.1	6%	0.058	31%	0.308	C	S	.	.	H	α-helix	trans	-66.6	-40	178.8	-178.9	60.7	0	0	0	111	V28 S29 F35 M36 L70 I81 K82 V85	V28-L32 HydrophobicContact CG1-CB 3.91Å; V28-L32 HydrophobicContact CG1-CD2 3.7Å; V28-L32 HydrophobicContact CG1-CG 3.98Å; S29-L32 PolarHBondContact O-N 3.4Å; S29-L32 VanDerWaalsContact O-N 3.09Å; S29-L32 WeakPolarHBondContact OG-CB 3.48Å; S29-L32 PolarHBondContact OG-N 3.23Å; L32-F35 PolarHBondContact O-N 2.91Å; L32-M36 WeakPolarHBondContact O-CB 3.3Å; L32-M36 PolarHBondContact O-N 3.44Å; L32-L70 HydrophobicContact CD2-CD2 4.25Å; L32-L70 HydrophobicContact CG-CD2 4.2Å; L32-I81 HydrophobicContact CD1-CG2 3.68Å; L32-K82 HydrophobicContact CD1-CG 4.35Å; L32-K82 HydrophobicContact CD2-CD 4.45Å; L32-K82 HydrophobicContact CD2-CG 3.61Å; L32-V85 HydrophobicContact CD1-CB 4.42Å; L32-V85 HydrophobicContact CD1-CG2 4.03Å
33	I	91.6	Very high	88.6	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-62.7	-45.8	175.3	-62.4	167.6	0	0	0	110.3	I14 I17 V28 S29 E30 T31 F35 M36 V37 L70	I14-I33 HydrophobicContact CB-CG2 4.16Å; I14-I33 HydrophobicContact CG1-CG2 4.14Å; I14-I33 HydrophobicContact CG2-CB 4.14Å; I14-I33 HydrophobicContact CG2-CG2 3.91Å; I17-I33 HydrophobicContact CB-CG2 3.82Å; I17-I33 HydrophobicContact CD1-CG2 3.97Å; I17-I33 HydrophobicContact CG2-CD1 4.42Å; I17-I33 HydrophobicContact CG2-CG1 4.25Å; I17-I33 HydrophobicContact CG2-CG2 3.73Å; V28-I33 HydrophobicContact CB-CD1 4.22Å; V28-I33 HydrophobicContact CB-CG1 4.13Å; V28-I33 HydrophobicContact CG1-CD1 4.29Å; V28-I33 HydrophobicContact CG1-CG1 3.69Å; S29-I33 WeakPolarHBondContact O-CG1 3.45Å; S29-I33 PolarHBondContact O-N 3.02Å; S29-I33 VanDerWaalsContact O-N 3.09Å; E30-I33 PolarHBondContact O-N 3.39Å; T31-I33 VanDerWaalsContact C-N 3.35Å; I33-F35 VanDerWaalsContact C-N 3.31Å; I33-F35 PolarHBondContact O-N 3.48Å; I33-M36 PolarHBondContact O-N 3.29Å; I33-V37 HydrophobicContact CG2-CG2 4.41Å; I33-V37 WeakPolarHBondContact O-CG2 3.47Å; I33-V37 PolarHBondContact O-N 2.99Å; I33-L70 HydrophobicContact CG1-CD1 4.24Å
34	A	87	Confident	88.3	Confident	31 Å²	31	49.2 Å²	49.2	26%	0.256	28%	0.277	S	S	.	.	H	α-helix	trans	-60.1	-41.9	177.6	0	0	0	0	0	111.8	I14 E30 T31 K38	I14-A34 HydrophobicContact CD1-CB 3.84Å; E30-A34 WeakPolarHBondContact O-CB 3.3Å; E30-A34 PolarHBondContact O-N 2.96Å; T31-A34 PolarHBondContact O-N 2.97Å; A34-K38 WeakPolarHBondContact O-CG 3.49Å; A34-K38 PolarHBondContact O-N 3.23Å
35	F	87.5	Confident	88.2	Confident	31 Å²	31	47.7 Å²	47.7	14%	0.136	28%	0.28	C	S	.	.	H	α-helix	trans	-62.3	-46.8	173.5	-175.2	-82.8	0	0	0	111.4	T31 L32 I33 V37 K38 A39 I81 V85 L493	T31-F35 PolarHBondContact O-N 3.3Å; L32-F35 PolarHBondContact O-N 2.91Å; I33-F35 VanDerWaalsContact C-N 3.31Å; I33-F35 PolarHBondContact O-N 3.48Å; F35-V37 VanDerWaalsContact C-N 3.34Å; F35-V37 PolarHBondContact O-N 3.46Å; F35-K38 WeakPolarHBondContact O-CB 3.47Å; F35-K38 PolarHBondContact O-N 3.1Å; F35-K38 VanDerWaalsContact O-N 3.13Å; F35-A39 HydrophobicContact CE1-CB 4.31Å; F35-A39 PolarHBondContact O-N 2.88Å; F35-I81 HydrophobicContact CD1-CG2 3.35Å; F35-I81 HydrophobicContact CE1-CB 4.27Å; F35-I81 HydrophobicContact CE1-CD1 4.1Å; F35-I81 HydrophobicContact CE1-CG1 3.91Å; F35-I81 HydrophobicContact CE1-CG2 3.39Å; F35-I81 HydrophobicContact CG-CG2 4.3Å; F35-I81 HydrophobicContact CZ-CG2 4.33Å; F35-V85 HydrophobicContact CB-CG2 4.07Å; F35-V85 HydrophobicContact CD2-CG2 4.19Å; F35-V85 HydrophobicContact CG-CG2 4.01Å; F35-L493 HydrophobicContact CE2-CD2 4.36Å
36	M	91.6	Very high	88.2	Confident	3 Å²	3	46.2 Å²	46.2	2%	0.015	26%	0.257	C	S	.	.	H	α-helix	trans	-61.2	-41.7	180	-174.4	58.4	64.4	0	0	112.2	L32 I33 K38 A39 V40 C66 R69 L70 L78 I81	L32-M36 WeakPolarHBondContact O-CB 3.3Å; L32-M36 PolarHBondContact O-N 3.44Å; I33-M36 PolarHBondContact O-N 3.29Å; M36-K38 VanDerWaalsContact C-N 3.32Å; M36-K38 PolarHBondContact O-N 3.36Å; M36-A39 PolarHBondContact O-N 3.47Å; M36-V40 HydrophobicContact CG-CG2 4.39Å; M36-V40 WeakPolarHBondContact O-CG2 3.41Å; M36-V40 PolarHBondContact O-N 2.99Å; M36-V40 HydrophobicContact SD-CG2 4.18Å; M36-C66 HydrophobicContact CG-CB 4.1Å; M36-R69 HydrophobicContact CE-CB 3.98Å; M36-R69 HydrophobicContact SD-CB 3.63Å; M36-R69 HydrophobicContact SD-CG 4.27Å; M36-L70 HydrophobicContact CB-CD2 4.22Å; M36-L70 HydrophobicContact CB-CG 4.42Å; M36-L70 HydrophobicContact CE-CD2 4.04Å; M36-L70 HydrophobicContact CE-CG 4.46Å; M36-L70 HydrophobicContact CG-CD1 4.38Å; M36-L70 HydrophobicContact CG-CD2 4.21Å; M36-L70 HydrophobicContact CG-CG 4.01Å; M36-L78 HydrophobicContact CE-CD1 3.81Å; M36-I81 HydrophobicContact CE-CD1 4.38Å
37	V	88.9	Confident	87.9	Confident	15 Å²	15	45.3 Å²	45.3	9%	0.091	27%	0.268	C	S	.	.	H	α-helix	trans	-57.4	-47.3	174.4	167.1	0	0	0	0	110.5	I13 I17 I33 F35 A39 V40 V41 L62	I13-V37 HydrophobicContact CG2-CG2 4.37Å; I17-V37 HydrophobicContact CD1-CG2 3.63Å; I33-V37 HydrophobicContact CG2-CG2 4.41Å; I33-V37 WeakPolarHBondContact O-CG2 3.47Å; I33-V37 PolarHBondContact O-N 2.99Å; F35-V37 VanDerWaalsContact C-N 3.34Å; F35-V37 PolarHBondContact O-N 3.46Å; V37-A39 VanDerWaalsContact C-N 3.34Å; V37-A39 PolarHBondContact O-N 3.22Å; V37-V40 PolarHBondContact O-N 2.94Å; V37-V41 VanDerWaalsContact O-CG2 3.28Å; V37-V41 WeakPolarHBondContact O-CG2 3.36Å; V37-V41 PolarHBondContact O-N 3.32Å; V37-L62 HydrophobicContact CG1-CD1 4.49Å; V37-L62 HydrophobicContact CG1-CD2 4.13Å
38	K	84.7	Confident	87.6	Confident	86 Å²	86	39 Å²	39	37%	0.374	24%	0.235	S	C	.	.	H	α-helix	trans	-62.5	-41.6	176.5	-66.8	-179.9	-178.4	-170.3	0	111.8	A34 F35 M36 V41 L42 T492 L493	A34-K38 WeakPolarHBondContact O-CG 3.49Å; A34-K38 PolarHBondContact O-N 3.23Å; F35-K38 WeakPolarHBondContact O-CB 3.47Å; F35-K38 PolarHBondContact O-N 3.1Å; F35-K38 VanDerWaalsContact O-N 3.13Å; M36-K38 VanDerWaalsContact C-N 3.32Å; M36-K38 PolarHBondContact O-N 3.36Å; K38-V41 PolarHBondContact O-N 3.41Å; K38-L42 VanDerWaalsContact O-CB 3.31Å; K38-L42 WeakPolarHBondContact O-CB 3.3Å; K38-L42 PolarHBondContact O-N 2.99Å; K38-T492 WeakPolarHBondContact CD-O 3.39Å; K38-T492 WeakPolarHBondContact CE-O 3.4Å; K38-T492 PolarHBondContact NZ-O 3.44Å; K38-L493 HydrophobicContact CB-CD2 3.49Å; K38-L493 VanDerWaalsContact CB-CD2 3.49Å; K38-L493 HydrophobicContact CD-CD2 3.84Å; K38-L493 HydrophobicContact CG-CD2 4.34Å
39	A	88.1	Confident	86.6	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63.5	-42.4	179.6	0	0	0	0	0	112.8	F35 M36 V37 L42 D43 T478	F35-A39 HydrophobicContact CE1-CB 4.31Å; F35-A39 PolarHBondContact O-N 2.88Å; M36-A39 PolarHBondContact O-N 3.47Å; V37-A39 VanDerWaalsContact C-N 3.34Å; V37-A39 PolarHBondContact O-N 3.22Å; A39-L42 PolarHBondContact O-N 3.43Å; A39-D43 PolarHBondContact O-N 3.1Å; A39-T478 HydrophobicContact CB-CG2 3.58Å; A39-T478 WeakPolarHBondContact CB-OG1 3.43Å
40	V	90.3	Very high	85.4	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-66.8	-39.5	176.7	170	0	0	0	0	111.4	M36 V37 L42 N46 F48 L62 L65	M36-V40 HydrophobicContact CG-CG2 4.39Å; M36-V40 WeakPolarHBondContact O-CG2 3.41Å; M36-V40 PolarHBondContact O-N 2.99Å; M36-V40 HydrophobicContact SD-CG2 4.18Å; V37-V40 PolarHBondContact O-N 2.94Å; V40-L42 VanDerWaalsContact C-N 3.35Å; V40-N46 PolarHBondContact O-ND2 3.33Å; V40-F48 HydrophobicContact CG1-CD2 4.49Å; V40-F48 HydrophobicContact CG1-CE2 3.88Å; V40-L62 HydrophobicContact CB-CD1 4.06Å; V40-L62 HydrophobicContact CG1-CD1 3.61Å; V40-L65 HydrophobicContact CG1-CB 3.69Å; V40-L65 HydrophobicContact CG1-CD1 3.93Å; V40-L65 HydrophobicContact CG1-CG 4.47Å; V40-L65 HydrophobicContact CG2-CB 4.44Å
41	V	86.4	Confident	84.2	Confident	39 Å²	39	46.8 Å²	46.8	24%	0.236	27%	0.274	C	S	.	.	H	α-helix	trans	-68.5	-34.5	177	170.8	0	0	0	0	111.9	V37 K38 F48 M50 L62	V37-V41 VanDerWaalsContact O-CG2 3.28Å; V37-V41 WeakPolarHBondContact O-CG2 3.36Å; V37-V41 PolarHBondContact O-N 3.32Å; K38-V41 PolarHBondContact O-N 3.41Å; V41-F48 HydrophobicContact CG1-CB 4.29Å; V41-M50 HydrophobicContact CG1-CG 4.37Å; V41-L62 HydrophobicContact CG2-CD1 3.87Å; V41-L62 HydrophobicContact CG2-CD2 4.44Å
42	L	85.4	Confident	83.3	Confident	19 Å²	19	52.6 Å²	52.6	10%	0.099	29%	0.288	C	S	.	.	H	α-helix	trans	-73.2	-30.2	-177.9	-174.7	62.6	0	0	0	113.1	K38 A39 V40 P44 K475 T478 I481 F490 L493	K38-L42 VanDerWaalsContact O-CB 3.31Å; K38-L42 WeakPolarHBondContact O-CB 3.3Å; K38-L42 PolarHBondContact O-N 2.99Å; A39-L42 PolarHBondContact O-N 3.43Å; V40-L42 VanDerWaalsContact C-N 3.35Å; L42-P44 VanDerWaalsContact O-CD 3.23Å; L42-P44 WeakPolarHBondContact O-CD 3.41Å; L42-K475 HydrophobicContact CD1-CD 4.4Å; L42-K475 HydrophobicContact CD1-CG 3.98Å; L42-K475 HydrophobicContact CD2-CG 4.27Å; L42-K475 HydrophobicContact CG-CB 4.04Å; L42-K475 HydrophobicContact CG-CG 3.87Å; L42-T478 HydrophobicContact CD2-CG2 4.26Å; L42-I481 HydrophobicContact CD2-CD1 3.59Å; L42-F490 HydrophobicContact CD1-CD1 4.06Å; L42-F490 HydrophobicContact CD1-CE1 4.15Å; L42-F490 HydrophobicContact CD2-CD1 3.87Å; L42-F490 HydrophobicContact CD2-CE1 4.02Å; L42-L493 HydrophobicContact CD2-CD1 3.53Å
43	D	88.5	Confident	82.3	Confident	4 Å²	4	58.1 Å²	58.1	2%	0.021	32%	0.323	C	S	.	.			trans	-67.4	113.3	-179.6	-176.7	-14.1	0	0	0	111.2	A39 S45 N46 R69	A39-D43 PolarHBondContact O-N 3.1Å; D43-S45 PolarHBondContact O-N 2.64Å; D43-S45 VanDerWaalsContact O-N 3.08Å; D43-S45 WeakPolarHBondContact OD1-CB 3.45Å; D43-S45 PolarHBondContact OD1-N 3.3Å; D43-S45 PolarHBondContact OD1-OG 3.09Å; D43-S45 PolarHBondContact OD2-OG 3.22Å; D43-N46 PolarHBondContact O-N 2.75Å; D43-N46 VanDerWaalsContact O-N 3.1Å; D43-R69 IonicContact OD2-CZ 2.79Å; D43-R69 IonicContact OD2-NH2 2.63Å; D43-R69 PolarHBondContact OD2-NH2 3.05Å
44	P	85.4	Confident	81.4	Confident	71 Å²	71	62 Å²	62	46%	0.461	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-61.1	-23.7	-176.5	-22	33.3	0	0	0	113.5	L42 N46 G47 E472 K475	L42-P44 VanDerWaalsContact O-CD 3.23Å; L42-P44 WeakPolarHBondContact O-CD 3.41Å; P44-N46 PolarHBondContact O-N 2.92Å; P44-G47 PolarHBondContact O-N 3.02Å; P44-E472 WeakPolarHBondContact CG-OE2 3.24Å; P44-K475 HydrophobicContact CG-CB 4.38Å; P44-K475 HydrophobicContact CG-CD 4.08Å
45	S	87.4	Confident	81	Confident	89 Å²	89	66.6 Å²	66.6	62%	0.622	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-68.7	-20.9	-179.8	69	0	0	0	0	113.2	D43 G47	D43-S45 PolarHBondContact O-N 2.64Å; D43-S45 VanDerWaalsContact O-N 3.08Å; D43-S45 WeakPolarHBondContact OD1-CB 3.45Å; D43-S45 PolarHBondContact OD1-N 3.3Å; D43-S45 PolarHBondContact OD1-OG 3.09Å; D43-S45 PolarHBondContact OD2-OG 3.22Å; S45-G47 VanDerWaalsContact C-N 3.34Å
46	N	87.3	Confident	80.7	Confident	32 Å²	32	73.4 Å²	73.4	17%	0.171	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-83.1	-11.3	177.8	-64.9	-36	0	0	0	113.1	V40 D43 P44 F48 L65	V40-N46 PolarHBondContact O-ND2 3.33Å; D43-N46 PolarHBondContact O-N 2.75Å; D43-N46 VanDerWaalsContact O-N 3.1Å; P44-N46 PolarHBondContact O-N 2.92Å; N46-F48 VanDerWaalsContact C-N 3.33Å; N46-F48 HydrophobicContact CB-CD2 3.64Å; N46-F48 HydrophobicContact CB-CE2 3.75Å; N46-F48 PolarHBondContact O-N 3.38Å; N46-L65 HydrophobicContact CB-CD1 4.05Å
47	G	82.2	Confident	80.3	Confident	58 Å²	58	76.4 Å²	76.4	60%	0.598	41%	0.411	S	S	*	.			trans	73.3	14.8	172.8	0	0	0	0	0	115.9	P44 S45	P44-G47 PolarHBondContact O-N 3.02Å; S45-G47 VanDerWaalsContact C-N 3.34Å
48	F	81.1	Confident	80.1	Confident	30 Å²	30	78.4 Å²	78.4	13%	0.132	42%	0.421	C	S	.	.			trans	-75.7	127.5	173.7	-64.5	-73.3	0	0	0	110.5	V40 V41 N46 L54 D58 L62 L65	V40-F48 HydrophobicContact CG1-CD2 4.49Å; V40-F48 HydrophobicContact CG1-CE2 3.88Å; V41-F48 HydrophobicContact CG1-CB 4.29Å; N46-F48 VanDerWaalsContact C-N 3.33Å; N46-F48 HydrophobicContact CB-CD2 3.64Å; N46-F48 HydrophobicContact CB-CE2 3.75Å; N46-F48 PolarHBondContact O-N 3.38Å; F48-L54 HydrophobicContact CD1-CD2 4.35Å; F48-D58 HydrophobicContact CE1-CB 4.29Å; F48-L62 HydrophobicContact CE1-CB 4.17Å; F48-L62 HydrophobicContact CE2-CD1 4.2Å; F48-L62 HydrophobicContact CZ-CB 3.79Å; F48-L62 HydrophobicContact CZ-CD1 4.16Å; F48-L65 HydrophobicContact CE2-CD1 3.83Å; F48-L65 HydrophobicContact CZ-CD1 4.22Å
49	N	69.3	Low	80.2	Confident	96 Å²	96	75.5 Å²	75.5	51%	0.513	41%	0.411	S	S	.	.			trans	-99.6	121.7	171.6	-74.6	-55.5	0	0	0	109.1	D51 R52	N49-D51 PolarHBondContact O-N 3.36Å; N49-D51 VanDerWaalsContact O-N 3.12Å; N49-R52 HydrophobicContact CB-CB 4.3Å; N49-R52 HydrophobicContact CB-CG 4.04Å; N49-R52 PolarHBondContact O-N 2.86Å; N49-R52 VanDerWaalsContact O-N 3.15Å
50	M	63.8	Low	80.1	Confident	135 Å²	135	81.3 Å²	81.3	67%	0.665	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-25.3	179.8	-74.8	-175.6	-80.7	0	0	113.4	V41	V41-M50 HydrophobicContact CG1-CG 4.37Å
51	D	64.3	Low	80.1	Confident	165 Å²	165	84.6 Å²	84.6	88%	0.882	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-6.7	-177.8	-57.9	-39.4	0	0	0	114.5	N49	N49-D51 PolarHBondContact O-N 3.36Å; N49-D51 VanDerWaalsContact O-N 3.12Å
52	R	67.5	Low	80.3	Confident	188 Å²	188	82.9 Å²	82.9	71%	0.709	45%	0.445	S	S	*	.	S	Bend	trans	-97.4	140.7	-178.4	-72.5	-171.3	177.3	-174.3	-0.7	111.6	N49 L54	N49-R52 HydrophobicContact CB-CB 4.3Å; N49-R52 HydrophobicContact CB-CG 4.04Å; N49-R52 PolarHBondContact O-N 2.86Å; N49-R52 VanDerWaalsContact O-N 3.15Å; R52-L54 PolarHBondContact O-N 2.89Å
53	T	70.3	Confident	80.6	Confident	127 Å²	127	82.6 Å²	82.6	78%	0.779	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-64.3	127.1	168.4	34.9	0	0	0	0	110.4	M55	T53-M55 PolarHBondContact O-N 3.42Å
54	L	71.9	Confident	80.8	Confident	83 Å²	83	89.1 Å²	89.1	44%	0.435	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-64.5	119.9	178.6	-72.3	163	0	0	0	110.7	F48 R52 D58 V59	F48-L54 HydrophobicContact CD1-CD2 4.35Å; R52-L54 PolarHBondContact O-N 2.89Å; L54-D58 HydrophobicContact CD2-CB 3.91Å; L54-V59 HydrophobicContact CB-CG2 4.25Å
55	M	79.5	Confident	81.2	Confident	128 Å²	128	87.7 Å²	87.7	63%	0.631	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-79.4	163.5	169	-56.4	-167.4	-166	0	0	110.7	T53 S57 D58 V59	T53-M55 PolarHBondContact O-N 3.42Å; M55-S57 PolarHBondContact O-N 2.94Å; M55-D58 WeakPolarHBondContact CB-OD2 3.44Å; M55-D58 PolarHBondContact N-OD2 2.86Å; M55-D58 WeakPolarHBondContact O-CB 3.38Å; M55-D58 PolarHBondContact O-N 3.44Å; M55-V59 PolarHBondContact O-N 3.02Å
56	K	80.5	Confident	81.5	Confident	173 Å²	173	83.5 Å²	83.5	75%	0.752	43%	0.431	S	S	*	.	H	α-helix	trans	-57.2	-36.2	177.3	-172	177.2	179.4	-179.6	0	112.8	D58 V59 Q60	K56-D58 VanDerWaalsContact C-N 3.35Å; K56-V59 PolarHBondContact O-N 3.22Å; K56-Q60 WeakPolarHBondContact O-CG 3.35Å; K56-Q60 PolarHBondContact O-N 3.2Å; K56-Q60 VanDerWaalsContact O-N 3.12Å
57	S	83.7	Confident	81.8	Confident	67 Å²	67	82.8 Å²	82.8	47%	0.469	43%	0.427	S	S	.	.	H	α-helix	trans	-64.2	-38.8	174	49.5	0	0	0	0	112.5	M55 V59 Q60 N61	M55-S57 PolarHBondContact O-N 2.94Å; S57-V59 VanDerWaalsContact C-N 3.35Å; S57-Q60 PolarHBondContact O-N 3.21Å; S57-N61 PolarHBondContact O-N 3.46Å
58	D	84.8	Confident	82.3	Confident	56 Å²	56	84.2 Å²	84.2	30%	0.299	43%	0.425	S	S	.	.	H	α-helix	trans	-67.9	-40	-179.9	-53.8	-29.6	0	0	0	110.2	F48 L54 M55 K56 N61 L62	F48-D58 HydrophobicContact CE1-CB 4.29Å; L54-D58 HydrophobicContact CD2-CB 3.91Å; M55-D58 WeakPolarHBondContact CB-OD2 3.44Å; M55-D58 PolarHBondContact N-OD2 2.86Å; M55-D58 WeakPolarHBondContact O-CB 3.38Å; M55-D58 PolarHBondContact O-N 3.44Å; K56-D58 VanDerWaalsContact C-N 3.35Å; D58-N61 PolarHBondContact O-N 2.83Å; D58-L62 VanDerWaalsContact O-CB 3.3Å; D58-L62 WeakPolarHBondContact O-CB 3.43Å; D58-L62 PolarHBondContact O-N 3.41Å
59	V	85.5	Confident	82.9	Confident	26 Å²	26	86.2 Å²	86.2	16%	0.158	43%	0.431	C	S	.	.	H	α-helix	trans	-61.4	-46.2	173.9	175.7	0	0	0	0	111.3	I13 L54 M55 K56 S57 N61 L62 V63	I13-V59 HydrophobicContact CD1-CG1 3.98Å; I13-V59 HydrophobicContact CD1-CG2 4.07Å; I13-V59 HydrophobicContact CG1-CG1 3.78Å; L54-V59 HydrophobicContact CB-CG2 4.25Å; M55-V59 PolarHBondContact O-N 3.02Å; K56-V59 PolarHBondContact O-N 3.22Å; S57-V59 VanDerWaalsContact C-N 3.35Å; V59-N61 VanDerWaalsContact C-N 3.33Å; V59-N61 PolarHBondContact O-N 3.38Å; V59-L62 WeakPolarHBondContact O-CB 3.3Å; V59-L62 PolarHBondContact O-N 3.07Å; V59-V63 HydrophobicContact CG1-CG2 4.4Å; V59-V63 WeakPolarHBondContact O-CG2 3.46Å; V59-V63 PolarHBondContact O-N 2.68Å
60	Q	88	Confident	84.1	Confident	121 Å²	121	81.9 Å²	81.9	57%	0.565	41%	0.408	S	S	*	.	H	α-helix	trans	-61.6	-41.1	177.3	-72.8	177.5	-24.7	0	0	112.2	K56 S57 K64	K56-Q60 WeakPolarHBondContact O-CG 3.35Å; K56-Q60 PolarHBondContact O-N 3.2Å; K56-Q60 VanDerWaalsContact O-N 3.12Å; S57-Q60 PolarHBondContact O-N 3.21Å; Q60-K64 WeakPolarHBondContact O-CB 3.41Å; Q60-K64 PolarHBondContact O-N 2.97Å
61	N	90.2	Very high	85.4	Confident	70 Å²	70	78 Å²	78	37%	0.374	39%	0.39	S	S	.	.	H	α-helix	trans	-65.5	-42.4	175.9	-169.6	40.6	0	0	0	111.7	S57 D58 V59 K64 L65	S57-N61 PolarHBondContact O-N 3.46Å; D58-N61 PolarHBondContact O-N 2.83Å; V59-N61 VanDerWaalsContact C-N 3.33Å; V59-N61 PolarHBondContact O-N 3.38Å; N61-K64 PolarHBondContact O-N 2.67Å; N61-L65 WeakPolarHBondContact O-CB 3.44Å; N61-L65 WeakPolarHBondContact O-CG 3.24Å; N61-L65 PolarHBondContact O-N 2.89Å
62	L	90.5	Very high	86.6	Confident	2 Å²	2	73 Å²	73	1%	0.01	36%	0.363	C	S	.	.	H	α-helix	trans	-60.3	-47.8	176.6	178.1	61.4	0	0	0	111.7	I13 V37 V40 V41 F48 D58 V59 K64 L65 C66	I13-L62 HydrophobicContact CD1-CD2 4.29Å; I13-L62 HydrophobicContact CG2-CD2 4.32Å; V37-L62 HydrophobicContact CG1-CD1 4.49Å; V37-L62 HydrophobicContact CG1-CD2 4.13Å; V40-L62 HydrophobicContact CB-CD1 4.06Å; V40-L62 HydrophobicContact CG1-CD1 3.61Å; V41-L62 HydrophobicContact CG2-CD1 3.87Å; V41-L62 HydrophobicContact CG2-CD2 4.44Å; F48-L62 HydrophobicContact CE1-CB 4.17Å; F48-L62 HydrophobicContact CE2-CD1 4.2Å; F48-L62 HydrophobicContact CZ-CB 3.79Å; F48-L62 HydrophobicContact CZ-CD1 4.16Å; D58-L62 VanDerWaalsContact O-CB 3.3Å; D58-L62 WeakPolarHBondContact O-CB 3.43Å; D58-L62 PolarHBondContact O-N 3.41Å; V59-L62 WeakPolarHBondContact O-CB 3.3Å; V59-L62 PolarHBondContact O-N 3.07Å; L62-K64 PolarHBondContact O-N 2.9Å; L62-L65 PolarHBondContact O-N 3.44Å; L62-C66 WeakPolarHBondContact O-CB 3.36Å; L62-C66 PolarHBondContact O-N 3.05Å; L62-C66 PolarHBondContact O-SG 3.35Å
63	V	90.8	Very high	87.4	Confident	13 Å²	13	67 Å²	67	8%	0.079	35%	0.347	C	S	.	.	H	α-helix	trans	-57.7	-49.3	175.6	171.2	0	0	0	0	109.9	I13 I17 V59 L65 C66 M67	I13-V63 HydrophobicContact CG2-CG2 4.18Å; I17-V63 HydrophobicContact CD1-CG2 4.48Å; I17-V63 HydrophobicContact CG1-CB 4.31Å; I17-V63 HydrophobicContact CG1-CG1 4.07Å; I17-V63 HydrophobicContact CG1-CG2 4.03Å; V59-V63 HydrophobicContact CG1-CG2 4.4Å; V59-V63 WeakPolarHBondContact O-CG2 3.46Å; V59-V63 PolarHBondContact O-N 2.68Å; V63-L65 PolarHBondContact O-N 3.41Å; V63-C66 PolarHBondContact O-N 2.98Å; V63-M67 HydrophobicContact CG1-CG 4.18Å; V63-M67 WeakPolarHBondContact O-CB 3.4Å; V63-M67 WeakPolarHBondContact O-CG 3.45Å; V63-M67 PolarHBondContact O-N 3.27Å
64	K	93.1	Very high	88	Confident	142 Å²	142	67.2 Å²	67.2	62%	0.617	34%	0.337	S	S	*	.	H	α-helix	trans	-59.1	-45.3	179.3	-175.9	-177.2	177.6	-175.7	0	112.8	Q60 N61 L62 M67 T68	Q60-K64 WeakPolarHBondContact O-CB 3.41Å; Q60-K64 PolarHBondContact O-N 2.97Å; N61-K64 PolarHBondContact O-N 2.67Å; L62-K64 PolarHBondContact O-N 2.9Å; K64-M67 PolarHBondContact O-N 3Å; K64-T68 WeakPolarHBondContact O-CB 3.39Å; K64-T68 PolarHBondContact O-N 3.42Å; K64-T68 PolarHBondContact O-OG1 3.17Å
65	L	93.8	Very high	88.9	Confident	41 Å²	41	65 Å²	65	22%	0.215	33%	0.326	C	S	.	.	H	α-helix	trans	-65.9	-43.6	179.2	-73.6	168.6	0	0	0	111.8	V40 N46 F48 N61 L62 V63 T68 R69	V40-L65 HydrophobicContact CG1-CB 3.69Å; V40-L65 HydrophobicContact CG1-CD1 3.93Å; V40-L65 HydrophobicContact CG1-CG 4.47Å; V40-L65 HydrophobicContact CG2-CB 4.44Å; N46-L65 HydrophobicContact CB-CD1 4.05Å; F48-L65 HydrophobicContact CE2-CD1 3.83Å; F48-L65 HydrophobicContact CZ-CD1 4.22Å; N61-L65 WeakPolarHBondContact O-CB 3.44Å; N61-L65 WeakPolarHBondContact O-CG 3.24Å; N61-L65 PolarHBondContact O-N 2.89Å; L62-L65 PolarHBondContact O-N 3.44Å; V63-L65 PolarHBondContact O-N 3.41Å; L65-T68 PolarHBondContact O-N 3.24Å; L65-R69 PolarHBondContact O-N 3.39Å; L65-R69 VanDerWaalsContact O-N 3.11Å
66	C	93.7	Very high	89.5	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-61.7	-46.4	174.9	-66.1	0	0	0	0	111.3	I17 M36 L62 V63 T68 R69 L70	I17-C66 HydrophobicContact CD1-CB 3.78Å; I17-C66 HydrophobicContact CG1-CB 4.43Å; M36-C66 HydrophobicContact CG-CB 4.1Å; L62-C66 WeakPolarHBondContact O-CB 3.36Å; L62-C66 PolarHBondContact O-N 3.05Å; L62-C66 PolarHBondContact O-SG 3.35Å; V63-C66 PolarHBondContact O-N 2.98Å; C66-T68 VanDerWaalsContact C-N 3.33Å; C66-T68 PolarHBondContact O-N 2.9Å; C66-R69 PolarHBondContact O-N 2.57Å; C66-L70 WeakPolarHBondContact O-CB 3.3Å; C66-L70 VanDerWaalsContact O-CG 3.31Å; C66-L70 WeakPolarHBondContact O-CG 3.44Å; C66-L70 PolarHBondContact O-N 3.09Å
67	M	93	Very high	90.1	Very high	17 Å²	17	51.9 Å²	51.9	8%	0.084	27%	0.268	C	S	.	.	H	α-helix	trans	-58.3	-44.6	176.8	-75.3	-61.9	-59.3	0	0	111.7	I17 E20 C21 V63 K64 R69 L70 L71	I17-M67 HydrophobicContact CG2-SD 4Å; E20-M67 HydrophobicContact CB-CE 3.66Å; E20-M67 HydrophobicContact CB-CG 4.38Å; E20-M67 HydrophobicContact CB-SD 3.55Å; E20-M67 VanDerWaalsContact CB-SD 3.55Å; C21-M67 HydrophobicContact CB-SD 4.49Å; C21-M67 PolarHBondContact SG-SD 3.44Å; V63-M67 HydrophobicContact CG1-CG 4.18Å; V63-M67 WeakPolarHBondContact O-CB 3.4Å; V63-M67 WeakPolarHBondContact O-CG 3.45Å; V63-M67 PolarHBondContact O-N 3.27Å; K64-M67 PolarHBondContact O-N 3Å; M67-R69 VanDerWaalsContact C-N 3.32Å; M67-R69 PolarHBondContact O-N 2.94Å; M67-L70 PolarHBondContact O-N 3.33Å; M67-L71 HydrophobicContact CE-CD1 3.67Å; M67-L71 HydrophobicContact CE-CD2 4.49Å; M67-L71 HydrophobicContact CE-CG 4.09Å; M67-L71 WeakPolarHBondContact O-CB 3.31Å; M67-L71 VanDerWaalsContact O-CG 3.3Å; M67-L71 WeakPolarHBondContact O-CG 3.42Å; M67-L71 PolarHBondContact O-N 3.01Å
68	T	93.3	Very high	90.6	Very high	89 Å²	89	48.9 Å²	48.9	55%	0.546	25%	0.247	S	C	.	.	H	α-helix	trans	-60.2	-42.9	178.4	-55.1	0	0	0	0	111.2	K64 L65 C66 D72	K64-T68 WeakPolarHBondContact O-CB 3.39Å; K64-T68 PolarHBondContact O-N 3.42Å; K64-T68 PolarHBondContact O-OG1 3.17Å; L65-T68 PolarHBondContact O-N 3.24Å; C66-T68 VanDerWaalsContact C-N 3.33Å; C66-T68 PolarHBondContact O-N 2.9Å; T68-D72 WeakPolarHBondContact O-CB 3.47Å; T68-D72 PolarHBondContact O-N 2.69Å
69	R	92.9	Very high	91.1	Very high	72 Å²	72	47.1 Å²	47.1	27%	0.272	24%	0.238	S	C	.	.	H	α-helix	trans	-72.5	-38	177.8	-70.4	-170	179.9	-173.7	1.1	113.2	M36 D43 L65 C66 M67 L78	M36-R69 HydrophobicContact CE-CB 3.98Å; M36-R69 HydrophobicContact SD-CB 3.63Å; M36-R69 HydrophobicContact SD-CG 4.27Å; D43-R69 IonicContact OD2-CZ 2.79Å; D43-R69 IonicContact OD2-NH2 2.63Å; D43-R69 PolarHBondContact OD2-NH2 3.05Å; L65-R69 PolarHBondContact O-N 3.39Å; L65-R69 VanDerWaalsContact O-N 3.11Å; C66-R69 PolarHBondContact O-N 2.57Å; M67-R69 VanDerWaalsContact C-N 3.32Å; M67-R69 PolarHBondContact O-N 2.94Å; R69-L78 WeakPolarHBondContact O-CD2 3.43Å
70	L	93.9	Very high	91.6	Very high	5 Å²	5	45.9 Å²	45.9	3%	0.026	23%	0.23	C	C	.	.	H	α-helix	trans	-73.1	-33.3	-178.4	-73.3	170.5	0	0	0	113.1	I17 V28 L32 I33 M36 C66 M67 D72 L78	I17-L70 HydrophobicContact CG2-CD1 3.62Å; V28-L70 HydrophobicContact CG1-CD2 4.2Å; L32-L70 HydrophobicContact CD2-CD2 4.25Å; L32-L70 HydrophobicContact CG-CD2 4.2Å; I33-L70 HydrophobicContact CG1-CD1 4.24Å; M36-L70 HydrophobicContact CB-CD2 4.22Å; M36-L70 HydrophobicContact CB-CG 4.42Å; M36-L70 HydrophobicContact CE-CD2 4.04Å; M36-L70 HydrophobicContact CE-CG 4.46Å; M36-L70 HydrophobicContact CG-CD1 4.38Å; M36-L70 HydrophobicContact CG-CD2 4.21Å; M36-L70 HydrophobicContact CG-CG 4.01Å; C66-L70 WeakPolarHBondContact O-CB 3.3Å; C66-L70 VanDerWaalsContact O-CG 3.31Å; C66-L70 WeakPolarHBondContact O-CG 3.44Å; C66-L70 PolarHBondContact O-N 3.09Å; M67-L70 PolarHBondContact O-N 3.33Å; L70-D72 VanDerWaalsContact C-N 3.35Å; L70-L78 HydrophobicContact CD2-CD1 4.26Å; L70-L78 WeakPolarHBondContact O-CD2 3.5Å
71	L	92.1	Very high	91.9	Very high	54 Å²	54	40.3 Å²	40.3	28%	0.283	20%	0.204	S	C	.	.	H	α-helix	trans	-84	-10.6	177.4	-63.7	-178.9	0	0	0	113.2	H24 E26 M67 T73	H24-L71 HydrophobicContact CB-CD1 4.13Å; H24-L71 HydrophobicContact CB-CD2 3.88Å; E26-L71 HydrophobicContact CB-CD2 4.21Å; E26-L71 HydrophobicContact CG-CD2 4.03Å; M67-L71 HydrophobicContact CE-CD1 3.67Å; M67-L71 HydrophobicContact CE-CD2 4.49Å; M67-L71 HydrophobicContact CE-CG 4.09Å; M67-L71 WeakPolarHBondContact O-CB 3.31Å; M67-L71 VanDerWaalsContact O-CG 3.3Å; M67-L71 WeakPolarHBondContact O-CG 3.42Å; M67-L71 PolarHBondContact O-N 3.01Å; L71-T73 PolarHBondContact O-N 3.09Å
72	D	89.5	Confident	92.1	Very high	58 Å²	58	39.2 Å²	39.2	31%	0.31	20%	0.196	S	C	.	.			trans	-78.5	65.2	172.5	-168.5	13.8	0	0	0	110.5	T68 L70 K74 N75 L78	T68-D72 WeakPolarHBondContact O-CB 3.47Å; T68-D72 PolarHBondContact O-N 2.69Å; L70-D72 VanDerWaalsContact C-N 3.35Å; D72-K74 PolarHBondContact O-N 2.82Å; D72-N75 HydrophobicContact CB-CB 4.36Å; D72-N75 WeakPolarHBondContact O-CB 3.48Å; D72-N75 PolarHBondContact O-N 3.4Å; D72-N75 VanDerWaalsContact O-N 3.11Å; D72-N75 WeakPolarHBondContact OD2-CB 3.32Å; D72-N75 PolarHBondContact OD2-ND2 3.18Å; D72-N75 VanDerWaalsContact OD2-ND2 3.16Å; D72-L78 WeakPolarHBondContact O-CD2 3.46Å
73	T	84.6	Confident	92.3	Very high	64 Å²	64	39.1 Å²	39.1	39%	0.393	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-3.6	178.3	56.1	0	0	0	0	113.9	L71	L71-T73 PolarHBondContact O-N 3.09Å
74	K	83.6	Confident	92.5	Very high	131 Å²	131	38.5 Å²	38.5	57%	0.57	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-4.8	-178.4	-74.5	-163.4	173.6	-178.5	0	113	D72 Y360	D72-K74 PolarHBondContact O-N 2.82Å; K74-Y360 VanDerWaalsContact CA-OH 3.28Å; K74-Y360 WeakPolarHBondContact CA-OH 3.46Å; K74-Y360 WeakPolarHBondContact CB-OH 3.02Å; K74-Y360 VanDerWaalsContact CD-OH 3.25Å; K74-Y360 WeakPolarHBondContact CD-OH 3.42Å; K74-Y360 WeakPolarHBondContact CG-OH 3.49Å; K74-Y360 WeakPolarHBondContact O-CE2 3.38Å; K74-Y360 VanDerWaalsContact O-CZ 3.26Å; K74-Y360 PolarHBondContact O-OH 3.35Å
75	N	89.4	Confident	92.4	Very high	35 Å²	35	32.3 Å²	32.3	19%	0.187	17%	0.166	C	C	.	.			trans	-97.1	119.5	-172.6	-163.4	-39.4	0	0	0	112.2	D72 S77 L78 D79	D72-N75 HydrophobicContact CB-CB 4.36Å; D72-N75 WeakPolarHBondContact O-CB 3.48Å; D72-N75 PolarHBondContact O-N 3.4Å; D72-N75 VanDerWaalsContact O-N 3.11Å; D72-N75 WeakPolarHBondContact OD2-CB 3.32Å; D72-N75 PolarHBondContact OD2-ND2 3.18Å; D72-N75 VanDerWaalsContact OD2-ND2 3.16Å; N75-S77 PolarHBondContact O-N 2.96Å; N75-S77 VanDerWaalsContact O-N 3.15Å; N75-S77 VanDerWaalsContact OD1-CB 3.26Å; N75-S77 WeakPolarHBondContact OD1-CB 3.43Å; N75-S77 PolarHBondContact OD1-N 3.25Å; N75-L78 HydrophobicContact CB-CB 4.32Å; N75-L78 WeakPolarHBondContact O-CB 3.29Å; N75-L78 PolarHBondContact O-N 3.03Å; N75-D79 PolarHBondContact O-N 3.44Å
76	P	93	Very high	92.2	Very high	4 Å²	4	33.1 Å²	33.1	3%	0.026	17%	0.167	C	C	.	.	H	α-helix	trans	-59.3	-26.7	176.7	-23.8	33.6	0	0	0	114	D79 T80 M261 E264 A265 A356	P76-D79 PolarHBondContact O-N 3.46Å; P76-T80 WeakPolarHBondContact O-CB 3.42Å; P76-T80 PolarHBondContact O-N 2.96Å; P76-T80 PolarHBondContact O-OG1 2.88Å; P76-M261 HydrophobicContact CG-CB 4.4Å; P76-E264 HydrophobicContact CB-CB 4.09Å; P76-A265 HydrophobicContact CB-CB 4.41Å; P76-A265 HydrophobicContact CG-CB 4.34Å; P76-A356 HydrophobicContact CG-CB 4.33Å
77	S	93.1	Very high	92.2	Very high	22 Å²	22	33.4 Å²	33.4	15%	0.154	17%	0.168	C	C	.	.	H	α-helix	trans	-63.5	-42.5	173.9	169.5	0	0	0	0	110.9	N75 D79 T80 I81 E479	N75-S77 PolarHBondContact O-N 2.96Å; N75-S77 VanDerWaalsContact O-N 3.15Å; N75-S77 VanDerWaalsContact OD1-CB 3.26Å; N75-S77 WeakPolarHBondContact OD1-CB 3.43Å; N75-S77 PolarHBondContact OD1-N 3.25Å; S77-D79 PolarHBondContact O-N 3.35Å; S77-T80 WeakPolarHBondContact O-CB 3.48Å; S77-T80 PolarHBondContact O-N 3.13Å; S77-I81 WeakPolarHBondContact O-CG1 3.38Å; S77-I81 PolarHBondContact O-N 2.95Å; S77-E479 VanDerWaalsContact OG-CD 3.26Å; S77-E479 PolarHBondContact OG-OE2 2.87Å
78	L	93.9	Very high	91.9	Very high	5 Å²	5	33.7 Å²	33.7	3%	0.026	17%	0.17	C	C	.	.	H	α-helix	trans	-64	-42.8	176.9	179.3	64.8	0	0	0	111.4	M36 R69 L70 D72 N75 T80 I81 K82	M36-L78 HydrophobicContact CE-CD1 3.81Å; R69-L78 WeakPolarHBondContact O-CD2 3.43Å; L70-L78 HydrophobicContact CD2-CD1 4.26Å; L70-L78 WeakPolarHBondContact O-CD2 3.5Å; D72-L78 WeakPolarHBondContact O-CD2 3.46Å; N75-L78 HydrophobicContact CB-CB 4.32Å; N75-L78 WeakPolarHBondContact O-CB 3.29Å; N75-L78 PolarHBondContact O-N 3.03Å; L78-T80 VanDerWaalsContact C-N 3.3Å; L78-T80 PolarHBondContact O-N 3.3Å; L78-I81 PolarHBondContact O-N 3.23Å; L78-K82 HydrophobicContact CD1-CG 4.5Å; L78-K82 HydrophobicContact CG-CD 4.23Å; L78-K82 WeakPolarHBondContact O-CB 3.27Å; L78-K82 WeakPolarHBondContact O-CG 3.39Å; L78-K82 PolarHBondContact O-N 3.46Å
79	D	94.6	Very high	91.6	Very high	19 Å²	19	34.4 Å²	34.4	10%	0.102	17%	0.168	C	C	.	.	H	α-helix	trans	-63.9	-37.6	177	-71.9	-25.6	0	0	0	111.8	N75 P76 S77 K82 M83 F353	N75-D79 PolarHBondContact O-N 3.44Å; P76-D79 PolarHBondContact O-N 3.46Å; S77-D79 PolarHBondContact O-N 3.35Å; D79-K82 PolarHBondContact O-N 3.5Å; D79-M83 WeakPolarHBondContact O-CB 3.29Å; D79-M83 PolarHBondContact O-N 3.46Å; D79-F353 WeakPolarHBondContact CB-O 3.4Å
80	T	96.1	Very high	91.4	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-62.5	-46.3	174	-50.3	0	0	0	0	111.1	P76 S77 L78 M83 Q84 N268 Q271 E479	P76-T80 WeakPolarHBondContact O-CB 3.42Å; P76-T80 PolarHBondContact O-N 2.96Å; P76-T80 PolarHBondContact O-OG1 2.88Å; S77-T80 WeakPolarHBondContact O-CB 3.48Å; S77-T80 PolarHBondContact O-N 3.13Å; L78-T80 VanDerWaalsContact C-N 3.3Å; L78-T80 PolarHBondContact O-N 3.3Å; T80-M83 PolarHBondContact O-N 3.09Å; T80-Q84 HydrophobicContact CG2-CG 4.49Å; T80-Q84 VanDerWaalsContact O-CB 3.31Å; T80-Q84 WeakPolarHBondContact O-CB 3.47Å; T80-Q84 VanDerWaalsContact O-CG 3.23Å; T80-Q84 WeakPolarHBondContact O-CG 3.41Å; T80-Q84 PolarHBondContact O-N 3Å; T80-N268 WeakPolarHBondContact CA-ND2 3.48Å; T80-N268 PolarHBondContact N-ND2 3.33Å; T80-N268 WeakPolarHBondContact OG1-CA 3.41Å; T80-N268 WeakPolarHBondContact OG1-CB 3.43Å; T80-N268 PolarHBondContact OG1-ND2 3.49Å; T80-Q271 HydrophobicContact CG2-CB 3.94Å; T80-Q271 HydrophobicContact CG2-CG 4.1Å; T80-E479 HydrophobicContact CG2-CB 3.76Å; T80-E479 HydrophobicContact CG2-CG 4.37Å
81	I	94.1	Very high	91.2	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.021	18%	0.183	C	C	.	.	H	α-helix	trans	-63.7	-42.9	177.8	-68.4	166.6	0	0	0	110.9	L32 F35 M36 S77 L78 M83 Q84 V85 E479	L32-I81 HydrophobicContact CD1-CG2 3.68Å; F35-I81 HydrophobicContact CD1-CG2 3.35Å; F35-I81 HydrophobicContact CE1-CB 4.27Å; F35-I81 HydrophobicContact CE1-CD1 4.1Å; F35-I81 HydrophobicContact CE1-CG1 3.91Å; F35-I81 HydrophobicContact CE1-CG2 3.39Å; F35-I81 HydrophobicContact CG-CG2 4.3Å; F35-I81 HydrophobicContact CZ-CG2 4.33Å; M36-I81 HydrophobicContact CE-CD1 4.38Å; S77-I81 WeakPolarHBondContact O-CG1 3.38Å; S77-I81 PolarHBondContact O-N 2.95Å; L78-I81 PolarHBondContact O-N 3.23Å; I81-M83 VanDerWaalsContact C-N 3.33Å; I81-M83 PolarHBondContact O-N 3.46Å; I81-Q84 WeakPolarHBondContact O-CB 3.31Å; I81-Q84 PolarHBondContact O-N 3.26Å; I81-V85 HydrophobicContact CG2-CG2 4.31Å; I81-V85 WeakPolarHBondContact O-CB 3.36Å; I81-V85 WeakPolarHBondContact O-CG2 3.37Å; I81-V85 PolarHBondContact O-N 3.47Å; I81-E479 HydrophobicContact CG1-CB 4.19Å
82	K	94.3	Very high	90.9	Very high	46 Å²	46	37 Å²	37	20%	0.2	19%	0.186	C	C	.	.	H	α-helix	trans	-59.5	-45.5	175.7	-76.5	172.4	177.5	174.1	0	111.3	L32 L78 D79 Y86 F353	L32-K82 HydrophobicContact CD1-CG 4.35Å; L32-K82 HydrophobicContact CD2-CD 4.45Å; L32-K82 HydrophobicContact CD2-CG 3.61Å; L78-K82 HydrophobicContact CD1-CG 4.5Å; L78-K82 HydrophobicContact CG-CD 4.23Å; L78-K82 WeakPolarHBondContact O-CB 3.27Å; L78-K82 WeakPolarHBondContact O-CG 3.39Å; L78-K82 PolarHBondContact O-N 3.46Å; D79-K82 PolarHBondContact O-N 3.5Å; K82-Y86 VanDerWaalsContact O-CB 3.24Å; K82-Y86 WeakPolarHBondContact O-CB 3.32Å; K82-Y86 PolarHBondContact O-N 2.91Å; K82-F353 HydrophobicContact CB-CD1 3.79Å; K82-F353 HydrophobicContact CB-CE1 3.53Å; K82-F353 HydrophobicContact CB-CZ 4.24Å; K82-F353 HydrophobicContact CD-CE1 4.35Å; K82-F353 HydrophobicContact CG-CE1 4.49Å
83	M	95.7	Very high	90.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.1	-44.7	177	-173.2	173.1	56	0	0	111.9	D79 T80 I81 Y86 F87 N268 Q271 Y272 F275 I350 F353	D79-M83 WeakPolarHBondContact O-CB 3.29Å; D79-M83 PolarHBondContact O-N 3.46Å; T80-M83 PolarHBondContact O-N 3.09Å; I81-M83 VanDerWaalsContact C-N 3.33Å; I81-M83 PolarHBondContact O-N 3.46Å; M83-Y86 PolarHBondContact O-N 3Å; M83-F87 WeakPolarHBondContact O-CB 3.4Å; M83-F87 PolarHBondContact O-N 3.42Å; M83-N268 WeakPolarHBondContact CE-O 3.47Å; M83-Q271 HydrophobicContact CE-CB 3.71Å; M83-Q271 HydrophobicContact CE-CG 3.66Å; M83-Y272 HydrophobicContact SD-CD2 3.91Å; M83-Y272 HydrophobicContact SD-CG 4.46Å; M83-F275 HydrophobicContact CE-CD2 4.33Å; M83-F275 HydrophobicContact CE-CE2 4.38Å; M83-F275 HydrophobicContact CG-CD2 3.97Å; M83-F275 HydrophobicContact CG-CE2 3.93Å; M83-F275 HydrophobicContact SD-CD2 4.19Å; M83-I350 HydrophobicContact CG-CB 4.08Å; M83-I350 HydrophobicContact CG-CG2 4.14Å; M83-I350 HydrophobicContact SD-CB 4.32Å; M83-F353 HydrophobicContact CB-CB 3.81Å; M83-F353 HydrophobicContact CB-CD2 3.51Å; M83-F353 HydrophobicContact CB-CE2 4.24Å; M83-F353 HydrophobicContact CB-CG 3.73Å; M83-F353 HydrophobicContact CG-CB 4.26Å; M83-F353 HydrophobicContact CG-CD2 3.72Å; M83-F353 HydrophobicContact CG-CE2 4.5Å; M83-F353 HydrophobicContact CG-CG 4.3Å; M83-F353 HydrophobicContact SD-CB 4.26Å
84	Q	93.9	Very high	90.8	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-59.1	-52.8	176.3	-81.8	174.6	-13.4	0	0	112.3	T80 I81 Y86 F87 D88 Q271 F275 E479 Q482	T80-Q84 HydrophobicContact CG2-CG 4.49Å; T80-Q84 VanDerWaalsContact O-CB 3.31Å; T80-Q84 WeakPolarHBondContact O-CB 3.47Å; T80-Q84 VanDerWaalsContact O-CG 3.23Å; T80-Q84 WeakPolarHBondContact O-CG 3.41Å; T80-Q84 PolarHBondContact O-N 3Å; I81-Q84 WeakPolarHBondContact O-CB 3.31Å; I81-Q84 PolarHBondContact O-N 3.26Å; Q84-Y86 VanDerWaalsContact C-N 3.32Å; Q84-Y86 PolarHBondContact O-N 2.88Å; Q84-F87 PolarHBondContact O-N 3.24Å; Q84-D88 PolarHBondContact O-N 3.43Å; Q84-Q271 HydrophobicContact CG-CG 3.84Å; Q84-F275 HydrophobicContact CG-CE2 4.29Å; Q84-F275 HydrophobicContact CG-CZ 4.11Å; Q84-E479 PolarHBondContact NE2-O 3.28Å; Q84-Q482 HydrophobicContact CG-CB 4.39Å; Q84-Q482 HydrophobicContact CG-CG 4.37Å
85	V	90.8	Very high	91	Very high	11 Å²	11	34.6 Å²	34.6	7%	0.067	18%	0.176	C	C	.	.	H	α-helix	trans	-61.6	-41.5	177.2	170.9	0	0	0	0	111.2	T31 L32 F35 I81 M89	T31-V85 HydrophobicContact CG2-CG1 3.9Å; L32-V85 HydrophobicContact CD1-CB 4.42Å; L32-V85 HydrophobicContact CD1-CG2 4.03Å; F35-V85 HydrophobicContact CB-CG2 4.07Å; F35-V85 HydrophobicContact CD2-CG2 4.19Å; F35-V85 HydrophobicContact CG-CG2 4.01Å; I81-V85 HydrophobicContact CG2-CG2 4.31Å; I81-V85 WeakPolarHBondContact O-CB 3.36Å; I81-V85 WeakPolarHBondContact O-CG2 3.37Å; I81-V85 PolarHBondContact O-N 3.47Å; V85-M89 HydrophobicContact CG1-CG 4.43Å; V85-M89 HydrophobicContact CG1-SD 3.87Å; V85-M89 WeakPolarHBondContact O-CB 3.3Å; V85-M89 WeakPolarHBondContact O-CG 3.41Å; V85-M89 PolarHBondContact O-N 3.4Å; V85-M89 VanDerWaalsContact O-N 3.07Å
86	Y	91.6	Very high	91	Very high	59 Å²	59	35.6 Å²	35.6	23%	0.231	18%	0.18	C	C	.	.	H	α-helix	trans	-62.9	-45.8	176.7	-177.2	-91.9	0	0	0	111.3	K82 M83 Q84 M89 N90 L346 H349 I350 F353	K82-Y86 VanDerWaalsContact O-CB 3.24Å; K82-Y86 WeakPolarHBondContact O-CB 3.32Å; K82-Y86 PolarHBondContact O-N 2.91Å; M83-Y86 PolarHBondContact O-N 3Å; Q84-Y86 VanDerWaalsContact C-N 3.32Å; Q84-Y86 PolarHBondContact O-N 2.88Å; Y86-M89 PolarHBondContact O-N 3.38Å; Y86-N90 WeakPolarHBondContact CD2-ND2 3.27Å; Y86-N90 WeakPolarHBondContact CE2-ND2 3.39Å; Y86-N90 WeakPolarHBondContact O-CB 3.29Å; Y86-N90 PolarHBondContact O-N 3.46Å; Y86-N90 PolarHBondContact O-ND2 3.24Å; Y86-L346 HydrophobicContact CD1-CD1 4.16Å; Y86-L346 HydrophobicContact CE1-CD1 3.83Å; Y86-H349 HydrophobicContact CE1-CB 3.48Å; Y86-H349 VanDerWaalsContact CE1-CB 3.48Å; Y86-H349 HydrophobicContact CE2-CB 4.31Å; Y86-H349 AromaticContact CZ-CG 3.99Å; Y86-H349 WeakPolarHBondContact OH-CB 3.41Å; Y86-I350 HydrophobicContact CD1-CG2 3.82Å; Y86-I350 HydrophobicContact CE1-CG2 4.26Å; Y86-F353 HydrophobicContact CD1-CE2 4.38Å; Y86-F353 HydrophobicContact CG-CE2 4.14Å; Y86-F353 HydrophobicContact CG-CZ 4.41Å
87	F	92.9	Very high	90.9	Very high	6 Å²	6	37.8 Å²	37.8	3%	0.026	19%	0.189	C	C	.	.	H	α-helix	trans	-61.1	-50	177.9	-168.9	-87.1	0	0	0	111	M83 Q84 M89 N90 Y91 F275 I278 I279 L346	M83-F87 WeakPolarHBondContact O-CB 3.4Å; M83-F87 PolarHBondContact O-N 3.42Å; Q84-F87 PolarHBondContact O-N 3.24Å; F87-M89 PolarHBondContact O-N 3.01Å; F87-N90 PolarHBondContact O-N 3.49Å; F87-N90 VanDerWaalsContact O-N 3.13Å; F87-Y91 HydrophobicContact CD1-CD1 4.37Å; F87-Y91 HydrophobicContact CD1-CG 4.25Å; F87-Y91 AromaticContact CE1-CD1 3.49Å; F87-Y91 HydrophobicContact CE1-CD1 3.49Å; F87-Y91 VanDerWaalsContact CE1-CD1 3.49Å; F87-Y91 HydrophobicContact CE1-CD2 4.23Å; F87-Y91 HydrophobicContact CE1-CE1 4.19Å; F87-Y91 AromaticContact CE1-CG 3.49Å; F87-Y91 HydrophobicContact CE1-CG 3.49Å; F87-Y91 VanDerWaalsContact CE1-CG 3.49Å; F87-Y91 HydrophobicContact CE2-CD2 4.43Å; F87-Y91 HydrophobicContact CE2-CG 4.34Å; F87-Y91 AromaticContact CZ-CD1 3.87Å; F87-Y91 HydrophobicContact CZ-CD1 3.87Å; F87-Y91 AromaticContact CZ-CD2 3.8Å; F87-Y91 HydrophobicContact CZ-CD2 3.8Å; F87-Y91 HydrophobicContact CZ-CE1 4.37Å; F87-Y91 HydrophobicContact CZ-CE2 4.31Å; F87-Y91 AromaticContact CZ-CG 3.55Å; F87-Y91 HydrophobicContact CZ-CG 3.55Å; F87-Y91 WeakPolarHBondContact O-CB 3.25Å; F87-Y91 PolarHBondContact O-N 2.92Å; F87-F275 HydrophobicContact CB-CD1 4.36Å; F87-F275 HydrophobicContact CB-CD2 4.15Å; F87-F275 HydrophobicContact CB-CE1 3.98Å; F87-F275 HydrophobicContact CB-CE2 3.74Å; F87-F275 HydrophobicContact CB-CG 4.45Å; F87-F275 HydrophobicContact CB-CZ 3.64Å; F87-F275 AromaticContact CD1-CD1 3.64Å; F87-F275 HydrophobicContact CD1-CD1 3.64Å; F87-F275 AromaticContact CD1-CE1 3.39Å; F87-F275 HydrophobicContact CD1-CE1 3.39Å; F87-F275 HydrophobicContact CD1-CG 4.39Å; F87-F275 AromaticContact CD1-CZ 3.94Å; F87-F275 HydrophobicContact CD1-CZ 3.94Å; F87-F275 HydrophobicContact CD2-CB 3.86Å; F87-F275 AromaticContact CD2-CD1 3.61Å; F87-F275 HydrophobicContact CD2-CD1 3.61Å; F87-F275 AromaticContact CD2-CD2 3.95Å; F87-F275 HydrophobicContact CD2-CD2 3.95Å; F87-F275 HydrophobicContact CD2-CE1 4.06Å; F87-F275 HydrophobicContact CD2-CE2 4.35Å; F87-F275 AromaticContact CD2-CG 3.55Å; F87-F275 HydrophobicContact CD2-CG 3.55Å; F87-F275 HydrophobicContact CD2-CZ 4.4Å; F87-F275 AromaticContact CE1-CD1 3.7Å; F87-F275 HydrophobicContact CE1-CD1 3.7Å; F87-F275 AromaticContact CE1-CE1 3.81Å; F87-F275 HydrophobicContact CE1-CE1 3.81Å; F87-F275 HydrophobicContact CE2-CB 3.72Å; F87-F275 AromaticContact CE2-CD1 3.66Å; F87-F275 HydrophobicContact CE2-CD1 3.66Å; F87-F275 HydrophobicContact CE2-CE1 4.41Å; F87-F275 AromaticContact CE2-CG 3.78Å; F87-F275 HydrophobicContact CE2-CG 3.78Å; F87-F275 AromaticContact CG-CD1 3.59Å; F87-F275 HydrophobicContact CG-CD1 3.59Å; F87-F275 HydrophobicContact CG-CD2 4.08Å; F87-F275 AromaticContact CG-CE1 3.53Å; F87-F275 HydrophobicContact CG-CE1 3.53Å; F87-F275 HydrophobicContact CG-CE2 4.02Å; F87-F275 AromaticContact CG-CG 3.88Å; F87-F275 HydrophobicContact CG-CG 3.88Å; F87-F275 AromaticContact CG-CZ 3.74Å; F87-F275 HydrophobicContact CG-CZ 3.74Å; F87-F275 HydrophobicContact CZ-CB 4.43Å; F87-F275 AromaticContact CZ-CD1 3.72Å; F87-F275 HydrophobicContact CZ-CD1 3.72Å; F87-F275 HydrophobicContact CZ-CE1 4.3Å; F87-F275 HydrophobicContact CZ-CG 4.31Å; F87-I278 HydrophobicContact CE1-CD1 4.49Å; F87-I278 HydrophobicContact CZ-CB 4.32Å; F87-I278 HydrophobicContact CZ-CD1 4.36Å; F87-I278 HydrophobicContact CZ-CG2 3.96Å; F87-I279 HydrophobicContact CE2-CD1 4.11Å; F87-I279 HydrophobicContact CE2-CG1 4.09Å; F87-L346 HydrophobicContact CD2-CD1 4.05Å; F87-L346 HydrophobicContact CD2-CD2 3.98Å; F87-L346 HydrophobicContact CD2-CG 4.2Å; F87-L346 HydrophobicContact CE2-CD2 3.68Å; F87-L346 HydrophobicContact CE2-CG 4.28Å; F87-L346 HydrophobicContact CZ-CD2 4.33Å
88	D	87.6	Confident	90.9	Very high	22 Å²	22	37.9 Å²	37.9	12%	0.118	19%	0.188	C	C	.	.	H	α-helix	trans	-61.7	-28.9	-179.8	-74.7	-10.1	0	0	0	113.9	Q84 Q482 P495 Q498	Q84-D88 PolarHBondContact O-N 3.43Å; D88-Q482 PolarHBondContact OD1-NE2 2.99Å; D88-P495 HydrophobicContact CB-CG 4.4Å; D88-Q498 PolarHBondContact OD1-NE2 2.87Å
89	M	85.8	Confident	90.9	Very high	104 Å²	104	43.7 Å²	43.7	51%	0.512	22%	0.215	S	C	.	.	H	α-helix	trans	-80.8	-25.9	178.1	-75.1	-179	67.1	0	0	113.7	T31 V85 Y86 F87	T31-M89 HydrophobicContact CG2-CG 4.2Å; T31-M89 HydrophobicContact CG2-SD 3.7Å; V85-M89 HydrophobicContact CG1-CG 4.43Å; V85-M89 HydrophobicContact CG1-SD 3.87Å; V85-M89 WeakPolarHBondContact O-CB 3.3Å; V85-M89 WeakPolarHBondContact O-CG 3.41Å; V85-M89 PolarHBondContact O-N 3.4Å; V85-M89 VanDerWaalsContact O-N 3.07Å; Y86-M89 PolarHBondContact O-N 3.38Å; F87-M89 PolarHBondContact O-N 3.01Å
90	N	88.6	Confident	90.8	Very high	75 Å²	75	46.3 Å²	46.3	40%	0.401	23%	0.226	S	C	.	.	H	α-helix	trans	-115.2	-17.6	-170.4	-66	-80.7	0	0	0	113.3	Y86 F87 L346	Y86-N90 WeakPolarHBondContact CD2-ND2 3.27Å; Y86-N90 WeakPolarHBondContact CE2-ND2 3.39Å; Y86-N90 WeakPolarHBondContact O-CB 3.29Å; Y86-N90 PolarHBondContact O-N 3.46Å; Y86-N90 PolarHBondContact O-ND2 3.24Å; F87-N90 PolarHBondContact O-N 3.49Å; F87-N90 VanDerWaalsContact O-N 3.13Å; N90-L346 HydrophobicContact CB-CD1 3.98Å
91	Y	90.3	Very high	90.7	Very high	53 Å²	53	48.3 Å²	48.3	21%	0.208	24%	0.236	C	C	.	.			trans	-98.2	127.7	174.7	-176.8	-98.1	0	0	0	110.7	F87 I278 D282 L343 L346	F87-Y91 HydrophobicContact CD1-CD1 4.37Å; F87-Y91 HydrophobicContact CD1-CG 4.25Å; F87-Y91 AromaticContact CE1-CD1 3.49Å; F87-Y91 HydrophobicContact CE1-CD1 3.49Å; F87-Y91 VanDerWaalsContact CE1-CD1 3.49Å; F87-Y91 HydrophobicContact CE1-CD2 4.23Å; F87-Y91 HydrophobicContact CE1-CE1 4.19Å; F87-Y91 AromaticContact CE1-CG 3.49Å; F87-Y91 HydrophobicContact CE1-CG 3.49Å; F87-Y91 VanDerWaalsContact CE1-CG 3.49Å; F87-Y91 HydrophobicContact CE2-CD2 4.43Å; F87-Y91 HydrophobicContact CE2-CG 4.34Å; F87-Y91 AromaticContact CZ-CD1 3.87Å; F87-Y91 HydrophobicContact CZ-CD1 3.87Å; F87-Y91 AromaticContact CZ-CD2 3.8Å; F87-Y91 HydrophobicContact CZ-CD2 3.8Å; F87-Y91 HydrophobicContact CZ-CE1 4.37Å; F87-Y91 HydrophobicContact CZ-CE2 4.31Å; F87-Y91 AromaticContact CZ-CG 3.55Å; F87-Y91 HydrophobicContact CZ-CG 3.55Å; F87-Y91 WeakPolarHBondContact O-CB 3.25Å; F87-Y91 PolarHBondContact O-N 2.92Å; Y91-I278 HydrophobicContact CE1-CG2 4.02Å; Y91-I278 HydrophobicContact CE2-CG2 3.86Å; Y91-I278 VanDerWaalsContact CZ-CG2 3.47Å; Y91-I278 VanDerWaalsContact OH-CG2 3.27Å; Y91-I278 WeakPolarHBondContact OH-CG2 3.5Å; Y91-D282 PolarHBondContact OH-OD2 2.96Å; Y91-D282 VanDerWaalsContact OH-OD2 3.07Å; Y91-L343 HydrophobicContact CD2-CD2 4.26Å; Y91-L343 HydrophobicContact CE2-CD2 4.13Å; Y91-L346 HydrophobicContact CD2-CD2 3.72Å; Y91-L346 HydrophobicContact CG-CD2 4.2Å
92	T	86.3	Confident	90.7	Very high	58 Å²	58	51.4 Å²	51.4	36%	0.356	25%	0.25	S	C	.	.			trans	-136.1	151.1	175.2	-60.3	0	0	0	0	107.5	E96 F97	T92-E96 HydrophobicContact CG2-CB 3.81Å; T92-F97 HydrophobicContact CG2-CB 4.46Å
93	N	84	Confident	90.7	Very high	55 Å²	55	56.9 Å²	56.9	29%	0.294	27%	0.269	S	S	.	.			trans	-57.2	147.4	174.3	66.8	77.1	0	0	0	111.1	V95 E96 F97	N93-V95 VanDerWaalsContact C-N 3.29Å; N93-V95 PolarHBondContact O-N 3.49Å; N93-V95 PolarHBondContact OD1-N 3.29Å; N93-E96 WeakPolarHBondContact ND2-CG 3.36Å; N93-E96 PolarHBondContact ND2-OE2 3.3Å; N93-E96 PolarHBondContact O-N 3.19Å; N93-E96 VanDerWaalsContact OD1-CB 3.24Å; N93-E96 WeakPolarHBondContact OD1-CB 3.2Å; N93-E96 VanDerWaalsContact OD1-CG 3.29Å; N93-E96 WeakPolarHBondContact OD1-CG 3.27Å; N93-E96 PolarHBondContact OD1-N 3.01Å; N93-F97 WeakPolarHBondContact O-CB 3.46Å; N93-F97 PolarHBondContact O-N 2.93Å
94	R	87.1	Confident	90.6	Very high	53 Å²	53	59 Å²	59	20%	0.2	28%	0.282	C	S	.	.	H	α-helix	trans	-50.4	-44.2	-175.7	-178.9	178.2	170.7	79	12.9	113.7	L98 E289 E336	R94-L98 HydrophobicContact CG-CD1 4.22Å; R94-L98 VanDerWaalsContact O-CG 3.32Å; R94-L98 WeakPolarHBondContact O-CG 3.23Å; R94-L98 PolarHBondContact O-N 3.21Å; R94-E289 IonicContact CZ-OE1 3.04Å; R94-E289 IonicContact CZ-OE2 4Å; R94-E289 VanDerWaalsContact CZ-OE2 3.26Å; R94-E289 IonicContact NE-OE1 3.84Å; R94-E289 IonicContact NE-OE2 2.79Å; R94-E289 PolarHBondContact NE-OE2 3.48Å; R94-E289 IonicContact NH2-OE1 2.73Å; R94-E289 IonicContact NH2-OE2 2.72Å; R94-E289 PolarHBondContact NH2-OE2 3.48Å; R94-E336 IonicContact CZ-OE1 3.08Å; R94-E336 IonicContact CZ-OE2 3.45Å; R94-E336 VanDerWaalsContact NH1-CD 3.3Å; R94-E336 IonicContact NH1-OE1 3.34Å; R94-E336 PolarHBondContact NH1-OE1 2.69Å; R94-E336 IonicContact NH1-OE2 3.22Å; R94-E336 PolarHBondContact NH1-OE2 2.95Å; R94-E336 IonicContact NH2-OE1 3.36Å; R94-E336 PolarHBondContact NH2-OE1 3.27Å; R94-E336 IonicContact NH2-OE2 2.87Å
95	V	89	Confident	90.5	Very high	94 Å²	94	62.4 Å²	62.4	57%	0.57	30%	0.3	S	S	*	.	H	α-helix	trans	-67.9	-52.8	-175.9	178.6	0	0	0	0	110.9	N93 F97 L98 E99	N93-V95 VanDerWaalsContact C-N 3.29Å; N93-V95 PolarHBondContact O-N 3.49Å; N93-V95 PolarHBondContact OD1-N 3.29Å; V95-F97 VanDerWaalsContact C-N 3.29Å; V95-F97 PolarHBondContact O-N 3.42Å; V95-L98 PolarHBondContact O-N 3.2Å; V95-E99 HydrophobicContact CG1-CG 4.47Å; V95-E99 WeakPolarHBondContact O-CB 3.4Å; V95-E99 WeakPolarHBondContact O-CG 3.21Å; V95-E99 PolarHBondContact O-N 3.41Å
96	E	89	Confident	90.6	Very high	56 Å²	56	64.6 Å²	64.6	26%	0.262	31%	0.31	S	S	.	.	H	α-helix	trans	-63.8	-36	179.6	-71.4	-175.8	159.9	0	0	111.6	T92 N93 E100 R500	T92-E96 HydrophobicContact CG2-CB 3.81Å; N93-E96 WeakPolarHBondContact ND2-CG 3.36Å; N93-E96 PolarHBondContact ND2-OE2 3.3Å; N93-E96 PolarHBondContact O-N 3.19Å; N93-E96 VanDerWaalsContact OD1-CB 3.24Å; N93-E96 WeakPolarHBondContact OD1-CB 3.2Å; N93-E96 VanDerWaalsContact OD1-CG 3.29Å; N93-E96 WeakPolarHBondContact OD1-CG 3.27Å; N93-E96 PolarHBondContact OD1-N 3.01Å; E96-E100 WeakPolarHBondContact O-CB 3.3Å; E96-E100 PolarHBondContact O-N 3.18Å; E96-R500 IonicContact OE1-CZ 2.99Å; E96-R500 IonicContact OE1-NH1 3.83Å; E96-R500 PolarHBondContact OE1-NH1 2.97Å
97	F	90.5	Very high	90.7	Very high	51 Å²	51	65.7 Å²	65.7	22%	0.224	33%	0.326	C	S	.	.	H	α-helix	trans	-61.1	-49.2	174.8	174.8	-98.5	0	0	0	111.9	T92 N93 V95 E100 H101 I338 V339 V342	T92-F97 HydrophobicContact CG2-CB 4.46Å; N93-F97 WeakPolarHBondContact O-CB 3.46Å; N93-F97 PolarHBondContact O-N 2.93Å; V95-F97 VanDerWaalsContact C-N 3.29Å; V95-F97 PolarHBondContact O-N 3.42Å; F97-E100 PolarHBondContact O-N 2.9Å; F97-H101 WeakPolarHBondContact O-CB 3.46Å; F97-H101 PolarHBondContact O-N 2.65Å; F97-I338 HydrophobicContact CE1-CG2 3.91Å; F97-I338 HydrophobicContact CZ-CG2 3.83Å; F97-V339 HydrophobicContact CD1-CG2 4.03Å; F97-V339 HydrophobicContact CE1-CG2 4.01Å; F97-V342 HydrophobicContact CE2-CG2 4.15Å; F97-V342 HydrophobicContact CZ-CB 4.47Å; F97-V342 HydrophobicContact CZ-CG2 3.75Å
98	L	93.5	Very high	90.7	Very high	24 Å²	24	74.2 Å²	74.2	13%	0.126	36%	0.358	C	S	.	.	H	α-helix	trans	-68.4	-38.3	-179.4	-69.6	178.1	0	0	0	112.3	R94 V95 E100 H101 H102 D335 V339	R94-L98 HydrophobicContact CG-CD1 4.22Å; R94-L98 VanDerWaalsContact O-CG 3.32Å; R94-L98 WeakPolarHBondContact O-CG 3.23Å; R94-L98 PolarHBondContact O-N 3.21Å; V95-L98 PolarHBondContact O-N 3.2Å; L98-E100 PolarHBondContact O-N 2.91Å; L98-H101 PolarHBondContact O-N 2.94Å; L98-H102 PolarHBondContact O-N 3.21Å; L98-D335 HydrophobicContact CD1-CB 4.28Å; L98-D335 HydrophobicContact CD2-CB 3.63Å; L98-V339 HydrophobicContact CD2-CG2 3.91Å; L98-V339 HydrophobicContact CG-CG2 4.4Å
99	E	93.9	Very high	91	Very high	126 Å²	126	73.9 Å²	73.9	59%	0.589	36%	0.356	S	S	*	.	H	α-helix	trans	-60	-45.7	173.7	-75.4	-178.7	170.5	0	0	111.8	V95 R103	V95-E99 HydrophobicContact CG1-CG 4.47Å; V95-E99 WeakPolarHBondContact O-CB 3.4Å; V95-E99 WeakPolarHBondContact O-CG 3.21Å; V95-E99 PolarHBondContact O-N 3.41Å; E99-R103 WeakPolarHBondContact O-CB 3.34Å; E99-R103 PolarHBondContact O-N 3.19Å
100	E	92.2	Very high	91.4	Very high	74 Å²	74	70 Å²	70	35%	0.346	34%	0.342	S	S	.	.	H	α-helix	trans	-63.5	-44.4	175.9	-178.4	56.5	-143.1	0	0	111.4	E96 F97 L98 R103 V104	E96-E100 WeakPolarHBondContact O-CB 3.3Å; E96-E100 PolarHBondContact O-N 3.18Å; F97-E100 PolarHBondContact O-N 2.9Å; L98-E100 PolarHBondContact O-N 2.91Å; E100-R103 WeakPolarHBondContact O-CB 3.28Å; E100-R103 PolarHBondContact O-N 2.75Å; E100-R103 IonicContact OE1-CZ 3.26Å; E100-R103 IonicContact OE1-NE 3.99Å; E100-R103 PolarHBondContact OE1-NE 3.32Å; E100-R103 IonicContact OE1-NH2 3.34Å; E100-R103 PolarHBondContact OE1-NH2 3.44Å; E100-R103 IonicContact OE2-CZ 2.66Å; E100-R103 IonicContact OE2-NE 2.77Å; E100-R103 PolarHBondContact OE2-NE 2.96Å; E100-R103 IonicContact OE2-NH1 2.95Å; E100-R103 PolarHBondContact OE2-NH1 3.45Å; E100-R103 IonicContact OE2-NH2 2.77Å; E100-R103 PolarHBondContact OE2-NH2 2.96Å; E100-V104 WeakPolarHBondContact O-CG2 3.48Å; E100-V104 PolarHBondContact O-N 3.42Å; E100-V104 WeakPolarHBondContact OE1-CG2 3.42Å
101	H	93.1	Very high	91.7	Very high	42 Å²	42	70 Å²	70	19%	0.194	35%	0.348	C	S	.	.	H	α-helix	trans	-58	-50.7	177.5	173.8	-109.6	0	0	0	111.7	F97 L98 R103 V104 L105 D335 I338	F97-H101 WeakPolarHBondContact O-CB 3.46Å; F97-H101 PolarHBondContact O-N 2.65Å; L98-H101 PolarHBondContact O-N 2.94Å; H101-R103 VanDerWaalsContact C-N 3.33Å; H101-R103 PolarHBondContact O-N 3.28Å; H101-V104 PolarHBondContact O-N 3.26Å; H101-L105 WeakPolarHBondContact CE1-CD1 3.28Å; H101-L105 WeakPolarHBondContact O-CG 3.41Å; H101-L105 PolarHBondContact O-N 3.44Å; H101-D335 IonicContact ND1-OD1 3.05Å; H101-I338 WeakPolarHBondContact CE1-CD1 3.41Å; H101-I338 WeakPolarHBondContact NE2-CD1 3.36Å
102	H	94.3	Very high	91.9	Very high	69 Å²	69	69 Å²	69	32%	0.319	35%	0.348	S	S	.	.	H	α-helix	trans	-63.5	-37.6	177.1	-69.3	171.7	0	0	0	112.1	L98 V104 L105 E106 D335	L98-H102 PolarHBondContact O-N 3.21Å; H102-V104 PolarHBondContact O-N 2.91Å; H102-L105 PolarHBondContact O-N 3.21Å; H102-E106 WeakPolarHBondContact O-CB 3.44Å; H102-E106 WeakPolarHBondContact O-CG 3.48Å; H102-E106 PolarHBondContact O-N 3.21Å; H102-D335 IonicContact CD2-OD1 2.8Å; H102-D335 IonicContact CE1-OD1 2.86Å; H102-D335 IonicContact CE1-OD2 2.77Å; H102-D335 PolarHBondContact CE1-OD2 2.89Å; H102-D335 VanDerWaalsContact NE2-CG 3.27Å; H102-D335 IonicContact NE2-OD1 3.81Å; H102-D335 PolarHBondContact NE2-OD1 3.41Å; H102-D335 IonicContact NE2-OD2 2.76Å; H102-D335 PolarHBondContact NE2-OD2 3.11Å
103	R	95.5	Very high	92.3	Very high	161 Å²	161	67 Å²	67	61%	0.608	34%	0.335	S	S	*	.	H	α-helix	trans	-60.2	-45.5	174.4	-172.9	-173.8	80.2	-177.7	10.1	111.6	E99 E100 H101 E106 S107	E99-R103 WeakPolarHBondContact O-CB 3.34Å; E99-R103 PolarHBondContact O-N 3.19Å; E100-R103 WeakPolarHBondContact O-CB 3.28Å; E100-R103 PolarHBondContact O-N 2.75Å; E100-R103 IonicContact OE1-CZ 3.26Å; E100-R103 IonicContact OE1-NE 3.99Å; E100-R103 PolarHBondContact OE1-NE 3.32Å; E100-R103 IonicContact OE1-NH2 3.34Å; E100-R103 PolarHBondContact OE1-NH2 3.44Å; E100-R103 IonicContact OE2-CZ 2.66Å; E100-R103 IonicContact OE2-NE 2.77Å; E100-R103 PolarHBondContact OE2-NE 2.96Å; E100-R103 IonicContact OE2-NH1 2.95Å; E100-R103 PolarHBondContact OE2-NH1 3.45Å; E100-R103 IonicContact OE2-NH2 2.77Å; E100-R103 PolarHBondContact OE2-NH2 2.96Å; H101-R103 VanDerWaalsContact C-N 3.33Å; H101-R103 PolarHBondContact O-N 3.28Å; R103-E106 PolarHBondContact O-N 2.99Å; R103-S107 WeakPolarHBondContact O-CB 3.45Å; R103-S107 PolarHBondContact O-N 2.97Å
104	V	93.5	Very high	92.9	Very high	45 Å²	45	72.1 Å²	72.1	27%	0.273	35%	0.351	S	S	.	.	H	α-helix	trans	-63.5	-44.5	177.6	172.2	0	0	0	0	110.5	E100 H101 H102 S107 R108	E100-V104 WeakPolarHBondContact O-CG2 3.48Å; E100-V104 PolarHBondContact O-N 3.42Å; E100-V104 WeakPolarHBondContact OE1-CG2 3.42Å; H101-V104 PolarHBondContact O-N 3.26Å; H102-V104 PolarHBondContact O-N 2.91Å; V104-S107 PolarHBondContact O-N 3.37Å; V104-S107 PolarHBondContact O-OG 3.06Å; V104-R108 WeakPolarHBondContact O-CG 3.42Å; V104-R108 PolarHBondContact O-N 3.41Å
105	L	91.1	Very high	93.3	Very high	72 Å²	72	73.7 Å²	73.7	38%	0.377	36%	0.36	S	S	.	.	H	α-helix	trans	-59.9	-48.8	176.8	-72.8	-179	0	0	0	112.1	H101 H102 S107 R108 L109	H101-L105 WeakPolarHBondContact CE1-CD1 3.28Å; H101-L105 WeakPolarHBondContact O-CG 3.41Å; H101-L105 PolarHBondContact O-N 3.44Å; H102-L105 PolarHBondContact O-N 3.21Å; L105-S107 VanDerWaalsContact C-N 3.28Å; L105-S107 PolarHBondContact O-N 3.09Å; L105-R108 PolarHBondContact O-N 2.81Å; L105-L109 WeakPolarHBondContact O-CG 3.41Å; L105-L109 PolarHBondContact O-N 3.07Å; L105-L109 VanDerWaalsContact O-N 3.13Å
106	E	93.1	Very high	93.6	Very high	58 Å²	58	69.2 Å²	69.2	27%	0.271	33%	0.333	S	S	.	.	H	α-helix	trans	-63.4	-34.6	177.2	-69.8	-80	158.4	0	0	111.4	H102 R103 R108 L109 G110 R141 K185	H102-E106 WeakPolarHBondContact O-CB 3.44Å; H102-E106 WeakPolarHBondContact O-CG 3.48Å; H102-E106 PolarHBondContact O-N 3.21Å; R103-E106 PolarHBondContact O-N 2.99Å; E106-R108 PolarHBondContact O-N 2.88Å; E106-L109 PolarHBondContact O-N 3.45Å; E106-G110 PolarHBondContact O-N 3.45Å; E106-R141 IonicContact OE1-CZ 2.73Å; E106-R141 IonicContact OE1-NE 2.91Å; E106-R141 PolarHBondContact OE1-NE 3.38Å; E106-R141 IonicContact OE1-NH2 3.35Å; E106-R141 PolarHBondContact OE1-NH2 3.47Å; E106-K185 WeakPolarHBondContact OE2-CE 3.3Å; E106-K185 IonicContact OE2-NZ 2.6Å; E106-K185 PolarHBondContact OE2-NZ 3.37Å
107	S	94.7	Very high	93.9	Very high	81 Å²	81	66.7 Å²	66.7	57%	0.566	32%	0.321	S	S	*	.	H	α-helix	trans	-63.7	-38.9	174.8	83.5	0	0	0	0	112.7	R103 V104 L105 L109 G110	R103-S107 WeakPolarHBondContact O-CB 3.45Å; R103-S107 PolarHBondContact O-N 2.97Å; V104-S107 PolarHBondContact O-N 3.37Å; V104-S107 PolarHBondContact O-OG 3.06Å; L105-S107 VanDerWaalsContact C-N 3.28Å; L105-S107 PolarHBondContact O-N 3.09Å; S107-L109 VanDerWaalsContact C-N 3.31Å; S107-L109 PolarHBondContact O-N 2.85Å; S107-G110 PolarHBondContact O-N 2.65Å; S107-G110 VanDerWaalsContact O-N 3.07Å
108	R	92.6	Very high	94.1	Very high	185 Å²	185	68.1 Å²	68.1	70%	0.698	33%	0.331	S	S	*	.	H	α-helix	trans	-68.1	-32.5	177.4	-69.1	173.9	-179	-176	2.5	111.8	V104 L105 E106 G110	V104-R108 WeakPolarHBondContact O-CG 3.42Å; V104-R108 PolarHBondContact O-N 3.41Å; L105-R108 PolarHBondContact O-N 2.81Å; E106-R108 PolarHBondContact O-N 2.88Å; R108-G110 PolarHBondContact O-N 3.2Å
109	L	93.5	Very high	94.1	Very high	15 Å²	15	68.7 Å²	68.7	8%	0.079	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-8.5	173.1	-64	171.6	0	0	0	113.1	L105 E106 S107 S111 V112 T113 Y137 L140 R141	L105-L109 WeakPolarHBondContact O-CG 3.41Å; L105-L109 PolarHBondContact O-N 3.07Å; L105-L109 VanDerWaalsContact O-N 3.13Å; E106-L109 PolarHBondContact O-N 3.45Å; S107-L109 VanDerWaalsContact C-N 3.31Å; S107-L109 PolarHBondContact O-N 2.85Å; L109-S111 VanDerWaalsContact C-N 3.33Å; L109-S111 PolarHBondContact O-N 3.44Å; L109-V112 PolarHBondContact O-N 3.03Å; L109-T113 WeakPolarHBondContact O-CB 3.39Å; L109-T113 PolarHBondContact O-N 2.9Å; L109-T113 PolarHBondContact O-OG1 3.45Å; L109-Y137 HydrophobicContact CB-CE2 4.48Å; L109-L140 HydrophobicContact CD2-CB 3.55Å; L109-R141 HydrophobicContact CD1-CB 3.67Å; L109-R141 HydrophobicContact CD1-CG 3.73Å
110	G	93.6	Very high	93.9	Very high	22 Å²	22	70.9 Å²	70.9	23%	0.227	34%	0.337	C	S	.	.	H	α-helix	trans	-58.4	-38.7	-174.9	0	0	0	0	0	114	E106 S107 R108 R114	E106-G110 PolarHBondContact O-N 3.45Å; S107-G110 PolarHBondContact O-N 2.65Å; S107-G110 VanDerWaalsContact O-N 3.07Å; R108-G110 PolarHBondContact O-N 3.2Å; G110-R114 WeakPolarHBondContact O-CB 3.35Å; G110-R114 VanDerWaalsContact O-CG 3.26Å; G110-R114 WeakPolarHBondContact O-CG 3.27Å; G110-R114 PolarHBondContact O-N 2.89Å
111	S	94.2	Very high	93.7	Very high	76 Å²	76	67.7 Å²	67.7	53%	0.531	32%	0.324	S	S	.	.	H	α-helix	trans	-65.2	-52.9	178.2	-167.4	0	0	0	0	111.6	L109 T113 R114 E115	L109-S111 VanDerWaalsContact C-N 3.33Å; L109-S111 PolarHBondContact O-N 3.44Å; S111-T113 VanDerWaalsContact C-N 3.29Å; S111-T113 PolarHBondContact O-N 3.49Å; S111-R114 PolarHBondContact O-N 3.41Å; S111-E115 WeakPolarHBondContact O-CG 3.43Å; S111-E115 PolarHBondContact O-N 2.95Å
112	V	94.5	Very high	93.3	Very high	32 Å²	32	71.2 Å²	71.2	19%	0.194	35%	0.352	C	S	.	.	H	α-helix	trans	-61.1	-40.8	179.1	-177.8	0	0	0	0	110.8	L109 E115 I116 Y137 L140	L109-V112 PolarHBondContact O-N 3.03Å; V112-E115 PolarHBondContact O-N 3.2Å; V112-I116 HydrophobicContact CG1-CD1 4.07Å; V112-I116 WeakPolarHBondContact O-CD1 3.49Å; V112-I116 WeakPolarHBondContact O-CG1 3.32Å; V112-I116 PolarHBondContact O-N 3.29Å; V112-Y137 HydrophobicContact CG1-CD2 4.43Å; V112-L140 HydrophobicContact CG2-CD1 4.13Å
113	T	96.1	Very high	93.1	Very high	15 Å²	15	69.8 Å²	69.8	9%	0.092	35%	0.352	C	S	.	.	H	α-helix	trans	-60.2	-48.4	176.9	-54.4	0	0	0	0	111	L109 S111 E115 I116 T117 Y137 E181	L109-T113 WeakPolarHBondContact O-CB 3.39Å; L109-T113 PolarHBondContact O-N 2.9Å; L109-T113 PolarHBondContact O-OG1 3.45Å; S111-T113 VanDerWaalsContact C-N 3.29Å; S111-T113 PolarHBondContact O-N 3.49Å; T113-E115 PolarHBondContact O-N 3.3Å; T113-I116 PolarHBondContact O-N 2.82Å; T113-I116 VanDerWaalsContact O-N 3.16Å; T113-T117 HydrophobicContact CG2-CG2 4.11Å; T113-T117 WeakPolarHBondContact O-CG2 3.39Å; T113-T117 PolarHBondContact O-N 3.27Å; T113-T117 PolarHBondContact O-OG1 3.04Å; T113-Y137 WeakPolarHBondContact OG1-CE2 3.25Å; T113-E181 HydrophobicContact CG2-CG 3.93Å
114	R	95.3	Very high	92.8	Very high	164 Å²	164	69 Å²	69	62%	0.619	35%	0.353	S	S	*	.	H	α-helix	trans	-61.2	-42.7	178.2	-74.2	171.8	-177.1	-173.4	0.9	112.4	G110 S111 I116 T117 D118	G110-R114 WeakPolarHBondContact O-CB 3.35Å; G110-R114 VanDerWaalsContact O-CG 3.26Å; G110-R114 WeakPolarHBondContact O-CG 3.27Å; G110-R114 PolarHBondContact O-N 2.89Å; S111-R114 PolarHBondContact O-N 3.41Å; R114-I116 PolarHBondContact O-N 3.47Å; R114-T117 PolarHBondContact O-N 2.93Å; R114-T117 PolarHBondContact O-OG1 3.11Å; R114-D118 VanDerWaalsContact O-CB 3.24Å; R114-D118 WeakPolarHBondContact O-CB 3.38Å; R114-D118 PolarHBondContact O-N 2.76Å
115	E	95.4	Very high	92.6	Very high	86 Å²	86	73.3 Å²	73.3	40%	0.402	37%	0.37	S	S	.	.	H	α-helix	trans	-61	-26.6	177.4	-74.4	-177.3	-141	0	0	113.9	S111 V112 T113 N119 K133	S111-E115 WeakPolarHBondContact O-CG 3.43Å; S111-E115 PolarHBondContact O-N 2.95Å; V112-E115 PolarHBondContact O-N 3.2Å; T113-E115 PolarHBondContact O-N 3.3Å; E115-N119 WeakPolarHBondContact O-CB 3.37Å; E115-N119 PolarHBondContact O-ND2 3.1Å; E115-K133 HydrophobicContact CB-CD 4.21Å; E115-K133 WeakPolarHBondContact OE2-CE 3.38Å; E115-K133 IonicContact OE2-NZ 2.65Å; E115-K133 PolarHBondContact OE2-NZ 3.47Å
116	I	96.6	Very high	92.7	Very high	0 Å²	0	74.4 Å²	74.4	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-86.8	-48.4	176	-63.1	163.9	0	0	0	110.4	V112 T113 R114 D118 N119 L130 K133 I134 Y137 F172 L184	V112-I116 HydrophobicContact CG1-CD1 4.07Å; V112-I116 WeakPolarHBondContact O-CD1 3.49Å; V112-I116 WeakPolarHBondContact O-CG1 3.32Å; V112-I116 PolarHBondContact O-N 3.29Å; T113-I116 PolarHBondContact O-N 2.82Å; T113-I116 VanDerWaalsContact O-N 3.16Å; R114-I116 PolarHBondContact O-N 3.47Å; I116-D118 PolarHBondContact O-N 2.98Å; I116-N119 VanDerWaalsContact O-CB 3.32Å; I116-N119 WeakPolarHBondContact O-CB 3.44Å; I116-N119 PolarHBondContact O-N 3.19Å; I116-L130 HydrophobicContact CB-CD1 4.35Å; I116-L130 HydrophobicContact CG1-CD1 4.46Å; I116-L130 HydrophobicContact CG2-CD1 3.98Å; I116-K133 HydrophobicContact CD1-CB 4.28Å; I116-K133 HydrophobicContact CG1-CB 3.79Å; I116-I134 HydrophobicContact CD1-CG1 4.3Å; I116-I134 HydrophobicContact CG1-CG1 4.45Å; I116-I134 HydrophobicContact CG2-CD1 4.45Å; I116-I134 HydrophobicContact CG2-CG1 3.87Å; I116-Y137 HydrophobicContact CD1-CD2 4.5Å; I116-Y137 HydrophobicContact CD1-CG 4.17Å; I116-F172 HydrophobicContact CG2-CE1 3.86Å; I116-F172 HydrophobicContact CG2-CZ 3.83Å; I116-L184 HydrophobicContact CB-CD1 4.3Å; I116-L184 HydrophobicContact CD1-CD1 4.34Å; I116-L184 HydrophobicContact CG2-CD1 3.85Å; I116-L184 HydrophobicContact CG2-CD2 4.16Å
117	T	95.7	Very high	92.6	Very high	2 Å²	2	73.9 Å²	73.9	1%	0.012	37%	0.372	C	S	.	.	H	α-helix	trans	-68.3	-37.2	-174.2	60.6	0	0	0	0	112.8	T113 R114 N119 R120 K177 K180 E181	T113-T117 HydrophobicContact CG2-CG2 4.11Å; T113-T117 WeakPolarHBondContact O-CG2 3.39Å; T113-T117 PolarHBondContact O-N 3.27Å; T113-T117 PolarHBondContact O-OG1 3.04Å; R114-T117 PolarHBondContact O-N 2.93Å; R114-T117 PolarHBondContact O-OG1 3.11Å; T117-N119 VanDerWaalsContact C-N 3.32Å; T117-R120 PolarHBondContact O-NH1 3.36Å; T117-K177 HydrophobicContact CG2-CG 4.35Å; T117-K177 WeakPolarHBondContact OG1-CE 3.4Å; T117-K180 HydrophobicContact CG2-CB 4.04Å; T117-K180 PolarHBondContact O-NZ 2.93Å; T117-K180 VanDerWaalsContact O-NZ 3.17Å; T117-E181 HydrophobicContact CG2-CG 3.81Å
118	D	94	Very high	92.5	Very high	82 Å²	82	73.2 Å²	73.2	44%	0.439	36%	0.36	S	S	.	.	S	Bend	trans	-90.7	-4	-174.6	-54.3	-11.8	0	0	0	111.1	R114 I116 R120 K177	R114-D118 VanDerWaalsContact O-CB 3.24Å; R114-D118 WeakPolarHBondContact O-CB 3.38Å; R114-D118 PolarHBondContact O-N 2.76Å; I116-D118 PolarHBondContact O-N 2.98Å; D118-R120 PolarHBondContact O-NH1 3.37Å; D118-K177 IonicContact OD1-NZ 3.21Å; D118-K177 PolarHBondContact OD1-NZ 3.39Å; D118-K177 IonicContact OD2-NZ 3.19Å; D118-K177 PolarHBondContact OD2-NZ 3.2Å
119	N	92.5	Very high	92.6	Very high	35 Å²	35	67 Å²	67	19%	0.187	35%	0.345	C	S	.	.			trans	-61.4	145.7	176.5	-154.9	-68.5	0	0	0	112.4	E115 I116 T117 A121 L130	E115-N119 WeakPolarHBondContact O-CB 3.37Å; E115-N119 PolarHBondContact O-ND2 3.1Å; I116-N119 VanDerWaalsContact O-CB 3.32Å; I116-N119 WeakPolarHBondContact O-CB 3.44Å; I116-N119 PolarHBondContact O-N 3.19Å; T117-N119 VanDerWaalsContact C-N 3.32Å; N119-A121 VanDerWaalsContact OD1-CB 3.28Å; N119-A121 WeakPolarHBondContact OD1-CB 3.23Å; N119-A121 PolarHBondContact OD1-N 2.93Å; N119-L130 HydrophobicContact CB-CD1 3.81Å; N119-L130 HydrophobicContact CB-CD2 4.4Å
120	R	90.8	Very high	92.7	Very high	172 Å²	172	66.3 Å²	66.3	65%	0.649	34%	0.341	S	S	*	.			trans	-134.7	42.4	179.2	-62.3	-65.5	-177.6	-88.1	-2.2	111.2	T117 D118 C122	T117-R120 PolarHBondContact O-NH1 3.36Å; D118-R120 PolarHBondContact O-NH1 3.37Å; R120-C122 PolarHBondContact O-N 3.33Å
121	A	87.1	Confident	92.8	Very high	7 Å²	7	65.4 Å²	65.4	6%	0.058	33%	0.331	C	S	.	.			trans	-56.8	129.2	178	0	0	0	0	0	111.9	N119 E126 L127 L130 L173	N119-A121 VanDerWaalsContact OD1-CB 3.28Å; N119-A121 WeakPolarHBondContact OD1-CB 3.23Å; N119-A121 PolarHBondContact OD1-N 2.93Å; A121-E126 WeakPolarHBondContact CA-OE2 3.29Å; A121-E126 HydrophobicContact CB-CB 3.52Å; A121-L127 HydrophobicContact CB-CD2 3.94Å; A121-L127 HydrophobicContact CB-CG 4.26Å; A121-L130 HydrophobicContact CB-CD2 4.36Å; A121-L173 HydrophobicContact CB-CD1 4.44Å; A121-L173 VanDerWaalsContact O-CD1 3.3Å; A121-L173 WeakPolarHBondContact O-CD1 3.45Å
122	C	86.1	Confident	92.8	Very high	116 Å²	116	69.6 Å²	69.6	78%	0.784	34%	0.335	S	S	*	.			trans	-122.1	-34.4	175.5	-68.9	0	0	0	0	111.4	R120 E126	R120-C122 PolarHBondContact O-N 3.33Å; C122-E126 PolarHBondContact N-OE2 2.99Å
123	A	89.1	Confident	92.9	Very high	40 Å²	40	70.9 Å²	70.9	33%	0.331	34%	0.338	S	S	.	.	S	Bend	trans	-81.2	157.3	178.2	0	0	0	0	0	112	E125 E126 L127	A123-E125 VanDerWaalsContact C-N 3.32Å; A123-E125 PolarHBondContact O-N 3.1Å; A123-E126 HydrophobicContact CB-CB 4.43Å; A123-E126 HydrophobicContact CB-CG 4.04Å; A123-E126 PolarHBondContact N-OE2 3.47Å; A123-E126 WeakPolarHBondContact O-CB 3.3Å; A123-E126 PolarHBondContact O-N 2.94Å; A123-E126 VanDerWaalsContact O-N 3.17Å; A123-L127 WeakPolarHBondContact O-CG 3.48Å; A123-L127 PolarHBondContact O-N 3.08Å
124	K	89.2	Confident	92.9	Very high	145 Å²	145	70.2 Å²	70.2	63%	0.63	33%	0.334	S	S	*	.	H	α-helix	trans	-60.1	-43.4	-179.7	-174.3	-176.6	174.5	-172.6	0	111.6	E126 L127 E128	K124-E126 VanDerWaalsContact C-N 3.29Å; K124-E126 PolarHBondContact O-N 3.11Å; K124-L127 PolarHBondContact O-N 3.5Å; K124-E128 WeakPolarHBondContact CE-OE1 3.34Å; K124-E128 WeakPolarHBondContact O-CG 3.28Å; K124-E128 PolarHBondContact O-N 3Å
125	E	90.4	Very high	92.9	Very high	135 Å²	135	62.8 Å²	62.8	63%	0.631	31%	0.307	S	S	*	.	H	α-helix	trans	-64.6	-34.9	178.8	-62.2	74	-161.6	0	0	111.7	A123 S129	A123-E125 VanDerWaalsContact C-N 3.32Å; A123-E125 PolarHBondContact O-N 3.1Å; E125-S129 WeakPolarHBondContact O-CB 3.35Å; E125-S129 PolarHBondContact O-N 3.31Å
126	E	91.7	Very high	92.9	Very high	95 Å²	95	60.8 Å²	60.8	44%	0.444	30%	0.302	S	S	.	.	H	α-helix	trans	-70.5	-39.4	176.2	-64.2	176.4	157.7	0	0	111.7	A121 C122 A123 K124 S129 L130	A121-E126 WeakPolarHBondContact CA-OE2 3.29Å; A121-E126 HydrophobicContact CB-CB 3.52Å; C122-E126 PolarHBondContact N-OE2 2.99Å; A123-E126 HydrophobicContact CB-CB 4.43Å; A123-E126 HydrophobicContact CB-CG 4.04Å; A123-E126 PolarHBondContact N-OE2 3.47Å; A123-E126 WeakPolarHBondContact O-CB 3.3Å; A123-E126 PolarHBondContact O-N 2.94Å; A123-E126 VanDerWaalsContact O-N 3.17Å; K124-E126 VanDerWaalsContact C-N 3.29Å; K124-E126 PolarHBondContact O-N 3.11Å; E126-S129 WeakPolarHBondContact O-CB 3.5Å; E126-S129 PolarHBondContact O-N 3.41Å; E126-L130 WeakPolarHBondContact O-CB 3.44Å; E126-L130 PolarHBondContact O-N 3.46Å
127	L	92.2	Very high	92.9	Very high	47 Å²	47	60.9 Å²	60.9	25%	0.246	30%	0.302	C	S	.	.	H	α-helix	trans	-65.1	-41.4	174.7	-70.3	171	0	0	0	111.5	A121 A123 K124 S129 L130 Y131 L169 L173	A121-L127 HydrophobicContact CB-CD2 3.94Å; A121-L127 HydrophobicContact CB-CG 4.26Å; A123-L127 WeakPolarHBondContact O-CG 3.48Å; A123-L127 PolarHBondContact O-N 3.08Å; K124-L127 PolarHBondContact O-N 3.5Å; L127-S129 VanDerWaalsContact C-N 3.34Å; L127-L130 PolarHBondContact O-N 2.86Å; L127-Y131 WeakPolarHBondContact O-CB 3.41Å; L127-Y131 PolarHBondContact O-N 3.38Å; L127-L169 HydrophobicContact CB-CD1 4.02Å; L127-L169 HydrophobicContact CD2-CB 3.97Å; L127-L169 HydrophobicContact CD2-CD1 4.16Å; L127-L169 WeakPolarHBondContact O-CD1 3.42Å; L127-L173 HydrophobicContact CD2-CD1 3.8Å
128	E	92.9	Very high	92.9	Very high	66 Å²	66	60.8 Å²	60.8	31%	0.308	30%	0.302	S	S	.	.	H	α-helix	trans	-62.2	-42.1	173.6	-73.4	-179.3	-165.5	0	0	111.7	K124 Y131 R132	K124-E128 WeakPolarHBondContact CE-OE1 3.34Å; K124-E128 WeakPolarHBondContact O-CG 3.28Å; K124-E128 PolarHBondContact O-N 3Å; E128-Y131 PolarHBondContact O-N 3.37Å; E128-R132 WeakPolarHBondContact O-CG 3.43Å; E128-R132 PolarHBondContact O-N 3.2Å
129	S	93.9	Very high	93	Very high	55 Å²	55	56.9 Å²	56.9	39%	0.385	28%	0.281	S	S	.	.	H	α-helix	trans	-62.6	-45.1	174.9	-175.8	0	0	0	0	112	E125 E126 L127 Y131 R132 K133	E125-S129 WeakPolarHBondContact O-CB 3.35Å; E125-S129 PolarHBondContact O-N 3.31Å; E126-S129 WeakPolarHBondContact O-CB 3.5Å; E126-S129 PolarHBondContact O-N 3.41Å; L127-S129 VanDerWaalsContact C-N 3.34Å; S129-Y131 VanDerWaalsContact C-N 3.34Å; S129-Y131 PolarHBondContact O-N 3.14Å; S129-R132 WeakPolarHBondContact O-CB 3.25Å; S129-R132 PolarHBondContact O-N 3.27Å; S129-K133 PolarHBondContact O-N 3.34Å
130	L	95.4	Very high	93	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-59.6	-44.3	175	177.6	58.5	0	0	0	111.4	I116 N119 A121 E126 L127 R132 K133 I134 L169 L173	I116-L130 HydrophobicContact CB-CD1 4.35Å; I116-L130 HydrophobicContact CG1-CD1 4.46Å; I116-L130 HydrophobicContact CG2-CD1 3.98Å; N119-L130 HydrophobicContact CB-CD1 3.81Å; N119-L130 HydrophobicContact CB-CD2 4.4Å; A121-L130 HydrophobicContact CB-CD2 4.36Å; E126-L130 WeakPolarHBondContact O-CB 3.44Å; E126-L130 PolarHBondContact O-N 3.46Å; L127-L130 PolarHBondContact O-N 2.86Å; L130-R132 VanDerWaalsContact C-N 3.32Å; L130-R132 PolarHBondContact O-N 2.94Å; L130-K133 WeakPolarHBondContact O-CB 3.23Å; L130-K133 PolarHBondContact O-N 2.67Å; L130-K133 VanDerWaalsContact O-N 3.09Å; L130-I134 HydrophobicContact CG-CD1 4.41Å; L130-I134 WeakPolarHBondContact O-CG1 3.38Å; L130-I134 PolarHBondContact O-N 2.86Å; L130-L169 HydrophobicContact CD2-CD2 4.19Å; L130-L169 HydrophobicContact CG-CD2 4.33Å; L130-L173 HydrophobicContact CD2-CD1 4.42Å; L130-L173 HydrophobicContact CD2-CD2 3.77Å; L130-L173 HydrophobicContact CD2-CG 4.22Å
131	Y	96	Very high	93.2	Very high	4 Å²	4	54.6 Å²	54.6	2%	0.016	28%	0.276	C	S	.	.	H	α-helix	trans	-61.3	-40.3	177.7	-158.9	-96.2	0	0	0	112.1	L127 E128 S129 K133 I134 I135 L160 Q161 F164 Q166 L169	L127-Y131 WeakPolarHBondContact O-CB 3.41Å; L127-Y131 PolarHBondContact O-N 3.38Å; E128-Y131 PolarHBondContact O-N 3.37Å; S129-Y131 VanDerWaalsContact C-N 3.34Å; S129-Y131 PolarHBondContact O-N 3.14Å; Y131-K133 VanDerWaalsContact C-N 3.32Å; Y131-K133 PolarHBondContact O-N 3.29Å; Y131-I134 PolarHBondContact O-N 3.3Å; Y131-I135 HydrophobicContact CD1-CD1 3.58Å; Y131-I135 HydrophobicContact CD1-CG1 4.21Å; Y131-I135 HydrophobicContact CE1-CD1 3.73Å; Y131-I135 HydrophobicContact CE1-CG1 4.17Å; Y131-I135 WeakPolarHBondContact O-CG1 3.29Å; Y131-I135 PolarHBondContact O-N 3.02Å; Y131-L160 HydrophobicContact CE1-CD2 4.08Å; Y131-L160 HydrophobicContact CE2-CD2 4.21Å; Y131-L160 WeakPolarHBondContact OH-CG 3.39Å; Y131-Q161 HydrophobicContact CE1-CG 4.04Å; Y131-Q161 WeakPolarHBondContact OH-CA 3.4Å; Y131-Q161 WeakPolarHBondContact OH-CG 3.39Å; Y131-Q161 PolarHBondContact OH-N 3.5Å; Y131-F164 AromaticContact CE2-CD1 3.96Å; Y131-F164 HydrophobicContact CE2-CD1 3.96Å; Y131-F164 HydrophobicContact CE2-CE1 4.22Å; Y131-F164 PolarHBondContact OH-O 2.88Å; Y131-Q166 HydrophobicContact CD1-CG 4.21Å; Y131-Q166 HydrophobicContact CD2-CG 3.73Å; Y131-Q166 HydrophobicContact CE1-CG 4.31Å; Y131-Q166 HydrophobicContact CE2-CG 3.83Å; Y131-Q166 HydrophobicContact CG-CG 3.92Å; Y131-L169 HydrophobicContact CD2-CD1 3.94Å; Y131-L169 HydrophobicContact CD2-CD2 4.12Å; Y131-L169 HydrophobicContact CD2-CG 4.14Å
132	R	94.2	Very high	93.6	Very high	164 Å²	164	54.6 Å²	54.6	62%	0.619	28%	0.276	S	S	*	.	H	α-helix	trans	-61.4	-39.1	173	-69.9	177.5	-165.5	164.4	8.6	112	E128 S129 L130 I135 S136	E128-R132 WeakPolarHBondContact O-CG 3.43Å; E128-R132 PolarHBondContact O-N 3.2Å; S129-R132 WeakPolarHBondContact O-CB 3.25Å; S129-R132 PolarHBondContact O-N 3.27Å; L130-R132 VanDerWaalsContact C-N 3.32Å; L130-R132 PolarHBondContact O-N 2.94Å; R132-I135 PolarHBondContact O-N 2.98Å; R132-S136 PolarHBondContact O-N 3.28Å; R132-S136 PolarHBondContact O-OG 3.31Å
133	K	95.4	Very high	93.8	Very high	59 Å²	59	51.4 Å²	51.4	26%	0.257	26%	0.262	S	S	.	.	H	α-helix	trans	-64.2	-39.7	174.5	-65.5	-174.4	-176.4	-158.3	0	112.1	E115 I116 S129 L130 Y131 S136 Y137	E115-K133 HydrophobicContact CB-CD 4.21Å; E115-K133 WeakPolarHBondContact OE2-CE 3.38Å; E115-K133 IonicContact OE2-NZ 2.65Å; E115-K133 PolarHBondContact OE2-NZ 3.47Å; I116-K133 HydrophobicContact CD1-CB 4.28Å; I116-K133 HydrophobicContact CG1-CB 3.79Å; S129-K133 PolarHBondContact O-N 3.34Å; L130-K133 WeakPolarHBondContact O-CB 3.23Å; L130-K133 PolarHBondContact O-N 2.67Å; L130-K133 VanDerWaalsContact O-N 3.09Å; Y131-K133 VanDerWaalsContact C-N 3.32Å; Y131-K133 PolarHBondContact O-N 3.29Å; K133-S136 PolarHBondContact O-N 3.05Å; K133-Y137 PolarHBondContact O-N 2.9Å
134	I	96.8	Very high	94	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62	-44.4	174.5	-63.6	171.6	0	0	0	110.5	I116 L130 Y131 S136 Y137 V138 L160 F164 L169 L184	I116-I134 HydrophobicContact CD1-CG1 4.3Å; I116-I134 HydrophobicContact CG1-CG1 4.45Å; I116-I134 HydrophobicContact CG2-CD1 4.45Å; I116-I134 HydrophobicContact CG2-CG1 3.87Å; L130-I134 HydrophobicContact CG-CD1 4.41Å; L130-I134 WeakPolarHBondContact O-CG1 3.38Å; L130-I134 PolarHBondContact O-N 2.86Å; Y131-I134 PolarHBondContact O-N 3.3Å; I134-S136 VanDerWaalsContact C-N 3.34Å; I134-S136 PolarHBondContact O-N 2.86Å; I134-Y137 WeakPolarHBondContact O-CB 3.1Å; I134-Y137 PolarHBondContact O-N 2.93Å; I134-V138 HydrophobicContact CG2-CG2 4.42Å; I134-V138 WeakPolarHBondContact O-CG2 3.5Å; I134-V138 PolarHBondContact O-N 3.16Å; I134-L160 HydrophobicContact CG2-CD2 3.78Å; I134-F164 HydrophobicContact CD1-CE1 4.11Å; I134-L169 HydrophobicContact CD1-CD2 3.73Å; I134-L184 HydrophobicContact CG1-CD2 4.14Å; I134-L184 HydrophobicContact CG2-CD2 3.96Å
135	I	96.2	Very high	93.9	Very high	9 Å²	9	44 Å²	44	5%	0.046	23%	0.231	C	C	.	.	H	α-helix	trans	-58.2	-46.8	174.6	-68.5	158.6	0	0	0	110.9	Y131 R132 Y137 V138 L139 V153 V156 T157 L160	Y131-I135 HydrophobicContact CD1-CD1 3.58Å; Y131-I135 HydrophobicContact CD1-CG1 4.21Å; Y131-I135 HydrophobicContact CE1-CD1 3.73Å; Y131-I135 HydrophobicContact CE1-CG1 4.17Å; Y131-I135 WeakPolarHBondContact O-CG1 3.29Å; Y131-I135 PolarHBondContact O-N 3.02Å; R132-I135 PolarHBondContact O-N 2.98Å; I135-Y137 VanDerWaalsContact C-N 3.34Å; I135-Y137 PolarHBondContact O-N 3.45Å; I135-V138 PolarHBondContact O-N 2.9Å; I135-L139 HydrophobicContact CG2-CD1 4.01Å; I135-L139 PolarHBondContact O-N 3.22Å; I135-V153 HydrophobicContact CG2-CG1 4.26Å; I135-V156 HydrophobicContact CG2-CB 4.44Å; I135-V156 HydrophobicContact CG2-CG1 3.89Å; I135-T157 HydrophobicContact CD1-CG2 4.07Å; I135-T157 VanDerWaalsContact CD1-OG1 3.31Å; I135-T157 WeakPolarHBondContact CD1-OG1 3.23Å; I135-L160 HydrophobicContact CG1-CD2 3.9Å
136	S	94.8	Very high	93.8	Very high	43 Å²	43	39.9 Å²	39.9	30%	0.301	22%	0.216	S	C	.	.	H	α-helix	trans	-60.8	-41.1	176.6	-63.5	0	0	0	0	112.4	R132 K133 I134 L139 L140	R132-S136 PolarHBondContact O-N 3.28Å; R132-S136 PolarHBondContact O-OG 3.31Å; K133-S136 PolarHBondContact O-N 3.05Å; I134-S136 VanDerWaalsContact C-N 3.34Å; I134-S136 PolarHBondContact O-N 2.86Å; S136-L139 PolarHBondContact O-N 3.08Å; S136-L140 WeakPolarHBondContact O-CB 3.33Å; S136-L140 VanDerWaalsContact O-CG 3.22Å; S136-L140 WeakPolarHBondContact O-CG 3.32Å; S136-L140 PolarHBondContact O-N 2.99Å
137	Y	96.3	Very high	93.6	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.008	21%	0.21	C	C	.	.	H	α-helix	trans	-61.1	-47.2	174.3	173	-89.9	0	0	0	111.9	L109 V112 T113 I116 K133 I134 I135 L139 L140 R141 L184 T188	L109-Y137 HydrophobicContact CB-CE2 4.48Å; V112-Y137 HydrophobicContact CG1-CD2 4.43Å; T113-Y137 WeakPolarHBondContact OG1-CE2 3.25Å; I116-Y137 HydrophobicContact CD1-CD2 4.5Å; I116-Y137 HydrophobicContact CD1-CG 4.17Å; K133-Y137 PolarHBondContact O-N 2.9Å; I134-Y137 WeakPolarHBondContact O-CB 3.1Å; I134-Y137 PolarHBondContact O-N 2.93Å; I135-Y137 VanDerWaalsContact C-N 3.34Å; I135-Y137 PolarHBondContact O-N 3.45Å; Y137-L139 VanDerWaalsContact C-N 3.32Å; Y137-L139 PolarHBondContact O-N 3.44Å; Y137-L140 PolarHBondContact O-N 3.37Å; Y137-R141 HydrophobicContact CE1-CB 4.44Å; Y137-R141 VanDerWaalsContact O-CB 3.25Å; Y137-R141 WeakPolarHBondContact O-CB 3.42Å; Y137-R141 PolarHBondContact O-N 2.89Å; Y137-R141 WeakPolarHBondContact OH-CD 3.22Å; Y137-L184 HydrophobicContact CD1-CB 4.12Å; Y137-L184 HydrophobicContact CD1-CD2 4.24Å; Y137-L184 HydrophobicContact CE1-CB 3.57Å; Y137-L184 HydrophobicContact CE1-CG 4.43Å; Y137-T188 WeakPolarHBondContact CE1-OG1 3.23Å
138	V	96.5	Very high	93.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-60.2	-43	179	170.5	0	0	0	0	110.8	I134 I135 S142 V156 V191	I134-V138 HydrophobicContact CG2-CG2 4.42Å; I134-V138 WeakPolarHBondContact O-CG2 3.5Å; I134-V138 PolarHBondContact O-N 3.16Å; I135-V138 PolarHBondContact O-N 2.9Å; V138-S142 VanDerWaalsContact O-CB 3.23Å; V138-S142 WeakPolarHBondContact O-CB 3.38Å; V138-S142 PolarHBondContact O-N 3.41Å; V138-S142 PolarHBondContact O-OG 2.73Å; V138-V156 HydrophobicContact CB-CG1 4.24Å; V138-V156 HydrophobicContact CG1-CG1 3.84Å; V138-V191 HydrophobicContact CG1-CB 3.93Å; V138-V191 HydrophobicContact CG1-CG1 3.71Å; V138-V191 HydrophobicContact CG1-CG2 4.45Å
139	L	94.6	Very high	93.5	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-63.2	-52.8	175.8	-80.8	166.1	0	0	0	112.4	I135 S136 Y137 R141 S142 G143 P147 T152 V153 V156	I135-L139 HydrophobicContact CG2-CD1 4.01Å; I135-L139 PolarHBondContact O-N 3.22Å; S136-L139 PolarHBondContact O-N 3.08Å; Y137-L139 VanDerWaalsContact C-N 3.32Å; Y137-L139 PolarHBondContact O-N 3.44Å; L139-R141 VanDerWaalsContact C-N 3.3Å; L139-R141 PolarHBondContact O-N 2.93Å; L139-S142 PolarHBondContact O-N 2.9Å; L139-S142 PolarHBondContact O-OG 3.47Å; L139-G143 PolarHBondContact O-N 3.22Å; L139-G143 VanDerWaalsContact O-N 3.08Å; L139-P147 HydrophobicContact CB-CG 4.13Å; L139-P147 HydrophobicContact CD1-CB 4.45Å; L139-T152 HydrophobicContact CD2-CG2 3.39Å; L139-V153 HydrophobicContact CD1-CG2 3.75Å; L139-V156 HydrophobicContact CD2-CB 4.34Å; L139-V156 HydrophobicContact CD2-CG2 3.48Å; L139-V156 VanDerWaalsContact CD2-CG2 3.48Å; L139-V156 HydrophobicContact CG-CB 4.29Å; L139-V156 HydrophobicContact CG-CG1 4.25Å; L139-V156 HydrophobicContact CG-CG2 3.87Å
140	L	94.1	Very high	93.4	Very high	88 Å²	88	43.6 Å²	43.6	46%	0.461	24%	0.243	S	C	.	.	H	α-helix	trans	-63.7	-36.3	-177.5	-70.2	170.4	0	0	0	112.4	L109 V112 S136 Y137 P147	L109-L140 HydrophobicContact CD2-CB 3.55Å; V112-L140 HydrophobicContact CG2-CD1 4.13Å; S136-L140 WeakPolarHBondContact O-CB 3.33Å; S136-L140 VanDerWaalsContact O-CG 3.22Å; S136-L140 WeakPolarHBondContact O-CG 3.32Å; S136-L140 PolarHBondContact O-N 2.99Å; Y137-L140 PolarHBondContact O-N 3.37Å; L140-P147 HydrophobicContact CD2-CG 3.78Å; L140-P147 HydrophobicContact CG-CG 3.96Å
141	R	95.1	Very high	93.3	Very high	71 Å²	71	49.5 Å²	49.5	27%	0.268	27%	0.269	S	S	.	.	H	α-helix	trans	-78.7	-36.9	-179.9	-173.3	171	-171.4	-86.8	-8.2	113.4	E106 L109 Y137 L139 G143 T188	E106-R141 IonicContact OE1-CZ 2.73Å; E106-R141 IonicContact OE1-NE 2.91Å; E106-R141 PolarHBondContact OE1-NE 3.38Å; E106-R141 IonicContact OE1-NH2 3.35Å; E106-R141 PolarHBondContact OE1-NH2 3.47Å; L109-R141 HydrophobicContact CD1-CB 3.67Å; L109-R141 HydrophobicContact CD1-CG 3.73Å; Y137-R141 HydrophobicContact CE1-CB 4.44Å; Y137-R141 VanDerWaalsContact O-CB 3.25Å; Y137-R141 WeakPolarHBondContact O-CB 3.42Å; Y137-R141 PolarHBondContact O-N 2.89Å; Y137-R141 WeakPolarHBondContact OH-CD 3.22Å; L139-R141 VanDerWaalsContact C-N 3.3Å; L139-R141 PolarHBondContact O-N 2.93Å; R141-G143 VanDerWaalsContact C-N 3.32Å; R141-T188 HydrophobicContact CB-CG2 3.98Å; R141-T188 HydrophobicContact CG-CG2 4.02Å
142	S	94.6	Very high	93.2	Very high	7 Å²	7	49.3 Å²	49.3	5%	0.049	27%	0.269	C	S	.	.	H	α-helix	trans	-73.4	-26	177.9	61	0	0	0	0	112.8	V138 L139 L144 T192 Q334	V138-S142 VanDerWaalsContact O-CB 3.23Å; V138-S142 WeakPolarHBondContact O-CB 3.38Å; V138-S142 PolarHBondContact O-N 3.41Å; V138-S142 PolarHBondContact O-OG 2.73Å; L139-S142 PolarHBondContact O-N 2.9Å; L139-S142 PolarHBondContact O-OG 3.47Å; S142-L144 PolarHBondContact O-N 3.22Å; S142-T192 VanDerWaalsContact CB-OG1 3.23Å; S142-T192 WeakPolarHBondContact CB-OG1 3.4Å; S142-Q334 PolarHBondContact O-NE2 3.46Å
143	G	91.6	Very high	93.2	Very high	48 Å²	48	43.5 Å²	43.5	50%	0.495	25%	0.251	S	S	.	.			trans	66	13.4	-175.4	0	0	0	0	0	113.6	L139 R141 G145	L139-G143 PolarHBondContact O-N 3.22Å; L139-G143 VanDerWaalsContact O-N 3.08Å; R141-G143 VanDerWaalsContact C-N 3.32Å; G143-G145 VanDerWaalsContact C-N 3.34Å; G143-G145 PolarHBondContact O-N 2.91Å
144	L	91.4	Very high	93.2	Very high	3 Å²	3	49.6 Å²	49.6	2%	0.016	27%	0.272	C	S	.	.	S	Bend	trans	-90.8	61.6	-177.5	-64.6	-168.4	0	0	0	111.6	S142 T152 T192 R195 L196 I208	S142-L144 PolarHBondContact O-N 3.22Å; L144-T152 WeakPolarHBondContact O-CG2 3.49Å; L144-T192 HydrophobicContact CD1-CG2 3.58Å; L144-T192 HydrophobicContact CG-CG2 4.33Å; L144-R195 HydrophobicContact CD1-CB 4.48Å; L144-R195 PolarHBondContact O-NH1 3.03Å; L144-R195 PolarHBondContact O-NH2 3.2Å; L144-L196 HydrophobicContact CD1-CD2 4.44Å; L144-L196 HydrophobicContact CD1-CG 4.41Å; L144-I208 HydrophobicContact CB-CD1 4.5Å; L144-I208 HydrophobicContact CB-CG1 4.17Å; L144-I208 HydrophobicContact CD1-CD1 3.94Å; L144-I208 HydrophobicContact CD1-CG1 4.41Å; L144-I208 HydrophobicContact CD2-CG1 4.29Å; L144-I208 HydrophobicContact CD2-CG2 4.1Å
145	G	88.5	Confident	93.1	Very high	28 Å²	28	50.8 Å²	50.8	29%	0.289	28%	0.278	S	S	.	.	S	Bend	trans	98.9	-179.5	179.4	0	0	0	0	0	114.5	G143	G143-G145 VanDerWaalsContact C-N 3.34Å; G143-G145 PolarHBondContact O-N 2.91Å
146	S	88.7	Confident	93.1	Very high	47 Å²	47	50.4 Å²	50.4	33%	0.329	28%	0.276	S	S	.	.			trans	-98.5	138.8	-167.3	-176.9	0	0	0	0	112.9	T148 D149	S146-T148 PolarHBondContact O-N 2.85Å; S146-T148 VanDerWaalsContact O-N 3.09Å; S146-T148 PolarHBondContact OG-N 2.97Å; S146-T148 VanDerWaalsContact OG-N 3.09Å; S146-T148 PolarHBondContact OG-OG1 2.62Å; S146-D149 PolarHBondContact O-N 2.86Å
147	P	87.5	Confident	93.1	Very high	50 Å²	50	49.8 Å²	49.8	33%	0.325	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-15	165.4	-22.1	33	0	0	0	114.6	L139 L140 V153	L139-P147 HydrophobicContact CB-CG 4.13Å; L139-P147 HydrophobicContact CD1-CB 4.45Å; L140-P147 HydrophobicContact CD2-CG 3.78Å; L140-P147 HydrophobicContact CG-CG 3.96Å; P147-V153 WeakPolarHBondContact O-CG2 3.22Å
148	T	89.2	Confident	93.1	Very high	125 Å²	125	52.5 Å²	52.5	77%	0.767	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-16.4	176	62.8	0	0	0	0	113.5	S146	S146-T148 PolarHBondContact O-N 2.85Å; S146-T148 VanDerWaalsContact O-N 3.09Å; S146-T148 PolarHBondContact OG-N 2.97Å; S146-T148 VanDerWaalsContact OG-N 3.09Å; S146-T148 PolarHBondContact OG-OG1 2.62Å
149	D	92.1	Very high	93	Very high	51 Å²	51	52.7 Å²	52.7	27%	0.273	30%	0.295	S	S	.	.			trans	-87	115.8	178.1	174.3	34.7	0	0	0	111.3	S146 K151 T152 V153	S146-D149 PolarHBondContact O-N 2.86Å; D149-K151 VanDerWaalsContact C-N 3.28Å; D149-K151 PolarHBondContact O-N 3.08Å; D149-K151 PolarHBondContact OD1-N 3.21Å; D149-T152 PolarHBondContact O-N 3.47Å; D149-T152 VanDerWaalsContact OD2-CB 3.32Å; D149-T152 WeakPolarHBondContact OD2-CB 3.45Å; D149-T152 PolarHBondContact OD2-N 2.87Å; D149-T152 PolarHBondContact OD2-OG1 3.42Å; D149-V153 VanDerWaalsContact O-CG2 3.29Å; D149-V153 WeakPolarHBondContact O-CG2 3.35Å; D149-V153 PolarHBondContact O-N 3.02Å
150	I	92.7	Very high	93.2	Very high	115 Å²	115	52.7 Å²	52.7	59%	0.59	30%	0.295	S	S	*	.	H	α-helix	trans	-60.7	-36.9	-177	-61	172.6	0	0	0	111.5	R154	I150-R154 HydrophobicContact CG2-CG 4.48Å; I150-R154 WeakPolarHBondContact O-CB 3.4Å; I150-R154 VanDerWaalsContact O-CG 3.3Å; I150-R154 WeakPolarHBondContact O-CG 3.23Å; I150-R154 PolarHBondContact O-N 3.45Å
151	K	93	Very high	93.3	Very high	124 Å²	124	52.5 Å²	52.5	54%	0.539	29%	0.292	S	S	.	.	H	α-helix	trans	-67	-49.3	-180	-67.5	-177.9	-172.6	176.2	0	110.7	D149 V153 R154 E155 E206	D149-K151 VanDerWaalsContact C-N 3.28Å; D149-K151 PolarHBondContact O-N 3.08Å; D149-K151 PolarHBondContact OD1-N 3.21Å; K151-V153 VanDerWaalsContact C-N 3.33Å; K151-V153 PolarHBondContact O-N 3.48Å; K151-R154 PolarHBondContact O-N 2.85Å; K151-E155 PolarHBondContact O-N 3.15Å; K151-E206 HydrophobicContact CB-CG 4.26Å; K151-E206 HydrophobicContact CD-CG 4.01Å; K151-E206 WeakPolarHBondContact CD-OE1 3.48Å; K151-E206 IonicContact NZ-OE1 2.77Å; K151-E206 PolarHBondContact NZ-OE1 3.25Å
152	T	93.9	Very high	93.2	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.006	31%	0.307	C	S	.	.	H	α-helix	trans	-57.9	-44.7	175.8	-58.4	0	0	0	0	111.3	L139 L144 D149 R154 E155 V156	L139-T152 HydrophobicContact CD2-CG2 3.39Å; L144-T152 WeakPolarHBondContact O-CG2 3.49Å; D149-T152 PolarHBondContact O-N 3.47Å; D149-T152 VanDerWaalsContact OD2-CB 3.32Å; D149-T152 WeakPolarHBondContact OD2-CB 3.45Å; D149-T152 PolarHBondContact OD2-N 2.87Å; D149-T152 PolarHBondContact OD2-OG1 3.42Å; T152-R154 PolarHBondContact O-N 3.44Å; T152-E155 PolarHBondContact O-N 3.33Å; T152-V156 PolarHBondContact O-N 3.44Å
153	V	94.9	Very high	93.2	Very high	42 Å²	42	54.4 Å²	54.4	26%	0.255	31%	0.313	S	S	.	.	H	α-helix	trans	-61.5	-42.5	177.1	171.7	0	0	0	0	111.8	I135 L139 P147 D149 K151 T157	I135-V153 HydrophobicContact CG2-CG1 4.26Å; L139-V153 HydrophobicContact CD1-CG2 3.75Å; P147-V153 WeakPolarHBondContact O-CG2 3.22Å; D149-V153 VanDerWaalsContact O-CG2 3.29Å; D149-V153 WeakPolarHBondContact O-CG2 3.35Å; D149-V153 PolarHBondContact O-N 3.02Å; K151-V153 VanDerWaalsContact C-N 3.33Å; K151-V153 PolarHBondContact O-N 3.48Å; V153-T157 VanDerWaalsContact O-CB 3.3Å; V153-T157 WeakPolarHBondContact O-CB 3.43Å; V153-T157 PolarHBondContact O-N 3.27Å; V153-T157 PolarHBondContact O-OG1 3.34Å
154	R	94.6	Very high	93.4	Very high	186 Å²	186	52.4 Å²	52.4	70%	0.702	29%	0.291	S	S	*	.	H	α-helix	trans	-63.8	-42.1	176.9	-76.8	176.4	178.7	-170.7	0.6	112	I150 K151 T152 T157 A158	I150-R154 HydrophobicContact CG2-CG 4.48Å; I150-R154 WeakPolarHBondContact O-CB 3.4Å; I150-R154 VanDerWaalsContact O-CG 3.3Å; I150-R154 WeakPolarHBondContact O-CG 3.23Å; I150-R154 PolarHBondContact O-N 3.45Å; K151-R154 PolarHBondContact O-N 2.85Å; T152-R154 PolarHBondContact O-N 3.44Å; R154-T157 PolarHBondContact O-N 3.16Å; R154-A158 WeakPolarHBondContact O-CB 3.29Å; R154-A158 PolarHBondContact O-N 3.5Å
155	E	94.7	Very high	93.5	Very high	26 Å²	26	55 Å²	55	12%	0.121	31%	0.308	C	S	.	.	H	α-helix	trans	-63.9	-48	178.3	-171.4	-176.8	-161.5	0	0	111.6	K151 T152 T157 A158 A159 R195 G204 G205	K151-E155 PolarHBondContact O-N 3.15Å; T152-E155 PolarHBondContact O-N 3.33Å; E155-T157 VanDerWaalsContact C-N 3.3Å; E155-T157 PolarHBondContact O-N 3.19Å; E155-A158 PolarHBondContact O-N 3.25Å; E155-A159 WeakPolarHBondContact O-CB 3.45Å; E155-A159 PolarHBondContact O-N 2.98Å; E155-R195 HydrophobicContact CG-CG 4.18Å; E155-R195 IonicContact OE1-NE 3.4Å; E155-R195 IonicContact OE2-CZ 2.89Å; E155-R195 IonicContact OE2-NE 3.99Å; E155-R195 PolarHBondContact OE2-NE 2.78Å; E155-R195 IonicContact OE2-NH2 3.32Å; E155-R195 PolarHBondContact OE2-NH2 2.79Å; E155-G204 WeakPolarHBondContact OE1-CA 3.49Å; E155-G205 PolarHBondContact OE1-N 3.28Å; E155-G205 PolarHBondContact OE2-N 3.47Å
156	V	96	Very high	93.7	Very high	1 Å²	1	57.8 Å²	57.8	1%	0.006	31%	0.313	C	S	.	.	H	α-helix	trans	-61.5	-40.6	175.1	169.7	0	0	0	0	111.2	I135 V138 L139 T152 A158 A159 L160 V191 R195	I135-V156 HydrophobicContact CG2-CB 4.44Å; I135-V156 HydrophobicContact CG2-CG1 3.89Å; V138-V156 HydrophobicContact CB-CG1 4.24Å; V138-V156 HydrophobicContact CG1-CG1 3.84Å; L139-V156 HydrophobicContact CD2-CB 4.34Å; L139-V156 HydrophobicContact CD2-CG2 3.48Å; L139-V156 VanDerWaalsContact CD2-CG2 3.48Å; L139-V156 HydrophobicContact CG-CB 4.29Å; L139-V156 HydrophobicContact CG-CG1 4.25Å; L139-V156 HydrophobicContact CG-CG2 3.87Å; T152-V156 PolarHBondContact O-N 3.44Å; V156-A158 PolarHBondContact O-N 3.3Å; V156-A159 PolarHBondContact O-N 3.47Å; V156-L160 VanDerWaalsContact O-CB 3.24Å; V156-L160 WeakPolarHBondContact O-CB 3.49Å; V156-L160 PolarHBondContact O-N 3.38Å; V156-V191 HydrophobicContact CG1-CG1 4.18Å; V156-V191 HydrophobicContact CG2-CG1 4.45Å; V156-R195 VanDerWaalsContact CG2-CD 3.49Å
157	T	95.9	Very high	93.9	Very high	30 Å²	30	59.8 Å²	59.8	18%	0.184	33%	0.332	C	S	.	.	H	α-helix	trans	-59.7	-47.9	177.3	-59.5	0	0	0	0	110.9	I135 V153 R154 E155 L160 Q161	I135-T157 HydrophobicContact CD1-CG2 4.07Å; I135-T157 VanDerWaalsContact CD1-OG1 3.31Å; I135-T157 WeakPolarHBondContact CD1-OG1 3.23Å; V153-T157 VanDerWaalsContact O-CB 3.3Å; V153-T157 WeakPolarHBondContact O-CB 3.43Å; V153-T157 PolarHBondContact O-N 3.27Å; V153-T157 PolarHBondContact O-OG1 3.34Å; R154-T157 PolarHBondContact O-N 3.16Å; E155-T157 VanDerWaalsContact C-N 3.3Å; E155-T157 PolarHBondContact O-N 3.19Å; T157-L160 PolarHBondContact O-N 2.91Å; T157-Q161 HydrophobicContact CG2-CG 4.31Å; T157-Q161 VanDerWaalsContact O-CB 3.3Å; T157-Q161 WeakPolarHBondContact O-CB 3.43Å; T157-Q161 VanDerWaalsContact O-CG 3.22Å; T157-Q161 WeakPolarHBondContact O-CG 3.17Å; T157-Q161 PolarHBondContact O-N 2.84Å
158	A	95.4	Very high	94.1	Very high	58 Å²	58	61.6 Å²	61.6	48%	0.479	34%	0.337	S	S	.	.	H	α-helix	trans	-64.3	-44.3	179.3	0	0	0	0	0	112	R154 E155 V156 Q161 S162	R154-A158 WeakPolarHBondContact O-CB 3.29Å; R154-A158 PolarHBondContact O-N 3.5Å; E155-A158 PolarHBondContact O-N 3.25Å; V156-A158 PolarHBondContact O-N 3.3Å; A158-Q161 PolarHBondContact O-N 2.98Å; A158-S162 PolarHBondContact O-N 3.42Å; A158-S162 VanDerWaalsContact O-N 3.09Å
159	A	95.4	Very high	94.3	Very high	5 Å²	5	55.7 Å²	55.7	4%	0.041	30%	0.301	C	S	.	.	H	α-helix	trans	-62.4	-45.8	176.5	0	0	0	0	0	111.6	E155 V156 S162 V191 I194	E155-A159 WeakPolarHBondContact O-CB 3.45Å; E155-A159 PolarHBondContact O-N 2.98Å; V156-A159 PolarHBondContact O-N 3.47Å; A159-S162 PolarHBondContact O-N 3.04Å; A159-S162 PolarHBondContact O-OG 3.16Å; A159-V191 HydrophobicContact CB-CG1 3.88Å; A159-V191 HydrophobicContact CB-CG2 4.44Å; A159-I194 HydrophobicContact CB-CB 4.32Å; A159-I194 HydrophobicContact CB-CG2 3.82Å
160	L	97.2	Very high	94.3	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-64.8	-45.1	177.8	-175.3	65.4	0	0	0	111.4	Y131 I134 I135 V156 T157 S162 I163 F164 L187 V191	Y131-L160 HydrophobicContact CE1-CD2 4.08Å; Y131-L160 HydrophobicContact CE2-CD2 4.21Å; Y131-L160 WeakPolarHBondContact OH-CG 3.39Å; I134-L160 HydrophobicContact CG2-CD2 3.78Å; I135-L160 HydrophobicContact CG1-CD2 3.9Å; V156-L160 VanDerWaalsContact O-CB 3.24Å; V156-L160 WeakPolarHBondContact O-CB 3.49Å; V156-L160 PolarHBondContact O-N 3.38Å; T157-L160 PolarHBondContact O-N 2.91Å; L160-S162 PolarHBondContact O-N 3.44Å; L160-I163 WeakPolarHBondContact O-CG1 3.37Å; L160-I163 PolarHBondContact O-N 2.98Å; L160-I163 VanDerWaalsContact O-N 3.1Å; L160-F164 HydrophobicContact CD1-CB 4.07Å; L160-F164 HydrophobicContact CD1-CD1 4.38Å; L160-F164 HydrophobicContact CG-CB 4.49Å; L160-F164 CarbonylContact O-C 3.57Å; L160-F164 WeakPolarHBondContact O-CA 3.41Å; L160-F164 PolarHBondContact O-N 3.38Å; L160-L187 HydrophobicContact CD1-CB 4.2Å; L160-L187 HydrophobicContact CD1-CD1 4.28Å; L160-L187 HydrophobicContact CD1-CD2 4.29Å; L160-L187 HydrophobicContact CD1-CG 4.5Å; L160-V191 HydrophobicContact CB-CG2 4.07Å; L160-V191 HydrophobicContact CD1-CG2 3.98Å
161	Q	96.5	Very high	94.3	Very high	84 Å²	84	53.6 Å²	53.6	39%	0.393	30%	0.303	S	S	.	.	H	α-helix	trans	-61.4	-28.7	178.4	-77.3	178	-20	0	0	112.7	Y131 T157 A158 I163	Y131-Q161 HydrophobicContact CE1-CG 4.04Å; Y131-Q161 WeakPolarHBondContact OH-CA 3.4Å; Y131-Q161 WeakPolarHBondContact OH-CG 3.39Å; Y131-Q161 PolarHBondContact OH-N 3.5Å; T157-Q161 HydrophobicContact CG2-CG 4.31Å; T157-Q161 VanDerWaalsContact O-CB 3.3Å; T157-Q161 WeakPolarHBondContact O-CB 3.43Å; T157-Q161 VanDerWaalsContact O-CG 3.22Å; T157-Q161 WeakPolarHBondContact O-CG 3.17Å; T157-Q161 PolarHBondContact O-N 2.84Å; A158-Q161 PolarHBondContact O-N 2.98Å; Q161-I163 VanDerWaalsContact C-N 3.27Å; Q161-I163 PolarHBondContact O-N 3.2Å
162	S	93	Very high	94.4	Very high	84 Å²	84	47.7 Å²	47.7	59%	0.587	28%	0.278	S	S	*	.	H	α-helix	trans	-68.8	-23.2	177.8	78.1	0	0	0	0	113.9	A158 A159 L160	A158-S162 PolarHBondContact O-N 3.42Å; A158-S162 VanDerWaalsContact O-N 3.09Å; A159-S162 PolarHBondContact O-N 3.04Å; A159-S162 PolarHBondContact O-OG 3.16Å; L160-S162 PolarHBondContact O-N 3.44Å
163	I	94.3	Very high	94.4	Very high	35 Å²	35	49.2 Å²	49.2	18%	0.179	29%	0.286	C	S	.	.	H	α-helix	trans	-118.1	-22.9	-177.3	65.5	171.9	0	0	0	113.5	L160 Q161 L187 I190 V191 I194 F320	L160-I163 WeakPolarHBondContact O-CG1 3.37Å; L160-I163 PolarHBondContact O-N 2.98Å; L160-I163 VanDerWaalsContact O-N 3.1Å; Q161-I163 VanDerWaalsContact C-N 3.27Å; Q161-I163 PolarHBondContact O-N 3.2Å; I163-L187 HydrophobicContact CD1-CD2 3.76Å; I163-L187 HydrophobicContact CG1-CD2 4.09Å; I163-I190 HydrophobicContact CD1-CB 3.7Å; I163-I190 HydrophobicContact CD1-CD1 4.38Å; I163-I190 HydrophobicContact CD1-CG2 3.51Å; I163-I190 HydrophobicContact CG2-CG2 4.1Å; I163-V191 HydrophobicContact CD1-CG2 3.82Å; I163-I194 HydrophobicContact CG2-CD1 3.87Å; I163-F320 HydrophobicContact CB-CE1 4.46Å; I163-F320 HydrophobicContact CB-CZ 3.92Å; I163-F320 HydrophobicContact CG2-CE1 3.62Å; I163-F320 HydrophobicContact CG2-CZ 3.57Å
164	F	96.1	Very high	94.4	Very high	5 Å²	5	52.7 Å²	52.7	2%	0.022	31%	0.307	C	S	.	.	S	Bend	trans	-142.2	78.6	-177.7	-176.3	-110.7	0	0	0	109.3	Y131 I134 L160 E168 L169 F172 L187	Y131-F164 AromaticContact CE2-CD1 3.96Å; Y131-F164 HydrophobicContact CE2-CD1 3.96Å; Y131-F164 HydrophobicContact CE2-CE1 4.22Å; Y131-F164 PolarHBondContact OH-O 2.88Å; I134-F164 HydrophobicContact CD1-CE1 4.11Å; L160-F164 HydrophobicContact CD1-CB 4.07Å; L160-F164 HydrophobicContact CD1-CD1 4.38Å; L160-F164 HydrophobicContact CG-CB 4.49Å; L160-F164 CarbonylContact O-C 3.57Å; L160-F164 WeakPolarHBondContact O-CA 3.41Å; L160-F164 PolarHBondContact O-N 3.38Å; F164-E168 HydrophobicContact CD2-CB 3.69Å; F164-E168 HydrophobicContact CD2-CG 4.48Å; F164-E168 HydrophobicContact CE2-CB 3.44Å; F164-E168 VanDerWaalsContact CE2-CB 3.44Å; F164-E168 HydrophobicContact CZ-CB 4.2Å; F164-L169 HydrophobicContact CE1-CD2 3.85Å; F164-L169 HydrophobicContact CE1-CG 4.4Å; F164-L169 HydrophobicContact CZ-CD2 4.05Å; F164-L169 HydrophobicContact CZ-CG 4.5Å; F164-F172 HydrophobicContact CE2-CB 4.21Å; F164-F172 HydrophobicContact CZ-CB 3.8Å; F164-F172 HydrophobicContact CZ-CD2 4.3Å; F164-F172 HydrophobicContact CZ-CG 4.16Å; F164-L187 HydrophobicContact CB-CD1 4.23Å; F164-L187 HydrophobicContact CB-CD2 3.73Å; F164-L187 HydrophobicContact CD1-CD1 4.03Å; F164-L187 HydrophobicContact CD2-CD1 4.24Å; F164-L187 HydrophobicContact CE1-CD1 4.48Å; F164-L187 HydrophobicContact CG-CD1 3.9Å; F164-L187 HydrophobicContact CG-CD2 4.24Å
165	P	94.9	Very high	94.5	Very high	59 Å²	59	46.6 Å²	46.6	38%	0.383	29%	0.288	S	S	.	.			trans	-60.4	154.9	176.8	-21.5	33.3	0	0	0	111.7	A167 E168	P165-A167 PolarHBondContact O-N 3.14Å; P165-E168 WeakPolarHBondContact O-CB 3.27Å; P165-E168 PolarHBondContact O-N 2.87Å
166	Q	92.5	Very high	94.5	Very high	86 Å²	86	48.1 Å²	48.1	40%	0.402	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-57.3	-25	178.4	-71.4	-179.3	-8	0	0	113.8	Y131 E168 L169	Y131-Q166 HydrophobicContact CD1-CG 4.21Å; Y131-Q166 HydrophobicContact CD2-CG 3.73Å; Y131-Q166 HydrophobicContact CE1-CG 4.31Å; Y131-Q166 HydrophobicContact CE2-CG 3.83Å; Y131-Q166 HydrophobicContact CG-CG 3.92Å; Q166-E168 PolarHBondContact O-N 3.1Å; Q166-L169 HydrophobicContact CB-CD1 4.44Å; Q166-L169 VanDerWaalsContact O-CB 3.3Å; Q166-L169 WeakPolarHBondContact O-CB 3.24Å; Q166-L169 WeakPolarHBondContact O-CG 3.4Å; Q166-L169 PolarHBondContact O-N 3.42Å
167	A	91.3	Very high	94.5	Very high	88 Å²	88	52.2 Å²	52.2	73%	0.727	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-62	-28.2	174.8	0	0	0	0	0	113.1	P165 L169	P165-A167 PolarHBondContact O-N 3.14Å; A167-L169 PolarHBondContact O-N 2.91Å
168	E	92.9	Very high	94.5	Very high	88 Å²	88	58.8 Å²	58.8	41%	0.411	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-78.3	-6.4	179.1	-65.9	-61.5	156.6	0	0	113.3	F164 P165 Q166 G170 T171 F172	F164-E168 HydrophobicContact CD2-CB 3.69Å; F164-E168 HydrophobicContact CD2-CG 4.48Å; F164-E168 HydrophobicContact CE2-CB 3.44Å; F164-E168 VanDerWaalsContact CE2-CB 3.44Å; F164-E168 HydrophobicContact CZ-CB 4.2Å; P165-E168 WeakPolarHBondContact O-CB 3.27Å; P165-E168 PolarHBondContact O-N 2.87Å; Q166-E168 PolarHBondContact O-N 3.1Å; E168-G170 PolarHBondContact O-N 3.03Å; E168-T171 WeakPolarHBondContact O-CB 3.45Å; E168-T171 PolarHBondContact O-N 3.29Å; E168-T171 PolarHBondContact OE2-OG1 2.94Å; E168-F172 PolarHBondContact O-N 3.17Å
169	L	93.3	Very high	94.6	Very high	2 Å²	2	59.6 Å²	59.6	1%	0.01	34%	0.341	C	S	.	.	H	α-helix	trans	-60.1	-33.8	174.8	-75.1	171.8	0	0	0	112.2	L127 L130 Y131 I134 F164 Q166 A167 F172 L173	L127-L169 HydrophobicContact CB-CD1 4.02Å; L127-L169 HydrophobicContact CD2-CB 3.97Å; L127-L169 HydrophobicContact CD2-CD1 4.16Å; L127-L169 WeakPolarHBondContact O-CD1 3.42Å; L130-L169 HydrophobicContact CD2-CD2 4.19Å; L130-L169 HydrophobicContact CG-CD2 4.33Å; Y131-L169 HydrophobicContact CD2-CD1 3.94Å; Y131-L169 HydrophobicContact CD2-CD2 4.12Å; Y131-L169 HydrophobicContact CD2-CG 4.14Å; I134-L169 HydrophobicContact CD1-CD2 3.73Å; F164-L169 HydrophobicContact CE1-CD2 3.85Å; F164-L169 HydrophobicContact CE1-CG 4.4Å; F164-L169 HydrophobicContact CZ-CD2 4.05Å; F164-L169 HydrophobicContact CZ-CG 4.5Å; Q166-L169 HydrophobicContact CB-CD1 4.44Å; Q166-L169 VanDerWaalsContact O-CB 3.3Å; Q166-L169 WeakPolarHBondContact O-CB 3.24Å; Q166-L169 WeakPolarHBondContact O-CG 3.4Å; Q166-L169 PolarHBondContact O-N 3.42Å; A167-L169 PolarHBondContact O-N 2.91Å; L169-F172 PolarHBondContact O-N 3.45Å; L169-L173 WeakPolarHBondContact O-CB 3.31Å; L169-L173 VanDerWaalsContact O-CG 3.28Å; L169-L173 WeakPolarHBondContact O-CG 3.47Å; L169-L173 PolarHBondContact O-N 3.24Å
170	G	91.6	Very high	94.7	Very high	42 Å²	42	59.5 Å²	59.5	43%	0.433	34%	0.34	S	S	.	.	H	α-helix	trans	-58.9	-51.6	175.2	0	0	0	0	0	111	E168 F172 L173	E168-G170 PolarHBondContact O-N 3.03Å; G170-F172 PolarHBondContact O-N 2.92Å; G170-L173 PolarHBondContact O-N 3.1Å
171	T	92.7	Very high	94.6	Very high	79 Å²	79	62.7 Å²	62.7	49%	0.485	36%	0.355	S	S	.	.	H	α-helix	trans	-58.5	-48.3	175.4	-46.1	0	0	0	0	110.9	E168 L173 T174	E168-T171 WeakPolarHBondContact O-CB 3.45Å; E168-T171 PolarHBondContact O-N 3.29Å; E168-T171 PolarHBondContact OE2-OG1 2.94Å; T171-L173 VanDerWaalsContact C-N 3.3Å; T171-L173 PolarHBondContact O-N 3.33Å; T171-T174 PolarHBondContact O-N 3.3Å; T171-T174 VanDerWaalsContact O-N 3.14Å; T171-T174 PolarHBondContact O-OG1 3.29Å
172	F	95.9	Very high	94.7	Very high	1 Å²	1	67.2 Å²	67.2	0%	0.004	37%	0.369	C	S	.	.	H	α-helix	trans	-55.3	-42.8	178.4	176.8	-93.6	0	0	0	112.5	I116 F164 E168 L169 G170 T174 L175 K180 Q183 L184	I116-F172 HydrophobicContact CG2-CE1 3.86Å; I116-F172 HydrophobicContact CG2-CZ 3.83Å; F164-F172 HydrophobicContact CE2-CB 4.21Å; F164-F172 HydrophobicContact CZ-CB 3.8Å; F164-F172 HydrophobicContact CZ-CD2 4.3Å; F164-F172 HydrophobicContact CZ-CG 4.16Å; E168-F172 PolarHBondContact O-N 3.17Å; L169-F172 PolarHBondContact O-N 3.45Å; G170-F172 PolarHBondContact O-N 2.92Å; F172-T174 PolarHBondContact O-N 2.89Å; F172-L175 WeakPolarHBondContact O-CB 3.29Å; F172-L175 PolarHBondContact O-N 3.17Å; F172-K180 HydrophobicContact CE1-CD 4.04Å; F172-K180 HydrophobicContact CE1-CG 4.13Å; F172-K180 HydrophobicContact CE2-CB 4.02Å; F172-K180 HydrophobicContact CE2-CG 4.05Å; F172-K180 HydrophobicContact CZ-CB 3.79Å; F172-K180 HydrophobicContact CZ-CD 4.15Å; F172-K180 HydrophobicContact CZ-CG 3.83Å; F172-K180 WeakPolarHBondContact O-CE 3.45Å; F172-Q183 HydrophobicContact CD2-CG 4.5Å; F172-Q183 VanDerWaalsContact CD2-OE1 3.26Å; F172-Q183 HydrophobicContact CE2-CB 4.46Å; F172-L184 HydrophobicContact CE2-CD2 4.32Å; F172-L184 HydrophobicContact CE2-CG 4.22Å; F172-L184 HydrophobicContact CZ-CD1 4.45Å; F172-L184 HydrophobicContact CZ-CD2 4.18Å; F172-L184 HydrophobicContact CZ-CG 4.12Å
173	L	94.4	Very high	94.9	Very high	33 Å²	33	65.6 Å²	65.6	17%	0.173	35%	0.352	C	S	.	.	H	α-helix	trans	-64.1	-28.2	-178.1	-77.5	170.2	0	0	0	113.5	A121 L127 L130 L169 G170 T171 L175 K180	A121-L173 HydrophobicContact CB-CD1 4.44Å; A121-L173 VanDerWaalsContact O-CD1 3.3Å; A121-L173 WeakPolarHBondContact O-CD1 3.45Å; L127-L173 HydrophobicContact CD2-CD1 3.8Å; L130-L173 HydrophobicContact CD2-CD1 4.42Å; L130-L173 HydrophobicContact CD2-CD2 3.77Å; L130-L173 HydrophobicContact CD2-CG 4.22Å; L169-L173 WeakPolarHBondContact O-CB 3.31Å; L169-L173 VanDerWaalsContact O-CG 3.28Å; L169-L173 WeakPolarHBondContact O-CG 3.47Å; L169-L173 PolarHBondContact O-N 3.24Å; G170-L173 PolarHBondContact O-N 3.1Å; T171-L173 VanDerWaalsContact C-N 3.3Å; T171-L173 PolarHBondContact O-N 3.33Å; L173-L175 VanDerWaalsContact C-N 3.31Å; L173-L175 PolarHBondContact O-N 3.25Å; L173-K180 WeakPolarHBondContact O-CE 3.22Å; L173-K180 PolarHBondContact O-NZ 3.04Å
174	T	94.2	Very high	95	Very high	115 Å²	115	64 Å²	64	71%	0.706	34%	0.343	S	S	*	.	H	α-helix	trans	-74.9	-16.2	178.4	69	0	0	0	0	114.3	T171 F172	T171-T174 PolarHBondContact O-N 3.3Å; T171-T174 VanDerWaalsContact O-N 3.14Å; T171-T174 PolarHBondContact O-OG1 3.29Å; F172-T174 PolarHBondContact O-N 2.89Å
175	L	95.7	Very high	95	Very high	58 Å²	58	67.4 Å²	67.4	30%	0.304	36%	0.358	S	S	.	.	S	Bend	trans	-70.8	157.6	-176.3	-64.3	179.2	0	0	0	112.9	F172 L173 D179 K180	F172-L175 WeakPolarHBondContact O-CB 3.29Å; F172-L175 PolarHBondContact O-N 3.17Å; L173-L175 VanDerWaalsContact C-N 3.31Å; L173-L175 PolarHBondContact O-N 3.25Å; L175-D179 HydrophobicContact CB-CB 4.08Å; L175-D179 HydrophobicContact CD1-CB 4.42Å; L175-K180 HydrophobicContact CB-CG 3.86Å; L175-K180 VanDerWaalsContact O-CE 3.27Å; L175-K180 WeakPolarHBondContact O-CE 3.33Å
176	S	96	Very high	95.2	Very high	58 Å²	58	68.7 Å²	68.7	41%	0.406	36%	0.359	S	S	.	.			trans	-64.8	158.4	169.7	85.2	0	0	0	0	110.7	K178 D179 K180	S176-K178 VanDerWaalsContact C-N 3.27Å; S176-K178 PolarHBondContact O-N 3.15Å; S176-D179 WeakPolarHBondContact CB-OD2 3.41Å; S176-D179 PolarHBondContact O-N 2.89Å; S176-D179 VanDerWaalsContact O-N 3.15Å; S176-D179 PolarHBondContact OG-N 2.7Å; S176-D179 PolarHBondContact OG-OD2 3.16Å; S176-K180 WeakPolarHBondContact O-CG 3.32Å; S176-K180 PolarHBondContact O-N 3.29Å
177	K	95.1	Very high	95.4	Very high	86 Å²	86	65.1 Å²	65.1	37%	0.374	34%	0.343	S	S	.	.	H	α-helix	trans	-55	-43.4	177.1	179.3	164.7	-172.5	150.1	0	112.5	T117 D118 D179 K180 E181	T117-K177 HydrophobicContact CG2-CG 4.35Å; T117-K177 WeakPolarHBondContact OG1-CE 3.4Å; D118-K177 IonicContact OD1-NZ 3.21Å; D118-K177 PolarHBondContact OD1-NZ 3.39Å; D118-K177 IonicContact OD2-NZ 3.19Å; D118-K177 PolarHBondContact OD2-NZ 3.2Å; K177-D179 PolarHBondContact O-N 3.44Å; K177-K180 PolarHBondContact O-N 2.89Å; K177-E181 WeakPolarHBondContact CE-OE1 3.48Å; K177-E181 WeakPolarHBondContact O-CG 3.34Å; K177-E181 PolarHBondContact O-N 3.38Å
178	K	95.9	Very high	95.8	Very high	169 Å²	169	61 Å²	61	74%	0.735	31%	0.309	S	S	*	.	H	α-helix	trans	-64.6	-39.9	179.1	-68.3	-172.7	176.6	-177.1	0	112	S176 E181 R182	S176-K178 VanDerWaalsContact C-N 3.27Å; S176-K178 PolarHBondContact O-N 3.15Å; K178-E181 PolarHBondContact O-N 3.24Å; K178-R182 WeakPolarHBondContact O-CB 3.45Å; K178-R182 PolarHBondContact O-N 3.36Å
179	D	97.4	Very high	96	Very high	74 Å²	74	59.3 Å²	59.3	40%	0.396	30%	0.301	S	S	.	.	H	α-helix	trans	-70.5	-38	178.6	-62.3	-43.5	0	0	0	111.6	L175 S176 K177 R182 Q183	L175-D179 HydrophobicContact CB-CB 4.08Å; L175-D179 HydrophobicContact CD1-CB 4.42Å; S176-D179 WeakPolarHBondContact CB-OD2 3.41Å; S176-D179 PolarHBondContact O-N 2.89Å; S176-D179 VanDerWaalsContact O-N 3.15Å; S176-D179 PolarHBondContact OG-N 2.7Å; S176-D179 PolarHBondContact OG-OD2 3.16Å; K177-D179 PolarHBondContact O-N 3.44Å; D179-R182 PolarHBondContact O-N 3.41Å; D179-Q183 WeakPolarHBondContact O-CB 3.24Å; D179-Q183 PolarHBondContact O-N 3.29Å
180	K	97.5	Very high	96.2	Very high	3 Å²	3	59.4 Å²	59.4	1%	0.013	30%	0.302	C	S	.	.	H	α-helix	trans	-58.6	-47.8	171.5	-70.4	-178.4	-176.4	179.8	0	111.3	T117 F172 L173 L175 S176 K177 R182 Q183 L184	T117-K180 HydrophobicContact CG2-CB 4.04Å; T117-K180 PolarHBondContact O-NZ 2.93Å; T117-K180 VanDerWaalsContact O-NZ 3.17Å; F172-K180 HydrophobicContact CE1-CD 4.04Å; F172-K180 HydrophobicContact CE1-CG 4.13Å; F172-K180 HydrophobicContact CE2-CB 4.02Å; F172-K180 HydrophobicContact CE2-CG 4.05Å; F172-K180 HydrophobicContact CZ-CB 3.79Å; F172-K180 HydrophobicContact CZ-CD 4.15Å; F172-K180 HydrophobicContact CZ-CG 3.83Å; F172-K180 WeakPolarHBondContact O-CE 3.45Å; L173-K180 WeakPolarHBondContact O-CE 3.22Å; L173-K180 PolarHBondContact O-NZ 3.04Å; L175-K180 HydrophobicContact CB-CG 3.86Å; L175-K180 VanDerWaalsContact O-CE 3.27Å; L175-K180 WeakPolarHBondContact O-CE 3.33Å; S176-K180 WeakPolarHBondContact O-CG 3.32Å; S176-K180 PolarHBondContact O-N 3.29Å; K177-K180 PolarHBondContact O-N 2.89Å; K180-R182 VanDerWaalsContact C-N 3.34Å; K180-R182 PolarHBondContact O-N 3.31Å; K180-Q183 PolarHBondContact O-N 3.48Å; K180-L184 WeakPolarHBondContact O-CB 3.48Å; K180-L184 VanDerWaalsContact O-CG 3.25Å; K180-L184 WeakPolarHBondContact O-CG 3.45Å; K180-L184 PolarHBondContact O-N 3.42Å
181	E	96.5	Very high	96.5	Very high	68 Å²	68	57.4 Å²	57.4	32%	0.318	28%	0.281	S	S	.	.	H	α-helix	trans	-60.7	-43.2	177.2	-71.8	172.7	-174.9	0	0	111.8	T113 T117 K177 K178 L184 K185	T113-E181 HydrophobicContact CG2-CG 3.93Å; T117-E181 HydrophobicContact CG2-CG 3.81Å; K177-E181 WeakPolarHBondContact CE-OE1 3.48Å; K177-E181 WeakPolarHBondContact O-CG 3.34Å; K177-E181 PolarHBondContact O-N 3.38Å; K178-E181 PolarHBondContact O-N 3.24Å; E181-L184 PolarHBondContact O-N 3.22Å; E181-K185 WeakPolarHBondContact O-CG 3.32Å; E181-K185 PolarHBondContact O-N 3.01Å; E181-K185 VanDerWaalsContact O-N 3.1Å
182	R	96.9	Very high	96.8	Very high	179 Å²	179	53.8 Å²	53.8	68%	0.675	26%	0.259	S	S	*	.	H	α-helix	trans	-62.6	-46.2	176.3	-174.8	-179.6	176.6	-145.3	-3.6	111.8	K178 D179 K180 L184 K185 E186	K178-R182 WeakPolarHBondContact O-CB 3.45Å; K178-R182 PolarHBondContact O-N 3.36Å; D179-R182 PolarHBondContact O-N 3.41Å; K180-R182 VanDerWaalsContact C-N 3.34Å; K180-R182 PolarHBondContact O-N 3.31Å; R182-L184 VanDerWaalsContact C-N 3.35Å; R182-L184 PolarHBondContact O-N 2.88Å; R182-K185 PolarHBondContact O-N 3.33Å; R182-E186 PolarHBondContact O-N 3.03Å
183	Q	97.4	Very high	96.9	Very high	50 Å²	50	53.7 Å²	53.7	23%	0.234	26%	0.259	C	S	.	.	H	α-helix	trans	-65	-39.5	179.5	-171.9	172.3	13.1	0	0	111.5	F172 D179 K180 K185 E186 L187	F172-Q183 HydrophobicContact CD2-CG 4.5Å; F172-Q183 VanDerWaalsContact CD2-OE1 3.26Å; F172-Q183 HydrophobicContact CE2-CB 4.46Å; D179-Q183 WeakPolarHBondContact O-CB 3.24Å; D179-Q183 PolarHBondContact O-N 3.29Å; K180-Q183 PolarHBondContact O-N 3.48Å; Q183-K185 VanDerWaalsContact C-N 3.34Å; Q183-K185 PolarHBondContact O-N 3.13Å; Q183-E186 PolarHBondContact O-N 3.38Å; Q183-L187 HydrophobicContact CG-CD1 4.07Å; Q183-L187 HydrophobicContact CG-CG 4.26Å; Q183-L187 WeakPolarHBondContact O-CB 3.43Å; Q183-L187 VanDerWaalsContact O-CG 3.25Å; Q183-L187 WeakPolarHBondContact O-CG 3.39Å; Q183-L187 PolarHBondContact O-N 2.99Å
184	L	97.6	Very high	96.9	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-59.4	-44.6	174	-75.1	175.4	0	0	0	111.7	I116 I134 Y137 F172 K180 E181 R182 L187 T188	I116-L184 HydrophobicContact CB-CD1 4.3Å; I116-L184 HydrophobicContact CD1-CD1 4.34Å; I116-L184 HydrophobicContact CG2-CD1 3.85Å; I116-L184 HydrophobicContact CG2-CD2 4.16Å; I134-L184 HydrophobicContact CG1-CD2 4.14Å; I134-L184 HydrophobicContact CG2-CD2 3.96Å; Y137-L184 HydrophobicContact CD1-CB 4.12Å; Y137-L184 HydrophobicContact CD1-CD2 4.24Å; Y137-L184 HydrophobicContact CE1-CB 3.57Å; Y137-L184 HydrophobicContact CE1-CG 4.43Å; F172-L184 HydrophobicContact CE2-CD2 4.32Å; F172-L184 HydrophobicContact CE2-CG 4.22Å; F172-L184 HydrophobicContact CZ-CD1 4.45Å; F172-L184 HydrophobicContact CZ-CD2 4.18Å; F172-L184 HydrophobicContact CZ-CG 4.12Å; K180-L184 WeakPolarHBondContact O-CB 3.48Å; K180-L184 VanDerWaalsContact O-CG 3.25Å; K180-L184 WeakPolarHBondContact O-CG 3.45Å; K180-L184 PolarHBondContact O-N 3.42Å; E181-L184 PolarHBondContact O-N 3.22Å; R182-L184 VanDerWaalsContact C-N 3.35Å; R182-L184 PolarHBondContact O-N 2.88Å; L184-L187 PolarHBondContact O-N 3.18Å; L184-T188 PolarHBondContact O-N 3.01Å; L184-T188 PolarHBondContact O-OG1 3.47Å
185	K	96.7	Very high	97.1	Very high	78 Å²	78	47.5 Å²	47.5	34%	0.339	22%	0.221	S	C	.	.	H	α-helix	trans	-62.4	-43.9	176.8	-69.8	-178.9	176.4	-173.9	0	112	E106 E181 R182 Q183 T188 M189	E106-K185 WeakPolarHBondContact OE2-CE 3.3Å; E106-K185 IonicContact OE2-NZ 2.6Å; E106-K185 PolarHBondContact OE2-NZ 3.37Å; E181-K185 WeakPolarHBondContact O-CG 3.32Å; E181-K185 PolarHBondContact O-N 3.01Å; E181-K185 VanDerWaalsContact O-N 3.1Å; R182-K185 PolarHBondContact O-N 3.33Å; Q183-K185 VanDerWaalsContact C-N 3.34Å; Q183-K185 PolarHBondContact O-N 3.13Å; K185-T188 PolarHBondContact O-N 3.38Å; K185-M189 WeakPolarHBondContact O-CG 3.29Å; K185-M189 PolarHBondContact O-N 3.28Å; K185-M189 VanDerWaalsContact O-N 3.08Å
186	E	97.6	Very high	97.1	Very high	86 Å²	86	44.9 Å²	44.9	40%	0.402	21%	0.208	S	C	.	.	H	α-helix	trans	-63.9	-47.7	177.8	-175.1	172.3	-157.9	0	0	112.3	R182 Q183 T188 M189 I190	R182-E186 PolarHBondContact O-N 3.03Å; Q183-E186 PolarHBondContact O-N 3.38Å; E186-T188 VanDerWaalsContact C-N 3.3Å; E186-T188 PolarHBondContact O-N 2.77Å; E186-M189 HydrophobicContact CB-CE 4.46Å; E186-M189 PolarHBondContact O-N 3.24Å; E186-M189 VanDerWaalsContact O-N 3.11Å; E186-I190 HydrophobicContact CG-CD1 3.98Å; E186-I190 WeakPolarHBondContact O-CG1 3.32Å; E186-I190 PolarHBondContact O-N 3.34Å
187	L	98	Very high	97.1	Very high	11 Å²	11	43 Å²	43	6%	0.058	19%	0.192	C	C	.	.	H	α-helix	trans	-58.6	-42.3	175.5	-70.8	174.4	0	0	0	111.4	L160 I163 F164 Q183 L184 M189 I190 V191	L160-L187 HydrophobicContact CD1-CB 4.2Å; L160-L187 HydrophobicContact CD1-CD1 4.28Å; L160-L187 HydrophobicContact CD1-CD2 4.29Å; L160-L187 HydrophobicContact CD1-CG 4.5Å; I163-L187 HydrophobicContact CD1-CD2 3.76Å; I163-L187 HydrophobicContact CG1-CD2 4.09Å; F164-L187 HydrophobicContact CB-CD1 4.23Å; F164-L187 HydrophobicContact CB-CD2 3.73Å; F164-L187 HydrophobicContact CD1-CD1 4.03Å; F164-L187 HydrophobicContact CD2-CD1 4.24Å; F164-L187 HydrophobicContact CE1-CD1 4.48Å; F164-L187 HydrophobicContact CG-CD1 3.9Å; F164-L187 HydrophobicContact CG-CD2 4.24Å; Q183-L187 HydrophobicContact CG-CD1 4.07Å; Q183-L187 HydrophobicContact CG-CG 4.26Å; Q183-L187 WeakPolarHBondContact O-CB 3.43Å; Q183-L187 VanDerWaalsContact O-CG 3.25Å; Q183-L187 WeakPolarHBondContact O-CG 3.39Å; Q183-L187 PolarHBondContact O-N 2.99Å; L184-L187 PolarHBondContact O-N 3.18Å; L187-M189 PolarHBondContact O-N 3.16Å; L187-I190 PolarHBondContact O-N 2.83Å; L187-V191 WeakPolarHBondContact O-CB 3.42Å; L187-V191 VanDerWaalsContact O-CG2 3.27Å; L187-V191 WeakPolarHBondContact O-CG2 3.49Å; L187-V191 PolarHBondContact O-N 3.28Å
188	T	97.8	Very high	97.1	Very high	2 Å²	2	41 Å²	41	1%	0.012	19%	0.185	C	C	.	.	H	α-helix	trans	-58.9	-45.7	174.6	-63	0	0	0	0	111.6	Y137 R141 L184 K185 E186 V191 T192	Y137-T188 WeakPolarHBondContact CE1-OG1 3.23Å; R141-T188 HydrophobicContact CB-CG2 3.98Å; R141-T188 HydrophobicContact CG-CG2 4.02Å; L184-T188 PolarHBondContact O-N 3.01Å; L184-T188 PolarHBondContact O-OG1 3.47Å; K185-T188 PolarHBondContact O-N 3.38Å; E186-T188 VanDerWaalsContact C-N 3.3Å; E186-T188 PolarHBondContact O-N 2.77Å; T188-V191 PolarHBondContact O-N 2.6Å; T188-T192 VanDerWaalsContact O-CB 3.27Å; T188-T192 WeakPolarHBondContact O-CB 3.34Å; T188-T192 PolarHBondContact O-N 3.19Å; T188-T192 PolarHBondContact O-OG1 2.63Å
189	M	98.4	Very high	97.1	Very high	51 Å²	51	35.7 Å²	35.7	25%	0.251	16%	0.161	S	C	.	.	H	α-helix	trans	-63.2	-45.2	179.8	-68.8	-175.6	-61.4	0	0	111.9	K185 E186 L187 T192 G193 I324 S327	K185-M189 WeakPolarHBondContact O-CG 3.29Å; K185-M189 PolarHBondContact O-N 3.28Å; K185-M189 VanDerWaalsContact O-N 3.08Å; E186-M189 HydrophobicContact CB-CE 4.46Å; E186-M189 PolarHBondContact O-N 3.24Å; E186-M189 VanDerWaalsContact O-N 3.11Å; L187-M189 PolarHBondContact O-N 3.16Å; M189-T192 PolarHBondContact O-N 3.01Å; M189-G193 PolarHBondContact O-N 3.44Å; M189-I324 HydrophobicContact CB-CG1 4.07Å; M189-I324 HydrophobicContact CB-CG2 4.44Å; M189-I324 HydrophobicContact CE-CG2 4.19Å; M189-I324 HydrophobicContact SD-CG2 4.01Å; M189-S327 WeakPolarHBondContact CA-OG 3.15Å; M189-S327 VanDerWaalsContact O-CB 3.29Å; M189-S327 WeakPolarHBondContact O-CB 3.27Å
190	I	98.1	Very high	97	Very high	4 Å²	4	35.2 Å²	35.2	2%	0.021	16%	0.158	C	C	.	.	H	α-helix	trans	-64.9	-46.3	179.8	-60.3	165.1	0	0	0	110.6	I163 E186 L187 T192 G193 I194 F320 F323 I324	I163-I190 HydrophobicContact CD1-CB 3.7Å; I163-I190 HydrophobicContact CD1-CD1 4.38Å; I163-I190 HydrophobicContact CD1-CG2 3.51Å; I163-I190 HydrophobicContact CG2-CG2 4.1Å; E186-I190 HydrophobicContact CG-CD1 3.98Å; E186-I190 WeakPolarHBondContact O-CG1 3.32Å; E186-I190 PolarHBondContact O-N 3.34Å; L187-I190 PolarHBondContact O-N 2.83Å; I190-T192 VanDerWaalsContact C-N 3.32Å; I190-T192 PolarHBondContact O-N 2.91Å; I190-G193 PolarHBondContact O-N 3.42Å; I190-I194 HydrophobicContact CG2-CD1 3.92Å; I190-I194 HydrophobicContact CG2-CG1 4.45Å; I190-I194 WeakPolarHBondContact O-CG1 3.47Å; I190-I194 PolarHBondContact O-N 2.59Å; I190-F320 HydrophobicContact CD1-CB 4.45Å; I190-F320 HydrophobicContact CD1-CD2 3.77Å; I190-F320 HydrophobicContact CD1-CE2 4.09Å; I190-F320 HydrophobicContact CD1-CG 4.07Å; I190-F320 HydrophobicContact CG1-CG 4.46Å; I190-F320 HydrophobicContact CG2-CD1 3.95Å; I190-F320 HydrophobicContact CG2-CE1 4.07Å; I190-F320 HydrophobicContact CG2-CG 4.37Å; I190-F323 HydrophobicContact CG2-CB 4.42Å; I190-F323 HydrophobicContact CG2-CD2 4.34Å; I190-I324 HydrophobicContact CG1-CD1 4.1Å; I190-I324 HydrophobicContact CG1-CG1 3.84Å
191	V	97.9	Very high	96.8	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.006	17%	0.171	C	C	.	.	H	α-helix	trans	-62.4	-40.2	178.3	171.4	0	0	0	0	111.5	V138 V156 A159 L160 I163 L187 T188 I194 R195	V138-V191 HydrophobicContact CG1-CB 3.93Å; V138-V191 HydrophobicContact CG1-CG1 3.71Å; V138-V191 HydrophobicContact CG1-CG2 4.45Å; V156-V191 HydrophobicContact CG1-CG1 4.18Å; V156-V191 HydrophobicContact CG2-CG1 4.45Å; A159-V191 HydrophobicContact CB-CG1 3.88Å; A159-V191 HydrophobicContact CB-CG2 4.44Å; L160-V191 HydrophobicContact CB-CG2 4.07Å; L160-V191 HydrophobicContact CD1-CG2 3.98Å; I163-V191 HydrophobicContact CD1-CG2 3.82Å; L187-V191 WeakPolarHBondContact O-CB 3.42Å; L187-V191 VanDerWaalsContact O-CG2 3.27Å; L187-V191 WeakPolarHBondContact O-CG2 3.49Å; L187-V191 PolarHBondContact O-N 3.28Å; T188-V191 PolarHBondContact O-N 2.6Å; V191-I194 PolarHBondContact O-N 3.2Å; V191-R195 HydrophobicContact CG1-CG 4.48Å; V191-R195 WeakPolarHBondContact O-CG 3.39Å; V191-R195 PolarHBondContact O-N 3.15Å
192	T	97.7	Very high	96.5	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.012	19%	0.191	C	C	.	.	H	α-helix	trans	-58.2	-49.9	175	-58.9	0	0	0	0	110.2	S142 L144 T188 M189 I190 I194 R195 L196	S142-T192 VanDerWaalsContact CB-OG1 3.23Å; S142-T192 WeakPolarHBondContact CB-OG1 3.4Å; L144-T192 HydrophobicContact CD1-CG2 3.58Å; L144-T192 HydrophobicContact CG-CG2 4.33Å; T188-T192 VanDerWaalsContact O-CB 3.27Å; T188-T192 WeakPolarHBondContact O-CB 3.34Å; T188-T192 PolarHBondContact O-N 3.19Å; T188-T192 PolarHBondContact O-OG1 2.63Å; M189-T192 PolarHBondContact O-N 3.01Å; I190-T192 VanDerWaalsContact C-N 3.32Å; I190-T192 PolarHBondContact O-N 2.91Å; T192-I194 PolarHBondContact O-N 3.5Å; T192-R195 PolarHBondContact O-N 3.41Å; T192-L196 HydrophobicContact CG2-CD1 4.14Å; T192-L196 VanDerWaalsContact O-CG 3.32Å; T192-L196 WeakPolarHBondContact O-CG 3.33Å; T192-L196 PolarHBondContact O-N 3.37Å
193	G	97.5	Very high	96.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-60.3	-41.7	176.4	0	0	0	0	0	114	M189 I190 R195 L196 F197 F323	M189-G193 PolarHBondContact O-N 3.44Å; I190-G193 PolarHBondContact O-N 3.42Å; G193-R195 VanDerWaalsContact C-N 3.33Å; G193-R195 PolarHBondContact O-N 2.89Å; G193-L196 PolarHBondContact O-N 3.04Å; G193-F197 WeakPolarHBondContact O-CB 3.43Å; G193-F197 PolarHBondContact O-N 3.38Å; G193-F323 VanDerWaalsContact C-CD1 3.41Å; G193-F323 WeakPolarHBondContact CA-O 3.41Å
194	I	96.1	Very high	95.9	Very high	16 Å²	16	36.3 Å²	36.3	8%	0.082	20%	0.2	C	C	.	.	H	α-helix	trans	-60.8	-43.7	176.1	-69.3	167.2	0	0	0	110.7	A159 I163 I190 V191 T192 F197 N198 F323	A159-I194 HydrophobicContact CB-CB 4.32Å; A159-I194 HydrophobicContact CB-CG2 3.82Å; I163-I194 HydrophobicContact CG2-CD1 3.87Å; I190-I194 HydrophobicContact CG2-CD1 3.92Å; I190-I194 HydrophobicContact CG2-CG1 4.45Å; I190-I194 WeakPolarHBondContact O-CG1 3.47Å; I190-I194 PolarHBondContact O-N 2.59Å; V191-I194 PolarHBondContact O-N 3.2Å; T192-I194 PolarHBondContact O-N 3.5Å; I194-F197 PolarHBondContact O-N 3.47Å; I194-N198 WeakPolarHBondContact O-CB 3.23Å; I194-N198 VanDerWaalsContact O-CG 3.25Å; I194-N198 PolarHBondContact O-N 3Å; I194-N198 PolarHBondContact O-ND2 3.33Å; I194-F323 HydrophobicContact CD1-CE2 4.49Å; I194-F323 HydrophobicContact CG1-CD1 4.17Å; I194-F323 HydrophobicContact CG1-CD2 3.87Å; I194-F323 HydrophobicContact CG1-CE1 4.06Å; I194-F323 HydrophobicContact CG1-CE2 3.75Å; I194-F323 HydrophobicContact CG1-CG 4.09Å; I194-F323 HydrophobicContact CG1-CZ 3.86Å
195	R	96.6	Very high	95.5	Very high	1 Å²	1	36.7 Å²	36.7	0%	0.004	21%	0.205	C	C	.	.	H	α-helix	trans	-67.9	-40.3	179.8	-71.7	-170.2	66.2	-149.1	-1.6	112.6	L144 E155 V156 V191 T192 G193 F197 N198 R199 E206 I208	L144-R195 HydrophobicContact CD1-CB 4.48Å; L144-R195 PolarHBondContact O-NH1 3.03Å; L144-R195 PolarHBondContact O-NH2 3.2Å; E155-R195 HydrophobicContact CG-CG 4.18Å; E155-R195 IonicContact OE1-NE 3.4Å; E155-R195 IonicContact OE2-CZ 2.89Å; E155-R195 IonicContact OE2-NE 3.99Å; E155-R195 PolarHBondContact OE2-NE 2.78Å; E155-R195 IonicContact OE2-NH2 3.32Å; E155-R195 PolarHBondContact OE2-NH2 2.79Å; V156-R195 VanDerWaalsContact CG2-CD 3.49Å; V191-R195 HydrophobicContact CG1-CG 4.48Å; V191-R195 WeakPolarHBondContact O-CG 3.39Å; V191-R195 PolarHBondContact O-N 3.15Å; T192-R195 PolarHBondContact O-N 3.41Å; G193-R195 VanDerWaalsContact C-N 3.33Å; G193-R195 PolarHBondContact O-N 2.89Å; R195-F197 VanDerWaalsContact C-N 3.31Å; R195-F197 PolarHBondContact O-N 2.85Å; R195-N198 PolarHBondContact O-N 3.26Å; R195-R199 WeakPolarHBondContact O-CB 3.31Å; R195-R199 PolarHBondContact O-N 3.22Å; R195-E206 PolarHBondContact NH2-O 2.92Å; R195-I208 HydrophobicContact CB-CD1 4.11Å
196	L	97.2	Very high	95	Very high	4 Å²	4	37.4 Å²	37.4	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-60.9	-41.8	173.5	-68	170	0	0	0	111.7	L144 T192 G193 R199 D200 I208 L326 W330	L144-L196 HydrophobicContact CD1-CD2 4.44Å; L144-L196 HydrophobicContact CD1-CG 4.41Å; T192-L196 HydrophobicContact CG2-CD1 4.14Å; T192-L196 VanDerWaalsContact O-CG 3.32Å; T192-L196 WeakPolarHBondContact O-CG 3.33Å; T192-L196 PolarHBondContact O-N 3.37Å; G193-L196 PolarHBondContact O-N 3.04Å; L196-R199 WeakPolarHBondContact O-CB 3.36Å; L196-R199 PolarHBondContact O-N 2.88Å; L196-D200 PolarHBondContact O-N 2.96Å; L196-D200 VanDerWaalsContact O-N 3.1Å; L196-I208 HydrophobicContact CD2-CD1 4.42Å; L196-I208 HydrophobicContact CD2-CG2 4.1Å; L196-L326 HydrophobicContact CD1-CB 4.27Å; L196-W330 HydrophobicContact CD1-CB 3.56Å; L196-W330 HydrophobicContact CD1-CD2 4.03Å; L196-W330 HydrophobicContact CD1-CE3 4.21Å; L196-W330 HydrophobicContact CD1-CG 3.76Å; L196-W330 HydrophobicContact CD2-CD2 3.43Å; L196-W330 VanDerWaalsContact CD2-CD2 3.43Å; L196-W330 HydrophobicContact CD2-CE3 3.51Å; L196-W330 HydrophobicContact CD2-CG 3.93Å; L196-W330 HydrophobicContact CD2-CH2 4.22Å; L196-W330 HydrophobicContact CD2-CZ2 4.12Å; L196-W330 HydrophobicContact CD2-CZ3 3.92Å; L196-W330 HydrophobicContact CG-CD2 4.37Å; L196-W330 HydrophobicContact CG-CE3 4.5Å; L196-W330 HydrophobicContact CG-CG 4.46Å
197	F	96.2	Very high	94.6	Very high	19 Å²	19	35.5 Å²	35.5	8%	0.083	21%	0.212	C	C	.	.	H	α-helix	trans	-66.1	-42.3	175.1	178.4	-104.1	0	0	0	112.8	G193 I194 R195 R199 D200 C201 L301 L304 K305 I308 F323	G193-F197 WeakPolarHBondContact O-CB 3.43Å; G193-F197 PolarHBondContact O-N 3.38Å; I194-F197 PolarHBondContact O-N 3.47Å; R195-F197 VanDerWaalsContact C-N 3.31Å; R195-F197 PolarHBondContact O-N 2.85Å; F197-R199 VanDerWaalsContact C-N 3.3Å; F197-R199 PolarHBondContact O-N 3.48Å; F197-D200 PolarHBondContact O-N 3.16Å; F197-C201 WeakPolarHBondContact CZ-SG 3.43Å; F197-C201 WeakPolarHBondContact O-CB 3.4Å; F197-C201 PolarHBondContact O-N 2.89Å; F197-C201 PolarHBondContact O-SG 2.98Å; F197-C201 VanDerWaalsContact O-SG 3.33Å; F197-L301 HydrophobicContact CB-CD2 4.37Å; F197-L301 HydrophobicContact CD2-CD2 4.28Å; F197-L304 HydrophobicContact CB-CD1 4.42Å; F197-L304 HydrophobicContact CD2-CB 3.66Å; F197-L304 HydrophobicContact CD2-CD1 4.03Å; F197-L304 HydrophobicContact CD2-CG 4.47Å; F197-L304 HydrophobicContact CE2-CB 3.56Å; F197-L304 HydrophobicContact CG-CD1 4.39Å; F197-L304 HydrophobicContact CZ-CB 4.39Å; F197-K305 HydrophobicContact CE2-CG 3.87Å; F197-K305 HydrophobicContact CZ-CG 4.44Å; F197-I308 HydrophobicContact CD1-CD1 4.31Å; F197-I308 HydrophobicContact CE1-CD1 3.59Å; F197-I308 HydrophobicContact CE2-CD1 4.33Å; F197-I308 HydrophobicContact CZ-CD1 3.6Å; F197-F323 HydrophobicContact CB-CE1 3.93Å; F197-F323 HydrophobicContact CD1-CE1 4.47Å; F197-F323 HydrophobicContact CG-CE1 4.23Å
198	N	94.7	Very high	94.4	Very high	43 Å²	43	35.7 Å²	35.7	23%	0.23	21%	0.213	C	C	.	.	H	α-helix	trans	-64	-36.6	176.7	-73.6	-18.4	0	0	0	112	I194 R195 C201 G202 K203 G204	I194-N198 WeakPolarHBondContact O-CB 3.23Å; I194-N198 VanDerWaalsContact O-CG 3.25Å; I194-N198 PolarHBondContact O-N 3Å; I194-N198 PolarHBondContact O-ND2 3.33Å; R195-N198 PolarHBondContact O-N 3.26Å; N198-C201 PolarHBondContact O-N 3.24Å; N198-G202 PolarHBondContact O-N 2.91Å; N198-K203 PolarHBondContact O-N 3.33Å; N198-G204 PolarHBondContact O-N 3.29Å
199	R	95.4	Very high	94.2	Very high	57 Å²	57	41.1 Å²	41.1	22%	0.215	24%	0.242	C	C	.	.	H	α-helix	trans	-58.4	-53.2	171.5	-170	-175.2	76.6	156.5	3.1	111.6	R195 L196 F197 C201 G202 G204 I208 D209 W330	R195-R199 WeakPolarHBondContact O-CB 3.31Å; R195-R199 PolarHBondContact O-N 3.22Å; L196-R199 WeakPolarHBondContact O-CB 3.36Å; L196-R199 PolarHBondContact O-N 2.88Å; F197-R199 VanDerWaalsContact C-N 3.3Å; F197-R199 PolarHBondContact O-N 3.48Å; R199-C201 PolarHBondContact O-N 3.43Å; R199-G202 PolarHBondContact O-N 3.48Å; R199-G204 WeakPolarHBondContact CA-O 3.33Å; R199-I208 VanDerWaalsContact NH1-CG2 3.29Å; R199-I208 PolarHBondContact NH1-O 2.9Å; R199-D209 PolarHBondContact NH1-O 3.2Å; R199-W330 VanDerWaalsContact NH1-CH2 3.27Å
200	D	94.7	Very high	94	Very high	65 Å²	65	42.7 Å²	42.7	35%	0.348	25%	0.252	S	S	.	.	H	α-helix	trans	-64.4	-28.2	-179.2	-179.1	68.2	0	0	0	112.8	L196 F197 G202 L301 K305	L196-D200 PolarHBondContact O-N 2.96Å; L196-D200 VanDerWaalsContact O-N 3.1Å; F197-D200 PolarHBondContact O-N 3.16Å; D200-G202 VanDerWaalsContact C-N 3.3Å; D200-G202 PolarHBondContact O-N 3.49Å; D200-L301 HydrophobicContact CB-CD1 4.01Å; D200-L301 HydrophobicContact CB-CD2 3.87Å; D200-L301 HydrophobicContact CB-CG 4.45Å; D200-K305 IonicContact OD1-NZ 3.7Å; D200-K305 WeakPolarHBondContact OD2-CE 3.14Å; D200-K305 IonicContact OD2-NZ 2.64Å; D200-K305 PolarHBondContact OD2-NZ 3.26Å
201	C	92.8	Very high	93.9	Very high	43 Å²	43	43.3 Å²	43.3	29%	0.291	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-3.9	171.7	-69.1	0	0	0	0	114.5	F197 N198 R199 K203	F197-C201 WeakPolarHBondContact CZ-SG 3.43Å; F197-C201 WeakPolarHBondContact O-CB 3.4Å; F197-C201 PolarHBondContact O-N 2.89Å; F197-C201 PolarHBondContact O-SG 2.98Å; F197-C201 VanDerWaalsContact O-SG 3.33Å; N198-C201 PolarHBondContact O-N 3.24Å; R199-C201 PolarHBondContact O-N 3.43Å; C201-K203 HydrophobicContact CB-CB 4.46Å; C201-K203 HydrophobicContact CB-CD 4.2Å; C201-K203 HydrophobicContact CB-CG 4.16Å; C201-K203 PolarHBondContact O-N 3.2Å
202	G	91.6	Very high	93.9	Very high	71 Å²	71	43.8 Å²	43.8	73%	0.732	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.2	21.3	-173.8	0	0	0	0	0	114.2	N198 R199 D200	N198-G202 PolarHBondContact O-N 2.91Å; R199-G202 PolarHBondContact O-N 3.48Å; D200-G202 VanDerWaalsContact C-N 3.3Å; D200-G202 PolarHBondContact O-N 3.49Å
203	K	89.8	Confident	93.8	Very high	175 Å²	175	45.9 Å²	45.9	76%	0.761	28%	0.275	S	S	*	.	S	Bend	trans	-106.8	1	-177.3	-66.1	179.8	-177.2	176.2	0	113.4	N198 C201	N198-K203 PolarHBondContact O-N 3.33Å; C201-K203 HydrophobicContact CB-CB 4.46Å; C201-K203 HydrophobicContact CB-CD 4.2Å; C201-K203 HydrophobicContact CB-CG 4.16Å; C201-K203 PolarHBondContact O-N 3.2Å
204	G	90.8	Very high	93.8	Very high	33 Å²	33	49.3 Å²	49.3	34%	0.34	30%	0.296	S	S	.	.			trans	179.1	-155.6	-175.2	0	0	0	0	0	111.3	E155 N198 R199	E155-G204 WeakPolarHBondContact OE1-CA 3.49Å; N198-G204 PolarHBondContact O-N 3.29Å; R199-G204 WeakPolarHBondContact CA-O 3.33Å
205	G	89.2	Confident	93.9	Very high	9 Å²	9	48.6 Å²	48.6	9%	0.093	29%	0.293	C	S	.	.			trans	85.8	22.7	177.8	0	0	0	0	0	115.4	E155 G207 I208	E155-G205 PolarHBondContact OE1-N 3.28Å; E155-G205 PolarHBondContact OE2-N 3.47Å; G205-G207 PolarHBondContact O-N 3.33Å; G205-I208 PolarHBondContact O-N 3.14Å
206	E	87.8	Confident	93.8	Very high	93 Å²	93	53.2 Å²	53.2	44%	0.435	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	133.1	173	-169.6	87.2	154.5	0	0	109.6	K151 R195 I208	K151-E206 HydrophobicContact CB-CG 4.26Å; K151-E206 HydrophobicContact CD-CG 4.01Å; K151-E206 WeakPolarHBondContact CD-OE1 3.48Å; K151-E206 IonicContact NZ-OE1 2.77Å; K151-E206 PolarHBondContact NZ-OE1 3.25Å; R195-E206 PolarHBondContact NH2-O 2.92Å; E206-I208 VanDerWaalsContact C-N 3.31Å; E206-I208 PolarHBondContact O-N 3.07Å
207	G	87.4	Confident	93.8	Very high	45 Å²	45	58.1 Å²	58.1	46%	0.464	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.6	8.7	179.4	0	0	0	0	0	115.3	G205	G205-G207 PolarHBondContact O-N 3.33Å
208	I	94.4	Very high	93.8	Very high	16 Å²	16	58.8 Å²	58.8	8%	0.082	35%	0.353	C	S	.	.			trans	-98.6	107.2	173.8	-54.5	179.9	0	0	0	109.8	L144 R195 L196 R199 G205 E206 W330	L144-I208 HydrophobicContact CB-CD1 4.5Å; L144-I208 HydrophobicContact CB-CG1 4.17Å; L144-I208 HydrophobicContact CD1-CD1 3.94Å; L144-I208 HydrophobicContact CD1-CG1 4.41Å; L144-I208 HydrophobicContact CD2-CG1 4.29Å; L144-I208 HydrophobicContact CD2-CG2 4.1Å; R195-I208 HydrophobicContact CB-CD1 4.11Å; L196-I208 HydrophobicContact CD2-CD1 4.42Å; L196-I208 HydrophobicContact CD2-CG2 4.1Å; R199-I208 VanDerWaalsContact NH1-CG2 3.29Å; R199-I208 PolarHBondContact NH1-O 2.9Å; G205-I208 PolarHBondContact O-N 3.14Å; E206-I208 VanDerWaalsContact C-N 3.31Å; E206-I208 PolarHBondContact O-N 3.07Å; I208-W330 HydrophobicContact CG2-CH2 4.04Å; I208-W330 HydrophobicContact CG2-CZ2 3.5Å; I208-W330 VanDerWaalsContact CG2-CZ2 3.5Å
209	D	93	Very high	94	Very high	116 Å²	116	57.1 Å²	57.1	62%	0.62	34%	0.344	S	S	*	.			trans	-62.3	148.8	175.1	-62.4	-46.9	0	0	0	112.3	R199 L211 W330	R199-D209 PolarHBondContact NH1-O 3.2Å; D209-L211 VanDerWaalsContact C-N 3.26Å; D209-L211 HydrophobicContact CB-CD2 4.24Å; D209-L211 PolarHBondContact O-N 2.96Å; D209-W330 WeakPolarHBondContact O-CH2 3.38Å; D209-W330 WeakPolarHBondContact O-CZ2 3.48Å
210	D	95	Very high	94.1	Very high	84 Å²	84	56.9 Å²	56.9	45%	0.449	35%	0.35	S	S	.	.			trans	-81	73.9	174.3	-167.2	4.7	0	0	0	110.7	P212 A213 V214	D210-P212 VanDerWaalsContact C-N 3.33Å; D210-P212 WeakPolarHBondContact OD1-CD 3.44Å; D210-A213 HydrophobicContact CB-CB 4.04Å; D210-A213 PolarHBondContact O-N 3.49Å; D210-A213 VanDerWaalsContact OD2-CB 3.3Å; D210-A213 WeakPolarHBondContact OD2-CB 3.49Å; D210-V214 WeakPolarHBondContact O-CG2 3.47Å; D210-V214 PolarHBondContact O-N 2.77Å
211	L	96.2	Very high	94.2	Very high	16 Å²	16	56.3 Å²	56.3	8%	0.084	35%	0.354	C	S	.	.	H	α-helix	trans	-52	-43.6	-178.1	-58.6	179.3	0	0	0	113.2	D209 A213 V214 L215 W330 L333 Q334	D209-L211 VanDerWaalsContact C-N 3.26Å; D209-L211 HydrophobicContact CB-CD2 4.24Å; D209-L211 PolarHBondContact O-N 2.96Å; L211-A213 PolarHBondContact O-N 3.17Å; L211-V214 PolarHBondContact O-N 3.29Å; L211-L215 WeakPolarHBondContact O-CB 3.09Å; L211-L215 VanDerWaalsContact O-CG 3.28Å; L211-L215 WeakPolarHBondContact O-CG 3.38Å; L211-L215 PolarHBondContact O-N 2.7Å; L211-W330 HydrophobicContact CB-CH2 4.08Å; L211-W330 HydrophobicContact CB-CZ2 4.17Å; L211-W330 HydrophobicContact CD1-CD2 4.28Å; L211-W330 HydrophobicContact CD1-CH2 4.25Å; L211-W330 HydrophobicContact CD1-CZ2 3.55Å; L211-W330 HydrophobicContact CG-CH2 3.99Å; L211-W330 HydrophobicContact CG-CZ2 3.57Å; L211-L333 HydrophobicContact CB-CB 4.32Å; L211-L333 HydrophobicContact CD1-CB 4.23Å; L211-Q334 HydrophobicContact CD1-CB 4.31Å; L211-Q334 HydrophobicContact CD1-CG 3.39Å
212	P	97.1	Very high	94.3	Very high	12 Å²	12	55.1 Å²	55.1	8%	0.078	35%	0.345	C	S	.	.	H	α-helix	trans	-52.8	-49.5	172	-28.9	35.7	0	0	0	113.5	D210 L215 H216 T294 L297 L333	D210-P212 VanDerWaalsContact C-N 3.33Å; D210-P212 WeakPolarHBondContact OD1-CD 3.44Å; P212-L215 PolarHBondContact O-N 3.37Å; P212-H216 VanDerWaalsContact O-CB 3.3Å; P212-H216 WeakPolarHBondContact O-CB 3.26Å; P212-H216 PolarHBondContact O-CD2 3.17Å; P212-H216 PolarHBondContact O-N 3.08Å; P212-T294 HydrophobicContact CB-CG2 3.97Å; P212-L297 HydrophobicContact CG-CD2 4.23Å; P212-L333 HydrophobicContact CG-CD1 4.04Å
213	A	96.4	Very high	94.6	Very high	45 Å²	45	53.8 Å²	53.8	37%	0.372	32%	0.321	S	S	.	.	H	α-helix	trans	-66.3	-41.3	179.3	0	0	0	0	0	112.3	D210 L211 H216 V217	D210-A213 HydrophobicContact CB-CB 4.04Å; D210-A213 PolarHBondContact O-N 3.49Å; D210-A213 VanDerWaalsContact OD2-CB 3.3Å; D210-A213 WeakPolarHBondContact OD2-CB 3.49Å; L211-A213 PolarHBondContact O-N 3.17Å; A213-H216 PolarHBondContact O-N 3.17Å; A213-V217 WeakPolarHBondContact O-CG2 3.25Å; A213-V217 PolarHBondContact O-N 3.05Å
214	V	96.9	Very high	95	Very high	72 Å²	72	52.1 Å²	52.1	44%	0.436	32%	0.316	S	S	.	.	H	α-helix	trans	-59.8	-48.1	176.6	172.3	0	0	0	0	110.6	D210 L211 V217 A218	D210-V214 WeakPolarHBondContact O-CG2 3.47Å; D210-V214 PolarHBondContact O-N 2.77Å; L211-V214 PolarHBondContact O-N 3.29Å; V214-V217 PolarHBondContact O-N 2.95Å; V214-A218 VanDerWaalsContact O-CB 3.29Å; V214-A218 WeakPolarHBondContact O-CB 3.29Å; V214-A218 PolarHBondContact O-N 3.28Å
215	L	97.9	Very high	95.2	Very high	2 Å²	2	54.6 Å²	54.6	1%	0.01	32%	0.318	C	S	.	.	H	α-helix	trans	-67.6	-39.6	179.6	-71.3	164.9	0	0	0	112.1	L211 P212 V217 A218 I219 V290 L333 E336 V340	L211-L215 WeakPolarHBondContact O-CB 3.09Å; L211-L215 VanDerWaalsContact O-CG 3.28Å; L211-L215 WeakPolarHBondContact O-CG 3.38Å; L211-L215 PolarHBondContact O-N 2.7Å; P212-L215 PolarHBondContact O-N 3.37Å; L215-V217 PolarHBondContact O-N 2.93Å; L215-A218 PolarHBondContact O-N 3.23Å; L215-I219 HydrophobicContact CB-CD1 4.29Å; L215-I219 HydrophobicContact CD2-CD1 4.26Å; L215-I219 WeakPolarHBondContact O-CB 3.49Å; L215-I219 WeakPolarHBondContact O-CG1 3.38Å; L215-I219 PolarHBondContact O-N 3.07Å; L215-V290 HydrophobicContact CB-CG1 3.92Å; L215-V290 HydrophobicContact CB-CG2 4.44Å; L215-V290 HydrophobicContact CD1-CG1 4.16Å; L215-V290 HydrophobicContact CD1-CG2 3.87Å; L215-L333 HydrophobicContact CD1-CB 4.42Å; L215-L333 HydrophobicContact CD1-CD2 3.9Å; L215-E336 HydrophobicContact CD1-CB 4.12Å; L215-E336 HydrophobicContact CD2-CB 4.19Å; L215-V340 HydrophobicContact CD2-CG2 4.4Å
216	H	96.3	Very high	95.6	Very high	98 Å²	98	54.2 Å²	54.2	45%	0.454	31%	0.314	S	S	.	.	H	α-helix	trans	-62.9	-20.8	175.6	-87.4	-59.3	0	0	0	113.8	P212 A213 P220	P212-H216 VanDerWaalsContact O-CB 3.3Å; P212-H216 WeakPolarHBondContact O-CB 3.26Å; P212-H216 PolarHBondContact O-CD2 3.17Å; P212-H216 PolarHBondContact O-N 3.08Å; A213-H216 PolarHBondContact O-N 3.17Å; H216-P220 VanDerWaalsContact O-CD 3.23Å; H216-P220 WeakPolarHBondContact O-CD 3.23Å; H216-P220 VanDerWaalsContact O-CG 3.29Å; H216-P220 WeakPolarHBondContact O-CG 3.48Å
217	V	96.5	Very high	96.1	Very high	107 Å²	107	53 Å²	53	65%	0.648	31%	0.311	S	S	*	.	H	α-helix	trans	-93.5	-46.4	172.3	175.5	0	0	0	0	111.2	A213 V214 L215 A221	A213-V217 WeakPolarHBondContact O-CG2 3.25Å; A213-V217 PolarHBondContact O-N 3.05Å; V214-V217 PolarHBondContact O-N 2.95Å; L215-V217 PolarHBondContact O-N 2.93Å; V217-A221 WeakPolarHBondContact O-CB 3.34Å; V217-A221 PolarHBondContact O-N 2.79Å
218	A	96.2	Very high	96.6	Very high	33 Å²	33	58.2 Å²	58.2	27%	0.273	32%	0.317	S	S	.	.	H	α-helix	trans	-65.3	-47.5	-174.4	0	0	0	0	0	112.4	V214 L215 A221 T222	V214-A218 VanDerWaalsContact O-CB 3.29Å; V214-A218 WeakPolarHBondContact O-CB 3.29Å; V214-A218 PolarHBondContact O-N 3.28Å; L215-A218 PolarHBondContact O-N 3.23Å; A218-A221 PolarHBondContact O-N 3.15Å; A218-T222 PolarHBondContact O-N 2.97Å; A218-T222 PolarHBondContact O-OG1 3.4Å; A218-T222 VanDerWaalsContact O-OG1 3.04Å
219	I	97.8	Very high	96.7	Very high	7 Å²	7	58.8 Å²	58.8	4%	0.036	32%	0.32	C	S	.	.	H	α-helix	trans	-60.7	-54.1	-175.8	-71.1	172.7	0	0	0	111.4	L215 A221 T222 M223 I283 A287 V290 V340	L215-I219 HydrophobicContact CB-CD1 4.29Å; L215-I219 HydrophobicContact CD2-CD1 4.26Å; L215-I219 WeakPolarHBondContact O-CB 3.49Å; L215-I219 WeakPolarHBondContact O-CG1 3.38Å; L215-I219 PolarHBondContact O-N 3.07Å; I219-A221 VanDerWaalsContact C-N 3.3Å; I219-A221 PolarHBondContact O-N 3.34Å; I219-T222 PolarHBondContact O-N 3.5Å; I219-M223 HydrophobicContact CG2-CG 4.33Å; I219-M223 HydrophobicContact CG2-SD 3.78Å; I219-M223 VanDerWaalsContact O-CG 3.29Å; I219-M223 WeakPolarHBondContact O-CG 3.5Å; I219-M223 PolarHBondContact O-N 3.04Å; I219-I283 HydrophobicContact CG2-CG2 3.95Å; I219-A287 HydrophobicContact CG2-CB 3.65Å; I219-V290 HydrophobicContact CD1-CB 4.31Å; I219-V290 HydrophobicContact CD1-CG2 3.9Å; I219-V340 HydrophobicContact CD1-CG2 4.12Å; I219-V340 HydrophobicContact CG1-CG1 4.39Å; I219-V340 HydrophobicContact CG1-CG2 3.72Å
220	P	97.4	Very high	96.8	Very high	53 Å²	53	53.5 Å²	53.5	34%	0.344	29%	0.291	S	S	.	.	H	α-helix	trans	-61.1	-36.8	178.2	-26.1	37	0	0	0	113.4	H216 M223 Q224	H216-P220 VanDerWaalsContact O-CD 3.23Å; H216-P220 WeakPolarHBondContact O-CD 3.23Å; H216-P220 VanDerWaalsContact O-CG 3.29Å; H216-P220 WeakPolarHBondContact O-CG 3.48Å; P220-M223 PolarHBondContact O-N 3.44Å; P220-Q224 WeakPolarHBondContact O-CB 3.47Å; P220-Q224 VanDerWaalsContact O-CG 3.24Å; P220-Q224 WeakPolarHBondContact O-CG 3.26Å; P220-Q224 PolarHBondContact O-N 3.07Å
221	A	96.7	Very high	96.9	Very high	53 Å²	53	54.7 Å²	54.7	44%	0.438	29%	0.294	S	S	.	.	H	α-helix	trans	-64	-44.9	177.2	0	0	0	0	0	111.7	V217 A218 I219 H225	V217-A221 WeakPolarHBondContact O-CB 3.34Å; V217-A221 PolarHBondContact O-N 2.79Å; A218-A221 PolarHBondContact O-N 3.15Å; I219-A221 VanDerWaalsContact C-N 3.3Å; I219-A221 PolarHBondContact O-N 3.34Å; A221-H225 WeakPolarHBondContact O-CB 3.36Å; A221-H225 PolarHBondContact O-N 3.29Å; A221-H225 VanDerWaalsContact O-N 3.1Å
222	T	96.6	Very high	96.9	Very high	17 Å²	17	56.2 Å²	56.2	10%	0.104	30%	0.304	C	S	.	.	H	α-helix	trans	-65.3	-43	176.3	-55.2	0	0	0	0	111.3	A218 I219 H225 I226 I283	A218-T222 PolarHBondContact O-N 2.97Å; A218-T222 PolarHBondContact O-OG1 3.4Å; A218-T222 VanDerWaalsContact O-OG1 3.04Å; I219-T222 PolarHBondContact O-N 3.5Å; T222-H225 PolarHBondContact O-N 3.27Å; T222-I226 HydrophobicContact CG2-CD1 3.88Å; T222-I226 WeakPolarHBondContact O-CG1 3.36Å; T222-I226 PolarHBondContact O-N 2.95Å; T222-I283 HydrophobicContact CG2-CD1 3.62Å
223	M	97.4	Very high	96.8	Very high	44 Å²	44	55.9 Å²	55.9	22%	0.217	30%	0.302	C	S	.	.	H	α-helix	trans	-58.7	-51.5	176.2	-71.4	176.2	63.7	0	0	111.7	I219 P220 H225 I226 D227 L280 I283 I284	I219-M223 HydrophobicContact CG2-CG 4.33Å; I219-M223 HydrophobicContact CG2-SD 3.78Å; I219-M223 VanDerWaalsContact O-CG 3.29Å; I219-M223 WeakPolarHBondContact O-CG 3.5Å; I219-M223 PolarHBondContact O-N 3.04Å; P220-M223 PolarHBondContact O-N 3.44Å; M223-H225 PolarHBondContact O-N 3.38Å; M223-I226 PolarHBondContact O-N 3.43Å; M223-I226 VanDerWaalsContact O-N 3.16Å; M223-D227 WeakPolarHBondContact O-CB 3.42Å; M223-D227 PolarHBondContact O-N 3.31Å; M223-L280 HydrophobicContact CB-CD1 4.32Å; M223-L280 HydrophobicContact CG-CD1 4.21Å; M223-I283 HydrophobicContact CG-CB 4.47Å; M223-I283 HydrophobicContact CG-CG2 3.45Å; M223-I283 VanDerWaalsContact CG-CG2 3.45Å; M223-I283 HydrophobicContact SD-CG2 4.18Å; M223-I284 HydrophobicContact CE-CD1 4.43Å; M223-I284 HydrophobicContact CE-CG1 3.65Å; M223-I284 HydrophobicContact SD-CG1 4.48Å
224	Q	97.1	Very high	96.8	Very high	139 Å²	139	56.5 Å²	56.5	65%	0.65	30%	0.295	S	S	*	.	H	α-helix	trans	-58.1	-38.4	178.8	-75	174.8	5.5	0	0	112.2	P220 Y228	P220-Q224 WeakPolarHBondContact O-CB 3.47Å; P220-Q224 VanDerWaalsContact O-CG 3.24Å; P220-Q224 WeakPolarHBondContact O-CG 3.26Å; P220-Q224 PolarHBondContact O-N 3.07Å; Q224-Y228 WeakPolarHBondContact O-CB 3.34Å; Q224-Y228 PolarHBondContact O-N 2.97Å
225	H	96.4	Very high	96.7	Very high	86 Å²	86	56 Å²	56	40%	0.398	30%	0.295	S	S	.	.	H	α-helix	trans	-68.1	-42.7	178.5	-171	49	0	0	0	112.3	A221 T222 M223 Y228 Q229 F347	A221-H225 WeakPolarHBondContact O-CB 3.36Å; A221-H225 PolarHBondContact O-N 3.29Å; A221-H225 VanDerWaalsContact O-N 3.1Å; T222-H225 PolarHBondContact O-N 3.27Å; M223-H225 PolarHBondContact O-N 3.38Å; H225-Y228 PolarHBondContact O-N 3.24Å; H225-Q229 PolarHBondContact O-N 2.82Å; H225-Q229 VanDerWaalsContact O-N 3.14Å; H225-F347 AromaticContact CD2-CE1 3.09Å; H225-F347 WeakPolarHBondContact CD2-CE1 3.42Å; H225-F347 AromaticContact CD2-CZ 3.44Å; H225-F347 VanDerWaalsContact CD2-CZ 3.44Å; H225-F347 WeakPolarHBondContact CD2-CZ 3.46Å; H225-F347 AromaticContact NE2-CE1 3.25Å; H225-F347 WeakPolarHBondContact NE2-CE1 3.33Å; H225-F347 AromaticContact NE2-CZ 3.49Å; H225-F347 WeakPolarHBondContact NE2-CZ 3.41Å
226	I	97.2	Very high	96.5	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-66.1	-45.1	176.2	-67.1	165.9	0	0	0	110.8	T222 M223 Y228 Q229 L230 L276 I279 L280 I283 F347	T222-I226 HydrophobicContact CG2-CD1 3.88Å; T222-I226 WeakPolarHBondContact O-CG1 3.36Å; T222-I226 PolarHBondContact O-N 2.95Å; M223-I226 PolarHBondContact O-N 3.43Å; M223-I226 VanDerWaalsContact O-N 3.16Å; I226-Y228 VanDerWaalsContact C-N 3.3Å; I226-Y228 PolarHBondContact O-N 3.47Å; I226-Q229 PolarHBondContact O-N 3.21Å; I226-Q229 VanDerWaalsContact O-N 3.16Å; I226-L230 WeakPolarHBondContact O-CB 3.41Å; I226-L230 PolarHBondContact O-N 3.07Å; I226-L276 HydrophobicContact CG2-CB 4.3Å; I226-L276 HydrophobicContact CG2-CD2 4.39Å; I226-I279 HydrophobicContact CD1-CG2 3.74Å; I226-L280 HydrophobicContact CB-CD1 4.48Å; I226-L280 HydrophobicContact CG2-CB 3.99Å; I226-L280 HydrophobicContact CG2-CD1 4.29Å; I226-I283 HydrophobicContact CD1-CD1 3.33Å; I226-F347 HydrophobicContact CG1-CD2 3.78Å; I226-F347 HydrophobicContact CG1-CE2 4Å; I226-F347 HydrophobicContact CG1-CG 4.03Å; I226-F347 HydrophobicContact CG1-CZ 4.48Å
227	D	97.6	Very high	96.5	Very high	69 Å²	69	53.6 Å²	53.6	37%	0.369	28%	0.284	S	S	.	.	H	α-helix	trans	-57.4	-44.3	177.1	-78.7	-35.1	0	0	0	111.4	M223 Q229 L230 E231 L280	M223-D227 WeakPolarHBondContact O-CB 3.42Å; M223-D227 PolarHBondContact O-N 3.31Å; D227-Q229 PolarHBondContact O-N 3.5Å; D227-L230 PolarHBondContact O-N 2.88Å; D227-E231 WeakPolarHBondContact O-CG 3.42Å; D227-E231 PolarHBondContact O-N 2.9Å; D227-L280 VanDerWaalsContact OD1-CD2 3.23Å; D227-L280 WeakPolarHBondContact OD1-CD2 3.37Å
228	Y	97.4	Very high	96.5	Very high	154 Å²	154	50.3 Å²	50.3	60%	0.604	26%	0.26	S	S	*	.	H	α-helix	trans	-60.6	-44	176.1	175.9	-95.5	0	0	0	112.7	Q224 H225 I226 L230 T232	Q224-Y228 WeakPolarHBondContact O-CB 3.34Å; Q224-Y228 PolarHBondContact O-N 2.97Å; H225-Y228 PolarHBondContact O-N 3.24Å; I226-Y228 VanDerWaalsContact C-N 3.3Å; I226-Y228 PolarHBondContact O-N 3.47Å; Y228-L230 VanDerWaalsContact C-N 3.35Å; Y228-T232 PolarHBondContact O-N 3.25Å; Y228-T232 VanDerWaalsContact O-N 3.12Å; Y228-T232 PolarHBondContact O-OG1 2.94Å
229	Q	96.5	Very high	96.4	Very high	28 Å²	28	50 Å²	50	13%	0.131	25%	0.252	C	S	.	.	H	α-helix	trans	-67.9	-36.1	175.8	-69	-54.7	-19.9	0	0	112.3	H225 I226 D227 T232 A233 L276 F347	H225-Q229 PolarHBondContact O-N 2.82Å; H225-Q229 VanDerWaalsContact O-N 3.14Å; I226-Q229 PolarHBondContact O-N 3.21Å; I226-Q229 VanDerWaalsContact O-N 3.16Å; D227-Q229 PolarHBondContact O-N 3.5Å; Q229-T232 WeakPolarHBondContact O-CB 3.37Å; Q229-T232 PolarHBondContact O-N 3Å; Q229-A233 WeakPolarHBondContact O-CB 3.32Å; Q229-A233 PolarHBondContact O-N 3.16Å; Q229-L276 HydrophobicContact CB-CD1 3.93Å; Q229-F347 HydrophobicContact CB-CE2 4.1Å; Q229-F347 HydrophobicContact CB-CZ 4.35Å; Q229-F347 HydrophobicContact CG-CE2 3.85Å; Q229-F347 HydrophobicContact CG-CZ 3.61Å
230	L	97	Very high	96.3	Very high	4 Å²	4	49.8 Å²	49.8	2%	0.021	25%	0.25	C	S	.	.	H	α-helix	trans	-63.5	-43.4	178.1	-172.7	64.9	0	0	0	111.1	I226 D227 Y228 T232 A233 R234 E273 L276 Q277 L280	I226-L230 WeakPolarHBondContact O-CB 3.41Å; I226-L230 PolarHBondContact O-N 3.07Å; D227-L230 PolarHBondContact O-N 2.88Å; Y228-L230 VanDerWaalsContact C-N 3.35Å; L230-T232 VanDerWaalsContact C-N 3.35Å; L230-A233 PolarHBondContact O-N 3.41Å; L230-R234 WeakPolarHBondContact O-CB 3.41Å; L230-R234 VanDerWaalsContact O-CG 3.26Å; L230-R234 WeakPolarHBondContact O-CG 3.46Å; L230-R234 PolarHBondContact O-N 2.86Å; L230-E273 HydrophobicContact CD1-CB 4.5Å; L230-E273 HydrophobicContact CD1-CG 3.7Å; L230-L276 HydrophobicContact CB-CD1 4.13Å; L230-L276 HydrophobicContact CD1-CB 3.94Å; L230-L276 HydrophobicContact CD1-CD1 4.2Å; L230-Q277 HydrophobicContact CD1-CG 4.12Å; L230-Q277 HydrophobicContact CD2-CG 4.32Å; L230-L280 HydrophobicContact CD2-CD2 4.38Å
231	E	96.9	Very high	96.2	Very high	109 Å²	109	47.2 Å²	47.2	51%	0.509	23%	0.234	S	C	.	.	H	α-helix	trans	-65.1	-38.3	174.7	-70	-54.8	118.3	0	0	112.3	D227 R234 S235	D227-E231 WeakPolarHBondContact O-CG 3.42Å; D227-E231 PolarHBondContact O-N 2.9Å; E231-R234 PolarHBondContact O-N 3.4Å; E231-R234 IonicContact OE1-CZ 3.44Å; E231-R234 IonicContact OE1-NH1 2.63Å; E231-R234 PolarHBondContact OE1-NH1 2.97Å; E231-S235 WeakPolarHBondContact O-CB 3.48Å; E231-S235 PolarHBondContact O-N 2.91Å
232	T	95	Very high	96	Very high	49 Å²	49	44.9 Å²	44.9	30%	0.301	21%	0.214	S	C	.	.	H	α-helix	trans	-62.4	-46.1	174.2	-58.9	0	0	0	0	111.2	Y228 Q229 L230 S235 Q236	Y228-T232 PolarHBondContact O-N 3.25Å; Y228-T232 VanDerWaalsContact O-N 3.12Å; Y228-T232 PolarHBondContact O-OG1 2.94Å; Q229-T232 WeakPolarHBondContact O-CB 3.37Å; Q229-T232 PolarHBondContact O-N 3Å; L230-T232 VanDerWaalsContact C-N 3.35Å; T232-S235 PolarHBondContact O-N 3.48Å; T232-Q236 PolarHBondContact O-N 3.35Å
233	A	95.8	Very high	95.9	Very high	4 Å²	4	44 Å²	44	3%	0.033	21%	0.209	C	C	.	.	H	α-helix	trans	-63.7	-45.5	178.3	0	0	0	0	0	111.7	Q229 L230 S235 Q236 V237 I269 Y272	Q229-A233 WeakPolarHBondContact O-CB 3.32Å; Q229-A233 PolarHBondContact O-N 3.16Å; L230-A233 PolarHBondContact O-N 3.41Å; A233-S235 PolarHBondContact O-N 2.83Å; A233-Q236 PolarHBondContact O-N 2.82Å; A233-V237 WeakPolarHBondContact O-CB 3.4Å; A233-V237 WeakPolarHBondContact O-CG2 3.37Å; A233-V237 PolarHBondContact O-N 2.91Å; A233-I269 HydrophobicContact CB-CD1 4.3Å; A233-I269 HydrophobicContact CB-CG1 4.05Å; A233-I269 WeakPolarHBondContact O-CD1 3.35Å; A233-Y272 HydrophobicContact CB-CD1 3.94Å; A233-Y272 HydrophobicContact CB-CE1 4.17Å
234	R	96.8	Very high	95.7	Very high	59 Å²	59	43 Å²	43	22%	0.223	20%	0.204	C	C	.	.	H	α-helix	trans	-59.6	-43.5	176.2	-78.5	171.5	173.8	160.2	-0.4	112.6	L230 E231 Q236 V237 Y238 E273	L230-R234 WeakPolarHBondContact O-CB 3.41Å; L230-R234 VanDerWaalsContact O-CG 3.26Å; L230-R234 WeakPolarHBondContact O-CG 3.46Å; L230-R234 PolarHBondContact O-N 2.86Å; E231-R234 PolarHBondContact O-N 3.4Å; E231-R234 IonicContact OE1-CZ 3.44Å; E231-R234 IonicContact OE1-NH1 2.63Å; E231-R234 PolarHBondContact OE1-NH1 2.97Å; R234-Q236 VanDerWaalsContact C-N 3.33Å; R234-Q236 PolarHBondContact O-N 2.94Å; R234-V237 WeakPolarHBondContact O-CB 3.39Å; R234-V237 PolarHBondContact O-N 3.26Å; R234-Y238 HydrophobicContact CB-CE2 3.98Å; R234-Y238 WeakPolarHBondContact O-CD1 3.14Å; R234-Y238 WeakPolarHBondContact O-CD2 3.47Å; R234-Y238 PolarHBondContact O-N 3.12Å; R234-E273 WeakPolarHBondContact CG-OE1 3.07Å; R234-E273 IonicContact NE-OE1 2.92Å; R234-E273 PolarHBondContact NE-OE1 3.41Å
235	S	94.8	Very high	95.4	Very high	62 Å²	62	38.5 Å²	38.5	43%	0.434	18%	0.184	S	C	.	.	H	α-helix	trans	-57.8	-46.4	175.8	-178.4	0	0	0	0	111.5	E231 T232 A233 Y238 R239	E231-S235 WeakPolarHBondContact O-CB 3.48Å; E231-S235 PolarHBondContact O-N 2.91Å; T232-S235 PolarHBondContact O-N 3.48Å; A233-S235 PolarHBondContact O-N 2.83Å; S235-Y238 PolarHBondContact O-N 2.95Å; S235-R239 WeakPolarHBondContact O-CD 3.16Å; S235-R239 WeakPolarHBondContact O-CG 3.24Å; S235-R239 PolarHBondContact O-N 3.4Å
236	Q	94.1	Very high	95.2	Very high	49 Å²	49	38 Å²	38	23%	0.229	18%	0.18	C	C	.	.	H	α-helix	trans	-65.6	-43.5	176.7	-76.1	-178.9	17.4	0	0	112.7	T232 A233 R234 Y238 R239 Y240 I269	T232-Q236 PolarHBondContact O-N 3.35Å; A233-Q236 PolarHBondContact O-N 2.82Å; R234-Q236 VanDerWaalsContact C-N 3.33Å; R234-Q236 PolarHBondContact O-N 2.94Å; Q236-Y238 VanDerWaalsContact C-N 3.33Å; Q236-Y238 PolarHBondContact O-N 3.08Å; Q236-R239 WeakPolarHBondContact O-CB 3.38Å; Q236-R239 PolarHBondContact O-N 3.21Å; Q236-Y240 PolarHBondContact O-N 3.04Å; Q236-I269 HydrophobicContact CB-CD1 3.29Å; Q236-I269 HydrophobicContact CG-CD1 4.2Å
237	V	96	Very high	94.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-50.7	-53.4	172.3	159.5	0	0	0	0	110.8	A233 R234 R239 Y240 T241 L266 I269 R270	A233-V237 WeakPolarHBondContact O-CB 3.4Å; A233-V237 WeakPolarHBondContact O-CG2 3.37Å; A233-V237 PolarHBondContact O-N 2.91Å; R234-V237 WeakPolarHBondContact O-CB 3.39Å; R234-V237 PolarHBondContact O-N 3.26Å; V237-R239 VanDerWaalsContact C-N 3.25Å; V237-R239 PolarHBondContact O-N 2.99Å; V237-Y240 PolarHBondContact O-N 3.43Å; V237-T241 WeakPolarHBondContact O-CB 3.32Å; V237-T241 PolarHBondContact O-N 2.63Å; V237-T241 PolarHBondContact O-OG1 3.42Å; V237-L266 HydrophobicContact CG1-CD1 4.33Å; V237-I269 HydrophobicContact CG2-CB 4.31Å; V237-I269 HydrophobicContact CG2-CD1 4.35Å; V237-I269 HydrophobicContact CG2-CG1 4.03Å; V237-I269 HydrophobicContact CG2-CG2 3.54Å; V237-R270 VanDerWaalsContact CG1-NE 3.25Å; V237-R270 HydrophobicContact CG2-CG 4.33Å
238	Y	96.5	Very high	94.4	Very high	37 Å²	37	37.4 Å²	37.4	15%	0.145	19%	0.185	C	C	.	.	H	α-helix	trans	-61.7	-36.4	-176.8	-60.3	-25.1	0	0	0	112.4	R234 S235 Q236 A242 K376 T377 D378	R234-Y238 HydrophobicContact CB-CE2 3.98Å; R234-Y238 WeakPolarHBondContact O-CD1 3.14Å; R234-Y238 WeakPolarHBondContact O-CD2 3.47Å; R234-Y238 PolarHBondContact O-N 3.12Å; S235-Y238 PolarHBondContact O-N 2.95Å; Q236-Y238 VanDerWaalsContact C-N 3.33Å; Q236-Y238 PolarHBondContact O-N 3.08Å; Y238-A242 WeakPolarHBondContact O-CB 3.27Å; Y238-A242 PolarHBondContact O-N 3.37Å; Y238-K376 WeakPolarHBondContact CB-O 3.31Å; Y238-T377 HydrophobicContact CD2-CG2 3.94Å; Y238-T377 HydrophobicContact CE2-CG2 3.7Å; Y238-D378 HydrophobicContact CE1-CB 4.11Å
239	R	94.3	Very high	93.8	Very high	28 Å²	28	37 Å²	37	11%	0.106	19%	0.194	C	C	.	.	H	α-helix	trans	-67.3	-46.8	176.5	-68.2	169.8	72	-178.7	9.7	111.6	S235 Q236 V237 A242 I243 E363 M366 L370 V375	S235-R239 WeakPolarHBondContact O-CD 3.16Å; S235-R239 WeakPolarHBondContact O-CG 3.24Å; S235-R239 PolarHBondContact O-N 3.4Å; Q236-R239 WeakPolarHBondContact O-CB 3.38Å; Q236-R239 PolarHBondContact O-N 3.21Å; V237-R239 VanDerWaalsContact C-N 3.25Å; V237-R239 PolarHBondContact O-N 2.99Å; R239-A242 PolarHBondContact O-N 3.38Å; R239-I243 VanDerWaalsContact O-CG1 3.29Å; R239-I243 WeakPolarHBondContact O-CG1 3.29Å; R239-I243 PolarHBondContact O-N 3.1Å; R239-E363 IonicContact CZ-OE1 3.39Å; R239-E363 IonicContact CZ-OE2 2.75Å; R239-E363 IonicContact NH1-OE1 3.95Å; R239-E363 PolarHBondContact NH1-OE1 3.3Å; R239-E363 IonicContact NH1-OE2 3.17Å; R239-E363 PolarHBondContact NH1-OE2 3.31Å; R239-E363 IonicContact NH2-OE1 3.93Å; R239-E363 PolarHBondContact NH2-OE1 3.14Å; R239-E363 IonicContact NH2-OE2 3.5Å; R239-E363 PolarHBondContact NH2-OE2 2.73Å; R239-E363 VanDerWaalsContact NH2-OE2 3.08Å; R239-M366 VanDerWaalsContact CZ-SD 3.6Å; R239-M366 VanDerWaalsContact NH2-CB 3.26Å; R239-L370 HydrophobicContact CB-CD1 4.1Å; R239-L370 HydrophobicContact CG-CD1 4.02Å; R239-V375 HydrophobicContact CG-CG1 4.07Å; R239-V375 HydrophobicContact CG-CG2 4.25Å
240	Y	94	Very high	93.4	Very high	1 Å²	1	38.6 Å²	38.6	0%	0.004	20%	0.203	C	C	.	.	H	α-helix	trans	-63.2	-44.4	177.5	-70.3	-0.8	0	0	0	111.5	Q236 V237 A242 I243 L244 L262 A265 L266 I269 H357 F361 M366	Q236-Y240 PolarHBondContact O-N 3.04Å; V237-Y240 PolarHBondContact O-N 3.43Å; Y240-A242 VanDerWaalsContact C-N 3.34Å; Y240-A242 PolarHBondContact O-N 3.39Å; Y240-I243 PolarHBondContact O-N 3.28Å; Y240-L244 WeakPolarHBondContact O-CB 3.44Å; Y240-L244 WeakPolarHBondContact O-CG 3.26Å; Y240-L244 PolarHBondContact O-N 2.74Å; Y240-L262 HydrophobicContact CD1-CD1 3.73Å; Y240-L262 HydrophobicContact CD2-CD1 4.08Å; Y240-L262 HydrophobicContact CE1-CD1 4.04Å; Y240-L262 HydrophobicContact CE2-CD1 4.32Å; Y240-L262 HydrophobicContact CG-CD1 3.76Å; Y240-A265 HydrophobicContact CD2-CB 4.49Å; Y240-A265 HydrophobicContact CE2-CB 3.97Å; Y240-L266 HydrophobicContact CD2-CB 4.43Å; Y240-I269 HydrophobicContact CD2-CG2 4.31Å; Y240-H357 AromaticContact CE2-CE1 3.58Å; Y240-H357 AromaticContact CE2-ND1 3.34Å; Y240-H357 VanDerWaalsContact CE2-ND1 3.34Å; Y240-H357 WeakPolarHBondContact CE2-ND1 3.45Å; Y240-H357 AromaticContact CZ-ND1 3.53Å; Y240-H357 PolarHBondContact OH-ND1 3.14Å; Y240-F361 HydrophobicContact CD1-CD1 4.24Å; Y240-F361 HydrophobicContact CD1-CE1 4.49Å; Y240-F361 AromaticContact CE1-CD1 3.63Å; Y240-F361 HydrophobicContact CE1-CD1 3.63Å; Y240-F361 HydrophobicContact CE1-CE1 4.29Å; Y240-F361 HydrophobicContact CE1-CG 4.49Å; Y240-M366 HydrophobicContact CE1-SD 3.78Å
241	T	95.2	Very high	92.9	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-59.4	-45.4	175.6	-55.9	0	0	0	0	111.1	V237 I243 L244 E245 L432	V237-T241 WeakPolarHBondContact O-CB 3.32Å; V237-T241 PolarHBondContact O-N 2.63Å; V237-T241 PolarHBondContact O-OG1 3.42Å; T241-I243 VanDerWaalsContact C-N 3.34Å; T241-I243 PolarHBondContact O-N 3.31Å; T241-L244 PolarHBondContact O-N 2.95Å; T241-E245 HydrophobicContact CG2-CG 4.28Å; T241-E245 WeakPolarHBondContact O-CB 3.38Å; T241-E245 VanDerWaalsContact O-CG 3.28Å; T241-E245 WeakPolarHBondContact O-CG 3.37Å; T241-E245 PolarHBondContact O-N 2.94Å; T241-L432 HydrophobicContact CG2-CD2 3.26Å
242	A	94.3	Very high	92.5	Very high	3 Å²	3	45.5 Å²	45.5	3%	0.025	24%	0.244	C	C	.	.	H	α-helix	trans	-61.9	-38.5	178.4	0	0	0	0	0	113.2	Y238 R239 Y240 E245 K246 L370 V375	Y238-A242 WeakPolarHBondContact O-CB 3.27Å; Y238-A242 PolarHBondContact O-N 3.37Å; R239-A242 PolarHBondContact O-N 3.38Å; Y240-A242 VanDerWaalsContact C-N 3.34Å; Y240-A242 PolarHBondContact O-N 3.39Å; A242-E245 WeakPolarHBondContact CA-OE2 3.46Å; A242-K246 PolarHBondContact O-N 3.14Å; A242-K246 VanDerWaalsContact O-N 3.1Å; A242-L370 HydrophobicContact CB-CD2 4.15Å; A242-V375 HydrophobicContact CB-CG2 4.3Å
243	I	93.1	Very high	92.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-67.1	-44.4	176.1	-66.7	168.5	0	0	0	110.5	R239 Y240 T241 K246 A247 M253 L257 L262 F361 H369 L370	R239-I243 VanDerWaalsContact O-CG1 3.29Å; R239-I243 WeakPolarHBondContact O-CG1 3.29Å; R239-I243 PolarHBondContact O-N 3.1Å; Y240-I243 PolarHBondContact O-N 3.28Å; T241-I243 VanDerWaalsContact C-N 3.34Å; T241-I243 PolarHBondContact O-N 3.31Å; I243-K246 PolarHBondContact O-N 2.92Å; I243-A247 WeakPolarHBondContact O-CB 3.47Å; I243-A247 PolarHBondContact O-N 3.34Å; I243-M253 HydrophobicContact CB-CE 4.48Å; I243-M253 HydrophobicContact CG2-CE 3.61Å; I243-L257 HydrophobicContact CG2-CD1 3.67Å; I243-L257 HydrophobicContact CG2-CD2 4.22Å; I243-L262 HydrophobicContact CB-CD2 4Å; I243-L262 HydrophobicContact CG2-CD2 3.47Å; I243-L262 VanDerWaalsContact CG2-CD2 3.47Å; I243-F361 HydrophobicContact CD1-CE1 3.43Å; I243-F361 VanDerWaalsContact CD1-CE1 3.43Å; I243-F361 HydrophobicContact CD1-CZ 3.75Å; I243-H369 HydrophobicContact CD1-CB 4.15Å; I243-H369 HydrophobicContact CG1-CB 4.18Å; I243-H369 HydrophobicContact CG2-CB 4.19Å; I243-L370 HydrophobicContact CD1-CD2 4.08Å; I243-L370 HydrophobicContact CD1-CG 3.94Å; I243-L370 HydrophobicContact CG1-CD2 3.58Å; I243-L370 HydrophobicContact CG1-CG 3.89Å
244	L	93.1	Very high	91.6	Very high	21 Å²	21	49.3 Å²	49.3	11%	0.11	25%	0.252	C	S	.	.	H	α-helix	trans	-67.5	-37.3	179	-70.5	168.5	0	0	0	112.3	Y240 T241 A247 A248 L262 K263 L266 L430	Y240-L244 WeakPolarHBondContact O-CB 3.44Å; Y240-L244 WeakPolarHBondContact O-CG 3.26Å; Y240-L244 PolarHBondContact O-N 2.74Å; T241-L244 PolarHBondContact O-N 2.95Å; L244-A247 PolarHBondContact O-N 3.23Å; L244-A248 WeakPolarHBondContact O-CB 3.47Å; L244-A248 PolarHBondContact O-N 3.34Å; L244-L262 HydrophobicContact CD1-CG 4.36Å; L244-L262 HydrophobicContact CD2-CB 4.19Å; L244-L262 HydrophobicContact CD2-CD2 3.91Å; L244-L262 HydrophobicContact CD2-CG 4.1Å; L244-L262 HydrophobicContact CG-CD2 3.88Å; L244-L262 HydrophobicContact CG-CG 4.11Å; L244-K263 HydrophobicContact CD1-CG 4.19Å; L244-K263 HydrophobicContact CD2-CG 3.87Å; L244-L266 HydrophobicContact CD1-CB 4.29Å; L244-L266 HydrophobicContact CD1-CD2 3.68Å; L244-L430 HydrophobicContact CB-CD1 3.62Å; L244-L430 HydrophobicContact CD1-CD1 4.04Å; L244-L430 HydrophobicContact CG-CD1 4.45Å
245	E	92.6	Very high	91.1	Very high	46 Å²	46	49.7 Å²	49.7	22%	0.215	27%	0.268	C	S	.	.	H	α-helix	trans	-61.3	-44.7	172.7	-75.7	171.7	132.3	0	0	111.2	T241 A242 A248 N249 R381 L430 L432	T241-E245 HydrophobicContact CG2-CG 4.28Å; T241-E245 WeakPolarHBondContact O-CB 3.38Å; T241-E245 VanDerWaalsContact O-CG 3.28Å; T241-E245 WeakPolarHBondContact O-CG 3.37Å; T241-E245 PolarHBondContact O-N 2.94Å; A242-E245 WeakPolarHBondContact CA-OE2 3.46Å; E245-A248 PolarHBondContact O-N 2.83Å; E245-N249 PolarHBondContact O-ND2 3.46Å; E245-R381 IonicContact OE1-CZ 3.88Å; E245-R381 IonicContact OE1-NE 3.69Å; E245-R381 PolarHBondContact OE1-NE 2.87Å; E245-R381 IonicContact OE2-CZ 3.2Å; E245-R381 IonicContact OE2-NE 3.77Å; E245-R381 PolarHBondContact OE2-NE 3.14Å; E245-R381 IonicContact OE2-NH2 2.79Å; E245-R381 PolarHBondContact OE2-NH2 3.19Å; E245-L430 HydrophobicContact CG-CD2 4.48Å; E245-L432 HydrophobicContact CG-CD1 4.47Å; E245-L432 HydrophobicContact CG-CD2 4.03Å
246	K	91	Very high	90.6	Very high	74 Å²	74	52.2 Å²	52.2	32%	0.322	27%	0.273	S	S	.	.	H	α-helix	trans	-63.1	-44.7	175.5	-174.4	177.5	168.5	-173.9	0	111.5	A242 I243 A248 N249 D250 M253 H369 N371 A373	A242-K246 PolarHBondContact O-N 3.14Å; A242-K246 VanDerWaalsContact O-N 3.1Å; I243-K246 PolarHBondContact O-N 2.92Å; K246-A248 VanDerWaalsContact C-N 3.3Å; K246-A248 PolarHBondContact O-N 3.31Å; K246-N249 PolarHBondContact O-N 3.42Å; K246-D250 PolarHBondContact O-N 3.26Å; K246-M253 HydrophobicContact CB-CE 4.21Å; K246-M253 HydrophobicContact CB-SD 4.16Å; K246-M253 HydrophobicContact CD-CE 4.05Å; K246-M253 HydrophobicContact CD-SD 3.83Å; K246-M253 HydrophobicContact CG-CE 4.22Å; K246-M253 HydrophobicContact CG-SD 3.68Å; K246-H369 PolarHBondContact NZ-O 2.87Å; K246-H369 VanDerWaalsContact NZ-O 3.11Å; K246-N371 PolarHBondContact NZ-O 2.98Å; K246-A373 HydrophobicContact CD-CB 4.24Å
247	A	90.7	Very high	90.2	Very high	6 Å²	6	50.3 Å²	50.3	5%	0.05	26%	0.264	C	S	.	.	H	α-helix	trans	-68.6	-25.5	178.9	0	0	0	0	0	113.7	I243 L244 N249 D250 M253 L257	I243-A247 WeakPolarHBondContact O-CB 3.47Å; I243-A247 PolarHBondContact O-N 3.34Å; L244-A247 PolarHBondContact O-N 3.23Å; A247-N249 PolarHBondContact O-N 3.03Å; A247-D250 CarbonylContact O-C 3.22Å; A247-D250 PolarHBondContact O-N 3.47Å; A247-M253 HydrophobicContact CB-CB 4.35Å; A247-M253 HydrophobicContact CB-CE 4.31Å; A247-M253 HydrophobicContact CB-CG 3.91Å; A247-M253 HydrophobicContact CB-SD 4.2Å; A247-L257 HydrophobicContact CB-CD1 3.58Å
248	A	88	Confident	89.6	Confident	52 Å²	52	55.6 Å²	55.6	43%	0.43	29%	0.289	S	S	.	.	H	α-helix	trans	-63.3	-30	174.1	0	0	0	0	0	112	L244 E245 K246 T427	L244-A248 WeakPolarHBondContact O-CB 3.47Å; L244-A248 PolarHBondContact O-N 3.34Å; E245-A248 PolarHBondContact O-N 2.83Å; K246-A248 VanDerWaalsContact C-N 3.3Å; K246-A248 PolarHBondContact O-N 3.31Å; A248-T427 HydrophobicContact CB-CG2 3.97Å
249	N	85.2	Confident	88.8	Confident	146 Å²	146	58.4 Å²	58.4	78%	0.781	31%	0.312	S	S	*	.	H	α-helix	trans	-91.8	-10.4	177.4	-64	-40.5	0	0	0	113.7	E245 K246 A247	E245-N249 PolarHBondContact O-ND2 3.46Å; K246-N249 PolarHBondContact O-N 3.42Å; A247-N249 PolarHBondContact O-N 3.03Å
250	D	87.7	Confident	88.3	Confident	60 Å²	60	60.8 Å²	60.8	32%	0.321	32%	0.321	S	S	.	.			trans	-127.8	102.1	-176.5	-176.9	-9.9	0	0	0	111.5	K246 A247 H252 M253 R254	K246-D250 PolarHBondContact O-N 3.26Å; A247-D250 CarbonylContact O-C 3.22Å; A247-D250 PolarHBondContact O-N 3.47Å; D250-H252 PolarHBondContact O-N 3.38Å; D250-H252 WeakPolarHBondContact OD1-CB 3.39Å; D250-H252 IonicContact OD1-CD2 3.19Å; D250-H252 PolarHBondContact OD1-N 3.15Å; D250-M253 HydrophobicContact CB-CB 3.89Å; D250-M253 PolarHBondContact O-N 2.9Å; D250-M253 PolarHBondContact OD1-N 3.04Å; D250-R254 PolarHBondContact O-N 3.05Å
251	P	86.7	Confident	88	Confident	102 Å²	102	63.8 Å²	63.8	66%	0.662	34%	0.336	S	S	*	.	H	α-helix	trans	-58.1	-31.6	178.2	-25.1	34.6	0	0	0	114.5	R254 A255	P251-R254 PolarHBondContact O-N 3.01Å; P251-A255 PolarHBondContact O-N 3.27Å; P251-A255 VanDerWaalsContact O-N 3.1Å
252	H	87.9	Confident	87.7	Confident	157 Å²	157	64.1 Å²	64.1	73%	0.727	34%	0.338	S	S	*	.	H	α-helix	trans	-69.8	-46.3	179	-67.3	-72.1	0	0	0	110.5	D250 R254 A255 E256	D250-H252 PolarHBondContact O-N 3.38Å; D250-H252 WeakPolarHBondContact OD1-CB 3.39Å; D250-H252 IonicContact OD1-CD2 3.19Å; D250-H252 PolarHBondContact OD1-N 3.15Å; H252-R254 VanDerWaalsContact C-N 3.29Å; H252-R254 PolarHBondContact O-N 3.22Å; H252-A255 PolarHBondContact O-N 3.18Å; H252-E256 PolarHBondContact O-N 3.4Å
253	M	86.2	Confident	87.6	Confident	12 Å²	12	65.6 Å²	65.6	6%	0.059	34%	0.344	C	S	.	.	H	α-helix	trans	-62.4	-38	174.5	-173.3	173.3	171.1	0	0	111.4	I243 K246 A247 D250 A255 E256 L257 H369	I243-M253 HydrophobicContact CB-CE 4.48Å; I243-M253 HydrophobicContact CG2-CE 3.61Å; K246-M253 HydrophobicContact CB-CE 4.21Å; K246-M253 HydrophobicContact CB-SD 4.16Å; K246-M253 HydrophobicContact CD-CE 4.05Å; K246-M253 HydrophobicContact CD-SD 3.83Å; K246-M253 HydrophobicContact CG-CE 4.22Å; K246-M253 HydrophobicContact CG-SD 3.68Å; A247-M253 HydrophobicContact CB-CB 4.35Å; A247-M253 HydrophobicContact CB-CE 4.31Å; A247-M253 HydrophobicContact CB-CG 3.91Å; A247-M253 HydrophobicContact CB-SD 4.2Å; D250-M253 HydrophobicContact CB-CB 3.89Å; D250-M253 PolarHBondContact O-N 2.9Å; D250-M253 PolarHBondContact OD1-N 3.04Å; M253-A255 VanDerWaalsContact C-N 3.32Å; M253-A255 PolarHBondContact O-N 3Å; M253-E256 PolarHBondContact O-N 3.33Å; M253-L257 HydrophobicContact CE-CD1 3.91Å; M253-L257 HydrophobicContact CG-CD1 3.95Å; M253-L257 HydrophobicContact CG-CG 4.37Å; M253-L257 WeakPolarHBondContact O-CB 3.47Å; M253-L257 VanDerWaalsContact O-CG 3.28Å; M253-L257 WeakPolarHBondContact O-CG 3.21Å; M253-L257 PolarHBondContact O-N 2.8Å; M253-H369 HydrophobicContact CE-CB 4.14Å
254	R	85.3	Confident	87.6	Confident	120 Å²	120	67.3 Å²	67.3	45%	0.453	35%	0.352	S	S	.	.	H	α-helix	trans	-60.7	-40.3	175.1	-174.5	177	179	-179.9	2.6	112.5	D250 P251 H252 Q258 D428	D250-R254 PolarHBondContact O-N 3.05Å; P251-R254 PolarHBondContact O-N 3.01Å; H252-R254 VanDerWaalsContact C-N 3.29Å; H252-R254 PolarHBondContact O-N 3.22Å; R254-Q258 WeakPolarHBondContact O-CG 3.32Å; R254-Q258 PolarHBondContact O-N 3.44Å; R254-Q258 PolarHBondContact O-NE2 3.36Å; R254-D428 IonicContact NH2-OD2 3.08Å; R254-D428 PolarHBondContact NH2-OD2 3.49Å
255	A	86	Confident	87.7	Confident	67 Å²	67	66.7 Å²	66.7	55%	0.554	35%	0.35	S	S	*	.	H	α-helix	trans	-68.7	-42	177.2	0	0	0	0	0	111.7	P251 H252 M253 L257 Q258	P251-A255 PolarHBondContact O-N 3.27Å; P251-A255 VanDerWaalsContact O-N 3.1Å; H252-A255 PolarHBondContact O-N 3.18Å; M253-A255 VanDerWaalsContact C-N 3.32Å; M253-A255 PolarHBondContact O-N 3Å; A255-L257 VanDerWaalsContact C-N 3.28Å; A255-L257 PolarHBondContact O-N 3.21Å; A255-Q258 PolarHBondContact O-N 3.42Å
256	E	85.8	Confident	87.8	Confident	115 Å²	115	64.5 Å²	64.5	54%	0.537	34%	0.34	S	S	.	.	H	α-helix	trans	-61.6	-36.1	175.6	-174.7	177.3	-174.7	0	0	112.3	H252 M253 P259 Y260 H369	H252-E256 PolarHBondContact O-N 3.4Å; M253-E256 PolarHBondContact O-N 3.33Å; E256-P259 VanDerWaalsContact O-CD 3.28Å; E256-P259 WeakPolarHBondContact O-CD 3.47Å; E256-Y260 WeakPolarHBondContact O-CE2 3.39Å; E256-H369 IonicContact OE1-NE2 3.37Å
257	L	85	Confident	88	Confident	9 Å²	9	61 Å²	61	5%	0.047	33%	0.325	C	S	.	.	H	α-helix	trans	-81.1	-14.5	-178.1	-70.6	174	0	0	0	114.8	I243 A247 M253 A255 P259 Y260 L262 F361	I243-L257 HydrophobicContact CG2-CD1 3.67Å; I243-L257 HydrophobicContact CG2-CD2 4.22Å; A247-L257 HydrophobicContact CB-CD1 3.58Å; M253-L257 HydrophobicContact CE-CD1 3.91Å; M253-L257 HydrophobicContact CG-CD1 3.95Å; M253-L257 HydrophobicContact CG-CG 4.37Å; M253-L257 WeakPolarHBondContact O-CB 3.47Å; M253-L257 VanDerWaalsContact O-CG 3.28Å; M253-L257 WeakPolarHBondContact O-CG 3.21Å; M253-L257 PolarHBondContact O-N 2.8Å; A255-L257 VanDerWaalsContact C-N 3.28Å; A255-L257 PolarHBondContact O-N 3.21Å; L257-P259 VanDerWaalsContact C-CD 3.44Å; L257-Y260 HydrophobicContact CD2-CD2 4.31Å; L257-Y260 PolarHBondContact O-N 3.2Å; L257-Y260 VanDerWaalsContact O-N 3.1Å; L257-L262 HydrophobicContact CD1-CD2 4.38Å; L257-L262 HydrophobicContact CD2-CD2 4.4Å; L257-F361 HydrophobicContact CD2-CE2 4.35Å
258	Q	82.7	Confident	88.3	Confident	111 Å²	111	60.8 Å²	60.8	52%	0.519	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-52.4	-44.7	-177.2	-69.6	-55.1	-63.4	0	0	114	R254 A255 Y260 M261	R254-Q258 WeakPolarHBondContact O-CG 3.32Å; R254-Q258 PolarHBondContact O-N 3.44Å; R254-Q258 PolarHBondContact O-NE2 3.36Å; A255-Q258 PolarHBondContact O-N 3.42Å; Q258-Y260 PolarHBondContact O-N 2.86Å; Q258-M261 PolarHBondContact O-N 2.87Å
259	P	81	Confident	88.7	Confident	97 Å²	97	58.3 Å²	58.3	63%	0.63	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-67.3	-18.1	-177.5	-20.9	35.2	0	0	0	114.3	E256 L257	E256-P259 VanDerWaalsContact O-CD 3.28Å; E256-P259 WeakPolarHBondContact O-CD 3.47Å; L257-P259 VanDerWaalsContact C-CD 3.44Å
260	Y	82.3	Confident	89.3	Confident	77 Å²	77	51.7 Å²	51.7	30%	0.302	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-85.7	-8.5	-175.1	-64.2	-84.1	0	0	0	113.7	E256 L257 Q258 L262 Y360 F361	E256-Y260 WeakPolarHBondContact O-CE2 3.39Å; L257-Y260 HydrophobicContact CD2-CD2 4.31Å; L257-Y260 PolarHBondContact O-N 3.2Å; L257-Y260 VanDerWaalsContact O-N 3.1Å; Q258-Y260 PolarHBondContact O-N 2.86Å; Y260-L262 PolarHBondContact O-N 3.21Å; Y260-L262 VanDerWaalsContact O-N 3.13Å; Y260-Y360 WeakPolarHBondContact CD1-O 3.48Å; Y260-F361 AromaticContact CD1-CD2 3.81Å; Y260-F361 HydrophobicContact CD1-CD2 3.81Å; Y260-F361 HydrophobicContact CD1-CE2 4.21Å; Y260-F361 HydrophobicContact CE1-CD2 4.35Å; Y260-F361 HydrophobicContact CG-CD2 4.19Å; Y260-F361 HydrophobicContact CG-CE2 4.3Å
261	M	87.9	Confident	89.8	Confident	65 Å²	65	48.9 Å²	48.9	32%	0.32	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.8	40.2	-178.2	-52.7	-175.1	-164.8	0	0	112.5	P76 Q258 K263 E264 A265	P76-M261 HydrophobicContact CG-CB 4.4Å; Q258-M261 PolarHBondContact O-N 2.87Å; M261-K263 PolarHBondContact O-N 3.13Å; M261-K263 VanDerWaalsContact O-N 3.14Å; M261-E264 VanDerWaalsContact C-OE2 3.27Å; M261-E264 WeakPolarHBondContact CA-OE2 3.19Å; M261-E264 HydrophobicContact CB-CB 4.2Å; M261-E264 HydrophobicContact CB-CG 4.47Å; M261-E264 PolarHBondContact O-N 3.19Å; M261-E264 VanDerWaalsContact O-N 3.09Å; M261-A265 PolarHBondContact O-N 2.67Å
262	L	90.3	Very high	90.3	Very high	7 Å²	7	44 Å²	44	4%	0.037	22%	0.219	C	C	.	.	H	α-helix	trans	-63.5	-25.1	-169.4	-173.3	62.9	0	0	0	112.8	Y240 I243 L244 L257 Y260 L266 F361	Y240-L262 HydrophobicContact CD1-CD1 3.73Å; Y240-L262 HydrophobicContact CD2-CD1 4.08Å; Y240-L262 HydrophobicContact CE1-CD1 4.04Å; Y240-L262 HydrophobicContact CE2-CD1 4.32Å; Y240-L262 HydrophobicContact CG-CD1 3.76Å; I243-L262 HydrophobicContact CB-CD2 4Å; I243-L262 HydrophobicContact CG2-CD2 3.47Å; I243-L262 VanDerWaalsContact CG2-CD2 3.47Å; L244-L262 HydrophobicContact CD1-CG 4.36Å; L244-L262 HydrophobicContact CD2-CB 4.19Å; L244-L262 HydrophobicContact CD2-CD2 3.91Å; L244-L262 HydrophobicContact CD2-CG 4.1Å; L244-L262 HydrophobicContact CG-CD2 3.88Å; L244-L262 HydrophobicContact CG-CG 4.11Å; L257-L262 HydrophobicContact CD1-CD2 4.38Å; L257-L262 HydrophobicContact CD2-CD2 4.4Å; Y260-L262 PolarHBondContact O-N 3.21Å; Y260-L262 VanDerWaalsContact O-N 3.13Å; L262-L266 WeakPolarHBondContact O-CB 3.18Å; L262-L266 PolarHBondContact O-N 2.78Å; L262-F361 HydrophobicContact CD1-CD1 4.15Å; L262-F361 HydrophobicContact CD1-CE1 4.25Å; L262-F361 HydrophobicContact CD1-CG 4.38Å
263	K	91.8	Very high	90.7	Very high	33 Å²	33	37.2 Å²	37.2	14%	0.143	19%	0.188	C	C	.	.	H	α-helix	trans	-71.9	-46.2	174.6	-69	-174.3	-62.7	177.7	0	111	L244 M261 A265 L266 Y267 D428	L244-K263 HydrophobicContact CD1-CG 4.19Å; L244-K263 HydrophobicContact CD2-CG 3.87Å; M261-K263 PolarHBondContact O-N 3.13Å; M261-K263 VanDerWaalsContact O-N 3.14Å; K263-A265 VanDerWaalsContact C-N 3.29Å; K263-A265 PolarHBondContact O-N 3.36Å; K263-L266 CarbonylContact O-C 3.23Å; K263-L266 WeakPolarHBondContact O-CA 3.31Å; K263-L266 WeakPolarHBondContact O-CB 3.49Å; K263-L266 PolarHBondContact O-N 2.72Å; K263-L266 VanDerWaalsContact O-N 3.08Å; K263-Y267 HydrophobicContact CB-CE2 4.4Å; K263-Y267 WeakPolarHBondContact O-CD1 3.39Å; K263-Y267 WeakPolarHBondContact O-CD2 3.43Å; K263-Y267 PolarHBondContact O-N 3.23Å; K263-D428 PolarHBondContact NZ-O 3.15Å; K263-D428 IonicContact NZ-OD1 3.92Å; K263-D428 IonicContact NZ-OD2 2.64Å; K263-D428 PolarHBondContact NZ-OD2 3.37Å
264	E	93.4	Very high	91.2	Very high	36 Å²	36	37.4 Å²	37.4	17%	0.168	19%	0.189	C	C	.	.	H	α-helix	trans	-62.6	-39.6	176	-63.8	71.6	-164.6	0	0	110.4	P76 M261 Y267 N268	P76-E264 HydrophobicContact CB-CB 4.09Å; M261-E264 VanDerWaalsContact C-OE2 3.27Å; M261-E264 WeakPolarHBondContact CA-OE2 3.19Å; M261-E264 HydrophobicContact CB-CB 4.2Å; M261-E264 HydrophobicContact CB-CG 4.47Å; M261-E264 PolarHBondContact O-N 3.19Å; M261-E264 VanDerWaalsContact O-N 3.09Å; E264-Y267 PolarHBondContact O-N 2.77Å; E264-N268 PolarHBondContact O-N 2.93Å
265	A	93.4	Very high	91.8	Very high	8 Å²	8	31.8 Å²	31.8	7%	0.066	17%	0.168	C	C	.	.	H	α-helix	trans	-62.2	-42.5	170.4	0	0	0	0	0	111.8	P76 Y240 M261 K263 Y267 N268 I269 H357	P76-A265 HydrophobicContact CB-CB 4.41Å; P76-A265 HydrophobicContact CG-CB 4.34Å; Y240-A265 HydrophobicContact CD2-CB 4.49Å; Y240-A265 HydrophobicContact CE2-CB 3.97Å; M261-A265 PolarHBondContact O-N 2.67Å; K263-A265 VanDerWaalsContact C-N 3.29Å; K263-A265 PolarHBondContact O-N 3.36Å; A265-Y267 VanDerWaalsContact C-N 3.32Å; A265-Y267 PolarHBondContact O-N 2.99Å; A265-N268 WeakPolarHBondContact O-CB 3.37Å; A265-N268 PolarHBondContact O-N 3.08Å; A265-I269 WeakPolarHBondContact O-CG2 3.24Å; A265-I269 PolarHBondContact O-N 3.42Å; A265-I269 VanDerWaalsContact O-N 3.16Å; A265-H357 PolarHBondContact O-CE1 3.1Å
266	L	94.9	Very high	92.3	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-60.8	-40.3	173.4	177.7	62.4	0	0	0	111.8	V237 Y240 L244 L262 K263 I269 R270 L431	V237-L266 HydrophobicContact CG1-CD1 4.33Å; Y240-L266 HydrophobicContact CD2-CB 4.43Å; L244-L266 HydrophobicContact CD1-CB 4.29Å; L244-L266 HydrophobicContact CD1-CD2 3.68Å; L262-L266 WeakPolarHBondContact O-CB 3.18Å; L262-L266 PolarHBondContact O-N 2.78Å; K263-L266 CarbonylContact O-C 3.23Å; K263-L266 WeakPolarHBondContact O-CA 3.31Å; K263-L266 WeakPolarHBondContact O-CB 3.49Å; K263-L266 PolarHBondContact O-N 2.72Å; K263-L266 VanDerWaalsContact O-N 3.08Å; L266-I269 HydrophobicContact CD1-CG2 4.36Å; L266-I269 WeakPolarHBondContact O-CG2 3.46Å; L266-R270 HydrophobicContact CD1-CG 3.98Å; L266-R270 HydrophobicContact CG-CG 4.33Å; L266-R270 VanDerWaalsContact O-CB 3.31Å; L266-R270 WeakPolarHBondContact O-CB 3.42Å; L266-R270 WeakPolarHBondContact O-CG 3.46Å; L266-R270 PolarHBondContact O-N 3.05Å; L266-L431 HydrophobicContact CD2-CB 4.32Å
267	Y	96.5	Very high	92.8	Very high	1 Å²	1	26.9 Å²	26.9	0%	0.004	13%	0.134	C	C	.	.	H	α-helix	trans	-63.9	-42.7	176.8	-54.4	-23.6	0	0	0	111.6	K263 E264 A265 R270 Q271 G429 L431 E479 L480 L483	K263-Y267 HydrophobicContact CB-CE2 4.4Å; K263-Y267 WeakPolarHBondContact O-CD1 3.39Å; K263-Y267 WeakPolarHBondContact O-CD2 3.43Å; K263-Y267 PolarHBondContact O-N 3.23Å; E264-Y267 PolarHBondContact O-N 2.77Å; A265-Y267 VanDerWaalsContact C-N 3.32Å; A265-Y267 PolarHBondContact O-N 2.99Å; Y267-R270 PolarHBondContact O-N 3.09Å; Y267-Q271 WeakPolarHBondContact O-CB 3.4Å; Y267-Q271 PolarHBondContact O-N 3.05Å; Y267-G429 WeakPolarHBondContact CE1-O 3.47Å; Y267-G429 WeakPolarHBondContact OH-CA 3.31Å; Y267-G429 PolarHBondContact OH-O 3.24Å; Y267-L431 HydrophobicContact CD1-CD1 3.5Å; Y267-L431 VanDerWaalsContact CD1-CD1 3.5Å; Y267-L431 HydrophobicContact CD1-CG 4.17Å; Y267-L431 HydrophobicContact CE1-CD1 3.81Å; Y267-L431 HydrophobicContact CE1-CG 3.95Å; Y267-E479 HydrophobicContact CD2-CG 4.09Å; Y267-L480 HydrophobicContact CD1-CD2 3.78Å; Y267-L480 HydrophobicContact CD2-CD1 4.47Å; Y267-L480 HydrophobicContact CD2-CD2 3.65Å; Y267-L480 HydrophobicContact CD2-CG 4.14Å; Y267-L480 HydrophobicContact CE1-CD2 3.84Å; Y267-L480 HydrophobicContact CE2-CD1 3.9Å; Y267-L480 HydrophobicContact CE2-CD2 3.72Å; Y267-L480 HydrophobicContact CE2-CG 4.06Å; Y267-L480 HydrophobicContact CG-CD2 3.69Å; Y267-L483 HydrophobicContact CD1-CD2 4.39Å; Y267-L483 HydrophobicContact CG-CD2 4.44Å
268	N	96.7	Very high	93.2	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-56.3	-53.7	177.8	-176.4	-97.9	0	0	0	111.6	T80 M83 E264 A265 R270 Q271 Y272 F353 L354 H357	T80-N268 WeakPolarHBondContact CA-ND2 3.48Å; T80-N268 PolarHBondContact N-ND2 3.33Å; T80-N268 WeakPolarHBondContact OG1-CA 3.41Å; T80-N268 WeakPolarHBondContact OG1-CB 3.43Å; T80-N268 PolarHBondContact OG1-ND2 3.49Å; M83-N268 WeakPolarHBondContact CE-O 3.47Å; E264-N268 PolarHBondContact O-N 2.93Å; A265-N268 WeakPolarHBondContact O-CB 3.37Å; A265-N268 PolarHBondContact O-N 3.08Å; N268-R270 PolarHBondContact O-N 3.15Å; N268-Q271 WeakPolarHBondContact O-CB 3.46Å; N268-Q271 PolarHBondContact O-N 3.13Å; N268-Y272 PolarHBondContact O-N 3.06Å; N268-F353 PolarHBondContact ND2-O 3.08Å; N268-F353 PolarHBondContact OD1-O 2.82Å; N268-L354 WeakPolarHBondContact OD1-CD2 3.33Å; N268-H357 PolarHBondContact OD1-NE2 3.28Å
269	I	96.6	Very high	93.8	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-72.2	-30.5	-177.1	-164.3	167.1	0	0	0	113.1	A233 Q236 V237 Y240 A265 L266 Y272 E273	A233-I269 HydrophobicContact CB-CD1 4.3Å; A233-I269 HydrophobicContact CB-CG1 4.05Å; A233-I269 WeakPolarHBondContact O-CD1 3.35Å; Q236-I269 HydrophobicContact CB-CD1 3.29Å; Q236-I269 HydrophobicContact CG-CD1 4.2Å; V237-I269 HydrophobicContact CG2-CB 4.31Å; V237-I269 HydrophobicContact CG2-CD1 4.35Å; V237-I269 HydrophobicContact CG2-CG1 4.03Å; V237-I269 HydrophobicContact CG2-CG2 3.54Å; Y240-I269 HydrophobicContact CD2-CG2 4.31Å; A265-I269 WeakPolarHBondContact O-CG2 3.24Å; A265-I269 PolarHBondContact O-N 3.42Å; A265-I269 VanDerWaalsContact O-N 3.16Å; L266-I269 HydrophobicContact CD1-CG2 4.36Å; L266-I269 WeakPolarHBondContact O-CG2 3.46Å; I269-Y272 PolarHBondContact O-N 3.11Å; I269-E273 WeakPolarHBondContact O-CB 3.48Å; I269-E273 PolarHBondContact O-N 3.49Å
270	R	97.6	Very high	94.6	Very high	7 Å²	7	19.7 Å²	19.7	3%	0.026	9%	0.093	C	C	.	.	H	α-helix	trans	-65.8	-39.7	170.5	-76.6	-65.6	-164.2	-179.9	1.7	111.5	V237 L266 Y267 N268 Y272 E273 V274 D378 L431 L483	V237-R270 VanDerWaalsContact CG1-NE 3.25Å; V237-R270 HydrophobicContact CG2-CG 4.33Å; L266-R270 HydrophobicContact CD1-CG 3.98Å; L266-R270 HydrophobicContact CG-CG 4.33Å; L266-R270 VanDerWaalsContact O-CB 3.31Å; L266-R270 WeakPolarHBondContact O-CB 3.42Å; L266-R270 WeakPolarHBondContact O-CG 3.46Å; L266-R270 PolarHBondContact O-N 3.05Å; Y267-R270 PolarHBondContact O-N 3.09Å; N268-R270 PolarHBondContact O-N 3.15Å; R270-Y272 VanDerWaalsContact C-N 3.33Å; R270-E273 WeakPolarHBondContact CD-OE2 3.46Å; R270-E273 IonicContact CZ-OE2 3.03Å; R270-E273 IonicContact NH1-OE2 3.27Å; R270-E273 PolarHBondContact NH1-OE2 3.13Å; R270-E273 WeakPolarHBondContact O-CB 3.5Å; R270-E273 PolarHBondContact O-N 2.79Å; R270-V274 WeakPolarHBondContact O-CG2 3.45Å; R270-V274 PolarHBondContact O-N 3.39Å; R270-D378 IonicContact CZ-OD2 3.4Å; R270-D378 IonicContact NH1-OD2 3.95Å; R270-D378 PolarHBondContact NH1-OD2 2.92Å; R270-D378 VanDerWaalsContact NH2-CG 3.28Å; R270-D378 IonicContact NH2-OD1 3.58Å; R270-D378 PolarHBondContact NH2-OD1 3.14Å; R270-D378 IonicContact NH2-OD2 3.14Å; R270-D378 PolarHBondContact NH2-OD2 3.36Å; R270-L431 HydrophobicContact CG-CD1 4.34Å; R270-L483 HydrophobicContact CB-CD1 4.1Å; R270-L483 HydrophobicContact CB-CD2 4.3Å
271	Q	97.3	Very high	95.1	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-64.6	-41	175	-175.1	63.9	69.9	0	0	111.2	T80 M83 Q84 Y267 N268 V274 F275 L483	T80-Q271 HydrophobicContact CG2-CB 3.94Å; T80-Q271 HydrophobicContact CG2-CG 4.1Å; M83-Q271 HydrophobicContact CE-CB 3.71Å; M83-Q271 HydrophobicContact CE-CG 3.66Å; Q84-Q271 HydrophobicContact CG-CG 3.84Å; Y267-Q271 WeakPolarHBondContact O-CB 3.4Å; Y267-Q271 PolarHBondContact O-N 3.05Å; N268-Q271 WeakPolarHBondContact O-CB 3.46Å; N268-Q271 PolarHBondContact O-N 3.13Å; Q271-V274 PolarHBondContact O-N 3.19Å; Q271-F275 HydrophobicContact CG-CD2 4.1Å; Q271-F275 HydrophobicContact CG-CE2 3.58Å; Q271-F275 HydrophobicContact CG-CZ 3.97Å; Q271-F275 WeakPolarHBondContact O-CD2 3.45Å; Q271-F275 WeakPolarHBondContact O-CG 3.29Å; Q271-F275 PolarHBondContact O-N 3.04Å; Q271-L483 HydrophobicContact CB-CD1 4.19Å; Q271-L483 VanDerWaalsContact OE1-CA 3.22Å
272	Y	98.1	Very high	95.4	Very high	1 Å²	1	17.9 Å²	17.9	0%	0.004	10%	0.095	C	C	.	.	H	α-helix	trans	-61.5	-46.5	173.7	-179.6	-106.3	0	0	0	111.6	M83 A233 N268 I269 R270 V274 F275 L276 I350 L354	M83-Y272 HydrophobicContact SD-CD2 3.91Å; M83-Y272 HydrophobicContact SD-CG 4.46Å; A233-Y272 HydrophobicContact CB-CD1 3.94Å; A233-Y272 HydrophobicContact CB-CE1 4.17Å; N268-Y272 PolarHBondContact O-N 3.06Å; I269-Y272 PolarHBondContact O-N 3.11Å; R270-Y272 VanDerWaalsContact C-N 3.33Å; Y272-V274 VanDerWaalsContact C-N 3.3Å; Y272-V274 PolarHBondContact O-N 3Å; Y272-F275 PolarHBondContact O-N 3.25Å; Y272-F275 VanDerWaalsContact O-N 3.15Å; Y272-L276 HydrophobicContact CD1-CD1 3.94Å; Y272-L276 HydrophobicContact CD1-CG 4.15Å; Y272-L276 HydrophobicContact CE1-CD1 3.32Å; Y272-L276 HydrophobicContact CE1-CD2 4.28Å; Y272-L276 HydrophobicContact CE1-CG 3.8Å; Y272-L276 HydrophobicContact CE2-CD2 4.02Å; Y272-L276 HydrophobicContact CE2-CG 4.22Å; Y272-L276 WeakPolarHBondContact O-CG 3.36Å; Y272-L276 PolarHBondContact O-N 2.79Å; Y272-I350 HydrophobicContact CD2-CD1 3.92Å; Y272-I350 HydrophobicContact CD2-CG1 4.26Å; Y272-I350 HydrophobicContact CE2-CD1 3.79Å; Y272-I350 HydrophobicContact CE2-CG1 3.88Å; Y272-L354 HydrophobicContact CD1-CD1 3.73Å; Y272-L354 HydrophobicContact CD1-CD2 4.31Å; Y272-L354 HydrophobicContact CD2-CD1 4.16Å; Y272-L354 HydrophobicContact CD2-CD2 4.27Å; Y272-L354 HydrophobicContact CD2-CG 4.31Å; Y272-L354 HydrophobicContact CE1-CD1 3.66Å; Y272-L354 HydrophobicContact CE2-CD1 4.11Å; Y272-L354 HydrophobicContact CG-CD1 3.98Å; Y272-L354 HydrophobicContact CG-CD2 3.91Å; Y272-L354 HydrophobicContact CG-CG 4.3Å
273	E	97.2	Very high	95.7	Very high	14 Å²	14	17.7 Å²	17.7	7%	0.065	9%	0.094	C	C	.	.	H	α-helix	trans	-53.3	-46.9	174.8	-174.9	-172.8	-171.7	0	0	111.5	L230 R234 I269 R270 L276 Q277	L230-E273 HydrophobicContact CD1-CB 4.5Å; L230-E273 HydrophobicContact CD1-CG 3.7Å; R234-E273 WeakPolarHBondContact CG-OE1 3.07Å; R234-E273 IonicContact NE-OE1 2.92Å; R234-E273 PolarHBondContact NE-OE1 3.41Å; I269-E273 WeakPolarHBondContact O-CB 3.48Å; I269-E273 PolarHBondContact O-N 3.49Å; R270-E273 WeakPolarHBondContact CD-OE2 3.46Å; R270-E273 IonicContact CZ-OE2 3.03Å; R270-E273 IonicContact NH1-OE2 3.27Å; R270-E273 PolarHBondContact NH1-OE2 3.13Å; R270-E273 WeakPolarHBondContact O-CB 3.5Å; R270-E273 PolarHBondContact O-N 2.79Å; E273-L276 PolarHBondContact O-N 3.45Å; E273-Q277 WeakPolarHBondContact O-CG 3.41Å; E273-Q277 PolarHBondContact O-N 3.05Å; E273-Q277 PolarHBondContact OE1-NE2 3.04Å
274	V	96.1	Very high	95.9	Very high	15 Å²	15	19.1 Å²	19.1	9%	0.091	10%	0.103	C	C	.	.	H	α-helix	trans	-61.2	-46.6	177.9	168.6	0	0	0	0	111.3	R270 Q271 Y272 L276 Q277 I278 L483	R270-V274 WeakPolarHBondContact O-CG2 3.45Å; R270-V274 PolarHBondContact O-N 3.39Å; Q271-V274 PolarHBondContact O-N 3.19Å; Y272-V274 VanDerWaalsContact C-N 3.3Å; Y272-V274 PolarHBondContact O-N 3Å; V274-L276 PolarHBondContact O-N 3.44Å; V274-Q277 PolarHBondContact O-N 2.86Å; V274-I278 HydrophobicContact CG1-CD1 4.01Å; V274-I278 WeakPolarHBondContact O-CG1 3.4Å; V274-I278 PolarHBondContact O-N 2.73Å; V274-L483 HydrophobicContact CG2-CD1 4.41Å
275	F	96.9	Very high	95.9	Very high	3 Å²	3	19.8 Å²	19.8	1%	0.013	11%	0.109	C	C	.	.	H	α-helix	trans	-64.7	-38.9	179	-68.6	-31	0	0	0	112.5	M83 Q84 F87 Q271 Y272 Q277 I278 I279 I350	M83-F275 HydrophobicContact CE-CD2 4.33Å; M83-F275 HydrophobicContact CE-CE2 4.38Å; M83-F275 HydrophobicContact CG-CD2 3.97Å; M83-F275 HydrophobicContact CG-CE2 3.93Å; M83-F275 HydrophobicContact SD-CD2 4.19Å; Q84-F275 HydrophobicContact CG-CE2 4.29Å; Q84-F275 HydrophobicContact CG-CZ 4.11Å; F87-F275 HydrophobicContact CB-CD1 4.36Å; F87-F275 HydrophobicContact CB-CD2 4.15Å; F87-F275 HydrophobicContact CB-CE1 3.98Å; F87-F275 HydrophobicContact CB-CE2 3.74Å; F87-F275 HydrophobicContact CB-CG 4.45Å; F87-F275 HydrophobicContact CB-CZ 3.64Å; F87-F275 AromaticContact CD1-CD1 3.64Å; F87-F275 HydrophobicContact CD1-CD1 3.64Å; F87-F275 AromaticContact CD1-CE1 3.39Å; F87-F275 HydrophobicContact CD1-CE1 3.39Å; F87-F275 HydrophobicContact CD1-CG 4.39Å; F87-F275 AromaticContact CD1-CZ 3.94Å; F87-F275 HydrophobicContact CD1-CZ 3.94Å; F87-F275 HydrophobicContact CD2-CB 3.86Å; F87-F275 AromaticContact CD2-CD1 3.61Å; F87-F275 HydrophobicContact CD2-CD1 3.61Å; F87-F275 AromaticContact CD2-CD2 3.95Å; F87-F275 HydrophobicContact CD2-CD2 3.95Å; F87-F275 HydrophobicContact CD2-CE1 4.06Å; F87-F275 HydrophobicContact CD2-CE2 4.35Å; F87-F275 AromaticContact CD2-CG 3.55Å; F87-F275 HydrophobicContact CD2-CG 3.55Å; F87-F275 HydrophobicContact CD2-CZ 4.4Å; F87-F275 AromaticContact CE1-CD1 3.7Å; F87-F275 HydrophobicContact CE1-CD1 3.7Å; F87-F275 AromaticContact CE1-CE1 3.81Å; F87-F275 HydrophobicContact CE1-CE1 3.81Å; F87-F275 HydrophobicContact CE2-CB 3.72Å; F87-F275 AromaticContact CE2-CD1 3.66Å; F87-F275 HydrophobicContact CE2-CD1 3.66Å; F87-F275 HydrophobicContact CE2-CE1 4.41Å; F87-F275 AromaticContact CE2-CG 3.78Å; F87-F275 HydrophobicContact CE2-CG 3.78Å; F87-F275 AromaticContact CG-CD1 3.59Å; F87-F275 HydrophobicContact CG-CD1 3.59Å; F87-F275 HydrophobicContact CG-CD2 4.08Å; F87-F275 AromaticContact CG-CE1 3.53Å; F87-F275 HydrophobicContact CG-CE1 3.53Å; F87-F275 HydrophobicContact CG-CE2 4.02Å; F87-F275 AromaticContact CG-CG 3.88Å; F87-F275 HydrophobicContact CG-CG 3.88Å; F87-F275 AromaticContact CG-CZ 3.74Å; F87-F275 HydrophobicContact CG-CZ 3.74Å; F87-F275 HydrophobicContact CZ-CB 4.43Å; F87-F275 AromaticContact CZ-CD1 3.72Å; F87-F275 HydrophobicContact CZ-CD1 3.72Å; F87-F275 HydrophobicContact CZ-CE1 4.3Å; F87-F275 HydrophobicContact CZ-CG 4.31Å; Q271-F275 HydrophobicContact CG-CD2 4.1Å; Q271-F275 HydrophobicContact CG-CE2 3.58Å; Q271-F275 HydrophobicContact CG-CZ 3.97Å; Q271-F275 WeakPolarHBondContact O-CD2 3.45Å; Q271-F275 WeakPolarHBondContact O-CG 3.29Å; Q271-F275 PolarHBondContact O-N 3.04Å; Y272-F275 PolarHBondContact O-N 3.25Å; Y272-F275 VanDerWaalsContact O-N 3.15Å; F275-Q277 VanDerWaalsContact C-N 3.33Å; F275-Q277 PolarHBondContact O-N 3.36Å; F275-I278 HydrophobicContact CD1-CD1 4.29Å; F275-I278 PolarHBondContact O-N 3.34Å; F275-I279 VanDerWaalsContact O-CG1 3.26Å; F275-I279 WeakPolarHBondContact O-CG1 3.29Å; F275-I279 PolarHBondContact O-N 2.88Å; F275-I350 HydrophobicContact CB-CD1 3.95Å
276	L	97.5	Very high	96	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-60.9	-41.9	173.2	-70.2	-164.5	0	0	0	112.3	I226 Q229 L230 Y272 E273 V274 I279 L280 F347 I350	I226-L276 HydrophobicContact CG2-CB 4.3Å; I226-L276 HydrophobicContact CG2-CD2 4.39Å; Q229-L276 HydrophobicContact CB-CD1 3.93Å; L230-L276 HydrophobicContact CB-CD1 4.13Å; L230-L276 HydrophobicContact CD1-CB 3.94Å; L230-L276 HydrophobicContact CD1-CD1 4.2Å; Y272-L276 HydrophobicContact CD1-CD1 3.94Å; Y272-L276 HydrophobicContact CD1-CG 4.15Å; Y272-L276 HydrophobicContact CE1-CD1 3.32Å; Y272-L276 HydrophobicContact CE1-CD2 4.28Å; Y272-L276 HydrophobicContact CE1-CG 3.8Å; Y272-L276 HydrophobicContact CE2-CD2 4.02Å; Y272-L276 HydrophobicContact CE2-CG 4.22Å; Y272-L276 WeakPolarHBondContact O-CG 3.36Å; Y272-L276 PolarHBondContact O-N 2.79Å; E273-L276 PolarHBondContact O-N 3.45Å; V274-L276 PolarHBondContact O-N 3.44Å; L276-I279 PolarHBondContact O-N 2.76Å; L276-L280 VanDerWaalsContact O-CB 3.23Å; L276-L280 WeakPolarHBondContact O-CB 3.46Å; L276-L280 PolarHBondContact O-N 2.77Å; L276-F347 HydrophobicContact CD2-CD2 3.34Å; L276-F347 HydrophobicContact CD2-CE2 3.61Å; L276-I350 HydrophobicContact CD2-CD1 4.15Å
277	Q	95.9	Very high	96.1	Very high	79 Å²	79	20.8 Å²	20.8	37%	0.369	12%	0.118	S	C	.	.	H	α-helix	trans	-64.5	-39.9	177.8	-72	173.1	4.5	0	0	112.2	L230 E273 V274 F275 S281	L230-Q277 HydrophobicContact CD1-CG 4.12Å; L230-Q277 HydrophobicContact CD2-CG 4.32Å; E273-Q277 WeakPolarHBondContact O-CG 3.41Å; E273-Q277 PolarHBondContact O-N 3.05Å; E273-Q277 PolarHBondContact OE1-NE2 3.04Å; V274-Q277 PolarHBondContact O-N 2.86Å; F275-Q277 VanDerWaalsContact C-N 3.33Å; F275-Q277 PolarHBondContact O-N 3.36Å; Q277-S281 WeakPolarHBondContact O-CB 3.33Å; Q277-S281 PolarHBondContact O-N 3.2Å
278	I	94	Very high	96.1	Very high	48 Å²	48	26.7 Å²	26.7	25%	0.246	15%	0.145	C	C	.	.	H	α-helix	trans	-61.6	-52	175.1	-67.5	166.4	0	0	0	110.1	F87 Y91 V274 F275 L280 S281 D282	F87-I278 HydrophobicContact CE1-CD1 4.49Å; F87-I278 HydrophobicContact CZ-CB 4.32Å; F87-I278 HydrophobicContact CZ-CD1 4.36Å; F87-I278 HydrophobicContact CZ-CG2 3.96Å; Y91-I278 HydrophobicContact CE1-CG2 4.02Å; Y91-I278 HydrophobicContact CE2-CG2 3.86Å; Y91-I278 VanDerWaalsContact CZ-CG2 3.47Å; Y91-I278 VanDerWaalsContact OH-CG2 3.27Å; Y91-I278 WeakPolarHBondContact OH-CG2 3.5Å; V274-I278 HydrophobicContact CG1-CD1 4.01Å; V274-I278 WeakPolarHBondContact O-CG1 3.4Å; V274-I278 PolarHBondContact O-N 2.73Å; F275-I278 HydrophobicContact CD1-CD1 4.29Å; F275-I278 PolarHBondContact O-N 3.34Å; I278-L280 VanDerWaalsContact C-N 3.34Å; I278-L280 PolarHBondContact O-N 3.17Å; I278-S281 PolarHBondContact O-N 2.94Å; I278-D282 PolarHBondContact O-N 3.3Å; I278-D282 VanDerWaalsContact O-N 3.15Å
279	I	95.4	Very high	96	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.2	-44.6	-180	-64.6	169	0	0	0	110.9	F87 I226 F275 L276 S281 D282 I283 L343 L346 F347 I350	F87-I279 HydrophobicContact CE2-CD1 4.11Å; F87-I279 HydrophobicContact CE2-CG1 4.09Å; I226-I279 HydrophobicContact CD1-CG2 3.74Å; F275-I279 VanDerWaalsContact O-CG1 3.26Å; F275-I279 WeakPolarHBondContact O-CG1 3.29Å; F275-I279 PolarHBondContact O-N 2.88Å; L276-I279 PolarHBondContact O-N 2.76Å; I279-S281 PolarHBondContact O-N 3.05Å; I279-D282 PolarHBondContact O-N 3.27Å; I279-I283 HydrophobicContact CG2-CD1 3.8Å; I279-I283 WeakPolarHBondContact O-CG1 3.48Å; I279-I283 PolarHBondContact O-N 3.4Å; I279-L343 HydrophobicContact CG2-CB 4.09Å; I279-L343 HydrophobicContact CG2-CD2 4.42Å; I279-L346 HydrophobicContact CD1-CD2 4Å; I279-L346 HydrophobicContact CD1-CG 3.99Å; I279-L346 HydrophobicContact CG1-CD2 4.09Å; I279-F347 HydrophobicContact CD1-CB 4.06Å; I279-F347 HydrophobicContact CG2-CB 4.48Å; I279-I350 HydrophobicContact CD1-CD1 4.11Å
280	L	96.2	Very high	96.1	Very high	18 Å²	18	29.7 Å²	29.7	9%	0.094	16%	0.16	C	C	.	.	H	α-helix	trans	-63	-42.8	179.8	-176.9	60.9	0	0	0	111.9	M223 I226 D227 L230 L276 I278 D282 I283 I284	M223-L280 HydrophobicContact CB-CD1 4.32Å; M223-L280 HydrophobicContact CG-CD1 4.21Å; I226-L280 HydrophobicContact CB-CD1 4.48Å; I226-L280 HydrophobicContact CG2-CB 3.99Å; I226-L280 HydrophobicContact CG2-CD1 4.29Å; D227-L280 VanDerWaalsContact OD1-CD2 3.23Å; D227-L280 WeakPolarHBondContact OD1-CD2 3.37Å; L230-L280 HydrophobicContact CD2-CD2 4.38Å; L276-L280 VanDerWaalsContact O-CB 3.23Å; L276-L280 WeakPolarHBondContact O-CB 3.46Å; L276-L280 PolarHBondContact O-N 2.77Å; I278-L280 VanDerWaalsContact C-N 3.34Å; I278-L280 PolarHBondContact O-N 3.17Å; L280-D282 VanDerWaalsContact C-N 3.32Å; L280-D282 PolarHBondContact O-N 3.19Å; L280-I283 PolarHBondContact O-N 3.01Å; L280-I284 HydrophobicContact CD1-CD1 4.29Å; L280-I284 HydrophobicContact CD1-CG1 4.43Å; L280-I284 HydrophobicContact CG-CD1 3.92Å; L280-I284 HydrophobicContact CG-CG1 4.49Å; L280-I284 VanDerWaalsContact O-CG1 3.27Å; L280-I284 WeakPolarHBondContact O-CG1 3.36Å; L280-I284 PolarHBondContact O-N 2.89Å
281	S	94.7	Very high	96.1	Very high	65 Å²	65	33.8 Å²	33.8	46%	0.455	18%	0.179	S	C	.	.	H	α-helix	trans	-59.5	-42.6	177.2	-177.9	0	0	0	0	112	Q277 I278 I279 I284 T285	Q277-S281 WeakPolarHBondContact O-CB 3.33Å; Q277-S281 PolarHBondContact O-N 3.2Å; I278-S281 PolarHBondContact O-N 2.94Å; I279-S281 PolarHBondContact O-N 3.05Å; S281-I284 PolarHBondContact O-N 3Å; S281-T285 PolarHBondContact O-N 3.46Å; S281-T285 PolarHBondContact O-OG1 2.87Å
282	D	94.1	Very high	96.1	Very high	39 Å²	39	38.6 Å²	38.6	21%	0.209	20%	0.203	C	C	.	.	H	α-helix	trans	-67.3	-40.1	177.7	-85.1	17.4	0	0	0	111.9	Y91 I278 I279 L280 T285 G286 L343	Y91-D282 PolarHBondContact OH-OD2 2.96Å; Y91-D282 VanDerWaalsContact OH-OD2 3.07Å; I278-D282 PolarHBondContact O-N 3.3Å; I278-D282 VanDerWaalsContact O-N 3.15Å; I279-D282 PolarHBondContact O-N 3.27Å; L280-D282 VanDerWaalsContact C-N 3.32Å; L280-D282 PolarHBondContact O-N 3.19Å; D282-T285 WeakPolarHBondContact O-CB 3.47Å; D282-T285 PolarHBondContact O-N 3.39Å; D282-G286 PolarHBondContact O-N 3.2Å; D282-L343 HydrophobicContact CB-CD1 3.73Å
283	I	95.8	Very high	96.1	Very high	2 Å²	2	39 Å²	39	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-65.8	-40	175.7	-66.4	167.8	0	0	0	111.2	I219 T222 M223 I226 I279 L280 T285 G286 A287 L343	I219-I283 HydrophobicContact CG2-CG2 3.95Å; T222-I283 HydrophobicContact CG2-CD1 3.62Å; M223-I283 HydrophobicContact CG-CB 4.47Å; M223-I283 HydrophobicContact CG-CG2 3.45Å; M223-I283 VanDerWaalsContact CG-CG2 3.45Å; M223-I283 HydrophobicContact SD-CG2 4.18Å; I226-I283 HydrophobicContact CD1-CD1 3.33Å; I279-I283 HydrophobicContact CG2-CD1 3.8Å; I279-I283 WeakPolarHBondContact O-CG1 3.48Å; I279-I283 PolarHBondContact O-N 3.4Å; L280-I283 PolarHBondContact O-N 3.01Å; I283-T285 VanDerWaalsContact C-N 3.31Å; I283-T285 PolarHBondContact O-N 2.95Å; I283-G286 PolarHBondContact O-N 2.81Å; I283-A287 PolarHBondContact O-N 3.24Å; I283-L343 HydrophobicContact CD1-CB 4.35Å; I283-L343 HydrophobicContact CG1-CB 4.28Å; I283-L343 HydrophobicContact CG1-CD1 3.79Å
284	I	95.9	Very high	96.2	Very high	63 Å²	63	40 Å²	40	32%	0.323	21%	0.212	S	C	.	.	H	α-helix	trans	-61.3	-42.3	174.7	-71.4	165.6	0	0	0	110.5	M223 L280 S281 A287 Q288	M223-I284 HydrophobicContact CE-CD1 4.43Å; M223-I284 HydrophobicContact CE-CG1 3.65Å; M223-I284 HydrophobicContact SD-CG1 4.48Å; L280-I284 HydrophobicContact CD1-CD1 4.29Å; L280-I284 HydrophobicContact CD1-CG1 4.43Å; L280-I284 HydrophobicContact CG-CD1 3.92Å; L280-I284 HydrophobicContact CG-CG1 4.49Å; L280-I284 VanDerWaalsContact O-CG1 3.27Å; L280-I284 WeakPolarHBondContact O-CG1 3.36Å; L280-I284 PolarHBondContact O-N 2.89Å; S281-I284 PolarHBondContact O-N 3Å; I284-A287 WeakPolarHBondContact O-CB 3.34Å; I284-A287 PolarHBondContact O-N 3.4Å; I284-Q288 WeakPolarHBondContact O-CG 3.44Å; I284-Q288 PolarHBondContact O-N 3.07Å; I284-Q288 VanDerWaalsContact O-N 3.15Å
285	T	94	Very high	96.2	Very high	51 Å²	51	45.7 Å²	45.7	31%	0.313	24%	0.236	S	C	.	.	H	α-helix	trans	-61.7	-47.5	175.7	-55.8	0	0	0	0	110.5	S281 D282 I283 A287 Q288 E289	S281-T285 PolarHBondContact O-N 3.46Å; S281-T285 PolarHBondContact O-OG1 2.87Å; D282-T285 WeakPolarHBondContact O-CB 3.47Å; D282-T285 PolarHBondContact O-N 3.39Å; I283-T285 VanDerWaalsContact C-N 3.31Å; I283-T285 PolarHBondContact O-N 2.95Å; T285-A287 VanDerWaalsContact C-N 3.29Å; T285-A287 PolarHBondContact O-N 3.41Å; T285-Q288 PolarHBondContact O-N 3.37Å; T285-Q288 VanDerWaalsContact O-N 3.16Å; T285-E289 WeakPolarHBondContact O-CG 3.46Å; T285-E289 PolarHBondContact O-N 3.47Å
286	G	94.7	Very high	96.3	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-58.4	-38	174	0	0	0	0	0	113	D282 I283 Q288 E289 V290	D282-G286 PolarHBondContact O-N 3.2Å; I283-G286 PolarHBondContact O-N 2.81Å; G286-Q288 PolarHBondContact O-N 3.1Å; G286-E289 PolarHBondContact O-N 2.91Å; G286-V290 WeakPolarHBondContact O-CB 3.47Å; G286-V290 VanDerWaalsContact O-CG2 3.23Å; G286-V290 WeakPolarHBondContact O-CG2 3.45Å; G286-V290 PolarHBondContact O-N 3.4Å
287	A	96.7	Very high	96.3	Very high	29 Å²	29	49.8 Å²	49.8	24%	0.24	26%	0.255	C	S	.	.	H	α-helix	trans	-60	-44.6	175.8	0	0	0	0	0	112.1	I219 I283 I284 T285 E291	I219-A287 HydrophobicContact CG2-CB 3.65Å; I283-A287 PolarHBondContact O-N 3.24Å; I284-A287 WeakPolarHBondContact O-CB 3.34Å; I284-A287 PolarHBondContact O-N 3.4Å; T285-A287 VanDerWaalsContact C-N 3.29Å; T285-A287 PolarHBondContact O-N 3.41Å; A287-E291 PolarHBondContact O-N 2.94Å
288	Q	96.9	Very high	96.4	Very high	124 Å²	124	47.9 Å²	47.9	58%	0.579	26%	0.257	S	S	*	.	H	α-helix	trans	-66.5	-42	178.4	-66.3	172.2	2.6	0	0	111.4	I284 T285 G286 E291 M292	I284-Q288 WeakPolarHBondContact O-CG 3.44Å; I284-Q288 PolarHBondContact O-N 3.07Å; I284-Q288 VanDerWaalsContact O-N 3.15Å; T285-Q288 PolarHBondContact O-N 3.37Å; T285-Q288 VanDerWaalsContact O-N 3.16Å; G286-Q288 PolarHBondContact O-N 3.1Å; Q288-E291 PolarHBondContact O-N 3.11Å; Q288-M292 PolarHBondContact O-N 3.3Å; Q288-M292 VanDerWaalsContact O-N 3.08Å
289	E	95.4	Very high	96.6	Very high	62 Å²	62	48.5 Å²	48.5	29%	0.29	27%	0.268	S	S	.	.	H	α-helix	trans	-63.8	-46	176.4	-70.2	-172.2	-156.5	0	0	111.4	R94 T285 G286 E291 M292 M293 E336	R94-E289 IonicContact CZ-OE1 3.04Å; R94-E289 IonicContact CZ-OE2 4Å; R94-E289 VanDerWaalsContact CZ-OE2 3.26Å; R94-E289 IonicContact NE-OE1 3.84Å; R94-E289 IonicContact NE-OE2 2.79Å; R94-E289 PolarHBondContact NE-OE2 3.48Å; R94-E289 IonicContact NH2-OE1 2.73Å; R94-E289 IonicContact NH2-OE2 2.72Å; R94-E289 PolarHBondContact NH2-OE2 3.48Å; T285-E289 WeakPolarHBondContact O-CG 3.46Å; T285-E289 PolarHBondContact O-N 3.47Å; G286-E289 PolarHBondContact O-N 2.91Å; E289-E291 PolarHBondContact O-N 3.15Å; E289-M292 PolarHBondContact O-N 2.88Å; E289-M293 HydrophobicContact CB-CE 4.04Å; E289-M293 WeakPolarHBondContact O-CB 3.41Å; E289-M293 WeakPolarHBondContact O-CE 3.16Å; E289-M293 VanDerWaalsContact O-CG 3.29Å; E289-M293 WeakPolarHBondContact O-CG 3.34Å; E289-M293 PolarHBondContact O-N 3.22Å; E289-E336 WeakPolarHBondContact CB-OE1 3.36Å
290	V	97.9	Very high	96.7	Very high	2 Å²	2	51 Å²	51	1%	0.012	28%	0.28	C	S	.	.	H	α-helix	trans	-60.6	-43.1	176.7	170.3	0	0	0	0	112	L215 I219 G286 M292 M293 T294 L333 E336	L215-V290 HydrophobicContact CB-CG1 3.92Å; L215-V290 HydrophobicContact CB-CG2 4.44Å; L215-V290 HydrophobicContact CD1-CG1 4.16Å; L215-V290 HydrophobicContact CD1-CG2 3.87Å; I219-V290 HydrophobicContact CD1-CB 4.31Å; I219-V290 HydrophobicContact CD1-CG2 3.9Å; G286-V290 WeakPolarHBondContact O-CB 3.47Å; G286-V290 VanDerWaalsContact O-CG2 3.23Å; G286-V290 WeakPolarHBondContact O-CG2 3.45Å; G286-V290 PolarHBondContact O-N 3.4Å; V290-M292 VanDerWaalsContact C-N 3.34Å; V290-M292 PolarHBondContact O-N 2.99Å; V290-M293 HydrophobicContact CG2-CE 4.26Å; V290-M293 PolarHBondContact O-N 3.23Å; V290-T294 VanDerWaalsContact O-CB 3.27Å; V290-T294 WeakPolarHBondContact O-CB 3.45Å; V290-T294 PolarHBondContact O-N 3.16Å; V290-T294 PolarHBondContact O-OG1 3.06Å; V290-L333 HydrophobicContact CG1-CD2 4.27Å; V290-L333 HydrophobicContact CG2-CD2 4.44Å; V290-E336 HydrophobicContact CG2-CB 3.88Å; V290-E336 HydrophobicContact CG2-CG 3.66Å
291	E	97.9	Very high	96.8	Very high	94 Å²	94	50.7 Å²	50.7	44%	0.439	28%	0.279	S	S	.	.	H	α-helix	trans	-61.8	-44.1	177.3	-171.6	-175.2	168	0	0	111.2	A287 Q288 E289 K295	A287-E291 PolarHBondContact O-N 2.94Å; Q288-E291 PolarHBondContact O-N 3.11Å; E289-E291 PolarHBondContact O-N 3.15Å; E291-K295 WeakPolarHBondContact O-CG 3.44Å; E291-K295 PolarHBondContact O-N 3.25Å; E291-K295 WeakPolarHBondContact OE1-CE 3.3Å; E291-K295 IonicContact OE1-NZ 2.9Å; E291-K295 PolarHBondContact OE1-NZ 3.33Å
292	M	97.7	Very high	96.8	Very high	101 Å²	101	51.6 Å²	51.6	50%	0.498	28%	0.276	S	S	.	.	H	α-helix	trans	-62.1	-50.1	176.5	-178.4	-172.1	62	0	0	111.5	Q288 E289 V290 T294 K295 Q296	Q288-M292 PolarHBondContact O-N 3.3Å; Q288-M292 VanDerWaalsContact O-N 3.08Å; E289-M292 PolarHBondContact O-N 2.88Å; V290-M292 VanDerWaalsContact C-N 3.34Å; V290-M292 PolarHBondContact O-N 2.99Å; M292-T294 VanDerWaalsContact C-N 3.34Å; M292-T294 PolarHBondContact O-N 3.45Å; M292-K295 PolarHBondContact O-N 3.48Å; M292-Q296 WeakPolarHBondContact O-CG 3.18Å; M292-Q296 PolarHBondContact O-N 2.86Å
293	M	98	Very high	96.9	Very high	10 Å²	10	54.1 Å²	54.1	5%	0.049	29%	0.286	C	S	.	.	H	α-helix	trans	-63.3	-39.5	-178.6	-72	-174.5	-75	0	0	112.1	E289 V290 K295 Q296 L297 L329 S332 L333 E336	E289-M293 HydrophobicContact CB-CE 4.04Å; E289-M293 WeakPolarHBondContact O-CB 3.41Å; E289-M293 WeakPolarHBondContact O-CE 3.16Å; E289-M293 VanDerWaalsContact O-CG 3.29Å; E289-M293 WeakPolarHBondContact O-CG 3.34Å; E289-M293 PolarHBondContact O-N 3.22Å; V290-M293 HydrophobicContact CG2-CE 4.26Å; V290-M293 PolarHBondContact O-N 3.23Å; M293-K295 PolarHBondContact O-N 2.88Å; M293-Q296 PolarHBondContact O-N 3.4Å; M293-L297 VanDerWaalsContact O-CB 3.31Å; M293-L297 WeakPolarHBondContact O-CB 3.35Å; M293-L297 PolarHBondContact O-N 3.3Å; M293-L329 HydrophobicContact CB-CD2 4.41Å; M293-L329 HydrophobicContact CG-CD2 4.21Å; M293-S332 WeakPolarHBondContact SD-CB 3.46Å; M293-L333 HydrophobicContact CB-CD2 4.08Å; M293-L333 HydrophobicContact CB-CG 4.33Å; M293-L333 HydrophobicContact CE-CD2 4.15Å; M293-L333 HydrophobicContact SD-CG 4.48Å; M293-E336 HydrophobicContact CE-CG 3.6Å
294	T	97.8	Very high	96.8	Very high	35 Å²	35	54 Å²	54	22%	0.215	29%	0.286	C	S	.	.	H	α-helix	trans	-63.4	-42.2	178	-60.1	0	0	0	0	111.3	P212 V290 M292 L297 G298	P212-T294 HydrophobicContact CB-CG2 3.97Å; V290-T294 VanDerWaalsContact O-CB 3.27Å; V290-T294 WeakPolarHBondContact O-CB 3.45Å; V290-T294 PolarHBondContact O-N 3.16Å; V290-T294 PolarHBondContact O-OG1 3.06Å; M292-T294 VanDerWaalsContact C-N 3.34Å; M292-T294 PolarHBondContact O-N 3.45Å; T294-L297 PolarHBondContact O-N 3.31Å; T294-G298 PolarHBondContact O-N 3.47Å; T294-G298 VanDerWaalsContact O-N 3.09Å
295	K	98	Very high	96.7	Very high	134 Å²	134	54.3 Å²	54.3	58%	0.583	28%	0.284	S	S	*	.	H	α-helix	trans	-63.3	-43.5	174.3	-71.5	173	-173.7	167.9	0	111.8	E291 M292 M293 G298 A299	E291-K295 WeakPolarHBondContact O-CG 3.44Å; E291-K295 PolarHBondContact O-N 3.25Å; E291-K295 WeakPolarHBondContact OE1-CE 3.3Å; E291-K295 IonicContact OE1-NZ 2.9Å; E291-K295 PolarHBondContact OE1-NZ 3.33Å; M292-K295 PolarHBondContact O-N 3.48Å; M293-K295 PolarHBondContact O-N 2.88Å; K295-G298 PolarHBondContact O-N 2.91Å; K295-A299 PolarHBondContact O-N 3.36Å
296	Q	98.2	Very high	96.5	Very high	80 Å²	80	57.2 Å²	57.2	37%	0.374	30%	0.296	S	S	.	.	H	α-helix	trans	-65.7	-41.1	178.2	-72	174.4	-18.8	0	0	112.2	M292 M293 G298 A299 H300 L329	M292-Q296 WeakPolarHBondContact O-CG 3.18Å; M292-Q296 PolarHBondContact O-N 2.86Å; M293-Q296 PolarHBondContact O-N 3.4Å; Q296-G298 PolarHBondContact O-N 2.88Å; Q296-A299 PolarHBondContact O-N 3.35Å; Q296-H300 PolarHBondContact O-N 3.44Å; Q296-L329 HydrophobicContact CB-CD1 3.83Å; Q296-L329 HydrophobicContact CB-CD2 4.09Å; Q296-L329 VanDerWaalsContact OE1-CD2 3.27Å
297	L	98	Very high	96.2	Very high	9 Å²	9	58.3 Å²	58.3	5%	0.047	30%	0.303	C	S	.	.	H	α-helix	trans	-59.1	-48.8	176.3	-171.9	76.3	0	0	0	110.5	P212 M293 T294 A299 H300 L301 L326 L329 W330 L333	P212-L297 HydrophobicContact CG-CD2 4.23Å; M293-L297 VanDerWaalsContact O-CB 3.31Å; M293-L297 WeakPolarHBondContact O-CB 3.35Å; M293-L297 PolarHBondContact O-N 3.3Å; T294-L297 PolarHBondContact O-N 3.31Å; L297-A299 VanDerWaalsContact C-N 3.35Å; L297-A299 PolarHBondContact O-N 3.38Å; L297-H300 PolarHBondContact O-N 2.76Å; L297-L301 HydrophobicContact CG-CD1 4.18Å; L297-L301 VanDerWaalsContact O-CG 3.3Å; L297-L301 WeakPolarHBondContact O-CG 3.31Å; L297-L301 PolarHBondContact O-N 3.08Å; L297-L326 HydrophobicContact CD1-CD2 3.59Å; L297-L326 HydrophobicContact CG-CD2 4.4Å; L297-L329 HydrophobicContact CB-CD1 4.48Å; L297-L329 HydrophobicContact CD1-CB 4.26Å; L297-W330 HydrophobicContact CD1-CE3 4.42Å; L297-W330 HydrophobicContact CD2-CE3 4Å; L297-W330 HydrophobicContact CD2-CZ3 3.94Å; L297-L333 HydrophobicContact CD2-CD1 4.17Å
298	G	97.5	Very high	95.8	Very high	39 Å²	39	59.5 Å²	59.5	40%	0.402	30%	0.304	S	S	.	.	H	α-helix	trans	-59.5	-42.4	175.8	0	0	0	0	0	113	T294 K295 Q296 L301 E302	T294-G298 PolarHBondContact O-N 3.47Å; T294-G298 VanDerWaalsContact O-N 3.09Å; K295-G298 PolarHBondContact O-N 2.91Å; Q296-G298 PolarHBondContact O-N 2.88Å; G298-L301 PolarHBondContact O-N 2.88Å; G298-E302 WeakPolarHBondContact O-CB 3.22Å; G298-E302 PolarHBondContact O-N 3.33Å
299	A	97.9	Very high	95	Very high	60 Å²	60	60.4 Å²	60.4	50%	0.496	31%	0.306	S	S	.	.	H	α-helix	trans	-64.1	-42.4	178	0	0	0	0	0	112.9	K295 Q296 L297 E302 Q303	K295-A299 PolarHBondContact O-N 3.36Å; Q296-A299 PolarHBondContact O-N 3.35Å; L297-A299 VanDerWaalsContact C-N 3.35Å; L297-A299 PolarHBondContact O-N 3.38Å; A299-E302 PolarHBondContact O-N 2.97Å; A299-Q303 WeakPolarHBondContact O-CB 3.46Å; A299-Q303 PolarHBondContact O-N 3.25Å
300	H	97.8	Very high	93.8	Very high	52 Å²	52	63.5 Å²	63.5	24%	0.241	34%	0.335	C	S	.	.	H	α-helix	trans	-70.3	-36.4	177.7	-75.4	-15.2	0	0	0	113.1	Q296 L297 Q303 L304 I322 L326	Q296-H300 PolarHBondContact O-N 3.44Å; L297-H300 PolarHBondContact O-N 2.76Å; H300-Q303 PolarHBondContact ND1-OE1 2.86Å; H300-Q303 PolarHBondContact O-N 3.39Å; H300-L304 PolarHBondContact O-N 3.32Å; H300-I322 HydrophobicContact CB-CG2 3.86Å; H300-L326 HydrophobicContact CB-CD2 3.56Å; H300-L326 HydrophobicContact CB-CG 4.15Å
301	L	97.2	Very high	92.8	Very high	13 Å²	13	68.1 Å²	68.1	7%	0.068	36%	0.355	C	S	.	.	H	α-helix	trans	-62.1	-44.2	172.5	-72.8	168.5	0	0	0	111.1	F197 D200 L297 G298 L304 K305 L326	F197-L301 HydrophobicContact CB-CD2 4.37Å; F197-L301 HydrophobicContact CD2-CD2 4.28Å; D200-L301 HydrophobicContact CB-CD1 4.01Å; D200-L301 HydrophobicContact CB-CD2 3.87Å; D200-L301 HydrophobicContact CB-CG 4.45Å; L297-L301 HydrophobicContact CG-CD1 4.18Å; L297-L301 VanDerWaalsContact O-CG 3.3Å; L297-L301 WeakPolarHBondContact O-CG 3.31Å; L297-L301 PolarHBondContact O-N 3.08Å; G298-L301 PolarHBondContact O-N 2.88Å; L301-L304 PolarHBondContact O-N 3.35Å; L301-K305 WeakPolarHBondContact O-CG 3.31Å; L301-K305 PolarHBondContact O-N 3.07Å; L301-L326 HydrophobicContact CD2-CD1 3.9Å; L301-L326 HydrophobicContact CD2-CD2 4.18Å; L301-L326 HydrophobicContact CG-CD2 3.99Å
302	E	96.1	Very high	91.7	Very high	84 Å²	84	71.1 Å²	71.1	39%	0.393	38%	0.38	S	S	.	.	H	α-helix	trans	-66.3	-39.9	176.7	-168.2	56	-146.8	0	0	112.3	G298 A299 L304 K305 M306	G298-E302 WeakPolarHBondContact O-CB 3.22Å; G298-E302 PolarHBondContact O-N 3.33Å; A299-E302 PolarHBondContact O-N 2.97Å; E302-L304 VanDerWaalsContact C-N 3.32Å; E302-L304 PolarHBondContact O-N 3.24Å; E302-K305 WeakPolarHBondContact O-CB 3.34Å; E302-K305 PolarHBondContact O-N 3.01Å; E302-K305 WeakPolarHBondContact OE2-CD 3.39Å; E302-M306 WeakPolarHBondContact O-CG 3.47Å; E302-M306 PolarHBondContact O-N 3.31Å; E302-M306 WeakPolarHBondContact OE1-CE 3.35Å
303	Q	94.8	Very high	90.8	Very high	92 Å²	92	70.5 Å²	70.5	43%	0.43	39%	0.39	S	S	.	.	H	α-helix	trans	-59.2	-42.3	173.9	-173.8	-176	-4	0	0	111.9	A299 H300 M306 T307 I322	A299-Q303 WeakPolarHBondContact O-CB 3.46Å; A299-Q303 PolarHBondContact O-N 3.25Å; H300-Q303 PolarHBondContact ND1-OE1 2.86Å; H300-Q303 PolarHBondContact O-N 3.39Å; Q303-M306 PolarHBondContact O-N 3.45Å; Q303-T307 WeakPolarHBondContact O-CB 3.49Å; Q303-T307 PolarHBondContact O-N 2.92Å; Q303-T307 PolarHBondContact O-OG1 3.34Å; Q303-I322 HydrophobicContact CG-CD1 3.93Å
304	L	94.4	Very high	90.2	Very high	0 Å²	0	71.8 Å²	71.8	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-66.1	-43	175.2	-81.9	164.3	0	0	0	112	F197 H300 L301 E302 M306 T307 I308 V319 I322 F323 L326	F197-L304 HydrophobicContact CB-CD1 4.42Å; F197-L304 HydrophobicContact CD2-CB 3.66Å; F197-L304 HydrophobicContact CD2-CD1 4.03Å; F197-L304 HydrophobicContact CD2-CG 4.47Å; F197-L304 HydrophobicContact CE2-CB 3.56Å; F197-L304 HydrophobicContact CG-CD1 4.39Å; F197-L304 HydrophobicContact CZ-CB 4.39Å; H300-L304 PolarHBondContact O-N 3.32Å; L301-L304 PolarHBondContact O-N 3.35Å; E302-L304 VanDerWaalsContact C-N 3.32Å; E302-L304 PolarHBondContact O-N 3.24Å; L304-M306 VanDerWaalsContact C-N 3.31Å; L304-M306 PolarHBondContact O-N 2.8Å; L304-T307 PolarHBondContact O-N 3.22Å; L304-I308 HydrophobicContact CB-CD1 4.41Å; L304-I308 HydrophobicContact CD2-CD1 4.18Å; L304-I308 WeakPolarHBondContact O-CB 3.33Å; L304-I308 WeakPolarHBondContact O-CG1 3.28Å; L304-I308 PolarHBondContact O-N 3.3Å; L304-V319 HydrophobicContact CD2-CB 4.17Å; L304-V319 HydrophobicContact CD2-CG1 4.06Å; L304-I322 HydrophobicContact CD1-CB 4.33Å; L304-I322 HydrophobicContact CD1-CG2 3.76Å; L304-I322 HydrophobicContact CD2-CB 4.07Å; L304-I322 HydrophobicContact CD2-CD1 4.17Å; L304-I322 HydrophobicContact CD2-CG2 4.22Å; L304-I322 HydrophobicContact CG-CB 4.07Å; L304-I322 HydrophobicContact CG-CD1 4.35Å; L304-I322 HydrophobicContact CG-CG2 3.64Å; L304-F323 HydrophobicContact CD1-CD1 3.7Å; L304-F323 HydrophobicContact CD1-CE1 3.58Å; L304-F323 HydrophobicContact CD2-CD1 4.25Å; L304-F323 HydrophobicContact CD2-CE1 3.8Å; L304-F323 HydrophobicContact CD2-CE2 4.48Å; L304-F323 HydrophobicContact CD2-CZ 3.92Å; L304-F323 HydrophobicContact CG-CE1 4.32Å; L304-L326 HydrophobicContact CD1-CD1 3.4Å; L304-L326 HydrophobicContact CD1-CG 4.37Å
305	K	93.3	Very high	89.7	Confident	68 Å²	68	73 Å²	73	30%	0.296	41%	0.407	S	S	.	.	H	α-helix	trans	-54.7	-49.4	174.2	-75	174	-177.4	157.7	0	110.4	F197 D200 L301 E302 T307 I308 K309	F197-K305 HydrophobicContact CE2-CG 3.87Å; F197-K305 HydrophobicContact CZ-CG 4.44Å; D200-K305 IonicContact OD1-NZ 3.7Å; D200-K305 WeakPolarHBondContact OD2-CE 3.14Å; D200-K305 IonicContact OD2-NZ 2.64Å; D200-K305 PolarHBondContact OD2-NZ 3.26Å; L301-K305 WeakPolarHBondContact O-CG 3.31Å; L301-K305 PolarHBondContact O-N 3.07Å; E302-K305 WeakPolarHBondContact O-CB 3.34Å; E302-K305 PolarHBondContact O-N 3.01Å; E302-K305 WeakPolarHBondContact OE2-CD 3.39Å; K305-T307 VanDerWaalsContact C-N 3.35Å; K305-T307 PolarHBondContact O-N 3.32Å; K305-I308 PolarHBondContact O-N 3.19Å; K305-K309 WeakPolarHBondContact O-CB 3.25Å; K305-K309 PolarHBondContact O-N 3.16Å
306	M	90.7	Very high	89.2	Confident	112 Å²	112	70.6 Å²	70.6	55%	0.552	40%	0.404	S	S	*	.	H	α-helix	trans	-66	-35.6	179.3	-68.1	-64.3	164.6	0	0	113	E302 Q303 L304	E302-M306 WeakPolarHBondContact O-CG 3.47Å; E302-M306 PolarHBondContact O-N 3.31Å; E302-M306 WeakPolarHBondContact OE1-CE 3.35Å; Q303-M306 PolarHBondContact O-N 3.45Å; L304-M306 VanDerWaalsContact C-N 3.31Å; L304-M306 PolarHBondContact O-N 2.8Å
307	T	89.2	Confident	88.8	Confident	25 Å²	25	71.2 Å²	71.2	15%	0.153	42%	0.417	C	S	.	.	H	α-helix	trans	-72.3	-37	-179.6	-57.3	0	0	0	0	112.3	Q303 L304 K305 K311 V314 Q318 V319	Q303-T307 WeakPolarHBondContact O-CB 3.49Å; Q303-T307 PolarHBondContact O-N 2.92Å; Q303-T307 PolarHBondContact O-OG1 3.34Å; L304-T307 PolarHBondContact O-N 3.22Å; K305-T307 VanDerWaalsContact C-N 3.35Å; K305-T307 PolarHBondContact O-N 3.32Å; T307-K311 WeakPolarHBondContact O-CD 3.46Å; T307-K311 WeakPolarHBondContact O-CE 3.5Å; T307-K311 PolarHBondContact O-NZ 2.87Å; T307-V314 HydrophobicContact CG2-CG1 3.94Å; T307-Q318 HydrophobicContact CG2-CB 4.47Å; T307-V319 HydrophobicContact CG2-CG1 4.19Å
308	I	87.5	Confident	88.4	Confident	54 Å²	54	75.1 Å²	75.1	28%	0.277	44%	0.435	S	S	.	.	H	α-helix	trans	-88.9	-29.9	-176.5	-63.6	166.8	0	0	0	111.8	F197 L304 K305 S310 K311 V314 V319 F323	F197-I308 HydrophobicContact CD1-CD1 4.31Å; F197-I308 HydrophobicContact CE1-CD1 3.59Å; F197-I308 HydrophobicContact CE2-CD1 4.33Å; F197-I308 HydrophobicContact CZ-CD1 3.6Å; L304-I308 HydrophobicContact CB-CD1 4.41Å; L304-I308 HydrophobicContact CD2-CD1 4.18Å; L304-I308 WeakPolarHBondContact O-CB 3.33Å; L304-I308 WeakPolarHBondContact O-CG1 3.28Å; L304-I308 PolarHBondContact O-N 3.3Å; K305-I308 PolarHBondContact O-N 3.19Å; I308-S310 PolarHBondContact O-N 2.98Å; I308-K311 PolarHBondContact O-N 2.81Å; I308-V314 HydrophobicContact CG1-CG2 4.41Å; I308-V319 HydrophobicContact CG1-CG1 4.42Å; I308-F323 HydrophobicContact CD1-CZ 4.49Å
309	K	79.7	Confident	88.3	Confident	142 Å²	142	73.8 Å²	73.8	62%	0.617	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	128.6	179.6	-174.5	174.8	-175.2	-179.6	0	109.8	K305 K311	K305-K309 WeakPolarHBondContact O-CB 3.25Å; K305-K309 PolarHBondContact O-N 3.16Å; K309-K311 VanDerWaalsContact C-N 3.27Å; K309-K311 PolarHBondContact O-N 3.47Å
310	S	71	Confident	88.2	Confident	127 Å²	127	73.2 Å²	73.2	89%	0.888	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	64	12	176.3	59.2	0	0	0	0	117.7	I308	I308-S310 PolarHBondContact O-N 2.98Å
311	K	76.5	Confident	88.1	Confident	100 Å²	100	74.4 Å²	74.4	44%	0.435	42%	0.418	S	S	.	.			trans	-108.7	128.8	173.9	-64.1	-173	-169.9	162.2	0	111.7	T307 I308 K309 V314	T307-K311 WeakPolarHBondContact O-CD 3.46Å; T307-K311 WeakPolarHBondContact O-CE 3.5Å; T307-K311 PolarHBondContact O-NZ 2.87Å; I308-K311 PolarHBondContact O-N 2.81Å; K309-K311 VanDerWaalsContact C-N 3.27Å; K309-K311 PolarHBondContact O-N 3.47Å; K311-V314 HydrophobicContact CB-CG2 3.84Å; K311-V314 HydrophobicContact CD-CG2 4.22Å
312	T	74.5	Confident	88.1	Confident	157 Å²	157	74.4 Å²	74.4	96%	0.963	42%	0.418	S	S	*	.	S	Bend	trans	-72.5	-33.1	176.3	-39.8	0	0	0	0	112.4
313	A	78.8	Confident	88.2	Confident	87 Å²	87	71.1 Å²	71.1	72%	0.719	40%	0.402	S	S	*	.	S	Bend	trans	-139	133.5	175.9	0	0	0	0	0	109
314	V	84.8	Confident	88.4	Confident	38 Å²	38	68.7 Å²	68.7	23%	0.23	39%	0.392	C	S	.	.			trans	-118.2	131.8	-179.8	-172.8	0	0	0	0	108.5	T307 I308 K311 T316 V319	T307-V314 HydrophobicContact CG2-CG1 3.94Å; I308-V314 HydrophobicContact CG1-CG2 4.41Å; K311-V314 HydrophobicContact CB-CG2 3.84Å; K311-V314 HydrophobicContact CD-CG2 4.22Å; V314-T316 PolarHBondContact O-N 2.87Å; V314-V319 HydrophobicContact CB-CG1 4.35Å; V314-V319 HydrophobicContact CG1-CG1 3.5Å
315	P	87.4	Confident	88.6	Confident	60 Å²	60	70 Å²	70	39%	0.39	40%	0.403	S	S	.	.			trans	-58.7	132.1	176.6	-23.6	33.5	0	0	0	111.8	S317 Q318 V319	P315-S317 PolarHBondContact O-N 3.23Å; P315-Q318 HydrophobicContact CB-CG 4.21Å; P315-Q318 HydrophobicContact CG-CG 4.44Å; P315-Q318 WeakPolarHBondContact O-CB 3.49Å; P315-Q318 PolarHBondContact O-N 3Å; P315-V319 PolarHBondContact O-N 3.42Å
316	T	88.7	Confident	88.8	Confident	83 Å²	83	66.8 Å²	66.8	51%	0.509	39%	0.389	S	S	.	.	H	α-helix	trans	-57.7	-34.4	177.1	52	0	0	0	0	112	V314 Q318 V319 F320	V314-T316 PolarHBondContact O-N 2.87Å; T316-Q318 PolarHBondContact O-N 3.09Å; T316-V319 PolarHBondContact O-N 3.12Å; T316-F320 HydrophobicContact CG2-CE1 3.82Å; T316-F320 HydrophobicContact CG2-CE2 3.94Å; T316-F320 HydrophobicContact CG2-CZ 3.5Å; T316-F320 VanDerWaalsContact CG2-CZ 3.5Å; T316-F320 VanDerWaalsContact O-CB 3.29Å; T316-F320 WeakPolarHBondContact O-CB 2.97Å; T316-F320 WeakPolarHBondContact O-CG 2.91Å; T316-F320 PolarHBondContact O-N 3.42Å
317	S	89.4	Confident	89.2	Confident	93 Å²	93	61.7 Å²	61.7	65%	0.65	36%	0.364	S	S	*	.	H	α-helix	trans	-60.8	-21.5	174.8	57.5	0	0	0	0	114.5	P315 P321	P315-S317 PolarHBondContact O-N 3.23Å; S317-P321 WeakPolarHBondContact O-CD 3.43Å; S317-P321 WeakPolarHBondContact O-CG 3.2Å
318	Q	90.1	Very high	89.6	Confident	92 Å²	92	64 Å²	64	43%	0.43	38%	0.378	S	S	.	.	H	α-helix	trans	-89.3	-35.4	176.7	-68.4	-177.7	-3.5	0	0	112.4	T307 P315 T316 I322	T307-Q318 HydrophobicContact CG2-CB 4.47Å; P315-Q318 HydrophobicContact CB-CG 4.21Å; P315-Q318 HydrophobicContact CG-CG 4.44Å; P315-Q318 WeakPolarHBondContact O-CB 3.49Å; P315-Q318 PolarHBondContact O-N 3Å; T316-Q318 PolarHBondContact O-N 3.09Å; Q318-I322 WeakPolarHBondContact O-CD1 3.47Å
319	V	93.6	Very high	90.1	Very high	11 Å²	11	62.3 Å²	62.3	7%	0.067	37%	0.37	C	S	.	.	H	α-helix	trans	-99.6	-35	-171.3	-67.2	0	0	0	0	113.9	L304 T307 I308 V314 P315 T316 I322 F323	L304-V319 HydrophobicContact CD2-CB 4.17Å; L304-V319 HydrophobicContact CD2-CG1 4.06Å; T307-V319 HydrophobicContact CG2-CG1 4.19Å; I308-V319 HydrophobicContact CG1-CG1 4.42Å; V314-V319 HydrophobicContact CB-CG1 4.35Å; V314-V319 HydrophobicContact CG1-CG1 3.5Å; P315-V319 PolarHBondContact O-N 3.42Å; T316-V319 PolarHBondContact O-N 3.12Å; V319-I322 PolarHBondContact O-N 2.91Å; V319-I322 VanDerWaalsContact O-N 3.13Å; V319-F323 HydrophobicContact CB-CD2 4.13Å; V319-F323 HydrophobicContact CB-CE2 3.7Å; V319-F323 HydrophobicContact CB-CZ 4.38Å; V319-F323 HydrophobicContact CG2-CD2 4.43Å; V319-F323 HydrophobicContact CG2-CE2 3.96Å; V319-F323 VanDerWaalsContact O-CD2 3.27Å; V319-F323 WeakPolarHBondContact O-CD2 3.46Å; V319-F323 PolarHBondContact O-N 3.19Å
320	F	95.9	Very high	91	Very high	48 Å²	48	55.7 Å²	55.7	21%	0.211	34%	0.341	C	S	.	.	H	α-helix	trans	-60.5	-42.8	-178.2	-72.5	5.1	0	0	0	112.9	I163 I190 T316 I322 F323 I324	I163-F320 HydrophobicContact CB-CE1 4.46Å; I163-F320 HydrophobicContact CB-CZ 3.92Å; I163-F320 HydrophobicContact CG2-CE1 3.62Å; I163-F320 HydrophobicContact CG2-CZ 3.57Å; I190-F320 HydrophobicContact CD1-CB 4.45Å; I190-F320 HydrophobicContact CD1-CD2 3.77Å; I190-F320 HydrophobicContact CD1-CE2 4.09Å; I190-F320 HydrophobicContact CD1-CG 4.07Å; I190-F320 HydrophobicContact CG1-CG 4.46Å; I190-F320 HydrophobicContact CG2-CD1 3.95Å; I190-F320 HydrophobicContact CG2-CE1 4.07Å; I190-F320 HydrophobicContact CG2-CG 4.37Å; T316-F320 HydrophobicContact CG2-CE1 3.82Å; T316-F320 HydrophobicContact CG2-CE2 3.94Å; T316-F320 HydrophobicContact CG2-CZ 3.5Å; T316-F320 VanDerWaalsContact CG2-CZ 3.5Å; T316-F320 VanDerWaalsContact O-CB 3.29Å; T316-F320 WeakPolarHBondContact O-CB 2.97Å; T316-F320 WeakPolarHBondContact O-CG 2.91Å; T316-F320 PolarHBondContact O-N 3.42Å; F320-I322 VanDerWaalsContact C-N 3.25Å; F320-I322 PolarHBondContact O-N 2.8Å; F320-F323 HydrophobicContact CD1-CD2 4.27Å; F320-F323 PolarHBondContact O-N 3.3Å; F320-I324 VanDerWaalsContact O-CG1 3.3Å; F320-I324 WeakPolarHBondContact O-CG1 3.36Å; F320-I324 PolarHBondContact O-N 3.04Å
321	P	97.2	Very high	92.2	Very high	76 Å²	76	52 Å²	52	49%	0.494	31%	0.313	S	S	.	.	H	α-helix	trans	-59.2	-37.1	175.8	-25.5	36.1	0	0	0	113	S317 A325	S317-P321 WeakPolarHBondContact O-CD 3.43Å; S317-P321 WeakPolarHBondContact O-CG 3.2Å; P321-A325 WeakPolarHBondContact O-CB 3.45Å; P321-A325 PolarHBondContact O-N 3.38Å
322	I	97.5	Very high	93.1	Very high	13 Å²	13	49.2 Å²	49.2	7%	0.067	31%	0.306	C	S	.	.	H	α-helix	trans	-74.2	-39.8	-180	-48.9	168.3	0	0	0	110.6	H300 Q303 L304 Q318 V319 F320 I324 A325 L326	H300-I322 HydrophobicContact CB-CG2 3.86Å; Q303-I322 HydrophobicContact CG-CD1 3.93Å; L304-I322 HydrophobicContact CD1-CB 4.33Å; L304-I322 HydrophobicContact CD1-CG2 3.76Å; L304-I322 HydrophobicContact CD2-CB 4.07Å; L304-I322 HydrophobicContact CD2-CD1 4.17Å; L304-I322 HydrophobicContact CD2-CG2 4.22Å; L304-I322 HydrophobicContact CG-CB 4.07Å; L304-I322 HydrophobicContact CG-CD1 4.35Å; L304-I322 HydrophobicContact CG-CG2 3.64Å; Q318-I322 WeakPolarHBondContact O-CD1 3.47Å; V319-I322 PolarHBondContact O-N 2.91Å; V319-I322 VanDerWaalsContact O-N 3.13Å; F320-I322 VanDerWaalsContact C-N 3.25Å; F320-I322 PolarHBondContact O-N 2.8Å; I322-I324 VanDerWaalsContact C-N 3.33Å; I322-I324 PolarHBondContact O-N 3.07Å; I322-A325 PolarHBondContact O-N 3.48Å; I322-L326 WeakPolarHBondContact O-CG 3.22Å; I322-L326 PolarHBondContact O-N 3.11Å
323	F	97.9	Very high	94.2	Very high	15 Å²	15	41.8 Å²	41.8	7%	0.066	26%	0.261	C	S	.	.	H	α-helix	trans	-62	-40.2	173.3	-68.8	-46	0	0	0	112.5	I190 G193 I194 F197 L304 I308 V319 F320 L326 S327	I190-F323 HydrophobicContact CG2-CB 4.42Å; I190-F323 HydrophobicContact CG2-CD2 4.34Å; G193-F323 VanDerWaalsContact C-CD1 3.41Å; G193-F323 WeakPolarHBondContact CA-O 3.41Å; I194-F323 HydrophobicContact CD1-CE2 4.49Å; I194-F323 HydrophobicContact CG1-CD1 4.17Å; I194-F323 HydrophobicContact CG1-CD2 3.87Å; I194-F323 HydrophobicContact CG1-CE1 4.06Å; I194-F323 HydrophobicContact CG1-CE2 3.75Å; I194-F323 HydrophobicContact CG1-CG 4.09Å; I194-F323 HydrophobicContact CG1-CZ 3.86Å; F197-F323 HydrophobicContact CB-CE1 3.93Å; F197-F323 HydrophobicContact CD1-CE1 4.47Å; F197-F323 HydrophobicContact CG-CE1 4.23Å; L304-F323 HydrophobicContact CD1-CD1 3.7Å; L304-F323 HydrophobicContact CD1-CE1 3.58Å; L304-F323 HydrophobicContact CD2-CD1 4.25Å; L304-F323 HydrophobicContact CD2-CE1 3.8Å; L304-F323 HydrophobicContact CD2-CE2 4.48Å; L304-F323 HydrophobicContact CD2-CZ 3.92Å; L304-F323 HydrophobicContact CG-CE1 4.32Å; I308-F323 HydrophobicContact CD1-CZ 4.49Å; V319-F323 HydrophobicContact CB-CD2 4.13Å; V319-F323 HydrophobicContact CB-CE2 3.7Å; V319-F323 HydrophobicContact CB-CZ 4.38Å; V319-F323 HydrophobicContact CG2-CD2 4.43Å; V319-F323 HydrophobicContact CG2-CE2 3.96Å; V319-F323 VanDerWaalsContact O-CD2 3.27Å; V319-F323 WeakPolarHBondContact O-CD2 3.46Å; V319-F323 PolarHBondContact O-N 3.19Å; F320-F323 HydrophobicContact CD1-CD2 4.27Å; F320-F323 PolarHBondContact O-N 3.3Å; F323-L326 HydrophobicContact CD1-CD1 4.38Å; F323-L326 PolarHBondContact O-N 2.77Å; F323-S327 PolarHBondContact O-N 2.66Å
324	I	98.2	Very high	95.1	Very high	41 Å²	41	39.8 Å²	39.8	21%	0.21	24%	0.236	C	C	.	.	H	α-helix	trans	-63.4	-45.6	174.1	-68.4	167.5	0	0	0	110.1	M189 I190 F320 I322 L326 S327 T328	M189-I324 HydrophobicContact CB-CG1 4.07Å; M189-I324 HydrophobicContact CB-CG2 4.44Å; M189-I324 HydrophobicContact CE-CG2 4.19Å; M189-I324 HydrophobicContact SD-CG2 4.01Å; I190-I324 HydrophobicContact CG1-CD1 4.1Å; I190-I324 HydrophobicContact CG1-CG1 3.84Å; F320-I324 VanDerWaalsContact O-CG1 3.3Å; F320-I324 WeakPolarHBondContact O-CG1 3.36Å; F320-I324 PolarHBondContact O-N 3.04Å; I322-I324 VanDerWaalsContact C-N 3.33Å; I322-I324 PolarHBondContact O-N 3.07Å; I324-L326 VanDerWaalsContact C-N 3.34Å; I324-L326 PolarHBondContact O-N 3.17Å; I324-S327 WeakPolarHBondContact O-CB 3.36Å; I324-S327 PolarHBondContact O-N 2.87Å; I324-S327 VanDerWaalsContact O-N 3.11Å; I324-T328 PolarHBondContact O-N 3.06Å; I324-T328 PolarHBondContact O-OG1 3.1Å
325	A	98.3	Very high	95.6	Very high	28 Å²	28	38.6 Å²	38.6	23%	0.231	23%	0.229	C	C	.	.	H	α-helix	trans	-59.5	-42.7	176.8	0	0	0	0	0	112.5	P321 I322 S327 T328 L329	P321-A325 WeakPolarHBondContact O-CB 3.45Å; P321-A325 PolarHBondContact O-N 3.38Å; I322-A325 PolarHBondContact O-N 3.48Å; A325-S327 VanDerWaalsContact C-N 3.34Å; A325-S327 PolarHBondContact O-N 2.77Å; A325-T328 PolarHBondContact O-N 3.12Å; A325-L329 WeakPolarHBondContact O-CG 3.5Å; A325-L329 PolarHBondContact O-N 2.75Å
326	L	98.3	Very high	96	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59.1	-44.1	172.9	-73.3	179.5	0	0	0	112	L196 L297 H300 L301 L304 I322 F323 I324 T328 L329 W330	L196-L326 HydrophobicContact CD1-CB 4.27Å; L297-L326 HydrophobicContact CD1-CD2 3.59Å; L297-L326 HydrophobicContact CG-CD2 4.4Å; H300-L326 HydrophobicContact CB-CD2 3.56Å; H300-L326 HydrophobicContact CB-CG 4.15Å; L301-L326 HydrophobicContact CD2-CD1 3.9Å; L301-L326 HydrophobicContact CD2-CD2 4.18Å; L301-L326 HydrophobicContact CG-CD2 3.99Å; L304-L326 HydrophobicContact CD1-CD1 3.4Å; L304-L326 HydrophobicContact CD1-CG 4.37Å; I322-L326 WeakPolarHBondContact O-CG 3.22Å; I322-L326 PolarHBondContact O-N 3.11Å; F323-L326 HydrophobicContact CD1-CD1 4.38Å; F323-L326 PolarHBondContact O-N 2.77Å; I324-L326 VanDerWaalsContact C-N 3.34Å; I324-L326 PolarHBondContact O-N 3.17Å; L326-T328 VanDerWaalsContact C-N 3.35Å; L326-L329 PolarHBondContact O-N 3.33Å; L326-W330 WeakPolarHBondContact O-CB 3.46Å; L326-W330 PolarHBondContact O-N 3.03Å
327	S	98.1	Very high	96.4	Very high	6 Å²	6	34 Å²	34	4%	0.042	20%	0.2	C	C	.	.	H	α-helix	trans	-61.7	-43.2	177	-179.7	0	0	0	0	111.8	M189 F323 I324 A325 W330 T331	M189-S327 WeakPolarHBondContact CA-OG 3.15Å; M189-S327 VanDerWaalsContact O-CB 3.29Å; M189-S327 WeakPolarHBondContact O-CB 3.27Å; F323-S327 PolarHBondContact O-N 2.66Å; I324-S327 WeakPolarHBondContact O-CB 3.36Å; I324-S327 PolarHBondContact O-N 2.87Å; I324-S327 VanDerWaalsContact O-N 3.11Å; A325-S327 VanDerWaalsContact C-N 3.34Å; A325-S327 PolarHBondContact O-N 2.77Å; S327-W330 PolarHBondContact O-N 2.83Å; S327-T331 PolarHBondContact O-N 2.99Å; S327-T331 PolarHBondContact O-OG1 2.93Å; S327-T331 VanDerWaalsContact O-OG1 3.1Å
328	T	97.7	Very high	96.7	Very high	73 Å²	73	32.3 Å²	32.3	45%	0.448	18%	0.183	S	C	.	.	H	α-helix	trans	-63.5	-48	178.7	-57.2	0	0	0	0	111.1	I324 A325 L326 W330 T331 S332	I324-T328 PolarHBondContact O-N 3.06Å; I324-T328 PolarHBondContact O-OG1 3.1Å; A325-T328 PolarHBondContact O-N 3.12Å; L326-T328 VanDerWaalsContact C-N 3.35Å; T328-W330 VanDerWaalsContact C-N 3.27Å; T328-W330 PolarHBondContact O-N 3.36Å; T328-T331 PolarHBondContact O-N 3.24Å; T328-S332 PolarHBondContact O-N 2.94Å; T328-S332 PolarHBondContact O-OG 3.44Å
329	L	98.1	Very high	96.9	Very high	19 Å²	19	28.5 Å²	28.5	10%	0.099	17%	0.166	C	C	.	.	H	α-helix	trans	-58.9	-41	176.3	-70.7	171	0	0	0	111.8	M293 Q296 L297 A325 L326 S332 L333	M293-L329 HydrophobicContact CB-CD2 4.41Å; M293-L329 HydrophobicContact CG-CD2 4.21Å; Q296-L329 HydrophobicContact CB-CD1 3.83Å; Q296-L329 HydrophobicContact CB-CD2 4.09Å; Q296-L329 VanDerWaalsContact OE1-CD2 3.27Å; L297-L329 HydrophobicContact CB-CD1 4.48Å; L297-L329 HydrophobicContact CD1-CB 4.26Å; A325-L329 WeakPolarHBondContact O-CG 3.5Å; A325-L329 PolarHBondContact O-N 2.75Å; L326-L329 PolarHBondContact O-N 3.33Å; L329-S332 PolarHBondContact O-N 3.45Å; L329-L333 WeakPolarHBondContact O-CG 3.22Å; L329-L333 PolarHBondContact O-N 3.4Å
330	W	98.1	Very high	97	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.008	17%	0.165	C	C	.	.	H	α-helix	trans	-67.2	-42.3	178.7	-166.1	-91	0	0	0	112.8	L196 R199 I208 D209 L211 L297 L326 S327 T328 S332 L333 Q334	L196-W330 HydrophobicContact CD1-CB 3.56Å; L196-W330 HydrophobicContact CD1-CD2 4.03Å; L196-W330 HydrophobicContact CD1-CE3 4.21Å; L196-W330 HydrophobicContact CD1-CG 3.76Å; L196-W330 HydrophobicContact CD2-CD2 3.43Å; L196-W330 VanDerWaalsContact CD2-CD2 3.43Å; L196-W330 HydrophobicContact CD2-CE3 3.51Å; L196-W330 HydrophobicContact CD2-CG 3.93Å; L196-W330 HydrophobicContact CD2-CH2 4.22Å; L196-W330 HydrophobicContact CD2-CZ2 4.12Å; L196-W330 HydrophobicContact CD2-CZ3 3.92Å; L196-W330 HydrophobicContact CG-CD2 4.37Å; L196-W330 HydrophobicContact CG-CE3 4.5Å; L196-W330 HydrophobicContact CG-CG 4.46Å; R199-W330 VanDerWaalsContact NH1-CH2 3.27Å; I208-W330 HydrophobicContact CG2-CH2 4.04Å; I208-W330 HydrophobicContact CG2-CZ2 3.5Å; I208-W330 VanDerWaalsContact CG2-CZ2 3.5Å; D209-W330 WeakPolarHBondContact O-CH2 3.38Å; D209-W330 WeakPolarHBondContact O-CZ2 3.48Å; L211-W330 HydrophobicContact CB-CH2 4.08Å; L211-W330 HydrophobicContact CB-CZ2 4.17Å; L211-W330 HydrophobicContact CD1-CD2 4.28Å; L211-W330 HydrophobicContact CD1-CH2 4.25Å; L211-W330 HydrophobicContact CD1-CZ2 3.55Å; L211-W330 HydrophobicContact CG-CH2 3.99Å; L211-W330 HydrophobicContact CG-CZ2 3.57Å; L297-W330 HydrophobicContact CD1-CE3 4.42Å; L297-W330 HydrophobicContact CD2-CE3 4Å; L297-W330 HydrophobicContact CD2-CZ3 3.94Å; L326-W330 WeakPolarHBondContact O-CB 3.46Å; L326-W330 PolarHBondContact O-N 3.03Å; S327-W330 PolarHBondContact O-N 2.83Å; T328-W330 VanDerWaalsContact C-N 3.27Å; T328-W330 PolarHBondContact O-N 3.36Å; W330-S332 VanDerWaalsContact C-N 3.28Å; W330-S332 PolarHBondContact O-N 3.38Å; W330-L333 HydrophobicContact CE3-CD1 4.19Å; W330-L333 HydrophobicContact CZ3-CD1 4.48Å; W330-L333 WeakPolarHBondContact O-CB 3.3Å; W330-L333 PolarHBondContact O-N 3.1Å; W330-L333 VanDerWaalsContact O-N 3.16Å; W330-Q334 WeakPolarHBondContact O-CG 3.2Å; W330-Q334 PolarHBondContact O-N 3.23Å
331	T	96.4	Very high	96.9	Very high	49 Å²	49	27.6 Å²	27.6	30%	0.301	17%	0.17	S	C	.	.	H	α-helix	trans	-59.6	-41.8	173	-61.9	0	0	0	0	111	S327 T328 L333 Q334 D335	S327-T331 PolarHBondContact O-N 2.99Å; S327-T331 PolarHBondContact O-OG1 2.93Å; S327-T331 VanDerWaalsContact O-OG1 3.1Å; T328-T331 PolarHBondContact O-N 3.24Å; T331-L333 VanDerWaalsContact C-N 3.34Å; T331-L333 PolarHBondContact O-N 2.83Å; T331-Q334 WeakPolarHBondContact O-CB 2.93Å; T331-Q334 PolarHBondContact O-N 3.45Å; T331-Q334 VanDerWaalsContact O-N 3.14Å; T331-D335 VanDerWaalsContact O-CG 3.26Å; T331-D335 PolarHBondContact O-N 2.8Å
332	S	96.7	Very high	96.8	Very high	43 Å²	43	26.4 Å²	26.4	30%	0.301	16%	0.161	S	C	.	.	H	α-helix	trans	-64.5	-34.6	175.2	-59.2	0	0	0	0	113	M293 T328 L329 W330 D335 E336	M293-S332 WeakPolarHBondContact SD-CB 3.46Å; T328-S332 PolarHBondContact O-N 2.94Å; T328-S332 PolarHBondContact O-OG 3.44Å; L329-S332 PolarHBondContact O-N 3.45Å; W330-S332 VanDerWaalsContact C-N 3.28Å; W330-S332 PolarHBondContact O-N 3.38Å; S332-D335 WeakPolarHBondContact O-CB 3.48Å; S332-D335 PolarHBondContact O-N 3.27Å; S332-E336 WeakPolarHBondContact O-CG 3.42Å; S332-E336 PolarHBondContact O-N 2.92Å
333	L	97.9	Very high	96.7	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-68	-36	171.1	-70.6	166.4	0	0	0	112.8	L211 P212 L215 V290 M293 L297 L329 W330 T331 D335 E336 T337	L211-L333 HydrophobicContact CB-CB 4.32Å; L211-L333 HydrophobicContact CD1-CB 4.23Å; P212-L333 HydrophobicContact CG-CD1 4.04Å; L215-L333 HydrophobicContact CD1-CB 4.42Å; L215-L333 HydrophobicContact CD1-CD2 3.9Å; V290-L333 HydrophobicContact CG1-CD2 4.27Å; V290-L333 HydrophobicContact CG2-CD2 4.44Å; M293-L333 HydrophobicContact CB-CD2 4.08Å; M293-L333 HydrophobicContact CB-CG 4.33Å; M293-L333 HydrophobicContact CE-CD2 4.15Å; M293-L333 HydrophobicContact SD-CG 4.48Å; L297-L333 HydrophobicContact CD2-CD1 4.17Å; L329-L333 WeakPolarHBondContact O-CG 3.22Å; L329-L333 PolarHBondContact O-N 3.4Å; W330-L333 HydrophobicContact CE3-CD1 4.19Å; W330-L333 HydrophobicContact CZ3-CD1 4.48Å; W330-L333 WeakPolarHBondContact O-CB 3.3Å; W330-L333 PolarHBondContact O-N 3.1Å; W330-L333 VanDerWaalsContact O-N 3.16Å; T331-L333 VanDerWaalsContact C-N 3.34Å; T331-L333 PolarHBondContact O-N 2.83Å; L333-D335 VanDerWaalsContact C-N 3.34Å; L333-E336 PolarHBondContact O-N 2.96Å; L333-T337 PolarHBondContact O-N 3.25Å; L333-T337 VanDerWaalsContact O-N 3.16Å; L333-T337 PolarHBondContact O-OG1 2.86Å
334	Q	96.4	Very high	96.5	Very high	45 Å²	45	27.1 Å²	27.1	21%	0.21	17%	0.169	C	C	.	.	H	α-helix	trans	-63.5	-43.2	172.5	-70.5	171.3	-50.2	0	0	110.7	S142 L211 W330 T331 E336 T337 I338	S142-Q334 PolarHBondContact O-NE2 3.46Å; L211-Q334 HydrophobicContact CD1-CB 4.31Å; L211-Q334 HydrophobicContact CD1-CG 3.39Å; W330-Q334 WeakPolarHBondContact O-CG 3.2Å; W330-Q334 PolarHBondContact O-N 3.23Å; T331-Q334 WeakPolarHBondContact O-CB 2.93Å; T331-Q334 PolarHBondContact O-N 3.45Å; T331-Q334 VanDerWaalsContact O-N 3.14Å; Q334-E336 VanDerWaalsContact C-N 3.32Å; Q334-E336 PolarHBondContact O-N 3.08Å; Q334-T337 WeakPolarHBondContact O-CB 3.49Å; Q334-T337 PolarHBondContact O-N 3.13Å; Q334-I338 WeakPolarHBondContact O-CG1 3.33Å; Q334-I338 PolarHBondContact O-N 3.46Å
335	D	95.9	Very high	96.4	Very high	13 Å²	13	29.6 Å²	29.6	7%	0.07	18%	0.182	C	C	.	.	H	α-helix	trans	-58	-44.5	175.7	-71.3	-24.1	0	0	0	111.2	L98 H101 H102 T331 S332 L333 T337 I338 V339	L98-D335 HydrophobicContact CD1-CB 4.28Å; L98-D335 HydrophobicContact CD2-CB 3.63Å; H101-D335 IonicContact ND1-OD1 3.05Å; H102-D335 IonicContact CD2-OD1 2.8Å; H102-D335 IonicContact CE1-OD1 2.86Å; H102-D335 IonicContact CE1-OD2 2.77Å; H102-D335 PolarHBondContact CE1-OD2 2.89Å; H102-D335 VanDerWaalsContact NE2-CG 3.27Å; H102-D335 IonicContact NE2-OD1 3.81Å; H102-D335 PolarHBondContact NE2-OD1 3.41Å; H102-D335 IonicContact NE2-OD2 2.76Å; H102-D335 PolarHBondContact NE2-OD2 3.11Å; T331-D335 VanDerWaalsContact O-CG 3.26Å; T331-D335 PolarHBondContact O-N 2.8Å; S332-D335 WeakPolarHBondContact O-CB 3.48Å; S332-D335 PolarHBondContact O-N 3.27Å; L333-D335 VanDerWaalsContact C-N 3.34Å; D335-T337 VanDerWaalsContact C-N 3.33Å; D335-T337 PolarHBondContact O-N 3.26Å; D335-I338 WeakPolarHBondContact O-CB 3.03Å; D335-I338 PolarHBondContact O-N 3.49Å; D335-I338 VanDerWaalsContact O-N 3.17Å; D335-V339 WeakPolarHBondContact O-CG2 3.31Å; D335-V339 PolarHBondContact O-N 3Å
336	E	96.1	Very high	96.2	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-61.6	-39.4	176.2	-70.3	-67.4	-176	0	0	113.7	R94 L215 E289 V290 M293 S332 L333 Q334 I338 V339 V340	R94-E336 IonicContact CZ-OE1 3.08Å; R94-E336 IonicContact CZ-OE2 3.45Å; R94-E336 VanDerWaalsContact NH1-CD 3.3Å; R94-E336 IonicContact NH1-OE1 3.34Å; R94-E336 PolarHBondContact NH1-OE1 2.69Å; R94-E336 IonicContact NH1-OE2 3.22Å; R94-E336 PolarHBondContact NH1-OE2 2.95Å; R94-E336 IonicContact NH2-OE1 3.36Å; R94-E336 PolarHBondContact NH2-OE1 3.27Å; R94-E336 IonicContact NH2-OE2 2.87Å; L215-E336 HydrophobicContact CD1-CB 4.12Å; L215-E336 HydrophobicContact CD2-CB 4.19Å; E289-E336 WeakPolarHBondContact CB-OE1 3.36Å; V290-E336 HydrophobicContact CG2-CB 3.88Å; V290-E336 HydrophobicContact CG2-CG 3.66Å; M293-E336 HydrophobicContact CE-CG 3.6Å; S332-E336 WeakPolarHBondContact O-CG 3.42Å; S332-E336 PolarHBondContact O-N 2.92Å; L333-E336 PolarHBondContact O-N 2.96Å; Q334-E336 VanDerWaalsContact C-N 3.32Å; Q334-E336 PolarHBondContact O-N 3.08Å; E336-I338 PolarHBondContact O-N 3.42Å; E336-V339 PolarHBondContact O-N 3.46Å; E336-V340 WeakPolarHBondContact O-CB 3.23Å; E336-V340 VanDerWaalsContact O-CG2 3.31Å; E336-V340 WeakPolarHBondContact O-CG2 3.45Å; E336-V340 PolarHBondContact O-N 2.9Å
337	T	96.2	Very high	96	Very high	47 Å²	47	28.5 Å²	28.5	29%	0.288	17%	0.173	S	C	.	.	H	α-helix	trans	-59.9	-38.1	178.3	-55.3	0	0	0	0	110.7	L333 Q334 D335 G341	L333-T337 PolarHBondContact O-N 3.25Å; L333-T337 VanDerWaalsContact O-N 3.16Å; L333-T337 PolarHBondContact O-OG1 2.86Å; Q334-T337 WeakPolarHBondContact O-CB 3.49Å; Q334-T337 PolarHBondContact O-N 3.13Å; D335-T337 VanDerWaalsContact C-N 3.33Å; D335-T337 PolarHBondContact O-N 3.26Å; T337-G341 PolarHBondContact O-N 2.94Å; T337-G341 VanDerWaalsContact O-N 3.15Å
338	I	95	Very high	95.9	Very high	57 Å²	57	31.6 Å²	31.6	29%	0.292	19%	0.191	S	C	.	.	H	α-helix	trans	-72.5	-45.6	178.3	-62.8	162.9	0	0	0	110.5	F97 H101 Q334 D335 E336 G341 V342	F97-I338 HydrophobicContact CE1-CG2 3.91Å; F97-I338 HydrophobicContact CZ-CG2 3.83Å; H101-I338 WeakPolarHBondContact CE1-CD1 3.41Å; H101-I338 WeakPolarHBondContact NE2-CD1 3.36Å; Q334-I338 WeakPolarHBondContact O-CG1 3.33Å; Q334-I338 PolarHBondContact O-N 3.46Å; D335-I338 WeakPolarHBondContact O-CB 3.03Å; D335-I338 PolarHBondContact O-N 3.49Å; D335-I338 VanDerWaalsContact O-N 3.17Å; E336-I338 PolarHBondContact O-N 3.42Å; I338-G341 PolarHBondContact O-N 3.43Å; I338-V342 HydrophobicContact CG2-CG2 4.46Å; I338-V342 WeakPolarHBondContact O-CG2 3.47Å; I338-V342 PolarHBondContact O-N 3.29Å
339	V	95	Very high	95.7	Very high	12 Å²	12	32.6 Å²	32.6	7%	0.073	19%	0.191	C	C	.	.	H	α-helix	trans	-59.2	-50.3	178.8	171.4	0	0	0	0	110.9	F97 L98 D335 E336 G341 V342 L343	F97-V339 HydrophobicContact CD1-CG2 4.03Å; F97-V339 HydrophobicContact CE1-CG2 4.01Å; L98-V339 HydrophobicContact CD2-CG2 3.91Å; L98-V339 HydrophobicContact CG-CG2 4.4Å; D335-V339 WeakPolarHBondContact O-CG2 3.31Å; D335-V339 PolarHBondContact O-N 3Å; E336-V339 PolarHBondContact O-N 3.46Å; V339-G341 VanDerWaalsContact C-N 3.27Å; V339-G341 PolarHBondContact O-N 3.09Å; V339-V342 PolarHBondContact O-N 3.15Å; V339-L343 HydrophobicContact CG1-CD1 3.75Å; V339-L343 HydrophobicContact CG1-CG 4.27Å; V339-L343 WeakPolarHBondContact O-CB 3.46Å; V339-L343 VanDerWaalsContact O-CG 3.31Å; V339-L343 WeakPolarHBondContact O-CG 3.22Å; V339-L343 PolarHBondContact O-N 2.95Å
340	V	95.3	Very high	95.6	Very high	9 Å²	9	31.7 Å²	31.7	6%	0.055	19%	0.186	C	C	.	.	H	α-helix	trans	-58.4	-41.7	177	173.2	0	0	0	0	111	L215 I219 E336 L343 S344	L215-V340 HydrophobicContact CD2-CG2 4.4Å; I219-V340 HydrophobicContact CD1-CG2 4.12Å; I219-V340 HydrophobicContact CG1-CG1 4.39Å; I219-V340 HydrophobicContact CG1-CG2 3.72Å; E336-V340 WeakPolarHBondContact O-CB 3.23Å; E336-V340 VanDerWaalsContact O-CG2 3.31Å; E336-V340 WeakPolarHBondContact O-CG2 3.45Å; E336-V340 PolarHBondContact O-N 2.9Å; V340-L343 PolarHBondContact O-N 2.86Å; V340-S344 VanDerWaalsContact O-CB 3.23Å; V340-S344 WeakPolarHBondContact O-CB 3.31Å; V340-S344 PolarHBondContact O-N 3.35Å
341	G	94.8	Very high	95.5	Very high	30 Å²	30	35 Å²	35	31%	0.309	20%	0.202	S	C	.	.	H	α-helix	trans	-62	-45.9	176.4	0	0	0	0	0	113.1	T337 I338 V339 N345	T337-G341 PolarHBondContact O-N 2.94Å; T337-G341 VanDerWaalsContact O-N 3.15Å; I338-G341 PolarHBondContact O-N 3.43Å; V339-G341 VanDerWaalsContact C-N 3.27Å; V339-G341 PolarHBondContact O-N 3.09Å; G341-N345 WeakPolarHBondContact O-CB 3.48Å; G341-N345 VanDerWaalsContact O-CG 3.23Å; G341-N345 PolarHBondContact O-N 2.87Å; G341-N345 PolarHBondContact O-ND2 3.09Å; G341-N345 VanDerWaalsContact O-ND2 3.17Å
342	V	94.6	Very high	95.3	Very high	51 Å²	51	37 Å²	37	31%	0.309	22%	0.216	S	C	.	.	H	α-helix	trans	-64.6	-44.7	177.6	170.3	0	0	0	0	111.2	F97 I338 V339 N345 L346	F97-V342 HydrophobicContact CE2-CG2 4.15Å; F97-V342 HydrophobicContact CZ-CB 4.47Å; F97-V342 HydrophobicContact CZ-CG2 3.75Å; I338-V342 HydrophobicContact CG2-CG2 4.46Å; I338-V342 WeakPolarHBondContact O-CG2 3.47Å; I338-V342 PolarHBondContact O-N 3.29Å; V339-V342 PolarHBondContact O-N 3.15Å; V342-N345 PolarHBondContact O-N 3.11Å; V342-L346 WeakPolarHBondContact O-CB 3.47Å; V342-L346 PolarHBondContact O-N 2.91Å
343	L	95.3	Very high	95.2	Very high	8 Å²	8	36.9 Å²	36.9	4%	0.042	21%	0.21	C	C	.	.	H	α-helix	trans	-64.6	-42.3	178.5	-70.5	177.9	0	0	0	112.1	Y91 I279 D282 I283 V339 V340 N345 L346 F347	Y91-L343 HydrophobicContact CD2-CD2 4.26Å; Y91-L343 HydrophobicContact CE2-CD2 4.13Å; I279-L343 HydrophobicContact CG2-CB 4.09Å; I279-L343 HydrophobicContact CG2-CD2 4.42Å; D282-L343 HydrophobicContact CB-CD1 3.73Å; I283-L343 HydrophobicContact CD1-CB 4.35Å; I283-L343 HydrophobicContact CG1-CB 4.28Å; I283-L343 HydrophobicContact CG1-CD1 3.79Å; V339-L343 HydrophobicContact CG1-CD1 3.75Å; V339-L343 HydrophobicContact CG1-CG 4.27Å; V339-L343 WeakPolarHBondContact O-CB 3.46Å; V339-L343 VanDerWaalsContact O-CG 3.31Å; V339-L343 WeakPolarHBondContact O-CG 3.22Å; V339-L343 PolarHBondContact O-N 2.95Å; V340-L343 PolarHBondContact O-N 2.86Å; L343-N345 VanDerWaalsContact C-N 3.34Å; L343-N345 PolarHBondContact O-N 2.93Å; L343-L346 PolarHBondContact O-N 2.94Å; L343-F347 WeakPolarHBondContact O-CB 3.34Å; L343-F347 PolarHBondContact O-N 3.34Å
344	S	94.9	Very high	95	Very high	36 Å²	36	38.4 Å²	38.4	25%	0.252	22%	0.217	S	C	.	.	H	α-helix	trans	-63.2	-40.2	174.6	-172.2	0	0	0	0	111.9	V340 T348	V340-S344 VanDerWaalsContact O-CB 3.23Å; V340-S344 WeakPolarHBondContact O-CB 3.31Å; V340-S344 PolarHBondContact O-N 3.35Å; S344-T348 WeakPolarHBondContact O-CB 3.48Å; S344-T348 PolarHBondContact O-N 3.34Å; S344-T348 PolarHBondContact O-OG1 3.2Å
345	N	94.5	Very high	94.5	Very high	93 Å²	93	38.6 Å²	38.6	50%	0.497	23%	0.232	S	C	.	.	H	α-helix	trans	-65.6	-47.4	174.9	-76.7	-29.6	0	0	0	111	G341 V342 L343 F347 T348 H349	G341-N345 WeakPolarHBondContact O-CB 3.48Å; G341-N345 VanDerWaalsContact O-CG 3.23Å; G341-N345 PolarHBondContact O-N 2.87Å; G341-N345 PolarHBondContact O-ND2 3.09Å; G341-N345 VanDerWaalsContact O-ND2 3.17Å; V342-N345 PolarHBondContact O-N 3.11Å; L343-N345 VanDerWaalsContact C-N 3.34Å; L343-N345 PolarHBondContact O-N 2.93Å; N345-F347 VanDerWaalsContact C-N 3.33Å; N345-F347 PolarHBondContact O-N 2.95Å; N345-T348 PolarHBondContact O-N 3.38Å; N345-T348 VanDerWaalsContact O-N 3.1Å; N345-H349 PolarHBondContact O-N 2.87Å; N345-H349 PolarHBondContact O-ND1 3.04Å
346	L	94.4	Very high	93.9	Very high	4 Å²	4	38.4 Å²	38.4	2%	0.021	23%	0.232	C	C	.	.	H	α-helix	trans	-54.6	-51.1	178	177.1	63.1	0	0	0	110.7	Y86 F87 N90 Y91 I279 V342 L343 T348 H349 I350	Y86-L346 HydrophobicContact CD1-CD1 4.16Å; Y86-L346 HydrophobicContact CE1-CD1 3.83Å; F87-L346 HydrophobicContact CD2-CD1 4.05Å; F87-L346 HydrophobicContact CD2-CD2 3.98Å; F87-L346 HydrophobicContact CD2-CG 4.2Å; F87-L346 HydrophobicContact CE2-CD2 3.68Å; F87-L346 HydrophobicContact CE2-CG 4.28Å; F87-L346 HydrophobicContact CZ-CD2 4.33Å; N90-L346 HydrophobicContact CB-CD1 3.98Å; Y91-L346 HydrophobicContact CD2-CD2 3.72Å; Y91-L346 HydrophobicContact CG-CD2 4.2Å; I279-L346 HydrophobicContact CD1-CD2 4Å; I279-L346 HydrophobicContact CD1-CG 3.99Å; I279-L346 HydrophobicContact CG1-CD2 4.09Å; V342-L346 WeakPolarHBondContact O-CB 3.47Å; V342-L346 PolarHBondContact O-N 2.91Å; L343-L346 PolarHBondContact O-N 2.94Å; L346-T348 VanDerWaalsContact C-N 3.33Å; L346-T348 PolarHBondContact O-N 3.22Å; L346-H349 PolarHBondContact O-N 3.24Å; L346-I350 HydrophobicContact CD1-CG2 4.37Å; L346-I350 WeakPolarHBondContact O-CG1 3.32Å; L346-I350 PolarHBondContact O-N 3.36Å; L346-I350 VanDerWaalsContact O-N 3.08Å
347	F	95.2	Very high	93.5	Very high	1 Å²	1	38.9 Å²	38.9	0%	0.004	23%	0.234	C	C	.	.	H	α-helix	trans	-52.6	-48.5	174.3	160.5	-95.8	0	0	0	112.5	H225 I226 Q229 L276 I279 L343 N345 H349 I350	H225-F347 AromaticContact CD2-CE1 3.09Å; H225-F347 WeakPolarHBondContact CD2-CE1 3.42Å; H225-F347 AromaticContact CD2-CZ 3.44Å; H225-F347 VanDerWaalsContact CD2-CZ 3.44Å; H225-F347 WeakPolarHBondContact CD2-CZ 3.46Å; H225-F347 AromaticContact NE2-CE1 3.25Å; H225-F347 WeakPolarHBondContact NE2-CE1 3.33Å; H225-F347 AromaticContact NE2-CZ 3.49Å; H225-F347 WeakPolarHBondContact NE2-CZ 3.41Å; I226-F347 HydrophobicContact CG1-CD2 3.78Å; I226-F347 HydrophobicContact CG1-CE2 4Å; I226-F347 HydrophobicContact CG1-CG 4.03Å; I226-F347 HydrophobicContact CG1-CZ 4.48Å; Q229-F347 HydrophobicContact CB-CE2 4.1Å; Q229-F347 HydrophobicContact CB-CZ 4.35Å; Q229-F347 HydrophobicContact CG-CE2 3.85Å; Q229-F347 HydrophobicContact CG-CZ 3.61Å; L276-F347 HydrophobicContact CD2-CD2 3.34Å; L276-F347 HydrophobicContact CD2-CE2 3.61Å; I279-F347 HydrophobicContact CD1-CB 4.06Å; I279-F347 HydrophobicContact CG2-CB 4.48Å; L343-F347 WeakPolarHBondContact O-CB 3.34Å; L343-F347 PolarHBondContact O-N 3.34Å; N345-F347 VanDerWaalsContact C-N 3.33Å; N345-F347 PolarHBondContact O-N 2.95Å; F347-H349 VanDerWaalsContact C-N 3.3Å; F347-H349 PolarHBondContact O-N 3Å; F347-I350 WeakPolarHBondContact O-CG1 3.45Å; F347-I350 PolarHBondContact O-N 3.36Å
348	T	94.9	Very high	92.9	Very high	71 Å²	71	44.8 Å²	44.8	44%	0.436	26%	0.258	S	S	.	.	H	α-helix	trans	-64.6	-35.6	-177.9	-55.6	0	0	0	0	112	S344 N345 L346 P352	S344-T348 WeakPolarHBondContact O-CB 3.48Å; S344-T348 PolarHBondContact O-N 3.34Å; S344-T348 PolarHBondContact O-OG1 3.2Å; N345-T348 PolarHBondContact O-N 3.38Å; N345-T348 VanDerWaalsContact O-N 3.1Å; L346-T348 VanDerWaalsContact C-N 3.33Å; L346-T348 PolarHBondContact O-N 3.22Å; T348-P352 WeakPolarHBondContact O-CD 3.39Å
349	H	94.9	Very high	92.1	Very high	94 Å²	94	47.8 Å²	47.8	44%	0.435	27%	0.274	S	S	.	.	H	α-helix	trans	-86	-15.4	-176.4	-69.8	86.9	0	0	0	114.1	Y86 N345 L346 F347 P352 F353	Y86-H349 HydrophobicContact CE1-CB 3.48Å; Y86-H349 VanDerWaalsContact CE1-CB 3.48Å; Y86-H349 HydrophobicContact CE2-CB 4.31Å; Y86-H349 AromaticContact CZ-CG 3.99Å; Y86-H349 WeakPolarHBondContact OH-CB 3.41Å; N345-H349 PolarHBondContact O-N 2.87Å; N345-H349 PolarHBondContact O-ND1 3.04Å; L346-H349 PolarHBondContact O-N 3.24Å; F347-H349 VanDerWaalsContact C-N 3.3Å; F347-H349 PolarHBondContact O-N 3Å; H349-P352 WeakPolarHBondContact O-CD 3.5Å; H349-F353 WeakPolarHBondContact O-CE2 3.47Å
350	I	95.7	Very high	91.1	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-83	-25	172.2	58.3	165.7	0	0	0	112.9	M83 Y86 Y272 F275 L276 I279 L346 F347 P352 F353	M83-I350 HydrophobicContact CG-CB 4.08Å; M83-I350 HydrophobicContact CG-CG2 4.14Å; M83-I350 HydrophobicContact SD-CB 4.32Å; Y86-I350 HydrophobicContact CD1-CG2 3.82Å; Y86-I350 HydrophobicContact CE1-CG2 4.26Å; Y272-I350 HydrophobicContact CD2-CD1 3.92Å; Y272-I350 HydrophobicContact CD2-CG1 4.26Å; Y272-I350 HydrophobicContact CE2-CD1 3.79Å; Y272-I350 HydrophobicContact CE2-CG1 3.88Å; F275-I350 HydrophobicContact CB-CD1 3.95Å; L276-I350 HydrophobicContact CD2-CD1 4.15Å; I279-I350 HydrophobicContact CD1-CD1 4.11Å; L346-I350 HydrophobicContact CD1-CG2 4.37Å; L346-I350 WeakPolarHBondContact O-CG1 3.32Å; L346-I350 PolarHBondContact O-N 3.36Å; L346-I350 VanDerWaalsContact O-N 3.08Å; F347-I350 WeakPolarHBondContact O-CG1 3.45Å; F347-I350 PolarHBondContact O-N 3.36Å; I350-P352 VanDerWaalsContact C-CD 3.49Å; I350-F353 HydrophobicContact CB-CD2 4.45Å; I350-F353 VanDerWaalsContact O-CD2 3.31Å; I350-F353 WeakPolarHBondContact O-CD2 3.31Å; I350-F353 PolarHBondContact O-N 3.38Å
351	Q	94.8	Very high	90.4	Very high	72 Å²	72	49.9 Å²	49.9	34%	0.336	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-58.3	-39.6	-178.7	-174.8	-176.2	-14.9	0	0	114.6	F353 L354	Q351-F353 PolarHBondContact O-N 2.77Å; Q351-F353 VanDerWaalsContact O-N 3.13Å; Q351-L354 WeakPolarHBondContact O-CB 3.46Å; Q351-L354 WeakPolarHBondContact O-CG 3.3Å; Q351-L354 PolarHBondContact O-N 2.98Å
352	P	93.3	Very high	89.8	Confident	91 Å²	91	51.3 Å²	51.3	59%	0.591	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-60.2	-21.8	178.9	-26.6	36.3	0	0	0	114.9	T348 H349 I350 L354 G355	T348-P352 WeakPolarHBondContact O-CD 3.39Å; H349-P352 WeakPolarHBondContact O-CD 3.5Å; I350-P352 VanDerWaalsContact C-CD 3.49Å; P352-L354 PolarHBondContact O-N 3.29Å; P352-L354 VanDerWaalsContact O-N 3.15Å; P352-G355 PolarHBondContact O-N 3.49Å; P352-G355 VanDerWaalsContact O-N 3.11Å
353	F	94.5	Very high	89.3	Confident	40 Å²	40	53.6 Å²	53.6	18%	0.175	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-71.1	-2	176	-57.7	-61.6	0	0	0	113.5	D79 K82 M83 Y86 N268 H349 I350 Q351	D79-F353 WeakPolarHBondContact CB-O 3.4Å; K82-F353 HydrophobicContact CB-CD1 3.79Å; K82-F353 HydrophobicContact CB-CE1 3.53Å; K82-F353 HydrophobicContact CB-CZ 4.24Å; K82-F353 HydrophobicContact CD-CE1 4.35Å; K82-F353 HydrophobicContact CG-CE1 4.49Å; M83-F353 HydrophobicContact CB-CB 3.81Å; M83-F353 HydrophobicContact CB-CD2 3.51Å; M83-F353 HydrophobicContact CB-CE2 4.24Å; M83-F353 HydrophobicContact CB-CG 3.73Å; M83-F353 HydrophobicContact CG-CB 4.26Å; M83-F353 HydrophobicContact CG-CD2 3.72Å; M83-F353 HydrophobicContact CG-CE2 4.5Å; M83-F353 HydrophobicContact CG-CG 4.3Å; M83-F353 HydrophobicContact SD-CB 4.26Å; Y86-F353 HydrophobicContact CD1-CE2 4.38Å; Y86-F353 HydrophobicContact CG-CE2 4.14Å; Y86-F353 HydrophobicContact CG-CZ 4.41Å; N268-F353 PolarHBondContact ND2-O 3.08Å; N268-F353 PolarHBondContact OD1-O 2.82Å; H349-F353 WeakPolarHBondContact O-CE2 3.47Å; I350-F353 HydrophobicContact CB-CD2 4.45Å; I350-F353 VanDerWaalsContact O-CD2 3.31Å; I350-F353 WeakPolarHBondContact O-CD2 3.31Å; I350-F353 PolarHBondContact O-N 3.38Å; Q351-F353 PolarHBondContact O-N 2.77Å; Q351-F353 VanDerWaalsContact O-N 3.13Å
354	L	92.8	Very high	88.8	Confident	31 Å²	31	63.2 Å²	63.2	16%	0.162	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-89.1	1.9	170.1	-56.7	-177.4	0	0	0	113.2	N268 Y272 Q351 P352 A356 H357	N268-L354 WeakPolarHBondContact OD1-CD2 3.33Å; Y272-L354 HydrophobicContact CD1-CD1 3.73Å; Y272-L354 HydrophobicContact CD1-CD2 4.31Å; Y272-L354 HydrophobicContact CD2-CD1 4.16Å; Y272-L354 HydrophobicContact CD2-CD2 4.27Å; Y272-L354 HydrophobicContact CD2-CG 4.31Å; Y272-L354 HydrophobicContact CE1-CD1 3.66Å; Y272-L354 HydrophobicContact CE2-CD1 4.11Å; Y272-L354 HydrophobicContact CG-CD1 3.98Å; Y272-L354 HydrophobicContact CG-CD2 3.91Å; Y272-L354 HydrophobicContact CG-CG 4.3Å; Q351-L354 WeakPolarHBondContact O-CB 3.46Å; Q351-L354 WeakPolarHBondContact O-CG 3.3Å; Q351-L354 PolarHBondContact O-N 2.98Å; P352-L354 PolarHBondContact O-N 3.29Å; P352-L354 VanDerWaalsContact O-N 3.15Å; L354-A356 PolarHBondContact O-N 3.36Å; L354-A356 VanDerWaalsContact O-N 3.09Å; L354-H357 WeakPolarHBondContact O-CB 3.39Å; L354-H357 PolarHBondContact O-CD2 3.4Å; L354-H357 VanDerWaalsContact O-CD2 3.23Å; L354-H357 PolarHBondContact O-N 3.29Å
355	G	86.1	Confident	88.3	Confident	50 Å²	50	62.2 Å²	62.2	52%	0.515	32%	0.321	S	S	.	.	H	α-helix	trans	-56.9	-29.2	-173.5	0	0	0	0	0	114.7	P352 H357	P352-G355 PolarHBondContact O-N 3.49Å; P352-G355 VanDerWaalsContact O-N 3.11Å; G355-H357 VanDerWaalsContact C-N 3.28Å; G355-H357 PolarHBondContact O-N 2.87Å
356	A	83.3	Confident	87.8	Confident	8 Å²	8	58.3 Å²	58.3	7%	0.066	30%	0.3	C	S	.	.	H	α-helix	trans	-62.3	-31.1	177.3	0	0	0	0	0	113.2	P76 L354 E358 L359 Y360	P76-A356 HydrophobicContact CG-CB 4.33Å; L354-A356 PolarHBondContact O-N 3.36Å; L354-A356 VanDerWaalsContact O-N 3.09Å; A356-E358 PolarHBondContact O-N 3.23Å; A356-L359 PolarHBondContact O-N 2.97Å; A356-Y360 HydrophobicContact CB-CD2 3.91Å; A356-Y360 HydrophobicContact CB-CE2 4.1Å; A356-Y360 WeakPolarHBondContact O-CD2 3.45Å; A356-Y360 PolarHBondContact O-N 3.39Å
357	H	89.2	Confident	87.5	Confident	11 Å²	11	62.8 Å²	62.8	5%	0.051	32%	0.321	C	S	.	.	H	α-helix	trans	-61.4	-46.7	-173.6	-71.1	-82.2	0	0	0	113.2	Y240 A265 N268 L354 G355 L359 F361	Y240-H357 AromaticContact CE2-CE1 3.58Å; Y240-H357 AromaticContact CE2-ND1 3.34Å; Y240-H357 VanDerWaalsContact CE2-ND1 3.34Å; Y240-H357 WeakPolarHBondContact CE2-ND1 3.45Å; Y240-H357 AromaticContact CZ-ND1 3.53Å; Y240-H357 PolarHBondContact OH-ND1 3.14Å; A265-H357 PolarHBondContact O-CE1 3.1Å; N268-H357 PolarHBondContact OD1-NE2 3.28Å; L354-H357 WeakPolarHBondContact O-CB 3.39Å; L354-H357 PolarHBondContact O-CD2 3.4Å; L354-H357 VanDerWaalsContact O-CD2 3.23Å; L354-H357 PolarHBondContact O-N 3.29Å; G355-H357 VanDerWaalsContact C-N 3.28Å; G355-H357 PolarHBondContact O-N 2.87Å; H357-L359 VanDerWaalsContact C-N 3.33Å; H357-F361 CarbonylContact O-C 3.59Å; H357-F361 PolarHBondContact O-N 3.42Å; H357-F361 VanDerWaalsContact O-N 3.08Å
358	E	81.6	Confident	87.1	Confident	171 Å²	171	71.5 Å²	71.5	80%	0.799	35%	0.354	S	S	*	.	H	α-helix	trans	-69.3	-33.6	179.8	-171.5	170.5	-168.8	0	0	111.9	A356	A356-E358 PolarHBondContact O-N 3.23Å
359	L	79.1	Confident	86.7	Confident	120 Å²	120	69.1 Å²	69.1	63%	0.628	34%	0.338	S	S	*	.	H	α-helix	trans	-73	-46.4	-178.5	-177	62	0	0	0	112.8	A356 H357	A356-L359 PolarHBondContact O-N 2.97Å; H357-L359 VanDerWaalsContact C-N 3.33Å
360	Y	74	Confident	86.5	Confident	61 Å²	61	65.1 Å²	65.1	24%	0.239	32%	0.319	C	S	.	.	H	α-helix	trans	-90.6	-32.7	-173.2	-69.5	-72.5	0	0	0	113.6	K74 Y260 A356 P362	K74-Y360 VanDerWaalsContact CA-OH 3.28Å; K74-Y360 WeakPolarHBondContact CA-OH 3.46Å; K74-Y360 WeakPolarHBondContact CB-OH 3.02Å; K74-Y360 VanDerWaalsContact CD-OH 3.25Å; K74-Y360 WeakPolarHBondContact CD-OH 3.42Å; K74-Y360 WeakPolarHBondContact CG-OH 3.49Å; K74-Y360 WeakPolarHBondContact O-CE2 3.38Å; K74-Y360 VanDerWaalsContact O-CZ 3.26Å; K74-Y360 PolarHBondContact O-OH 3.35Å; Y260-Y360 WeakPolarHBondContact CD1-O 3.48Å; A356-Y360 HydrophobicContact CB-CD2 3.91Å; A356-Y360 HydrophobicContact CB-CE2 4.1Å; A356-Y360 WeakPolarHBondContact O-CD2 3.45Å; A356-Y360 PolarHBondContact O-N 3.39Å; Y360-P362 VanDerWaalsContact C-CD 3.45Å; Y360-P362 WeakPolarHBondContact O-CD 3.41Å
361	F	80.8	Confident	86	Confident	5 Å²	5	69.7 Å²	69.7	2%	0.022	34%	0.344	C	S	.	.	S	Bend	trans	-132.4	62.7	-172	-143	-114.1	0	0	0	111.4	Y240 I243 L257 Y260 L262 H357 M366 H369	Y240-F361 HydrophobicContact CD1-CD1 4.24Å; Y240-F361 HydrophobicContact CD1-CE1 4.49Å; Y240-F361 AromaticContact CE1-CD1 3.63Å; Y240-F361 HydrophobicContact CE1-CD1 3.63Å; Y240-F361 HydrophobicContact CE1-CE1 4.29Å; Y240-F361 HydrophobicContact CE1-CG 4.49Å; I243-F361 HydrophobicContact CD1-CE1 3.43Å; I243-F361 VanDerWaalsContact CD1-CE1 3.43Å; I243-F361 HydrophobicContact CD1-CZ 3.75Å; L257-F361 HydrophobicContact CD2-CE2 4.35Å; Y260-F361 AromaticContact CD1-CD2 3.81Å; Y260-F361 HydrophobicContact CD1-CD2 3.81Å; Y260-F361 HydrophobicContact CD1-CE2 4.21Å; Y260-F361 HydrophobicContact CE1-CD2 4.35Å; Y260-F361 HydrophobicContact CG-CD2 4.19Å; Y260-F361 HydrophobicContact CG-CE2 4.3Å; L262-F361 HydrophobicContact CD1-CD1 4.15Å; L262-F361 HydrophobicContact CD1-CE1 4.25Å; L262-F361 HydrophobicContact CD1-CG 4.38Å; H357-F361 CarbonylContact O-C 3.59Å; H357-F361 PolarHBondContact O-N 3.42Å; H357-F361 VanDerWaalsContact O-N 3.08Å; F361-M366 HydrophobicContact CD1-CB 4.17Å; F361-M366 HydrophobicContact CD1-CG 3.32Å; F361-M366 HydrophobicContact CD1-SD 3.75Å; F361-M366 HydrophobicContact CE1-CB 3.88Å; F361-M366 HydrophobicContact CE1-CG 3.56Å; F361-M366 HydrophobicContact CE1-SD 4.21Å; F361-M366 HydrophobicContact CG-CG 4.22Å; F361-M366 VanDerWaalsContact O-CE 3.31Å; F361-M366 WeakPolarHBondContact O-CE 3.43Å; F361-M366 VanDerWaalsContact O-CG 3.31Å; F361-M366 WeakPolarHBondContact O-CG 3.41Å; F361-H369 AromaticContact CZ-ND1 3.97Å
362	P	82.7	Confident	85.5	Confident	59 Å²	59	70.5 Å²	70.5	38%	0.383	37%	0.372	S	S	.	.			trans	-62.5	155.4	-178.6	27.9	-36.2	0	0	0	111.2	Y360 R364 A365 M366	Y360-P362 VanDerWaalsContact C-CD 3.45Å; Y360-P362 WeakPolarHBondContact O-CD 3.41Å; P362-R364 PolarHBondContact O-N 3.31Å; P362-A365 HydrophobicContact CG-CB 4.09Å; P362-A365 WeakPolarHBondContact O-CA 3.45Å; P362-A365 WeakPolarHBondContact O-CB 3.18Å; P362-A365 PolarHBondContact O-N 3.49Å; P362-M366 WeakPolarHBondContact O-CG 3.45Å; P362-M366 PolarHBondContact O-N 2.77Å; P362-M366 VanDerWaalsContact O-N 3.08Å
363	E	83.8	Confident	85.2	Confident	100 Å²	100	67.5 Å²	67.5	47%	0.467	35%	0.354	S	S	.	.	H	α-helix	trans	-47.1	-40.6	-174.7	-172.1	56.2	-144.6	0	0	114.1	R239 A365 M366 Q367	R239-E363 IonicContact CZ-OE1 3.39Å; R239-E363 IonicContact CZ-OE2 2.75Å; R239-E363 IonicContact NH1-OE1 3.95Å; R239-E363 PolarHBondContact NH1-OE1 3.3Å; R239-E363 IonicContact NH1-OE2 3.17Å; R239-E363 PolarHBondContact NH1-OE2 3.31Å; R239-E363 IonicContact NH2-OE1 3.93Å; R239-E363 PolarHBondContact NH2-OE1 3.14Å; R239-E363 IonicContact NH2-OE2 3.5Å; R239-E363 PolarHBondContact NH2-OE2 2.73Å; R239-E363 VanDerWaalsContact NH2-OE2 3.08Å; E363-A365 PolarHBondContact O-N 3.05Å; E363-M366 PolarHBondContact O-N 3.43Å; E363-M366 WeakPolarHBondContact OE2-CE 3.46Å; E363-Q367 WeakPolarHBondContact O-CB 3.08Å; E363-Q367 PolarHBondContact O-N 3Å
364	R	84.5	Confident	85	Confident	209 Å²	209	70.9 Å²	70.9	79%	0.789	38%	0.378	S	S	*	.	H	α-helix	trans	-64.8	-39.4	178.2	-64.3	-179.1	-177.5	169.9	1.4	113	P362 R368	P362-R364 PolarHBondContact O-N 3.31Å; R364-R368 WeakPolarHBondContact O-CG 3.47Å; R364-R368 PolarHBondContact O-N 3.4Å
365	A	83.7	Confident	85	Confident	16 Å²	16	72.4 Å²	72.4	13%	0.132	39%	0.389	C	S	.	.	H	α-helix	trans	-69.3	-42.8	176.4	0	0	0	0	0	109.9	P362 E363 Q367 R368 H369	P362-A365 HydrophobicContact CG-CB 4.09Å; P362-A365 WeakPolarHBondContact O-CA 3.45Å; P362-A365 WeakPolarHBondContact O-CB 3.18Å; P362-A365 PolarHBondContact O-N 3.49Å; E363-A365 PolarHBondContact O-N 3.05Å; A365-Q367 PolarHBondContact O-N 3.48Å; A365-R368 PolarHBondContact O-N 2.77Å; A365-H369 PolarHBondContact O-N 3.39Å; A365-H369 PolarHBondContact O-ND1 3.09Å
366	M	84.9	Confident	85.4	Confident	11 Å²	11	73 Å²	73	5%	0.054	38%	0.377	C	S	.	.	H	α-helix	trans	-57.6	-49.8	176.2	-48.4	-149.4	-123.8	0	0	111.8	R239 Y240 F361 P362 E363 R368 H369 L370	R239-M366 VanDerWaalsContact CZ-SD 3.6Å; R239-M366 VanDerWaalsContact NH2-CB 3.26Å; Y240-M366 HydrophobicContact CE1-SD 3.78Å; F361-M366 HydrophobicContact CD1-CB 4.17Å; F361-M366 HydrophobicContact CD1-CG 3.32Å; F361-M366 HydrophobicContact CD1-SD 3.75Å; F361-M366 HydrophobicContact CE1-CB 3.88Å; F361-M366 HydrophobicContact CE1-CG 3.56Å; F361-M366 HydrophobicContact CE1-SD 4.21Å; F361-M366 HydrophobicContact CG-CG 4.22Å; F361-M366 VanDerWaalsContact O-CE 3.31Å; F361-M366 WeakPolarHBondContact O-CE 3.43Å; F361-M366 VanDerWaalsContact O-CG 3.31Å; F361-M366 WeakPolarHBondContact O-CG 3.41Å; P362-M366 WeakPolarHBondContact O-CG 3.45Å; P362-M366 PolarHBondContact O-N 2.77Å; P362-M366 VanDerWaalsContact O-N 3.08Å; E363-M366 PolarHBondContact O-N 3.43Å; E363-M366 WeakPolarHBondContact OE2-CE 3.46Å; M366-R368 VanDerWaalsContact C-N 3.28Å; M366-R368 PolarHBondContact O-N 3.33Å; M366-H369 PolarHBondContact O-N 3.17Å; M366-H369 VanDerWaalsContact O-N 3.15Å; M366-L370 HydrophobicContact CB-CD1 4.38Å; M366-L370 WeakPolarHBondContact O-CB 3.43Å; M366-L370 VanDerWaalsContact O-CG 3.3Å; M366-L370 WeakPolarHBondContact O-CG 3.41Å; M366-L370 PolarHBondContact O-N 2.81Å
367	Q	87	Confident	85.9	Confident	97 Å²	97	75.1 Å²	75.1	45%	0.453	39%	0.39	S	S	.	.	H	α-helix	trans	-61.4	-37.6	-175.8	-170.3	58.8	39.2	0	0	112	E363 A365 H369 L370 N371	E363-Q367 WeakPolarHBondContact O-CB 3.08Å; E363-Q367 PolarHBondContact O-N 3Å; A365-Q367 PolarHBondContact O-N 3.48Å; Q367-H369 PolarHBondContact O-N 3.45Å; Q367-L370 PolarHBondContact O-N 3.22Å; Q367-N371 VanDerWaalsContact O-CG 3.27Å; Q367-N371 PolarHBondContact O-N 3.47Å; Q367-N371 VanDerWaalsContact O-N 3.11Å; Q367-N371 PolarHBondContact O-OD1 3.23Å; Q367-N371 VanDerWaalsContact O-OD1 3.1Å
368	R	87.4	Confident	86.2	Confident	185 Å²	185	75.5 Å²	75.5	70%	0.698	39%	0.392	S	S	*	.	H	α-helix	trans	-59.8	-45.4	175.9	-73.4	173.8	-175.9	-178.8	1.1	112.2	R364 A365 M366 N371	R364-R368 WeakPolarHBondContact O-CG 3.47Å; R364-R368 PolarHBondContact O-N 3.4Å; A365-R368 PolarHBondContact O-N 2.77Å; M366-R368 VanDerWaalsContact C-N 3.28Å; M366-R368 PolarHBondContact O-N 3.33Å; R368-N371 WeakPolarHBondContact O-CB 3.48Å; R368-N371 PolarHBondContact O-N 2.84Å
369	H	87.6	Confident	86.7	Confident	20 Å²	20	71.2 Å²	71.2	9%	0.093	38%	0.377	C	S	.	.	H	α-helix	trans	-75.1	-30.9	-178.8	-64.4	91.6	0	0	0	112.5	I243 K246 M253 E256 F361 A365 M366 Q367 N371	I243-H369 HydrophobicContact CD1-CB 4.15Å; I243-H369 HydrophobicContact CG1-CB 4.18Å; I243-H369 HydrophobicContact CG2-CB 4.19Å; K246-H369 PolarHBondContact NZ-O 2.87Å; K246-H369 VanDerWaalsContact NZ-O 3.11Å; M253-H369 HydrophobicContact CE-CB 4.14Å; E256-H369 IonicContact OE1-NE2 3.37Å; F361-H369 AromaticContact CZ-ND1 3.97Å; A365-H369 PolarHBondContact O-N 3.39Å; A365-H369 PolarHBondContact O-ND1 3.09Å; M366-H369 PolarHBondContact O-N 3.17Å; M366-H369 VanDerWaalsContact O-N 3.15Å; Q367-H369 PolarHBondContact O-N 3.45Å; H369-N371 VanDerWaalsContact C-N 3.29Å; H369-N371 PolarHBondContact O-N 3.13Å
370	L	89.1	Confident	87.4	Confident	10 Å²	10	68.3 Å²	68.3	5%	0.052	37%	0.367	C	S	.	.	H	α-helix	trans	-74.2	-14.1	175.6	-72.8	170.9	0	0	0	113.9	R239 A242 I243 M366 Q367 G372 A373 V375	R239-L370 HydrophobicContact CB-CD1 4.1Å; R239-L370 HydrophobicContact CG-CD1 4.02Å; A242-L370 HydrophobicContact CB-CD2 4.15Å; I243-L370 HydrophobicContact CD1-CD2 4.08Å; I243-L370 HydrophobicContact CD1-CG 3.94Å; I243-L370 HydrophobicContact CG1-CD2 3.58Å; I243-L370 HydrophobicContact CG1-CG 3.89Å; M366-L370 HydrophobicContact CB-CD1 4.38Å; M366-L370 WeakPolarHBondContact O-CB 3.43Å; M366-L370 VanDerWaalsContact O-CG 3.3Å; M366-L370 WeakPolarHBondContact O-CG 3.41Å; M366-L370 PolarHBondContact O-N 2.81Å; Q367-L370 PolarHBondContact O-N 3.22Å; L370-G372 PolarHBondContact O-N 3.39Å; L370-G372 VanDerWaalsContact O-N 3.17Å; L370-A373 WeakPolarHBondContact O-CB 3.28Å; L370-A373 PolarHBondContact O-N 2.83Å; L370-V375 HydrophobicContact CD1-CG2 4.4Å; L370-V375 HydrophobicContact CD2-CG2 3.68Å
371	N	86.6	Confident	88.3	Confident	96 Å²	96	66.1 Å²	66.1	51%	0.513	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	125.2	176.7	-75	-22	0	0	0	110.9	K246 Q367 R368 H369 A373	K246-N371 PolarHBondContact NZ-O 2.98Å; Q367-N371 VanDerWaalsContact O-CG 3.27Å; Q367-N371 PolarHBondContact O-N 3.47Å; Q367-N371 VanDerWaalsContact O-N 3.11Å; Q367-N371 PolarHBondContact O-OD1 3.23Å; Q367-N371 VanDerWaalsContact O-OD1 3.1Å; R368-N371 WeakPolarHBondContact O-CB 3.48Å; R368-N371 PolarHBondContact O-N 2.84Å; H369-N371 VanDerWaalsContact C-N 3.29Å; H369-N371 PolarHBondContact O-N 3.13Å; N371-A373 PolarHBondContact O-N 3.47Å
372	G	84.2	Confident	88.7	Confident	89 Å²	89	68.6 Å²	68.6	92%	0.918	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.8	-2.4	-176.5	0	0	0	0	0	115.4	L370	L370-G372 PolarHBondContact O-N 3.39Å; L370-G372 VanDerWaalsContact O-N 3.17Å
373	A	86.5	Confident	88.9	Confident	28 Å²	28	72 Å²	72	23%	0.231	38%	0.379	C	S	.	.			trans	-95.8	138.8	173.4	0	0	0	0	0	110.5	K246 L370 N371	K246-A373 HydrophobicContact CD-CB 4.24Å; L370-A373 WeakPolarHBondContact O-CB 3.28Å; L370-A373 PolarHBondContact O-N 2.83Å; N371-A373 PolarHBondContact O-N 3.47Å
374	T	89.4	Confident	88.8	Confident	111 Å²	111	72 Å²	72	68%	0.681	38%	0.379	S	S	*	.			trans	-89	120.4	169.7	-59.4	0	0	0	0	108.8	K376	T374-K376 HydrophobicContact CG2-CG 4.41Å; T374-K376 PolarHBondContact O-N 3.42Å
375	V	92.9	Very high	88.4	Confident	64 Å²	64	65 Å²	65	39%	0.388	36%	0.355	S	S	.	.			trans	-77.8	107.1	175	-179.3	0	0	0	0	108.8	R239 A242 L370	R239-V375 HydrophobicContact CG-CG1 4.07Å; R239-V375 HydrophobicContact CG-CG2 4.25Å; A242-V375 HydrophobicContact CB-CG2 4.3Å; L370-V375 HydrophobicContact CD1-CG2 4.4Å; L370-V375 HydrophobicContact CD2-CG2 3.68Å
376	K	94.3	Very high	87.7	Confident	61 Å²	61	68.4 Å²	68.4	27%	0.265	37%	0.37	S	S	.	.			trans	-93	143.8	178.1	-60.4	173.7	-175.4	-178.6	0	110.3	Y238 T374 C380 R381 E384	Y238-K376 WeakPolarHBondContact CB-O 3.31Å; T374-K376 HydrophobicContact CG2-CG 4.41Å; T374-K376 PolarHBondContact O-N 3.42Å; K376-C380 HydrophobicContact CB-CB 4.22Å; K376-R381 HydrophobicContact CB-CG 4.13Å; K376-R381 HydrophobicContact CD-CG 4.43Å; K376-R381 PolarHBondContact O-NH1 2.95Å; K376-R381 PolarHBondContact O-NH2 3.18Å; K376-E384 WeakPolarHBondContact CD-OE1 3.39Å; K376-E384 WeakPolarHBondContact CE-OE1 3.38Å; K376-E384 IonicContact NZ-OE1 3.68Å; K376-E384 PolarHBondContact NZ-OE1 3.41Å; K376-E384 IonicContact NZ-OE2 3.07Å; K376-E384 PolarHBondContact NZ-OE2 2.96Å
377	T	95.3	Very high	87.3	Confident	53 Å²	53	76.7 Å²	76.7	33%	0.325	41%	0.408	S	S	.	.			trans	-76	163.1	165.4	68.9	0	0	0	0	110.1	Y238 V379 C380 R381	Y238-T377 HydrophobicContact CD2-CG2 3.94Å; Y238-T377 HydrophobicContact CE2-CG2 3.7Å; T377-V379 VanDerWaalsContact C-N 3.26Å; T377-V379 PolarHBondContact O-N 3.22Å; T377-C380 WeakPolarHBondContact O-CB 3.21Å; T377-C380 PolarHBondContact O-N 3.34Å; T377-C380 VanDerWaalsContact O-N 3.13Å; T377-C380 PolarHBondContact OG1-N 3.4Å; T377-C380 VanDerWaalsContact OG1-N 3.14Å; T377-C380 PolarHBondContact OG1-SG 2.8Å; T377-R381 PolarHBondContact O-N 2.88Å
378	D	94.8	Very high	87.1	Confident	19 Å²	19	75.6 Å²	75.6	10%	0.102	41%	0.405	C	S	.	.	H	α-helix	trans	-61.5	-37.2	175.1	-72.3	-19.3	0	0	0	112.2	Y238 R270 C380 R381 M382 P433	Y238-D378 HydrophobicContact CE1-CB 4.11Å; R270-D378 IonicContact CZ-OD2 3.4Å; R270-D378 IonicContact NH1-OD2 3.95Å; R270-D378 PolarHBondContact NH1-OD2 2.92Å; R270-D378 VanDerWaalsContact NH2-CG 3.28Å; R270-D378 IonicContact NH2-OD1 3.58Å; R270-D378 PolarHBondContact NH2-OD1 3.14Å; R270-D378 IonicContact NH2-OD2 3.14Å; R270-D378 PolarHBondContact NH2-OD2 3.36Å; D378-C380 VanDerWaalsContact C-N 3.3Å; D378-C380 PolarHBondContact O-N 3.37Å; D378-R381 PolarHBondContact O-N 3.2Å; D378-R381 IonicContact OD1-NH1 2.78Å; D378-R381 PolarHBondContact OD1-NH1 2.97Å; D378-M382 VanDerWaalsContact O-CG 3.3Å; D378-M382 WeakPolarHBondContact O-CG 3.45Å; D378-M382 PolarHBondContact O-N 3.08Å; D378-P433 HydrophobicContact CB-CB 4.21Å; D378-P433 HydrophobicContact CB-CG 3.85Å
379	V	92.5	Very high	87.2	Confident	81 Å²	81	72.1 Å²	72.1	49%	0.491	39%	0.392	S	S	.	.	H	α-helix	trans	-61.5	-40.2	174.5	179.3	0	0	0	0	111.1	T377 M382 K383	T377-V379 VanDerWaalsContact C-N 3.26Å; T377-V379 PolarHBondContact O-N 3.22Å; V379-M382 PolarHBondContact O-N 3.42Å; V379-K383 HydrophobicContact CG1-CD 4.1Å; V379-K383 WeakPolarHBondContact O-CB 3.38Å; V379-K383 VanDerWaalsContact O-CG 3.29Å; V379-K383 WeakPolarHBondContact O-CG 3.2Å; V379-K383 PolarHBondContact O-N 3.36Å
380	C	92.9	Very high	87.3	Confident	60 Å²	60	71.5 Å²	71.5	41%	0.405	39%	0.39	S	S	.	.	H	α-helix	trans	-64.6	-45.1	174.5	-69.8	0	0	0	0	111.3	K376 T377 D378 M382 K383 E384	K376-C380 HydrophobicContact CB-CB 4.22Å; T377-C380 WeakPolarHBondContact O-CB 3.21Å; T377-C380 PolarHBondContact O-N 3.34Å; T377-C380 VanDerWaalsContact O-N 3.13Å; T377-C380 PolarHBondContact OG1-N 3.4Å; T377-C380 VanDerWaalsContact OG1-N 3.14Å; T377-C380 PolarHBondContact OG1-SG 2.8Å; D378-C380 VanDerWaalsContact C-N 3.3Å; D378-C380 PolarHBondContact O-N 3.37Å; C380-M382 VanDerWaalsContact C-N 3.31Å; C380-M382 PolarHBondContact O-N 3.14Å; C380-K383 PolarHBondContact O-N 3.01Å; C380-E384 WeakPolarHBondContact O-CG 3.26Å; C380-E384 PolarHBondContact O-N 3.32Å
381	R	92.9	Very high	87.4	Confident	14 Å²	14	74.7 Å²	74.7	5%	0.053	41%	0.407	C	S	.	.	H	α-helix	trans	-58.1	-42.7	176.3	-69.5	-174.5	178.9	83.4	11.2	112.1	E245 K376 T377 D378 K383 P433	E245-R381 IonicContact OE1-CZ 3.88Å; E245-R381 IonicContact OE1-NE 3.69Å; E245-R381 PolarHBondContact OE1-NE 2.87Å; E245-R381 IonicContact OE2-CZ 3.2Å; E245-R381 IonicContact OE2-NE 3.77Å; E245-R381 PolarHBondContact OE2-NE 3.14Å; E245-R381 IonicContact OE2-NH2 2.79Å; E245-R381 PolarHBondContact OE2-NH2 3.19Å; K376-R381 HydrophobicContact CB-CG 4.13Å; K376-R381 HydrophobicContact CD-CG 4.43Å; K376-R381 PolarHBondContact O-NH1 2.95Å; K376-R381 PolarHBondContact O-NH2 3.18Å; T377-R381 PolarHBondContact O-N 2.88Å; D378-R381 PolarHBondContact O-N 3.2Å; D378-R381 IonicContact OD1-NH1 2.78Å; D378-R381 PolarHBondContact OD1-NH1 2.97Å; R381-K383 VanDerWaalsContact C-N 3.28Å; R381-K383 PolarHBondContact O-N 3.09Å; R381-P433 HydrophobicContact CB-CG 3.97Å
382	M	89.8	Confident	87.4	Confident	58 Å²	58	73.4 Å²	73.4	29%	0.286	40%	0.403	S	S	.	.	H	α-helix	trans	-66	-31.6	176.3	-66.6	170.8	75.3	0	0	112.3	D378 V379 C380 P433 G434 N435	D378-M382 VanDerWaalsContact O-CG 3.3Å; D378-M382 WeakPolarHBondContact O-CG 3.45Å; D378-M382 PolarHBondContact O-N 3.08Å; V379-M382 PolarHBondContact O-N 3.42Å; C380-M382 VanDerWaalsContact C-N 3.31Å; C380-M382 PolarHBondContact O-N 3.14Å; M382-P433 HydrophobicContact CG-CB 4.13Å; M382-P433 HydrophobicContact CG-CG 4.34Å; M382-P433 HydrophobicContact SD-CB 4.41Å; M382-G434 WeakPolarHBondContact CE-O 3.43Å; M382-N435 HydrophobicContact CB-CB 4.33Å; M382-N435 PolarHBondContact O-ND2 2.92Å
383	K	86.1	Confident	87.6	Confident	129 Å²	129	71.8 Å²	71.8	56%	0.561	38%	0.38	S	S	*	.	H	α-helix	trans	-79	-22.7	-177.5	-77.9	176.9	180	-178.7	0	114.7	V379 C380 R381 H385 M386	V379-K383 HydrophobicContact CG1-CD 4.1Å; V379-K383 WeakPolarHBondContact O-CB 3.38Å; V379-K383 VanDerWaalsContact O-CG 3.29Å; V379-K383 WeakPolarHBondContact O-CG 3.2Å; V379-K383 PolarHBondContact O-N 3.36Å; C380-K383 PolarHBondContact O-N 3.01Å; R381-K383 VanDerWaalsContact C-N 3.28Å; R381-K383 PolarHBondContact O-N 3.09Å; K383-H385 PolarHBondContact O-N 2.79Å; K383-M386 HydrophobicContact CB-CG 4.37Å; K383-M386 HydrophobicContact CG-CE 3.88Å; K383-M386 HydrophobicContact CG-CG 4.43Å; K383-M386 HydrophobicContact CG-SD 4.32Å; K383-M386 WeakPolarHBondContact O-CG 3.45Å; K383-M386 PolarHBondContact O-N 3.16Å
384	E	82.7	Confident	87.7	Confident	102 Å²	102	74.5 Å²	74.5	48%	0.477	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-28.1	-176.6	-77.6	176.9	175.4	0	0	113.7	K376 C380	K376-E384 WeakPolarHBondContact CD-OE1 3.39Å; K376-E384 WeakPolarHBondContact CE-OE1 3.38Å; K376-E384 IonicContact NZ-OE1 3.68Å; K376-E384 PolarHBondContact NZ-OE1 3.41Å; K376-E384 IonicContact NZ-OE2 3.07Å; K376-E384 PolarHBondContact NZ-OE2 2.96Å; C380-E384 WeakPolarHBondContact O-CG 3.26Å; C380-E384 PolarHBondContact O-N 3.32Å
385	H	76.5	Confident	87.8	Confident	61 Å²	61	70.7 Å²	70.7	28%	0.282	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	28.7	-176.5	-63.2	-68.7	0	0	0	112.9	K383 E387 D388 I438 N451	K383-H385 PolarHBondContact O-N 2.79Å; H385-E387 PolarHBondContact O-N 3.37Å; H385-D388 HydrophobicContact CB-CB 4.45Å; H385-D388 IonicContact CG-OD2 3.84Å; H385-D388 IonicContact ND1-OD2 2.87Å; H385-D388 PolarHBondContact ND1-OD2 3.44Å; H385-D388 VanDerWaalsContact ND1-OD2 3.14Å; H385-D388 PolarHBondContact O-N 3.41Å; H385-I438 HydrophobicContact CB-CD1 3.99Å; H385-N451 PolarHBondContact CD2-O 3.36Å; H385-N451 VanDerWaalsContact CD2-O 3.22Å
386	M	68.9	Low	87.3	Confident	88 Å²	88	78.4 Å²	78.4	43%	0.433	39%	0.387	S	S	.	.	S	Bend	trans	-63	-29.8	-178.4	-70.8	-130.1	147.6	0	0	113.7	K383	K383-M386 HydrophobicContact CB-CG 4.37Å; K383-M386 HydrophobicContact CG-CE 3.88Å; K383-M386 HydrophobicContact CG-CG 4.43Å; K383-M386 HydrophobicContact CG-SD 4.32Å; K383-M386 WeakPolarHBondContact O-CG 3.45Å; K383-M386 PolarHBondContact O-N 3.16Å
387	E	75	Confident	87	Confident	185 Å²	185	85.5 Å²	85.5	86%	0.864	42%	0.418	S	S	*	.	S	Bend	trans	-85.5	-16.5	-177.4	-60.6	-172.6	171.5	0	0	112.5	H385 R389	H385-E387 PolarHBondContact O-N 3.37Å; E387-R389 PolarHBondContact O-N 3.1Å
388	D	83.2	Confident	86.8	Confident	73 Å²	73	84.7 Å²	84.7	39%	0.39	41%	0.411	S	S	.	.			trans	-87.2	72.6	-174.3	-65.5	-36.8	0	0	0	111.7	H385 K453	H385-D388 HydrophobicContact CB-CB 4.45Å; H385-D388 IonicContact CG-OD2 3.84Å; H385-D388 IonicContact ND1-OD2 2.87Å; H385-D388 PolarHBondContact ND1-OD2 3.44Å; H385-D388 VanDerWaalsContact ND1-OD2 3.14Å; H385-D388 PolarHBondContact O-N 3.41Å; D388-K453 HydrophobicContact CB-CB 3.88Å; D388-K453 HydrophobicContact CB-CD 4.37Å
389	R	89.4	Confident	86.7	Confident	112 Å²	112	87.5 Å²	87.5	42%	0.423	42%	0.424	S	S	.	.			trans	-80.1	147.5	177.6	-63.3	-172.3	-177.9	-161.6	-0.9	113	E387 E404 K453	E387-R389 PolarHBondContact O-N 3.1Å; R389-E404 IonicContact CZ-OE1 3.95Å; R389-E404 IonicContact NH1-OE1 2.86Å; R389-E404 PolarHBondContact NH1-OE1 3.07Å; R389-E404 IonicContact NH1-OE2 3.15Å; R389-E404 PolarHBondContact NH1-OE2 3.37Å; R389-E404 IonicContact NH2-OE1 2.69Å; R389-E404 PolarHBondContact NH2-OE1 3.41Å; R389-K453 WeakPolarHBondContact O-CE 3.47Å; R389-K453 PolarHBondContact O-NZ 3.2Å
390	V	90.9	Very high	86.8	Confident	8 Å²	8	84.3 Å²	84.3	5%	0.048	40%	0.403	C	S	.	.			trans	-69.1	137.9	169.7	178.6	0	0	0	0	110	F395 W400 I438 A456 Y457	V390-F395 HydrophobicContact CG1-CD2 4.34Å; V390-W400 HydrophobicContact CB-CD2 4.41Å; V390-W400 HydrophobicContact CB-CE3 4.24Å; V390-W400 HydrophobicContact CB-CH2 4.47Å; V390-W400 HydrophobicContact CB-CZ3 4.28Å; V390-W400 HydrophobicContact CG1-CD2 3.92Å; V390-W400 HydrophobicContact CG1-CE3 4.21Å; V390-W400 HydrophobicContact CG1-CG 4.5Å; V390-W400 HydrophobicContact CG1-CH2 4.11Å; V390-W400 HydrophobicContact CG1-CZ2 3.79Å; V390-W400 HydrophobicContact CG1-CZ3 4.3Å; V390-W400 HydrophobicContact CG2-CE3 4.26Å; V390-W400 HydrophobicContact CG2-CH2 3.92Å; V390-W400 HydrophobicContact CG2-CZ2 4.44Å; V390-W400 HydrophobicContact CG2-CZ3 3.81Å; V390-I438 HydrophobicContact CG2-CG2 3.9Å; V390-I438 PolarHBondContact N-O 3.4Å; V390-A456 HydrophobicContact CG2-CB 3.65Å; V390-Y457 HydrophobicContact CB-CE2 4.13Å; V390-Y457 HydrophobicContact CG1-CD2 4.43Å; V390-Y457 HydrophobicContact CG1-CE2 3.78Å; V390-Y457 HydrophobicContact CG2-CD2 4.27Å; V390-Y457 HydrophobicContact CG2-CE2 3.95Å
391	N	89.7	Confident	86.8	Confident	77 Å²	77	81.6 Å²	81.6	41%	0.412	39%	0.385	S	S	.	.			trans	-89.7	114.7	173.5	179	13.3	0	0	0	108.7	A393 D394 Y457	N391-A393 PolarHBondContact O-N 3.19Å; N391-A393 VanDerWaalsContact O-N 3.13Å; N391-A393 WeakPolarHBondContact OD1-CB 3.35Å; N391-A393 PolarHBondContact OD1-N 2.86Å; N391-A393 VanDerWaalsContact OD1-N 3.17Å; N391-D394 PolarHBondContact ND2-OD1 3.18Å; N391-D394 WeakPolarHBondContact O-CB 3.33Å; N391-D394 PolarHBondContact O-N 2.87Å; N391-D394 VanDerWaalsContact O-N 3.09Å; N391-Y457 PolarHBondContact N-OH 2.93Å
392	V	87.8	Confident	86.7	Confident	69 Å²	69	81.8 Å²	81.8	42%	0.418	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-58.5	-28.9	-179	-173	0	0	0	0	111.8	D394 F395 W400 F402	V392-D394 PolarHBondContact O-N 3.13Å; V392-F395 PolarHBondContact O-N 3.41Å; V392-W400 HydrophobicContact CG2-CB 4.23Å; V392-F402 HydrophobicContact CG2-CE2 3.53Å; V392-F402 HydrophobicContact CG2-CZ 4.13Å
393	A	87.5	Confident	86.6	Confident	54 Å²	54	81.8 Å²	81.8	45%	0.446	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-64.9	-25.2	-180	0	0	0	0	0	113.7	N391 F395 R396	N391-A393 PolarHBondContact O-N 3.19Å; N391-A393 VanDerWaalsContact O-N 3.13Å; N391-A393 WeakPolarHBondContact OD1-CB 3.35Å; N391-A393 PolarHBondContact OD1-N 2.86Å; N391-A393 VanDerWaalsContact OD1-N 3.17Å; A393-F395 VanDerWaalsContact C-N 3.33Å; A393-R396 WeakPolarHBondContact O-CG 3.42Å
394	D	90.2	Very high	86.7	Confident	86 Å²	86	80.8 Å²	80.8	46%	0.46	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-74.8	-27.9	-176.3	-61.3	-6.9	0	0	0	111.1	N391 V392 Y457	N391-D394 PolarHBondContact ND2-OD1 3.18Å; N391-D394 WeakPolarHBondContact O-CB 3.33Å; N391-D394 PolarHBondContact O-N 2.87Å; N391-D394 VanDerWaalsContact O-N 3.09Å; V392-D394 PolarHBondContact O-N 3.13Å; D394-Y457 HydrophobicContact CB-CE1 4.48Å; D394-Y457 WeakPolarHBondContact OD2-CE1 3.28Å; D394-Y457 PolarHBondContact OD2-OH 3.35Å
395	F	90.1	Very high	86.8	Confident	31 Å²	31	78.8 Å²	78.8	14%	0.136	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-125.4	61.8	-177	-60.6	-78.9	0	0	0	112.5	V390 V392 A393 K397 L398 W400 Y457 A460 E461	V390-F395 HydrophobicContact CG1-CD2 4.34Å; V392-F395 PolarHBondContact O-N 3.41Å; A393-F395 VanDerWaalsContact C-N 3.33Å; F395-K397 PolarHBondContact O-N 3.16Å; F395-L398 HydrophobicContact CB-CB 4.14Å; F395-L398 HydrophobicContact CB-CD1 4.16Å; F395-L398 HydrophobicContact CB-CG 4.43Å; F395-L398 HydrophobicContact CD1-CD1 4.17Å; F395-L398 HydrophobicContact CG-CD1 4.37Å; F395-L398 PolarHBondContact O-N 3.34Å; F395-W400 HydrophobicContact CD2-CZ2 4.31Å; F395-Y457 AromaticContact CE2-CD1 3.81Å; F395-Y457 HydrophobicContact CE2-CD1 3.81Å; F395-Y457 AromaticContact CE2-CD2 3.97Å; F395-Y457 HydrophobicContact CE2-CD2 3.97Å; F395-Y457 HydrophobicContact CE2-CE1 4.02Å; F395-Y457 HydrophobicContact CE2-CE2 4.19Å; F395-Y457 AromaticContact CE2-CG 3.8Å; F395-Y457 HydrophobicContact CE2-CG 3.8Å; F395-Y457 AromaticContact CZ-CD1 3.92Å; F395-Y457 HydrophobicContact CZ-CD1 3.92Å; F395-Y457 AromaticContact CZ-CG 3.95Å; F395-Y457 HydrophobicContact CZ-CG 3.95Å; F395-A460 HydrophobicContact CD1-CB 3.85Å; F395-A460 HydrophobicContact CD2-CB 4.28Å; F395-A460 HydrophobicContact CE1-CB 3.6Å; F395-A460 HydrophobicContact CE2-CB 4.05Å; F395-A460 HydrophobicContact CG-CB 4.18Å; F395-A460 HydrophobicContact CZ-CB 3.72Å; F395-E461 HydrophobicContact CE1-CG 4.44Å
396	R	82.5	Confident	87.4	Confident	225 Å²	225	76 Å²	76	85%	0.849	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-19.8	-176.2	-60.4	-173.2	-175.8	-175	-0.7	116.1	A393	A393-R396 WeakPolarHBondContact O-CG 3.42Å
397	K	88	Confident	88.1	Confident	211 Å²	211	74.6 Å²	74.6	92%	0.917	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-12.4	179.2	-64.7	-178.5	-178.9	176.9	0	113.2	F395	F395-K397 PolarHBondContact O-N 3.16Å
398	L	92.3	Very high	88.7	Confident	35 Å²	35	66.7 Å²	66.7	18%	0.183	34%	0.336	C	S	.	.	S	Bend	trans	-110.1	145.2	-176	-64	178.1	0	0	0	109.9	F395 L441 Y443 A460	F395-L398 HydrophobicContact CB-CB 4.14Å; F395-L398 HydrophobicContact CB-CD1 4.16Å; F395-L398 HydrophobicContact CB-CG 4.43Å; F395-L398 HydrophobicContact CD1-CD1 4.17Å; F395-L398 HydrophobicContact CG-CD1 4.37Å; F395-L398 PolarHBondContact O-N 3.34Å; L398-L441 HydrophobicContact CB-CD1 3.76Å; L398-L441 HydrophobicContact CD1-CD1 4Å; L398-L441 HydrophobicContact CD2-CD1 4.38Å; L398-L441 HydrophobicContact CG-CD1 4.26Å; L398-Y443 HydrophobicContact CD2-CD2 3.92Å; L398-Y443 HydrophobicContact CD2-CE2 4.29Å; L398-A460 HydrophobicContact CD1-CB 3.78Å; L398-A460 WeakPolarHBondContact CD1-O 3.34Å
399	E	91.6	Very high	88.9	Confident	78 Å²	78	64.1 Å²	64.1	36%	0.364	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	119.4	179.5	-172.3	-178.6	158.9	0	0	109.1	L401 K442	E399-L401 HydrophobicContact CG-CD2 4.36Å; E399-K442 HydrophobicContact CB-CB 4.22Å; E399-K442 HydrophobicContact CB-CD 4.45Å; E399-K442 HydrophobicContact CG-CD 4.3Å; E399-K442 PolarHBondContact O-N 2.85Å; E399-K442 IonicContact OE1-NZ 2.72Å; E399-K442 VanDerWaalsContact OE2-CD 3.29Å; E399-K442 WeakPolarHBondContact OE2-CD 3.36Å; E399-K442 IonicContact OE2-NZ 3.33Å; E399-K442 PolarHBondContact OE2-NZ 3.31Å
400	W	94.1	Very high	88.7	Confident	15 Å²	15	66.2 Å²	66.2	6%	0.057	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	131.7	177.1	-69.5	91.2	0	0	0	109.8	V390 V392 F395 F402 I440 L441 F450 A456 A460	V390-W400 HydrophobicContact CB-CD2 4.41Å; V390-W400 HydrophobicContact CB-CE3 4.24Å; V390-W400 HydrophobicContact CB-CH2 4.47Å; V390-W400 HydrophobicContact CB-CZ3 4.28Å; V390-W400 HydrophobicContact CG1-CD2 3.92Å; V390-W400 HydrophobicContact CG1-CE3 4.21Å; V390-W400 HydrophobicContact CG1-CG 4.5Å; V390-W400 HydrophobicContact CG1-CH2 4.11Å; V390-W400 HydrophobicContact CG1-CZ2 3.79Å; V390-W400 HydrophobicContact CG1-CZ3 4.3Å; V390-W400 HydrophobicContact CG2-CE3 4.26Å; V390-W400 HydrophobicContact CG2-CH2 3.92Å; V390-W400 HydrophobicContact CG2-CZ2 4.44Å; V390-W400 HydrophobicContact CG2-CZ3 3.81Å; V392-W400 HydrophobicContact CG2-CB 4.23Å; F395-W400 HydrophobicContact CD2-CZ2 4.31Å; W400-F402 HydrophobicContact CB-CE2 3.73Å; W400-F402 HydrophobicContact CB-CZ 4.22Å; W400-I440 WeakPolarHBondContact CA-O 3.26Å; W400-L441 HydrophobicContact CD2-CB 4.47Å; W400-L441 HydrophobicContact CD2-CD1 4.26Å; W400-L441 HydrophobicContact CE3-CB 4.04Å; W400-L441 HydrophobicContact CH2-CB 3.86Å; W400-L441 HydrophobicContact CH2-CD1 4.43Å; W400-L441 HydrophobicContact CH2-CG 4.49Å; W400-L441 HydrophobicContact CZ2-CB 4.3Å; W400-L441 HydrophobicContact CZ2-CD1 4.01Å; W400-L441 HydrophobicContact CZ3-CB 3.72Å; W400-F450 HydrophobicContact CH2-CD2 4.39Å; W400-F450 AromaticContact CH2-CE2 3.86Å; W400-F450 HydrophobicContact CH2-CE2 3.86Å; W400-F450 HydrophobicContact CZ3-CD2 4.22Å; W400-F450 AromaticContact CZ3-CE2 3.83Å; W400-F450 HydrophobicContact CZ3-CE2 3.83Å; W400-A456 HydrophobicContact CH2-CB 3.91Å; W400-A456 HydrophobicContact CZ3-CB 4.32Å; W400-A460 HydrophobicContact CH2-CB 4.4Å; W400-A460 HydrophobicContact CZ2-CB 3.76Å
401	L	92.7	Very high	88.5	Confident	3 Å²	3	73 Å²	73	2%	0.016	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	137.2	-179.5	-56.9	177.5	0	0	0	110.1	E399 L412 I440 Y447 P509 T511	E399-L401 HydrophobicContact CG-CD2 4.36Å; L401-L412 HydrophobicContact CD1-CD1 3.78Å; L401-I440 HydrophobicContact CB-CB 4.29Å; L401-I440 PolarHBondContact N-O 3.11Å; L401-I440 PolarHBondContact O-N 3.4Å; L401-Y447 HydrophobicContact CD1-CD1 3.76Å; L401-Y447 HydrophobicContact CD1-CE1 3.61Å; L401-P509 HydrophobicContact CD1-CB 3.95Å; L401-P509 HydrophobicContact CD1-CG 4.18Å; L401-P509 HydrophobicContact CD2-CB 4.44Å; L401-T511 HydrophobicContact CD2-CG2 4.03Å
402	F	92.3	Very high	88.4	Confident	18 Å²	18	70 Å²	70	8%	0.079	35%	0.353	C	S	.	.			trans	-128.9	157.9	177.5	-62.2	-87.5	0	0	0	111	V392 W400 E404 T405 T406 F409 I438	V392-F402 HydrophobicContact CG2-CE2 3.53Å; V392-F402 HydrophobicContact CG2-CZ 4.13Å; W400-F402 HydrophobicContact CB-CE2 3.73Å; W400-F402 HydrophobicContact CB-CZ 4.22Å; F402-E404 WeakPolarHBondContact CB-OE2 3.28Å; F402-E404 PolarHBondContact O-N 3.43Å; F402-T405 PolarHBondContact N-OG1 2.96Å; F402-T405 PolarHBondContact O-N 3.47Å; F402-T405 PolarHBondContact O-OG1 2.92Å; F402-T405 VanDerWaalsContact O-OG1 3.1Å; F402-T406 WeakPolarHBondContact O-CB 3.36Å; F402-T406 PolarHBondContact O-N 3.19Å; F402-T406 VanDerWaalsContact O-N 3.14Å; F402-T406 PolarHBondContact O-OG1 3.22Å; F402-F409 VanDerWaalsContact C-CD2 3.43Å; F402-F409 VanDerWaalsContact C-CE2 3.49Å; F402-I438 WeakPolarHBondContact CE1-O 3.4Å
403	P	87.8	Confident	88.5	Confident	58 Å²	58	69.7 Å²	69.7	38%	0.377	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-34.8	178.4	-23.8	31.9	0	0	0	113.4	F409	P403-F409 HydrophobicContact CB-CD1 4.19Å; P403-F409 HydrophobicContact CB-CE1 4.42Å; P403-F409 HydrophobicContact CB-CG 4.31Å; P403-F409 HydrophobicContact CG-CD1 3.94Å; P403-F409 HydrophobicContact CG-CD2 4.48Å; P403-F409 HydrophobicContact CG-CE1 3.68Å; P403-F409 HydrophobicContact CG-CE2 4.24Å; P403-F409 HydrophobicContact CG-CG 4.33Å; P403-F409 HydrophobicContact CG-CZ 3.83Å
404	E	86.9	Confident	88.8	Confident	107 Å²	107	68.9 Å²	68.9	50%	0.5	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-31.6	-175.9	-54.3	84.6	174.9	0	0	112.4	R389 F402	R389-E404 IonicContact CZ-OE1 3.95Å; R389-E404 IonicContact NH1-OE1 2.86Å; R389-E404 PolarHBondContact NH1-OE1 3.07Å; R389-E404 IonicContact NH1-OE2 3.15Å; R389-E404 PolarHBondContact NH1-OE2 3.37Å; R389-E404 IonicContact NH2-OE1 2.69Å; R389-E404 PolarHBondContact NH2-OE1 3.41Å; F402-E404 WeakPolarHBondContact CB-OE2 3.28Å; F402-E404 PolarHBondContact O-N 3.43Å
405	T	86.1	Confident	88.9	Confident	60 Å²	60	66.3 Å²	66.3	37%	0.368	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-19.1	-176.1	57.6	0	0	0	0	113.5	F402 K512	F402-T405 PolarHBondContact N-OG1 2.96Å; F402-T405 PolarHBondContact O-N 3.47Å; F402-T405 PolarHBondContact O-OG1 2.92Å; F402-T405 VanDerWaalsContact O-OG1 3.1Å; T405-K512 PolarHBondContact O-N 2.97Å
406	T	87.5	Confident	89.1	Confident	4 Å²	4	65.1 Å²	65.1	3%	0.025	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-120.9	114	-169.2	-53.3	0	0	0	0	111.1	F402 N408 F409 L412 P509	F402-T406 WeakPolarHBondContact O-CB 3.36Å; F402-T406 PolarHBondContact O-N 3.19Å; F402-T406 VanDerWaalsContact O-N 3.14Å; F402-T406 PolarHBondContact O-OG1 3.22Å; T406-N408 VanDerWaalsContact C-N 3.32Å; T406-N408 PolarHBondContact O-N 3.08Å; T406-F409 HydrophobicContact CG2-CB 4.45Å; T406-F409 WeakPolarHBondContact O-CB 3.45Å; T406-F409 PolarHBondContact O-N 3.38Å; T406-L412 HydrophobicContact CG2-CD1 4.3Å; T406-P509 HydrophobicContact CG2-CB 3.91Å
407	A	85.5	Confident	89.6	Confident	57 Å²	57	58.5 Å²	58.5	47%	0.471	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-28.6	-172.6	0	0	0	0	0	114.1	I510	A407-I510 HydrophobicContact CB-CB 4.1Å; A407-I510 HydrophobicContact CB-CG2 4.04Å; A407-I510 PolarHBondContact N-O 3.05Å
408	N	86.5	Confident	89.9	Confident	20 Å²	20	49.3 Å²	49.3	11%	0.107	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	32.2	179.1	64.8	-32.7	0	0	0	112.3	T406 D410 K411 L412 I507 K508 P509 I510	T406-N408 VanDerWaalsContact C-N 3.32Å; T406-N408 PolarHBondContact O-N 3.08Å; N408-D410 VanDerWaalsContact C-N 3.32Å; N408-D410 PolarHBondContact O-N 2.99Å; N408-K411 HydrophobicContact CB-CB 4.41Å; N408-K411 PolarHBondContact O-N 3.4Å; N408-L412 PolarHBondContact O-N 2.94Å; N408-I507 WeakPolarHBondContact ND2-CG2 3.46Å; N408-K508 PolarHBondContact ND2-O 2.86Å; N408-P509 WeakPolarHBondContact OD1-CA 3.44Å; N408-I510 HydrophobicContact CB-CD1 4.46Å; N408-I510 PolarHBondContact OD1-N 2.84Å
409	F	87.4	Confident	90.1	Very high	19 Å²	19	48.5 Å²	48.5	8%	0.083	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-51.3	-47.2	-176.2	-171.9	-95.9	0	0	0	113.2	F402 P403 T406 K411 L412 P436 I440	F402-F409 VanDerWaalsContact C-CD2 3.43Å; F402-F409 VanDerWaalsContact C-CE2 3.49Å; P403-F409 HydrophobicContact CB-CD1 4.19Å; P403-F409 HydrophobicContact CB-CE1 4.42Å; P403-F409 HydrophobicContact CB-CG 4.31Å; P403-F409 HydrophobicContact CG-CD1 3.94Å; P403-F409 HydrophobicContact CG-CD2 4.48Å; P403-F409 HydrophobicContact CG-CE1 3.68Å; P403-F409 HydrophobicContact CG-CE2 4.24Å; P403-F409 HydrophobicContact CG-CG 4.33Å; P403-F409 HydrophobicContact CG-CZ 3.83Å; T406-F409 HydrophobicContact CG2-CB 4.45Å; T406-F409 WeakPolarHBondContact O-CB 3.45Å; T406-F409 PolarHBondContact O-N 3.38Å; F409-K411 PolarHBondContact O-N 3.47Å; F409-K411 VanDerWaalsContact O-N 3.16Å; F409-L412 HydrophobicContact CD2-CD1 4.2Å; F409-L412 WeakPolarHBondContact O-CB 3.34Å; F409-L412 WeakPolarHBondContact O-CG 3.46Å; F409-L412 PolarHBondContact O-N 2.96Å; F409-P436 HydrophobicContact CE1-CB 3.77Å; F409-P436 HydrophobicContact CZ-CB 3.73Å; F409-I440 HydrophobicContact CD2-CD1 4.28Å; F409-I440 HydrophobicContact CE1-CD1 4.19Å; F409-I440 HydrophobicContact CE2-CD1 3.52Å; F409-I440 HydrophobicContact CE2-CG1 3.97Å; F409-I440 HydrophobicContact CZ-CD1 3.47Å; F409-I440 VanDerWaalsContact CZ-CD1 3.47Å; F409-I440 HydrophobicContact CZ-CG1 3.87Å
410	D	85.8	Confident	90.3	Very high	156 Å²	156	44.8 Å²	44.8	83%	0.834	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-70.2	-11.4	-178.6	-53.9	-41.3	0	0	0	113.9	N408	N408-D410 VanDerWaalsContact C-N 3.32Å; N408-D410 PolarHBondContact O-N 2.99Å
411	K	86.6	Confident	90.5	Very high	150 Å²	150	44.1 Å²	44.1	65%	0.652	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-101.2	1.1	179	-59.2	-176.7	179.1	-178.1	0	112.5	N408 F409 I507	N408-K411 HydrophobicContact CB-CB 4.41Å; N408-K411 PolarHBondContact O-N 3.4Å; F409-K411 PolarHBondContact O-N 3.47Å; F409-K411 VanDerWaalsContact O-N 3.16Å; K411-I507 HydrophobicContact CB-CG2 4.47Å; K411-I507 WeakPolarHBondContact O-CD1 3.4Å
412	L	88.1	Confident	90.7	Very high	13 Å²	13	46.5 Å²	46.5	7%	0.068	24%	0.241	C	C	.	.			trans	-69.6	133.8	178.9	-64.4	175.4	0	0	0	110.4	L401 T406 N408 F409 I414 I440 P509	L401-L412 HydrophobicContact CD1-CD1 3.78Å; T406-L412 HydrophobicContact CG2-CD1 4.3Å; N408-L412 PolarHBondContact O-N 2.94Å; F409-L412 HydrophobicContact CD2-CD1 4.2Å; F409-L412 WeakPolarHBondContact O-CB 3.34Å; F409-L412 WeakPolarHBondContact O-CG 3.46Å; F409-L412 PolarHBondContact O-N 2.96Å; L412-I414 PolarHBondContact O-N 3.26Å; L412-I414 VanDerWaalsContact O-N 3.12Å; L412-I440 HydrophobicContact CD1-CD1 4.12Å; L412-P509 HydrophobicContact CD2-CB 4Å
413	L	89.3	Confident	90.8	Very high	63 Å²	63	46.3 Å²	46.3	33%	0.33	24%	0.241	S	C	.	.			trans	-82.6	91.2	177.5	-67	171.4	0	0	0	110	Y447 H505 I507	L413-Y447 WeakPolarHBondContact O-CD2 3.37Å; L413-H505 HydrophobicContact CD1-CB 4.07Å; L413-H505 VanDerWaalsContact CD1-O 3.22Å; L413-H505 WeakPolarHBondContact CD1-O 3.19Å; L413-I507 HydrophobicContact CD1-CD1 4.23Å; L413-I507 HydrophobicContact CD1-CG1 4.22Å; L413-I507 HydrophobicContact CG-CD1 4.14Å; L413-I507 HydrophobicContact CG-CG1 4.49Å
414	I	92.9	Very high	91.3	Very high	37 Å²	37	43.8 Å²	43.8	19%	0.19	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-73.8	128.6	179.7	-52.5	178	0	0	0	109.4	L412 P436 I440 T449	L412-I414 PolarHBondContact O-N 3.26Å; L412-I414 VanDerWaalsContact O-N 3.12Å; I414-P436 HydrophobicContact CD1-CG 3.94Å; I414-I440 HydrophobicContact CD1-CD1 3.84Å; I414-I440 HydrophobicContact CG1-CD1 4.23Å; I414-T449 HydrophobicContact CG2-CG2 3.69Å
415	Q	93.5	Very high	91.7	Very high	33 Å²	33	39.1 Å²	39.1	15%	0.154	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-60.4	157.2	177.7	-66.9	-65.9	-70.6	0	0	111.6	R417 G418 K446 Y447 Y448	Q415-R417 PolarHBondContact O-N 2.96Å; Q415-G418 PolarHBondContact O-N 3.37Å; Q415-G418 VanDerWaalsContact O-N 3.1Å; Q415-K446 HydrophobicContact CG-CB 3.81Å; Q415-K446 HydrophobicContact CG-CD 4.28Å; Q415-K446 HydrophobicContact CG-CG 4.27Å; Q415-Y447 WeakPolarHBondContact CB-O 3.49Å; Q415-Y447 WeakPolarHBondContact CG-O 3.34Å; Q415-Y447 PolarHBondContact N-O 2.98Å; Q415-Y448 HydrophobicContact CB-CD1 3.89Å; Q415-Y448 HydrophobicContact CB-CE1 3.77Å; Q415-Y448 HydrophobicContact CG-CD1 4.23Å; Q415-Y448 HydrophobicContact CG-CE1 3.79Å
416	Y	94.7	Very high	92	Very high	6 Å²	6	38.9 Å²	38.9	2%	0.024	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	57.6	33	177.4	-43.1	-47.3	0	0	0	112.4	G418 F419 A421 Y448 V470 L484 L486	Y416-G418 PolarHBondContact O-N 3.42Å; Y416-F419 WeakPolarHBondContact O-CB 3.45Å; Y416-F419 WeakPolarHBondContact O-CD2 3.33Å; Y416-F419 PolarHBondContact O-N 3.5Å; Y416-A421 HydrophobicContact CD2-CB 3.86Å; Y416-A421 HydrophobicContact CE2-CB 3.69Å; Y416-Y448 HydrophobicContact CD2-CD1 4.19Å; Y416-Y448 HydrophobicContact CD2-CE1 4.43Å; Y416-Y448 AromaticContact CE2-CD1 3.63Å; Y416-Y448 HydrophobicContact CE2-CD1 3.63Å; Y416-Y448 AromaticContact CE2-CE1 3.59Å; Y416-Y448 HydrophobicContact CE2-CE1 3.59Å; Y416-Y448 AromaticContact CZ-CE1 3.84Å; Y416-V470 HydrophobicContact CD1-CG1 4.2Å; Y416-V470 HydrophobicContact CE1-CG1 3.52Å; Y416-V470 HydrophobicContact CE2-CG1 4.4Å; Y416-V470 HydrophobicContact CE2-CG2 4.46Å; Y416-L484 WeakPolarHBondContact CA-O 3.34Å; Y416-L484 HydrophobicContact CD1-CB 4.23Å; Y416-L486 HydrophobicContact CD1-CD2 3.81Å; Y416-L486 HydrophobicContact CE1-CD2 3.5Å; Y416-L486 VanDerWaalsContact CE1-CD2 3.5Å
417	R	92.3	Very high	92.2	Very high	85 Å²	85	41.1 Å²	41.1	32%	0.321	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	50.9	28.2	-174.3	-62.4	-168.8	-179.9	-76.8	-6.8	114.7	Q415 F419 L483 E485	Q415-R417 PolarHBondContact O-N 2.96Å; R417-F419 VanDerWaalsContact C-N 3.35Å; R417-F419 HydrophobicContact CB-CD2 4.41Å; R417-F419 HydrophobicContact CB-CE2 4.35Å; R417-L483 WeakPolarHBondContact CD-O 3.26Å; R417-L483 WeakPolarHBondContact CG-O 3.4Å; R417-L483 PolarHBondContact NE-O 3.09Å; R417-E485 HydrophobicContact CG-CG 4.04Å; R417-E485 VanDerWaalsContact CZ-CG 3.46Å; R417-E485 IonicContact CZ-OE1 2.63Å; R417-E485 IonicContact NE-OE1 2.76Å; R417-E485 IonicContact NH1-OE1 3.6Å; R417-E485 PolarHBondContact NH1-OE1 3.31Å; R417-E485 IonicContact NH1-OE2 3.55Å; R417-E485 IonicContact NH2-OE1 3.91Å; R417-E485 PolarHBondContact NH2-OE1 3.38Å
418	G	94	Very high	92.3	Very high	18 Å²	18	41.2 Å²	41.2	19%	0.186	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	79.4	11.2	-178.6	0	0	0	0	0	115.2	Q415 Y416 G434 T449	Q415-G418 PolarHBondContact O-N 3.37Å; Q415-G418 VanDerWaalsContact O-N 3.1Å; Y416-G418 PolarHBondContact O-N 3.42Å; G418-G434 WeakPolarHBondContact O-CA 3.35Å; G418-G434 PolarHBondContact O-N 2.97Å; G418-T449 WeakPolarHBondContact O-CG2 3.39Å
419	F	96.8	Very high	92.6	Very high	18 Å²	18	40.3 Å²	40.3	8%	0.079	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-69.3	152.1	166.3	-66.2	-64.2	0	0	0	111.2	Y416 R417 A421 L431 L432 L484	Y416-F419 WeakPolarHBondContact O-CB 3.45Å; Y416-F419 WeakPolarHBondContact O-CD2 3.33Å; Y416-F419 PolarHBondContact O-N 3.5Å; R417-F419 VanDerWaalsContact C-N 3.35Å; R417-F419 HydrophobicContact CB-CD2 4.41Å; R417-F419 HydrophobicContact CB-CE2 4.35Å; F419-A421 PolarHBondContact O-N 2.85Å; F419-A421 VanDerWaalsContact O-N 3.13Å; F419-L431 HydrophobicContact CB-CD2 4.21Å; F419-L431 HydrophobicContact CD1-CB 4.12Å; F419-L431 HydrophobicContact CD1-CD2 4.3Å; F419-L431 HydrophobicContact CD2-CD2 3.81Å; F419-L431 HydrophobicContact CE1-CB 4.18Å; F419-L431 HydrophobicContact CE2-CD1 4.47Å; F419-L431 HydrophobicContact CE2-CD2 4.28Å; F419-L431 HydrophobicContact CG-CD2 3.85Å; F419-L431 HydrophobicContact CZ-CD1 4.49Å; F419-L432 WeakPolarHBondContact CA-O 3.38Å; F419-L484 HydrophobicContact CD2-CD2 3.78Å; F419-L484 HydrophobicContact CE2-CD2 4.35Å
420	C	96.3	Very high	92.9	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.007	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-64.6	113.3	178	175.6	0	0	0	0	110.9	Y422 T423 F424 L432 T449 N451	C420-Y422 VanDerWaalsContact C-N 3.35Å; C420-Y422 PolarHBondContact O-N 2.96Å; C420-T423 PolarHBondContact SG-N 3.09Å; C420-T423 VanDerWaalsContact SG-N 3.37Å; C420-T423 PolarHBondContact SG-OG1 3.16Å; C420-F424 WeakPolarHBondContact O-CB 3.34Å; C420-F424 PolarHBondContact O-N 3.27Å; C420-F424 VanDerWaalsContact O-N 3.13Å; C420-L432 PolarHBondContact N-O 3.35Å; C420-T449 WeakPolarHBondContact CA-O 3.5Å; C420-N451 HydrophobicContact CB-CB 4.05Å; C420-N451 PolarHBondContact SG-N 2.91Å; C420-N451 VanDerWaalsContact SG-N 3.4Å
421	A	96.8	Very high	93.4	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61	-43	-177.6	0	0	0	0	0	112.5	Y416 F419 A425 Y448 T449 F450 F459	Y416-A421 HydrophobicContact CD2-CB 3.86Å; Y416-A421 HydrophobicContact CE2-CB 3.69Å; F419-A421 PolarHBondContact O-N 2.85Å; F419-A421 VanDerWaalsContact O-N 3.13Å; A421-A425 PolarHBondContact O-N 2.86Å; A421-Y448 HydrophobicContact CB-CD1 4.1Å; A421-T449 PolarHBondContact N-O 3.4Å; A421-F450 HydrophobicContact CB-CE1 4.19Å; A421-F459 HydrophobicContact CB-CD2 4.12Å; A421-F459 HydrophobicContact CB-CE2 3.7Å; A421-F459 HydrophobicContact CB-CZ 4.18Å
422	Y	97.2	Very high	93.8	Very high	54 Å²	54	26.2 Å²	26.2	21%	0.212	14%	0.143	C	C	.	.	H	α-helix	trans	-66.3	-54.2	-179.8	177.3	-98.9	0	0	0	112.6	C420 F424 A425 A426 A455 F459 Y466	C420-Y422 VanDerWaalsContact C-N 3.35Å; C420-Y422 PolarHBondContact O-N 2.96Å; Y422-F424 VanDerWaalsContact C-N 3.28Å; Y422-F424 PolarHBondContact O-N 3.39Å; Y422-A425 PolarHBondContact O-N 2.85Å; Y422-A426 HydrophobicContact CD1-CB 4.35Å; Y422-A426 HydrophobicContact CE1-CB 3.93Å; Y422-A426 HydrophobicContact CE2-CB 4.2Å; Y422-A426 WeakPolarHBondContact O-CB 3.35Å; Y422-A426 PolarHBondContact O-N 2.89Å; Y422-A455 WeakPolarHBondContact CB-O 3.42Å; Y422-A455 HydrophobicContact CD1-CB 3.49Å; Y422-A455 VanDerWaalsContact CD1-CB 3.49Å; Y422-A455 HydrophobicContact CE1-CB 4.3Å; Y422-A455 HydrophobicContact CG-CB 3.95Å; Y422-F459 HydrophobicContact CD2-CB 4.33Å; Y422-Y466 HydrophobicContact CD2-CD1 4.12Å; Y422-Y466 HydrophobicContact CD2-CD2 4.49Å; Y422-Y466 AromaticContact CD2-CE1 3.83Å; Y422-Y466 HydrophobicContact CD2-CE1 3.83Å; Y422-Y466 HydrophobicContact CD2-CE2 4.25Å; Y422-Y466 HydrophobicContact CD2-CG 4.44Å; Y422-Y466 AromaticContact CD2-CZ 3.91Å; Y422-Y466 HydrophobicContact CE2-CD1 4.34Å; Y422-Y466 AromaticContact CE2-CE1 3.61Å; Y422-Y466 HydrophobicContact CE2-CE1 3.61Å; Y422-Y466 HydrophobicContact CE2-CE2 4.27Å; Y422-Y466 AromaticContact CE2-CZ 3.56Å
423	T	95.6	Very high	94.2	Very high	13 Å²	13	26.1 Å²	26.1	8%	0.08	14%	0.143	C	C	.	.	H	α-helix	trans	-62.8	-38	-176.7	-65.2	0	0	0	0	111.7	C420 A425 T427 L430 L432 N451	C420-T423 PolarHBondContact SG-N 3.09Å; C420-T423 VanDerWaalsContact SG-N 3.37Å; C420-T423 PolarHBondContact SG-OG1 3.16Å; T423-A425 VanDerWaalsContact C-N 3.31Å; T423-A425 PolarHBondContact O-N 3.03Å; T423-T427 WeakPolarHBondContact O-CA 3.49Å; T423-T427 VanDerWaalsContact O-CB 3.23Å; T423-T427 WeakPolarHBondContact O-CB 3.44Å; T423-T427 PolarHBondContact O-N 3.11Å; T423-T427 PolarHBondContact O-OG1 3.45Å; T423-L430 HydrophobicContact CG2-CB 4.38Å; T423-L430 HydrophobicContact CG2-CD2 4.2Å; T423-L430 HydrophobicContact CG2-CG 4.4Å; T423-L432 HydrophobicContact CG2-CB 4.47Å; T423-L432 HydrophobicContact CG2-CD1 3.96Å; T423-L432 HydrophobicContact CG2-CG 4.09Å; T423-N451 PolarHBondContact OG1-ND2 3Å; T423-N451 PolarHBondContact OG1-OD1 3.35Å
424	F	96.5	Very high	94.4	Very high	5 Å²	5	23.3 Å²	23.3	2%	0.022	13%	0.129	C	C	.	.	H	α-helix	trans	-59	-44.6	174	179.4	-92.9	0	0	0	111.6	C420 Y422 G429 L430 L431 V470 K473 L480 L484	C420-F424 WeakPolarHBondContact O-CB 3.34Å; C420-F424 PolarHBondContact O-N 3.27Å; C420-F424 VanDerWaalsContact O-N 3.13Å; Y422-F424 VanDerWaalsContact C-N 3.28Å; Y422-F424 PolarHBondContact O-N 3.39Å; F424-G429 WeakPolarHBondContact CD2-O 3.29Å; F424-G429 WeakPolarHBondContact O-CA 3.03Å; F424-G429 PolarHBondContact O-N 3.44Å; F424-L430 WeakPolarHBondContact CA-O 3.36Å; F424-L431 HydrophobicContact CD2-CD2 3.5Å; F424-L431 VanDerWaalsContact CD2-CD2 3.5Å; F424-L431 HydrophobicContact CD2-CG 4.27Å; F424-L431 HydrophobicContact CE2-CD2 3.8Å; F424-L431 HydrophobicContact CE2-CG 4.47Å; F424-V470 HydrophobicContact CD1-CB 4.21Å; F424-V470 HydrophobicContact CD1-CG1 3.98Å; F424-V470 HydrophobicContact CD1-CG2 3.63Å; F424-V470 HydrophobicContact CE1-CB 4.17Å; F424-V470 HydrophobicContact CE1-CG1 3.73Å; F424-V470 HydrophobicContact CE1-CG2 4.09Å; F424-K473 HydrophobicContact CE1-CB 4.23Å; F424-K473 HydrophobicContact CE1-CG 4.2Å; F424-K473 HydrophobicContact CZ-CB 4.47Å; F424-K473 HydrophobicContact CZ-CG 4.05Å; F424-L480 HydrophobicContact CE2-CD1 4.25Å; F424-L480 HydrophobicContact CE2-CD2 4.29Å; F424-L480 HydrophobicContact CZ-CD1 3.82Å; F424-L480 HydrophobicContact CZ-CD2 4.47Å; F424-L484 HydrophobicContact CE1-CD1 4.02Å; F424-L484 HydrophobicContact CE2-CD1 3.99Å; F424-L484 HydrophobicContact CZ-CD1 3.63Å
425	A	95.6	Very high	94.4	Very high	10 Å²	10	21.7 Å²	21.7	8%	0.083	12%	0.121	C	C	.	.	H	α-helix	trans	-69.2	-48.5	178	0	0	0	0	0	113	A421 Y422 T423 Y466 I469 V470	A421-A425 PolarHBondContact O-N 2.86Å; Y422-A425 PolarHBondContact O-N 2.85Å; T423-A425 VanDerWaalsContact C-N 3.31Å; T423-A425 PolarHBondContact O-N 3.03Å; A425-Y466 HydrophobicContact CB-CD1 3.87Å; A425-Y466 HydrophobicContact CB-CG 4.46Å; A425-I469 HydrophobicContact CB-CB 4.19Å; A425-I469 HydrophobicContact CB-CG2 3.9Å; A425-V470 HydrophobicContact CB-CG2 3.94Å
426	A	93.5	Very high	94.3	Very high	55 Å²	55	21.5 Å²	21.5	46%	0.455	12%	0.122	S	C	.	.	H	α-helix	trans	-77.6	-30	-172.5	0	0	0	0	0	113.4	Y422	Y422-A426 HydrophobicContact CD1-CB 4.35Å; Y422-A426 HydrophobicContact CE1-CB 3.93Å; Y422-A426 HydrophobicContact CE2-CB 4.2Å; Y422-A426 WeakPolarHBondContact O-CB 3.35Å; Y422-A426 PolarHBondContact O-N 2.89Å
427	T	91.5	Very high	94.1	Very high	51 Å²	51	22.3 Å²	22.3	31%	0.313	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	39.6	-174.9	-40.2	0	0	0	0	111.5	A248 T423 G429 L430	A248-T427 HydrophobicContact CB-CG2 3.97Å; T423-T427 WeakPolarHBondContact O-CA 3.49Å; T423-T427 VanDerWaalsContact O-CB 3.23Å; T423-T427 WeakPolarHBondContact O-CB 3.44Å; T423-T427 PolarHBondContact O-N 3.11Å; T423-T427 PolarHBondContact O-OG1 3.45Å; T427-G429 VanDerWaalsContact C-N 3.25Å; T427-G429 PolarHBondContact O-N 3.41Å; T427-G429 VanDerWaalsContact O-N 3.11Å; T427-L430 HydrophobicContact CG2-CB 3.93Å; T427-L430 HydrophobicContact CG2-CD2 3.86Å; T427-L430 PolarHBondContact O-N 3.13Å; T427-L430 VanDerWaalsContact O-N 3.14Å
428	D	87.8	Confident	94.1	Very high	59 Å²	59	18.2 Å²	18.2	32%	0.316	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	36.7	168.8	-172.5	33.7	0	0	0	114.4	R254 K263 K473	R254-D428 IonicContact NH2-OD2 3.08Å; R254-D428 PolarHBondContact NH2-OD2 3.49Å; K263-D428 PolarHBondContact NZ-O 3.15Å; K263-D428 IonicContact NZ-OD1 3.92Å; K263-D428 IonicContact NZ-OD2 2.64Å; K263-D428 PolarHBondContact NZ-OD2 3.37Å; D428-K473 WeakPolarHBondContact O-CE 3.41Å; D428-K473 PolarHBondContact O-NZ 3.22Å; D428-K473 IonicContact OD1-NZ 2.56Å; D428-K473 PolarHBondContact OD1-NZ 3.47Å
429	G	92	Very high	94	Very high	1 Å²	1	17.4 Å²	17.4	1%	0.01	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.1	10.8	178.1	0	0	0	0	0	115.9	Y267 F424 T427 L431	Y267-G429 WeakPolarHBondContact CE1-O 3.47Å; Y267-G429 WeakPolarHBondContact OH-CA 3.31Å; Y267-G429 PolarHBondContact OH-O 3.24Å; F424-G429 WeakPolarHBondContact CD2-O 3.29Å; F424-G429 WeakPolarHBondContact O-CA 3.03Å; F424-G429 PolarHBondContact O-N 3.44Å; T427-G429 VanDerWaalsContact C-N 3.25Å; T427-G429 PolarHBondContact O-N 3.41Å; T427-G429 VanDerWaalsContact O-N 3.11Å; G429-L431 PolarHBondContact O-N 3.27Å
430	L	94.3	Very high	94	Very high	10 Å²	10	16.5 Å²	16.5	5%	0.052	10%	0.102	C	C	.	.			trans	-61.3	119.2	175.5	-179.3	59.6	0	0	0	111.5	L244 E245 T423 F424 T427 L432	L244-L430 HydrophobicContact CB-CD1 3.62Å; L244-L430 HydrophobicContact CD1-CD1 4.04Å; L244-L430 HydrophobicContact CG-CD1 4.45Å; E245-L430 HydrophobicContact CG-CD2 4.48Å; T423-L430 HydrophobicContact CG2-CB 4.38Å; T423-L430 HydrophobicContact CG2-CD2 4.2Å; T423-L430 HydrophobicContact CG2-CG 4.4Å; F424-L430 WeakPolarHBondContact CA-O 3.36Å; T427-L430 HydrophobicContact CG2-CB 3.93Å; T427-L430 HydrophobicContact CG2-CD2 3.86Å; T427-L430 PolarHBondContact O-N 3.13Å; T427-L430 VanDerWaalsContact O-N 3.14Å; L430-L432 HydrophobicContact CD2-CD1 4.28Å; L430-L432 HydrophobicContact CD2-CD2 4.38Å; L430-L432 HydrophobicContact CD2-CG 4.14Å; L430-L432 HydrophobicContact CG-CD2 4.29Å; L430-L432 HydrophobicContact CG-CG 4.09Å; L430-L432 PolarHBondContact O-N 2.86Å
431	L	96.1	Very high	93.9	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	10%	0.102	C	C	.	.			trans	-86.3	104.9	175.3	-66.6	174.2	0	0	0	110.7	L266 Y267 R270 F419 F424 G429 L483 L484	L266-L431 HydrophobicContact CD2-CB 4.32Å; Y267-L431 HydrophobicContact CD1-CD1 3.5Å; Y267-L431 VanDerWaalsContact CD1-CD1 3.5Å; Y267-L431 HydrophobicContact CD1-CG 4.17Å; Y267-L431 HydrophobicContact CE1-CD1 3.81Å; Y267-L431 HydrophobicContact CE1-CG 3.95Å; R270-L431 HydrophobicContact CG-CD1 4.34Å; F419-L431 HydrophobicContact CB-CD2 4.21Å; F419-L431 HydrophobicContact CD1-CB 4.12Å; F419-L431 HydrophobicContact CD1-CD2 4.3Å; F419-L431 HydrophobicContact CD2-CD2 3.81Å; F419-L431 HydrophobicContact CE1-CB 4.18Å; F419-L431 HydrophobicContact CE2-CD1 4.47Å; F419-L431 HydrophobicContact CE2-CD2 4.28Å; F419-L431 HydrophobicContact CG-CD2 3.85Å; F419-L431 HydrophobicContact CZ-CD1 4.49Å; F424-L431 HydrophobicContact CD2-CD2 3.5Å; F424-L431 VanDerWaalsContact CD2-CD2 3.5Å; F424-L431 HydrophobicContact CD2-CG 4.27Å; F424-L431 HydrophobicContact CE2-CD2 3.8Å; F424-L431 HydrophobicContact CE2-CG 4.47Å; G429-L431 PolarHBondContact O-N 3.27Å; L431-L483 HydrophobicContact CD1-CD2 3.83Å; L431-L484 HydrophobicContact CD2-CD2 3.91Å
432	L	95.4	Very high	93.8	Very high	18 Å²	18	18 Å²	18	9%	0.094	11%	0.108	C	C	.	.			trans	-112.5	141.7	166.3	-64.6	-169.3	0	0	0	110.3	T241 E245 F419 C420 T423 L430 G434 N451	T241-L432 HydrophobicContact CG2-CD2 3.26Å; E245-L432 HydrophobicContact CG-CD1 4.47Å; E245-L432 HydrophobicContact CG-CD2 4.03Å; F419-L432 WeakPolarHBondContact CA-O 3.38Å; C420-L432 PolarHBondContact N-O 3.35Å; T423-L432 HydrophobicContact CG2-CB 4.47Å; T423-L432 HydrophobicContact CG2-CD1 3.96Å; T423-L432 HydrophobicContact CG2-CG 4.09Å; L430-L432 HydrophobicContact CD2-CD1 4.28Å; L430-L432 HydrophobicContact CD2-CD2 4.38Å; L430-L432 HydrophobicContact CD2-CG 4.14Å; L430-L432 HydrophobicContact CG-CD2 4.29Å; L430-L432 HydrophobicContact CG-CG 4.09Å; L430-L432 PolarHBondContact O-N 2.86Å; L432-G434 PolarHBondContact O-N 3.42Å; L432-N451 WeakPolarHBondContact CD1-ND2 3.39Å
433	P	95.4	Very high	93.7	Very high	12 Å²	12	17.8 Å²	17.8	8%	0.078	11%	0.108	C	C	.	.	B	Isolated β-bridge	trans	-62.3	135.7	174.1	29.1	-36.4	0	0	0	109.9	D378 R381 M382	D378-P433 HydrophobicContact CB-CB 4.21Å; D378-P433 HydrophobicContact CB-CG 3.85Å; R381-P433 HydrophobicContact CB-CG 3.97Å; M382-P433 HydrophobicContact CG-CB 4.13Å; M382-P433 HydrophobicContact CG-CG 4.34Å; M382-P433 HydrophobicContact SD-CB 4.41Å
434	G	93.8	Very high	93.4	Very high	3 Å²	3	24.1 Å²	24.1	3%	0.031	13%	0.134	C	C	.	.			trans	-80.2	155	167.1	0	0	0	0	0	111.2	M382 G418 L432 P436	M382-G434 WeakPolarHBondContact CE-O 3.43Å; G418-G434 WeakPolarHBondContact O-CA 3.35Å; G418-G434 PolarHBondContact O-N 2.97Å; L432-G434 PolarHBondContact O-N 3.42Å; G434-P436 WeakPolarHBondContact O-CD 3.41Å
435	N	93.6	Very high	93	Very high	4 Å²	4	28.6 Å²	28.6	2%	0.021	16%	0.155	C	C	.	.			trans	-109	104.5	174.3	179.7	9.6	0	0	0	109.5	M382 A437 I438 T449 F450	M382-N435 HydrophobicContact CB-CB 4.33Å; M382-N435 PolarHBondContact O-ND2 2.92Å; N435-A437 PolarHBondContact O-N 2.98Å; N435-A437 VanDerWaalsContact O-N 3.09Å; N435-A437 VanDerWaalsContact OD1-CB 3.22Å; N435-A437 WeakPolarHBondContact OD1-CB 3.46Å; N435-A437 PolarHBondContact OD1-N 3.42Å; N435-I438 HydrophobicContact CB-CD1 3.96Å; N435-I438 HydrophobicContact CB-CG1 4.1Å; N435-I438 PolarHBondContact O-N 2.86Å; N435-I438 VanDerWaalsContact O-N 3.17Å; N435-T449 VanDerWaalsContact C-OG1 3.29Å; N435-T449 PolarHBondContact N-OG1 2.78Å; N435-T449 PolarHBondContact O-OG1 3.07Å; N435-F450 PolarHBondContact N-O 3.45Å
436	P	92.3	Very high	92.8	Very high	28 Å²	28	30.5 Å²	30.5	18%	0.182	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-55.2	-25.6	175.2	-29	37.3	0	0	0	114.5	F409 I414 G434 I438 G439 I440	F409-P436 HydrophobicContact CE1-CB 3.77Å; F409-P436 HydrophobicContact CZ-CB 3.73Å; I414-P436 HydrophobicContact CD1-CG 3.94Å; G434-P436 WeakPolarHBondContact O-CD 3.41Å; P436-I438 VanDerWaalsContact C-N 3.26Å; P436-I438 PolarHBondContact O-N 3.35Å; P436-G439 PolarHBondContact O-N 3.35Å; P436-G439 VanDerWaalsContact O-N 3.09Å; P436-I440 HydrophobicContact CB-CD1 4.12Å; P436-I440 HydrophobicContact CB-CG1 4.11Å
437	A	90.1	Very high	92.8	Very high	23 Å²	23	28.5 Å²	28.5	19%	0.19	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-67.3	-23.1	-179.4	0	0	0	0	0	113.8	N435 G439	N435-A437 PolarHBondContact O-N 2.98Å; N435-A437 VanDerWaalsContact O-N 3.09Å; N435-A437 VanDerWaalsContact OD1-CB 3.22Å; N435-A437 WeakPolarHBondContact OD1-CB 3.46Å; N435-A437 PolarHBondContact OD1-N 3.42Å; A437-G439 PolarHBondContact O-N 3.16Å
438	I	92	Very high	93.1	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-65.1	-31.6	173.2	-66.9	176.8	0	0	0	110.7	H385 V390 F402 N435 P436 N451 A456	H385-I438 HydrophobicContact CB-CD1 3.99Å; V390-I438 HydrophobicContact CG2-CG2 3.9Å; V390-I438 PolarHBondContact N-O 3.4Å; F402-I438 WeakPolarHBondContact CE1-O 3.4Å; N435-I438 HydrophobicContact CB-CD1 3.96Å; N435-I438 HydrophobicContact CB-CG1 4.1Å; N435-I438 PolarHBondContact O-N 2.86Å; N435-I438 VanDerWaalsContact O-N 3.17Å; P436-I438 VanDerWaalsContact C-N 3.26Å; P436-I438 PolarHBondContact O-N 3.35Å; I438-N451 WeakPolarHBondContact CD1-O 3.43Å; I438-A456 HydrophobicContact CG2-CB 4.25Å
439	G	92.5	Very high	93.4	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.114	C	C	.	.			trans	131.5	133.4	-175.3	0	0	0	0	0	110.6	P436 A437	P436-G439 PolarHBondContact O-N 3.35Å; P436-G439 VanDerWaalsContact O-N 3.09Å; A437-G439 PolarHBondContact O-N 3.16Å
440	I	95	Very high	93.6	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	122.5	172.1	-63.6	178.2	0	0	0	108.2	W400 L401 F409 L412 I414 P436 Y447 Y448	W400-I440 WeakPolarHBondContact CA-O 3.26Å; L401-I440 HydrophobicContact CB-CB 4.29Å; L401-I440 PolarHBondContact N-O 3.11Å; L401-I440 PolarHBondContact O-N 3.4Å; F409-I440 HydrophobicContact CD2-CD1 4.28Å; F409-I440 HydrophobicContact CE1-CD1 4.19Å; F409-I440 HydrophobicContact CE2-CD1 3.52Å; F409-I440 HydrophobicContact CE2-CG1 3.97Å; F409-I440 HydrophobicContact CZ-CD1 3.47Å; F409-I440 VanDerWaalsContact CZ-CD1 3.47Å; F409-I440 HydrophobicContact CZ-CG1 3.87Å; L412-I440 HydrophobicContact CD1-CD1 4.12Å; I414-I440 HydrophobicContact CD1-CD1 3.84Å; I414-I440 HydrophobicContact CG1-CD1 4.23Å; P436-I440 HydrophobicContact CB-CD1 4.12Å; P436-I440 HydrophobicContact CB-CG1 4.11Å; I440-Y447 HydrophobicContact CG2-CD1 4.16Å; I440-Y447 HydrophobicContact CG2-CG 4.37Å; I440-Y448 WeakPolarHBondContact CA-O 3.38Å
441	L	96	Very high	93.6	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	121.9	173.7	175.5	63	0	0	0	109.6	L398 W400 Y447 Y448 F450 F459 P463	L398-L441 HydrophobicContact CB-CD1 3.76Å; L398-L441 HydrophobicContact CD1-CD1 4Å; L398-L441 HydrophobicContact CD2-CD1 4.38Å; L398-L441 HydrophobicContact CG-CD1 4.26Å; W400-L441 HydrophobicContact CD2-CB 4.47Å; W400-L441 HydrophobicContact CD2-CD1 4.26Å; W400-L441 HydrophobicContact CE3-CB 4.04Å; W400-L441 HydrophobicContact CH2-CB 3.86Å; W400-L441 HydrophobicContact CH2-CD1 4.43Å; W400-L441 HydrophobicContact CH2-CG 4.49Å; W400-L441 HydrophobicContact CZ2-CB 4.3Å; W400-L441 HydrophobicContact CZ2-CD1 4.01Å; W400-L441 HydrophobicContact CZ3-CB 3.72Å; L441-Y447 WeakPolarHBondContact O-CA 3.41Å; L441-Y448 PolarHBondContact N-O 3.11Å; L441-Y448 PolarHBondContact O-N 2.79Å; L441-F450 HydrophobicContact CB-CE2 3.79Å; L441-F450 HydrophobicContact CB-CZ 4.06Å; L441-F450 HydrophobicContact CD2-CZ 4.19Å; L441-F459 HydrophobicContact CD2-CD1 3.61Å; L441-F459 HydrophobicContact CD2-CE1 3.76Å; L441-P463 HydrophobicContact CD2-CG 4.47Å
442	K	94.5	Very high	93.5	Very high	32 Å²	32	25.2 Å²	25.2	14%	0.139	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	118.5	167.6	-177.6	-170.3	171.3	-159.8	0	109.4	E399 E445 K446 Y447	E399-K442 HydrophobicContact CB-CB 4.22Å; E399-K442 HydrophobicContact CB-CD 4.45Å; E399-K442 HydrophobicContact CG-CD 4.3Å; E399-K442 PolarHBondContact O-N 2.85Å; E399-K442 IonicContact OE1-NZ 2.72Å; E399-K442 VanDerWaalsContact OE2-CD 3.29Å; E399-K442 WeakPolarHBondContact OE2-CD 3.36Å; E399-K442 IonicContact OE2-NZ 3.33Å; E399-K442 PolarHBondContact OE2-NZ 3.31Å; K442-E445 WeakPolarHBondContact CE-OE1 3.23Å; K442-E445 IonicContact NZ-OE1 2.92Å; K442-E445 PolarHBondContact NZ-OE1 2.95Å; K442-K446 CarbonylContact C-O 3.49Å; K442-K446 WeakPolarHBondContact CA-O 3.35Å; K442-Y447 HydrophobicContact CB-CD1 4.01Å; K442-Y447 HydrophobicContact CB-CE1 3.94Å; K442-Y447 HydrophobicContact CD-CE1 3.87Å; K442-Y447 HydrophobicContact CG-CD1 4.09Å; K442-Y447 HydrophobicContact CG-CE1 3.62Å
443	Y	93.4	Very high	93.4	Very high	49 Å²	49	27.7 Å²	27.7	19%	0.192	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	122	178.9	-173	-99.4	0	0	0	110.1	L398 E445 K446 P463 E464 I467	L398-Y443 HydrophobicContact CD2-CD2 3.92Å; L398-Y443 HydrophobicContact CD2-CE2 4.29Å; Y443-E445 VanDerWaalsContact C-N 3.35Å; Y443-E445 PolarHBondContact O-N 2.95Å; Y443-K446 PolarHBondContact N-O 3.33Å; Y443-K446 WeakPolarHBondContact O-CB 3.23Å; Y443-K446 PolarHBondContact O-N 3.27Å; Y443-P463 HydrophobicContact CD1-CB 3.94Å; Y443-P463 HydrophobicContact CD2-CB 4.03Å; Y443-P463 HydrophobicContact CD2-CG 4.04Å; Y443-P463 HydrophobicContact CE1-CB 3.94Å; Y443-P463 HydrophobicContact CE2-CB 4.03Å; Y443-P463 HydrophobicContact CE2-CG 4.03Å; Y443-P463 HydrophobicContact CG-CB 3.99Å; Y443-P463 HydrophobicContact CG-CG 4.44Å; Y443-E464 HydrophobicContact CE1-CG 4.16Å; Y443-E464 VanDerWaalsContact CE1-OE1 3.25Å; Y443-E464 WeakPolarHBondContact CE1-OE1 3.44Å; Y443-E464 VanDerWaalsContact OH-CG 3.27Å; Y443-E464 WeakPolarHBondContact OH-CG 3.36Å; Y443-E464 PolarHBondContact OH-OE1 3.22Å; Y443-I467 HydrophobicContact CD1-CD1 3.8Å; Y443-I467 HydrophobicContact CE1-CD1 4.08Å
444	K	89.7	Confident	93.3	Very high	147 Å²	147	33 Å²	33	64%	0.639	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.1	49.6	-174.6	-67.2	-178.1	165.9	178.9	0	113.4	K446 E464	K444-K446 PolarHBondContact O-N 3.46Å; K444-K446 VanDerWaalsContact O-N 3.09Å; K444-E464 WeakPolarHBondContact CD-OE1 3.47Å; K444-E464 WeakPolarHBondContact CE-OE1 3.43Å; K444-E464 IonicContact NZ-OE1 3.89Å; K444-E464 PolarHBondContact NZ-OE1 3.44Å; K444-E464 IonicContact NZ-OE2 2.67Å
445	E	87.8	Confident	93.4	Very high	98 Å²	98	33 Å²	33	46%	0.458	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	15	-177.6	-59.6	-60.1	118	0	0	115.3	K442 Y443	K442-E445 WeakPolarHBondContact CE-OE1 3.23Å; K442-E445 IonicContact NZ-OE1 2.92Å; K442-E445 PolarHBondContact NZ-OE1 2.95Å; Y443-E445 VanDerWaalsContact C-N 3.35Å; Y443-E445 PolarHBondContact O-N 2.95Å
446	K	91.4	Very high	93.5	Very high	50 Å²	50	32.8 Å²	32.8	22%	0.217	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	148.1	173.8	-68.3	-179.6	176.7	-175.2	0	110.7	Q415 K442 Y443 K444 Y448	Q415-K446 HydrophobicContact CG-CB 3.81Å; Q415-K446 HydrophobicContact CG-CD 4.28Å; Q415-K446 HydrophobicContact CG-CG 4.27Å; K442-K446 CarbonylContact C-O 3.49Å; K442-K446 WeakPolarHBondContact CA-O 3.35Å; Y443-K446 PolarHBondContact N-O 3.33Å; Y443-K446 WeakPolarHBondContact O-CB 3.23Å; Y443-K446 PolarHBondContact O-N 3.27Å; K444-K446 PolarHBondContact O-N 3.46Å; K444-K446 VanDerWaalsContact O-N 3.09Å; K446-Y448 HydrophobicContact CB-CE2 3.67Å; K446-Y448 WeakPolarHBondContact CD-OH 3.49Å
447	Y	94.6	Very high	93.7	Very high	13 Å²	13	33.5 Å²	33.5	5%	0.051	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	127.4	-174.4	-54.7	-72.2	0	0	0	110.8	L401 L413 Q415 I440 L441 K442 P509	L401-Y447 HydrophobicContact CD1-CD1 3.76Å; L401-Y447 HydrophobicContact CD1-CE1 3.61Å; L413-Y447 WeakPolarHBondContact O-CD2 3.37Å; Q415-Y447 WeakPolarHBondContact CB-O 3.49Å; Q415-Y447 WeakPolarHBondContact CG-O 3.34Å; Q415-Y447 PolarHBondContact N-O 2.98Å; I440-Y447 HydrophobicContact CG2-CD1 4.16Å; I440-Y447 HydrophobicContact CG2-CG 4.37Å; L441-Y447 WeakPolarHBondContact O-CA 3.41Å; K442-Y447 HydrophobicContact CB-CD1 4.01Å; K442-Y447 HydrophobicContact CB-CE1 3.94Å; K442-Y447 HydrophobicContact CD-CE1 3.87Å; K442-Y447 HydrophobicContact CG-CD1 4.09Å; K442-Y447 HydrophobicContact CG-CE1 3.62Å; Y447-P509 HydrophobicContact CE1-CG 4.31Å; Y447-P509 WeakPolarHBondContact OH-CD 3.46Å
448	Y	96.7	Very high	93.9	Very high	4 Å²	4	34 Å²	34	2%	0.016	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	145.4	-177.5	-56.2	-87.4	0	0	0	111	Q415 Y416 A421 I440 L441 K446 F459 I467	Q415-Y448 HydrophobicContact CB-CD1 3.89Å; Q415-Y448 HydrophobicContact CB-CE1 3.77Å; Q415-Y448 HydrophobicContact CG-CD1 4.23Å; Q415-Y448 HydrophobicContact CG-CE1 3.79Å; Y416-Y448 HydrophobicContact CD2-CD1 4.19Å; Y416-Y448 HydrophobicContact CD2-CE1 4.43Å; Y416-Y448 AromaticContact CE2-CD1 3.63Å; Y416-Y448 HydrophobicContact CE2-CD1 3.63Å; Y416-Y448 AromaticContact CE2-CE1 3.59Å; Y416-Y448 HydrophobicContact CE2-CE1 3.59Å; Y416-Y448 AromaticContact CZ-CE1 3.84Å; A421-Y448 HydrophobicContact CB-CD1 4.1Å; I440-Y448 WeakPolarHBondContact CA-O 3.38Å; L441-Y448 PolarHBondContact N-O 3.11Å; L441-Y448 PolarHBondContact O-N 2.79Å; K446-Y448 HydrophobicContact CB-CE2 3.67Å; K446-Y448 WeakPolarHBondContact CD-OH 3.49Å; Y448-F459 HydrophobicContact CD1-CZ 4.21Å; Y448-F459 HydrophobicContact CD2-CE1 4.39Å; Y448-F459 HydrophobicContact CG-CE1 4.28Å; Y448-F459 HydrophobicContact CG-CZ 4.2Å; Y448-I467 HydrophobicContact CE1-CD1 4.46Å; Y448-I467 HydrophobicContact CE1-CG1 4.33Å; Y448-I467 HydrophobicContact CE2-CD1 4.29Å
449	T	95.4	Very high	94.2	Very high	2 Å²	2	34 Å²	34	1%	0.012	16%	0.161	C	C	.	.	B	Isolated β-bridge	trans	-124.6	162.6	178.5	-172.4	0	0	0	0	111.2	I414 G418 C420 A421 N435	I414-T449 HydrophobicContact CG2-CG2 3.69Å; G418-T449 WeakPolarHBondContact O-CG2 3.39Å; C420-T449 WeakPolarHBondContact CA-O 3.5Å; A421-T449 PolarHBondContact N-O 3.4Å; N435-T449 VanDerWaalsContact C-OG1 3.29Å; N435-T449 PolarHBondContact N-OG1 2.78Å; N435-T449 PolarHBondContact O-OG1 3.07Å
450	F	96.3	Very high	94.3	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.164	C	C	.	.			trans	-139.7	151.6	-171	-48.6	-77.4	0	0	0	111	W400 A421 N435 L441 A455 A456 F459	W400-F450 HydrophobicContact CH2-CD2 4.39Å; W400-F450 AromaticContact CH2-CE2 3.86Å; W400-F450 HydrophobicContact CH2-CE2 3.86Å; W400-F450 HydrophobicContact CZ3-CD2 4.22Å; W400-F450 AromaticContact CZ3-CE2 3.83Å; W400-F450 HydrophobicContact CZ3-CE2 3.83Å; A421-F450 HydrophobicContact CB-CE1 4.19Å; N435-F450 PolarHBondContact N-O 3.45Å; L441-F450 HydrophobicContact CB-CE2 3.79Å; L441-F450 HydrophobicContact CB-CZ 4.06Å; L441-F450 HydrophobicContact CD2-CZ 4.19Å; F450-A455 HydrophobicContact CB-CB 4.27Å; F450-A456 HydrophobicContact CB-CB 3.88Å; F450-A456 HydrophobicContact CD1-CB 4.46Å; F450-A456 HydrophobicContact CD2-CB 3.43Å; F450-A456 VanDerWaalsContact CD2-CB 3.43Å; F450-A456 HydrophobicContact CE2-CB 4.09Å; F450-A456 VanDerWaalsContact CG-CA 3.48Å; F450-A456 HydrophobicContact CG-CB 3.64Å; F450-F459 HydrophobicContact CD1-CB 4.18Å; F450-F459 HydrophobicContact CD1-CG 4.49Å; F450-F459 HydrophobicContact CE1-CB 3.42Å; F450-F459 VanDerWaalsContact CE1-CB 3.42Å; F450-F459 AromaticContact CE1-CD1 3.63Å; F450-F459 HydrophobicContact CE1-CD1 3.63Å; F450-F459 AromaticContact CE1-CD2 3.93Å; F450-F459 HydrophobicContact CE1-CD2 3.93Å; F450-F459 HydrophobicContact CE1-CE1 4.32Å; F450-F459 AromaticContact CE1-CG 3.39Å; F450-F459 HydrophobicContact CE1-CG 3.39Å; F450-F459 HydrophobicContact CZ-CB 3.95Å; F450-F459 AromaticContact CZ-CD1 3.52Å; F450-F459 HydrophobicContact CZ-CD1 3.52Å; F450-F459 HydrophobicContact CZ-CE1 4.12Å; F450-F459 AromaticContact CZ-CG 3.8Å; F450-F459 HydrophobicContact CZ-CG 3.8Å
451	N	93.9	Very high	94.3	Very high	25 Å²	25	41.2 Å²	41.2	13%	0.134	20%	0.196	C	C	.	.	S	Bend	trans	-84.3	-23.3	179.2	58.3	5.5	0	0	0	113.5	H385 C420 T423 L432 I438 A455	H385-N451 PolarHBondContact CD2-O 3.36Å; H385-N451 VanDerWaalsContact CD2-O 3.22Å; C420-N451 HydrophobicContact CB-CB 4.05Å; C420-N451 PolarHBondContact SG-N 2.91Å; C420-N451 VanDerWaalsContact SG-N 3.4Å; T423-N451 PolarHBondContact OG1-ND2 3Å; T423-N451 PolarHBondContact OG1-OD1 3.35Å; L432-N451 WeakPolarHBondContact CD1-ND2 3.39Å; I438-N451 WeakPolarHBondContact CD1-O 3.43Å; N451-A455 WeakPolarHBondContact OD1-CB 3.31Å
452	S	93.7	Very high	94.2	Very high	22 Å²	22	45 Å²	45	15%	0.154	22%	0.217	C	C	.	.	S	Bend	trans	-141.5	161.9	178.3	74.3	0	0	0	0	110.9	D454 A455 A456	S452-D454 VanDerWaalsContact C-N 3.32Å; S452-A455 PolarHBondContact O-N 3.24Å; S452-A455 WeakPolarHBondContact OG-CB 3.46Å; S452-A455 PolarHBondContact OG-N 3.25Å; S452-A455 VanDerWaalsContact OG-N 3.16Å; S452-A456 PolarHBondContact O-N 2.8Å; S452-A456 VanDerWaalsContact O-N 3.11Å
453	K	93.8	Very high	94.3	Very high	69 Å²	69	44 Å²	44	30%	0.3	21%	0.214	S	C	.	.	H	α-helix	trans	-61.9	-40.1	174.1	-178.4	179.2	178.3	176.4	0	112	D388 R389 A455 A456 Y457	D388-K453 HydrophobicContact CB-CB 3.88Å; D388-K453 HydrophobicContact CB-CD 4.37Å; R389-K453 WeakPolarHBondContact O-CE 3.47Å; R389-K453 PolarHBondContact O-NZ 3.2Å; K453-A455 VanDerWaalsContact C-N 3.34Å; K453-A455 PolarHBondContact O-N 2.69Å; K453-A456 WeakPolarHBondContact O-CB 3.47Å; K453-A456 PolarHBondContact O-N 3.07Å; K453-A456 VanDerWaalsContact O-N 3.15Å; K453-Y457 HydrophobicContact CD-CE2 4.2Å; K453-Y457 VanDerWaalsContact CE-CZ 3.45Å; K453-Y457 WeakPolarHBondContact CE-OH 3.36Å; K453-Y457 HydrophobicContact CG-CD2 3.87Å; K453-Y457 HydrophobicContact CG-CE2 3.53Å; K453-Y457 WeakPolarHBondContact O-CD2 3.43Å; K453-Y457 PolarHBondContact O-N 3.29Å
454	D	93.5	Very high	94.3	Very high	124 Å²	124	44 Å²	44	66%	0.663	22%	0.215	S	C	*	.	H	α-helix	trans	-62.6	-42	178.2	-63.4	-29	0	0	0	111.8	S452 A456 Y457 S458	S452-D454 VanDerWaalsContact C-N 3.32Å; D454-A456 VanDerWaalsContact C-N 3.31Å; D454-A456 PolarHBondContact O-N 2.63Å; D454-Y457 PolarHBondContact O-N 2.9Å; D454-S458 WeakPolarHBondContact O-CB 3.38Å; D454-S458 PolarHBondContact O-N 2.95Å; D454-S458 PolarHBondContact O-OG 3.25Å
455	A	95.1	Very high	94.7	Very high	2 Å²	2	41.6 Å²	41.6	2%	0.017	21%	0.206	C	C	.	.	H	α-helix	trans	-61.4	-40.6	174.5	0	0	0	0	0	111.8	Y422 F450 N451 S452 K453 F459	Y422-A455 WeakPolarHBondContact CB-O 3.42Å; Y422-A455 HydrophobicContact CD1-CB 3.49Å; Y422-A455 VanDerWaalsContact CD1-CB 3.49Å; Y422-A455 HydrophobicContact CE1-CB 4.3Å; Y422-A455 HydrophobicContact CG-CB 3.95Å; F450-A455 HydrophobicContact CB-CB 4.27Å; N451-A455 WeakPolarHBondContact OD1-CB 3.31Å; S452-A455 PolarHBondContact O-N 3.24Å; S452-A455 WeakPolarHBondContact OG-CB 3.46Å; S452-A455 PolarHBondContact OG-N 3.25Å; S452-A455 VanDerWaalsContact OG-N 3.16Å; K453-A455 VanDerWaalsContact C-N 3.34Å; K453-A455 PolarHBondContact O-N 2.69Å; A455-F459 WeakPolarHBondContact O-CB 3.37Å; A455-F459 PolarHBondContact O-N 3.39Å
456	A	95.7	Very high	95	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-63.8	-43	175.6	0	0	0	0	0	112	V390 W400 I438 F450 S452 K453 D454 A460	V390-A456 HydrophobicContact CG2-CB 3.65Å; W400-A456 HydrophobicContact CH2-CB 3.91Å; W400-A456 HydrophobicContact CZ3-CB 4.32Å; I438-A456 HydrophobicContact CG2-CB 4.25Å; F450-A456 HydrophobicContact CB-CB 3.88Å; F450-A456 HydrophobicContact CD1-CB 4.46Å; F450-A456 HydrophobicContact CD2-CB 3.43Å; F450-A456 VanDerWaalsContact CD2-CB 3.43Å; F450-A456 HydrophobicContact CE2-CB 4.09Å; F450-A456 VanDerWaalsContact CG-CA 3.48Å; F450-A456 HydrophobicContact CG-CB 3.64Å; S452-A456 PolarHBondContact O-N 2.8Å; S452-A456 VanDerWaalsContact O-N 3.11Å; K453-A456 WeakPolarHBondContact O-CB 3.47Å; K453-A456 PolarHBondContact O-N 3.07Å; K453-A456 VanDerWaalsContact O-N 3.15Å; D454-A456 VanDerWaalsContact C-N 3.31Å; D454-A456 PolarHBondContact O-N 2.63Å; A456-A460 WeakPolarHBondContact O-CB 3.48Å; A456-A460 PolarHBondContact O-N 3.1Å
457	Y	95.7	Very high	95.2	Very high	44 Å²	44	36.9 Å²	36.9	17%	0.173	18%	0.183	C	C	.	.	H	α-helix	trans	-68.6	-48.7	-179.9	-83.4	-131.8	0	0	0	111.1	V390 N391 D394 F395 K453 D454 F459 A460 E461	V390-Y457 HydrophobicContact CB-CE2 4.13Å; V390-Y457 HydrophobicContact CG1-CD2 4.43Å; V390-Y457 HydrophobicContact CG1-CE2 3.78Å; V390-Y457 HydrophobicContact CG2-CD2 4.27Å; V390-Y457 HydrophobicContact CG2-CE2 3.95Å; N391-Y457 PolarHBondContact N-OH 2.93Å; D394-Y457 HydrophobicContact CB-CE1 4.48Å; D394-Y457 WeakPolarHBondContact OD2-CE1 3.28Å; D394-Y457 PolarHBondContact OD2-OH 3.35Å; F395-Y457 AromaticContact CE2-CD1 3.81Å; F395-Y457 HydrophobicContact CE2-CD1 3.81Å; F395-Y457 AromaticContact CE2-CD2 3.97Å; F395-Y457 HydrophobicContact CE2-CD2 3.97Å; F395-Y457 HydrophobicContact CE2-CE1 4.02Å; F395-Y457 HydrophobicContact CE2-CE2 4.19Å; F395-Y457 AromaticContact CE2-CG 3.8Å; F395-Y457 HydrophobicContact CE2-CG 3.8Å; F395-Y457 AromaticContact CZ-CD1 3.92Å; F395-Y457 HydrophobicContact CZ-CD1 3.92Å; F395-Y457 AromaticContact CZ-CG 3.95Å; F395-Y457 HydrophobicContact CZ-CG 3.95Å; K453-Y457 HydrophobicContact CD-CE2 4.2Å; K453-Y457 VanDerWaalsContact CE-CZ 3.45Å; K453-Y457 WeakPolarHBondContact CE-OH 3.36Å; K453-Y457 HydrophobicContact CG-CD2 3.87Å; K453-Y457 HydrophobicContact CG-CE2 3.53Å; K453-Y457 WeakPolarHBondContact O-CD2 3.43Å; K453-Y457 PolarHBondContact O-N 3.29Å; D454-Y457 PolarHBondContact O-N 2.9Å; Y457-F459 VanDerWaalsContact C-N 3.29Å; Y457-F459 PolarHBondContact O-N 3.42Å; Y457-A460 PolarHBondContact O-N 3.43Å; Y457-A460 VanDerWaalsContact O-N 3.09Å; Y457-E461 WeakPolarHBondContact O-CG 3.34Å; Y457-E461 PolarHBondContact O-N 3.46Å
458	S	95.7	Very high	95.2	Very high	32 Å²	32	39.2 Å²	39.2	22%	0.224	20%	0.197	C	C	.	.	H	α-helix	trans	-58.4	-42.9	177.6	-67.7	0	0	0	0	111.5	D454 E461 Y466	D454-S458 WeakPolarHBondContact O-CB 3.38Å; D454-S458 PolarHBondContact O-N 2.95Å; D454-S458 PolarHBondContact O-OG 3.25Å; S458-E461 PolarHBondContact O-N 3Å; S458-Y466 WeakPolarHBondContact O-CE2 3.38Å
459	F	97	Very high	95.1	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-65.4	-41.4	175	-171.1	-86.6	0	0	0	112.6	A421 Y422 L441 Y448 F450 A455 Y457 E461 N462 P463 Y466 I467	A421-F459 HydrophobicContact CB-CD2 4.12Å; A421-F459 HydrophobicContact CB-CE2 3.7Å; A421-F459 HydrophobicContact CB-CZ 4.18Å; Y422-F459 HydrophobicContact CD2-CB 4.33Å; L441-F459 HydrophobicContact CD2-CD1 3.61Å; L441-F459 HydrophobicContact CD2-CE1 3.76Å; Y448-F459 HydrophobicContact CD1-CZ 4.21Å; Y448-F459 HydrophobicContact CD2-CE1 4.39Å; Y448-F459 HydrophobicContact CG-CE1 4.28Å; Y448-F459 HydrophobicContact CG-CZ 4.2Å; F450-F459 HydrophobicContact CD1-CB 4.18Å; F450-F459 HydrophobicContact CD1-CG 4.49Å; F450-F459 HydrophobicContact CE1-CB 3.42Å; F450-F459 VanDerWaalsContact CE1-CB 3.42Å; F450-F459 AromaticContact CE1-CD1 3.63Å; F450-F459 HydrophobicContact CE1-CD1 3.63Å; F450-F459 AromaticContact CE1-CD2 3.93Å; F450-F459 HydrophobicContact CE1-CD2 3.93Å; F450-F459 HydrophobicContact CE1-CE1 4.32Å; F450-F459 AromaticContact CE1-CG 3.39Å; F450-F459 HydrophobicContact CE1-CG 3.39Å; F450-F459 HydrophobicContact CZ-CB 3.95Å; F450-F459 AromaticContact CZ-CD1 3.52Å; F450-F459 HydrophobicContact CZ-CD1 3.52Å; F450-F459 HydrophobicContact CZ-CE1 4.12Å; F450-F459 AromaticContact CZ-CG 3.8Å; F450-F459 HydrophobicContact CZ-CG 3.8Å; A455-F459 WeakPolarHBondContact O-CB 3.37Å; A455-F459 PolarHBondContact O-N 3.39Å; Y457-F459 VanDerWaalsContact C-N 3.29Å; Y457-F459 PolarHBondContact O-N 3.42Å; F459-E461 VanDerWaalsContact C-N 3.27Å; F459-E461 PolarHBondContact O-N 3.02Å; F459-N462 CarbonylContact O-C 3.51Å; F459-N462 VanDerWaalsContact O-C 3.22Å; F459-N462 PolarHBondContact O-N 3.2Å; F459-P463 HydrophobicContact CD1-CB 4.18Å; F459-P463 HydrophobicContact CD1-CG 4.44Å; F459-P463 HydrophobicContact CE1-CB 3.74Å; F459-P463 HydrophobicContact CE1-CG 4.41Å; F459-P463 HydrophobicContact CZ-CB 4.31Å; F459-P463 VanDerWaalsContact O-CA 3.29Å; F459-P463 WeakPolarHBondContact O-CA 3.28Å; F459-P463 VanDerWaalsContact O-CD 3.24Å; F459-P463 WeakPolarHBondContact O-CD 3.34Å; F459-P463 WeakPolarHBondContact O-CG 3.38Å; F459-Y466 HydrophobicContact CB-CD2 4.41Å; F459-Y466 AromaticContact CD2-CD2 3.94Å; F459-Y466 HydrophobicContact CD2-CD2 3.94Å; F459-Y466 AromaticContact CD2-CG 3.94Å; F459-Y466 HydrophobicContact CD2-CG 3.94Å; F459-Y466 HydrophobicContact CE2-CG 4.43Å; F459-Y466 HydrophobicContact CG-CD2 4.34Å; F459-I467 HydrophobicContact CE2-CG1 4.31Å; F459-I467 HydrophobicContact CZ-CD1 4.13Å; F459-I467 HydrophobicContact CZ-CG1 3.8Å
460	A	95.6	Very high	95.1	Very high	6 Å²	6	41.6 Å²	41.6	5%	0.05	21%	0.209	C	C	.	.	H	α-helix	trans	-66.4	-26.4	-179.1	0	0	0	0	0	113.6	F395 L398 W400 A456 Y457	F395-A460 HydrophobicContact CD1-CB 3.85Å; F395-A460 HydrophobicContact CD2-CB 4.28Å; F395-A460 HydrophobicContact CE1-CB 3.6Å; F395-A460 HydrophobicContact CE2-CB 4.05Å; F395-A460 HydrophobicContact CG-CB 4.18Å; F395-A460 HydrophobicContact CZ-CB 3.72Å; L398-A460 HydrophobicContact CD1-CB 3.78Å; L398-A460 WeakPolarHBondContact CD1-O 3.34Å; W400-A460 HydrophobicContact CH2-CB 4.4Å; W400-A460 HydrophobicContact CZ2-CB 3.76Å; A456-A460 WeakPolarHBondContact O-CB 3.48Å; A456-A460 PolarHBondContact O-N 3.1Å; Y457-A460 PolarHBondContact O-N 3.43Å; Y457-A460 VanDerWaalsContact O-N 3.09Å
461	E	94.9	Very high	94.8	Very high	146 Å²	146	44.9 Å²	44.9	68%	0.682	22%	0.222	S	C	*	.	H	α-helix	trans	-63.9	-39.6	172.6	-73.7	177.2	-178.6	0	0	112.5	F395 Y457 S458 F459	F395-E461 HydrophobicContact CE1-CG 4.44Å; Y457-E461 WeakPolarHBondContact O-CG 3.34Å; Y457-E461 PolarHBondContact O-N 3.46Å; S458-E461 PolarHBondContact O-N 3Å; F459-E461 VanDerWaalsContact C-N 3.27Å; F459-E461 PolarHBondContact O-N 3.02Å
462	N	94.4	Very high	94.7	Very high	80 Å²	80	47.5 Å²	47.5	43%	0.428	23%	0.233	S	C	.	.			trans	-147.1	73.8	178.8	-165.1	-9.7	0	0	0	113.3	F459 E464 H465 Y466	F459-N462 CarbonylContact O-C 3.51Å; F459-N462 VanDerWaalsContact O-C 3.22Å; F459-N462 PolarHBondContact O-N 3.2Å; N462-E464 VanDerWaalsContact C-N 3.33Å; N462-E464 PolarHBondContact O-N 2.76Å; N462-H465 HydrophobicContact CB-CB 4.16Å; N462-H465 WeakPolarHBondContact ND2-CB 3.33Å; N462-H465 PolarHBondContact O-N 3.05Å; N462-H465 WeakPolarHBondContact OD1-CB 3.5Å; N462-H465 PolarHBondContact OD1-N 3.44Å; N462-Y466 WeakPolarHBondContact O-CD2 3.42Å
463	P	95.1	Very high	94.7	Very high	12 Å²	12	47.8 Å²	47.8	8%	0.078	23%	0.232	C	C	.	.	H	α-helix	trans	-59	-41.7	-175.2	-27	35.2	0	0	0	113.3	L441 Y443 F459 H465 Y466 I467	L441-P463 HydrophobicContact CD2-CG 4.47Å; Y443-P463 HydrophobicContact CD1-CB 3.94Å; Y443-P463 HydrophobicContact CD2-CB 4.03Å; Y443-P463 HydrophobicContact CD2-CG 4.04Å; Y443-P463 HydrophobicContact CE1-CB 3.94Å; Y443-P463 HydrophobicContact CE2-CB 4.03Å; Y443-P463 HydrophobicContact CE2-CG 4.03Å; Y443-P463 HydrophobicContact CG-CB 3.99Å; Y443-P463 HydrophobicContact CG-CG 4.44Å; F459-P463 HydrophobicContact CD1-CB 4.18Å; F459-P463 HydrophobicContact CD1-CG 4.44Å; F459-P463 HydrophobicContact CE1-CB 3.74Å; F459-P463 HydrophobicContact CE1-CG 4.41Å; F459-P463 HydrophobicContact CZ-CB 4.31Å; F459-P463 VanDerWaalsContact O-CA 3.29Å; F459-P463 WeakPolarHBondContact O-CA 3.28Å; F459-P463 VanDerWaalsContact O-CD 3.24Å; F459-P463 WeakPolarHBondContact O-CD 3.34Å; F459-P463 WeakPolarHBondContact O-CG 3.38Å; P463-H465 VanDerWaalsContact C-N 3.35Å; P463-H465 PolarHBondContact O-N 2.88Å; P463-Y466 PolarHBondContact O-N 3.47Å; P463-I467 HydrophobicContact CB-CD1 4.41Å; P463-I467 WeakPolarHBondContact O-CB 3.05Å; P463-I467 WeakPolarHBondContact O-CD1 3.48Å; P463-I467 WeakPolarHBondContact O-CG1 3.48Å; P463-I467 PolarHBondContact O-N 2.98Å
464	E	95.1	Very high	94.6	Very high	49 Å²	49	44.5 Å²	44.5	23%	0.229	22%	0.217	C	C	.	.	H	α-helix	trans	-60.1	-43.9	-178.8	-70.9	-65	172.3	0	0	112.3	Y443 K444 N462 Y466 I467 D468	Y443-E464 HydrophobicContact CE1-CG 4.16Å; Y443-E464 VanDerWaalsContact CE1-OE1 3.25Å; Y443-E464 WeakPolarHBondContact CE1-OE1 3.44Å; Y443-E464 VanDerWaalsContact OH-CG 3.27Å; Y443-E464 WeakPolarHBondContact OH-CG 3.36Å; Y443-E464 PolarHBondContact OH-OE1 3.22Å; K444-E464 WeakPolarHBondContact CD-OE1 3.47Å; K444-E464 WeakPolarHBondContact CE-OE1 3.43Å; K444-E464 IonicContact NZ-OE1 3.89Å; K444-E464 PolarHBondContact NZ-OE1 3.44Å; K444-E464 IonicContact NZ-OE2 2.67Å; N462-E464 VanDerWaalsContact C-N 3.33Å; N462-E464 PolarHBondContact O-N 2.76Å; E464-Y466 VanDerWaalsContact C-N 3.34Å; E464-Y466 PolarHBondContact O-N 3.43Å; E464-I467 PolarHBondContact O-N 3.31Å; E464-D468 WeakPolarHBondContact O-CB 3.38Å; E464-D468 VanDerWaalsContact O-CG 3.26Å; E464-D468 PolarHBondContact O-N 3.18Å
465	H	96.4	Very high	94.4	Very high	95 Å²	95	40.8 Å²	40.8	44%	0.44	20%	0.195	S	C	.	.	H	α-helix	trans	-58.7	-45.7	-179.2	176.6	61.2	0	0	0	112.2	N462 P463 D468 I469	N462-H465 HydrophobicContact CB-CB 4.16Å; N462-H465 WeakPolarHBondContact ND2-CB 3.33Å; N462-H465 PolarHBondContact O-N 3.05Å; N462-H465 WeakPolarHBondContact OD1-CB 3.5Å; N462-H465 PolarHBondContact OD1-N 3.44Å; P463-H465 VanDerWaalsContact C-N 3.35Å; P463-H465 PolarHBondContact O-N 2.88Å; H465-D468 PolarHBondContact O-N 2.98Å; H465-I469 WeakPolarHBondContact NE2-CD1 3.35Å; H465-I469 VanDerWaalsContact O-CG1 3.32Å; H465-I469 WeakPolarHBondContact O-CG1 3.44Å; H465-I469 PolarHBondContact O-N 3.16Å
466	Y	96	Very high	94.2	Very high	40 Å²	40	46.3 Å²	46.3	16%	0.157	22%	0.219	C	C	.	.	H	α-helix	trans	-72.2	-37.2	179	-63.6	-69.5	0	0	0	112.2	Y422 A425 S458 F459 N462 P463 E464 D468 I469 V470	Y422-Y466 HydrophobicContact CD2-CD1 4.12Å; Y422-Y466 HydrophobicContact CD2-CD2 4.49Å; Y422-Y466 AromaticContact CD2-CE1 3.83Å; Y422-Y466 HydrophobicContact CD2-CE1 3.83Å; Y422-Y466 HydrophobicContact CD2-CE2 4.25Å; Y422-Y466 HydrophobicContact CD2-CG 4.44Å; Y422-Y466 AromaticContact CD2-CZ 3.91Å; Y422-Y466 HydrophobicContact CE2-CD1 4.34Å; Y422-Y466 AromaticContact CE2-CE1 3.61Å; Y422-Y466 HydrophobicContact CE2-CE1 3.61Å; Y422-Y466 HydrophobicContact CE2-CE2 4.27Å; Y422-Y466 AromaticContact CE2-CZ 3.56Å; A425-Y466 HydrophobicContact CB-CD1 3.87Å; A425-Y466 HydrophobicContact CB-CG 4.46Å; S458-Y466 WeakPolarHBondContact O-CE2 3.38Å; F459-Y466 HydrophobicContact CB-CD2 4.41Å; F459-Y466 AromaticContact CD2-CD2 3.94Å; F459-Y466 HydrophobicContact CD2-CD2 3.94Å; F459-Y466 AromaticContact CD2-CG 3.94Å; F459-Y466 HydrophobicContact CD2-CG 3.94Å; F459-Y466 HydrophobicContact CE2-CG 4.43Å; F459-Y466 HydrophobicContact CG-CD2 4.34Å; N462-Y466 WeakPolarHBondContact O-CD2 3.42Å; P463-Y466 PolarHBondContact O-N 3.47Å; E464-Y466 VanDerWaalsContact C-N 3.34Å; E464-Y466 PolarHBondContact O-N 3.43Å; Y466-D468 VanDerWaalsContact C-N 3.3Å; Y466-D468 PolarHBondContact O-N 3.28Å; Y466-I469 HydrophobicContact CD1-CD1 4.34Å; Y466-I469 PolarHBondContact O-N 2.98Å; Y466-V470 VanDerWaalsContact O-CG2 3.23Å; Y466-V470 WeakPolarHBondContact O-CG2 3.46Å; Y466-V470 PolarHBondContact O-N 3.44Å
467	I	95	Very high	94	Very high	9 Å²	9	47.1 Å²	47.1	5%	0.046	22%	0.223	C	C	.	.	H	α-helix	trans	-60.6	-41.7	173.8	-69.2	164.9	0	0	0	110.7	Y443 Y448 F459 P463 E464 V470 R471	Y443-I467 HydrophobicContact CD1-CD1 3.8Å; Y443-I467 HydrophobicContact CE1-CD1 4.08Å; Y448-I467 HydrophobicContact CE1-CD1 4.46Å; Y448-I467 HydrophobicContact CE1-CG1 4.33Å; Y448-I467 HydrophobicContact CE2-CD1 4.29Å; F459-I467 HydrophobicContact CE2-CG1 4.31Å; F459-I467 HydrophobicContact CZ-CD1 4.13Å; F459-I467 HydrophobicContact CZ-CG1 3.8Å; P463-I467 HydrophobicContact CB-CD1 4.41Å; P463-I467 WeakPolarHBondContact O-CB 3.05Å; P463-I467 WeakPolarHBondContact O-CD1 3.48Å; P463-I467 WeakPolarHBondContact O-CG1 3.48Å; P463-I467 PolarHBondContact O-N 2.98Å; E464-I467 PolarHBondContact O-N 3.31Å; I467-V470 PolarHBondContact O-N 2.94Å; I467-R471 PolarHBondContact O-N 3.48Å
468	D	93.8	Very high	93.8	Very high	62 Å²	62	45 Å²	45	33%	0.332	22%	0.215	S	C	.	.	H	α-helix	trans	-65.4	-42.6	176.7	-73.1	-19.8	0	0	0	111.4	E464 H465 Y466 V470 R471 E472	E464-D468 WeakPolarHBondContact O-CB 3.38Å; E464-D468 VanDerWaalsContact O-CG 3.26Å; E464-D468 PolarHBondContact O-N 3.18Å; H465-D468 PolarHBondContact O-N 2.98Å; Y466-D468 VanDerWaalsContact C-N 3.3Å; Y466-D468 PolarHBondContact O-N 3.28Å; D468-V470 VanDerWaalsContact C-N 3.34Å; D468-V470 PolarHBondContact O-N 3.33Å; D468-R471 WeakPolarHBondContact O-CB 3.15Å; D468-R471 PolarHBondContact O-N 2.97Å; D468-R471 VanDerWaalsContact O-N 3.15Å; D468-R471 IonicContact OD1-CZ 3.87Å; D468-R471 IonicContact OD1-NH1 2.66Å; D468-R471 PolarHBondContact OD1-NH1 3.36Å; D468-R471 IonicContact OD1-NH2 3.26Å; D468-R471 PolarHBondContact OD1-NH2 3.41Å; D468-E472 WeakPolarHBondContact O-CG 3.19Å; D468-E472 PolarHBondContact O-N 3.05Å
469	I	94.6	Very high	93.7	Very high	57 Å²	57	43.6 Å²	43.6	29%	0.292	21%	0.205	S	C	.	.	H	α-helix	trans	-58.8	-45.8	173.8	-69.9	165.4	0	0	0	111	A425 H465 Y466 R471 E472 K473	A425-I469 HydrophobicContact CB-CB 4.19Å; A425-I469 HydrophobicContact CB-CG2 3.9Å; H465-I469 WeakPolarHBondContact NE2-CD1 3.35Å; H465-I469 VanDerWaalsContact O-CG1 3.32Å; H465-I469 WeakPolarHBondContact O-CG1 3.44Å; H465-I469 PolarHBondContact O-N 3.16Å; Y466-I469 HydrophobicContact CD1-CD1 4.34Å; Y466-I469 PolarHBondContact O-N 2.98Å; I469-R471 VanDerWaalsContact C-N 3.27Å; I469-R471 PolarHBondContact O-N 2.75Å; I469-E472 PolarHBondContact O-N 2.92Å; I469-K473 WeakPolarHBondContact O-CB 3.34Å; I469-K473 PolarHBondContact O-N 3.04Å
470	V	94.8	Very high	93.6	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-58.4	-43	176.5	173	0	0	0	0	110.7	Y416 F424 A425 Y466 I467 D468 K473 A474	Y416-V470 HydrophobicContact CD1-CG1 4.2Å; Y416-V470 HydrophobicContact CE1-CG1 3.52Å; Y416-V470 HydrophobicContact CE2-CG1 4.4Å; Y416-V470 HydrophobicContact CE2-CG2 4.46Å; F424-V470 HydrophobicContact CD1-CB 4.21Å; F424-V470 HydrophobicContact CD1-CG1 3.98Å; F424-V470 HydrophobicContact CD1-CG2 3.63Å; F424-V470 HydrophobicContact CE1-CB 4.17Å; F424-V470 HydrophobicContact CE1-CG1 3.73Å; F424-V470 HydrophobicContact CE1-CG2 4.09Å; A425-V470 HydrophobicContact CB-CG2 3.94Å; Y466-V470 VanDerWaalsContact O-CG2 3.23Å; Y466-V470 WeakPolarHBondContact O-CG2 3.46Å; Y466-V470 PolarHBondContact O-N 3.44Å; I467-V470 PolarHBondContact O-N 2.94Å; D468-V470 VanDerWaalsContact C-N 3.34Å; D468-V470 PolarHBondContact O-N 3.33Å; V470-K473 WeakPolarHBondContact O-CB 3.29Å; V470-K473 PolarHBondContact O-N 3.36Å; V470-A474 WeakPolarHBondContact O-CB 3.39Å; V470-A474 PolarHBondContact O-N 3.39Å
471	R	91.5	Very high	93.4	Very high	68 Å²	68	43.5 Å²	43.5	26%	0.257	20%	0.204	S	C	.	.	H	α-helix	trans	-62.7	-48.7	178.6	-166.4	-170.9	-54.3	120.8	10.2	111.8	I467 D468 I469 K473 A474 K475 F490	I467-R471 PolarHBondContact O-N 3.48Å; D468-R471 WeakPolarHBondContact O-CB 3.15Å; D468-R471 PolarHBondContact O-N 2.97Å; D468-R471 VanDerWaalsContact O-N 3.15Å; D468-R471 IonicContact OD1-CZ 3.87Å; D468-R471 IonicContact OD1-NH1 2.66Å; D468-R471 PolarHBondContact OD1-NH1 3.36Å; D468-R471 IonicContact OD1-NH2 3.26Å; D468-R471 PolarHBondContact OD1-NH2 3.41Å; I469-R471 VanDerWaalsContact C-N 3.27Å; I469-R471 PolarHBondContact O-N 2.75Å; R471-K473 VanDerWaalsContact C-N 3.25Å; R471-K473 PolarHBondContact O-N 2.9Å; R471-A474 PolarHBondContact O-N 3.44Å; R471-K475 WeakPolarHBondContact O-CG 3.46Å; R471-K475 PolarHBondContact O-N 2.97Å; R471-F490 HydrophobicContact CG-CE1 4.34Å; R471-F490 HydrophobicContact CG-CZ 3.82Å
472	E	91.6	Very high	93.2	Very high	80 Å²	80	37.2 Å²	37.2	37%	0.374	17%	0.174	S	C	.	.	H	α-helix	trans	-62.8	-35.8	178.5	-66.3	-50.8	119.5	0	0	111.6	P44 D468 I469 K475 K476	P44-E472 WeakPolarHBondContact CG-OE2 3.24Å; D468-E472 WeakPolarHBondContact O-CG 3.19Å; D468-E472 PolarHBondContact O-N 3.05Å; I469-E472 PolarHBondContact O-N 2.92Å; E472-K475 PolarHBondContact O-N 3.13Å; E472-K475 IonicContact OE1-NZ 2.73Å; E472-K475 PolarHBondContact OE1-NZ 2.9Å; E472-K475 IonicContact OE2-NZ 2.8Å; E472-K476 PolarHBondContact O-N 3.31Å; E472-K476 VanDerWaalsContact O-N 3.17Å
473	K	92.6	Very high	93.2	Very high	29 Å²	29	33.4 Å²	33.4	13%	0.126	15%	0.154	C	C	.	.	H	α-helix	trans	-64.4	-44.8	174.3	-164.9	71.4	179.4	177.1	0	112.1	F424 D428 I469 V470 R471 K475 K476 N477 L480	F424-K473 HydrophobicContact CE1-CB 4.23Å; F424-K473 HydrophobicContact CE1-CG 4.2Å; F424-K473 HydrophobicContact CZ-CB 4.47Å; F424-K473 HydrophobicContact CZ-CG 4.05Å; D428-K473 WeakPolarHBondContact O-CE 3.41Å; D428-K473 PolarHBondContact O-NZ 3.22Å; D428-K473 IonicContact OD1-NZ 2.56Å; D428-K473 PolarHBondContact OD1-NZ 3.47Å; I469-K473 WeakPolarHBondContact O-CB 3.34Å; I469-K473 PolarHBondContact O-N 3.04Å; V470-K473 WeakPolarHBondContact O-CB 3.29Å; V470-K473 PolarHBondContact O-N 3.36Å; R471-K473 VanDerWaalsContact C-N 3.25Å; R471-K473 PolarHBondContact O-N 2.9Å; K473-K475 VanDerWaalsContact C-N 3.32Å; K473-K475 PolarHBondContact O-N 2.93Å; K473-K476 PolarHBondContact O-N 3.34Å; K473-N477 PolarHBondContact O-N 3.14Å; K473-L480 HydrophobicContact CG-CD1 4.2Å
474	A	92.6	Very high	93.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-66.4	-31.4	177.7	0	0	0	0	0	113	V470 R471 N477 T478 L480 I481 L486 F490	V470-A474 WeakPolarHBondContact O-CB 3.39Å; V470-A474 PolarHBondContact O-N 3.39Å; R471-A474 PolarHBondContact O-N 3.44Å; A474-N477 CarbonylContact O-C 3.09Å; A474-N477 VanDerWaalsContact O-C 3.23Å; A474-T478 WeakPolarHBondContact O-CA 3.18Å; A474-T478 PolarHBondContact O-N 3.17Å; A474-L480 HydrophobicContact CB-CB 4.4Å; A474-I481 HydrophobicContact CB-CG1 4.05Å; A474-L486 HydrophobicContact CB-CD1 3.54Å; A474-F490 HydrophobicContact CB-CE2 4.16Å; A474-F490 HydrophobicContact CB-CZ 4.27Å
475	K	89.7	Confident	92.9	Very high	46 Å²	46	34.6 Å²	34.6	20%	0.2	16%	0.158	C	C	.	.	H	α-helix	trans	-66.5	-40.2	172.6	-69.8	177.1	-178.1	167.8	0	112.6	L42 P44 R471 E472 K473 F490	L42-K475 HydrophobicContact CD1-CD 4.4Å; L42-K475 HydrophobicContact CD1-CG 3.98Å; L42-K475 HydrophobicContact CD2-CG 4.27Å; L42-K475 HydrophobicContact CG-CB 4.04Å; L42-K475 HydrophobicContact CG-CG 3.87Å; P44-K475 HydrophobicContact CG-CB 4.38Å; P44-K475 HydrophobicContact CG-CD 4.08Å; R471-K475 WeakPolarHBondContact O-CG 3.46Å; R471-K475 PolarHBondContact O-N 2.97Å; E472-K475 PolarHBondContact O-N 3.13Å; E472-K475 IonicContact OE1-NZ 2.73Å; E472-K475 PolarHBondContact OE1-NZ 2.9Å; E472-K475 IonicContact OE2-NZ 2.8Å; K473-K475 VanDerWaalsContact C-N 3.32Å; K473-K475 PolarHBondContact O-N 2.93Å; K475-F490 HydrophobicContact CD-CE1 4.44Å; K475-F490 HydrophobicContact CG-CE1 3.6Å; K475-F490 HydrophobicContact CG-CZ 3.91Å
476	K	90.6	Very high	92.4	Very high	118 Å²	118	30.1 Å²	30.1	51%	0.513	14%	0.137	S	C	.	.	H	α-helix	trans	-70.8	-40.5	178.3	-172.5	177.7	178.3	175.4	0	112	E472 K473	E472-K476 PolarHBondContact O-N 3.31Å; E472-K476 VanDerWaalsContact O-N 3.17Å; K473-K476 PolarHBondContact O-N 3.34Å
477	N	92.3	Very high	91.4	Very high	16 Å²	16	29.7 Å²	29.7	9%	0.086	14%	0.137	C	C	.	.	S	Bend	trans	-115.9	83	-178.2	-77.1	50.9	0	0	0	108.9	K473 A474 E479 L480	K473-N477 PolarHBondContact O-N 3.14Å; A474-N477 CarbonylContact O-C 3.09Å; A474-N477 VanDerWaalsContact O-C 3.23Å; N477-E479 VanDerWaalsContact C-OE2 3.25Å; N477-E479 WeakPolarHBondContact CA-OE2 3.4Å; N477-E479 WeakPolarHBondContact CB-OE1 3.41Å; N477-E479 PolarHBondContact ND2-OE1 3.35Å; N477-E479 PolarHBondContact O-N 3.4Å; N477-E479 VanDerWaalsContact O-N 3.16Å; N477-L480 HydrophobicContact CB-CD1 3.48Å; N477-L480 VanDerWaalsContact CB-CD1 3.48Å; N477-L480 HydrophobicContact CB-CG 4Å; N477-L480 VanDerWaalsContact O-CB 3.26Å; N477-L480 WeakPolarHBondContact O-CB 3.23Å; N477-L480 PolarHBondContact O-N 3.38Å
478	T	90.8	Very high	89.9	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.006	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-19.6	-171.2	50.9	0	0	0	0	114.2	A39 L42 A474 L480 I481	A39-T478 HydrophobicContact CB-CG2 3.58Å; A39-T478 WeakPolarHBondContact CB-OG1 3.43Å; L42-T478 HydrophobicContact CD2-CG2 4.26Å; A474-T478 WeakPolarHBondContact O-CA 3.18Å; A474-T478 PolarHBondContact O-N 3.17Å; T478-L480 PolarHBondContact O-N 3.19Å; T478-I481 HydrophobicContact CG2-CD1 4.13Å; T478-I481 WeakPolarHBondContact O-CB 3.32Å; T478-I481 PolarHBondContact O-N 2.88Å; T478-I481 VanDerWaalsContact O-N 3.08Å
479	E	93.6	Very high	88.2	Confident	2 Å²	2	32.6 Å²	32.6	1%	0.009	15%	0.148	C	C	.	.	H	α-helix	trans	-58.7	-25.3	170.5	69.2	-81.3	-173.9	0	0	112.5	S77 T80 I81 Q84 Y267 N477 I481 L483	S77-E479 VanDerWaalsContact OG-CD 3.26Å; S77-E479 PolarHBondContact OG-OE2 2.87Å; T80-E479 HydrophobicContact CG2-CB 3.76Å; T80-E479 HydrophobicContact CG2-CG 4.37Å; I81-E479 HydrophobicContact CG1-CB 4.19Å; Q84-E479 PolarHBondContact NE2-O 3.28Å; Y267-E479 HydrophobicContact CD2-CG 4.09Å; N477-E479 VanDerWaalsContact C-OE2 3.25Å; N477-E479 WeakPolarHBondContact CA-OE2 3.4Å; N477-E479 WeakPolarHBondContact CB-OE1 3.41Å; N477-E479 PolarHBondContact ND2-OE1 3.35Å; N477-E479 PolarHBondContact O-N 3.4Å; N477-E479 VanDerWaalsContact O-N 3.16Å; E479-I481 VanDerWaalsContact C-N 3.27Å; E479-I481 PolarHBondContact O-N 3.09Å; E479-L483 PolarHBondContact O-N 2.94Å
480	L	94.8	Very high	86.6	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-73.6	-19.5	178.7	-63.9	170	0	0	0	112.7	Y267 F424 K473 A474 N477 T478 L483 L484	Y267-L480 HydrophobicContact CD1-CD2 3.78Å; Y267-L480 HydrophobicContact CD2-CD1 4.47Å; Y267-L480 HydrophobicContact CD2-CD2 3.65Å; Y267-L480 HydrophobicContact CD2-CG 4.14Å; Y267-L480 HydrophobicContact CE1-CD2 3.84Å; Y267-L480 HydrophobicContact CE2-CD1 3.9Å; Y267-L480 HydrophobicContact CE2-CD2 3.72Å; Y267-L480 HydrophobicContact CE2-CG 4.06Å; Y267-L480 HydrophobicContact CG-CD2 3.69Å; F424-L480 HydrophobicContact CE2-CD1 4.25Å; F424-L480 HydrophobicContact CE2-CD2 4.29Å; F424-L480 HydrophobicContact CZ-CD1 3.82Å; F424-L480 HydrophobicContact CZ-CD2 4.47Å; K473-L480 HydrophobicContact CG-CD1 4.2Å; A474-L480 HydrophobicContact CB-CB 4.4Å; N477-L480 HydrophobicContact CB-CD1 3.48Å; N477-L480 VanDerWaalsContact CB-CD1 3.48Å; N477-L480 HydrophobicContact CB-CG 4Å; N477-L480 VanDerWaalsContact O-CB 3.26Å; N477-L480 WeakPolarHBondContact O-CB 3.23Å; N477-L480 PolarHBondContact O-N 3.38Å; T478-L480 PolarHBondContact O-N 3.19Å; L480-L483 HydrophobicContact CD2-CD2 4.12Å; L480-L484 HydrophobicContact CB-CD1 4.21Å; L480-L484 HydrophobicContact CB-CG 4.48Å; L480-L484 WeakPolarHBondContact O-CB 3.35Å; L480-L484 VanDerWaalsContact O-CG 3.31Å; L480-L484 WeakPolarHBondContact O-CG 3.3Å; L480-L484 PolarHBondContact O-N 3.04Å
481	I	91.5	Very high	84.6	Confident	4 Å²	4	37.4 Å²	37.4	2%	0.021	17%	0.17	C	C	.	.	H	α-helix	trans	-65.7	-48.7	-175.5	-64.8	174	0	0	0	110.4	L42 A474 T478 E479 E485 L486 F490 L493	L42-I481 HydrophobicContact CD2-CD1 3.59Å; A474-I481 HydrophobicContact CB-CG1 4.05Å; T478-I481 HydrophobicContact CG2-CD1 4.13Å; T478-I481 WeakPolarHBondContact O-CB 3.32Å; T478-I481 PolarHBondContact O-N 2.88Å; T478-I481 VanDerWaalsContact O-N 3.08Å; E479-I481 VanDerWaalsContact C-N 3.27Å; E479-I481 PolarHBondContact O-N 3.09Å; I481-E485 PolarHBondContact O-N 3.35Å; I481-L486 HydrophobicContact CG2-CB 4.25Å; I481-L486 PolarHBondContact O-N 2.98Å; I481-F490 HydrophobicContact CB-CD2 4.47Å; I481-F490 HydrophobicContact CD1-CD2 3.93Å; I481-F490 HydrophobicContact CD1-CE2 4.09Å; I481-F490 HydrophobicContact CD1-CG 4.17Å; I481-F490 HydrophobicContact CD1-CZ 4.47Å; I481-F490 HydrophobicContact CG1-CD2 3.94Å; I481-F490 HydrophobicContact CG1-CE2 3.91Å; I481-F490 HydrophobicContact CG2-CB 4.46Å; I481-F490 HydrophobicContact CG2-CD2 3.79Å; I481-F490 HydrophobicContact CG2-CG 4.45Å; I481-L493 HydrophobicContact CD1-CD1 3.24Å; I481-L493 HydrophobicContact CG2-CD1 4.34Å
482	Q	90.4	Very high	82.6	Confident	14 Å²	14	38.3 Å²	38.3	7%	0.065	18%	0.183	C	C	.	.	H	α-helix	trans	-75.6	-38.6	176.2	179.7	167.8	13.6	0	0	112.1	Q84 D88 L484 E485	Q84-Q482 HydrophobicContact CG-CB 4.39Å; Q84-Q482 HydrophobicContact CG-CG 4.37Å; D88-Q482 PolarHBondContact OD1-NE2 2.99Å; Q482-L484 VanDerWaalsContact C-N 3.28Å; Q482-L484 PolarHBondContact O-N 3.26Å; Q482-E485 PolarHBondContact O-N 2.92Å
483	L	94.7	Very high	80.7	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-59.1	-40.9	178.7	-179.4	58.1	0	0	0	111.8	Y267 R270 Q271 V274 R417 L431 E479 L480	Y267-L483 HydrophobicContact CD1-CD2 4.39Å; Y267-L483 HydrophobicContact CG-CD2 4.44Å; R270-L483 HydrophobicContact CB-CD1 4.1Å; R270-L483 HydrophobicContact CB-CD2 4.3Å; Q271-L483 HydrophobicContact CB-CD1 4.19Å; Q271-L483 VanDerWaalsContact OE1-CA 3.22Å; V274-L483 HydrophobicContact CG2-CD1 4.41Å; R417-L483 WeakPolarHBondContact CD-O 3.26Å; R417-L483 WeakPolarHBondContact CG-O 3.4Å; R417-L483 PolarHBondContact NE-O 3.09Å; L431-L483 HydrophobicContact CD1-CD2 3.83Å; E479-L483 PolarHBondContact O-N 2.94Å; L480-L483 HydrophobicContact CD2-CD2 4.12Å
484	L	94.3	Very high	78.5	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.005	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	8.4	-178	-56	-178.8	0	0	0	113.8	Y416 F419 F424 L431 L480 Q482 L486	Y416-L484 WeakPolarHBondContact CA-O 3.34Å; Y416-L484 HydrophobicContact CD1-CB 4.23Å; F419-L484 HydrophobicContact CD2-CD2 3.78Å; F419-L484 HydrophobicContact CE2-CD2 4.35Å; F424-L484 HydrophobicContact CE1-CD1 4.02Å; F424-L484 HydrophobicContact CE2-CD1 3.99Å; F424-L484 HydrophobicContact CZ-CD1 3.63Å; L431-L484 HydrophobicContact CD2-CD2 3.91Å; L480-L484 HydrophobicContact CB-CD1 4.21Å; L480-L484 HydrophobicContact CB-CG 4.48Å; L480-L484 WeakPolarHBondContact O-CB 3.35Å; L480-L484 VanDerWaalsContact O-CG 3.31Å; L480-L484 WeakPolarHBondContact O-CG 3.3Å; L480-L484 PolarHBondContact O-N 3.04Å; Q482-L484 VanDerWaalsContact C-N 3.28Å; Q482-L484 PolarHBondContact O-N 3.26Å; L484-L486 VanDerWaalsContact C-N 3.34Å; L484-L486 HydrophobicContact CB-CD1 3.92Å; L484-L486 HydrophobicContact CB-CG 3.92Å; L484-L486 HydrophobicContact CD1-CD1 4.23Å; L484-L486 PolarHBondContact O-N 3.26Å
485	E	89	Confident	76.2	Confident	84 Å²	84	37.3 Å²	37.3	39%	0.393	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	42	-179.4	-62	-175.8	149.9	0	0	114.2	R417 I481 Q482 H487	R417-E485 HydrophobicContact CG-CG 4.04Å; R417-E485 VanDerWaalsContact CZ-CG 3.46Å; R417-E485 IonicContact CZ-OE1 2.63Å; R417-E485 IonicContact NE-OE1 2.76Å; R417-E485 IonicContact NH1-OE1 3.6Å; R417-E485 PolarHBondContact NH1-OE1 3.31Å; R417-E485 IonicContact NH1-OE2 3.55Å; R417-E485 IonicContact NH2-OE1 3.91Å; R417-E485 PolarHBondContact NH2-OE1 3.38Å; I481-E485 PolarHBondContact O-N 3.35Å; Q482-E485 PolarHBondContact O-N 2.92Å; E485-H487 VanDerWaalsContact C-N 3.31Å; E485-H487 PolarHBondContact O-N 3.23Å
486	L	85.8	Confident	73.8	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.005	21%	0.21	C	C	.	.			trans	-86.4	8.7	-176.8	-62.8	170.3	0	0	0	114.6	Y416 A474 I481 L484 Q488 Q489 F490	Y416-L486 HydrophobicContact CD1-CD2 3.81Å; Y416-L486 HydrophobicContact CE1-CD2 3.5Å; Y416-L486 VanDerWaalsContact CE1-CD2 3.5Å; A474-L486 HydrophobicContact CB-CD1 3.54Å; I481-L486 HydrophobicContact CG2-CB 4.25Å; I481-L486 PolarHBondContact O-N 2.98Å; L484-L486 VanDerWaalsContact C-N 3.34Å; L484-L486 HydrophobicContact CB-CD1 3.92Å; L484-L486 HydrophobicContact CB-CG 3.92Å; L484-L486 HydrophobicContact CD1-CD1 4.23Å; L484-L486 PolarHBondContact O-N 3.26Å; L486-Q488 VanDerWaalsContact C-N 3.26Å; L486-Q488 PolarHBondContact O-N 3.36Å; L486-Q488 VanDerWaalsContact O-N 3.14Å; L486-Q489 WeakPolarHBondContact O-CA 3.43Å; L486-Q489 WeakPolarHBondContact O-CB 3.49Å; L486-Q489 PolarHBondContact O-N 2.94Å; L486-F490 HydrophobicContact CB-CD2 3.91Å; L486-F490 HydrophobicContact CB-CE2 3.84Å; L486-F490 HydrophobicContact CD1-CE2 4.37Å; L486-F490 WeakPolarHBondContact O-CD2 3.48Å; L486-F490 PolarHBondContact O-N 3.45Å
487	H	75.2	Confident	71.4	Confident	31 Å²	31	41.1 Å²	41.1	14%	0.144	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-52.2	-38.5	-176.2	-58.2	106	0	0	0	114.1	E485 Q489 F490 E491 I494 Q498	E485-H487 VanDerWaalsContact C-N 3.31Å; E485-H487 PolarHBondContact O-N 3.23Å; H487-Q489 PolarHBondContact O-N 3.28Å; H487-Q489 VanDerWaalsContact O-N 3.16Å; H487-F490 CarbonylContact O-C 3.5Å; H487-F490 PolarHBondContact O-N 3.15Å; H487-E491 PolarHBondContact O-N 3.42Å; H487-I494 HydrophobicContact CB-CG1 4.25Å; H487-Q498 PolarHBondContact CE1-OE1 2.93Å
488	Q	63.9	Low	69.1	Low	85 Å²	85	43.3 Å²	43.3	40%	0.397	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-59.7	-26.5	176.6	-68.8	-176.4	-14.1	0	0	113.2	L486	L486-Q488 VanDerWaalsContact C-N 3.26Å; L486-Q488 PolarHBondContact O-N 3.36Å; L486-Q488 VanDerWaalsContact O-N 3.14Å
489	Q	57.4	Low	66.5	Low	48 Å²	48	48.6 Å²	48.6	22%	0.224	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-89.6	-13.3	179.3	-51.6	-173.4	30.7	0	0	112	L486 H487	L486-Q489 WeakPolarHBondContact O-CA 3.43Å; L486-Q489 WeakPolarHBondContact O-CB 3.49Å; L486-Q489 PolarHBondContact O-N 2.94Å; H487-Q489 PolarHBondContact O-N 3.28Å; H487-Q489 VanDerWaalsContact O-N 3.16Å
490	F	61.6	Low	63.9	Low	9 Å²	9	56.5 Å²	56.5	4%	0.039	27%	0.268	C	S	.	.			trans	-132.5	60.6	-177.1	-57.1	-73.3	0	0	0	110.2	L42 R471 A474 K475 I481 L486 H487 T492 L493	L42-F490 HydrophobicContact CD1-CD1 4.06Å; L42-F490 HydrophobicContact CD1-CE1 4.15Å; L42-F490 HydrophobicContact CD2-CD1 3.87Å; L42-F490 HydrophobicContact CD2-CE1 4.02Å; R471-F490 HydrophobicContact CG-CE1 4.34Å; R471-F490 HydrophobicContact CG-CZ 3.82Å; A474-F490 HydrophobicContact CB-CE2 4.16Å; A474-F490 HydrophobicContact CB-CZ 4.27Å; K475-F490 HydrophobicContact CD-CE1 4.44Å; K475-F490 HydrophobicContact CG-CE1 3.6Å; K475-F490 HydrophobicContact CG-CZ 3.91Å; I481-F490 HydrophobicContact CB-CD2 4.47Å; I481-F490 HydrophobicContact CD1-CD2 3.93Å; I481-F490 HydrophobicContact CD1-CE2 4.09Å; I481-F490 HydrophobicContact CD1-CG 4.17Å; I481-F490 HydrophobicContact CD1-CZ 4.47Å; I481-F490 HydrophobicContact CG1-CD2 3.94Å; I481-F490 HydrophobicContact CG1-CE2 3.91Å; I481-F490 HydrophobicContact CG2-CB 4.46Å; I481-F490 HydrophobicContact CG2-CD2 3.79Å; I481-F490 HydrophobicContact CG2-CG 4.45Å; L486-F490 HydrophobicContact CB-CD2 3.91Å; L486-F490 HydrophobicContact CB-CE2 3.84Å; L486-F490 HydrophobicContact CD1-CE2 4.37Å; L486-F490 WeakPolarHBondContact O-CD2 3.48Å; L486-F490 PolarHBondContact O-N 3.45Å; H487-F490 CarbonylContact O-C 3.5Å; H487-F490 PolarHBondContact O-N 3.15Å; F490-T492 PolarHBondContact O-N 2.98Å; F490-L493 HydrophobicContact CB-CB 4.38Å; F490-L493 HydrophobicContact CB-CD1 4.03Å; F490-L493 HydrophobicContact CG-CD1 4.46Å; F490-L493 PolarHBondContact O-N 3.39Å
491	E	52.3	Low	61.3	Low	149 Å²	149	59.4 Å²	59.4	70%	0.696	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-55.3	-25	-177.7	-151.9	169.2	-159.3	0	0	112.6	H487 L493 I494	H487-E491 PolarHBondContact O-N 3.42Å; E491-L493 VanDerWaalsContact C-N 3.29Å; E491-L493 PolarHBondContact O-N 3.36Å; E491-I494 HydrophobicContact CG-CD1 4.17Å
492	T	50.8	Low	58.8	Low	87 Å²	87	61.4 Å²	61.4	53%	0.534	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-67.4	-19.3	174.9	45.4	0	0	0	0	114.8	K38 F490	K38-T492 WeakPolarHBondContact CD-O 3.39Å; K38-T492 WeakPolarHBondContact CE-O 3.4Å; K38-T492 PolarHBondContact NZ-O 3.44Å; F490-T492 PolarHBondContact O-N 2.98Å
493	L	50.8	Low	56.4	Low	9 Å²	9	67.9 Å²	67.9	5%	0.047	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-96.8	-7.2	-175.7	-81	169.8	0	0	0	114.9	F35 K38 L42 I481 F490 E491 P495	F35-L493 HydrophobicContact CE2-CD2 4.36Å; K38-L493 HydrophobicContact CB-CD2 3.49Å; K38-L493 VanDerWaalsContact CB-CD2 3.49Å; K38-L493 HydrophobicContact CD-CD2 3.84Å; K38-L493 HydrophobicContact CG-CD2 4.34Å; L42-L493 HydrophobicContact CD2-CD1 3.53Å; I481-L493 HydrophobicContact CD1-CD1 3.24Å; I481-L493 HydrophobicContact CG2-CD1 4.34Å; F490-L493 HydrophobicContact CB-CB 4.38Å; F490-L493 HydrophobicContact CB-CD1 4.03Å; F490-L493 HydrophobicContact CG-CD1 4.46Å; F490-L493 PolarHBondContact O-N 3.39Å; E491-L493 VanDerWaalsContact C-N 3.29Å; E491-L493 PolarHBondContact O-N 3.36Å; L493-P495 VanDerWaalsContact O-CD 3.31Å; L493-P495 WeakPolarHBondContact O-CD 3.42Å
494	I	45.6	Very low	53.9	Low	34 Å²	34	75.2 Å²	75.2	17%	0.174	37%	0.368	C	S	.	.			trans	-68.9	122.2	-171.9	-58.6	174.2	0	0	0	111.7	H487 E491 Q498 M499	H487-I494 HydrophobicContact CB-CG1 4.25Å; E491-I494 HydrophobicContact CG-CD1 4.17Å; I494-Q498 HydrophobicContact CG2-CB 4Å; I494-M499 HydrophobicContact CG2-CG 3.76Å
495	P	45.5	Very low	51.7	Low	45 Å²	45	79.1 Å²	79.1	29%	0.292	39%	0.386	S	S	.	.			trans	-66.9	140.7	159.9	-15.4	30.9	0	0	0	109.8	D88 L493 S497 Q498	D88-P495 HydrophobicContact CB-CG 4.4Å; L493-P495 VanDerWaalsContact O-CD 3.31Å; L493-P495 WeakPolarHBondContact O-CD 3.42Å; P495-S497 PolarHBondContact O-N 3.04Å; P495-Q498 PolarHBondContact O-N 2.91Å
496	Y	38.1	Very low	49.7	Very low	191 Å²	191	82.4 Å²	82.4	75%	0.749	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.3	-24.1	-170.7	-166	-100.9	0	0	0	115.6
497	S	41.4	Very low	48.2	Very low	53 Å²	53	85.3 Å²	85.3	37%	0.371	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-33.5	178.3	48.2	0	0	0	0	114.1	P495	P495-S497 PolarHBondContact O-N 3.04Å
498	Q	42.9	Very low	47.7	Very low	62 Å²	62	91.4 Å²	91.4	29%	0.29	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-91.2	-6.9	-174.6	-65.4	-179.6	15	0	0	114.3	D88 H487 I494 P495 R500	D88-Q498 PolarHBondContact OD1-NE2 2.87Å; H487-Q498 PolarHBondContact CE1-OE1 2.93Å; I494-Q498 HydrophobicContact CG2-CB 4Å; P495-Q498 PolarHBondContact O-N 2.91Å; Q498-R500 PolarHBondContact O-N 3.45Å; Q498-R500 VanDerWaalsContact O-N 3.12Å
499	M	37.8	Very low	47.7	Very low	112 Å²	112	88.3 Å²	88.3	55%	0.552	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-61.9	-21.3	-179.6	-77.8	-160.9	86.8	0	0	113.6	I494	I494-M499 HydrophobicContact CG2-CG 3.76Å
500	R	38.5	Very low	48.5	Very low	168 Å²	168	91.1 Å²	91.1	63%	0.634	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-90.8	-15.4	-173.1	-63.5	-170.3	-154.8	165.6	3.3	115.5	E96 Q498	E96-R500 IonicContact OE1-CZ 2.99Å; E96-R500 IonicContact OE1-NH1 3.83Å; E96-R500 PolarHBondContact OE1-NH1 2.97Å; Q498-R500 PolarHBondContact O-N 3.45Å; Q498-R500 VanDerWaalsContact O-N 3.12Å
501	D	39.7	Very low	49.1	Very low	60 Å²	60	94.1 Å²	94.1	32%	0.321	46%	0.459	S	S	.	.	S	Bend	trans	-97.8	2	-179.2	-80.1	-41.2	0	0	0	113.8	D503 K504 H505	D501-D503 PolarHBondContact O-N 3.38Å; D501-D503 VanDerWaalsContact O-N 3.11Å; D501-K504 PolarHBondContact O-N 2.72Å; D501-K504 WeakPolarHBondContact OD1-CD 3.49Å; D501-K504 WeakPolarHBondContact OD1-CE 3.41Å; D501-K504 IonicContact OD1-NZ 3.93Å; D501-K504 PolarHBondContact OD1-NZ 3.4Å; D501-H505 PolarHBondContact O-CE1 3.17Å; D501-H505 VanDerWaalsContact O-CE1 3.3Å; D501-H505 PolarHBondContact O-ND1 3.2Å
502	A	40.1	Very low	50	Low	47 Å²	47	94 Å²	94	39%	0.388	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-54.8	-32.1	177.2	0	0	0	0	0	113.1	K504	A502-K504 PolarHBondContact O-N 3.26Å
503	D	38.8	Very low	51	Low	149 Å²	149	95 Å²	95	80%	0.797	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-76.3	-17.1	-179.1	-75.6	-23.1	0	0	0	114.5	D501 H505	D501-D503 PolarHBondContact O-N 3.38Å; D501-D503 VanDerWaalsContact O-N 3.11Å; D503-H505 VanDerWaalsContact C-N 3.32Å; D503-H505 PolarHBondContact O-N 3.34Å
504	K	43.1	Very low	51.9	Low	155 Å²	155	104.4 Å²	104.4	67%	0.674	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-83.6	-2.6	-179	-69.5	-177.3	-171.3	146.5	0	114.4	D501 A502	D501-K504 PolarHBondContact O-N 2.72Å; D501-K504 WeakPolarHBondContact OD1-CD 3.49Å; D501-K504 WeakPolarHBondContact OD1-CE 3.41Å; D501-K504 IonicContact OD1-NZ 3.93Å; D501-K504 PolarHBondContact OD1-NZ 3.4Å; A502-K504 PolarHBondContact O-N 3.26Å
505	H	46.7	Very low	52.9	Low	82 Å²	82	107.9 Å²	107.9	38%	0.38	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-94.1	11.2	-167.4	-71.4	79.2	0	0	0	115.8	L413 D501 D503	L413-H505 HydrophobicContact CD1-CB 4.07Å; L413-H505 VanDerWaalsContact CD1-O 3.22Å; L413-H505 WeakPolarHBondContact CD1-O 3.19Å; D501-H505 PolarHBondContact O-CE1 3.17Å; D501-H505 VanDerWaalsContact O-CE1 3.3Å; D501-H505 PolarHBondContact O-ND1 3.2Å; D503-H505 VanDerWaalsContact C-N 3.32Å; D503-H505 PolarHBondContact O-N 3.34Å
506	Y	48.2	Very low	54.2	Low	153 Å²	153	111.3 Å²	111.3	60%	0.6	56%	0.561	S	S	*	*			trans	-109.3	77.4	175.6	-63.5	-78.3	0	0	0	112	K508	Y506-K508 PolarHBondContact O-N 2.62Å
507	I	54.2	Low	55.3	Low	62 Å²	62	108.4 Å²	108.4	32%	0.318	56%	0.563	S	S	.	*			trans	-80.6	104.4	167.4	-61	176.2	0	0	0	107.9	N408 K411 L413	N408-I507 WeakPolarHBondContact ND2-CG2 3.46Å; K411-I507 HydrophobicContact CB-CG2 4.47Å; K411-I507 WeakPolarHBondContact O-CD1 3.4Å; L413-I507 HydrophobicContact CD1-CD1 4.23Å; L413-I507 HydrophobicContact CD1-CG1 4.22Å; L413-I507 HydrophobicContact CG-CD1 4.14Å; L413-I507 HydrophobicContact CG-CG1 4.49Å
508	K	65	Low	56.8	Low	159 Å²	159	114.1 Å²	114.1	69%	0.691	58%	0.584	S	S	*	*			trans	-70.4	136.4	176.8	-70.1	-176.1	177.3	-179.7	0	110.9	N408 Y506 I510	N408-K508 PolarHBondContact ND2-O 2.86Å; Y506-K508 PolarHBondContact O-N 2.62Å; K508-I510 PolarHBondContact O-N 3.1Å
509	P	63.5	Low	57.9	Low	21 Å²	21	116.7 Å²	116.7	14%	0.136	61%	0.605	C	S	.	*			trans	-67.3	133	175.2	25.7	-34.3	0	0	0	109.8	L401 T406 N408 L412 Y447 T511	L401-P509 HydrophobicContact CD1-CB 3.95Å; L401-P509 HydrophobicContact CD1-CG 4.18Å; L401-P509 HydrophobicContact CD2-CB 4.44Å; T406-P509 HydrophobicContact CG2-CB 3.91Å; N408-P509 WeakPolarHBondContact OD1-CA 3.44Å; L412-P509 HydrophobicContact CD2-CB 4Å; Y447-P509 HydrophobicContact CE1-CG 4.31Å; Y447-P509 WeakPolarHBondContact OH-CD 3.46Å; P509-T511 HydrophobicContact CB-CG2 4.4Å; P509-T511 PolarHBondContact O-N 3.33Å
510	I	75.1	Confident	59.2	Low	107 Å²	107	118 Å²	118	55%	0.549	61%	0.613	S	S	.	*			trans	-92.7	89.2	170.7	-56.7	172.8	0	0	0	106	A407 N408 K508	A407-I510 HydrophobicContact CB-CB 4.1Å; A407-I510 HydrophobicContact CB-CG2 4.04Å; A407-I510 PolarHBondContact N-O 3.05Å; N408-I510 HydrophobicContact CB-CD1 4.46Å; N408-I510 PolarHBondContact OD1-N 2.84Å; K508-I510 PolarHBondContact O-N 3.1Å
511	T	73.3	Confident	60.4	Low	72 Å²	72	115.7 Å²	115.7	44%	0.442	62%	0.619	S	S	.	*	B	Isolated β-bridge	trans	-77.5	135.2	176.7	51.4	0	0	0	0	110	L401 P509	L401-T511 HydrophobicContact CD2-CG2 4.03Å; P509-T511 HydrophobicContact CB-CG2 4.4Å; P509-T511 PolarHBondContact O-N 3.33Å
512	K	70.3	Confident	61.5	Low	147 Å²	147	120.4 Å²	120.4	64%	0.639	64%	0.638	S	S	*	*			trans	-90.1	118.2	172.2	-65	177.2	178.2	172.3	0	107.9	T405	T405-K512 PolarHBondContact O-N 2.97Å
513	C	71.8	Confident	62.7	Low	108 Å²	108	125.8 Å²	125.8	73%	0.73	66%	0.659	S	S	*	*			trans	-126.2	146.2	170.3	60.4	0	0	0	0	110.3	S515	C513-S515 PolarHBondContact O-N 3.08Å
514	E	70	Confident	64	Low	206 Å²	206	125.3 Å²	125.3	96%	0.963	66%	0.655	S	S	*	*			trans	-70	124.1	168.5	-69.8	-176.4	167.4	0	0	108.6
515	S	67.1	Low	65	Low	107 Å²	107	123.1 Å²	123.1	75%	0.748	66%	0.657	S	S	*	*			trans	-122.4	118	175.2	-172.4	0	0	0	0	108.4	C513	C513-S515 PolarHBondContact O-N 3.08Å
516	S	71.9	Confident	65.9	Low	117 Å²	117	124.6 Å²	124.6	82%	0.818	67%	0.674	S	S	*	*			trans	-108.8	126.1	172.1	63.6	0	0	0	0	109.2
517	T	61.6	Low	67.2	Low	129 Å²	129	123.6 Å²	123.6	79%	0.791	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-103.5	117.5	167.4	-53.7	0	0	0	0	108.1
518	Q	74.2	Confident	68.4	Low	173 Å²	173	127.4 Å²	127.4	81%	0.808	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-83.7	118	171.7	-174.4	170.1	12.2	0	0	108.4	D520	Q518-D520 PolarHBondContact O-N 3.4Å
519	T	64.8	Low	69	Low	117 Å²	117	124 Å²	124	72%	0.718	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-71.5	121.9	171.7	-46.2	0	0	0	0	108.9	T521	T519-T521 PolarHBondContact O-N 3.06Å; T519-T521 VanDerWaalsContact O-N 3.14Å
520	D	64.4	Low	69.8	Low	138 Å²	138	134 Å²	134	74%	0.738	73%	0.731	S	S	*	*			trans	-61.3	115.1	174.1	-74.4	-35	0	0	0	109.7	Q518 H522	Q518-D520 PolarHBondContact O-N 3.4Å; D520-H522 PolarHBondContact O-N 2.86Å
521	T	65.2	Low	70	Confident	121 Å²	121	133.9 Å²	133.9	74%	0.742	74%	0.739	S	S	*	*	S	Bend	trans	-73	-21.8	-167.1	37.7	0	0	0	0	114.8	T519	T519-T521 PolarHBondContact O-N 3.06Å; T519-T521 VanDerWaalsContact O-N 3.14Å
522	H	61.4	Low	70.6	Confident	159 Å²	159	137.5 Å²	137.5	74%	0.736	75%	0.746	S	S	*	*			trans	-152.3	103	176.8	-62.7	-68.1	0	0	0	112.3	D520 L524	D520-H522 PolarHBondContact O-N 2.86Å; H522-L524 PolarHBondContact O-N 3.35Å
523	I	67.1	Low	71.1	Confident	159 Å²	159	133.8 Å²	133.8	82%	0.815	73%	0.731	S	S	*	*	S	Bend	trans	-65.1	-25.4	178.5	-57.7	170.9	0	0	0	111.7
524	L	64.5	Low	71.7	Confident	139 Å²	139	138.9 Å²	138.9	73%	0.728	74%	0.735	S	S	*	*	S	Bend	trans	-125	134.9	-179.6	-64.3	173	0	0	0	111	H522	H522-L524 PolarHBondContact O-N 3.35Å
525	P	63.9	Low	72.6	Confident	109 Å²	109	132.3 Å²	132.3	71%	0.708	71%	0.707	S	S	*	*			trans	-66	141.4	178.7	24.9	-31.1	0	0	0	111.3	T527	P525-T527 PolarHBondContact O-N 3.24Å
526	P	66	Low	73.5	Confident	114 Å²	114	133.6 Å²	133.6	74%	0.74	70%	0.701	S	S	*	*			trans	-63.9	123.2	-176.6	23.7	-32.2	0	0	0	111.7	I528	P526-I528 PolarHBondContact O-N 3Å
527	T	76.9	Confident	74.3	Confident	132 Å²	132	136.1 Å²	136.1	81%	0.81	69%	0.693	S	S	*	*			trans	-86.5	100.1	173.6	-60.6	0	0	0	0	109.3	P525 V529	P525-T527 PolarHBondContact O-N 3.24Å; T527-V529 PolarHBondContact O-N 3.42Å
528	I	78	Confident	75.7	Confident	141 Å²	141	132.7 Å²	132.7	72%	0.723	67%	0.668	S	S	*	*			trans	-84.9	109.4	174.3	-57.8	176.4	0	0	0	109.1	P526 R530	P526-I528 PolarHBondContact O-N 3Å; I528-R530 PolarHBondContact O-N 3.12Å
529	V	78.6	Confident	76.4	Confident	87 Å²	87	128.8 Å²	128.8	53%	0.527	65%	0.652	S	S	.	*			trans	-74.1	94.2	171.5	-177.9	0	0	0	0	108.8	T527 S531 Y532	T527-V529 PolarHBondContact O-N 3.42Å; V529-S531 VanDerWaalsContact CG1-OG 3.24Å; V529-S531 WeakPolarHBondContact CG1-OG 3.19Å; V529-S531 PolarHBondContact O-N 3.35Å; V529-S531 VanDerWaalsContact O-N 3.08Å; V529-Y532 WeakPolarHBondContact O-CB 3.27Å; V529-Y532 PolarHBondContact O-N 3.48Å
530	R	80.6	Confident	77.6	Confident	232 Å²	232	130.1 Å²	130.1	88%	0.875	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	-18	-177.6	-64.3	-172.5	-179.5	-173.3	0.3	114.7	I528	I528-R530 PolarHBondContact O-N 3.12Å
531	S	79.3	Confident	79	Confident	104 Å²	104	130.7 Å²	130.7	73%	0.727	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-14.3	176.8	52.7	0	0	0	0	113.5	V529	V529-S531 VanDerWaalsContact CG1-OG 3.24Å; V529-S531 WeakPolarHBondContact CG1-OG 3.19Å; V529-S531 PolarHBondContact O-N 3.35Å; V529-S531 VanDerWaalsContact O-N 3.08Å
532	Y	84.2	Confident	80.2	Confident	149 Å²	149	128.6 Å²	128.6	58%	0.584	62%	0.616	S	S	*	*			trans	-81.5	124	-177.9	-176.5	-103.7	0	0	0	110.7	V529 W534	V529-Y532 WeakPolarHBondContact O-CB 3.27Å; V529-Y532 PolarHBondContact O-N 3.48Å; Y532-W534 HydrophobicContact CE1-CB 4.34Å; Y532-W534 WeakPolarHBondContact OH-CZ3 2.92Å
533	E	82.6	Confident	81.5	Confident	69 Å²	69	123.8 Å²	123.8	32%	0.322	60%	0.604	S	S	.	*			trans	-127.7	122.4	169.3	-66.4	-69	174.6	0	0	107.8	L539 K542	E533-L539 HydrophobicContact CB-CD2 4.02Å; E533-L539 HydrophobicContact CB-CG 4.3Å; E533-K542 VanDerWaalsContact CD-NZ 3.26Å; E533-K542 HydrophobicContact CG-CD 4.33Å; E533-K542 WeakPolarHBondContact OE1-CE 3.25Å; E533-K542 IonicContact OE1-NZ 2.65Å; E533-K542 PolarHBondContact OE1-NZ 3.06Å
534	W	83.7	Confident	82.6	Confident	214 Å²	214	121.2 Å²	121.2	81%	0.811	59%	0.591	S	S	*	*			trans	-74.9	-29.8	175.7	180	-100.6	0	0	0	112.2	Y532 E536	Y532-W534 HydrophobicContact CE1-CB 4.34Å; Y532-W534 WeakPolarHBondContact OH-CZ3 2.92Å; W534-E536 PolarHBondContact O-N 3.45Å
535	N	88.3	Confident	83.9	Confident	69 Å²	69	121.5 Å²	121.5	37%	0.369	59%	0.586	S	S	.	*			trans	-80.6	113.6	-173.5	-175.8	-4	0	0	0	111.4	W537 E538 L539	N535-W537 PolarHBondContact O-N 3.39Å; N535-W537 WeakPolarHBondContact OD1-CB 3.47Å; N535-W537 PolarHBondContact OD1-N 2.94Å; N535-E538 HydrophobicContact CB-CB 4.11Å; N535-E538 HydrophobicContact CB-CG 4.2Å; N535-E538 WeakPolarHBondContact O-CB 3.43Å; N535-E538 PolarHBondContact O-N 3.08Å; N535-L539 PolarHBondContact O-N 3.01Å; N535-L539 VanDerWaalsContact O-N 3.13Å
536	E	86.4	Confident	85	Confident	134 Å²	134	121 Å²	121	63%	0.626	58%	0.577	S	S	*	*	H	α-helix	trans	-55.4	-33.1	175.8	-63.4	-172.4	171.5	0	0	113.3	W534 L539 R540	W534-E536 PolarHBondContact O-N 3.45Å; E536-L539 WeakPolarHBondContact O-CB 3.37Å; E536-L539 PolarHBondContact O-N 3.36Å; E536-R540 WeakPolarHBondContact O-CG 3.38Å; E536-R540 PolarHBondContact O-N 3.17Å
537	W	89.1	Confident	86	Confident	170 Å²	170	118 Å²	118	64%	0.644	56%	0.562	S	S	*	*	H	α-helix	trans	-72.1	-31.9	177.7	-66.6	104.5	0	0	0	112.7	N535 R540 R541	N535-W537 PolarHBondContact O-N 3.39Å; N535-W537 WeakPolarHBondContact OD1-CB 3.47Å; N535-W537 PolarHBondContact OD1-N 2.94Å; W537-R540 PolarHBondContact O-N 3Å; W537-R541 WeakPolarHBondContact O-CG 3.17Å; W537-R541 PolarHBondContact O-N 2.64Å
538	E	90.2	Very high	86.5	Confident	57 Å²	57	115.6 Å²	115.6	27%	0.266	54%	0.544	S	S	.	.	H	α-helix	trans	-66.6	-42.3	170.3	-85.3	-59.5	145.2	0	0	111.1	N535 R540 R541 K542	N535-E538 HydrophobicContact CB-CB 4.11Å; N535-E538 HydrophobicContact CB-CG 4.2Å; N535-E538 WeakPolarHBondContact O-CB 3.43Å; N535-E538 PolarHBondContact O-N 3.08Å; E538-R540 VanDerWaalsContact C-N 3.31Å; E538-R540 PolarHBondContact O-N 3.3Å; E538-R541 PolarHBondContact O-N 3.23Å; E538-R541 IonicContact OE1-CZ 3.01Å; E538-R541 IonicContact OE1-NE 3.14Å; E538-R541 PolarHBondContact OE1-NE 3.48Å; E538-R541 VanDerWaalsContact OE1-NE 3.08Å; E538-R541 IonicContact OE1-NH2 3.22Å; E538-R541 PolarHBondContact OE1-NH2 2.99Å; E538-R541 IonicContact OE2-NE 3.27Å; E538-K542 WeakPolarHBondContact O-CB 3.32Å; E538-K542 WeakPolarHBondContact O-CG 3.49Å; E538-K542 PolarHBondContact O-N 2.99Å
539	L	89.4	Confident	86.8	Confident	90 Å²	90	113.2 Å²	113.2	47%	0.471	53%	0.532	S	S	.	.	H	α-helix	trans	-58.2	-44	174.3	-67.4	173.5	0	0	0	111.4	E533 N535 E536 K542 A543	E533-L539 HydrophobicContact CB-CD2 4.02Å; E533-L539 HydrophobicContact CB-CG 4.3Å; N535-L539 PolarHBondContact O-N 3.01Å; N535-L539 VanDerWaalsContact O-N 3.13Å; E536-L539 WeakPolarHBondContact O-CB 3.37Å; E536-L539 PolarHBondContact O-N 3.36Å; L539-K542 PolarHBondContact O-N 3.13Å; L539-A543 WeakPolarHBondContact O-CB 3.34Å; L539-A543 PolarHBondContact O-N 2.56Å
540	R	90.9	Very high	86.9	Confident	145 Å²	145	116.6 Å²	116.6	55%	0.547	54%	0.542	S	S	.	.	H	α-helix	trans	-63.3	-43.8	175	-70.8	176.8	-175.5	-133.3	3.8	112.4	E536 W537 E538 K542 A543 I544	E536-R540 WeakPolarHBondContact O-CG 3.38Å; E536-R540 PolarHBondContact O-N 3.17Å; W537-R540 PolarHBondContact O-N 3Å; E538-R540 VanDerWaalsContact C-N 3.31Å; E538-R540 PolarHBondContact O-N 3.3Å; R540-K542 PolarHBondContact O-N 3.37Å; R540-A543 PolarHBondContact O-N 3.37Å; R540-I544 WeakPolarHBondContact O-CG1 3.38Å; R540-I544 PolarHBondContact O-N 3.33Å
541	R	93.4	Very high	86.7	Confident	151 Å²	151	113.1 Å²	113.1	57%	0.57	54%	0.535	S	S	*	.	H	α-helix	trans	-60.6	-43.9	175	-80.4	-164.9	-80.2	-127.5	-1.6	111.9	W537 E538 I544 K545	W537-R541 WeakPolarHBondContact O-CG 3.17Å; W537-R541 PolarHBondContact O-N 2.64Å; E538-R541 PolarHBondContact O-N 3.23Å; E538-R541 IonicContact OE1-CZ 3.01Å; E538-R541 IonicContact OE1-NE 3.14Å; E538-R541 PolarHBondContact OE1-NE 3.48Å; E538-R541 VanDerWaalsContact OE1-NE 3.08Å; E538-R541 IonicContact OE1-NH2 3.22Å; E538-R541 PolarHBondContact OE1-NH2 2.99Å; E538-R541 IonicContact OE2-NE 3.27Å; R541-I544 PolarHBondContact O-N 2.94Å; R541-K545 WeakPolarHBondContact O-CB 3.42Å; R541-K545 PolarHBondContact O-N 2.95Å
542	K	88.8	Confident	86.5	Confident	77 Å²	77	115 Å²	115	34%	0.335	53%	0.53	S	S	.	.	H	α-helix	trans	-61.8	-41.9	175.6	-73.2	-176.6	-176.7	-171.8	0	111.6	E533 E538 L539 R540 K545 L546	E533-K542 VanDerWaalsContact CD-NZ 3.26Å; E533-K542 HydrophobicContact CG-CD 4.33Å; E533-K542 WeakPolarHBondContact OE1-CE 3.25Å; E533-K542 IonicContact OE1-NZ 2.65Å; E533-K542 PolarHBondContact OE1-NZ 3.06Å; E538-K542 WeakPolarHBondContact O-CB 3.32Å; E538-K542 WeakPolarHBondContact O-CG 3.49Å; E538-K542 PolarHBondContact O-N 2.99Å; L539-K542 PolarHBondContact O-N 3.13Å; R540-K542 PolarHBondContact O-N 3.37Å; K542-K545 PolarHBondContact O-N 2.66Å; K542-L546 WeakPolarHBondContact O-CB 3.35Å; K542-L546 PolarHBondContact O-N 3.25Å
543	A	89.3	Confident	85.2	Confident	58 Å²	58	113.5 Å²	113.5	48%	0.479	54%	0.537	S	S	.	.	H	α-helix	trans	-63.3	-45.9	176.8	0	0	0	0	0	112.5	L539 R540 K545 L546 A547	L539-A543 WeakPolarHBondContact O-CB 3.34Å; L539-A543 PolarHBondContact O-N 2.56Å; R540-A543 PolarHBondContact O-N 3.37Å; A543-K545 VanDerWaalsContact C-N 3.33Å; A543-K545 PolarHBondContact O-N 3.12Å; A543-L546 PolarHBondContact O-N 3.37Å; A543-A547 PolarHBondContact O-N 3.4Å
544	I	91.1	Very high	84	Confident	105 Å²	105	116.4 Å²	116.4	54%	0.538	56%	0.559	S	S	.	*	H	α-helix	trans	-63	-41.1	175.9	-66	166.8	0	0	0	110.8	R540 R541 L546 A547 N548	R540-I544 WeakPolarHBondContact O-CG1 3.38Å; R540-I544 PolarHBondContact O-N 3.33Å; R541-I544 PolarHBondContact O-N 2.94Å; I544-L546 PolarHBondContact O-N 3.29Å; I544-A547 PolarHBondContact O-N 3.31Å; I544-N548 WeakPolarHBondContact O-CB 3.39Å; I544-N548 PolarHBondContact O-N 2.83Å; I544-N548 PolarHBondContact O-ND2 2.93Å
545	K	90.7	Very high	82.4	Confident	145 Å²	145	114.4 Å²	114.4	63%	0.63	56%	0.559	S	S	*	*	H	α-helix	trans	-61	-43.3	175.8	-173.3	178.7	179.8	-179.9	0	111.7	R541 K542 A543 N548 L549	R541-K545 WeakPolarHBondContact O-CB 3.42Å; R541-K545 PolarHBondContact O-N 2.95Å; K542-K545 PolarHBondContact O-N 2.66Å; A543-K545 VanDerWaalsContact C-N 3.33Å; A543-K545 PolarHBondContact O-N 3.12Å; K545-N548 PolarHBondContact O-N 2.84Å; K545-L549 HydrophobicContact CG-CD1 4.21Å; K545-L549 WeakPolarHBondContact O-CB 3.38Å; K545-L549 VanDerWaalsContact O-CG 3.27Å; K545-L549 WeakPolarHBondContact O-CG 3.43Å; K545-L549 PolarHBondContact O-N 3.43Å
546	L	87.9	Confident	80.6	Confident	98 Å²	98	116.5 Å²	116.5	51%	0.513	58%	0.579	S	S	.	*	H	α-helix	trans	-63.1	-45.1	174.9	-89.3	158.6	0	0	0	112.2	K542 A543 I544 N548 L549 H550	K542-L546 WeakPolarHBondContact O-CB 3.35Å; K542-L546 PolarHBondContact O-N 3.25Å; A543-L546 PolarHBondContact O-N 3.37Å; I544-L546 PolarHBondContact O-N 3.29Å; L546-N548 VanDerWaalsContact C-N 3.33Å; L546-N548 PolarHBondContact O-N 3.31Å; L546-L549 WeakPolarHBondContact O-CB 3.47Å; L546-L549 PolarHBondContact O-N 3.2Å; L546-L549 VanDerWaalsContact O-N 3.15Å; L546-H550 PolarHBondContact O-CD2 3.15Å; L546-H550 PolarHBondContact O-N 2.99Å
547	A	86.6	Confident	79	Confident	52 Å²	52	116.6 Å²	116.6	43%	0.43	59%	0.588	S	S	.	*	H	α-helix	trans	-60.5	-42.5	176.1	0	0	0	0	0	112	A543 I544 H550 Q551	A543-A547 PolarHBondContact O-N 3.4Å; I544-A547 PolarHBondContact O-N 3.31Å; A547-H550 PolarHBondContact O-N 3.28Å; A547-Q551 PolarHBondContact O-N 2.93Å
548	N	88	Confident	77	Confident	81 Å²	81	117.9 Å²	117.9	43%	0.433	60%	0.602	S	S	.	*	H	α-helix	trans	-66	-35.9	174.5	-75.4	-23.8	0	0	0	112.5	I544 K545 L546 Q551 K552	I544-N548 WeakPolarHBondContact O-CB 3.39Å; I544-N548 PolarHBondContact O-N 2.83Å; I544-N548 PolarHBondContact O-ND2 2.93Å; K545-N548 PolarHBondContact O-N 2.84Å; L546-N548 VanDerWaalsContact C-N 3.33Å; L546-N548 PolarHBondContact O-N 3.31Å; N548-Q551 PolarHBondContact O-N 2.98Å; N548-K552 VanDerWaalsContact O-CG 3.32Å; N548-K552 WeakPolarHBondContact O-CG 3.46Å; N548-K552 PolarHBondContact O-N 3.23Å
549	L	84.5	Confident	75.1	Confident	90 Å²	90	120.1 Å²	120.1	47%	0.471	62%	0.619	S	S	.	*	H	α-helix	trans	-67.9	-38.3	175.3	-77.6	165.3	0	0	0	111.8	K545 L546 Q551 K552	K545-L549 HydrophobicContact CG-CD1 4.21Å; K545-L549 WeakPolarHBondContact O-CB 3.38Å; K545-L549 VanDerWaalsContact O-CG 3.27Å; K545-L549 WeakPolarHBondContact O-CG 3.43Å; K545-L549 PolarHBondContact O-N 3.43Å; L546-L549 WeakPolarHBondContact O-CB 3.47Å; L546-L549 PolarHBondContact O-N 3.2Å; L546-L549 VanDerWaalsContact O-N 3.15Å; L549-Q551 PolarHBondContact O-N 3.5Å; L549-K552 PolarHBondContact O-N 3.38Å
550	H	79.1	Confident	73.4	Confident	158 Å²	158	123 Å²	123	73%	0.731	64%	0.635	S	S	*	*	H	α-helix	trans	-60.9	-29.6	174.3	-75.5	-167.4	0	0	0	112.4	L546 A547 K552	L546-H550 PolarHBondContact O-CD2 3.15Å; L546-H550 PolarHBondContact O-N 2.99Å; A547-H550 PolarHBondContact O-N 3.28Å; H550-K552 VanDerWaalsContact C-N 3.34Å
551	Q	77.2	Confident	71.7	Confident	159 Å²	159	124.4 Å²	124.4	74%	0.743	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-11.5	173.8	-67.1	-177.5	-1.8	0	0	113.4	A547 N548 L549 V553	A547-Q551 PolarHBondContact O-N 2.93Å; N548-Q551 PolarHBondContact O-N 2.98Å; L549-Q551 PolarHBondContact O-N 3.5Å; Q551-V553 PolarHBondContact O-N 2.65Å
552	K	75.8	Confident	69.9	Low	143 Å²	143	122.3 Å²	122.3	62%	0.622	66%	0.661	S	S	*	*			trans	-97	94	179.8	-71.7	176.8	-176.8	-166.3	0	109.8	N548 L549 H550 T554	N548-K552 VanDerWaalsContact O-CG 3.32Å; N548-K552 WeakPolarHBondContact O-CG 3.46Å; N548-K552 PolarHBondContact O-N 3.23Å; L549-K552 PolarHBondContact O-N 3.38Å; H550-K552 VanDerWaalsContact C-N 3.34Å; K552-T554 PolarHBondContact O-N 2.85Å; K552-T554 VanDerWaalsContact O-N 3.14Å
553	V	56.6	Low	68.2	Low	119 Å²	119	126.6 Å²	126.6	72%	0.721	68%	0.682	S	S	*	*			trans	-70.8	104.6	173.6	-178.1	0	0	0	0	108.8	Q551	Q551-V553 PolarHBondContact O-N 2.65Å
554	T	57.9	Low	66.3	Low	130 Å²	130	132 Å²	132	80%	0.798	70%	0.702	S	S	*	*			trans	-90.3	111.5	177	-28.1	0	0	0	0	109.9	K552	K552-T554 PolarHBondContact O-N 2.85Å; K552-T554 VanDerWaalsContact O-N 3.14Å
555	H	48.5	Very low	64.3	Low	171 Å²	171	138.9 Å²	138.9	79%	0.792	72%	0.721	S	S	*	*			trans	-90.3	89.4	171.8	-88.9	-90.6	0	0	0	110.4
556	S	51.8	Low	62.5	Low	114 Å²	114	143.3 Å²	143.3	80%	0.797	73%	0.734	S	S	*	*			trans	167.3	145.5	143.8	60.2	0	0	0	0	111.1
557	V	52.1	Low	60.8	Low	136 Å²	136	147.8 Å²	147.8	82%	0.824	75%	0.752	S	S	*	*			trans	-110.3	114.5	-168.2	-172.6	0	0	0	0	106.8
558	Q	47.8	Very low	58.9	Low	197 Å²	197	153.1 Å²	153.1	92%	0.921	77%	0.773	S	S	*	*			trans	-102.2	131.2	176.8	-155.7	172	2.8	0	0	109.8
559	T	49.3	Very low	57.2	Low	103 Å²	103	155.1 Å²	155.1	63%	0.632	79%	0.792	S	S	*	*			trans	-104.3	166.9	-156.9	39.8	0	0	0	0	114.5	L561	T559-L561 PolarHBondContact O-N 3.02Å
560	D	54.7	Low	55.4	Low	150 Å²	150	156.5 Å²	156.5	80%	0.802	81%	0.81	S	S	*	*	G	3₁₀ helix	trans	-58.1	2.6	-164.8	-67.4	-40.8	0	0	0	119.3	S562	D560-S562 VanDerWaalsContact C-N 3.32Å; D560-S562 PolarHBondContact O-N 3.08Å
561	L	53.9	Low	54.5	Low	175 Å²	175	156.9 Å²	156.9	92%	0.916	81%	0.812	S	S	*	*	G	3₁₀ helix	trans	-83.4	5.4	-171.8	-77.7	171.6	0	0	0	115.7	T559	T559-L561 PolarHBondContact O-N 3.02Å
562	S	55.7	Low	53.3	Low	108 Å²	108	155.3 Å²	155.3	76%	0.755	81%	0.812	S	S	*	*	G	3₁₀ helix	trans	-95.6	7.5	178.4	61.8	0	0	0	0	115.2	D560 L564	D560-S562 VanDerWaalsContact C-N 3.32Å; D560-S562 PolarHBondContact O-N 3.08Å; S562-L564 PolarHBondContact O-N 3.05Å
563	H	54.1	Low	52.7	Low	167 Å²	167	157.7 Å²	157.7	77%	0.773	82%	0.819	S	S	*	*			trans	-88.4	3.7	-165.7	-124.6	-66	0	0	0	117.3
564	L	48.3	Very low	53	Low	170 Å²	170	156.9 Å²	156.9	89%	0.89	82%	0.816	S	S	*	*			trans	-126.2	33.9	-167.2	-87.7	155.7	0	0	0	116.8	S562	S562-L564 PolarHBondContact O-N 3.05Å
565	R	50.7	Low	53.1	Low	250 Å²	250	156.7 Å²	156.7	94%	0.943	82%	0.817	S	S	*	*			trans	-97	99.6	160.6	-72.6	-170.7	179.8	176.5	0.8	110
566	R	52.6	Low	53.8	Low	238 Å²	238	157.9 Å²	157.9	90%	0.898	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-99.2	117.4	166.1	-90.8	-175.7	172.8	168.5	-1.9	109
567	E	52.2	Low	54	Low	192 Å²	192	160.1 Å²	160.1	90%	0.897	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-96.4	119.7	164.5	-80.7	179.4	155.9	0	0	108.5
568	N	47.4	Very low	54	Low	165 Å²	165	160.6 Å²	160.6	88%	0.882	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-95.3	119.9	169	-89	-10	0	0	0	108.6
569	C	50.5	Low	54.5	Low	122 Å²	122	156.6 Å²	156.6	82%	0.824	82%	0.82	S	S	*	*			trans	-113	121.9	171.8	50.2	0	0	0	0	110
570	S	46.7	Very low	54.6	Low	120 Å²	120	158.3 Å²	158.3	84%	0.839	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-80.8	124.3	173.4	36.8	0	0	0	0	110.3
571	Q	60.6	Low	54.3	Low	166 Å²	166	160.3 Å²	160.3	78%	0.776	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-85.5	119.5	-175	-144.5	171.3	9.8	0	0	110.3
572	V	52.7	Low	53.9	Low	125 Å²	125	157.5 Å²	157.5	76%	0.758	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-97.5	139.6	169.6	170.8	0	0	0	0	108.8	P574	V572-P574 WeakPolarHBondContact O-CD 3.24Å
573	Y	63.5	Low	53.5	Low	194 Å²	194	160.1 Å²	160.1	76%	0.761	83%	0.832	S	S	*	*			trans	-101.7	93	177.4	-68.6	-88.5	0	0	0	111.2
574	P	61.7	Low	53.3	Low	101 Å²	101	163.4 Å²	163.4	66%	0.656	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-71.9	148.8	168	27.6	-30.9	0	0	0	111.3	V572	V572-P574 WeakPolarHBondContact O-CD 3.24Å
575	P	61.3	Low	53.3	Low	127 Å²	127	164.2 Å²	164.2	83%	0.825	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-59.6	141	176.3	22.8	-31.3	0	0	0	111.7
576	K	62.4	Low	53.6	Low	195 Å²	195	159.9 Å²	159.9	85%	0.848	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-69.3	130.9	-172.4	-80.6	178.5	174.9	176.1	0	112.4	T578	K576-T578 PolarHBondContact O-N 3.46Å
577	D	55.7	Low	54.4	Low	162 Å²	162	153.6 Å²	153.6	87%	0.866	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-60.7	117.4	166.4	-71.2	-38.9	0	0	0	110.3	S579	D577-S579 PolarHBondContact O-N 3.4Å
578	T	53.2	Low	54.8	Low	146 Å²	146	150.7 Å²	150.7	90%	0.896	82%	0.821	S	S	*	*			trans	-85.3	102.5	175.8	5.7	0	0	0	0	108.1	K576	K576-T578 PolarHBondContact O-N 3.46Å
579	S	57.9	Low	55.5	Low	112 Å²	112	145.7 Å²	145.7	78%	0.783	81%	0.808	S	S	*	*			trans	-105.8	129.1	165.3	58.6	0	0	0	0	109.3	D577	D577-S579 PolarHBondContact O-N 3.4Å
580	T	51.3	Low	56.5	Low	139 Å²	139	145.1 Å²	145.1	85%	0.853	80%	0.801	S	S	*	*			trans	-86.1	109.7	178.3	-26.9	0	0	0	0	107.8	S582	T580-S582 PolarHBondContact O-N 3.28Å
581	Q	48.4	Very low	57.6	Low	193 Å²	193	141.4 Å²	141.4	90%	0.902	77%	0.774	S	S	*	*			trans	-76.5	112	166.8	-108.5	-175	24.6	0	0	108.3
582	S	45.3	Very low	58.3	Low	115 Å²	115	143.4 Å²	143.4	80%	0.804	77%	0.774	S	S	*	*			trans	-64.5	132.4	169.2	17.5	0	0	0	0	110.9	T580	T580-S582 PolarHBondContact O-N 3.28Å
583	M	48	Very low	59.5	Low	164 Å²	164	142.7 Å²	142.7	81%	0.808	77%	0.772	S	S	*	*			trans	25.7	124.5	168.1	-88.8	-161.2	72.8	0	0	121.2
584	R	48.7	Very low	60.5	Low	236 Å²	236	138.9 Å²	138.9	89%	0.891	76%	0.761	S	S	*	*			trans	-73.5	120.5	148	-111.1	-178.4	177.8	175.7	-0.8	108.7	D586	R584-D586 PolarHBondContact O-N 3.45Å
585	E	49.3	Very low	61.6	Low	187 Å²	187	138.5 Å²	138.5	87%	0.874	75%	0.753	S	S	*	*			trans	-72	118	160.9	-75.7	-177.5	160	0	0	108.4
586	D	56.2	Low	62.8	Low	159 Å²	159	139 Å²	139	85%	0.85	74%	0.739	S	S	*	*			trans	-108.4	120.9	165.8	-156.6	0.1	0	0	0	106.8	R584	R584-D586 PolarHBondContact O-N 3.45Å
587	S	69.2	Low	63.8	Low	106 Å²	106	133.5 Å²	133.5	74%	0.741	72%	0.719	S	S	*	*			trans	-107.2	119.6	-176.8	67.9	0	0	0	0	109.7	G589	S587-G589 PolarHBondContact O-N 2.94Å
588	T	60.8	Low	64.9	Low	131 Å²	131	127.1 Å²	127.1	80%	0.804	69%	0.688	S	S	*	*			trans	-79	110.7	167.6	39.1	0	0	0	0	109.5	V590	T588-V590 VanDerWaalsContact C-N 3.32Å; T588-V590 PolarHBondContact O-N 3.34Å
589	G	62.1	Low	66.1	Low	60 Å²	60	122.1 Å²	122.1	62%	0.619	67%	0.665	S	S	*	*			trans	-71.9	82.8	173.3	0	0	0	0	0	110.8	S587	S587-G589 PolarHBondContact O-N 2.94Å
590	V	71.1	Confident	67.1	Low	110 Å²	110	122.1 Å²	122.1	67%	0.667	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-65.3	135.5	169	-68	0	0	0	0	109.3	T588 R592	T588-V590 VanDerWaalsContact C-N 3.32Å; T588-V590 PolarHBondContact O-N 3.34Å; V590-R592 PolarHBondContact O-N 3.49Å; V590-R592 VanDerWaalsContact O-N 3.08Å
591	P	70.1	Confident	68.1	Low	41 Å²	41	127.5 Å²	127.5	27%	0.266	66%	0.661	S	S	.	*	P	Polyproline II helix	trans	-58.9	119.8	179	23.1	-33.1	0	0	0	109.1	P593 T616 R617 V619	P591-P593 VanDerWaalsContact O-CD 3.32Å; P591-P593 WeakPolarHBondContact O-CD 3.5Å; P591-T616 HydrophobicContact CB-CG2 4.16Å; P591-R617 VanDerWaalsContact CB-O 3.29Å; P591-R617 WeakPolarHBondContact CB-O 3.46Å; P591-V619 HydrophobicContact CG-CG2 3.77Å
592	R	74.8	Confident	68.9	Low	209 Å²	209	120.4 Å²	120.4	79%	0.789	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-74	121.1	177.8	-70.4	-175.2	-179.9	-173.6	0.8	108.5	V590 Q594	V590-R592 PolarHBondContact O-N 3.49Å; V590-R592 VanDerWaalsContact O-N 3.08Å; R592-Q594 PolarHBondContact O-N 3.46Å
593	P	79.6	Confident	69.9	Low	110 Å²	110	118 Å²	118	71%	0.714	63%	0.632	S	S	*	*			trans	-59.7	112.4	173.4	-21	32.7	0	0	0	109.6	P591 T616	P591-P593 VanDerWaalsContact O-CD 3.32Å; P591-P593 WeakPolarHBondContact O-CD 3.5Å; P593-T616 VanDerWaalsContact CA-OG1 3.3Å; P593-T616 WeakPolarHBondContact CA-OG1 3.46Å
594	Q	83.6	Confident	70.8	Confident	114 Å²	114	121.3 Å²	121.3	53%	0.533	64%	0.642	S	S	.	*			trans	-114.1	127.7	173.9	-77.5	-167.2	-17.3	0	0	108.8	R592 N614 L615 T616	R592-Q594 PolarHBondContact O-N 3.46Å; Q594-N614 PolarHBondContact O-OD1 2.92Å; Q594-L615 HydrophobicContact CB-CB 3.9Å; Q594-L615 WeakPolarHBondContact O-CA 3.12Å; Q594-L615 PolarHBondContact O-N 2.93Å; Q594-T616 PolarHBondContact N-OG1 3.34Å; Q594-T616 PolarHBondContact O-N 3.27Å
595	I	85.5	Confident	71.5	Confident	92 Å²	92	113.9 Å²	113.9	47%	0.472	63%	0.626	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.5	126.9	178.4	-60.9	167.9	0	0	0	106.8	L597 K612 V613	I595-L597 HydrophobicContact CG2-CD2 4.48Å; I595-L597 HydrophobicContact CG2-CG 4.49Å; I595-K612 HydrophobicContact CG2-CD 4.16Å; I595-K612 HydrophobicContact CG2-CG 3.54Å; I595-V613 WeakPolarHBondContact CA-O 3.27Å
596	Y	85.3	Confident	72.5	Confident	138 Å²	138	114.6 Å²	114.6	54%	0.541	63%	0.63	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.2	125.4	172.6	180	-108.7	0	0	0	109.5	A598 V613	Y596-A598 HydrophobicContact CD1-CB 4.26Å; Y596-A598 HydrophobicContact CE1-CB 3.72Å; Y596-V613 PolarHBondContact N-O 3.15Å; Y596-V613 PolarHBondContact O-N 3.43Å
597	L	83.5	Confident	73.3	Confident	80 Å²	80	112.9 Å²	112.9	42%	0.419	62%	0.619	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.6	114.2	176.4	-66.4	166.8	0	0	0	108.4	I595 L600 K612	I595-L597 HydrophobicContact CG2-CD2 4.48Å; I595-L597 HydrophobicContact CG2-CG 4.49Å; L597-L600 HydrophobicContact CB-CD1 4.08Å; L597-K612 HydrophobicContact CD2-CB 3.89Å; L597-K612 HydrophobicContact CD2-CD 4.49Å; L597-K612 HydrophobicContact CD2-CG 3.92Å
598	A	80.1	Confident	73.5	Confident	28 Å²	28	111.8 Å²	111.8	23%	0.231	61%	0.608	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.8	159.6	174.8	0	0	0	0	0	110.5	Y596 V611	Y596-A598 HydrophobicContact CD1-CB 4.26Å; Y596-A598 HydrophobicContact CE1-CB 3.72Å; A598-V611 HydrophobicContact CB-CB 4.47Å; A598-V611 PolarHBondContact N-O 2.92Å; A598-V611 PolarHBondContact O-N 3.43Å
599	G	77.2	Confident	74.2	Confident	40 Å²	40	111.2 Å²	111.2	41%	0.412	60%	0.6	S	S	.	*			trans	92.9	-7.2	177.1	0	0	0	0	0	115.4	R601 G602 T608	G599-R601 PolarHBondContact O-N 3.32Å; G599-G602 PolarHBondContact O-N 3.35Å; G599-T608 WeakPolarHBondContact O-CG2 3.32Å
600	L	78.9	Confident	75.1	Confident	112 Å²	112	114.9 Å²	114.9	59%	0.586	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	-12.4	-178.4	-65	174	0	0	0	115.3	L597	L597-L600 HydrophobicContact CB-CD1 4.08Å
601	R	71.7	Confident	75.6	Confident	253 Å²	253	113.5 Å²	113.5	96%	0.955	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	15.9	-177.3	-72.5	-165.7	-175.8	-144.9	2.3	114.9	G599	G599-R601 PolarHBondContact O-N 3.32Å
602	G	66.4	Low	76.4	Confident	43 Å²	43	118.5 Å²	118.5	44%	0.443	61%	0.611	S	S	.	*			trans	59.7	87.2	172.2	0	0	0	0	0	112.5	G599	G599-G602 PolarHBondContact O-N 3.35Å
603	G	66.4	Low	76.9	Confident	64 Å²	64	111.6 Å²	111.6	66%	0.66	59%	0.591	S	S	*	*			trans	-64	-178.2	168.5	0	0	0	0	0	111.7	S605	G603-S605 PolarHBondContact O-N 3.34Å
604	K	65.4	Low	77.2	Confident	234 Å²	234	111.7 Å²	111.7	100%	1.017	59%	0.586	S	S	*	*	S	Bend	trans	-63.8	9.7	177.5	-67.6	-175.5	177.4	-178.9	0	115.1
605	S	64.5	Low	77.2	Confident	80 Å²	80	110.5 Å²	110.5	56%	0.559	58%	0.583	S	S	*	*	S	Bend	trans	-96.8	139.7	177.8	-165.1	0	0	0	0	109.6	G603 I607	G603-S605 PolarHBondContact O-N 3.34Å; S605-I607 PolarHBondContact O-N 3.27Å
606	E	70.1	Confident	77.1	Confident	202 Å²	202	108.6 Å²	108.6	94%	0.944	58%	0.575	S	S	*	*	S	Bend	trans	-63.1	-22.3	179.1	-71.8	-174.9	159.8	0	0	113
607	I	73.4	Confident	76.7	Confident	123 Å²	123	109.9 Å²	109.9	63%	0.631	58%	0.579	S	S	*	*	S	Bend	trans	-107.1	129	178.2	-56.3	175.1	0	0	0	108.8	S605 D609	S605-I607 PolarHBondContact O-N 3.27Å; I607-D609 PolarHBondContact O-N 3.37Å
608	T	73.8	Confident	76.3	Confident	83 Å²	83	108.1 Å²	108.1	51%	0.509	58%	0.577	S	S	.	*			trans	-79.6	99.7	175.8	-50.9	0	0	0	0	108.8	G599 E610	G599-T608 WeakPolarHBondContact O-CG2 3.32Å; T608-E610 PolarHBondContact O-N 2.9Å
609	D	75.1	Confident	76	Confident	120 Å²	120	111.5 Å²	111.5	64%	0.642	59%	0.594	S	S	*	*			trans	-80.8	108.2	172	-73.7	-27.9	0	0	0	110	I607	I607-D609 PolarHBondContact O-N 3.37Å
610	E	81	Confident	75.7	Confident	136 Å²	136	116.7 Å²	116.7	64%	0.636	61%	0.612	S	S	*	*			trans	-77.8	128.9	170.7	61.1	171.7	-166.4	0	0	111.1	T608	T608-E610 PolarHBondContact O-N 2.9Å
611	V	81.2	Confident	75.2	Confident	82 Å²	82	117.7 Å²	117.7	50%	0.497	61%	0.614	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.1	115.2	172.7	-178.2	0	0	0	0	108.8	A598 V613	A598-V611 HydrophobicContact CB-CB 4.47Å; A598-V611 PolarHBondContact N-O 2.92Å; A598-V611 PolarHBondContact O-N 3.43Å; V611-V613 HydrophobicContact CG1-CG2 4.11Å
612	K	87	Confident	74.6	Confident	146 Å²	146	111.4 Å²	111.4	64%	0.635	60%	0.604	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-93.9	112.2	176.7	-175.3	177.9	178	177.7	0	110.4	I595 L597	I595-K612 HydrophobicContact CG2-CD 4.16Å; I595-K612 HydrophobicContact CG2-CG 3.54Å; L597-K612 HydrophobicContact CD2-CB 3.89Å; L597-K612 HydrophobicContact CD2-CD 4.49Å; L597-K612 HydrophobicContact CD2-CG 3.92Å
613	V	84.9	Confident	75	Confident	63 Å²	63	114.8 Å²	114.8	38%	0.382	61%	0.612	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.8	126.7	175.4	-175.1	0	0	0	0	109.5	I595 Y596 V611 L615	I595-V613 WeakPolarHBondContact CA-O 3.27Å; Y596-V613 PolarHBondContact N-O 3.15Å; Y596-V613 PolarHBondContact O-N 3.43Å; V611-V613 HydrophobicContact CG1-CG2 4.11Å; V613-L615 HydrophobicContact CG1-CD2 4.25Å
614	N	86	Confident	75.4	Confident	113 Å²	113	117.5 Å²	117.5	60%	0.604	61%	0.609	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-83.5	120.2	173	-169.8	-4.9	0	0	0	109.6	Q594 T616	Q594-N614 PolarHBondContact O-OD1 2.92Å; N614-T616 WeakPolarHBondContact OD1-CB 3.49Å; N614-T616 PolarHBondContact OD1-N 3.41Å; N614-T616 PolarHBondContact OD1-OG1 3.49Å
615	L	83.2	Confident	76	Confident	89 Å²	89	111 Å²	111	47%	0.466	59%	0.587	S	S	.	*			trans	-103.4	8.5	177.3	-63.1	-180	0	0	0	112.8	Q594 V613 R617	Q594-L615 HydrophobicContact CB-CB 3.9Å; Q594-L615 WeakPolarHBondContact O-CA 3.12Å; Q594-L615 PolarHBondContact O-N 2.93Å; V613-L615 HydrophobicContact CG1-CD2 4.25Å; L615-R617 PolarHBondContact O-N 2.94Å; L615-R617 VanDerWaalsContact O-N 3.16Å
616	T	83.6	Confident	76.7	Confident	51 Å²	51	112.8 Å²	112.8	31%	0.313	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-64	116.6	179.4	-49	0	0	0	0	109.6	P591 P593 Q594 N614	P591-T616 HydrophobicContact CB-CG2 4.16Å; P593-T616 VanDerWaalsContact CA-OG1 3.3Å; P593-T616 WeakPolarHBondContact CA-OG1 3.46Å; Q594-T616 PolarHBondContact N-OG1 3.34Å; Q594-T616 PolarHBondContact O-N 3.27Å; N614-T616 WeakPolarHBondContact OD1-CB 3.49Å; N614-T616 PolarHBondContact OD1-N 3.41Å; N614-T616 PolarHBondContact OD1-OG1 3.49Å
617	R	77.9	Confident	77.1	Confident	165 Å²	165	107.3 Å²	107.3	62%	0.623	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-69.2	143	172.6	-67.8	-172.7	-177.5	-175.9	-1.1	110.2	P591 L615 E621 T622	P591-R617 VanDerWaalsContact CB-O 3.29Å; P591-R617 WeakPolarHBondContact CB-O 3.46Å; L615-R617 PolarHBondContact O-N 2.94Å; L615-R617 VanDerWaalsContact O-N 3.16Å; R617-E621 HydrophobicContact CB-CB 4.32Å; R617-T622 HydrophobicContact CB-CG2 4.28Å
618	A	74.5	Confident	77.3	Confident	44 Å²	44	106.2 Å²	106.2	36%	0.364	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-65.1	155.6	173.5	0	0	0	0	0	110.4	D620 E621	A618-D620 PolarHBondContact O-N 2.89Å; A618-E621 PolarHBondContact O-N 3.14Å
619	V	72.8	Confident	77.6	Confident	98 Å²	98	107.9 Å²	107.9	59%	0.594	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-57.7	-31.2	179.8	178.5	0	0	0	0	111.2	P591 E621 T622	P591-V619 HydrophobicContact CG-CG2 3.77Å; V619-E621 VanDerWaalsContact C-N 3.27Å; V619-E621 PolarHBondContact O-N 3.47Å; V619-T622 PolarHBondContact O-OG1 3.29Å
620	D	72.9	Confident	77.8	Confident	150 Å²	150	106.9 Å²	106.9	80%	0.802	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-75.3	-8.1	178.5	26.7	-47.7	0	0	0	113.9	A618	A618-D620 PolarHBondContact O-N 2.89Å
621	E	68	Low	77.5	Confident	132 Å²	132	104.5 Å²	104.5	62%	0.617	55%	0.553	S	S	*	*	G	3₁₀ helix	trans	-108.3	-3	175.2	-64.5	-174.2	162.6	0	0	114.2	R617 A618 V619	R617-E621 HydrophobicContact CB-CB 4.32Å; A618-E621 PolarHBondContact O-N 3.14Å; V619-E621 VanDerWaalsContact C-N 3.27Å; V619-E621 PolarHBondContact O-N 3.47Å
622	T	58	Low	77.2	Confident	121 Å²	121	106.5 Å²	106.5	74%	0.742	56%	0.558	S	S	*	*			trans	-106.1	0	175.7	49.4	0	0	0	0	110.9	R617 V619	R617-T622 HydrophobicContact CB-CG2 4.28Å; V619-T622 PolarHBondContact O-OG1 3.29Å

Retrieved 622 of 622 residues in 246.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).